H9EU51_MACMU Loading...

Solute carrier organic anion transporter family member

AlphaFold DB , UniProt , Accession H9EU51, Species MACMU (Macaca mulatta, Rhesus macaque), Gene SLCO3A1, Length 692 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	31.8	Very low	30.8	Very low	242 Å²	242	139.7 Å²	139.7	100%	1.192	88%	0.878	S	S	*	*				0	122	0	-109.7	168.3	163.3	0	0	108.3
2	Q	30.7	Very low	30.6	Very low	199 Å²	199	135.3 Å²	135.3	93%	0.93	88%	0.879	S	S	*	*			trans	50.2	122.6	160.5	-72	174.2	-6.9	0	0	121.6
3	G	29.7	Very low	30.7	Very low	75 Å²	75	130.8 Å²	130.8	77%	0.773	87%	0.873	S	S	*	*			trans	144.2	94.3	133.1	0	0	0	0	0	119.5
4	K	28.5	Very low	31	Very low	217 Å²	217	138.1 Å²	138.1	94%	0.943	87%	0.873	S	S	*	*			trans	61.4	123.5	140.9	-77.5	179.5	173.3	176.6	0	123.1
5	K	30	Very low	31.1	Very low	200 Å²	200	135.8 Å²	135.8	87%	0.87	86%	0.863	S	S	*	*			trans	-59.8	-179.3	151.1	-86.2	-175.8	176.7	-179.4	0	112.8
6	P	49	Very low	31.5	Very low	125 Å²	125	131.4 Å²	131.4	81%	0.812	85%	0.851	S	S	*	*			cis	-140.3	175.6	-1	24.2	1.3	0	0	0	117.2
7	G	27.9	Very low	31.9	Very low	81 Å²	81	133.8 Å²	133.8	84%	0.835	85%	0.848	S	S	*	*			trans	123	117.6	133.2	0	0	0	0	0	120.6
8	G	27.2	Very low	32.3	Very low	81 Å²	81	134.3 Å²	134.3	84%	0.835	84%	0.843	S	S	*	*			trans	105.1	107.2	135	0	0	0	0	0	121.7
9	S	27.9	Very low	32.6	Very low	126 Å²	126	134.7 Å²	134.7	88%	0.881	83%	0.834	S	S	*	*			trans	34.1	130.3	141.6	-145.1	0	0	0	0	120.6
10	S	28.5	Very low	32.7	Very low	114 Å²	114	130.1 Å²	130.1	80%	0.797	81%	0.813	S	S	*	*				173.5	137.1	62	162.1	0	0	0	0	104.2
11	G	27.8	Very low	33.1	Very low	77 Å²	77	129.4 Å²	129.4	79%	0.794	80%	0.804	S	S	*	*				124.1	129.4	58.4	0	0	0	0	0	108.4
12	G	27.8	Very low	33.7	Very low	86 Å²	86	124 Å²	124	89%	0.887	78%	0.776	S	S	*	*			trans	130.6	111	163	0	0	0	0	0	117.7
13	G	32.4	Very low	34.1	Very low	77 Å²	77	116.9 Å²	116.9	79%	0.794	75%	0.752	S	S	*	*			trans	102.5	76.4	140.6	0	0	0	0	0	118.8
14	R	34.2	Very low	34.6	Very low	233 Å²	233	119.6 Å²	119.6	88%	0.879	74%	0.744	S	S	*	*			trans	-171.9	78.2	148.5	-111.3	169.9	170.9	177.5	-2.3	111.1
15	S	33.5	Very low	35.1	Very low	104 Å²	104	117.9 Å²	117.9	73%	0.727	73%	0.731	S	S	*	*			trans	-147.4	21	170	-75.4	0	0	0	0	113.1
16	G	37.8	Very low	35.4	Very low	65 Å²	65	113.7 Å²	113.7	67%	0.67	72%	0.719	S	S	*	*	S	Bend	trans	-91.9	-27.5	179.8	0	0	0	0	0	115
17	E	38	Very low	34.7	Very low	172 Å²	172	115.2 Å²	115.2	80%	0.804	71%	0.712	S	S	*	*	S	Bend	trans	-93.3	-21.6	-170.3	-73.4	175.8	125.9	0	0	114.1
18	L	38.8	Very low	34.9	Very low	144 Å²	144	120.5 Å²	120.5	75%	0.754	71%	0.713	S	S	*	*	H	α-helix	trans	-79	-19.6	176.5	-88.8	136.6	0	0	0	113.6
19	Q	37.8	Very low	35.2	Very low	142 Å²	142	123.7 Å²	123.7	66%	0.664	70%	0.703	S	S	*	*	H	α-helix	trans	-85.6	-21.1	-175	-145	159.2	39.1	0	0	112.9	A23	Q19-A23 VanDerWaalsContact O-CB 3.29Å; Q19-A23 WeakPolarHBondContact O-CB 3.14Å; Q19-A23 PolarHBondContact O-N 3.49Å; Q19-A23 VanDerWaalsContact O-N 3.15Å
20	G	35.8	Very low	35.7	Very low	41 Å²	41	126 Å²	126	42%	0.423	70%	0.698	S	S	.	*	H	α-helix	trans	-70.1	-42.9	173.5	0	0	0	0	0	112.7	A23 Q24	G20-A23 PolarHBondContact O-N 2.97Å; G20-Q24 PolarHBondContact O-N 2.87Å
21	D	41.2	Very low	36.4	Very low	117 Å²	117	129.5 Å²	129.5	63%	0.626	70%	0.698	S	S	*	*	H	α-helix	trans	-73.2	-33.6	179.9	-93.3	-25	0	0	0	112.8	R25	D21-R25 WeakPolarHBondContact O-CB 3.43Å; D21-R25 PolarHBondContact O-N 3.07Å
22	E	42.7	Very low	36.9	Very low	127 Å²	127	135.6 Å²	135.6	59%	0.593	70%	0.703	S	S	*	*	H	α-helix	trans	-70.6	-35.5	171.2	-77.9	-165.7	142	0	0	112.6	R25 N26	E22-R25 PolarHBondContact O-N 3.02Å; E22-N26 VanDerWaalsContact O-CB 3.24Å; E22-N26 WeakPolarHBondContact O-CB 3.5Å; E22-N26 PolarHBondContact O-N 3.09Å
23	A	39.8	Very low	37.9	Very low	51 Å²	51	137.3 Å²	137.3	42%	0.421	70%	0.696	S	S	.	*	H	α-helix	trans	-69.6	-35.1	174.5	0	0	0	0	0	112.3	Q19 G20 K27	Q19-A23 VanDerWaalsContact O-CB 3.29Å; Q19-A23 WeakPolarHBondContact O-CB 3.14Å; Q19-A23 PolarHBondContact O-N 3.49Å; Q19-A23 VanDerWaalsContact O-N 3.15Å; G20-A23 PolarHBondContact O-N 2.97Å; A23-K27 WeakPolarHBondContact O-CB 3.27Å; A23-K27 WeakPolarHBondContact O-CG 3.34Å; A23-K27 PolarHBondContact O-N 3.48Å
24	Q	39.8	Very low	39.2	Very low	132 Å²	132	136.6 Å²	136.6	62%	0.617	68%	0.679	S	S	*	*	H	α-helix	trans	-74.2	-35.6	172.5	-107.4	175	-32.8	0	0	112.5	G20 K27 K28	G20-Q24 PolarHBondContact O-N 2.87Å; Q24-K27 PolarHBondContact O-N 3.26Å; Q24-K28 PolarHBondContact O-N 2.88Å
25	R	38.8	Very low	40.5	Very low	180 Å²	180	129.8 Å²	129.8	68%	0.679	67%	0.666	S	S	*	*	H	α-helix	trans	-69.3	-34.7	173.1	-166.2	174.3	-177.5	-169.4	0.8	112	D21 E22 K29	D21-R25 WeakPolarHBondContact O-CB 3.43Å; D21-R25 PolarHBondContact O-N 3.07Å; E22-R25 PolarHBondContact O-N 3.02Å; R25-K29 PolarHBondContact O-N 3.4Å
26	N	36.4	Very low	42.4	Very low	112 Å²	112	127.6 Å²	127.6	60%	0.599	64%	0.643	S	S	*	*	H	α-helix	trans	-75	-29.6	172	-82.8	-22.2	0	0	0	113.1	E22 K29 K30	E22-N26 VanDerWaalsContact O-CB 3.24Å; E22-N26 WeakPolarHBondContact O-CB 3.5Å; E22-N26 PolarHBondContact O-N 3.09Å; N26-K29 CarbonylContact O-C 3.24Å; N26-K29 PolarHBondContact O-N 3.04Å; N26-K30 PolarHBondContact O-N 3.25Å
27	K	34.7	Very low	44.1	Very low	157 Å²	157	126 Å²	126	68%	0.683	62%	0.622	S	S	*	*	H	α-helix	trans	-73.6	-31.5	169.8	-82.5	179	177.4	174.8	0	113.3	A23 Q24 K29 K30	A23-K27 WeakPolarHBondContact O-CB 3.27Å; A23-K27 WeakPolarHBondContact O-CG 3.34Å; A23-K27 PolarHBondContact O-N 3.48Å; Q24-K27 PolarHBondContact O-N 3.26Å; K27-K29 VanDerWaalsContact C-N 3.32Å; K27-K30 WeakPolarHBondContact O-CB 3.44Å; K27-K30 PolarHBondContact O-N 3.33Å
28	K	31.8	Very low	46.4	Very low	193 Å²	193	120.6 Å²	120.6	84%	0.839	60%	0.598	S	S	*	*	H	α-helix	trans	-76	-16.6	169.5	-83.4	-178.5	176.7	174.7	0	113.5	Q24 K30	Q24-K28 PolarHBondContact O-N 2.88Å; K28-K30 VanDerWaalsContact C-N 3.31Å
29	K	34.6	Very low	48.7	Very low	147 Å²	147	115 Å²	115	64%	0.639	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.4	26.2	162.7	-80.8	-175.3	177.4	178.4	0	112.9	R25 N26 K27 K31	R25-K29 PolarHBondContact O-N 3.4Å; N26-K29 CarbonylContact O-C 3.24Å; N26-K29 PolarHBondContact O-N 3.04Å; K27-K29 VanDerWaalsContact C-N 3.32Å; K29-K31 PolarHBondContact O-N 3.07Å
30	K	38.3	Very low	51.1	Low	175 Å²	175	114.3 Å²	114.3	76%	0.761	56%	0.564	S	S	*	*	S	Bend	trans	-57	98.8	148.3	-85.9	-176	174.9	-176	0	105.5	N26 K27 K28 K32	N26-K30 PolarHBondContact O-N 3.25Å; K27-K30 WeakPolarHBondContact O-CB 3.44Å; K27-K30 PolarHBondContact O-N 3.33Å; K28-K30 VanDerWaalsContact C-N 3.31Å; K30-K32 PolarHBondContact O-N 3.47Å
31	K	42.6	Very low	53.7	Low	187 Å²	187	115 Å²	115	81%	0.813	56%	0.557	S	S	*	*			trans	-37.1	117.2	173	-78.3	173.7	174.8	174.4	0	106	K29 V33	K29-K31 PolarHBondContact O-N 3.07Å; K31-V33 PolarHBondContact O-N 3.26Å
32	K	39.3	Very low	56.1	Low	206 Å²	206	109.4 Å²	109.4	90%	0.896	53%	0.527	S	S	*	.			trans	-49.1	105	156	-86.5	-178.8	174.7	-179.8	0	102.9	K30 S34	K30-K32 PolarHBondContact O-N 3.47Å; K32-S34 PolarHBondContact O-N 3.29Å
33	V	47.9	Very low	58.5	Low	122 Å²	122	104.1 Å²	104.1	74%	0.739	50%	0.503	S	S	*	.			trans	-60.4	103.3	173.5	179.2	0	0	0	0	102.1	K31 C35	K31-V33 PolarHBondContact O-N 3.26Å; V33-C35 PolarHBondContact O-N 3.16Å
34	S	58.7	Low	61	Low	62 Å²	62	106.4 Å²	106.4	43%	0.434	51%	0.511	S	S	.	.			trans	-52.6	132.9	-179.8	177.1	0	0	0	0	105.9	K32 F36 S37	K32-S34 PolarHBondContact O-N 3.29Å; S34-F36 PolarHBondContact O-N 3.14Å; S34-F36 PolarHBondContact OG-N 3.22Å; S34-S37 VanDerWaalsContact O-CB 3.31Å; S34-S37 WeakPolarHBondContact O-CB 3.44Å; S34-S37 PolarHBondContact O-N 2.94Å
35	C	62.9	Low	63.6	Low	89 Å²	89	100.3 Å²	100.3	60%	0.601	48%	0.484	S	S	*	.	G	3₁₀ helix	trans	-48.7	-31	175.5	-166.9	0	0	0	0	110.7	V33 S37 I41	V33-C35 PolarHBondContact O-N 3.16Å; C35-S37 PolarHBondContact O-N 3.21Å; C35-I41 VanDerWaalsContact O-CD1 3.24Å; C35-I41 WeakPolarHBondContact O-CD1 3.43Å; C35-I41 VanDerWaalsContact SG-CD1 3.57Å
36	F	72.1	Confident	66.2	Low	58 Å²	58	91.8 Å²	91.8	25%	0.254	45%	0.451	S	S	.	.	G	3₁₀ helix	trans	-76	10	176.4	-61.4	-84.6	0	0	0	115.8	S34 L281 G284 F285 P286	S34-F36 PolarHBondContact O-N 3.14Å; S34-F36 PolarHBondContact OG-N 3.22Å; F36-L281 WeakPolarHBondContact CE1-O 3.39Å; F36-L281 HydrophobicContact CZ-CD2 4.48Å; F36-G284 WeakPolarHBondContact CB-O 3.38Å; F36-F285 HydrophobicContact CB-CD1 4.03Å; F36-F285 HydrophobicContact CB-CE1 4.2Å; F36-F285 HydrophobicContact CB-CG 4.39Å; F36-F285 HydrophobicContact CD1-CD1 4.26Å; F36-F285 AromaticContact CD1-CD2 3.97Å; F36-F285 HydrophobicContact CD1-CD2 3.97Å; F36-F285 AromaticContact CD1-CE1 3.94Å; F36-F285 HydrophobicContact CD1-CE1 3.94Å; F36-F285 AromaticContact CD1-CE2 3.68Å; F36-F285 HydrophobicContact CD1-CE2 3.68Å; F36-F285 HydrophobicContact CD1-CG 4.26Å; F36-F285 AromaticContact CD1-CZ 3.65Å; F36-F285 HydrophobicContact CD1-CZ 3.65Å; F36-F285 HydrophobicContact CE1-CE2 4.15Å; F36-F285 HydrophobicContact CE1-CZ 4.29Å; F36-F285 WeakPolarHBondContact O-CD1 3.47Å; F36-P286 WeakPolarHBondContact O-CD 3.39Å
37	S	74.4	Confident	69	Low	31 Å²	31	87 Å²	87	22%	0.217	43%	0.426	C	S	.	.	G	3₁₀ helix	trans	-97.4	23.4	174.2	-167.5	0	0	0	0	112.8	S34 C35 P290	S34-S37 VanDerWaalsContact O-CB 3.31Å; S34-S37 WeakPolarHBondContact O-CB 3.44Å; S34-S37 PolarHBondContact O-N 2.94Å; C35-S37 PolarHBondContact O-N 3.21Å; S37-P290 VanDerWaalsContact OG-CD 3.3Å; S37-P290 WeakPolarHBondContact OG-CD 3.36Å; S37-P290 VanDerWaalsContact OG-CG 3.26Å; S37-P290 WeakPolarHBondContact OG-CG 3.34Å
38	N	85	Confident	71.8	Confident	59 Å²	59	81 Å²	81	32%	0.316	41%	0.407	S	S	.	.			trans	-124.5	126.4	-179.5	-171.1	-29.4	0	0	0	111.2	K40 I41 F42	N38-K40 VanDerWaalsContact C-N 3.27Å; N38-K40 PolarHBondContact O-N 2.94Å; N38-K40 WeakPolarHBondContact OD1-CB 3.47Å; N38-K40 PolarHBondContact OD1-N 3.46Å; N38-I41 HydrophobicContact CB-CB 4.38Å; N38-I41 HydrophobicContact CB-CD1 4.02Å; N38-I41 HydrophobicContact CB-CG1 4.11Å; N38-I41 PolarHBondContact O-N 3.27Å; N38-I41 VanDerWaalsContact O-N 3.13Å; N38-F42 PolarHBondContact O-N 2.89Å; N38-F42 VanDerWaalsContact O-N 3.14Å
39	I	87.1	Confident	74.9	Confident	26 Å²	26	71.9 Å²	71.9	13%	0.133	37%	0.367	C	S	.	.	H	α-helix	trans	-63.3	-29.7	-180	-168.2	53	0	0	0	113.4	I41 F42 L43 Y201 I202 H205 V206 Y214 L289	I39-I41 VanDerWaalsContact C-N 3.32Å; I39-I41 PolarHBondContact O-N 3.46Å; I39-F42 HydrophobicContact CD1-CB 4.25Å; I39-F42 HydrophobicContact CD1-CD1 4.19Å; I39-F42 HydrophobicContact CD1-CG 4.49Å; I39-F42 PolarHBondContact O-N 3.47Å; I39-L43 PolarHBondContact O-N 3.39Å; I39-Y201 HydrophobicContact CD1-CD1 4.42Å; I39-Y201 HydrophobicContact CD1-CE1 4.34Å; I39-I202 HydrophobicContact CD1-CG1 4.13Å; I39-H205 HydrophobicContact CD1-CB 3.99Å; I39-H205 HydrophobicContact CG1-CB 4.4Å; I39-V206 HydrophobicContact CD1-CG2 4.32Å; I39-V206 HydrophobicContact CG1-CG2 3.49Å; I39-V206 VanDerWaalsContact CG1-CG2 3.49Å; I39-V206 HydrophobicContact CG2-CG2 4.41Å; I39-Y214 HydrophobicContact CG2-CE1 4.4Å; I39-L289 HydrophobicContact CB-CD1 3.67Å; I39-L289 HydrophobicContact CD1-CD1 3.75Å; I39-L289 HydrophobicContact CG1-CD1 4.19Å
40	K	89.1	Confident	77.6	Confident	129 Å²	129	65 Å²	65	56%	0.561	34%	0.337	S	S	*	.	H	α-helix	trans	-66.9	-35.8	175.6	-63.4	-178.7	-179.1	179.8	0	111.6	N38 L43 V44 Y214	N38-K40 VanDerWaalsContact C-N 3.27Å; N38-K40 PolarHBondContact O-N 2.94Å; N38-K40 WeakPolarHBondContact OD1-CB 3.47Å; N38-K40 PolarHBondContact OD1-N 3.46Å; K40-L43 WeakPolarHBondContact O-CB 3.42Å; K40-L43 PolarHBondContact O-N 3.42Å; K40-V44 WeakPolarHBondContact O-CG2 3.28Å; K40-V44 PolarHBondContact O-N 3.4Å; K40-Y214 HydrophobicContact CG-CE1 4.33Å
41	I	90.6	Very high	80.3	Confident	54 Å²	54	58.8 Å²	58.8	28%	0.277	31%	0.312	S	S	.	.	H	α-helix	trans	-73.6	-37.9	177.6	-61.8	177.3	0	0	0	109.6	C35 N38 I39 L43 V44 S45 F285	C35-I41 VanDerWaalsContact O-CD1 3.24Å; C35-I41 WeakPolarHBondContact O-CD1 3.43Å; C35-I41 VanDerWaalsContact SG-CD1 3.57Å; N38-I41 HydrophobicContact CB-CB 4.38Å; N38-I41 HydrophobicContact CB-CD1 4.02Å; N38-I41 HydrophobicContact CB-CG1 4.11Å; N38-I41 PolarHBondContact O-N 3.27Å; N38-I41 VanDerWaalsContact O-N 3.13Å; I39-I41 VanDerWaalsContact C-N 3.32Å; I39-I41 PolarHBondContact O-N 3.46Å; I41-L43 VanDerWaalsContact C-N 3.34Å; I41-L43 PolarHBondContact O-N 3.4Å; I41-V44 PolarHBondContact O-N 3.39Å; I41-S45 PolarHBondContact O-N 2.97Å; I41-S45 PolarHBondContact O-OG 3.33Å; I41-S45 VanDerWaalsContact O-OG 3.07Å; I41-F285 HydrophobicContact CB-CE1 4.48Å; I41-F285 HydrophobicContact CG2-CE1 4.31Å; I41-F285 HydrophobicContact CG2-CZ 4Å
42	F	92.3	Very high	82.8	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-57.8	-47.4	170.1	-179.1	-90.5	0	0	0	111.5	N38 I39 V44 S45 E46 P106 I109 Y201 I202 M282 F285	N38-F42 PolarHBondContact O-N 2.89Å; N38-F42 VanDerWaalsContact O-N 3.14Å; I39-F42 HydrophobicContact CD1-CB 4.25Å; I39-F42 HydrophobicContact CD1-CD1 4.19Å; I39-F42 HydrophobicContact CD1-CG 4.49Å; I39-F42 PolarHBondContact O-N 3.47Å; F42-V44 VanDerWaalsContact C-N 3.35Å; F42-V44 PolarHBondContact O-N 2.88Å; F42-S45 PolarHBondContact O-N 3.47Å; F42-E46 HydrophobicContact CE1-CB 4.25Å; F42-E46 WeakPolarHBondContact O-CB 3.44Å; F42-E46 PolarHBondContact O-N 2.9Å; F42-P106 HydrophobicContact CE2-CB 4.1Å; F42-P106 HydrophobicContact CE2-CG 3.98Å; F42-I109 HydrophobicContact CZ-CD1 4.15Å; F42-Y201 AromaticContact CD1-CD1 3.64Å; F42-Y201 HydrophobicContact CD1-CD1 3.64Å; F42-Y201 HydrophobicContact CD1-CE1 4.04Å; F42-Y201 AromaticContact CD2-CD1 3.88Å; F42-Y201 HydrophobicContact CD2-CD1 3.88Å; F42-Y201 AromaticContact CD2-CE1 3.7Å; F42-Y201 HydrophobicContact CD2-CE1 3.7Å; F42-Y201 AromaticContact CE1-CD1 3.43Å; F42-Y201 HydrophobicContact CE1-CD1 3.43Å; F42-Y201 VanDerWaalsContact CE1-CD1 3.43Å; F42-Y201 HydrophobicContact CE1-CE1 4.21Å; F42-Y201 HydrophobicContact CE1-CG 4.16Å; F42-Y201 AromaticContact CE2-CD1 3.68Å; F42-Y201 HydrophobicContact CE2-CD1 3.68Å; F42-Y201 AromaticContact CE2-CE1 3.87Å; F42-Y201 HydrophobicContact CE2-CE1 3.87Å; F42-Y201 HydrophobicContact CE2-CG 4.28Å; F42-Y201 AromaticContact CG-CD1 3.87Å; F42-Y201 HydrophobicContact CG-CD1 3.87Å; F42-Y201 AromaticContact CG-CE1 3.78Å; F42-Y201 HydrophobicContact CG-CE1 3.78Å; F42-Y201 AromaticContact CZ-CD1 3.45Å; F42-Y201 HydrophobicContact CZ-CD1 3.45Å; F42-Y201 VanDerWaalsContact CZ-CD1 3.45Å; F42-Y201 HydrophobicContact CZ-CE1 4.12Å; F42-Y201 AromaticContact CZ-CG 3.91Å; F42-Y201 HydrophobicContact CZ-CG 3.91Å; F42-I202 HydrophobicContact CD1-CD1 4.04Å; F42-I202 HydrophobicContact CD1-CG1 3.72Å; F42-I202 HydrophobicContact CE1-CD1 3.92Å; F42-I202 HydrophobicContact CE1-CG1 3.75Å; F42-M282 HydrophobicContact CD2-SD 4.37Å; F42-M282 HydrophobicContact CE2-SD 3.88Å; F42-F285 VanDerWaalsContact CA-CE1 3.43Å; F42-F285 HydrophobicContact CB-CD1 3.93Å; F42-F285 HydrophobicContact CB-CE1 3.55Å; F42-F285 HydrophobicContact CB-CZ 3.91Å; F42-F285 HydrophobicContact CD2-CB 4.38Å; F42-F285 AromaticContact CD2-CD1 3.92Å; F42-F285 HydrophobicContact CD2-CD1 3.92Å; F42-F285 AromaticContact CD2-CD2 3.92Å; F42-F285 HydrophobicContact CD2-CD2 3.92Å; F42-F285 HydrophobicContact CD2-CE1 4.18Å; F42-F285 HydrophobicContact CD2-CE2 4.14Å; F42-F285 AromaticContact CD2-CG 3.81Å; F42-F285 HydrophobicContact CD2-CG 3.81Å; F42-F285 HydrophobicContact CD2-CZ 4.27Å; F42-F285 HydrophobicContact CG-CD1 4.43Å; F42-F285 HydrophobicContact CG-CE1 4.39Å; F42-F285 VanDerWaalsContact N-CE1 3.34Å
43	L	91.8	Very high	85.4	Confident	16 Å²	16	41 Å²	41	8%	0.084	24%	0.236	C	C	.	.	H	α-helix	trans	-56	-48.1	176.5	178.9	72	0	0	0	111.6	I39 K40 I41 S45 E46 C47 I202 Y214 I217 L218	I39-L43 PolarHBondContact O-N 3.39Å; K40-L43 WeakPolarHBondContact O-CB 3.42Å; K40-L43 PolarHBondContact O-N 3.42Å; I41-L43 VanDerWaalsContact C-N 3.34Å; I41-L43 PolarHBondContact O-N 3.4Å; L43-S45 PolarHBondContact O-N 3.36Å; L43-E46 PolarHBondContact O-N 3.31Å; L43-C47 VanDerWaalsContact O-CB 3.29Å; L43-C47 WeakPolarHBondContact O-CB 3.23Å; L43-C47 PolarHBondContact O-N 3.48Å; L43-C47 PolarHBondContact O-SG 3Å; L43-I202 HydrophobicContact CD1-CD1 3.77Å; L43-Y214 HydrophobicContact CB-CD1 4.12Å; L43-Y214 HydrophobicContact CB-CE1 4.46Å; L43-Y214 HydrophobicContact CD1-CD1 4.18Å; L43-Y214 HydrophobicContact CD2-CD1 3.58Å; L43-Y214 HydrophobicContact CD2-CE1 3.97Å; L43-Y214 HydrophobicContact CD2-CG 4.18Å; L43-Y214 HydrophobicContact CG-CD1 4.16Å; L43-I217 HydrophobicContact CD2-CD1 4.13Å; L43-I217 HydrophobicContact CD2-CG2 4.3Å; L43-L218 HydrophobicContact CD1-CD2 3.95Å; L43-L218 HydrophobicContact CD1-CG 3.78Å
44	V	93.5	Very high	87.6	Confident	99 Å²	99	35.7 Å²	35.7	60%	0.6	21%	0.205	S	C	*	.	H	α-helix	trans	-61.6	-45.6	179.8	170.6	0	0	0	0	111.4	K40 I41 F42 E46 C47 A48	K40-V44 WeakPolarHBondContact O-CG2 3.28Å; K40-V44 PolarHBondContact O-N 3.4Å; I41-V44 PolarHBondContact O-N 3.39Å; F42-V44 VanDerWaalsContact C-N 3.35Å; F42-V44 PolarHBondContact O-N 2.88Å; V44-E46 VanDerWaalsContact C-N 3.32Å; V44-E46 PolarHBondContact O-N 3.11Å; V44-C47 WeakPolarHBondContact O-CB 3.48Å; V44-C47 PolarHBondContact O-N 3.31Å; V44-A48 PolarHBondContact O-N 3.39Å
45	S	93.6	Very high	89.3	Confident	5 Å²	5	33.1 Å²	33.1	4%	0.035	19%	0.187	C	C	.	.	H	α-helix	trans	-64.9	-38.1	179	-55.6	0	0	0	0	111.7	I41 F42 L43 A48 L49 M282	I41-S45 PolarHBondContact O-N 2.97Å; I41-S45 PolarHBondContact O-OG 3.33Å; I41-S45 VanDerWaalsContact O-OG 3.07Å; F42-S45 PolarHBondContact O-N 3.47Å; L43-S45 PolarHBondContact O-N 3.36Å; S45-A48 PolarHBondContact O-N 2.87Å; S45-L49 PolarHBondContact O-N 2.79Å; S45-L49 VanDerWaalsContact O-N 3.09Å; S45-M282 WeakPolarHBondContact O-CE 3.37Å
46	E	93.4	Very high	90.9	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-70.2	-41.4	178.1	-176.9	63.9	-168.5	0	0	111.1	F42 L43 V44 A48 L49 M50 I109 V194 L218 M282	F42-E46 HydrophobicContact CE1-CB 4.25Å; F42-E46 WeakPolarHBondContact O-CB 3.44Å; F42-E46 PolarHBondContact O-N 2.9Å; L43-E46 PolarHBondContact O-N 3.31Å; V44-E46 VanDerWaalsContact C-N 3.32Å; V44-E46 PolarHBondContact O-N 3.11Å; E46-A48 VanDerWaalsContact C-N 3.3Å; E46-A48 PolarHBondContact O-N 2.98Å; E46-L49 PolarHBondContact O-N 3.35Å; E46-M50 WeakPolarHBondContact O-CG 3.47Å; E46-M50 PolarHBondContact O-N 3.19Å; E46-I109 WeakPolarHBondContact OE2-CG2 3.48Å; E46-V194 WeakPolarHBondContact OE1-CG1 3.38Å; E46-V194 VanDerWaalsContact OE1-O 3.07Å; E46-L218 HydrophobicContact CB-CD2 3.97Å; E46-L218 HydrophobicContact CG-CD1 4.42Å; E46-L218 HydrophobicContact CG-CD2 3.51Å; E46-M282 HydrophobicContact CB-CE 4.06Å
47	C	94.3	Very high	91.9	Very high	11 Å²	11	27.8 Å²	27.8	7%	0.074	16%	0.163	C	C	.	.	H	α-helix	trans	-57.1	-43.2	171.5	-78	0	0	0	0	111.9	L43 V44 M50 L51 M221	L43-C47 VanDerWaalsContact O-CB 3.29Å; L43-C47 WeakPolarHBondContact O-CB 3.23Å; L43-C47 PolarHBondContact O-N 3.48Å; L43-C47 PolarHBondContact O-SG 3Å; V44-C47 WeakPolarHBondContact O-CB 3.48Å; V44-C47 PolarHBondContact O-N 3.31Å; C47-M50 PolarHBondContact O-N 3.14Å; C47-L51 VanDerWaalsContact O-CB 3.26Å; C47-L51 WeakPolarHBondContact O-CB 3.49Å; C47-L51 PolarHBondContact O-N 3.43Å; C47-M221 HydrophobicContact CB-CB 4.39Å; C47-M221 HydrophobicContact CB-CG 3.87Å
48	A	95.3	Very high	92.8	Very high	33 Å²	33	26.7 Å²	26.7	27%	0.273	16%	0.156	S	C	.	.	H	α-helix	trans	-63.2	-42.7	177.4	0	0	0	0	0	111.5	V44 S45 E46 L51 A52	V44-A48 PolarHBondContact O-N 3.39Å; S45-A48 PolarHBondContact O-N 2.87Å; E46-A48 VanDerWaalsContact C-N 3.3Å; E46-A48 PolarHBondContact O-N 2.98Å; A48-L51 PolarHBondContact O-N 3.01Å; A48-A52 WeakPolarHBondContact O-CB 3.47Å; A48-A52 PolarHBondContact O-N 3.11Å
49	L	95.3	Very high	93.3	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-66.3	-43.6	177.2	-173.7	60.9	0	0	0	112.2	S45 E46 L51 A52 Q53 I109 M116 V194 L275 M282	S45-L49 PolarHBondContact O-N 2.79Å; S45-L49 VanDerWaalsContact O-N 3.09Å; E46-L49 PolarHBondContact O-N 3.35Å; L49-L51 VanDerWaalsContact C-N 3.35Å; L49-L51 PolarHBondContact O-N 3.45Å; L49-A52 PolarHBondContact O-N 3.47Å; L49-Q53 WeakPolarHBondContact O-CB 3.38Å; L49-Q53 PolarHBondContact O-N 2.83Å; L49-I109 HydrophobicContact CD2-CG2 3.47Å; L49-I109 VanDerWaalsContact CD2-CG2 3.47Å; L49-M116 HydrophobicContact CD1-CE 3.99Å; L49-M116 HydrophobicContact CG-CE 4.36Å; L49-V194 HydrophobicContact CD2-CG1 3.98Å; L49-V194 HydrophobicContact CD2-CG2 4.12Å; L49-V194 HydrophobicContact CG-CG1 4.13Å; L49-L275 HydrophobicContact CD1-CD2 4.12Å; L49-M282 HydrophobicContact CD2-CG 4.42Å
50	M	93.2	Very high	93.6	Very high	4 Å²	4	23 Å²	23	2%	0.02	14%	0.136	C	C	.	.	H	α-helix	trans	-64	-38.6	175.4	-76.2	-165.2	169.1	0	0	112.6	E46 C47 Q53 G54 V194 Q195 L218	E46-M50 WeakPolarHBondContact O-CG 3.47Å; E46-M50 PolarHBondContact O-N 3.19Å; C47-M50 PolarHBondContact O-N 3.14Å; M50-Q53 PolarHBondContact O-N 3.34Å; M50-G54 PolarHBondContact O-N 2.8Å; M50-V194 HydrophobicContact CG-CG1 4.16Å; M50-Q195 HydrophobicContact CE-CB 3.88Å; M50-Q195 HydrophobicContact CE-CG 3.92Å; M50-L218 HydrophobicContact SD-CB 4.06Å; M50-L218 HydrophobicContact SD-CD2 3.92Å; M50-L218 HydrophobicContact SD-CG 4.48Å
51	L	94.2	Very high	93.8	Very high	43 Å²	43	18.5 Å²	18.5	23%	0.225	12%	0.119	C	C	.	.	H	α-helix	trans	-62.1	-47.4	175	-177	73.5	0	0	0	110.8	C47 A48 L49 Q53 G54 T55 M221 F224	C47-L51 VanDerWaalsContact O-CB 3.26Å; C47-L51 WeakPolarHBondContact O-CB 3.49Å; C47-L51 PolarHBondContact O-N 3.43Å; A48-L51 PolarHBondContact O-N 3.01Å; L49-L51 VanDerWaalsContact C-N 3.35Å; L49-L51 PolarHBondContact O-N 3.45Å; L51-Q53 VanDerWaalsContact C-N 3.34Å; L51-Q53 PolarHBondContact O-N 3.4Å; L51-G54 PolarHBondContact O-N 3.45Å; L51-T55 WeakPolarHBondContact O-CB 3.49Å; L51-T55 PolarHBondContact O-N 3.41Å; L51-T55 PolarHBondContact O-OG1 3.45Å; L51-M221 HydrophobicContact CB-CE 4.05Å; L51-M221 HydrophobicContact CD1-CE 3.96Å; L51-M221 HydrophobicContact CD2-CE 3.94Å; L51-M221 HydrophobicContact CG-CE 4.21Å; L51-F224 HydrophobicContact CD1-CB 4.37Å; L51-F224 HydrophobicContact CD1-CD1 3.72Å
52	A	95.3	Very high	93.9	Very high	5 Å²	5	15.9 Å²	15.9	4%	0.041	11%	0.106	C	C	.	.	H	α-helix	trans	-62.5	-41.2	177.7	0	0	0	0	0	111.7	A48 L49 T55 V56 L274 L275	A48-A52 WeakPolarHBondContact O-CB 3.47Å; A48-A52 PolarHBondContact O-N 3.11Å; L49-A52 PolarHBondContact O-N 3.47Å; A52-T55 PolarHBondContact O-N 3.37Å; A52-V56 PolarHBondContact O-N 3.32Å; A52-L274 HydrophobicContact CB-CB 4.13Å; A52-L275 HydrophobicContact CB-CD2 3.72Å; A52-L275 HydrophobicContact CB-CG 3.99Å
53	Q	94.4	Very high	93.9	Very high	16 Å²	16	15.9 Å²	15.9	8%	0.075	11%	0.106	C	C	.	.	H	α-helix	trans	-60.8	-46.6	174	-177.1	-171.3	-50.9	0	0	111.9	L49 M50 L51 T55 V56 G57 M116 A191	L49-Q53 WeakPolarHBondContact O-CB 3.38Å; L49-Q53 PolarHBondContact O-N 2.83Å; M50-Q53 PolarHBondContact O-N 3.34Å; L51-Q53 VanDerWaalsContact C-N 3.34Å; L51-Q53 PolarHBondContact O-N 3.4Å; Q53-T55 VanDerWaalsContact C-N 3.31Å; Q53-T55 PolarHBondContact O-N 3.06Å; Q53-V56 VanDerWaalsContact O-CG1 3.23Å; Q53-V56 WeakPolarHBondContact O-CG1 3.29Å; Q53-G57 PolarHBondContact O-N 2.92Å; Q53-M116 HydrophobicContact CB-CE 4.47Å; Q53-M116 HydrophobicContact CB-SD 4.23Å; Q53-M116 HydrophobicContact CG-SD 3.85Å; Q53-A191 HydrophobicContact CG-CB 4.29Å
54	G	92.6	Very high	93.9	Very high	9 Å²	9	15.3 Å²	15.3	9%	0.093	10%	0.103	C	C	.	.	H	α-helix	trans	-65.4	-35.5	177	0	0	0	0	0	112.8	M50 L51 A58	M50-G54 PolarHBondContact O-N 2.8Å; L51-G54 PolarHBondContact O-N 3.45Å; G54-A58 PolarHBondContact O-N 3.4Å
55	T	95.1	Very high	93.6	Very high	9 Å²	9	11.2 Å²	11.2	6%	0.055	8%	0.078	C	C	.	.	H	α-helix	trans	-64.7	-48.4	178.2	-56.9	0	0	0	0	111.2	L51 A52 Q53 G57 A58 Y59 G225 C228 G229 L232	L51-T55 WeakPolarHBondContact O-CB 3.49Å; L51-T55 PolarHBondContact O-N 3.41Å; L51-T55 PolarHBondContact O-OG1 3.45Å; A52-T55 PolarHBondContact O-N 3.37Å; Q53-T55 VanDerWaalsContact C-N 3.31Å; Q53-T55 PolarHBondContact O-N 3.06Å; T55-G57 VanDerWaalsContact C-N 3.33Å; T55-G57 PolarHBondContact O-N 3.48Å; T55-A58 PolarHBondContact O-N 2.77Å; T55-Y59 VanDerWaalsContact O-CB 3.22Å; T55-Y59 WeakPolarHBondContact O-CB 3.36Å; T55-Y59 PolarHBondContact O-N 2.76Å; T55-G225 WeakPolarHBondContact CA-O 3.3Å; T55-G225 PolarHBondContact OG1-O 3.47Å; T55-C228 HydrophobicContact CG2-CB 4.2Å; T55-G229 WeakPolarHBondContact O-CA 3Å; T55-L232 HydrophobicContact CG2-CD2 4.37Å
56	V	96.1	Very high	93.3	Very high	5 Å²	5	11.2 Å²	11.2	3%	0.03	8%	0.078	C	C	.	.	H	α-helix	trans	-64.9	-37.2	-179.5	68.6	0	0	0	0	112.3	A52 Q53 Y59 L60 A120 L187 F268 C271 L275	A52-V56 PolarHBondContact O-N 3.32Å; Q53-V56 VanDerWaalsContact O-CG1 3.23Å; Q53-V56 WeakPolarHBondContact O-CG1 3.29Å; V56-Y59 PolarHBondContact O-N 2.97Å; V56-L60 PolarHBondContact O-N 3.49Å; V56-A120 HydrophobicContact CG2-CB 4.25Å; V56-L187 HydrophobicContact CG1-CD2 4.17Å; V56-L187 HydrophobicContact CG2-CD1 4.36Å; V56-L187 HydrophobicContact CG2-CD2 4.32Å; V56-F268 HydrophobicContact CG2-CD1 4.11Å; V56-F268 HydrophobicContact CG2-CE1 4.31Å; V56-C271 HydrophobicContact CB-CB 3.86Å; V56-C271 HydrophobicContact CG2-CB 3.9Å; V56-L275 HydrophobicContact CB-CD1 4.46Å; V56-L275 HydrophobicContact CG1-CD1 4.17Å
57	G	92.8	Very high	93.1	Very high	30 Å²	30	11.2 Å²	11.2	31%	0.309	8%	0.078	S	C	.	.	H	α-helix	trans	-64.5	-47.2	177.9	0	0	0	0	0	112.6	Q53 T55 L60 V61	Q53-G57 PolarHBondContact O-N 2.92Å; T55-G57 VanDerWaalsContact C-N 3.33Å; T55-G57 PolarHBondContact O-N 3.48Å; G57-L60 PolarHBondContact O-N 3.45Å; G57-V61 PolarHBondContact O-N 3.26Å
58	A	93.3	Very high	92.7	Very high	8 Å²	8	11.1 Å²	11.1	7%	0.066	8%	0.076	C	C	.	.	H	α-helix	trans	-72.5	-30	176.3	0	0	0	0	0	113.1	G54 T55 V61 S62 P226 F230	G54-A58 PolarHBondContact O-N 3.4Å; T55-A58 PolarHBondContact O-N 2.77Å; A58-V61 PolarHBondContact O-N 3.43Å; A58-S62 WeakPolarHBondContact O-CB 3.39Å; A58-S62 PolarHBondContact O-N 3.19Å; A58-P226 VanDerWaalsContact CB-CA 3.44Å; A58-P226 HydrophobicContact CB-CB 3.86Å; A58-P226 WeakPolarHBondContact CB-O 3.38Å; A58-F230 HydrophobicContact CB-CD2 3.91Å; A58-F230 HydrophobicContact CB-CE2 3.84Å; A58-F230 HydrophobicContact CB-CZ 4.47Å
59	Y	95.7	Very high	92	Very high	0 Å²	0	13.9 Å²	13.9	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-61.2	-45.3	173.4	-178.5	-100.8	0	0	0	111.1	T55 V56 V61 S62 V63 L232 C236 W264 G267 F268	T55-Y59 VanDerWaalsContact O-CB 3.22Å; T55-Y59 WeakPolarHBondContact O-CB 3.36Å; T55-Y59 PolarHBondContact O-N 2.76Å; V56-Y59 PolarHBondContact O-N 2.97Å; Y59-V61 VanDerWaalsContact C-N 3.33Å; Y59-V61 PolarHBondContact O-N 2.74Å; Y59-S62 WeakPolarHBondContact CA-OG 3.33Å; Y59-S62 PolarHBondContact O-N 3.16Å; Y59-S62 VanDerWaalsContact O-N 3.14Å; Y59-S62 PolarHBondContact O-OG 3.04Å; Y59-V63 HydrophobicContact CE1-CG1 4.17Å; Y59-V63 HydrophobicContact CE1-CG2 4.4Å; Y59-V63 HydrophobicContact CE2-CG1 4.03Å; Y59-V63 WeakPolarHBondContact O-CG2 3.42Å; Y59-V63 PolarHBondContact O-N 3.09Å; Y59-L232 HydrophobicContact CD2-CB 4.24Å; Y59-L232 HydrophobicContact CD2-CD2 4.05Å; Y59-L232 HydrophobicContact CD2-CG 3.9Å; Y59-L232 HydrophobicContact CE2-CD2 4.44Å; Y59-L232 HydrophobicContact CE2-CG 4.05Å; Y59-C236 HydrophobicContact CE2-CB 4.04Å; Y59-W264 VanDerWaalsContact CE1-O 3.25Å; Y59-W264 WeakPolarHBondContact CE1-O 3.29Å; Y59-W264 VanDerWaalsContact CZ-O 3.31Å; Y59-W264 PolarHBondContact OH-O 3.42Å; Y59-G267 WeakPolarHBondContact OH-CA 3.3Å; Y59-G267 PolarHBondContact OH-N 3.24Å; Y59-F268 AromaticContact CD1-CD1 3.81Å; Y59-F268 HydrophobicContact CD1-CD1 3.81Å; Y59-F268 HydrophobicContact CD1-CD2 4.26Å; Y59-F268 AromaticContact CD1-CE1 3.75Å; Y59-F268 HydrophobicContact CD1-CE1 3.75Å; Y59-F268 HydrophobicContact CD1-CE2 4.21Å; Y59-F268 HydrophobicContact CD1-CG 4.05Å; Y59-F268 AromaticContact CD1-CZ 3.95Å; Y59-F268 HydrophobicContact CD1-CZ 3.95Å; Y59-F268 HydrophobicContact CE1-CB 4.47Å; Y59-F268 HydrophobicContact CE1-CD1 4.07Å; Y59-F268 AromaticContact CE1-CD2 3.72Å; Y59-F268 HydrophobicContact CE1-CD2 3.72Å; Y59-F268 HydrophobicContact CE1-CE1 4.19Å; Y59-F268 AromaticContact CE1-CE2 3.85Å; Y59-F268 HydrophobicContact CE1-CE2 3.85Å; Y59-F268 AromaticContact CE1-CG 3.81Å; Y59-F268 HydrophobicContact CE1-CG 3.81Å; Y59-F268 HydrophobicContact CE1-CZ 4.08Å
60	L	94.3	Very high	91.3	Very high	6 Å²	6	16.1 Å²	16.1	3%	0.031	9%	0.088	C	C	.	.	H	α-helix	trans	-52.1	-53.5	172.1	171.5	65.3	0	0	0	110.7	V56 G57 S62 V63 L64 L67 I81 Q184 F268	V56-L60 PolarHBondContact O-N 3.49Å; G57-L60 PolarHBondContact O-N 3.45Å; L60-S62 PolarHBondContact O-N 3.06Å; L60-V63 WeakPolarHBondContact O-CG2 3.36Å; L60-V63 PolarHBondContact O-N 2.9Å; L60-V63 VanDerWaalsContact O-N 3.08Å; L60-L64 HydrophobicContact CD1-CD2 3.98Å; L60-L64 HydrophobicContact CG-CD2 4.14Å; L60-L64 WeakPolarHBondContact O-CG 3.43Å; L60-L64 PolarHBondContact O-N 2.83Å; L60-L64 VanDerWaalsContact O-N 3.13Å; L60-L67 HydrophobicContact CD1-CD1 4.21Å; L60-I81 HydrophobicContact CD1-CG2 4.14Å; L60-Q184 VanDerWaalsContact CD2-CD 3.43Å; L60-Q184 HydrophobicContact CD2-CG 4.02Å; L60-F268 HydrophobicContact CB-CE1 4.32Å; L60-F268 HydrophobicContact CB-CZ 4.22Å; L60-F268 HydrophobicContact CD1-CZ 3.99Å
61	V	92.4	Very high	90.6	Very high	35 Å²	35	16.4 Å²	16.4	21%	0.212	9%	0.089	C	C	.	.	H	α-helix	trans	-56.7	-40.7	-179.5	176.9	0	0	0	0	111.6	G57 A58 Y59 V63 L64 F230 A369	G57-V61 PolarHBondContact O-N 3.26Å; A58-V61 PolarHBondContact O-N 3.43Å; Y59-V61 VanDerWaalsContact C-N 3.33Å; Y59-V61 PolarHBondContact O-N 2.74Å; V61-V63 VanDerWaalsContact C-N 3.26Å; V61-V63 PolarHBondContact O-N 3.24Å; V61-L64 HydrophobicContact CB-CD1 4.44Å; V61-L64 HydrophobicContact CG1-CD1 4.42Å; V61-L64 HydrophobicContact CG2-CD1 4.47Å; V61-L64 PolarHBondContact O-N 2.85Å; V61-F230 HydrophobicContact CB-CE1 4.31Å; V61-F230 HydrophobicContact CB-CZ 4.1Å; V61-F230 HydrophobicContact CG1-CE1 3.95Å; V61-F230 HydrophobicContact CG1-CZ 3.73Å; V61-A369 WeakPolarHBondContact CG1-O 3.22Å
62	S	93.1	Very high	89.8	Confident	0 Å²	0	15.9 Å²	15.9	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-66.7	-23.2	-179.9	77.5	0	0	0	0	114.4	A58 Y59 L60 G233 N388	A58-S62 WeakPolarHBondContact O-CB 3.39Å; A58-S62 PolarHBondContact O-N 3.19Å; Y59-S62 WeakPolarHBondContact CA-OG 3.33Å; Y59-S62 PolarHBondContact O-N 3.16Å; Y59-S62 VanDerWaalsContact O-N 3.14Å; Y59-S62 PolarHBondContact O-OG 3.04Å; L60-S62 PolarHBondContact O-N 3.06Å; S62-G233 VanDerWaalsContact OG-CA 3.24Å; S62-G233 WeakPolarHBondContact OG-CA 3.18Å; S62-N388 WeakPolarHBondContact CA-OD1 2.92Å; S62-N388 WeakPolarHBondContact CB-OD1 3.22Å; S62-N388 PolarHBondContact O-ND2 3.09Å; S62-N388 PolarHBondContact O-OD1 3.41Å
63	V	93.1	Very high	89.3	Confident	0 Å²	0	16.1 Å²	16.1	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-107.3	2.6	-179.6	-56.9	0	0	0	0	113.3	Y59 L60 V61 T65 T66 L67 T237 W264 F268	Y59-V63 HydrophobicContact CE1-CG1 4.17Å; Y59-V63 HydrophobicContact CE1-CG2 4.4Å; Y59-V63 HydrophobicContact CE2-CG1 4.03Å; Y59-V63 WeakPolarHBondContact O-CG2 3.42Å; Y59-V63 PolarHBondContact O-N 3.09Å; L60-V63 WeakPolarHBondContact O-CG2 3.36Å; L60-V63 PolarHBondContact O-N 2.9Å; L60-V63 VanDerWaalsContact O-N 3.08Å; V61-V63 VanDerWaalsContact C-N 3.26Å; V61-V63 PolarHBondContact O-N 3.24Å; V63-T65 VanDerWaalsContact C-N 3.3Å; V63-T65 PolarHBondContact O-N 3.15Å; V63-T66 WeakPolarHBondContact O-CA 3.36Å; V63-T66 WeakPolarHBondContact O-CB 3.24Å; V63-T66 PolarHBondContact O-N 3.29Å; V63-L67 HydrophobicContact CG2-CD1 4.21Å; V63-L67 HydrophobicContact CG2-CG 4.45Å; V63-L67 WeakPolarHBondContact O-CG 3.47Å; V63-L67 PolarHBondContact O-N 3.42Å; V63-T237 HydrophobicContact CG1-CG2 4.16Å; V63-W264 HydrophobicContact CB-CB 3.97Å; V63-W264 HydrophobicContact CG1-CB 4.15Å; V63-W264 HydrophobicContact CG2-CB 4.4Å; V63-F268 HydrophobicContact CG2-CE2 4.16Å; V63-F268 HydrophobicContact CG2-CZ 4.25Å
64	L	90.4	Very high	88.9	Confident	4 Å²	4	18 Å²	18	2%	0.021	10%	0.096	C	C	.	.	H	α-helix	trans	-56.1	-42.5	-179.9	-77.4	177.1	0	0	0	112.2	L60 V61 T66 L67 E68 V78 A82	L60-L64 HydrophobicContact CD1-CD2 3.98Å; L60-L64 HydrophobicContact CG-CD2 4.14Å; L60-L64 WeakPolarHBondContact O-CG 3.43Å; L60-L64 PolarHBondContact O-N 2.83Å; L60-L64 VanDerWaalsContact O-N 3.13Å; V61-L64 HydrophobicContact CB-CD1 4.44Å; V61-L64 HydrophobicContact CG1-CD1 4.42Å; V61-L64 HydrophobicContact CG2-CD1 4.47Å; V61-L64 PolarHBondContact O-N 2.85Å; L64-T66 VanDerWaalsContact C-N 3.31Å; L64-T66 PolarHBondContact O-N 3.26Å; L64-L67 PolarHBondContact O-N 2.87Å; L64-E68 WeakPolarHBondContact O-CB 3.46Å; L64-E68 PolarHBondContact O-N 3.49Å; L64-V78 HydrophobicContact CB-CG1 3.52Å; L64-V78 HydrophobicContact CD1-CG1 3.97Å; L64-V78 HydrophobicContact CD2-CG1 3.53Å; L64-V78 HydrophobicContact CG-CG1 3.8Å; L64-A82 HydrophobicContact CD1-CB 4.13Å
65	T	87.8	Confident	88.7	Confident	12 Å²	12	17.6 Å²	17.6	7%	0.074	9%	0.092	C	C	.	.	H	α-helix	trans	-66.3	-33.5	177.1	54	0	0	0	0	112.3	V63 E68 R69 K374 E377	V63-T65 VanDerWaalsContact C-N 3.3Å; V63-T65 PolarHBondContact O-N 3.15Å; T65-E68 WeakPolarHBondContact O-CB 3.37Å; T65-R69 WeakPolarHBondContact O-CG 3.27Å; T65-R69 PolarHBondContact O-N 3.24Å; T65-R69 VanDerWaalsContact O-N 3.14Å; T65-K374 HydrophobicContact CG2-CB 3.53Å; T65-K374 HydrophobicContact CG2-CD 4.32Å; T65-K374 HydrophobicContact CG2-CG 3.91Å; T65-E377 PolarHBondContact OG1-OE1 3.02Å
66	T	88.4	Confident	88.3	Confident	6 Å²	6	18.4 Å²	18.4	4%	0.037	10%	0.1	C	C	.	.	H	α-helix	trans	-69.1	-42.8	174.6	-50.3	0	0	0	0	111.4	V63 L64 E68 R69 R70 I261 W264	V63-T66 WeakPolarHBondContact O-CA 3.36Å; V63-T66 WeakPolarHBondContact O-CB 3.24Å; V63-T66 PolarHBondContact O-N 3.29Å; L64-T66 VanDerWaalsContact C-N 3.31Å; L64-T66 PolarHBondContact O-N 3.26Å; T66-E68 VanDerWaalsContact C-N 3.34Å; T66-R69 PolarHBondContact O-N 3.43Å; T66-R70 VanDerWaalsContact O-CB 3.29Å; T66-R70 WeakPolarHBondContact O-CB 3.19Å; T66-R70 PolarHBondContact O-N 2.96Å; T66-I261 HydrophobicContact CG2-CG2 3.56Å; T66-W264 HydrophobicContact CG2-CB 4.01Å; T66-W264 HydrophobicContact CG2-CG 4.35Å
67	L	87.4	Confident	88	Confident	0 Å²	0	20.5 Å²	20.5	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-63	-41.4	174.8	-69.3	173.9	0	0	0	111.5	L60 V63 L64 R69 R70 F71 L180 W264	L60-L67 HydrophobicContact CD1-CD1 4.21Å; V63-L67 HydrophobicContact CG2-CD1 4.21Å; V63-L67 HydrophobicContact CG2-CG 4.45Å; V63-L67 WeakPolarHBondContact O-CG 3.47Å; V63-L67 PolarHBondContact O-N 3.42Å; L64-L67 PolarHBondContact O-N 2.87Å; L67-R69 PolarHBondContact O-N 3.3Å; L67-R70 PolarHBondContact O-N 2.96Å; L67-F71 HydrophobicContact CB-CD2 4.4Å; L67-F71 HydrophobicContact CD2-CD2 4.06Å; L67-F71 HydrophobicContact CD2-CE2 3.59Å; L67-F71 WeakPolarHBondContact O-CB 3.37Å; L67-F71 VanDerWaalsContact O-CD2 3.27Å; L67-F71 WeakPolarHBondContact O-CD2 3.49Å; L67-F71 PolarHBondContact O-N 3.49Å; L67-L180 HydrophobicContact CD1-CD1 4.47Å; L67-L180 HydrophobicContact CD2-CD1 4.15Å; L67-W264 HydrophobicContact CD2-CD2 3.65Å; L67-W264 HydrophobicContact CD2-CE3 3.52Å; L67-W264 HydrophobicContact CD2-CG 4.24Å; L67-W264 HydrophobicContact CD2-CH2 4.32Å; L67-W264 HydrophobicContact CD2-CZ2 4.41Å; L67-W264 HydrophobicContact CD2-CZ3 3.88Å; L67-W264 HydrophobicContact CG-CE3 4.47Å
68	E	86.5	Confident	87.8	Confident	8 Å²	8	19.1 Å²	19.1	4%	0.037	10%	0.096	C	C	.	.	H	α-helix	trans	-55.7	-51.2	175.6	-167.4	-173.5	140.5	0	0	111.4	L64 T65 T66 N72 L73 V78 K374 A613	L64-E68 WeakPolarHBondContact O-CB 3.46Å; L64-E68 PolarHBondContact O-N 3.49Å; T65-E68 WeakPolarHBondContact O-CB 3.37Å; T66-E68 VanDerWaalsContact C-N 3.34Å; E68-N72 WeakPolarHBondContact O-CA 3.34Å; E68-N72 PolarHBondContact O-N 2.9Å; E68-L73 WeakPolarHBondContact CG-O 3.32Å; E68-L73 PolarHBondContact O-N 2.79Å; E68-V78 HydrophobicContact CB-CG2 3.84Å; E68-V78 HydrophobicContact CG-CG2 3.95Å; E68-K374 IonicContact OE1-NZ 2.91Å; E68-K374 PolarHBondContact OE1-NZ 3.28Å; E68-K374 WeakPolarHBondContact OE2-CE 3.34Å; E68-K374 IonicContact OE2-NZ 3.58Å; E68-K374 PolarHBondContact OE2-NZ 3.5Å; E68-A613 HydrophobicContact CG-CB 4.2Å
69	R	81.2	Confident	87.5	Confident	92 Å²	92	18.8 Å²	18.8	35%	0.347	9%	0.093	S	C	.	.	H	α-helix	trans	-67.3	-43.6	179.1	-66.3	177.5	-162.4	-166.7	6.8	112.1	T65 T66 L67 F71 P258 E377	T65-R69 WeakPolarHBondContact O-CG 3.27Å; T65-R69 PolarHBondContact O-N 3.24Å; T65-R69 VanDerWaalsContact O-N 3.14Å; T66-R69 PolarHBondContact O-N 3.43Å; L67-R69 PolarHBondContact O-N 3.3Å; R69-F71 VanDerWaalsContact C-N 3.35Å; R69-F71 PolarHBondContact O-N 3.46Å; R69-P258 PolarHBondContact NH1-O 3.37Å; R69-E377 IonicContact CZ-OE2 3.52Å; R69-E377 IonicContact NH2-OE2 3.94Å; R69-E377 PolarHBondContact NH2-OE2 3.31Å
70	R	79.4	Confident	87.4	Confident	47 Å²	47	21 Å²	21	18%	0.177	11%	0.106	C	C	.	.	H	α-helix	trans	-64.9	-37.7	-177.2	179.6	61.8	177.9	116.6	-7.8	112.8	T66 L67 Y133 I261	T66-R70 VanDerWaalsContact O-CB 3.29Å; T66-R70 WeakPolarHBondContact O-CB 3.19Å; T66-R70 PolarHBondContact O-N 2.96Å; L67-R70 PolarHBondContact O-N 2.96Å; R70-Y133 VanDerWaalsContact NH1-CD2 3.3Å; R70-I261 HydrophobicContact CB-CD1 4.03Å; R70-I261 HydrophobicContact CB-CG2 4.22Å; R70-I261 HydrophobicContact CG-CD1 4.38Å
71	F	79.5	Confident	87.3	Confident	9 Å²	9	20.7 Å²	20.7	4%	0.039	11%	0.105	C	C	.	.	H	α-helix	trans	-109.1	4.4	-174.7	-57.7	-55.5	0	0	0	113.9	L67 R69 L73 T173 M176 W264	L67-F71 HydrophobicContact CB-CD2 4.4Å; L67-F71 HydrophobicContact CD2-CD2 4.06Å; L67-F71 HydrophobicContact CD2-CE2 3.59Å; L67-F71 WeakPolarHBondContact O-CB 3.37Å; L67-F71 VanDerWaalsContact O-CD2 3.27Å; L67-F71 WeakPolarHBondContact O-CD2 3.49Å; L67-F71 PolarHBondContact O-N 3.49Å; R69-F71 VanDerWaalsContact C-N 3.35Å; R69-F71 PolarHBondContact O-N 3.46Å; F71-L73 VanDerWaalsContact C-N 3.3Å; F71-L73 HydrophobicContact CB-CD1 3.98Å; F71-L73 HydrophobicContact CB-CD2 4.36Å; F71-L73 HydrophobicContact CB-CG 3.8Å; F71-L73 PolarHBondContact O-N 3.08Å; F71-T173 HydrophobicContact CB-CG2 3.96Å; F71-T173 HydrophobicContact CD1-CG2 4.36Å; F71-T173 VanDerWaalsContact O-CG2 3.31Å; F71-T173 WeakPolarHBondContact O-CG2 3.28Å; F71-M176 HydrophobicContact CB-CE 4.06Å; F71-M176 HydrophobicContact CD1-CE 3.09Å; F71-M176 HydrophobicContact CD1-SD 3.48Å; F71-M176 WeakPolarHBondContact CD1-SD 3.18Å; F71-M176 HydrophobicContact CD2-CE 3.22Å; F71-M176 HydrophobicContact CD2-SD 4.26Å; F71-M176 HydrophobicContact CE1-CE 3.17Å; F71-M176 HydrophobicContact CE1-SD 2.92Å; F71-M176 WeakPolarHBondContact CE1-SD 3.44Å; F71-M176 HydrophobicContact CE2-CE 3.26Å; F71-M176 HydrophobicContact CE2-SD 3.77Å; F71-M176 HydrophobicContact CG-CE 3.12Å; F71-M176 HydrophobicContact CG-SD 4.12Å; F71-M176 HydrophobicContact CZ-CE 3.24Å; F71-M176 HydrophobicContact CZ-SD 3.08Å; F71-M176 WeakPolarHBondContact CZ-SD 3.22Å; F71-W264 HydrophobicContact CE2-CZ2 4.29Å; F71-W264 HydrophobicContact CZ-CZ2 4.11Å
72	N	78.1	Confident	87.1	Confident	32 Å²	32	19.9 Å²	19.9	17%	0.171	10%	0.102	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.8	48.8	178.5	-156.8	28.8	0	0	0	112.4	E68 S605 G612 A613	E68-N72 WeakPolarHBondContact O-CA 3.34Å; E68-N72 PolarHBondContact O-N 2.9Å; N72-S605 VanDerWaalsContact CG-OG 3.24Å; N72-S605 PolarHBondContact ND2-OG 3.27Å; N72-S605 PolarHBondContact OD1-OG 3.18Å; N72-G612 WeakPolarHBondContact O-CA 3.37Å; N72-A613 PolarHBondContact O-N 2.78Å; N72-A613 VanDerWaalsContact OD1-CB 3.27Å; N72-A613 WeakPolarHBondContact OD1-CB 3.19Å; N72-A613 PolarHBondContact OD1-N 2.93Å
73	L	83.5	Confident	87	Confident	10 Å²	10	20 Å²	20	5%	0.052	10%	0.103	C	C	.	.			trans	-92.9	154.1	-176.7	-60.9	174.1	0	0	0	111.1	E68 F71 D77 V78 I81 Y177 A613	E68-L73 WeakPolarHBondContact CG-O 3.32Å; E68-L73 PolarHBondContact O-N 2.79Å; F71-L73 VanDerWaalsContact C-N 3.3Å; F71-L73 HydrophobicContact CB-CD1 3.98Å; F71-L73 HydrophobicContact CB-CD2 4.36Å; F71-L73 HydrophobicContact CB-CG 3.8Å; F71-L73 PolarHBondContact O-N 3.08Å; L73-D77 HydrophobicContact CB-CB 4.17Å; L73-V78 HydrophobicContact CB-CG2 4.1Å; L73-V78 HydrophobicContact CD1-CG2 4.48Å; L73-I81 HydrophobicContact CD1-CD1 4.08Å; L73-Y177 HydrophobicContact CD1-CD2 3.93Å; L73-Y177 HydrophobicContact CD2-CD2 4.25Å; L73-Y177 HydrophobicContact CD2-CG 4.33Å; L73-A613 VanDerWaalsContact O-CA 3.3Å; L73-A613 WeakPolarHBondContact O-CA 3.49Å; L73-A613 VanDerWaalsContact O-CB 3.22Å; L73-A613 WeakPolarHBondContact O-CB 3.45Å
74	Q	87.3	Confident	87	Confident	56 Å²	56	20.1 Å²	20.1	26%	0.262	10%	0.104	S	C	.	.			trans	-76.7	159.3	171	-61.8	-173.9	-20.4	0	0	110.8	A76 D77 V78 W604 G612	Q74-A76 PolarHBondContact O-N 3.04Å; Q74-D77 PolarHBondContact N-OD2 2.98Å; Q74-D77 WeakPolarHBondContact O-CB 3.39Å; Q74-D77 PolarHBondContact O-N 3.32Å; Q74-D77 VanDerWaalsContact O-N 3.14Å; Q74-V78 WeakPolarHBondContact O-CG2 3.07Å; Q74-V78 PolarHBondContact O-N 3.26Å; Q74-V78 VanDerWaalsContact O-N 3.14Å; Q74-W604 HydrophobicContact CG-CZ3 4.06Å; Q74-G612 WeakPolarHBondContact CG-O 3.35Å
75	S	88.3	Confident	87.1	Confident	0 Å²	0	21.7 Å²	21.7	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-60.6	-33.1	176.4	-44.6	0	0	0	0	111.8	V78 G79 K374 G594 D598	S75-V78 PolarHBondContact O-N 2.9Å; S75-G79 PolarHBondContact O-N 3.28Å; S75-K374 PolarHBondContact OG-NZ 3.33Å; S75-G594 WeakPolarHBondContact CB-O 3.38Å; S75-D598 WeakPolarHBondContact CA-OD2 3.26Å; S75-D598 VanDerWaalsContact CB-CG 3.49Å; S75-D598 WeakPolarHBondContact CB-OD1 3.45Å; S75-D598 WeakPolarHBondContact CB-OD2 3.41Å; S75-D598 PolarHBondContact N-OD1 2.63Å; S75-D598 PolarHBondContact N-OD2 3.13Å; S75-D598 PolarHBondContact OG-OD1 3.05Å
76	A	86.8	Confident	87.3	Confident	27 Å²	27	22.3 Å²	22.3	22%	0.223	11%	0.112	C	C	.	.	H	α-helix	trans	-61.9	-45.1	174.8	0	0	0	0	0	112.1	Q74 V78 G79 V80 D598	Q74-A76 PolarHBondContact O-N 3.04Å; A76-V78 VanDerWaalsContact C-N 3.34Å; A76-V78 PolarHBondContact O-N 2.92Å; A76-G79 WeakPolarHBondContact O-CA 3.43Å; A76-G79 PolarHBondContact O-N 2.84Å; A76-G79 VanDerWaalsContact O-N 3.12Å; A76-V80 PolarHBondContact O-N 3.43Å; A76-D598 WeakPolarHBondContact CB-OD2 3.43Å; A76-D598 PolarHBondContact N-OD2 3.3Å
77	D	88.2	Confident	87.4	Confident	49 Å²	49	26.2 Å²	26.2	26%	0.262	13%	0.132	S	C	.	.	H	α-helix	trans	-61.5	-44.3	176.7	-66.3	-40.9	0	0	0	111	L73 Q74 G79 V80 I81 Y177	L73-D77 HydrophobicContact CB-CB 4.17Å; Q74-D77 PolarHBondContact N-OD2 2.98Å; Q74-D77 WeakPolarHBondContact O-CB 3.39Å; Q74-D77 PolarHBondContact O-N 3.32Å; Q74-D77 VanDerWaalsContact O-N 3.14Å; D77-G79 VanDerWaalsContact C-N 3.27Å; D77-G79 PolarHBondContact O-N 3.31Å; D77-V80 WeakPolarHBondContact O-CA 3.35Å; D77-V80 VanDerWaalsContact O-CB 3.31Å; D77-V80 WeakPolarHBondContact O-CB 3.4Å; D77-V80 PolarHBondContact O-N 3.46Å; D77-I81 PolarHBondContact O-N 2.82Å; D77-Y177 HydrophobicContact CB-CE2 3.89Å
78	V	89.1	Confident	87.5	Confident	1 Å²	1	26.3 Å²	26.3	1%	0.006	13%	0.133	C	C	.	.	H	α-helix	trans	-60.8	-38.1	175.2	174.8	0	0	0	0	111.1	L64 E68 L73 Q74 S75 A76 V80 I81 A82 F371	L64-V78 HydrophobicContact CB-CG1 3.52Å; L64-V78 HydrophobicContact CD1-CG1 3.97Å; L64-V78 HydrophobicContact CD2-CG1 3.53Å; L64-V78 HydrophobicContact CG-CG1 3.8Å; E68-V78 HydrophobicContact CB-CG2 3.84Å; E68-V78 HydrophobicContact CG-CG2 3.95Å; L73-V78 HydrophobicContact CB-CG2 4.1Å; L73-V78 HydrophobicContact CD1-CG2 4.48Å; Q74-V78 WeakPolarHBondContact O-CG2 3.07Å; Q74-V78 PolarHBondContact O-N 3.26Å; Q74-V78 VanDerWaalsContact O-N 3.14Å; S75-V78 PolarHBondContact O-N 2.9Å; A76-V78 VanDerWaalsContact C-N 3.34Å; A76-V78 PolarHBondContact O-N 2.92Å; V78-V80 VanDerWaalsContact C-N 3.32Å; V78-V80 PolarHBondContact O-N 3Å; V78-I81 WeakPolarHBondContact O-CB 3.35Å; V78-I81 PolarHBondContact O-N 2.96Å; V78-A82 PolarHBondContact O-N 3.46Å; V78-F371 HydrophobicContact CG1-CE1 4.43Å
79	G	87.6	Confident	87.7	Confident	0 Å²	0	26 Å²	26	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-61.9	-35.2	171.4	0	0	0	0	0	113.6	S75 A76 D77 S83	S75-G79 PolarHBondContact O-N 3.28Å; A76-G79 WeakPolarHBondContact O-CA 3.43Å; A76-G79 PolarHBondContact O-N 2.84Å; A76-G79 VanDerWaalsContact O-N 3.12Å; D77-G79 VanDerWaalsContact C-N 3.27Å; D77-G79 PolarHBondContact O-N 3.31Å; G79-S83 WeakPolarHBondContact O-CB 3.29Å; G79-S83 PolarHBondContact O-N 3.45Å; G79-S83 PolarHBondContact O-OG 3.42Å
80	V	92.2	Very high	87.9	Confident	46 Å²	46	23.2 Å²	23.2	28%	0.279	12%	0.124	S	C	.	.	H	α-helix	trans	-66.1	-43.9	173	175.3	0	0	0	0	110.9	A76 D77 V78 A82 S83 S84 I181 L591	A76-V80 PolarHBondContact O-N 3.43Å; D77-V80 WeakPolarHBondContact O-CA 3.35Å; D77-V80 VanDerWaalsContact O-CB 3.31Å; D77-V80 WeakPolarHBondContact O-CB 3.4Å; D77-V80 PolarHBondContact O-N 3.46Å; V78-V80 VanDerWaalsContact C-N 3.32Å; V78-V80 PolarHBondContact O-N 3Å; V80-A82 PolarHBondContact O-N 3.29Å; V80-S83 PolarHBondContact O-N 3.4Å; V80-S84 WeakPolarHBondContact O-CB 3.46Å; V80-S84 PolarHBondContact O-N 2.87Å; V80-I181 HydrophobicContact CG1-CD1 4.15Å; V80-L591 HydrophobicContact CG2-CD2 4.04Å; V80-L591 HydrophobicContact CG2-CG 4.44Å
81	I	92.3	Very high	88.2	Confident	0 Å²	0	24.7 Å²	24.7	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-56.7	-51.4	175.5	-56.7	172.7	0	0	0	109.9	L60 L73 D77 V78 S83 S84 Y177 L180 I181 Q184	L60-I81 HydrophobicContact CD1-CG2 4.14Å; L73-I81 HydrophobicContact CD1-CD1 4.08Å; D77-I81 PolarHBondContact O-N 2.82Å; V78-I81 WeakPolarHBondContact O-CB 3.35Å; V78-I81 PolarHBondContact O-N 2.96Å; I81-S83 VanDerWaalsContact C-N 3.28Å; I81-S83 PolarHBondContact O-N 2.9Å; I81-S84 PolarHBondContact O-N 3.33Å; I81-S84 PolarHBondContact O-OG 3.49Å; I81-Y177 HydrophobicContact CD1-CD2 3.75Å; I81-Y177 HydrophobicContact CD1-CE2 4Å; I81-Y177 HydrophobicContact CG1-CD2 3.79Å; I81-Y177 HydrophobicContact CG1-CE2 3.63Å; I81-L180 HydrophobicContact CD1-CD1 4.44Å; I81-I181 HydrophobicContact CG1-CG1 4.44Å; I81-Q184 HydrophobicContact CG2-CG 3.97Å
82	A	88.4	Confident	88.5	Confident	19 Å²	19	27.1 Å²	27.1	16%	0.157	16%	0.159	C	C	.	.	H	α-helix	trans	-59.3	-38.6	-179.9	0	0	0	0	0	112.6	L64 V78 V80	L64-A82 HydrophobicContact CD1-CB 4.13Å; V78-A82 PolarHBondContact O-N 3.46Å; V80-A82 PolarHBondContact O-N 3.29Å
83	S	91.4	Very high	88.6	Confident	3 Å²	3	26.2 Å²	26.2	2%	0.021	15%	0.154	C	C	.	.	H	α-helix	trans	-77.8	-23.6	-177.2	-55.6	0	0	0	0	113.6	G79 V80 I81 F85 E86 I87 I587 L591	G79-S83 WeakPolarHBondContact O-CB 3.29Å; G79-S83 PolarHBondContact O-N 3.45Å; G79-S83 PolarHBondContact O-OG 3.42Å; V80-S83 PolarHBondContact O-N 3.4Å; I81-S83 VanDerWaalsContact C-N 3.28Å; I81-S83 PolarHBondContact O-N 2.9Å; S83-F85 VanDerWaalsContact C-N 3.25Å; S83-F85 PolarHBondContact O-N 2.85Å; S83-E86 PolarHBondContact O-N 3.41Å; S83-I87 PolarHBondContact O-N 3.2Å; S83-I587 PolarHBondContact OG-O 2.96Å; S83-L591 VanDerWaalsContact OG-CD1 3.22Å; S83-L591 WeakPolarHBondContact OG-CD1 3.45Å
84	S	93.4	Very high	88.2	Confident	2 Å²	2	31.2 Å²	31.2	1%	0.014	18%	0.18	C	C	.	.	H	α-helix	trans	-64.6	-25.7	-175.5	66.8	0	0	0	0	114.3	V80 I81 E86 I87 G88 Q184	V80-S84 WeakPolarHBondContact O-CB 3.46Å; V80-S84 PolarHBondContact O-N 2.87Å; I81-S84 PolarHBondContact O-N 3.33Å; I81-S84 PolarHBondContact O-OG 3.49Å; S84-E86 VanDerWaalsContact C-N 3.35Å; S84-E86 PolarHBondContact O-N 3.39Å; S84-I87 PolarHBondContact O-N 2.63Å; S84-G88 PolarHBondContact O-N 3.49Å; S84-Q184 WeakPolarHBondContact OG-CB 3.35Å
85	F	92.9	Very high	87.7	Confident	36 Å²	36	34.3 Å²	34.3	16%	0.158	19%	0.193	C	C	.	.	H	α-helix	trans	-57.1	-46.6	168.7	172.4	-94.7	0	0	0	112	S83 I87 G88 N89 Q184 L187 G188 A191	S83-F85 VanDerWaalsContact C-N 3.25Å; S83-F85 PolarHBondContact O-N 2.85Å; F85-I87 VanDerWaalsContact C-N 3.35Å; F85-G88 PolarHBondContact O-N 3.11Å; F85-N89 PolarHBondContact O-N 3.35Å; F85-N89 VanDerWaalsContact O-N 3.12Å; F85-Q184 WeakPolarHBondContact CA-O 3.37Å; F85-L187 HydrophobicContact CD2-CB 3.86Å; F85-L187 HydrophobicContact CE2-CB 4.15Å; F85-G188 WeakPolarHBondContact O-CA 3.43Å; F85-A191 HydrophobicContact CE2-CB 3.87Å; F85-A191 HydrophobicContact CZ-CB 3.67Å
86	E	90.5	Very high	87.3	Confident	25 Å²	25	35 Å²	35	12%	0.117	20%	0.197	C	C	.	.	H	α-helix	trans	-71.8	-32.7	-179.6	-65	-63.2	163.1	0	0	111.9	S83 S84 N89 L90 R582 F586 I587	S83-E86 PolarHBondContact O-N 3.41Å; S84-E86 VanDerWaalsContact C-N 3.35Å; S84-E86 PolarHBondContact O-N 3.39Å; E86-N89 PolarHBondContact O-N 3.48Å; E86-L90 WeakPolarHBondContact O-CB 3.26Å; E86-L90 WeakPolarHBondContact O-CG 3.36Å; E86-L90 PolarHBondContact O-N 2.9Å; E86-R582 WeakPolarHBondContact OE2-CD 3.33Å; E86-R582 WeakPolarHBondContact OE2-CG 3.47Å; E86-R582 IonicContact OE2-NE 3.14Å; E86-R582 PolarHBondContact OE2-NE 3.47Å; E86-F586 HydrophobicContact CG-CB 3.78Å; E86-F586 HydrophobicContact CG-CG 4.47Å; E86-I587 HydrophobicContact CB-CD1 4.07Å; E86-I587 HydrophobicContact CB-CG1 3.7Å
87	I	90.4	Very high	86.6	Confident	89 Å²	89	36.2 Å²	36.2	46%	0.456	20%	0.204	S	C	.	.	H	α-helix	trans	-60	-48	173.5	-61.5	175.3	0	0	0	110.3	S83 S84 F85 N89 L90 A91 I587	S83-I87 PolarHBondContact O-N 3.2Å; S84-I87 PolarHBondContact O-N 2.63Å; F85-I87 VanDerWaalsContact C-N 3.35Å; I87-N89 VanDerWaalsContact C-N 3.31Å; I87-N89 PolarHBondContact O-N 2.64Å; I87-L90 PolarHBondContact O-N 2.93Å; I87-A91 PolarHBondContact O-N 3.21Å; I87-I587 HydrophobicContact CG1-CD1 3.97Å; I87-I587 HydrophobicContact CG1-CG1 4.43Å
88	G	91.1	Very high	85.6	Confident	2 Å²	2	36.9 Å²	36.9	2%	0.021	20%	0.203	C	C	.	.	H	α-helix	trans	-61.2	-39.1	176.7	0	0	0	0	0	113	S84 F85	S84-G88 PolarHBondContact O-N 3.49Å; F85-G88 PolarHBondContact O-N 3.11Å
89	N	89.4	Confident	84.8	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-68.1	-45.5	178.3	-159	-35.2	0	0	0	112.2	F85 E86 I87 A91 L92 I93 G188 T192 R582	F85-N89 PolarHBondContact O-N 3.35Å; F85-N89 VanDerWaalsContact O-N 3.12Å; E86-N89 PolarHBondContact O-N 3.48Å; I87-N89 VanDerWaalsContact C-N 3.31Å; I87-N89 PolarHBondContact O-N 2.64Å; N89-A91 VanDerWaalsContact C-N 3.26Å; N89-A91 PolarHBondContact O-N 3.39Å; N89-L92 PolarHBondContact O-N 3.42Å; N89-I93 WeakPolarHBondContact O-CB 3.15Å; N89-I93 PolarHBondContact O-N 3.27Å; N89-G188 WeakPolarHBondContact CA-O 3.38Å; N89-T192 WeakPolarHBondContact CA-OG1 3.39Å; N89-T192 PolarHBondContact O-OG1 3.23Å; N89-T192 PolarHBondContact OD1-OG1 2.8Å; N89-R582 VanDerWaalsContact CG-CZ 3.48Å; N89-R582 VanDerWaalsContact CG-NH1 3.31Å; N89-R582 VanDerWaalsContact ND2-CZ 3.28Å; N89-R582 PolarHBondContact ND2-NH2 3.44Å; N89-R582 PolarHBondContact OD1-NH1 2.96Å
90	L	87	Confident	84	Confident	35 Å²	35	41 Å²	41	18%	0.183	22%	0.222	C	C	.	.	H	α-helix	trans	-59.5	-35.5	178.3	-79.5	179.2	0	0	0	112.8	E86 I87 L92 L579 R582 L583 I587	E86-L90 WeakPolarHBondContact O-CB 3.26Å; E86-L90 WeakPolarHBondContact O-CG 3.36Å; E86-L90 PolarHBondContact O-N 2.9Å; I87-L90 PolarHBondContact O-N 2.93Å; L90-L92 PolarHBondContact O-N 3.03Å; L90-L579 HydrophobicContact CD2-CD1 3.72Å; L90-R582 HydrophobicContact CD1-CB 4.42Å; L90-R582 HydrophobicContact CD2-CB 3.73Å; L90-R582 HydrophobicContact CG-CB 4.08Å; L90-L583 HydrophobicContact CD1-CB 4.39Å; L90-L583 HydrophobicContact CD1-CD1 4.12Å; L90-I587 HydrophobicContact CD1-CD1 3.35Å; L90-I587 HydrophobicContact CG-CD1 4.5Å
91	A	84.9	Confident	82.9	Confident	77 Å²	77	40 Å²	40	64%	0.636	22%	0.219	S	C	*	.	H	α-helix	trans	-60.3	-31.7	-178.8	0	0	0	0	0	113.1	I87 N89	I87-A91 PolarHBondContact O-N 3.21Å; N89-A91 VanDerWaalsContact C-N 3.26Å; N89-A91 PolarHBondContact O-N 3.39Å
92	L	85.1	Confident	81.9	Confident	60 Å²	60	47 Å²	47	31%	0.314	25%	0.246	S	C	.	.	H	α-helix	trans	-116.9	-11.6	-173.5	-68	179.8	0	0	0	114.9	N89 L90 L94 F95 V96 I189 T192	N89-L92 PolarHBondContact O-N 3.42Å; L90-L92 PolarHBondContact O-N 3.03Å; L92-L94 VanDerWaalsContact C-N 3.33Å; L92-L94 PolarHBondContact O-N 3.4Å; L92-F95 PolarHBondContact O-N 3.46Å; L92-F95 VanDerWaalsContact O-N 3.12Å; L92-V96 HydrophobicContact CB-CG2 4.24Å; L92-V96 WeakPolarHBondContact O-CB 3.42Å; L92-V96 WeakPolarHBondContact O-CG2 3.28Å; L92-V96 PolarHBondContact O-N 2.94Å; L92-I189 HydrophobicContact CD1-CB 4.09Å; L92-I189 HydrophobicContact CD1-CG1 3.84Å; L92-I189 HydrophobicContact CD1-CG2 3.53Å; L92-T192 HydrophobicContact CB-CG2 4Å
93	I	80.6	Confident	81.6	Confident	14 Å²	14	47.6 Å²	47.6	7%	0.072	25%	0.253	C	S	.	.	H	α-helix	trans	-56.6	-42.7	-173.9	-161.3	-165.2	0	0	0	113.4	N89 S97 T192 L579	N89-I93 WeakPolarHBondContact O-CB 3.15Å; N89-I93 PolarHBondContact O-N 3.27Å; I93-S97 WeakPolarHBondContact O-CB 3.31Å; I93-S97 PolarHBondContact O-N 2.99Å; I93-S97 PolarHBondContact O-OG 3.28Å; I93-T192 HydrophobicContact CB-CG2 4.08Å; I93-T192 HydrophobicContact CG1-CG2 4.41Å; I93-L579 HydrophobicContact CG2-CD1 4.08Å
94	L	74.1	Confident	81.4	Confident	114 Å²	114	49.3 Å²	49.3	60%	0.597	26%	0.261	S	S	*	.	H	α-helix	trans	-67.7	-41.8	179.6	-65.4	178.7	0	0	0	111.3	L92 Y98	L92-L94 VanDerWaalsContact C-N 3.33Å; L92-L94 PolarHBondContact O-N 3.4Å; L94-Y98 PolarHBondContact O-N 3.13Å
95	F	77.9	Confident	81.2	Confident	121 Å²	121	50.2 Å²	50.2	53%	0.531	26%	0.264	S	S	.	.	H	α-helix	trans	-65	-50.5	179.4	-176.9	-93.3	0	0	0	111.1	L92 Y98 F99	L92-F95 PolarHBondContact O-N 3.46Å; L92-F95 VanDerWaalsContact O-N 3.12Å; F95-Y98 PolarHBondContact O-N 3.19Å; F95-F99 HydrophobicContact CD1-CD2 4.29Å; F95-F99 AromaticContact CD2-CD2 3.41Å; F95-F99 HydrophobicContact CD2-CD2 3.41Å; F95-F99 VanDerWaalsContact CD2-CD2 3.41Å; F95-F99 AromaticContact CD2-CE2 3.56Å; F95-F99 HydrophobicContact CD2-CE2 3.56Å; F95-F99 HydrophobicContact CE1-CB 4.49Å; F95-F99 HydrophobicContact CE1-CD2 4.21Å; F95-F99 AromaticContact CE2-CD2 3.31Å; F95-F99 HydrophobicContact CE2-CD2 3.31Å; F95-F99 AromaticContact CE2-CE2 3.42Å; F95-F99 HydrophobicContact CE2-CE2 3.42Å; F95-F99 VanDerWaalsContact CE2-CE2 3.42Å; F95-F99 HydrophobicContact CE2-CG 4.22Å; F95-F99 HydrophobicContact CE2-CZ 4.38Å; F95-F99 AromaticContact CG-CD2 3.92Å; F95-F99 HydrophobicContact CG-CD2 3.92Å; F95-F99 HydrophobicContact CG-CE2 4.46Å; F95-F99 AromaticContact CZ-CD2 3.74Å; F95-F99 HydrophobicContact CZ-CD2 3.74Å; F95-F99 HydrophobicContact CZ-CE2 4.23Å; F95-F99 HydrophobicContact CZ-CG 4.24Å; F95-F99 WeakPolarHBondContact O-CB 3.3Å; F95-F99 WeakPolarHBondContact O-CD2 3.35Å; F95-F99 PolarHBondContact O-N 3.41Å
96	V	80.1	Confident	81.1	Confident	15 Å²	15	48.5 Å²	48.5	9%	0.091	26%	0.257	C	S	.	.	H	α-helix	trans	-67.1	-39	-178.7	173.5	0	0	0	0	111.7	L92 Y98 G100 L108 T192 P193 L197	L92-V96 HydrophobicContact CB-CG2 4.24Å; L92-V96 WeakPolarHBondContact O-CB 3.42Å; L92-V96 WeakPolarHBondContact O-CG2 3.28Å; L92-V96 PolarHBondContact O-N 2.94Å; V96-Y98 VanDerWaalsContact C-N 3.28Å; V96-Y98 PolarHBondContact O-N 3.29Å; V96-G100 WeakPolarHBondContact O-CA 3.21Å; V96-G100 PolarHBondContact O-N 3.41Å; V96-L108 HydrophobicContact CG1-CD2 4.45Å; V96-T192 HydrophobicContact CB-CG2 3.86Å; V96-T192 HydrophobicContact CG1-CG2 4.29Å; V96-T192 HydrophobicContact CG2-CG2 3.83Å; V96-P193 HydrophobicContact CG1-CB 3.69Å; V96-L197 HydrophobicContact CG1-CD1 4.08Å; V96-L197 HydrophobicContact CG1-CG 4.44Å
97	S	71.4	Confident	81.3	Confident	53 Å²	53	53.7 Å²	53.7	37%	0.371	28%	0.275	S	S	.	.	H	α-helix	trans	-63.8	-34.7	178.2	-61.3	0	0	0	0	112.2	I93 A101	I93-S97 WeakPolarHBondContact O-CB 3.31Å; I93-S97 PolarHBondContact O-N 2.99Å; I93-S97 PolarHBondContact O-OG 3.28Å; S97-A101 WeakPolarHBondContact O-CB 3.47Å
98	Y	68.3	Low	81.3	Confident	63 Å²	63	52.4 Å²	52.4	25%	0.247	27%	0.269	C	S	.	.	H	α-helix	trans	-84.3	-54.4	-179.9	-176	-102.6	0	0	0	112.9	L94 F95 V96 R102 Q334	L94-Y98 PolarHBondContact O-N 3.13Å; F95-Y98 PolarHBondContact O-N 3.19Å; V96-Y98 VanDerWaalsContact C-N 3.28Å; V96-Y98 PolarHBondContact O-N 3.29Å; Y98-R102 PolarHBondContact OH-NH1 2.92Å; Y98-R102 PolarHBondContact OH-NH2 2.72Å; Y98-Q334 PolarHBondContact OH-NE2 3.03Å; Y98-Q334 PolarHBondContact OH-OE1 2.83Å
99	F	71.7	Confident	81.5	Confident	83 Å²	83	52.3 Å²	52.3	36%	0.364	27%	0.268	S	S	.	.	H	α-helix	trans	-81.5	-36.7	-175.6	-68.4	-72.8	0	0	0	112.5	F95 A101 R102 G103	F95-F99 HydrophobicContact CD1-CD2 4.29Å; F95-F99 AromaticContact CD2-CD2 3.41Å; F95-F99 HydrophobicContact CD2-CD2 3.41Å; F95-F99 VanDerWaalsContact CD2-CD2 3.41Å; F95-F99 AromaticContact CD2-CE2 3.56Å; F95-F99 HydrophobicContact CD2-CE2 3.56Å; F95-F99 HydrophobicContact CE1-CB 4.49Å; F95-F99 HydrophobicContact CE1-CD2 4.21Å; F95-F99 AromaticContact CE2-CD2 3.31Å; F95-F99 HydrophobicContact CE2-CD2 3.31Å; F95-F99 AromaticContact CE2-CE2 3.42Å; F95-F99 HydrophobicContact CE2-CE2 3.42Å; F95-F99 VanDerWaalsContact CE2-CE2 3.42Å; F95-F99 HydrophobicContact CE2-CG 4.22Å; F95-F99 HydrophobicContact CE2-CZ 4.38Å; F95-F99 AromaticContact CG-CD2 3.92Å; F95-F99 HydrophobicContact CG-CD2 3.92Å; F95-F99 HydrophobicContact CG-CE2 4.46Å; F95-F99 AromaticContact CZ-CD2 3.74Å; F95-F99 HydrophobicContact CZ-CD2 3.74Å; F95-F99 HydrophobicContact CZ-CE2 4.23Å; F95-F99 HydrophobicContact CZ-CG 4.24Å; F95-F99 WeakPolarHBondContact O-CB 3.3Å; F95-F99 WeakPolarHBondContact O-CD2 3.35Å; F95-F99 PolarHBondContact O-N 3.41Å; F99-A101 VanDerWaalsContact C-N 3.29Å; F99-A101 PolarHBondContact O-N 3.17Å; F99-R102 PolarHBondContact O-N 2.91Å; F99-G103 PolarHBondContact O-N 3Å
100	G	71.4	Confident	81.8	Confident	4 Å²	4	52.3 Å²	52.3	4%	0.041	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-65	-32.1	-179.3	0	0	0	0	0	113.1	V96 R102 G103	V96-G100 WeakPolarHBondContact O-CA 3.21Å; V96-G100 PolarHBondContact O-N 3.41Å; G100-R102 PolarHBondContact O-N 3.36Å; G100-G103 PolarHBondContact O-N 2.87Å; G100-G103 VanDerWaalsContact O-N 3.16Å
101	A	67.5	Low	82.2	Confident	26 Å²	26	53.4 Å²	53.4	22%	0.215	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-63.8	-25.2	176.5	0	0	0	0	0	113.6	S97 F99 R105	S97-A101 WeakPolarHBondContact O-CB 3.47Å; F99-A101 VanDerWaalsContact C-N 3.29Å; F99-A101 PolarHBondContact O-N 3.17Å; A101-R105 PolarHBondContact O-NE 2.93Å; A101-R105 PolarHBondContact O-NH2 3.44Å
102	R	72.9	Confident	82.7	Confident	146 Å²	146	50 Å²	50	55%	0.551	25%	0.25	S	S	*	.	G	3₁₀ helix	trans	-92.2	-14.8	177.7	-61.4	-175.4	-177.9	172.6	4.8	113.4	Y98 F99 G100	Y98-R102 PolarHBondContact OH-NH1 2.92Å; Y98-R102 PolarHBondContact OH-NH2 2.72Å; F99-R102 PolarHBondContact O-N 2.91Å; G100-R102 PolarHBondContact O-N 3.36Å
103	G	81.1	Confident	83.2	Confident	31 Å²	31	47.1 Å²	47.1	32%	0.32	24%	0.235	S	C	.	.	S	Bend	trans	-87.2	-167.9	179.5	0	0	0	0	0	113.6	F99 G100 R105	F99-G103 PolarHBondContact O-N 3Å; G100-G103 PolarHBondContact O-N 2.87Å; G100-G103 VanDerWaalsContact O-N 3.16Å; G103-R105 PolarHBondContact O-N 3.31Å
104	H	87.8	Confident	84	Confident	40 Å²	40	49 Å²	49	19%	0.185	25%	0.245	C	C	.	.			trans	-80.3	82.7	173.6	-167.7	-49.7	0	0	0	110.4	R107 L108 F285 Q287	H104-R107 HydrophobicContact CB-CB 4.38Å; H104-R107 WeakPolarHBondContact ND1-CG 3.34Å; H104-R107 PolarHBondContact NE2-NE 3.33Å; H104-R107 PolarHBondContact O-N 3.48Å; H104-L108 PolarHBondContact O-N 3.11Å; H104-L108 VanDerWaalsContact O-N 3.14Å; H104-F285 PolarHBondContact CE1-O 3.49Å; H104-Q287 PolarHBondContact CE1-N 3.3Å; H104-Q287 PolarHBondContact NE2-N 2.71Å; H104-Q287 VanDerWaalsContact NE2-N 3.19Å
105	R	88.7	Confident	85.1	Confident	21 Å²	21	45.6 Å²	45.6	8%	0.079	23%	0.228	C	C	.	.	H	α-helix	trans	-47.6	-51.2	-169.3	-56.7	-177.1	-166.1	162.6	7.4	114.8	A101 G103 R107 L108 I109 L197 S200 Y201 D204	A101-R105 PolarHBondContact O-NE 2.93Å; A101-R105 PolarHBondContact O-NH2 3.44Å; G103-R105 PolarHBondContact O-N 3.31Å; R105-R107 VanDerWaalsContact C-N 3.33Å; R105-R107 PolarHBondContact O-N 3.24Å; R105-L108 PolarHBondContact O-N 3.29Å; R105-L108 VanDerWaalsContact O-N 3.1Å; R105-I109 WeakPolarHBondContact O-CG1 3.46Å; R105-I109 PolarHBondContact O-N 3.01Å; R105-L197 HydrophobicContact CB-CB 4.29Å; R105-S200 PolarHBondContact NH1-O 3.37Å; R105-S200 VanDerWaalsContact NH1-O 3.15Å; R105-S200 PolarHBondContact NH1-OG 2.98Å; R105-Y201 HydrophobicContact CB-CD2 4.21Å; R105-D204 IonicContact CZ-OD2 3.65Å; R105-D204 IonicContact NH1-OD2 2.89Å; R105-D204 PolarHBondContact NH1-OD2 3.46Å; R105-D204 IonicContact NH2-OD2 3.99Å; R105-D204 PolarHBondContact NH2-OD2 3.23Å
106	P	91.5	Very high	86	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-59.3	-39.4	179.6	-26.6	36.2	0	0	0	114	F42 L108 I109 G110 Y201 M282 F285	F42-P106 HydrophobicContact CE2-CB 4.1Å; F42-P106 HydrophobicContact CE2-CG 3.98Å; P106-L108 VanDerWaalsContact C-N 3.34Å; P106-L108 PolarHBondContact O-N 3.1Å; P106-I109 WeakPolarHBondContact O-CB 3.45Å; P106-I109 PolarHBondContact O-N 3.42Å; P106-G110 PolarHBondContact O-N 3.06Å; P106-Y201 HydrophobicContact CG-CD2 3.89Å; P106-Y201 HydrophobicContact CG-CE1 4.35Å; P106-Y201 HydrophobicContact CG-CE2 3.5Å; P106-Y201 HydrophobicContact CG-CG 4.44Å; P106-M282 WeakPolarHBondContact O-CB 3.19Å; P106-F285 HydrophobicContact CB-CB 3.82Å; P106-F285 HydrophobicContact CG-CB 4.02Å
107	R	93.2	Very high	86.9	Confident	133 Å²	133	39.2 Å²	39.2	50%	0.502	20%	0.2	S	C	.	.	H	α-helix	trans	-68.1	-36.1	177.6	-71.8	179	-173.7	178.7	1.7	111.8	H104 R105 G110 C111 F283	H104-R107 HydrophobicContact CB-CB 4.38Å; H104-R107 WeakPolarHBondContact ND1-CG 3.34Å; H104-R107 PolarHBondContact NE2-NE 3.33Å; H104-R107 PolarHBondContact O-N 3.48Å; R105-R107 VanDerWaalsContact C-N 3.33Å; R105-R107 PolarHBondContact O-N 3.24Å; R107-G110 PolarHBondContact O-N 3.48Å; R107-C111 PolarHBondContact O-N 3.2Å; R107-C111 PolarHBondContact O-SG 3.42Å; R107-F283 HydrophobicContact CB-CD1 4.45Å; R107-F283 HydrophobicContact CG-CD1 4.15Å
108	L	92.3	Very high	88.1	Confident	62 Å²	62	41.3 Å²	41.3	33%	0.325	21%	0.206	S	C	.	.	H	α-helix	trans	-68.5	-37.5	177	-168.6	60.6	0	0	0	111.6	V96 H104 R105 P106 C111 G112 P193 L197	V96-L108 HydrophobicContact CG1-CD2 4.45Å; H104-L108 PolarHBondContact O-N 3.11Å; H104-L108 VanDerWaalsContact O-N 3.14Å; R105-L108 PolarHBondContact O-N 3.29Å; R105-L108 VanDerWaalsContact O-N 3.1Å; P106-L108 VanDerWaalsContact C-N 3.34Å; P106-L108 PolarHBondContact O-N 3.1Å; L108-C111 PolarHBondContact O-N 3.14Å; L108-G112 PolarHBondContact O-N 3.43Å; L108-P193 HydrophobicContact CG-CB 4.21Å; L108-L197 HydrophobicContact CB-CD1 4.07Å; L108-L197 HydrophobicContact CD2-CD1 3.53Å; L108-L197 HydrophobicContact CG-CD1 3.94Å
109	I	94.1	Very high	89.5	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-60.3	-47	169.7	-64.4	167.9	0	0	0	110.2	F42 E46 L49 R105 P106 G112 G113 V194 L197 M282	F42-I109 HydrophobicContact CZ-CD1 4.15Å; E46-I109 WeakPolarHBondContact OE2-CG2 3.48Å; L49-I109 HydrophobicContact CD2-CG2 3.47Å; L49-I109 VanDerWaalsContact CD2-CG2 3.47Å; R105-I109 WeakPolarHBondContact O-CG1 3.46Å; R105-I109 PolarHBondContact O-N 3.01Å; P106-I109 WeakPolarHBondContact O-CB 3.45Å; P106-I109 PolarHBondContact O-N 3.42Å; I109-G112 PolarHBondContact O-N 2.83Å; I109-G113 PolarHBondContact O-N 3.12Å; I109-V194 HydrophobicContact CG2-CG2 4.43Å; I109-L197 HydrophobicContact CD1-CB 3.91Å; I109-L197 HydrophobicContact CG1-CB 3.82Å; I109-L197 HydrophobicContact CG1-CD1 4.48Å; I109-M282 HydrophobicContact CG2-CG 4.03Å; I109-M282 HydrophobicContact CG2-SD 4.26Å
110	G	95.3	Very high	90.7	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-59.7	-45.3	175	0	0	0	0	0	113.1	P106 R107 G112 G113 I114 S279	P106-G110 PolarHBondContact O-N 3.06Å; R107-G110 PolarHBondContact O-N 3.48Å; G110-G112 VanDerWaalsContact C-N 3.31Å; G110-G112 PolarHBondContact O-N 3.02Å; G110-G113 PolarHBondContact O-N 2.71Å; G110-G113 VanDerWaalsContact O-N 3.15Å; G110-I114 PolarHBondContact O-N 3.4Å; G110-S279 VanDerWaalsContact C-OG 3.29Å; G110-S279 VanDerWaalsContact CA-OG 3.29Å; G110-S279 WeakPolarHBondContact CA-OG 3.41Å; G110-S279 PolarHBondContact O-OG 3.3Å
111	C	95.6	Very high	91.8	Very high	59 Å²	59	37.9 Å²	37.9	40%	0.399	20%	0.195	S	C	.	.	H	α-helix	trans	-57.8	-45	173.4	-69.5	0	0	0	0	111.4	R107 L108 G113 I114 V115	R107-C111 PolarHBondContact O-N 3.2Å; R107-C111 PolarHBondContact O-SG 3.42Å; L108-C111 PolarHBondContact O-N 3.14Å; C111-G113 PolarHBondContact O-N 3.21Å; C111-I114 PolarHBondContact O-N 3.06Å; C111-V115 WeakPolarHBondContact O-CG2 3.36Å; C111-V115 PolarHBondContact O-N 2.84Å
112	G	95.4	Very high	93.1	Very high	5 Å²	5	39.3 Å²	39.3	5%	0.052	20%	0.199	C	C	.	.	H	α-helix	trans	-58.2	-44.9	173.8	0	0	0	0	0	112.9	L108 I109 G110 I114 V115 M116 G190	L108-G112 PolarHBondContact O-N 3.43Å; I109-G112 PolarHBondContact O-N 2.83Å; G110-G112 VanDerWaalsContact C-N 3.31Å; G110-G112 PolarHBondContact O-N 3.02Å; G112-I114 PolarHBondContact O-N 2.7Å; G112-V115 PolarHBondContact O-N 2.68Å; G112-M116 WeakPolarHBondContact O-CG 3.37Å; G112-M116 PolarHBondContact O-N 3.44Å; G112-G190 CarbonylContact C-O 3.53Å; G112-G190 VanDerWaalsContact C-O 3.24Å; G112-G190 WeakPolarHBondContact CA-O 3.47Å; G112-G190 CarbonylContact O-C 3.25Å; G112-G190 WeakPolarHBondContact O-CA 3.35Å
113	G	96.5	Very high	94.1	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-61.9	-37.8	176.5	0	0	0	0	0	114.3	I109 G110 C111 M116 A117	I109-G113 PolarHBondContact O-N 3.12Å; G110-G113 PolarHBondContact O-N 2.71Å; G110-G113 VanDerWaalsContact O-N 3.15Å; C111-G113 PolarHBondContact O-N 3.21Å; G113-M116 PolarHBondContact O-N 3.3Å; G113-A117 PolarHBondContact O-N 3.43Å
114	I	97.8	Very high	94.7	Very high	54 Å²	54	30.9 Å²	30.9	28%	0.277	16%	0.157	S	C	.	.	H	α-helix	trans	-67	-42.6	173.7	-68.7	172.6	0	0	0	110.3	G110 C111 G112 M116 A117 L118 S279 F283	G110-I114 PolarHBondContact O-N 3.4Å; C111-I114 PolarHBondContact O-N 3.06Å; G112-I114 PolarHBondContact O-N 2.7Å; I114-M116 VanDerWaalsContact C-N 3.31Å; I114-M116 PolarHBondContact O-N 3.22Å; I114-A117 WeakPolarHBondContact O-CB 3.39Å; I114-A117 PolarHBondContact O-N 3.39Å; I114-A117 VanDerWaalsContact O-N 3.16Å; I114-L118 HydrophobicContact CG2-CD1 4.34Å; I114-L118 WeakPolarHBondContact O-CG 3.28Å; I114-L118 PolarHBondContact O-N 3.04Å; I114-S279 PolarHBondContact N-OG 3.28Å; I114-F283 HydrophobicContact CD1-CE2 3.55Å; I114-F283 HydrophobicContact CD1-CZ 3.67Å; I114-F283 HydrophobicContact CG1-CE2 4.3Å
115	V	97.3	Very high	94.7	Very high	41 Å²	41	32 Å²	32	25%	0.248	16%	0.164	C	C	.	.	H	α-helix	trans	-62.1	-40.3	176.5	174.4	0	0	0	0	111	C111 G112 L118 G119 L186 I189	C111-V115 WeakPolarHBondContact O-CG2 3.36Å; C111-V115 PolarHBondContact O-N 2.84Å; G112-V115 PolarHBondContact O-N 2.68Å; V115-L118 PolarHBondContact O-N 3.37Å; V115-G119 PolarHBondContact O-N 2.97Å; V115-L186 HydrophobicContact CG1-CD1 3.52Å; V115-L186 HydrophobicContact CG1-CG 3.78Å; V115-I189 HydrophobicContact CG1-CG2 4.15Å
116	M	97.1	Very high	94.5	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-61.3	-44.9	172	-70.1	-167.4	-72.4	0	0	112	L49 Q53 G112 G113 I114 L118 G119 A120 L187 A191 V194 L275	L49-M116 HydrophobicContact CD1-CE 3.99Å; L49-M116 HydrophobicContact CG-CE 4.36Å; Q53-M116 HydrophobicContact CB-CE 4.47Å; Q53-M116 HydrophobicContact CB-SD 4.23Å; Q53-M116 HydrophobicContact CG-SD 3.85Å; G112-M116 WeakPolarHBondContact O-CG 3.37Å; G112-M116 PolarHBondContact O-N 3.44Å; G113-M116 PolarHBondContact O-N 3.3Å; I114-M116 VanDerWaalsContact C-N 3.31Å; I114-M116 PolarHBondContact O-N 3.22Å; M116-L118 VanDerWaalsContact C-N 3.29Å; M116-L118 PolarHBondContact O-N 2.8Å; M116-G119 PolarHBondContact O-N 3.21Å; M116-G119 VanDerWaalsContact O-N 3.14Å; M116-A120 PolarHBondContact O-N 3.15Å; M116-L187 HydrophobicContact CB-CD2 3.97Å; M116-L187 HydrophobicContact CG-CD2 4.42Å; M116-L187 WeakPolarHBondContact O-CD2 3.48Å; M116-A191 HydrophobicContact CG-CB 4.47Å; M116-A191 VanDerWaalsContact SD-CA 3.52Å; M116-A191 HydrophobicContact SD-CB 3.7Å; M116-V194 HydrophobicContact CE-CG2 3.58Å; M116-L275 HydrophobicContact CB-CD1 4Å; M116-L275 HydrophobicContact CB-CD2 4.2Å; M116-L275 HydrophobicContact CE-CD2 3.89Å; M116-L275 HydrophobicContact SD-CD2 4.27Å
117	A	97.7	Very high	94.1	Very high	3 Å²	3	31.3 Å²	31.3	3%	0.025	16%	0.162	C	C	.	.	H	α-helix	trans	-59.4	-41.9	177.7	0	0	0	0	0	111.7	G113 I114 A120 L121 G272 L275 F276	G113-A117 PolarHBondContact O-N 3.43Å; I114-A117 WeakPolarHBondContact O-CB 3.39Å; I114-A117 PolarHBondContact O-N 3.39Å; I114-A117 VanDerWaalsContact O-N 3.16Å; A117-A120 PolarHBondContact O-N 3.34Å; A117-L121 WeakPolarHBondContact O-CG 3.44Å; A117-L121 PolarHBondContact O-N 2.96Å; A117-G272 WeakPolarHBondContact CB-O 3.43Å; A117-L275 HydrophobicContact CB-CB 3.93Å; A117-F276 HydrophobicContact CB-CB 3.94Å
118	L	97.3	Very high	93.6	Very high	96 Å²	96	29.7 Å²	29.7	50%	0.503	16%	0.159	S	C	.	.	H	α-helix	trans	-63	-42.1	174	-68.7	172.7	0	0	0	112	I114 V115 M116 L121 L122 L186	I114-L118 HydrophobicContact CG2-CD1 4.34Å; I114-L118 WeakPolarHBondContact O-CG 3.28Å; I114-L118 PolarHBondContact O-N 3.04Å; V115-L118 PolarHBondContact O-N 3.37Å; M116-L118 VanDerWaalsContact C-N 3.29Å; M116-L118 PolarHBondContact O-N 2.8Å; L118-L121 PolarHBondContact O-N 3.33Å; L118-L122 VanDerWaalsContact O-CB 3.29Å; L118-L122 WeakPolarHBondContact O-CB 3.33Å; L118-L122 PolarHBondContact O-N 3.21Å; L118-L186 HydrophobicContact CB-CD2 4.28Å
119	G	97	Very high	92.8	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-64.2	-37.5	175.1	0	0	0	0	0	113.1	V115 M116 L122 S123	V115-G119 PolarHBondContact O-N 2.97Å; M116-G119 PolarHBondContact O-N 3.21Å; M116-G119 VanDerWaalsContact O-N 3.14Å; G119-L122 PolarHBondContact O-N 3.35Å; G119-S123 PolarHBondContact O-N 3.19Å; G119-S123 PolarHBondContact O-OG 2.9Å
120	A	96.8	Very high	91.4	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-64.9	-45.1	173.4	0	0	0	0	0	111.6	V56 M116 A117 L122 S123 A124 L187 L275	V56-A120 HydrophobicContact CG2-CB 4.25Å; M116-A120 PolarHBondContact O-N 3.15Å; A117-A120 PolarHBondContact O-N 3.34Å; A120-L122 VanDerWaalsContact C-N 3.32Å; A120-L122 PolarHBondContact O-N 3.36Å; A120-S123 WeakPolarHBondContact O-CB 3.26Å; A120-S123 PolarHBondContact O-N 3.33Å; A120-S123 VanDerWaalsContact O-N 3.12Å; A120-A124 PolarHBondContact O-N 3.25Å; A120-L187 HydrophobicContact CB-CD2 4.32Å; A120-L275 HydrophobicContact CB-CD1 4.19Å
121	L	95.3	Very high	89.5	Confident	79 Å²	79	41.6 Å²	41.6	41%	0.414	22%	0.218	S	C	.	.	H	α-helix	trans	-62.9	-39.6	174.8	-67.6	174.6	0	0	0	111.9	A117 L118 S123 A124 L125 L269	A117-L121 WeakPolarHBondContact O-CG 3.44Å; A117-L121 PolarHBondContact O-N 2.96Å; L118-L121 PolarHBondContact O-N 3.33Å; L121-S123 VanDerWaalsContact C-N 3.25Å; L121-S123 PolarHBondContact O-N 3.36Å; L121-A124 PolarHBondContact O-N 3.46Å; L121-A124 VanDerWaalsContact O-N 3.12Å; L121-L125 PolarHBondContact O-N 3.4Å; L121-L125 VanDerWaalsContact O-N 3.09Å; L121-L269 HydrophobicContact CD2-CD2 3.72Å
122	L	94.6	Very high	87.5	Confident	56 Å²	56	43.6 Å²	43.6	29%	0.293	22%	0.221	S	C	.	.	H	α-helix	trans	-64.8	-32.4	175.2	-168.9	62	0	0	0	111.4	L118 G119 A120 A124 L125 P126 L179 A183	L118-L122 VanDerWaalsContact O-CB 3.29Å; L118-L122 WeakPolarHBondContact O-CB 3.33Å; L118-L122 PolarHBondContact O-N 3.21Å; G119-L122 PolarHBondContact O-N 3.35Å; A120-L122 VanDerWaalsContact C-N 3.32Å; A120-L122 PolarHBondContact O-N 3.36Å; L122-A124 VanDerWaalsContact C-N 3.28Å; L122-A124 PolarHBondContact O-N 3.16Å; L122-L125 HydrophobicContact CD1-CB 4.32Å; L122-L125 HydrophobicContact CD1-CD2 3.58Å; L122-L125 WeakPolarHBondContact O-CB 3.34Å; L122-L125 PolarHBondContact O-N 3.08Å; L122-P126 WeakPolarHBondContact O-CD 3.38Å; L122-L179 HydrophobicContact CD1-CD2 3.83Å; L122-L179 HydrophobicContact CD1-CG 4.3Å; L122-L179 HydrophobicContact CG-CD2 3.77Å; L122-L179 WeakPolarHBondContact O-CD2 3.36Å; L122-A183 HydrophobicContact CB-CB 3.92Å; L122-A183 HydrophobicContact CD2-CB 4.06Å; L122-A183 HydrophobicContact CG-CB 3.9Å
123	S	94.3	Very high	85.3	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-66	-30.1	173.8	-56.1	0	0	0	0	112.3	G119 A120 L121 P126 A183 W264	G119-S123 PolarHBondContact O-N 3.19Å; G119-S123 PolarHBondContact O-OG 2.9Å; A120-S123 WeakPolarHBondContact O-CB 3.26Å; A120-S123 PolarHBondContact O-N 3.33Å; A120-S123 VanDerWaalsContact O-N 3.12Å; L121-S123 VanDerWaalsContact C-N 3.25Å; L121-S123 PolarHBondContact O-N 3.36Å; S123-P126 WeakPolarHBondContact O-CD 3.4Å; S123-A183 WeakPolarHBondContact OG-CB 3.41Å; S123-W264 VanDerWaalsContact O-CZ3 3.24Å; S123-W264 WeakPolarHBondContact O-CZ3 3.09Å
124	A	92.4	Very high	82.7	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-82.3	-21.9	175.1	0	0	0	0	0	113.5	A120 L121 L122 E127 F128 W265 F268 L269	A120-A124 PolarHBondContact O-N 3.25Å; L121-A124 PolarHBondContact O-N 3.46Å; L121-A124 VanDerWaalsContact O-N 3.12Å; L122-A124 VanDerWaalsContact C-N 3.28Å; L122-A124 PolarHBondContact O-N 3.16Å; A124-E127 PolarHBondContact O-N 3Å; A124-F128 HydrophobicContact CB-CE2 4.35Å; A124-F128 WeakPolarHBondContact O-CD2 2.94Å; A124-W265 HydrophobicContact CB-CB 4.29Å; A124-F268 HydrophobicContact CB-CB 3.96Å; A124-L269 HydrophobicContact CB-CD2 3.69Å; A124-L269 HydrophobicContact CB-CG 4.06Å
125	L	88.8	Confident	80.1	Confident	63 Å²	63	55.6 Å²	55.6	33%	0.33	27%	0.267	S	S	.	.	H	α-helix	trans	-55.1	-37.8	-174.1	-173.3	62.4	0	0	0	115.1	L121 L122 E127 F128 L129 L179	L121-L125 PolarHBondContact O-N 3.4Å; L121-L125 VanDerWaalsContact O-N 3.09Å; L122-L125 HydrophobicContact CD1-CB 4.32Å; L122-L125 HydrophobicContact CD1-CD2 3.58Å; L122-L125 WeakPolarHBondContact O-CB 3.34Å; L122-L125 PolarHBondContact O-N 3.08Å; L125-E127 VanDerWaalsContact C-N 3.28Å; L125-E127 PolarHBondContact O-N 2.89Å; L125-F128 PolarHBondContact O-N 3.39Å; L125-F128 VanDerWaalsContact O-N 3.09Å; L125-L129 HydrophobicContact CD1-CD1 4.27Å; L125-L129 HydrophobicContact CD1-CD2 4.44Å; L125-L129 HydrophobicContact CD1-CG 4.06Å; L125-L129 HydrophobicContact CD2-CD1 3.87Å; L125-L129 HydrophobicContact CG-CD1 3.67Å; L125-L129 HydrophobicContact CG-CG 3.92Å; L125-L129 PolarHBondContact O-N 3.38Å; L125-L179 HydrophobicContact CD2-CD1 4.29Å
126	P	85.1	Confident	77.4	Confident	1 Å²	1	58.7 Å²	58.7	1%	0.006	28%	0.279	C	S	.	.	H	α-helix	trans	-46.8	-46.8	178.2	-37.4	40.9	0	0	0	115.4	L122 S123 F128 L129 T130 M176 L179 L180 W264	L122-P126 WeakPolarHBondContact O-CD 3.38Å; S123-P126 WeakPolarHBondContact O-CD 3.4Å; P126-F128 PolarHBondContact O-N 3.43Å; P126-L129 PolarHBondContact O-N 3.24Å; P126-L129 VanDerWaalsContact O-N 3.1Å; P126-T130 WeakPolarHBondContact O-CG2 3.3Å; P126-T130 PolarHBondContact O-N 3.42Å; P126-T130 PolarHBondContact O-OG1 3Å; P126-M176 HydrophobicContact CB-CG 3.34Å; P126-M176 HydrophobicContact CB-SD 3.61Å; P126-M176 HydrophobicContact CG-CG 3.64Å; P126-M176 HydrophobicContact CG-SD 4.37Å; P126-L179 HydrophobicContact CG-CD2 3.93Å; P126-L180 HydrophobicContact CG-CD2 4.08Å; P126-L180 HydrophobicContact CG-CG 4.21Å; P126-W264 HydrophobicContact CB-CH2 3.79Å; P126-W264 HydrophobicContact CB-CZ2 4.2Å; P126-W264 HydrophobicContact CG-CH2 4.16Å
127	E	82.3	Confident	74.5	Confident	6 Å²	6	61.4 Å²	61.4	3%	0.028	30%	0.302	C	S	.	.	H	α-helix	trans	-59.6	-39.4	-176.4	-168.9	68.1	-145.5	0	0	111.5	A124 L125 L129 T130 V241 W264 W265	A124-E127 PolarHBondContact O-N 3Å; L125-E127 VanDerWaalsContact C-N 3.28Å; L125-E127 PolarHBondContact O-N 2.89Å; E127-L129 VanDerWaalsContact C-N 3.35Å; E127-T130 WeakPolarHBondContact CA-OG1 3.47Å; E127-T130 PolarHBondContact O-OG1 3.37Å; E127-T130 VanDerWaalsContact O-OG1 3.11Å; E127-V241 WeakPolarHBondContact OE1-CG2 3.27Å; E127-W264 HydrophobicContact CB-CH2 4.45Å; E127-W264 HydrophobicContact CB-CZ2 3.91Å; E127-W264 WeakPolarHBondContact OE2-CZ2 3.42Å; E127-W264 PolarHBondContact OE2-NE1 3.5Å; E127-W265 HydrophobicContact CB-CB 4.03Å; E127-W265 HydrophobicContact CB-CG 3.94Å; E127-W265 VanDerWaalsContact CG-CD1 3.41Å; E127-W265 HydrophobicContact CG-CG 3.97Å
128	F	82.1	Confident	71.3	Confident	98 Å²	98	63.4 Å²	63.4	43%	0.43	32%	0.322	S	S	.	.	H	α-helix	trans	-78.6	-19.1	-177.9	-57.6	-77.1	0	0	0	113.5	A124 L125 P126 F245 W265 L269	A124-F128 HydrophobicContact CB-CE2 4.35Å; A124-F128 WeakPolarHBondContact O-CD2 2.94Å; L125-F128 PolarHBondContact O-N 3.39Å; L125-F128 VanDerWaalsContact O-N 3.09Å; P126-F128 PolarHBondContact O-N 3.43Å; F128-F245 HydrophobicContact CD1-CZ 4.46Å; F128-F245 HydrophobicContact CE1-CZ 4.36Å; F128-W265 HydrophobicContact CE2-CE3 4.16Å; F128-W265 HydrophobicContact CZ-CD2 4.3Å; F128-W265 AromaticContact CZ-CE3 3.68Å; F128-W265 HydrophobicContact CZ-CE3 3.68Å; F128-W265 HydrophobicContact CZ-CH2 4.49Å; F128-W265 AromaticContact CZ-CZ3 3.8Å; F128-W265 HydrophobicContact CZ-CZ3 3.8Å; F128-L269 HydrophobicContact CZ-CD1 4.2Å
129	L	75.9	Confident	68.1	Low	108 Å²	108	68 Å²	68	57%	0.565	34%	0.341	S	S	*	.	H	α-helix	trans	-92.6	-29.1	176.3	-67	-179.3	0	0	0	112.1	L125 P126 E127 L179	L125-L129 HydrophobicContact CD1-CD1 4.27Å; L125-L129 HydrophobicContact CD1-CD2 4.44Å; L125-L129 HydrophobicContact CD1-CG 4.06Å; L125-L129 HydrophobicContact CD2-CD1 3.87Å; L125-L129 HydrophobicContact CG-CD1 3.67Å; L125-L129 HydrophobicContact CG-CG 3.92Å; L125-L129 PolarHBondContact O-N 3.38Å; P126-L129 PolarHBondContact O-N 3.24Å; P126-L129 VanDerWaalsContact O-N 3.1Å; E127-L129 VanDerWaalsContact C-N 3.35Å; L129-L179 HydrophobicContact CD1-CD1 4.11Å
130	T	64.1	Low	65.2	Low	34 Å²	34	72 Å²	72	21%	0.209	36%	0.361	C	S	.	.	S	Bend	trans	-75.5	145.9	175.2	50.3	0	0	0	0	110.6	P126 E127 M176	P126-T130 WeakPolarHBondContact O-CG2 3.3Å; P126-T130 PolarHBondContact O-N 3.42Å; P126-T130 PolarHBondContact O-OG1 3Å; E127-T130 WeakPolarHBondContact CA-OG1 3.47Å; E127-T130 PolarHBondContact O-OG1 3.37Å; E127-T130 VanDerWaalsContact O-OG1 3.11Å; T130-M176 HydrophobicContact CG2-SD 4.15Å
131	H	57.1	Low	62.1	Low	171 Å²	171	79.1 Å²	79.1	79%	0.792	39%	0.388	S	S	*	.			trans	-57.2	145	165.2	-77.5	-56.9	0	0	0	109.7	Y133	H131-Y133 PolarHBondContact O-N 3.13Å
132	Q	53.7	Low	59.4	Low	100 Å²	100	78.6 Å²	78.6	47%	0.467	38%	0.381	S	S	.	.			trans	-39.2	138	175.1	-70.5	174.8	-26.7	0	0	109.9	K134	Q132-K134 PolarHBondContact O-N 2.99Å
133	Y	48.9	Very low	56.6	Low	53 Å²	53	77.3 Å²	77.3	21%	0.208	38%	0.382	C	S	.	.			trans	-65.9	88.3	173.4	179.2	-113.4	0	0	0	107.8	R70 H131 Y135 Y240 V241 D242 I261	R70-Y133 VanDerWaalsContact NH1-CD2 3.3Å; H131-Y133 PolarHBondContact O-N 3.13Å; Y133-Y135 PolarHBondContact O-N 3.27Å; Y133-Y240 VanDerWaalsContact CD1-OH 3.3Å; Y133-Y240 WeakPolarHBondContact CD1-OH 3.21Å; Y133-V241 HydrophobicContact CD1-CG1 4.05Å; Y133-V241 HydrophobicContact CG-CG1 4.41Å; Y133-D242 WeakPolarHBondContact CA-OD2 3.04Å; Y133-D242 VanDerWaalsContact CB-OD2 3.31Å; Y133-D242 WeakPolarHBondContact CB-OD2 3.33Å; Y133-D242 PolarHBondContact N-OD2 2.97Å; Y133-I261 HydrophobicContact CD1-CD1 4.31Å; Y133-I261 HydrophobicContact CD2-CD1 4.24Å; Y133-I261 HydrophobicContact CE1-CD1 3.86Å; Y133-I261 HydrophobicContact CE1-CG1 4.31Å; Y133-I261 HydrophobicContact CE2-CD1 3.75Å; Y133-I261 HydrophobicContact CG-CD1 4.48Å
134	K	40.5	Very low	53.5	Low	178 Å²	178	82.4 Å²	82.4	77%	0.774	42%	0.424	S	S	*	.			trans	-67.7	94.9	163.3	-70.9	-171.4	177.3	-173.6	0	105.3	Q132 E136	Q132-K134 PolarHBondContact O-N 2.99Å; K134-E136 PolarHBondContact O-N 3.25Å
135	Y	44.1	Very low	51.1	Low	80 Å²	80	87 Å²	87	31%	0.314	45%	0.445	S	S	.	.			trans	-51.5	136.3	148.6	106.6	-102.9	0	0	0	105.4	Y133 A137	Y133-Y135 PolarHBondContact O-N 3.27Å; Y135-A137 HydrophobicContact CD1-CB 3.93Å; Y135-A137 HydrophobicContact CD2-CB 4.15Å; Y135-A137 HydrophobicContact CE1-CB 3.33Å; Y135-A137 HydrophobicContact CE2-CB 3.56Å; Y135-A137 HydrophobicContact CG-CB 4.32Å; Y135-A137 PolarHBondContact O-N 3.03Å; Y135-A137 VanDerWaalsContact OH-CB 3.29Å; Y135-A137 WeakPolarHBondContact OH-CB 3.5Å
136	E	39.9	Very low	49	Very low	106 Å²	106	85 Å²	85	50%	0.495	44%	0.439	S	S	.	.	S	Bend	trans	-66.3	78	176.3	-70.2	-175.4	161.9	0	0	109.5	K134 G138 W142	K134-E136 PolarHBondContact O-N 3.25Å; E136-G138 VanDerWaalsContact C-N 3.26Å; E136-W142 HydrophobicContact CB-CZ2 4.2Å; E136-W142 WeakPolarHBondContact OE2-CZ2 3.41Å
137	A	36.6	Very low	47.6	Very low	58 Å²	58	89.4 Å²	89.4	48%	0.479	46%	0.456	S	S	.	.			trans	-86.2	-6.1	163	0	0	0	0	0	111	Y135 E139	Y135-A137 HydrophobicContact CD1-CB 3.93Å; Y135-A137 HydrophobicContact CD2-CB 4.15Å; Y135-A137 HydrophobicContact CE1-CB 3.33Å; Y135-A137 HydrophobicContact CE2-CB 3.56Å; Y135-A137 HydrophobicContact CG-CB 4.32Å; Y135-A137 PolarHBondContact O-N 3.03Å; Y135-A137 VanDerWaalsContact OH-CB 3.29Å; Y135-A137 WeakPolarHBondContact OH-CB 3.5Å; A137-E139 PolarHBondContact O-N 2.92Å
138	G	30.1	Very low	46.7	Very low	44 Å²	44	90.2 Å²	90.2	45%	0.454	46%	0.46	S	S	.	.	S	Bend	trans	-94.4	100.2	-169.1	0	0	0	0	0	111.2	E136 I140	E136-G138 VanDerWaalsContact C-N 3.26Å; G138-I140 VanDerWaalsContact C-N 3.28Å; G138-I140 PolarHBondContact O-N 3.49Å
139	E	30.6	Very low	46.4	Very low	192 Å²	192	86.9 Å²	86.9	90%	0.897	45%	0.448	S	S	*	.	S	Bend	trans	39.1	39.8	135.1	-70.3	-176.9	141.2	0	0	119	A137	A137-E139 PolarHBondContact O-N 2.92Å
140	I	35.6	Very low	46.5	Very low	84 Å²	84	82.3 Å²	82.3	43%	0.431	43%	0.425	S	S	.	.	S	Bend	trans	-132.2	96	166	-52.8	-176.7	0	0	0	106.9	G138 W142 P161	G138-I140 VanDerWaalsContact C-N 3.28Å; G138-I140 PolarHBondContact O-N 3.49Å; I140-W142 PolarHBondContact O-N 3.12Å; I140-W142 PolarHBondContact O-NE1 3.48Å; I140-P161 VanDerWaalsContact CD1-CD 3.48Å; I140-P161 HydrophobicContact CD1-CG 3.62Å
141	R	32.5	Very low	46.8	Very low	150 Å²	150	83.2 Å²	83.2	57%	0.566	44%	0.436	S	S	*	.	S	Bend	trans	59.4	3.4	179.7	-81.4	-176.3	172.5	175.2	0.7	118.8	G143 E476	R141-G143 PolarHBondContact O-N 2.9Å; R141-G143 VanDerWaalsContact O-N 3.15Å; R141-E476 IonicContact CZ-OE2 3.54Å; R141-E476 IonicContact NH1-OE2 2.65Å; R141-E476 PolarHBondContact NH1-OE2 3.08Å; R141-E476 IonicContact NH2-OE2 3.55Å
142	W	39.2	Very low	46.8	Very low	68 Å²	68	77.7 Å²	77.7	26%	0.258	42%	0.42	S	S	.	.			trans	-69.4	110.2	175	-53.5	106.4	0	0	0	111.3	E136 I140 D148	E136-W142 HydrophobicContact CB-CZ2 4.2Å; E136-W142 WeakPolarHBondContact OE2-CZ2 3.41Å; I140-W142 PolarHBondContact O-N 3.12Å; I140-W142 PolarHBondContact O-NE1 3.48Å; W142-D148 HydrophobicContact CZ3-CB 4.01Å
143	G	34.5	Very low	46.8	Very low	30 Å²	30	80.7 Å²	80.7	31%	0.309	44%	0.439	S	S	.	.			trans	-56.2	139.5	160.1	0	0	0	0	0	109.5	R141 E145	R141-G143 PolarHBondContact O-N 2.9Å; R141-G143 VanDerWaalsContact O-N 3.15Å; G143-E145 PolarHBondContact O-N 3.29Å
144	A	30.8	Very low	46.9	Very low	107 Å²	107	80 Å²	80	88%	0.884	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-30.9	7.2	-173	0	0	0	0	0	122.9
145	E	40.6	Very low	46.9	Very low	96 Å²	96	77 Å²	77	45%	0.449	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-144.8	28.1	-176.8	-66.7	-171.2	151.7	0	0	114.7	G143 R147	G143-E145 PolarHBondContact O-N 3.29Å; E145-R147 VanDerWaalsContact C-N 3.27Å; E145-R147 PolarHBondContact O-N 2.94Å; E145-R147 VanDerWaalsContact O-N 3.1Å
146	G	46.2	Very low	47.1	Very low	20 Å²	20	76.8 Å²	76.8	21%	0.206	47%	0.472	C	S	.	.	T	Hydrogen-bonded Turn	trans	62.9	25.6	168.7	0	0	0	0	0	116	R259	G146-R259 PolarHBondContact O-NH1 3.16Å
147	R	54.7	Low	47.3	Very low	94 Å²	94	76.7 Å²	76.7	36%	0.355	48%	0.483	S	S	.	.			trans	-113.4	127.5	177.1	-67.1	176.7	-173.5	-178.6	0.9	110.2	E145 V149 T504 L506	E145-R147 VanDerWaalsContact C-N 3.27Å; E145-R147 PolarHBondContact O-N 2.94Å; E145-R147 VanDerWaalsContact O-N 3.1Å; R147-V149 HydrophobicContact CB-CG1 4.29Å; R147-V149 PolarHBondContact O-N 3.48Å; R147-T504 PolarHBondContact NH1-O 3.29Å; R147-L506 VanDerWaalsContact NH1-CD1 3.35Å
148	D	63.9	Low	47.5	Very low	24 Å²	24	81.7 Å²	81.7	13%	0.128	50%	0.502	C	S	.	.			trans	-69.4	92.7	175.2	-177.6	27.6	0	0	0	109.3	W142 S495 A496 C497	W142-D148 HydrophobicContact CZ3-CB 4.01Å; D148-S495 VanDerWaalsContact OD2-CB 3.28Å; D148-S495 WeakPolarHBondContact OD2-CB 3.41Å; D148-S495 PolarHBondContact OD2-OG 3.43Å; D148-A496 CarbonylContact O-C 3.31Å; D148-A496 VanDerWaalsContact O-C 3.31Å; D148-A496 WeakPolarHBondContact O-CB 3.26Å; D148-C497 HydrophobicContact CB-CB 4.47Å; D148-C497 WeakPolarHBondContact O-CB 3.48Å; D148-C497 PolarHBondContact O-N 3.46Å; D148-C497 WeakPolarHBondContact OD1-CB 3.49Å; D148-C497 WeakPolarHBondContact OD2-CB 3.02Å
149	V	74.9	Confident	48.1	Very low	28 Å²	28	89 Å²	89	17%	0.17	52%	0.524	C	S	.	.			trans	-112.2	150.1	-178.5	-69.2	0	0	0	0	110.5	R147 A151 A496 C501	R147-V149 HydrophobicContact CB-CG1 4.29Å; R147-V149 PolarHBondContact O-N 3.48Å; V149-A151 PolarHBondContact O-N 3.43Å; V149-A496 HydrophobicContact CG1-CB 4.41Å; V149-C501 WeakPolarHBondContact CB-O 3.19Å
150	C	77.5	Confident	48.8	Very low	11 Å²	11	81.9 Å²	81.9	7%	0.074	50%	0.501	C	S	.	.			trans	-71.4	117.6	-179.5	173.4	0	0	0	0	111.4	C475 C501 N502	C150-C475 HydrophobicContact CB-CB 3.61Å; C150-C475 WeakPolarHBondContact CB-SG 3.3Å; C150-C475 WeakPolarHBondContact SG-CB 2.89Å; C150-C475 CovalentContact SG-SG 2Å; C150-C475 PolarHBondContact SG-SG 3.31Å; C150-C501 PolarHBondContact N-O 3.27Å; C150-N502 PolarHBondContact O-OD1 3.29Å; C150-N502 VanDerWaalsContact O-OD1 3.07Å
151	A	71.2	Confident	49.2	Very low	53 Å²	53	81 Å²	81	44%	0.438	50%	0.501	S	S	.	.			trans	-110.1	90.2	175	0	0	0	0	0	111.2	V149 N153	V149-A151 PolarHBondContact O-N 3.43Å; A151-N153 PolarHBondContact O-N 3.32Å
152	A	57.5	Low	49.8	Very low	55 Å²	55	78.3 Å²	78.3	46%	0.455	50%	0.498	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	2	-172.1	0	0	0	0	0	116.4
153	N	53.7	Low	50.3	Low	163 Å²	163	79.3 Å²	79.3	87%	0.872	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-148.9	29.5	-168.1	-101.2	-10.3	0	0	0	116.1	A151 S155	A151-N153 PolarHBondContact O-N 3.32Å; N153-S155 PolarHBondContact O-N 2.84Å
154	G	49.5	Very low	51.1	Low	40 Å²	40	83.6 Å²	83.6	41%	0.412	53%	0.529	S	S	.	.			trans	-72.5	106.5	177.1	0	0	0	0	0	112.8	G156	G154-G156 PolarHBondContact O-N 3.1Å
155	S	41.2	Very low	52.1	Low	115 Å²	115	84 Å²	84	80%	0.804	52%	0.516	S	S	*	.			trans	-55.2	117.1	168.5	51.6	0	0	0	0	110.3	N153 S157	N153-S155 PolarHBondContact O-N 2.84Å; S155-S157 PolarHBondContact O-N 3.45Å
156	G	49	Very low	52.8	Low	75 Å²	75	82.3 Å²	82.3	77%	0.773	51%	0.509	S	S	*	.			trans	-68.7	116.2	-178.4	0	0	0	0	0	112.9	G154	G154-G156 PolarHBondContact O-N 3.1Å
157	S	42.9	Very low	53.3	Low	103 Å²	103	83.6 Å²	83.6	72%	0.72	51%	0.514	S	S	*	.			trans	-165.5	83	148.1	59.6	0	0	0	0	108.4	S155	S155-S157 PolarHBondContact O-N 3.45Å
158	D	40.6	Very low	53.3	Low	164 Å²	164	88.1 Å²	88.1	88%	0.877	53%	0.532	S	S	*	.			trans	-167.4	123.9	138.8	-97.3	-24.8	0	0	0	107.5	G160	D158-G160 PolarHBondContact O-N 2.83Å
159	E	42.8	Very low	53.1	Low	198 Å²	198	91.4 Å²	91.4	93%	0.925	55%	0.549	S	S	*	.	P	Polyproline II helix	trans	-56.8	119.2	173.5	-70.6	177.3	147.7	0	0	107.6
160	G	45	Very low	52.5	Low	41 Å²	41	92.9 Å²	92.9	42%	0.423	55%	0.551	S	S	.	*	P	Polyproline II helix	trans	-54.7	165.7	167.5	0	0	0	0	0	110.6	D158 D162	D158-G160 PolarHBondContact O-N 2.83Å; G160-D162 PolarHBondContact O-N 3.23Å
161	P	44.9	Very low	51.9	Low	65 Å²	65	97 Å²	97	42%	0.422	58%	0.577	S	S	.	*	S	Bend	trans	-58.1	132.7	-178.2	-6.5	23.6	0	0	0	107.8	I140 P163 I166	I140-P161 VanDerWaalsContact CD1-CD 3.48Å; I140-P161 HydrophobicContact CD1-CG 3.62Å; P161-P163 VanDerWaalsContact O-N 3.14Å; P161-I166 HydrophobicContact CB-CD1 4.35Å
162	D	44.7	Very low	51.6	Low	95 Å²	95	96 Å²	96	51%	0.508	57%	0.568	S	S	.	*	P	Polyproline II helix	trans	-46	121.4	-179.4	-170.6	-6.9	0	0	0	110.1	G160 D164 L165 I166	G160-D162 PolarHBondContact O-N 3.23Å; D162-D164 PolarHBondContact O-N 3.37Å; D162-D164 PolarHBondContact OD1-N 3.43Å; D162-L165 HydrophobicContact CB-CB 4.39Å; D162-L165 WeakPolarHBondContact O-CA 3.23Å; D162-L165 VanDerWaalsContact O-CB 3.3Å; D162-L165 WeakPolarHBondContact O-CB 3.34Å; D162-L165 PolarHBondContact O-N 3.03Å; D162-I166 PolarHBondContact O-N 3.44Å
163	P	50.1	Low	52.3	Low	89 Å²	89	94.5 Å²	94.5	58%	0.578	55%	0.553	S	S	*	*	H	α-helix	trans	-54	-26.9	179.3	17.2	-29.5	0	0	0	112.3	P161 L165 I166 C167	P161-P163 VanDerWaalsContact O-N 3.14Å; P163-L165 VanDerWaalsContact C-N 3.32Å; P163-L165 PolarHBondContact O-N 2.87Å; P163-I166 PolarHBondContact O-N 3.28Å; P163-C167 WeakPolarHBondContact O-CB 3.45Å; P163-C167 PolarHBondContact O-N 2.96Å; P163-C167 PolarHBondContact O-SG 3.45Å
164	D	50.4	Low	53.5	Low	120 Å²	120	90.6 Å²	90.6	64%	0.642	53%	0.533	S	S	*	.	H	α-helix	trans	-65.7	-29.8	173.6	-78.2	-16.4	0	0	0	113.3	D162 R168	D162-D164 PolarHBondContact O-N 3.37Å; D162-D164 PolarHBondContact OD1-N 3.43Å; D164-R168 WeakPolarHBondContact O-CB 3.26Å; D164-R168 PolarHBondContact O-N 3.34Å
165	L	52.6	Low	55	Low	114 Å²	114	94.1 Å²	94.1	60%	0.597	54%	0.539	S	S	*	.	H	α-helix	trans	-74	-38.5	175.8	-164.8	75.4	0	0	0	111.8	D162 P163	D162-L165 HydrophobicContact CB-CB 4.39Å; D162-L165 WeakPolarHBondContact O-CA 3.23Å; D162-L165 VanDerWaalsContact O-CB 3.3Å; D162-L165 WeakPolarHBondContact O-CB 3.34Å; D162-L165 PolarHBondContact O-N 3.03Å; P163-L165 VanDerWaalsContact C-N 3.32Å; P163-L165 PolarHBondContact O-N 2.87Å
166	I	54.5	Low	56.9	Low	62 Å²	62	88.9 Å²	88.9	32%	0.318	50%	0.503	S	S	.	.	H	α-helix	trans	-68.6	-40	176.6	-60	173.5	0	0	0	109.9	P161 D162 P163 N169 F607	P161-I166 HydrophobicContact CB-CD1 4.35Å; D162-I166 PolarHBondContact O-N 3.44Å; P163-I166 PolarHBondContact O-N 3.28Å; I166-N169 WeakPolarHBondContact O-CB 3.43Å; I166-N169 PolarHBondContact O-N 3.04Å; I166-F607 HydrophobicContact CG2-CE1 4.26Å; I166-F607 HydrophobicContact CG2-CE2 3.71Å; I166-F607 HydrophobicContact CG2-CZ 3.44Å; I166-F607 VanDerWaalsContact CG2-CZ 3.44Å
167	C	57.8	Low	58.8	Low	46 Å²	46	87.1 Å²	87.1	31%	0.311	47%	0.473	S	S	.	.	H	α-helix	trans	-76.9	-25.3	177.8	-59.2	0	0	0	0	114.1	P163 N169 R170 C608	P163-C167 WeakPolarHBondContact O-CB 3.45Å; P163-C167 PolarHBondContact O-N 2.96Å; P163-C167 PolarHBondContact O-SG 3.45Å; C167-N169 PolarHBondContact O-N 3.1Å; C167-R170 WeakPolarHBondContact O-CB 3.49Å; C167-R170 PolarHBondContact O-N 3.32Å; C167-C608 WeakPolarHBondContact CA-SG 3.48Å; C167-C608 HydrophobicContact CB-CB 3.96Å; C167-C608 WeakPolarHBondContact CB-SG 3.39Å; C167-C608 PolarHBondContact N-SG 3.4Å; C167-C608 WeakPolarHBondContact SG-CB 3.31Å; C167-C608 CovalentContact SG-SG 2.03Å; C167-C608 PolarHBondContact SG-SG 2.85Å
168	R	54.6	Low	61	Low	190 Å²	190	87.8 Å²	87.8	72%	0.717	47%	0.468	S	S	*	.	H	α-helix	trans	-60.9	-26.1	168.6	-163.3	166.6	111.7	146.9	2.4	112.2	D164 R170 T171	D164-R168 WeakPolarHBondContact O-CB 3.26Å; D164-R168 PolarHBondContact O-N 3.34Å; R168-R170 PolarHBondContact O-N 3.48Å; R168-T171 PolarHBondContact O-N 3.5Å; R168-T171 PolarHBondContact O-OG1 2.83Å
169	N	59.3	Low	63.4	Low	92 Å²	92	81.6 Å²	81.6	49%	0.492	44%	0.435	S	S	.	.	H	α-helix	trans	-67.3	-22.7	174.6	-135.1	0.9	0	0	0	112.7	I166 C167 T171 A172 T173	I166-N169 WeakPolarHBondContact O-CB 3.43Å; I166-N169 PolarHBondContact O-N 3.04Å; C167-N169 PolarHBondContact O-N 3.1Å; N169-T171 PolarHBondContact O-N 3.21Å; N169-A172 WeakPolarHBondContact O-CB 3.28Å; N169-A172 PolarHBondContact O-N 3.47Å; N169-T173 PolarHBondContact O-N 3.11Å; N169-T173 PolarHBondContact O-OG1 3.33Å; N169-T173 VanDerWaalsContact O-OG1 3.05Å
170	R	63.6	Low	65.8	Low	59 Å²	59	72.2 Å²	72.2	22%	0.223	39%	0.39	C	S	.	.	H	α-helix	trans	-67.2	-35.4	178.5	-172.8	65.4	166.5	-176.1	-3.2	113.2	C167 R168 A172 T173 N174	C167-R170 WeakPolarHBondContact O-CB 3.49Å; C167-R170 PolarHBondContact O-N 3.32Å; R168-R170 PolarHBondContact O-N 3.48Å; R170-A172 VanDerWaalsContact C-N 3.27Å; R170-A172 PolarHBondContact O-N 3.26Å; R170-T173 WeakPolarHBondContact O-CB 3.34Å; R170-T173 PolarHBondContact O-N 2.99Å; R170-N174 PolarHBondContact O-N 3.31Å
171	T	63.2	Low	68.2	Low	99 Å²	99	72 Å²	72	61%	0.607	38%	0.379	S	S	*	.	H	α-helix	trans	-66.2	-34.6	174.8	54.8	0	0	0	0	111.2	R168 N169 M175	R168-T171 PolarHBondContact O-N 3.5Å; R168-T171 PolarHBondContact O-OG1 2.83Å; N169-T171 PolarHBondContact O-N 3.21Å; T171-M175 WeakPolarHBondContact O-CB 2.94Å; T171-M175 PolarHBondContact O-N 3.14Å
172	A	66.1	Low	70.5	Confident	31 Å²	31	70.5 Å²	70.5	26%	0.256	38%	0.376	S	S	.	.	H	α-helix	trans	-65.9	-43.4	170.8	0	0	0	0	0	111.5	N169 R170 N174 M175 M176	N169-A172 WeakPolarHBondContact O-CB 3.28Å; N169-A172 PolarHBondContact O-N 3.47Å; R170-A172 VanDerWaalsContact C-N 3.27Å; R170-A172 PolarHBondContact O-N 3.26Å; A172-N174 PolarHBondContact O-N 2.93Å; A172-M175 PolarHBondContact O-N 3.27Å; A172-M176 WeakPolarHBondContact O-CB 3.12Å; A172-M176 PolarHBondContact O-N 2.86Å
173	T	72.2	Confident	73	Confident	23 Å²	23	66 Å²	66	14%	0.141	35%	0.352	C	S	.	.	H	α-helix	trans	-58.9	-44.9	174.1	-47.3	0	0	0	0	112.2	F71 N169 R170 M176 Y177	F71-T173 HydrophobicContact CB-CG2 3.96Å; F71-T173 HydrophobicContact CD1-CG2 4.36Å; F71-T173 VanDerWaalsContact O-CG2 3.31Å; F71-T173 WeakPolarHBondContact O-CG2 3.28Å; N169-T173 PolarHBondContact O-N 3.11Å; N169-T173 PolarHBondContact O-OG1 3.33Å; N169-T173 VanDerWaalsContact O-OG1 3.05Å; R170-T173 WeakPolarHBondContact O-CB 3.34Å; R170-T173 PolarHBondContact O-N 2.99Å; T173-M176 PolarHBondContact O-N 3.03Å; T173-Y177 PolarHBondContact O-N 3.24Å
174	N	77.7	Confident	75.2	Confident	82 Å²	82	61.9 Å²	61.9	44%	0.439	33%	0.325	S	S	.	.	H	α-helix	trans	-68.1	-40.5	178.9	-74.6	-11.7	0	0	0	112.5	R170 A172 M176 Y177 L178	R170-N174 PolarHBondContact O-N 3.31Å; A172-N174 PolarHBondContact O-N 2.93Å; N174-M176 PolarHBondContact O-N 3.46Å; N174-Y177 VanDerWaalsContact O-CA 3.29Å; N174-Y177 WeakPolarHBondContact O-CA 3.38Å; N174-Y177 PolarHBondContact O-N 3.31Å; N174-L178 WeakPolarHBondContact O-CG 3.47Å; N174-L178 PolarHBondContact O-N 2.69Å; N174-L178 VanDerWaalsContact O-N 3.13Å
175	M	81.9	Confident	77.4	Confident	113 Å²	113	58.2 Å²	58.2	56%	0.557	31%	0.307	S	S	*	.	H	α-helix	trans	-60	-41.8	174.9	179.3	-177.6	69.8	0	0	110.9	T171 A172 L178 L179	T171-M175 WeakPolarHBondContact O-CB 2.94Å; T171-M175 PolarHBondContact O-N 3.14Å; A172-M175 PolarHBondContact O-N 3.27Å; M175-L178 PolarHBondContact O-N 2.96Å; M175-L179 WeakPolarHBondContact O-CB 3.38Å; M175-L179 PolarHBondContact O-N 3.32Å
176	M	81.8	Confident	79.4	Confident	6 Å²	6	55.3 Å²	55.3	3%	0.03	29%	0.292	C	S	.	.	H	α-helix	trans	-75.7	-36.4	-178	-168.3	-145.2	74.4	0	0	112.5	F71 P126 T130 A172 T173 N174 L178 L179 L180	F71-M176 HydrophobicContact CB-CE 4.06Å; F71-M176 HydrophobicContact CD1-CE 3.09Å; F71-M176 HydrophobicContact CD1-SD 3.48Å; F71-M176 WeakPolarHBondContact CD1-SD 3.18Å; F71-M176 HydrophobicContact CD2-CE 3.22Å; F71-M176 HydrophobicContact CD2-SD 4.26Å; F71-M176 HydrophobicContact CE1-CE 3.17Å; F71-M176 HydrophobicContact CE1-SD 2.92Å; F71-M176 WeakPolarHBondContact CE1-SD 3.44Å; F71-M176 HydrophobicContact CE2-CE 3.26Å; F71-M176 HydrophobicContact CE2-SD 3.77Å; F71-M176 HydrophobicContact CG-CE 3.12Å; F71-M176 HydrophobicContact CG-SD 4.12Å; F71-M176 HydrophobicContact CZ-CE 3.24Å; F71-M176 HydrophobicContact CZ-SD 3.08Å; F71-M176 WeakPolarHBondContact CZ-SD 3.22Å; P126-M176 HydrophobicContact CB-CG 3.34Å; P126-M176 HydrophobicContact CB-SD 3.61Å; P126-M176 HydrophobicContact CG-CG 3.64Å; P126-M176 HydrophobicContact CG-SD 4.37Å; T130-M176 HydrophobicContact CG2-SD 4.15Å; A172-M176 WeakPolarHBondContact O-CB 3.12Å; A172-M176 PolarHBondContact O-N 2.86Å; T173-M176 PolarHBondContact O-N 3.03Å; N174-M176 PolarHBondContact O-N 3.46Å; M176-L178 PolarHBondContact O-N 3.16Å; M176-L179 WeakPolarHBondContact O-CB 3.48Å; M176-L179 PolarHBondContact O-N 3.25Å; M176-L179 VanDerWaalsContact O-N 3.17Å; M176-L180 HydrophobicContact CE-CD1 4.06Å; M176-L180 PolarHBondContact O-N 3.09Å
177	Y	87.5	Confident	81.4	Confident	37 Å²	37	52.4 Å²	52.4	15%	0.145	28%	0.277	C	S	.	.	H	α-helix	trans	-17.2	-78.3	145.2	178.4	-48.7	0	0	0	114.4	L73 D77 I81 T173 N174 L179 L180 I181	L73-Y177 HydrophobicContact CD1-CD2 3.93Å; L73-Y177 HydrophobicContact CD2-CD2 4.25Å; L73-Y177 HydrophobicContact CD2-CG 4.33Å; D77-Y177 HydrophobicContact CB-CE2 3.89Å; I81-Y177 HydrophobicContact CD1-CD2 3.75Å; I81-Y177 HydrophobicContact CD1-CE2 4Å; I81-Y177 HydrophobicContact CG1-CD2 3.79Å; I81-Y177 HydrophobicContact CG1-CE2 3.63Å; T173-Y177 PolarHBondContact O-N 3.24Å; N174-Y177 VanDerWaalsContact O-CA 3.29Å; N174-Y177 WeakPolarHBondContact O-CA 3.38Å; N174-Y177 PolarHBondContact O-N 3.31Å; Y177-L179 VanDerWaalsContact C-N 3.3Å; Y177-L179 PolarHBondContact O-N 3.01Å; Y177-L180 PolarHBondContact O-N 3.09Å; Y177-I181 HydrophobicContact CD1-CD1 4.22Å; Y177-I181 HydrophobicContact CD2-CD1 4.35Å; Y177-I181 HydrophobicContact CE1-CD1 3.73Å; Y177-I181 HydrophobicContact CE2-CD1 3.87Å; Y177-I181 HydrophobicContact CE2-CG1 4.33Å; Y177-I181 PolarHBondContact O-N 3.41Å
178	L	89.9	Confident	83.2	Confident	118 Å²	118	50.2 Å²	50.2	62%	0.618	26%	0.262	S	S	*	.	H	α-helix	trans	-67	-31.3	-176.6	-62.7	172.3	0	0	0	112.5	N174 M175 M176 I181 G182	N174-L178 WeakPolarHBondContact O-CG 3.47Å; N174-L178 PolarHBondContact O-N 2.69Å; N174-L178 VanDerWaalsContact O-N 3.13Å; M175-L178 PolarHBondContact O-N 2.96Å; M176-L178 PolarHBondContact O-N 3.16Å; L178-I181 PolarHBondContact O-N 3.46Å; L178-G182 PolarHBondContact O-N 3.45Å
179	L	91.5	Very high	85.1	Confident	34 Å²	34	43.8 Å²	43.8	18%	0.178	24%	0.241	C	C	.	.	H	α-helix	trans	-63.9	-46.7	176.6	-165.2	165.4	0	0	0	110.8	L122 L125 P126 L129 M175 M176 Y177 I181 G182 A183	L122-L179 HydrophobicContact CD1-CD2 3.83Å; L122-L179 HydrophobicContact CD1-CG 4.3Å; L122-L179 HydrophobicContact CG-CD2 3.77Å; L122-L179 WeakPolarHBondContact O-CD2 3.36Å; L125-L179 HydrophobicContact CD2-CD1 4.29Å; P126-L179 HydrophobicContact CG-CD2 3.93Å; L129-L179 HydrophobicContact CD1-CD1 4.11Å; M175-L179 WeakPolarHBondContact O-CB 3.38Å; M175-L179 PolarHBondContact O-N 3.32Å; M176-L179 WeakPolarHBondContact O-CB 3.48Å; M176-L179 PolarHBondContact O-N 3.25Å; M176-L179 VanDerWaalsContact O-N 3.17Å; Y177-L179 VanDerWaalsContact C-N 3.3Å; Y177-L179 PolarHBondContact O-N 3.01Å; L179-I181 PolarHBondContact O-N 2.97Å; L179-G182 PolarHBondContact O-N 3.07Å; L179-A183 WeakPolarHBondContact O-CB 3.32Å; L179-A183 PolarHBondContact O-N 3.43Å
180	L	92.5	Very high	86.8	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-61	-44.6	176.1	-74.5	171.6	0	0	0	111.4	L67 I81 P126 M176 Y177 G182 A183 Q184	L67-L180 HydrophobicContact CD1-CD1 4.47Å; L67-L180 HydrophobicContact CD2-CD1 4.15Å; I81-L180 HydrophobicContact CD1-CD1 4.44Å; P126-L180 HydrophobicContact CG-CD2 4.08Å; P126-L180 HydrophobicContact CG-CG 4.21Å; M176-L180 HydrophobicContact CE-CD1 4.06Å; M176-L180 PolarHBondContact O-N 3.09Å; Y177-L180 PolarHBondContact O-N 3.09Å; L180-G182 PolarHBondContact O-N 3.49Å; L180-A183 WeakPolarHBondContact O-CB 3.39Å; L180-A183 PolarHBondContact O-N 2.84Å; L180-Q184 WeakPolarHBondContact O-CG 3.5Å; L180-Q184 PolarHBondContact O-N 3.46Å
181	I	94.6	Very high	88.2	Confident	36 Å²	36	36.7 Å²	36.7	19%	0.185	21%	0.208	C	C	.	.	H	α-helix	trans	-59	-47.9	174.1	-67.1	173.8	0	0	0	110.7	V80 I81 Y177 L178 L179 A183 Q184 V185	V80-I181 HydrophobicContact CG1-CD1 4.15Å; I81-I181 HydrophobicContact CG1-CG1 4.44Å; Y177-I181 HydrophobicContact CD1-CD1 4.22Å; Y177-I181 HydrophobicContact CD2-CD1 4.35Å; Y177-I181 HydrophobicContact CE1-CD1 3.73Å; Y177-I181 HydrophobicContact CE2-CD1 3.87Å; Y177-I181 HydrophobicContact CE2-CG1 4.33Å; Y177-I181 PolarHBondContact O-N 3.41Å; L178-I181 PolarHBondContact O-N 3.46Å; L179-I181 PolarHBondContact O-N 2.97Å; I181-A183 VanDerWaalsContact C-N 3.3Å; I181-A183 PolarHBondContact O-N 3.37Å; I181-Q184 PolarHBondContact O-N 3.35Å; I181-V185 HydrophobicContact CG2-CG2 4.41Å; I181-V185 WeakPolarHBondContact O-CG2 3.48Å; I181-V185 PolarHBondContact O-N 3.08Å
182	G	95.1	Very high	89.5	Confident	34 Å²	34	32 Å²	32	35%	0.351	18%	0.179	S	C	.	.	H	α-helix	trans	-59.9	-39.7	178.2	0	0	0	0	0	112.6	L178 L179 L180 V185 L186	L178-G182 PolarHBondContact O-N 3.45Å; L179-G182 PolarHBondContact O-N 3.07Å; L180-G182 PolarHBondContact O-N 3.49Å; G182-V185 PolarHBondContact O-N 2.83Å; G182-L186 WeakPolarHBondContact O-CB 3.34Å; G182-L186 PolarHBondContact O-N 3.29Å
183	A	96	Very high	90.6	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-64.4	-42.9	176.4	0	0	0	0	0	112.3	L122 S123 L179 L180 I181 L186 L187	L122-A183 HydrophobicContact CB-CB 3.92Å; L122-A183 HydrophobicContact CD2-CB 4.06Å; L122-A183 HydrophobicContact CG-CB 3.9Å; S123-A183 WeakPolarHBondContact OG-CB 3.41Å; L179-A183 WeakPolarHBondContact O-CB 3.32Å; L179-A183 PolarHBondContact O-N 3.43Å; L180-A183 WeakPolarHBondContact O-CB 3.39Å; L180-A183 PolarHBondContact O-N 2.84Å; I181-A183 VanDerWaalsContact C-N 3.3Å; I181-A183 PolarHBondContact O-N 3.37Å; A183-L186 WeakPolarHBondContact O-CB 3.3Å; A183-L186 PolarHBondContact O-N 3.41Å; A183-L187 PolarHBondContact O-N 3.45Å
184	Q	95.8	Very high	91.5	Very high	4 Å²	4	29.7 Å²	29.7	2%	0.019	16%	0.162	C	C	.	.	H	α-helix	trans	-69.1	-39.7	176.7	-66.7	-46.9	-23.1	0	0	112.8	L60 I81 S84 F85 L180 I181 L186 L187 G188	L60-Q184 VanDerWaalsContact CD2-CD 3.43Å; L60-Q184 HydrophobicContact CD2-CG 4.02Å; I81-Q184 HydrophobicContact CG2-CG 3.97Å; S84-Q184 WeakPolarHBondContact OG-CB 3.35Å; F85-Q184 WeakPolarHBondContact CA-O 3.37Å; L180-Q184 WeakPolarHBondContact O-CG 3.5Å; L180-Q184 PolarHBondContact O-N 3.46Å; I181-Q184 PolarHBondContact O-N 3.35Å; Q184-L186 VanDerWaalsContact C-N 3.27Å; Q184-L186 PolarHBondContact O-N 3.46Å; Q184-L187 WeakPolarHBondContact O-CB 3.43Å; Q184-L187 PolarHBondContact O-N 2.97Å; Q184-G188 PolarHBondContact O-N 3.24Å
185	V	96.3	Very high	91.9	Very high	43 Å²	43	27 Å²	27	26%	0.261	15%	0.147	S	C	.	.	H	α-helix	trans	-58.7	-42.3	171.5	169.9	0	0	0	0	110.5	I181 G182 G188 I189	I181-V185 HydrophobicContact CG2-CG2 4.41Å; I181-V185 WeakPolarHBondContact O-CG2 3.48Å; I181-V185 PolarHBondContact O-N 3.08Å; G182-V185 PolarHBondContact O-N 2.83Å; V185-G188 PolarHBondContact O-N 3.41Å; V185-I189 HydrophobicContact CG1-CD1 3.96Å; V185-I189 WeakPolarHBondContact O-CG1 3.27Å; V185-I189 PolarHBondContact O-N 2.98Å
186	L	96.1	Very high	91.9	Very high	53 Å²	53	23.5 Å²	23.5	28%	0.277	13%	0.132	S	C	.	.	H	α-helix	trans	-65	-42	177.5	-167.1	64.2	0	0	0	112.1	V115 L118 G182 A183 Q184 G188 I189 G190	V115-L186 HydrophobicContact CG1-CD1 3.52Å; V115-L186 HydrophobicContact CG1-CG 3.78Å; L118-L186 HydrophobicContact CB-CD2 4.28Å; G182-L186 WeakPolarHBondContact O-CB 3.34Å; G182-L186 PolarHBondContact O-N 3.29Å; A183-L186 WeakPolarHBondContact O-CB 3.3Å; A183-L186 PolarHBondContact O-N 3.41Å; Q184-L186 VanDerWaalsContact C-N 3.27Å; Q184-L186 PolarHBondContact O-N 3.46Å; L186-G188 VanDerWaalsContact C-N 3.33Å; L186-G188 PolarHBondContact O-N 3.48Å; L186-I189 PolarHBondContact O-N 3.32Å; L186-G190 PolarHBondContact O-N 3.17Å
187	L	96	Very high	92.1	Very high	1 Å²	1	23.3 Å²	23.3	1%	0.005	13%	0.131	C	C	.	.	H	α-helix	trans	-57.6	-45.3	170.7	-82.3	160.9	0	0	0	111.4	V56 F85 M116 A120 A183 Q184 G190 A191 L275	V56-L187 HydrophobicContact CG1-CD2 4.17Å; V56-L187 HydrophobicContact CG2-CD1 4.36Å; V56-L187 HydrophobicContact CG2-CD2 4.32Å; F85-L187 HydrophobicContact CD2-CB 3.86Å; F85-L187 HydrophobicContact CE2-CB 4.15Å; M116-L187 HydrophobicContact CB-CD2 3.97Å; M116-L187 HydrophobicContact CG-CD2 4.42Å; M116-L187 WeakPolarHBondContact O-CD2 3.48Å; A120-L187 HydrophobicContact CB-CD2 4.32Å; A183-L187 PolarHBondContact O-N 3.45Å; Q184-L187 WeakPolarHBondContact O-CB 3.43Å; Q184-L187 PolarHBondContact O-N 2.97Å; L187-G190 PolarHBondContact O-N 3.35Å; L187-A191 WeakPolarHBondContact O-CB 3.41Å; L187-A191 PolarHBondContact O-N 2.81Å; L187-L275 HydrophobicContact CD2-CD1 4.43Å
188	G	94.9	Very high	92.1	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-60.2	-45.4	176.6	0	0	0	0	0	113.4	F85 N89 Q184 V185 L186 A191 T192	F85-G188 WeakPolarHBondContact O-CA 3.43Å; N89-G188 WeakPolarHBondContact CA-O 3.38Å; Q184-G188 PolarHBondContact O-N 3.24Å; V185-G188 PolarHBondContact O-N 3.41Å; L186-G188 VanDerWaalsContact C-N 3.33Å; L186-G188 PolarHBondContact O-N 3.48Å; G188-A191 PolarHBondContact O-N 3.39Å; G188-T192 PolarHBondContact O-N 3.42Å; G188-T192 PolarHBondContact O-OG1 3.4Å
189	I	94.7	Very high	91.8	Very high	54 Å²	54	17.6 Å²	17.6	28%	0.277	11%	0.106	S	C	.	.	H	α-helix	trans	-58.2	-48.4	174.4	-74.9	168.2	0	0	0	110.5	L92 V115 V185 L186 A191 T192	L92-I189 HydrophobicContact CD1-CB 4.09Å; L92-I189 HydrophobicContact CD1-CG1 3.84Å; L92-I189 HydrophobicContact CD1-CG2 3.53Å; V115-I189 HydrophobicContact CG1-CG2 4.15Å; V185-I189 HydrophobicContact CG1-CD1 3.96Å; V185-I189 WeakPolarHBondContact O-CG1 3.27Å; V185-I189 PolarHBondContact O-N 2.98Å; L186-I189 PolarHBondContact O-N 3.32Å; I189-A191 PolarHBondContact O-N 3.48Å; I189-T192 WeakPolarHBondContact O-CB 3.46Å; I189-T192 PolarHBondContact O-N 3.04Å; I189-T192 PolarHBondContact O-OG1 3.36Å; I189-T192 VanDerWaalsContact O-OG1 3.12Å
190	G	94.8	Very high	91.4	Very high	1 Å²	1	17.6 Å²	17.6	1%	0.01	11%	0.108	C	C	.	.	H	α-helix	trans	-66.8	-32.6	-179.8	0	0	0	0	0	114	G112 L186 L187 T192 P193	G112-G190 CarbonylContact C-O 3.53Å; G112-G190 VanDerWaalsContact C-O 3.24Å; G112-G190 WeakPolarHBondContact CA-O 3.47Å; G112-G190 CarbonylContact O-C 3.25Å; G112-G190 WeakPolarHBondContact O-CA 3.35Å; L186-G190 PolarHBondContact O-N 3.17Å; L187-G190 PolarHBondContact O-N 3.35Å; G190-T192 VanDerWaalsContact C-N 3.27Å; G190-T192 PolarHBondContact O-N 2.82Å; G190-P193 WeakPolarHBondContact O-CD 3.12Å
191	A	93.1	Very high	91.1	Very high	1 Å²	1	17.6 Å²	17.6	1%	0.008	11%	0.108	C	C	.	.	H	α-helix	trans	-72.4	-20.7	177.8	0	0	0	0	0	113.2	Q53 F85 M116 L187 G188 I189 V194	Q53-A191 HydrophobicContact CG-CB 4.29Å; F85-A191 HydrophobicContact CE2-CB 3.87Å; F85-A191 HydrophobicContact CZ-CB 3.67Å; M116-A191 HydrophobicContact CG-CB 4.47Å; M116-A191 VanDerWaalsContact SD-CA 3.52Å; M116-A191 HydrophobicContact SD-CB 3.7Å; L187-A191 WeakPolarHBondContact O-CB 3.41Å; L187-A191 PolarHBondContact O-N 2.81Å; G188-A191 PolarHBondContact O-N 3.39Å; I189-A191 PolarHBondContact O-N 3.48Å; A191-V194 PolarHBondContact O-N 3.11Å
192	T	90.6	Very high	90.6	Very high	1 Å²	1	15.9 Å²	15.9	1%	0.006	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.2	-51.7	-175	-59.3	0	0	0	0	114.1	N89 L92 I93 V96 G188 I189 G190 P196	N89-T192 WeakPolarHBondContact CA-OG1 3.39Å; N89-T192 PolarHBondContact O-OG1 3.23Å; N89-T192 PolarHBondContact OD1-OG1 2.8Å; L92-T192 HydrophobicContact CB-CG2 4Å; I93-T192 HydrophobicContact CB-CG2 4.08Å; I93-T192 HydrophobicContact CG1-CG2 4.41Å; V96-T192 HydrophobicContact CB-CG2 3.86Å; V96-T192 HydrophobicContact CG1-CG2 4.29Å; V96-T192 HydrophobicContact CG2-CG2 3.83Å; G188-T192 PolarHBondContact O-N 3.42Å; G188-T192 PolarHBondContact O-OG1 3.4Å; I189-T192 WeakPolarHBondContact O-CB 3.46Å; I189-T192 PolarHBondContact O-N 3.04Å; I189-T192 PolarHBondContact O-OG1 3.36Å; I189-T192 VanDerWaalsContact O-OG1 3.12Å; G190-T192 VanDerWaalsContact C-N 3.27Å; G190-T192 PolarHBondContact O-N 2.82Å; T192-P196 WeakPolarHBondContact O-CD 3.47Å; T192-P196 WeakPolarHBondContact O-CG 3.36Å
193	P	90.4	Very high	90	Very high	6 Å²	6	17 Å²	17	4%	0.039	10%	0.097	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-23.8	-179.6	26.5	-36.3	0	0	0	115	V96 L108 G190 L197	V96-P193 HydrophobicContact CG1-CB 3.69Å; L108-P193 HydrophobicContact CG-CB 4.21Å; G190-P193 WeakPolarHBondContact O-CD 3.12Å; P193-L197 HydrophobicContact CB-CD1 3.68Å; P193-L197 HydrophobicContact CB-CG 4.39Å; P193-L197 WeakPolarHBondContact O-CB 3.44Å; P193-L197 VanDerWaalsContact O-CG 3.24Å; P193-L197 WeakPolarHBondContact O-CG 3.43Å; P193-L197 PolarHBondContact O-N 3.09Å; P193-L197 VanDerWaalsContact O-N 3.16Å
194	V	90.6	Very high	89.3	Confident	0 Å²	0	20.6 Å²	20.6	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-59.8	-63	-167.2	-179.1	0	0	0	0	110.6	E46 L49 M50 I109 M116 A191 G198	E46-V194 WeakPolarHBondContact OE1-CG1 3.38Å; E46-V194 VanDerWaalsContact OE1-O 3.07Å; L49-V194 HydrophobicContact CD2-CG1 3.98Å; L49-V194 HydrophobicContact CD2-CG2 4.12Å; L49-V194 HydrophobicContact CG-CG1 4.13Å; M50-V194 HydrophobicContact CG-CG1 4.16Å; I109-V194 HydrophobicContact CG2-CG2 4.43Å; M116-V194 HydrophobicContact CE-CG2 3.58Å; A191-V194 PolarHBondContact O-N 3.11Å; V194-G198 WeakPolarHBondContact O-CA 3.43Å; V194-G198 PolarHBondContact O-N 3.04Å
195	Q	85.2	Confident	88.7	Confident	24 Å²	24	23 Å²	23	11%	0.112	13%	0.127	C	C	.	.	H	α-helix	trans	-67.5	-49.6	-173.3	-175	-175.3	-10	0	0	114.4	M50 V199	M50-Q195 HydrophobicContact CE-CB 3.88Å; M50-Q195 HydrophobicContact CE-CG 3.92Å; Q195-V199 WeakPolarHBondContact O-CB 3.09Å; Q195-V199 VanDerWaalsContact O-CG2 3.28Å; Q195-V199 WeakPolarHBondContact O-CG2 3.17Å; Q195-V199 PolarHBondContact O-N 3.14Å
196	P	82	Confident	88	Confident	40 Å²	40	21.6 Å²	21.6	26%	0.26	12%	0.119	S	C	.	.	H	α-helix	trans	-68.2	-39.9	-177	-19.4	33.6	0	0	0	112.8	T192 S200	T192-P196 WeakPolarHBondContact O-CD 3.47Å; T192-P196 WeakPolarHBondContact O-CG 3.36Å; P196-S200 WeakPolarHBondContact O-CB 3.4Å; P196-S200 PolarHBondContact O-N 3.26Å; P196-S200 PolarHBondContact O-OG 3.02Å
197	L	86.3	Confident	87	Confident	2 Å²	2	25.9 Å²	25.9	1%	0.01	13%	0.132	C	C	.	.	H	α-helix	trans	-79.7	-34.3	-177.4	-54.8	-179.1	0	0	0	111.7	V96 R105 L108 I109 P193 S200 Y201	V96-L197 HydrophobicContact CG1-CD1 4.08Å; V96-L197 HydrophobicContact CG1-CG 4.44Å; R105-L197 HydrophobicContact CB-CB 4.29Å; L108-L197 HydrophobicContact CB-CD1 4.07Å; L108-L197 HydrophobicContact CD2-CD1 3.53Å; L108-L197 HydrophobicContact CG-CD1 3.94Å; I109-L197 HydrophobicContact CD1-CB 3.91Å; I109-L197 HydrophobicContact CG1-CB 3.82Å; I109-L197 HydrophobicContact CG1-CD1 4.48Å; P193-L197 HydrophobicContact CB-CD1 3.68Å; P193-L197 HydrophobicContact CB-CG 4.39Å; P193-L197 WeakPolarHBondContact O-CB 3.44Å; P193-L197 VanDerWaalsContact O-CG 3.24Å; P193-L197 WeakPolarHBondContact O-CG 3.43Å; P193-L197 PolarHBondContact O-N 3.09Å; P193-L197 VanDerWaalsContact O-N 3.16Å; L197-S200 WeakPolarHBondContact CA-OG 3.34Å; L197-S200 PolarHBondContact O-OG 3.4Å; L197-Y201 WeakPolarHBondContact O-CB 3.47Å; L197-Y201 PolarHBondContact O-N 3.32Å
198	G	88.1	Confident	85.7	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-62.7	-49.7	175.3	0	0	0	0	0	111.7	V194 S200 Y201 I202	V194-G198 WeakPolarHBondContact O-CA 3.43Å; V194-G198 PolarHBondContact O-N 3.04Å; G198-S200 PolarHBondContact O-N 3.1Å; G198-Y201 PolarHBondContact O-N 2.95Å; G198-I202 PolarHBondContact O-N 3.07Å
199	V	83.5	Confident	84.4	Confident	36 Å²	36	42.1 Å²	42.1	22%	0.218	20%	0.198	C	C	.	.	H	α-helix	trans	-60.7	-47.4	176.9	171.4	0	0	0	0	111.3	Q195 Y201 I202 D203 I215 L218	Q195-V199 WeakPolarHBondContact O-CB 3.09Å; Q195-V199 VanDerWaalsContact O-CG2 3.28Å; Q195-V199 WeakPolarHBondContact O-CG2 3.17Å; Q195-V199 PolarHBondContact O-N 3.14Å; V199-Y201 PolarHBondContact O-N 2.61Å; V199-I202 PolarHBondContact O-N 2.78Å; V199-D203 PolarHBondContact O-N 3.5Å; V199-I215 HydrophobicContact CG1-CD1 4.04Å; V199-I215 HydrophobicContact CG1-CG1 4.18Å; V199-I215 HydrophobicContact CG1-CG2 4.46Å; V199-L218 HydrophobicContact CG2-CD1 4.14Å
200	S	82.6	Confident	83.3	Confident	33 Å²	33	42.6 Å²	42.6	23%	0.231	20%	0.201	C	C	.	.	H	α-helix	trans	-66.9	-36.1	-179.9	61.3	0	0	0	0	113	R105 P196 L197 G198 D203 D204	R105-S200 PolarHBondContact NH1-O 3.37Å; R105-S200 VanDerWaalsContact NH1-O 3.15Å; R105-S200 PolarHBondContact NH1-OG 2.98Å; P196-S200 WeakPolarHBondContact O-CB 3.4Å; P196-S200 PolarHBondContact O-N 3.26Å; P196-S200 PolarHBondContact O-OG 3.02Å; L197-S200 WeakPolarHBondContact CA-OG 3.34Å; L197-S200 PolarHBondContact O-OG 3.4Å; G198-S200 PolarHBondContact O-N 3.1Å; S200-D203 PolarHBondContact O-N 3.09Å; S200-D204 WeakPolarHBondContact O-CB 3.43Å; S200-D204 VanDerWaalsContact O-CG 3.28Å; S200-D204 PolarHBondContact O-N 3.34Å
201	Y	85.6	Confident	82.2	Confident	1 Å²	1	42.8 Å²	42.8	0%	0.004	20%	0.202	C	C	.	.	H	α-helix	trans	-65.7	-40.7	176.5	-172.4	-90.4	0	0	0	111.7	I39 F42 R105 P106 L197 G198 V199 H205 P286 Q287 L289	I39-Y201 HydrophobicContact CD1-CD1 4.42Å; I39-Y201 HydrophobicContact CD1-CE1 4.34Å; F42-Y201 AromaticContact CD1-CD1 3.64Å; F42-Y201 HydrophobicContact CD1-CD1 3.64Å; F42-Y201 HydrophobicContact CD1-CE1 4.04Å; F42-Y201 AromaticContact CD2-CD1 3.88Å; F42-Y201 HydrophobicContact CD2-CD1 3.88Å; F42-Y201 AromaticContact CD2-CE1 3.7Å; F42-Y201 HydrophobicContact CD2-CE1 3.7Å; F42-Y201 AromaticContact CE1-CD1 3.43Å; F42-Y201 HydrophobicContact CE1-CD1 3.43Å; F42-Y201 VanDerWaalsContact CE1-CD1 3.43Å; F42-Y201 HydrophobicContact CE1-CE1 4.21Å; F42-Y201 HydrophobicContact CE1-CG 4.16Å; F42-Y201 AromaticContact CE2-CD1 3.68Å; F42-Y201 HydrophobicContact CE2-CD1 3.68Å; F42-Y201 AromaticContact CE2-CE1 3.87Å; F42-Y201 HydrophobicContact CE2-CE1 3.87Å; F42-Y201 HydrophobicContact CE2-CG 4.28Å; F42-Y201 AromaticContact CG-CD1 3.87Å; F42-Y201 HydrophobicContact CG-CD1 3.87Å; F42-Y201 AromaticContact CG-CE1 3.78Å; F42-Y201 HydrophobicContact CG-CE1 3.78Å; F42-Y201 AromaticContact CZ-CD1 3.45Å; F42-Y201 HydrophobicContact CZ-CD1 3.45Å; F42-Y201 VanDerWaalsContact CZ-CD1 3.45Å; F42-Y201 HydrophobicContact CZ-CE1 4.12Å; F42-Y201 AromaticContact CZ-CG 3.91Å; F42-Y201 HydrophobicContact CZ-CG 3.91Å; R105-Y201 HydrophobicContact CB-CD2 4.21Å; P106-Y201 HydrophobicContact CG-CD2 3.89Å; P106-Y201 HydrophobicContact CG-CE1 4.35Å; P106-Y201 HydrophobicContact CG-CE2 3.5Å; P106-Y201 HydrophobicContact CG-CG 4.44Å; L197-Y201 WeakPolarHBondContact O-CB 3.47Å; L197-Y201 PolarHBondContact O-N 3.32Å; G198-Y201 PolarHBondContact O-N 2.95Å; V199-Y201 PolarHBondContact O-N 2.61Å; Y201-H205 AromaticContact CD1-ND1 3.82Å; Y201-H205 AromaticContact CD2-CE1 3.6Å; Y201-H205 AromaticContact CD2-ND1 3.84Å; Y201-H205 AromaticContact CE1-ND1 3.78Å; Y201-H205 AromaticContact CE2-CE1 3.33Å; Y201-H205 WeakPolarHBondContact CE2-CE1 3.4Å; Y201-H205 AromaticContact CE2-ND1 3.79Å; Y201-H205 AromaticContact CG-ND1 3.87Å; Y201-H205 AromaticContact CZ-CE1 3.62Å; Y201-H205 AromaticContact CZ-ND1 3.77Å; Y201-H205 PolarHBondContact O-N 3.31Å; Y201-H205 PolarHBondContact O-ND1 2.81Å; Y201-P286 PolarHBondContact OH-O 3.22Å; Y201-Q287 WeakPolarHBondContact CE2-O 3.32Å; Y201-L289 HydrophobicContact CE1-CD1 4.27Å; Y201-L289 HydrophobicContact CE1-CG 4.49Å
202	I	85.9	Confident	81.2	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-65.9	-46.1	174.9	-77.4	157.1	0	0	0	111.3	I39 F42 L43 G198 V199 D204 H205 V206 Y214 I215 L218	I39-I202 HydrophobicContact CD1-CG1 4.13Å; F42-I202 HydrophobicContact CD1-CD1 4.04Å; F42-I202 HydrophobicContact CD1-CG1 3.72Å; F42-I202 HydrophobicContact CE1-CD1 3.92Å; F42-I202 HydrophobicContact CE1-CG1 3.75Å; L43-I202 HydrophobicContact CD1-CD1 3.77Å; G198-I202 PolarHBondContact O-N 3.07Å; V199-I202 PolarHBondContact O-N 2.78Å; I202-D204 VanDerWaalsContact C-N 3.29Å; I202-D204 PolarHBondContact O-N 3.02Å; I202-H205 PolarHBondContact O-N 3.08Å; I202-V206 HydrophobicContact CG2-CG2 4.14Å; I202-V206 WeakPolarHBondContact O-CB 3.26Å; I202-V206 VanDerWaalsContact O-CG2 3.26Å; I202-V206 WeakPolarHBondContact O-CG2 3.32Å; I202-V206 PolarHBondContact O-N 3.49Å; I202-V206 VanDerWaalsContact O-N 3.1Å; I202-Y214 HydrophobicContact CG2-CD1 4.34Å; I202-Y214 HydrophobicContact CG2-CG 4.26Å; I202-I215 HydrophobicContact CG2-CG1 4.44Å; I202-L218 HydrophobicContact CD1-CD1 3.34Å; I202-L218 HydrophobicContact CD1-CD2 4.36Å; I202-L218 HydrophobicContact CD1-CG 4.03Å
203	D	80.9	Confident	80.5	Confident	56 Å²	56	51.9 Å²	51.9	30%	0.299	26%	0.257	S	S	.	.	H	α-helix	trans	-60.2	-42.8	179.6	-173.3	46.5	0	0	0	111	V199 S200 H205 S211 I215 K313	V199-D203 PolarHBondContact O-N 3.5Å; S200-D203 PolarHBondContact O-N 3.09Å; D203-H205 VanDerWaalsContact C-N 3.25Å; D203-H205 PolarHBondContact O-N 3.5Å; D203-S211 WeakPolarHBondContact OD1-CB 3.39Å; D203-S211 PolarHBondContact OD1-OG 3.26Å; D203-I215 HydrophobicContact CB-CD1 4.49Å; D203-K313 PolarHBondContact O-NZ 3.21Å; D203-K313 IonicContact OD1-NZ 2.63Å; D203-K313 PolarHBondContact OD1-NZ 3.01Å; D203-K313 VanDerWaalsContact OD1-NZ 3.14Å; D203-K313 IonicContact OD2-NZ 2.72Å
204	D	81.6	Confident	80	Confident	76 Å²	76	53.3 Å²	53.3	41%	0.406	26%	0.262	S	S	.	.	H	α-helix	trans	-65.5	-26.3	-178.2	-73.8	-15.8	0	0	0	113.9	R105 S200 I202	R105-D204 IonicContact CZ-OD2 3.65Å; R105-D204 IonicContact NH1-OD2 2.89Å; R105-D204 PolarHBondContact NH1-OD2 3.46Å; R105-D204 IonicContact NH2-OD2 3.99Å; R105-D204 PolarHBondContact NH2-OD2 3.23Å; S200-D204 WeakPolarHBondContact O-CB 3.43Å; S200-D204 VanDerWaalsContact O-CG 3.28Å; S200-D204 PolarHBondContact O-N 3.34Å; I202-D204 VanDerWaalsContact C-N 3.29Å; I202-D204 PolarHBondContact O-N 3.02Å
205	H	83.4	Confident	79.4	Confident	54 Å²	54	55 Å²	55	25%	0.25	27%	0.27	C	S	.	.	H	α-helix	trans	-109.1	3	-173.9	-61.8	98.9	0	0	0	114.6	I39 Y201 I202 D203 S288 L289	I39-H205 HydrophobicContact CD1-CB 3.99Å; I39-H205 HydrophobicContact CG1-CB 4.4Å; Y201-H205 AromaticContact CD1-ND1 3.82Å; Y201-H205 AromaticContact CD2-CE1 3.6Å; Y201-H205 AromaticContact CD2-ND1 3.84Å; Y201-H205 AromaticContact CE1-ND1 3.78Å; Y201-H205 AromaticContact CE2-CE1 3.33Å; Y201-H205 WeakPolarHBondContact CE2-CE1 3.4Å; Y201-H205 AromaticContact CE2-ND1 3.79Å; Y201-H205 AromaticContact CG-ND1 3.87Å; Y201-H205 AromaticContact CZ-CE1 3.62Å; Y201-H205 AromaticContact CZ-ND1 3.77Å; Y201-H205 PolarHBondContact O-N 3.31Å; Y201-H205 PolarHBondContact O-ND1 2.81Å; I202-H205 PolarHBondContact O-N 3.08Å; D203-H205 VanDerWaalsContact C-N 3.25Å; D203-H205 PolarHBondContact O-N 3.5Å; H205-S288 WeakPolarHBondContact NE2-CA 3.49Å; H205-L289 HydrophobicContact CB-CD1 3.96Å; H205-L289 PolarHBondContact CD2-N 2.98Å; H205-L289 PolarHBondContact NE2-N 3.25Å; H205-L289 VanDerWaalsContact NE2-N 3.12Å
206	V	81.9	Confident	78.8	Confident	15 Å²	15	55.3 Å²	55.3	9%	0.091	28%	0.28	C	S	.	.	S	Bend	trans	-118.7	147.3	178.2	-177.8	0	0	0	0	110.5	I39 I202 D210 Y214 K313	I39-V206 HydrophobicContact CD1-CG2 4.32Å; I39-V206 HydrophobicContact CG1-CG2 3.49Å; I39-V206 VanDerWaalsContact CG1-CG2 3.49Å; I39-V206 HydrophobicContact CG2-CG2 4.41Å; I202-V206 HydrophobicContact CG2-CG2 4.14Å; I202-V206 WeakPolarHBondContact O-CB 3.26Å; I202-V206 VanDerWaalsContact O-CG2 3.26Å; I202-V206 WeakPolarHBondContact O-CG2 3.32Å; I202-V206 PolarHBondContact O-N 3.49Å; I202-V206 VanDerWaalsContact O-N 3.1Å; V206-D210 HydrophobicContact CG1-CB 3.52Å; V206-Y214 HydrophobicContact CG1-CD2 4.23Å; V206-Y214 HydrophobicContact CG1-CE2 4.3Å; V206-Y214 HydrophobicContact CG2-CD1 4.24Å; V206-Y214 HydrophobicContact CG2-CE1 4.41Å; V206-Y214 HydrophobicContact CG2-CG 4.42Å; V206-K313 PolarHBondContact O-NZ 3.49Å
207	R	75.9	Confident	78.8	Confident	142 Å²	142	56.7 Å²	56.7	54%	0.536	28%	0.284	S	S	.	.			trans	-56.9	144.2	173.8	-58.1	-177.3	-160	-171.6	8.3	109.4	K209 D210 S211 D294	R207-K209 PolarHBondContact O-N 2.94Å; R207-D210 PolarHBondContact O-N 3.44Å; R207-S211 PolarHBondContact O-N 2.58Å; R207-D294 IonicContact NH2-OD2 3.94Å
208	R	67.3	Low	78.7	Confident	158 Å²	158	56.6 Å²	56.6	60%	0.596	28%	0.284	S	S	*	.	H	α-helix	trans	-53.6	-32.8	-179	-70.5	-172	-176.6	175.2	4.1	113.5
209	K	68.9	Low	78.3	Confident	184 Å²	184	60.2 Å²	60.2	80%	0.8	30%	0.3	S	S	*	.	H	α-helix	trans	-69.2	-32.8	178.3	-169.8	177.9	178.6	-177.5	0	113.2	R207	R207-K209 PolarHBondContact O-N 2.94Å
210	D	71.3	Confident	78.2	Confident	65 Å²	65	62.9 Å²	62.9	35%	0.348	32%	0.316	S	S	.	.	H	α-helix	trans	-98.3	-21.9	-175.1	-56.1	-37.3	0	0	0	112.2	V206 R207 S212 L213 Y214	V206-D210 HydrophobicContact CG1-CB 3.52Å; R207-D210 PolarHBondContact O-N 3.44Å; D210-S212 VanDerWaalsContact C-N 3.3Å; D210-S212 PolarHBondContact O-N 3.28Å; D210-L213 WeakPolarHBondContact O-CB 3.2Å; D210-L213 PolarHBondContact O-N 3.17Å; D210-Y214 HydrophobicContact CB-CE2 4.32Å; D210-Y214 VanDerWaalsContact O-CD2 3.3Å; D210-Y214 WeakPolarHBondContact O-CD2 3.27Å; D210-Y214 PolarHBondContact O-N 2.91Å
211	S	71.7	Confident	78.3	Confident	5 Å²	5	63.8 Å²	63.8	4%	0.035	32%	0.317	C	S	.	.	H	α-helix	trans	-53.3	-43.6	-178.9	177.5	0	0	0	0	112.9	D203 R207 L213 Y214 I215	D203-S211 WeakPolarHBondContact OD1-CB 3.39Å; D203-S211 PolarHBondContact OD1-OG 3.26Å; R207-S211 PolarHBondContact O-N 2.58Å; S211-L213 VanDerWaalsContact C-N 3.27Å; S211-L213 PolarHBondContact O-N 3.2Å; S211-Y214 PolarHBondContact O-N 3.24Å; S211-I215 WeakPolarHBondContact O-CB 3.42Å; S211-I215 VanDerWaalsContact O-CG1 3.29Å; S211-I215 WeakPolarHBondContact O-CG1 3.27Å; S211-I215 PolarHBondContact O-N 2.88Å; S211-I215 WeakPolarHBondContact OG-CD1 3.47Å
212	S	71.1	Confident	78.1	Confident	84 Å²	84	65.9 Å²	65.9	59%	0.587	33%	0.329	S	S	*	.	H	α-helix	trans	-62.2	-31.9	178.2	55	0	0	0	0	113.6	D210 G216	D210-S212 VanDerWaalsContact C-N 3.3Å; D210-S212 PolarHBondContact O-N 3.28Å; S212-G216 PolarHBondContact O-N 2.61Å
213	L	76.6	Confident	77.8	Confident	109 Å²	109	68.3 Å²	68.3	57%	0.571	34%	0.343	S	S	*	.	H	α-helix	trans	-70.6	-46.3	177.5	-178.5	69.4	0	0	0	110.6	D210 S211 G216 I217	D210-L213 WeakPolarHBondContact O-CB 3.2Å; D210-L213 PolarHBondContact O-N 3.17Å; S211-L213 VanDerWaalsContact C-N 3.27Å; S211-L213 PolarHBondContact O-N 3.2Å; L213-G216 PolarHBondContact O-N 2.74Å; L213-I217 HydrophobicContact CG-CD1 4.37Å; L213-I217 WeakPolarHBondContact O-CG1 3.34Å; L213-I217 PolarHBondContact O-N 3.39Å
214	Y	79.3	Confident	78	Confident	36 Å²	36	70.9 Å²	70.9	14%	0.141	35%	0.352	C	S	.	.	H	α-helix	trans	-64.8	-43.4	-179.6	-76.9	-119.6	0	0	0	111.2	I39 K40 L43 I202 V206 D210 S211 G216 I217 L218	I39-Y214 HydrophobicContact CG2-CE1 4.4Å; K40-Y214 HydrophobicContact CG-CE1 4.33Å; L43-Y214 HydrophobicContact CB-CD1 4.12Å; L43-Y214 HydrophobicContact CB-CE1 4.46Å; L43-Y214 HydrophobicContact CD1-CD1 4.18Å; L43-Y214 HydrophobicContact CD2-CD1 3.58Å; L43-Y214 HydrophobicContact CD2-CE1 3.97Å; L43-Y214 HydrophobicContact CD2-CG 4.18Å; L43-Y214 HydrophobicContact CG-CD1 4.16Å; I202-Y214 HydrophobicContact CG2-CD1 4.34Å; I202-Y214 HydrophobicContact CG2-CG 4.26Å; V206-Y214 HydrophobicContact CG1-CD2 4.23Å; V206-Y214 HydrophobicContact CG1-CE2 4.3Å; V206-Y214 HydrophobicContact CG2-CD1 4.24Å; V206-Y214 HydrophobicContact CG2-CE1 4.41Å; V206-Y214 HydrophobicContact CG2-CG 4.42Å; D210-Y214 HydrophobicContact CB-CE2 4.32Å; D210-Y214 VanDerWaalsContact O-CD2 3.3Å; D210-Y214 WeakPolarHBondContact O-CD2 3.27Å; D210-Y214 PolarHBondContact O-N 2.91Å; S211-Y214 PolarHBondContact O-N 3.24Å; Y214-G216 VanDerWaalsContact C-N 3.32Å; Y214-G216 PolarHBondContact O-N 2.92Å; Y214-I217 PolarHBondContact O-N 3.43Å; Y214-L218 PolarHBondContact O-N 3.04Å; Y214-L218 VanDerWaalsContact O-N 3.11Å
215	I	77.4	Confident	78.5	Confident	34 Å²	34	67.2 Å²	67.2	17%	0.174	33%	0.333	C	S	.	.	H	α-helix	trans	-63.3	-38.9	175	-66.1	170.2	0	0	0	111	V199 I202 D203 S211 I217 L218 F219	V199-I215 HydrophobicContact CG1-CD1 4.04Å; V199-I215 HydrophobicContact CG1-CG1 4.18Å; V199-I215 HydrophobicContact CG1-CG2 4.46Å; I202-I215 HydrophobicContact CG2-CG1 4.44Å; D203-I215 HydrophobicContact CB-CD1 4.49Å; S211-I215 WeakPolarHBondContact O-CB 3.42Å; S211-I215 VanDerWaalsContact O-CG1 3.29Å; S211-I215 WeakPolarHBondContact O-CG1 3.27Å; S211-I215 PolarHBondContact O-N 2.88Å; S211-I215 WeakPolarHBondContact OG-CD1 3.47Å; I215-I217 PolarHBondContact O-N 3.36Å; I215-L218 WeakPolarHBondContact O-CB 3.45Å; I215-L218 PolarHBondContact O-N 3.23Å; I215-F219 HydrophobicContact CG2-CD2 3.64Å; I215-F219 HydrophobicContact CG2-CE2 3.43Å; I215-F219 VanDerWaalsContact CG2-CE2 3.43Å; I215-F219 VanDerWaalsContact O-CD2 3.27Å; I215-F219 WeakPolarHBondContact O-CD2 3.42Å; I215-F219 PolarHBondContact O-N 3.12Å; I215-F219 VanDerWaalsContact O-N 3.08Å
216	G	72.9	Confident	78.8	Confident	31 Å²	31	66.5 Å²	66.5	32%	0.32	33%	0.333	S	S	.	.	H	α-helix	trans	-62.2	-40	174.9	0	0	0	0	0	113.2	S212 L213 Y214 F219 T220	S212-G216 PolarHBondContact O-N 2.61Å; L213-G216 PolarHBondContact O-N 2.74Å; Y214-G216 VanDerWaalsContact C-N 3.32Å; Y214-G216 PolarHBondContact O-N 2.92Å; G216-F219 PolarHBondContact O-N 3.21Å; G216-T220 PolarHBondContact O-N 3.42Å; G216-T220 PolarHBondContact O-OG1 2.88Å
217	I	83.4	Confident	79.2	Confident	69 Å²	69	66.1 Å²	66.1	35%	0.354	33%	0.331	S	S	.	.	H	α-helix	trans	-62.2	-45.4	174.8	-66.8	164.8	0	0	0	110.4	L43 L213 Y214 I215 F219 T220 M221	L43-I217 HydrophobicContact CD2-CD1 4.13Å; L43-I217 HydrophobicContact CD2-CG2 4.3Å; L213-I217 HydrophobicContact CG-CD1 4.37Å; L213-I217 WeakPolarHBondContact O-CG1 3.34Å; L213-I217 PolarHBondContact O-N 3.39Å; Y214-I217 PolarHBondContact O-N 3.43Å; I215-I217 PolarHBondContact O-N 3.36Å; I217-F219 PolarHBondContact O-N 2.89Å; I217-T220 WeakPolarHBondContact O-CB 3.46Å; I217-T220 PolarHBondContact O-N 3.1Å; I217-M221 PolarHBondContact O-N 3.18Å; I217-M221 VanDerWaalsContact O-N 3.12Å
218	L	83.6	Confident	80.1	Confident	1 Å²	1	61.2 Å²	61.2	1%	0.005	32%	0.318	C	S	.	.	H	α-helix	trans	-57	-51.2	176.6	-77.7	179.1	0	0	0	112.7	L43 E46 M50 V199 I202 Y214 I215 T220 M221 L222	L43-L218 HydrophobicContact CD1-CD2 3.95Å; L43-L218 HydrophobicContact CD1-CG 3.78Å; E46-L218 HydrophobicContact CB-CD2 3.97Å; E46-L218 HydrophobicContact CG-CD1 4.42Å; E46-L218 HydrophobicContact CG-CD2 3.51Å; M50-L218 HydrophobicContact SD-CB 4.06Å; M50-L218 HydrophobicContact SD-CD2 3.92Å; M50-L218 HydrophobicContact SD-CG 4.48Å; V199-L218 HydrophobicContact CG2-CD1 4.14Å; I202-L218 HydrophobicContact CD1-CD1 3.34Å; I202-L218 HydrophobicContact CD1-CD2 4.36Å; I202-L218 HydrophobicContact CD1-CG 4.03Å; Y214-L218 PolarHBondContact O-N 3.04Å; Y214-L218 VanDerWaalsContact O-N 3.11Å; I215-L218 WeakPolarHBondContact O-CB 3.45Å; I215-L218 PolarHBondContact O-N 3.23Å; L218-T220 PolarHBondContact O-N 3.44Å; L218-M221 PolarHBondContact O-N 3.44Å; L218-L222 PolarHBondContact O-N 3.36Å; L218-L222 VanDerWaalsContact O-N 3.1Å
219	F	79.8	Confident	81.4	Confident	76 Å²	76	53.7 Å²	53.7	33%	0.333	29%	0.29	S	S	.	.	H	α-helix	trans	-63.6	-30.7	179.5	-78.6	-61	0	0	0	112.7	I215 G216 I217 L222 V223 F578	I215-F219 HydrophobicContact CG2-CD2 3.64Å; I215-F219 HydrophobicContact CG2-CE2 3.43Å; I215-F219 VanDerWaalsContact CG2-CE2 3.43Å; I215-F219 VanDerWaalsContact O-CD2 3.27Å; I215-F219 WeakPolarHBondContact O-CD2 3.42Å; I215-F219 PolarHBondContact O-N 3.12Å; I215-F219 VanDerWaalsContact O-N 3.08Å; G216-F219 PolarHBondContact O-N 3.21Å; I217-F219 PolarHBondContact O-N 2.89Å; F219-L222 HydrophobicContact CD1-CD2 4.23Å; F219-L222 WeakPolarHBondContact O-CB 3.47Å; F219-L222 PolarHBondContact O-N 3.35Å; F219-V223 WeakPolarHBondContact O-CG2 3.37Å; F219-V223 PolarHBondContact O-N 3.06Å; F219-F578 HydrophobicContact CZ-CZ 4.44Å
220	T	80.9	Confident	82.5	Confident	92 Å²	92	45.5 Å²	45.5	56%	0.564	25%	0.254	S	S	*	.	H	α-helix	trans	-66.4	-42.8	175.2	-55.7	0	0	0	0	111.1	G216 I217 L218 L222 V223 F224	G216-T220 PolarHBondContact O-N 3.42Å; G216-T220 PolarHBondContact O-OG1 2.88Å; I217-T220 WeakPolarHBondContact O-CB 3.46Å; I217-T220 PolarHBondContact O-N 3.1Å; L218-T220 PolarHBondContact O-N 3.44Å; T220-L222 VanDerWaalsContact C-N 3.29Å; T220-L222 PolarHBondContact O-N 3.27Å; T220-V223 PolarHBondContact O-N 2.81Å; T220-V223 VanDerWaalsContact O-N 3.16Å; T220-F224 PolarHBondContact O-N 3.38Å
221	M	84.8	Confident	83.6	Confident	51 Å²	51	46.3 Å²	46.3	25%	0.251	26%	0.258	S	S	.	.	H	α-helix	trans	-65	-34.3	177	-66.5	-60.2	-68.9	0	0	112.4	C47 L51 I217 L218 V223 F224 G225	C47-M221 HydrophobicContact CB-CB 4.39Å; C47-M221 HydrophobicContact CB-CG 3.87Å; L51-M221 HydrophobicContact CB-CE 4.05Å; L51-M221 HydrophobicContact CD1-CE 3.96Å; L51-M221 HydrophobicContact CD2-CE 3.94Å; L51-M221 HydrophobicContact CG-CE 4.21Å; I217-M221 PolarHBondContact O-N 3.18Å; I217-M221 VanDerWaalsContact O-N 3.12Å; L218-M221 PolarHBondContact O-N 3.44Å; M221-V223 VanDerWaalsContact C-N 3.31Å; M221-V223 PolarHBondContact O-N 3.06Å; M221-F224 PolarHBondContact O-N 2.8Å; M221-G225 PolarHBondContact O-N 3.49Å
222	L	82.4	Confident	84.7	Confident	46 Å²	46	47.3 Å²	47.3	24%	0.241	26%	0.262	C	S	.	.	H	α-helix	trans	-60.3	-39.7	172.6	179.4	65.9	0	0	0	112.2	L218 F219 T220 P226	L218-L222 PolarHBondContact O-N 3.36Å; L218-L222 VanDerWaalsContact O-N 3.1Å; F219-L222 HydrophobicContact CD1-CD2 4.23Å; F219-L222 WeakPolarHBondContact O-CB 3.47Å; F219-L222 PolarHBondContact O-N 3.35Å; T220-L222 VanDerWaalsContact C-N 3.29Å; T220-L222 PolarHBondContact O-N 3.27Å; L222-P226 WeakPolarHBondContact O-CD 3.48Å
223	V	78.8	Confident	85.7	Confident	50 Å²	50	43.3 Å²	43.3	30%	0.303	23%	0.234	S	C	.	.	H	α-helix	trans	-77.9	-29.1	178.7	-176.6	0	0	0	0	111.9	F219 T220 M221 P226 C400 I403	F219-V223 WeakPolarHBondContact O-CG2 3.37Å; F219-V223 PolarHBondContact O-N 3.06Å; T220-V223 PolarHBondContact O-N 2.81Å; T220-V223 VanDerWaalsContact O-N 3.16Å; M221-V223 VanDerWaalsContact C-N 3.31Å; M221-V223 PolarHBondContact O-N 3.06Å; V223-P226 WeakPolarHBondContact O-CD 3.29Å; V223-C400 WeakPolarHBondContact CG1-SG 3.39Å; V223-I403 HydrophobicContact CG1-CD1 4.44Å
224	F	85.2	Confident	86.5	Confident	110 Å²	110	38.5 Å²	38.5	48%	0.482	21%	0.21	S	C	.	.	H	α-helix	trans	-73.4	-33	177.4	-166.1	-104.2	0	0	0	113	L51 T220 M221 A227 C228	L51-F224 HydrophobicContact CD1-CB 4.37Å; L51-F224 HydrophobicContact CD1-CD1 3.72Å; T220-F224 PolarHBondContact O-N 3.38Å; M221-F224 PolarHBondContact O-N 2.8Å; F224-A227 WeakPolarHBondContact O-CB 3.02Å; F224-A227 PolarHBondContact O-N 2.87Å; F224-C228 VanDerWaalsContact CE1-SG 3.59Å; F224-C228 PolarHBondContact O-N 3.01Å
225	G	90.9	Very high	87.1	Confident	0 Å²	0	43 Å²	43	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-50.6	-48.1	179.2	0	0	0	0	0	114.3	T55 M221 A227 C228 G229	T55-G225 WeakPolarHBondContact CA-O 3.3Å; T55-G225 PolarHBondContact OG1-O 3.47Å; M221-G225 PolarHBondContact O-N 3.49Å; G225-A227 VanDerWaalsContact C-N 3.29Å; G225-A227 PolarHBondContact O-N 3.16Å; G225-C228 WeakPolarHBondContact O-CB 3.5Å; G225-C228 PolarHBondContact O-N 3.44Å; G225-C228 VanDerWaalsContact O-N 3.1Å; G225-G229 PolarHBondContact O-N 3.44Å
226	P	90.8	Very high	87.8	Confident	39 Å²	39	41.8 Å²	41.8	25%	0.253	23%	0.225	S	C	.	.	H	α-helix	trans	-53.9	-38.5	175.3	-33.1	36.6	0	0	0	115.5	A58 L222 V223 C228 G229 F230 I396	A58-P226 VanDerWaalsContact CB-CA 3.44Å; A58-P226 HydrophobicContact CB-CB 3.86Å; A58-P226 WeakPolarHBondContact CB-O 3.38Å; L222-P226 WeakPolarHBondContact O-CD 3.48Å; V223-P226 WeakPolarHBondContact O-CD 3.29Å; P226-C228 VanDerWaalsContact C-N 3.34Å; P226-C228 PolarHBondContact O-N 3.35Å; P226-G229 PolarHBondContact O-N 2.81Å; P226-G229 VanDerWaalsContact O-N 3.17Å; P226-F230 VanDerWaalsContact O-CD2 3.28Å; P226-F230 WeakPolarHBondContact O-CD2 3.49Å; P226-F230 PolarHBondContact O-N 3.47Å; P226-I396 HydrophobicContact CB-CD1 3.96Å
227	A	90.9	Very high	88.5	Confident	6 Å²	6	40.5 Å²	40.5	5%	0.05	21%	0.211	C	C	.	.	H	α-helix	trans	-62.2	-44	177.1	0	0	0	0	0	111.1	F224 G225 G229 I231 I396	F224-A227 WeakPolarHBondContact O-CB 3.02Å; F224-A227 PolarHBondContact O-N 2.87Å; G225-A227 VanDerWaalsContact C-N 3.29Å; G225-A227 PolarHBondContact O-N 3.16Å; A227-G229 VanDerWaalsContact C-N 3.31Å; A227-G229 PolarHBondContact O-N 2.91Å; A227-I231 WeakPolarHBondContact O-CD1 3.39Å; A227-I231 VanDerWaalsContact O-CG1 3.24Å; A227-I231 WeakPolarHBondContact O-CG1 3.31Å; A227-I231 PolarHBondContact O-N 3.06Å; A227-I231 VanDerWaalsContact O-N 3.12Å; A227-I396 HydrophobicContact CB-CB 4.33Å; A227-I396 HydrophobicContact CB-CD1 4.44Å; A227-I396 HydrophobicContact CB-CG2 3.87Å
228	C	93.4	Very high	88.7	Confident	40 Å²	40	42 Å²	42	27%	0.27	22%	0.215	S	C	.	.	H	α-helix	trans	-61	-39.8	174	-62.8	0	0	0	0	111.9	T55 F224 G225 P226 I231 L232	T55-C228 HydrophobicContact CG2-CB 4.2Å; F224-C228 VanDerWaalsContact CE1-SG 3.59Å; F224-C228 PolarHBondContact O-N 3.01Å; G225-C228 WeakPolarHBondContact O-CB 3.5Å; G225-C228 PolarHBondContact O-N 3.44Å; G225-C228 VanDerWaalsContact O-N 3.1Å; P226-C228 VanDerWaalsContact C-N 3.34Å; P226-C228 PolarHBondContact O-N 3.35Å; C228-I231 PolarHBondContact O-N 3.33Å; C228-L232 VanDerWaalsContact O-CB 3.29Å; C228-L232 WeakPolarHBondContact O-CB 3.47Å; C228-L232 PolarHBondContact O-N 2.92Å
229	G	94.5	Very high	88.8	Confident	0 Å²	0	45 Å²	45	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-63.6	-46.9	179.3	0	0	0	0	0	113.4	T55 G225 P226 A227 L232 G233	T55-G229 WeakPolarHBondContact O-CA 3Å; G225-G229 PolarHBondContact O-N 3.44Å; P226-G229 PolarHBondContact O-N 2.81Å; P226-G229 VanDerWaalsContact O-N 3.17Å; A227-G229 VanDerWaalsContact C-N 3.31Å; A227-G229 PolarHBondContact O-N 2.91Å; G229-L232 PolarHBondContact O-N 2.79Å; G229-G233 PolarHBondContact O-N 3.18Å
230	F	93.8	Very high	88.9	Confident	11 Å²	11	41.8 Å²	41.8	5%	0.048	22%	0.216	C	C	.	.	H	α-helix	trans	-67.6	-36.4	177	-78.4	-69.9	0	0	0	113.1	A58 V61 P226 G233 S234 L391 I396	A58-F230 HydrophobicContact CB-CD2 3.91Å; A58-F230 HydrophobicContact CB-CE2 3.84Å; A58-F230 HydrophobicContact CB-CZ 4.47Å; V61-F230 HydrophobicContact CB-CE1 4.31Å; V61-F230 HydrophobicContact CB-CZ 4.1Å; V61-F230 HydrophobicContact CG1-CE1 3.95Å; V61-F230 HydrophobicContact CG1-CZ 3.73Å; P226-F230 VanDerWaalsContact O-CD2 3.28Å; P226-F230 WeakPolarHBondContact O-CD2 3.49Å; P226-F230 PolarHBondContact O-N 3.47Å; F230-G233 PolarHBondContact O-N 3.41Å; F230-S234 PolarHBondContact O-N 2.94Å; F230-L391 HydrophobicContact CD1-CB 4.25Å; F230-L391 HydrophobicContact CD1-CD2 3.72Å; F230-L391 HydrophobicContact CD1-CG 3.95Å; F230-L391 HydrophobicContact CD2-CD2 4.35Å; F230-L391 HydrophobicContact CD2-CG 3.99Å; F230-L391 HydrophobicContact CE1-CD2 3.25Å; F230-L391 HydrophobicContact CE1-CG 3.91Å; F230-L391 HydrophobicContact CE2-CD2 3.92Å; F230-L391 HydrophobicContact CE2-CG 3.91Å; F230-L391 HydrophobicContact CG-CB 4.33Å; F230-L391 HydrophobicContact CG-CD2 4.26Å; F230-L391 HydrophobicContact CG-CG 4.01Å; F230-L391 HydrophobicContact CZ-CD2 3.35Å; F230-L391 HydrophobicContact CZ-CG 3.88Å; F230-I396 HydrophobicContact CD2-CD1 3.45Å; F230-I396 VanDerWaalsContact CD2-CD1 3.45Å; F230-I396 HydrophobicContact CE2-CD1 3.86Å
231	I	94.1	Very high	88.9	Confident	83 Å²	83	37.4 Å²	37.4	43%	0.426	19%	0.189	S	C	.	.	H	α-helix	trans	-65.5	-43.7	174.6	-67.6	166.8	0	0	0	110.3	A227 C228 G233 S234 F235 M393	A227-I231 WeakPolarHBondContact O-CD1 3.39Å; A227-I231 VanDerWaalsContact O-CG1 3.24Å; A227-I231 WeakPolarHBondContact O-CG1 3.31Å; A227-I231 PolarHBondContact O-N 3.06Å; A227-I231 VanDerWaalsContact O-N 3.12Å; C228-I231 PolarHBondContact O-N 3.33Å; I231-G233 VanDerWaalsContact C-N 3.32Å; I231-G233 PolarHBondContact O-N 2.91Å; I231-S234 WeakPolarHBondContact O-CB 3.17Å; I231-S234 PolarHBondContact O-N 2.84Å; I231-F235 PolarHBondContact O-N 3.02Å; I231-M393 HydrophobicContact CD1-CG 4.36Å; I231-M393 HydrophobicContact CG1-CG 4.36Å
232	L	94.6	Very high	88.5	Confident	26 Å²	26	35 Å²	35	14%	0.136	18%	0.177	C	C	.	.	H	α-helix	trans	-61.2	-42.5	174.2	-179.6	60.8	0	0	0	111.1	T55 Y59 C228 G229 S234 F235 C236 L270	T55-L232 HydrophobicContact CG2-CD2 4.37Å; Y59-L232 HydrophobicContact CD2-CB 4.24Å; Y59-L232 HydrophobicContact CD2-CD2 4.05Å; Y59-L232 HydrophobicContact CD2-CG 3.9Å; Y59-L232 HydrophobicContact CE2-CD2 4.44Å; Y59-L232 HydrophobicContact CE2-CG 4.05Å; C228-L232 VanDerWaalsContact O-CB 3.29Å; C228-L232 WeakPolarHBondContact O-CB 3.47Å; C228-L232 PolarHBondContact O-N 2.92Å; G229-L232 PolarHBondContact O-N 2.79Å; L232-S234 PolarHBondContact O-N 2.65Å; L232-F235 PolarHBondContact O-N 3.42Å; L232-C236 PolarHBondContact O-N 2.95Å; L232-C236 PolarHBondContact O-SG 2.99Å; L232-L270 HydrophobicContact CD1-CD2 3.67Å; L232-L270 HydrophobicContact CD2-CD2 3.97Å
233	G	92.6	Very high	88	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-55.9	-47.9	172.6	0	0	0	0	0	113	S62 G229 F230 I231 F235 C236 T237	S62-G233 VanDerWaalsContact OG-CA 3.24Å; S62-G233 WeakPolarHBondContact OG-CA 3.18Å; G229-G233 PolarHBondContact O-N 3.18Å; F230-G233 PolarHBondContact O-N 3.41Å; I231-G233 VanDerWaalsContact C-N 3.32Å; I231-G233 PolarHBondContact O-N 2.91Å; G233-F235 VanDerWaalsContact C-N 3.31Å; G233-F235 PolarHBondContact O-N 3.08Å; G233-C236 PolarHBondContact O-N 3.39Å; G233-T237 VanDerWaalsContact O-CB 3.31Å; G233-T237 WeakPolarHBondContact O-CB 3.34Å; G233-T237 VanDerWaalsContact O-CG2 3.25Å; G233-T237 WeakPolarHBondContact O-CG2 3.39Å; G233-T237 PolarHBondContact O-N 3.3Å; G233-T237 PolarHBondContact O-OG1 3.49Å
234	S	92.4	Very high	87.6	Confident	7 Å²	7	37 Å²	37	5%	0.049	19%	0.194	C	C	.	.	H	α-helix	trans	-57.4	-42.9	175.1	-177.4	0	0	0	0	112.1	F230 I231 L232 T237 K238 S385	F230-S234 PolarHBondContact O-N 2.94Å; I231-S234 WeakPolarHBondContact O-CB 3.17Å; I231-S234 PolarHBondContact O-N 2.84Å; L232-S234 PolarHBondContact O-N 2.65Å; S234-T237 PolarHBondContact O-OG1 3.33Å; S234-K238 WeakPolarHBondContact O-CG 3.31Å; S234-K238 PolarHBondContact O-N 3.06Å; S234-S385 WeakPolarHBondContact CB-O 3.2Å; S234-S385 PolarHBondContact OG-O 3.37Å
235	F	92.8	Very high	86.8	Confident	130 Å²	130	36.3 Å²	36.3	57%	0.57	19%	0.192	S	C	*	.	H	α-helix	trans	-67	-50.9	177.2	179.8	-97.7	0	0	0	112.3	I231 L232 G233 T237 K238 I239	I231-F235 PolarHBondContact O-N 3.02Å; L232-F235 PolarHBondContact O-N 3.42Å; G233-F235 VanDerWaalsContact C-N 3.31Å; G233-F235 PolarHBondContact O-N 3.08Å; F235-T237 VanDerWaalsContact C-N 3.31Å; F235-T237 PolarHBondContact O-N 3.12Å; F235-K238 PolarHBondContact O-N 2.89Å; F235-I239 HydrophobicContact CD1-CD1 4.25Å; F235-I239 HydrophobicContact CE1-CD1 3.66Å; F235-I239 HydrophobicContact CZ-CD1 3.9Å
236	C	91.6	Very high	85.7	Confident	10 Å²	10	39.7 Å²	39.7	7%	0.068	21%	0.209	C	C	.	.	H	α-helix	trans	-64.3	-35.2	-178.9	-69.4	0	0	0	0	112.4	Y59 L232 G233 K238 I239 A263	Y59-C236 HydrophobicContact CE2-CB 4.04Å; L232-C236 PolarHBondContact O-N 2.95Å; L232-C236 PolarHBondContact O-SG 2.99Å; G233-C236 PolarHBondContact O-N 3.39Å; C236-K238 VanDerWaalsContact C-N 3.3Å; C236-K238 PolarHBondContact O-N 2.94Å; C236-I239 PolarHBondContact O-N 3.05Å; C236-A263 PolarHBondContact O-N 3.29Å; C236-A263 VanDerWaalsContact O-N 3.13Å
237	T	87.9	Confident	84.3	Confident	4 Å²	4	42.4 Å²	42.4	3%	0.025	22%	0.221	C	C	.	.	H	α-helix	trans	-74.6	-17.3	179.4	53.4	0	0	0	0	113.8	V63 G233 S234 F235 I239 W260 T384	V63-T237 HydrophobicContact CG1-CG2 4.16Å; G233-T237 VanDerWaalsContact O-CB 3.31Å; G233-T237 WeakPolarHBondContact O-CB 3.34Å; G233-T237 VanDerWaalsContact O-CG2 3.25Å; G233-T237 WeakPolarHBondContact O-CG2 3.39Å; G233-T237 PolarHBondContact O-N 3.3Å; G233-T237 PolarHBondContact O-OG1 3.49Å; S234-T237 PolarHBondContact O-OG1 3.33Å; F235-T237 VanDerWaalsContact C-N 3.31Å; F235-T237 PolarHBondContact O-N 3.12Å; T237-I239 VanDerWaalsContact C-N 3.32Å; T237-W260 PolarHBondContact O-NE1 3.26Å; T237-T384 HydrophobicContact CG2-CG2 3.91Å
238	K	86.5	Confident	83	Confident	99 Å²	99	45.9 Å²	45.9	43%	0.43	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-15.9	170.2	-75.2	179.5	-176.1	-178.9	0	114.1	S234 F235 C236 W260 S385	S234-K238 WeakPolarHBondContact O-CG 3.31Å; S234-K238 PolarHBondContact O-N 3.06Å; F235-K238 PolarHBondContact O-N 2.89Å; C236-K238 VanDerWaalsContact C-N 3.3Å; C236-K238 PolarHBondContact O-N 2.94Å; K238-W260 VanDerWaalsContact O-CZ2 3.22Å; K238-W260 WeakPolarHBondContact O-CZ2 3.28Å; K238-S385 WeakPolarHBondContact CE-OG 3.44Å; K238-S385 VanDerWaalsContact CG-CB 3.41Å
239	I	86	Confident	81.4	Confident	66 Å²	66	48.1 Å²	48.1	34%	0.338	26%	0.258	S	S	.	.	S	Bend	trans	-96.8	134.5	179.6	-59.6	171.2	0	0	0	107.6	F235 C236 T237 A243 G262 A263	F235-I239 HydrophobicContact CD1-CD1 4.25Å; F235-I239 HydrophobicContact CE1-CD1 3.66Å; F235-I239 HydrophobicContact CZ-CD1 3.9Å; C236-I239 PolarHBondContact O-N 3.05Å; T237-I239 VanDerWaalsContact C-N 3.32Å; I239-A243 HydrophobicContact CG2-CB 3.68Å; I239-G262 CarbonylContact O-C 3.42Å; I239-G262 VanDerWaalsContact O-CA 3.26Å; I239-G262 WeakPolarHBondContact O-CA 3.31Å; I239-A263 HydrophobicContact CB-CB 4.19Å; I239-A263 HydrophobicContact CG2-CB 4.18Å; I239-A263 PolarHBondContact O-N 3.12Å
240	Y	82.4	Confident	79.7	Confident	7 Å²	7	54.1 Å²	54.1	3%	0.027	29%	0.29	C	S	.	.	B	Isolated β-bridge	trans	-64.3	142.8	179.3	-173	-111.3	0	0	0	110.7	Y133 D242 A243 L251 I253 W260	Y133-Y240 VanDerWaalsContact CD1-OH 3.3Å; Y133-Y240 WeakPolarHBondContact CD1-OH 3.21Å; Y240-D242 HydrophobicContact CD1-CB 4.12Å; Y240-D242 HydrophobicContact CE1-CB 3.91Å; Y240-D242 PolarHBondContact O-N 3.35Å; Y240-D242 VanDerWaalsContact O-N 3.16Å; Y240-A243 WeakPolarHBondContact O-CB 3.35Å; Y240-A243 PolarHBondContact O-N 3.01Å; Y240-L251 HydrophobicContact CD1-CD2 4Å; Y240-L251 HydrophobicContact CD2-CD2 4.22Å; Y240-L251 HydrophobicContact CE1-CD2 3.82Å; Y240-L251 HydrophobicContact CE2-CD2 4.07Å; Y240-L251 HydrophobicContact CG-CD2 4.19Å; Y240-I253 HydrophobicContact CD2-CD1 4.21Å; Y240-I253 HydrophobicContact CE2-CD1 3.65Å; Y240-W260 HydrophobicContact CD2-CD2 4.21Å; Y240-W260 AromaticContact CD2-CE3 3.94Å; Y240-W260 HydrophobicContact CD2-CE3 3.94Å; Y240-W260 HydrophobicContact CD2-CH2 4.22Å; Y240-W260 HydrophobicContact CD2-CZ2 4.44Å; Y240-W260 AromaticContact CD2-CZ3 3.95Å; Y240-W260 HydrophobicContact CD2-CZ3 3.95Å; Y240-W260 HydrophobicContact CG-CH2 4.37Å; Y240-W260 HydrophobicContact CG-CZ3 4.43Å
241	V	80.6	Confident	78.3	Confident	0 Å²	0	55 Å²	55	0%	0	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.9	-41.1	-174	64.3	0	0	0	0	113.7	E127 Y133 I261 W265	E127-V241 WeakPolarHBondContact OE1-CG2 3.27Å; Y133-V241 HydrophobicContact CD1-CG1 4.05Å; Y133-V241 HydrophobicContact CG-CG1 4.41Å; V241-I261 HydrophobicContact CB-CB 4.3Å; V241-I261 HydrophobicContact CB-CG2 4Å; V241-I261 WeakPolarHBondContact CB-O 3.41Å; V241-I261 HydrophobicContact CG1-CB 4.11Å; V241-I261 HydrophobicContact CG1-CG2 4.2Å; V241-I261 HydrophobicContact CG2-CG2 4.28Å; V241-I261 PolarHBondContact N-O 3.17Å; V241-W265 PolarHBondContact O-NE1 3.11Å
242	D	76.7	Confident	76.8	Confident	1 Å²	1	57.4 Å²	57.4	1%	0.005	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.8	20	-178.8	-75.2	-42.7	0	0	0	113.6	Y133 Y240 V244 F245 I246	Y133-D242 WeakPolarHBondContact CA-OD2 3.04Å; Y133-D242 VanDerWaalsContact CB-OD2 3.31Å; Y133-D242 WeakPolarHBondContact CB-OD2 3.33Å; Y133-D242 PolarHBondContact N-OD2 2.97Å; Y240-D242 HydrophobicContact CD1-CB 4.12Å; Y240-D242 HydrophobicContact CE1-CB 3.91Å; Y240-D242 PolarHBondContact O-N 3.35Å; Y240-D242 VanDerWaalsContact O-N 3.16Å; D242-V244 PolarHBondContact O-N 3.47Å; D242-F245 PolarHBondContact O-N 3.17Å; D242-I246 HydrophobicContact CB-CD1 3.83Å; D242-I246 HydrophobicContact CB-CG1 4.19Å; D242-I246 PolarHBondContact O-N 3.49Å
243	A	72.4	Confident	75.5	Confident	31 Å²	31	57.2 Å²	57.2	26%	0.256	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-18.8	-178.8	0	0	0	0	0	114.3	I239 Y240 T248	I239-A243 HydrophobicContact CG2-CB 3.68Å; Y240-A243 WeakPolarHBondContact O-CB 3.35Å; Y240-A243 PolarHBondContact O-N 3.01Å; A243-T248 HydrophobicContact CB-CG2 3.77Å
244	V	70.5	Confident	74.5	Confident	107 Å²	107	61 Å²	61	65%	0.648	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	-23.6	175.9	179.8	0	0	0	0	112.2	D242 W265	D242-V244 PolarHBondContact O-N 3.47Å; V244-W265 HydrophobicContact CG2-CH2 4Å; V244-W265 HydrophobicContact CG2-CZ2 4.14Å
245	F	67.6	Low	73.5	Confident	96 Å²	96	62.9 Å²	62.9	42%	0.421	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.7	-19.7	-173.8	-58.5	-70.3	0	0	0	113.4	F128 D242	F128-F245 HydrophobicContact CD1-CZ 4.46Å; F128-F245 HydrophobicContact CE1-CZ 4.36Å; D242-F245 PolarHBondContact O-N 3.17Å
246	I	68.4	Low	72.2	Confident	71 Å²	71	62.8 Å²	62.8	36%	0.364	35%	0.348	S	S	.	.	S	Bend	trans	-128.4	147.3	-174.1	-57.2	174.9	0	0	0	110.4	D242 T248 L251	D242-I246 HydrophobicContact CB-CD1 3.83Å; D242-I246 HydrophobicContact CB-CG1 4.19Å; D242-I246 PolarHBondContact O-N 3.49Å; I246-T248 PolarHBondContact O-N 3.48Å; I246-T248 VanDerWaalsContact O-N 3.15Å; I246-L251 HydrophobicContact CG2-CD1 4.19Å
247	D	61.1	Low	71	Confident	95 Å²	95	63.8 Å²	63.8	51%	0.508	35%	0.353	S	S	.	.			trans	-71.3	104.7	172	-167.2	-16.1	0	0	0	111	S249 N250	D247-S249 PolarHBondContact O-N 3.38Å; D247-S249 VanDerWaalsContact O-N 3.1Å; D247-S249 WeakPolarHBondContact OD1-CB 3.47Å; D247-S249 PolarHBondContact OD1-N 3.19Å; D247-S249 VanDerWaalsContact OD1-N 3.08Å; D247-S249 PolarHBondContact OD1-OG 2.89Å; D247-S249 PolarHBondContact OD2-OG 3.35Å; D247-N250 PolarHBondContact O-N 3.15Å
248	T	63.7	Low	69.8	Low	79 Å²	79	66.3 Å²	66.3	49%	0.485	37%	0.37	S	S	.	.	G	3₁₀ helix	trans	-60.4	-15.9	-179.9	54.6	0	0	0	0	114.9	A243 I246 N250 L251	A243-T248 HydrophobicContact CB-CG2 3.77Å; I246-T248 PolarHBondContact O-N 3.48Å; I246-T248 VanDerWaalsContact O-N 3.15Å; T248-N250 VanDerWaalsContact C-N 3.26Å; T248-N250 PolarHBondContact O-N 3.02Å; T248-L251 HydrophobicContact CG2-CD1 4.44Å; T248-L251 PolarHBondContact O-N 3.48Å
249	S	60.2	Low	69	Low	88 Å²	88	65.3 Å²	65.3	62%	0.615	36%	0.363	S	S	*	.	G	3₁₀ helix	trans	-71.9	-17.9	177.9	64.1	0	0	0	0	114.1	D247	D247-S249 PolarHBondContact O-N 3.38Å; D247-S249 VanDerWaalsContact O-N 3.1Å; D247-S249 WeakPolarHBondContact OD1-CB 3.47Å; D247-S249 PolarHBondContact OD1-N 3.19Å; D247-S249 VanDerWaalsContact OD1-N 3.08Å; D247-S249 PolarHBondContact OD1-OG 2.89Å; D247-S249 PolarHBondContact OD2-OG 3.35Å
250	N	57.7	Low	68.6	Low	125 Å²	125	63.9 Å²	63.9	67%	0.668	35%	0.353	S	S	*	.	G	3₁₀ helix	trans	-98.4	9.9	176.4	-62.2	-51.1	0	0	0	113.1	D247 T248	D247-N250 PolarHBondContact O-N 3.15Å; T248-N250 VanDerWaalsContact C-N 3.26Å; T248-N250 PolarHBondContact O-N 3.02Å
251	L	64.2	Low	68.6	Low	29 Å²	29	63.9 Å²	63.9	15%	0.152	35%	0.354	C	S	.	.			trans	-92.6	118.6	176.3	-85.3	109.1	0	0	0	111	Y240 I246 T248 I253	Y240-L251 HydrophobicContact CD1-CD2 4Å; Y240-L251 HydrophobicContact CD2-CD2 4.22Å; Y240-L251 HydrophobicContact CE1-CD2 3.82Å; Y240-L251 HydrophobicContact CE2-CD2 4.07Å; Y240-L251 HydrophobicContact CG-CD2 4.19Å; I246-L251 HydrophobicContact CG2-CD1 4.19Å; T248-L251 HydrophobicContact CG2-CD1 4.44Å; T248-L251 PolarHBondContact O-N 3.48Å; L251-I253 HydrophobicContact CB-CG1 4.29Å; L251-I253 HydrophobicContact CD2-CD1 3.7Å; L251-I253 HydrophobicContact CD2-CG1 3.6Å; L251-I253 PolarHBondContact O-N 2.8Å
252	D	62.8	Low	68.8	Low	135 Å²	135	63.9 Å²	63.9	72%	0.722	35%	0.354	S	S	*	.			trans	-80.6	7.1	174.5	-67.2	-37.8	0	0	0	113.7
253	I	67.6	Low	69.4	Low	22 Å²	22	64.2 Å²	64.2	11%	0.113	36%	0.357	C	S	.	.			trans	-107.8	142.7	-177.5	60.4	172.5	0	0	0	111.7	Y240 L251 D257 W260	Y240-I253 HydrophobicContact CD2-CD1 4.21Å; Y240-I253 HydrophobicContact CE2-CD1 3.65Å; L251-I253 HydrophobicContact CB-CG1 4.29Å; L251-I253 HydrophobicContact CD2-CD1 3.7Å; L251-I253 HydrophobicContact CD2-CG1 3.6Å; L251-I253 PolarHBondContact O-N 2.8Å; I253-D257 HydrophobicContact CB-CB 4.29Å; I253-W260 HydrophobicContact CD1-CE3 4.25Å; I253-W260 HydrophobicContact CG1-CE3 4.19Å; I253-W260 HydrophobicContact CG1-CZ3 4.38Å
254	T	71.1	Confident	70.3	Confident	78 Å²	78	62.8 Å²	62.8	48%	0.479	35%	0.345	S	S	.	.			trans	-113.2	165.7	177.4	62.6	0	0	0	0	110.4	D256 D257 W260	T254-D256 PolarHBondContact O-N 2.67Å; T254-D257 VanDerWaalsContact O-CB 3.3Å; T254-D257 WeakPolarHBondContact O-CB 3.43Å; T254-D257 PolarHBondContact O-N 2.59Å; T254-W260 VanDerWaalsContact C-CE3 3.46Å
255	P	72.1	Confident	71.3	Confident	48 Å²	48	58.9 Å²	58.9	31%	0.312	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-12.9	175	-25.3	35	0	0	0	115.6	W260 T383	P255-W260 HydrophobicContact CB-CD2 4.31Å; P255-W260 HydrophobicContact CB-CZ2 4.5Å; P255-W260 HydrophobicContact CG-CD2 4.33Å; P255-W260 HydrophobicContact CG-CH2 4.07Å; P255-W260 HydrophobicContact CG-CZ2 3.87Å; P255-W260 HydrophobicContact CG-CZ3 4.41Å; P255-T383 WeakPolarHBondContact O-CG2 3.26Å
256	D	66.2	Low	72.5	Confident	127 Å²	127	55.3 Å²	55.3	68%	0.679	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-14.7	174.4	-58.3	-45.2	0	0	0	112.2	T254 T383	T254-D256 PolarHBondContact O-N 2.67Å; D256-T383 HydrophobicContact CB-CG2 4.34Å; D256-T383 WeakPolarHBondContact OD1-CG2 3.31Å
257	D	65.3	Low	73.7	Confident	31 Å²	31	52 Å²	52	17%	0.166	29%	0.292	C	S	.	.	S	Bend	trans	-73.1	131.9	177.1	-168.4	-54.7	0	0	0	110.2	I253 T254 R259 W260	I253-D257 HydrophobicContact CB-CB 4.29Å; T254-D257 VanDerWaalsContact O-CB 3.3Å; T254-D257 WeakPolarHBondContact O-CB 3.43Å; T254-D257 PolarHBondContact O-N 2.59Å; D257-R259 PolarHBondContact O-N 2.95Å; D257-R259 VanDerWaalsContact O-N 3.15Å; D257-R259 VanDerWaalsContact OD1-CB 3.28Å; D257-R259 WeakPolarHBondContact OD1-CB 3.39Å; D257-R259 WeakPolarHBondContact OD1-CG 3.26Å; D257-R259 IonicContact OD1-CZ 3.73Å; D257-R259 PolarHBondContact OD1-N 2.98Å; D257-R259 IonicContact OD1-NE 2.67Å; D257-R259 PolarHBondContact OD1-NE 3.31Å; D257-R259 VanDerWaalsContact OD1-NE 3.12Å; D257-R259 IonicContact OD1-NH2 2.8Å; D257-R259 IonicContact OD2-CZ 3.92Å; D257-R259 IonicContact OD2-NE 3.12Å; D257-R259 IonicContact OD2-NH2 3.16Å; D257-R259 PolarHBondContact OD2-NH2 3.45Å; D257-W260 WeakPolarHBondContact O-CB 3.33Å; D257-W260 PolarHBondContact O-N 3.41Å
258	P	63.8	Low	75.3	Confident	57 Å²	57	47.4 Å²	47.4	37%	0.37	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-25.5	179.3	25.2	-37.6	0	0	0	114.2	R69 W260	R69-P258 PolarHBondContact NH1-O 3.37Å; P258-W260 PolarHBondContact O-N 3.35Å
259	R	68.4	Low	76.9	Confident	78 Å²	78	46.6 Å²	46.6	29%	0.294	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-7.3	176.7	-60.7	173.8	-69.6	-178.1	1.6	112.9	G146 D257 I261 T483	G146-R259 PolarHBondContact O-NH1 3.16Å; D257-R259 PolarHBondContact O-N 2.95Å; D257-R259 VanDerWaalsContact O-N 3.15Å; D257-R259 VanDerWaalsContact OD1-CB 3.28Å; D257-R259 WeakPolarHBondContact OD1-CB 3.39Å; D257-R259 WeakPolarHBondContact OD1-CG 3.26Å; D257-R259 IonicContact OD1-CZ 3.73Å; D257-R259 PolarHBondContact OD1-N 2.98Å; D257-R259 IonicContact OD1-NE 2.67Å; D257-R259 PolarHBondContact OD1-NE 3.31Å; D257-R259 VanDerWaalsContact OD1-NE 3.12Å; D257-R259 IonicContact OD1-NH2 2.8Å; D257-R259 IonicContact OD2-CZ 3.92Å; D257-R259 IonicContact OD2-NE 3.12Å; D257-R259 IonicContact OD2-NH2 3.16Å; D257-R259 PolarHBondContact OD2-NH2 3.45Å; R259-I261 PolarHBondContact O-N 3.42Å; R259-T483 HydrophobicContact CG-CG2 3.9Å
260	W	77.7	Confident	78.5	Confident	36 Å²	36	46.6 Å²	46.6	14%	0.136	25%	0.253	C	S	.	.			trans	-65.9	120.2	179.7	-176.1	-89.1	0	0	0	111.6	T237 K238 Y240 I253 T254 P255 D257 P258	T237-W260 PolarHBondContact O-NE1 3.26Å; K238-W260 VanDerWaalsContact O-CZ2 3.22Å; K238-W260 WeakPolarHBondContact O-CZ2 3.28Å; Y240-W260 HydrophobicContact CD2-CD2 4.21Å; Y240-W260 AromaticContact CD2-CE3 3.94Å; Y240-W260 HydrophobicContact CD2-CE3 3.94Å; Y240-W260 HydrophobicContact CD2-CH2 4.22Å; Y240-W260 HydrophobicContact CD2-CZ2 4.44Å; Y240-W260 AromaticContact CD2-CZ3 3.95Å; Y240-W260 HydrophobicContact CD2-CZ3 3.95Å; Y240-W260 HydrophobicContact CG-CH2 4.37Å; Y240-W260 HydrophobicContact CG-CZ3 4.43Å; I253-W260 HydrophobicContact CD1-CE3 4.25Å; I253-W260 HydrophobicContact CG1-CE3 4.19Å; I253-W260 HydrophobicContact CG1-CZ3 4.38Å; T254-W260 VanDerWaalsContact C-CE3 3.46Å; P255-W260 HydrophobicContact CB-CD2 4.31Å; P255-W260 HydrophobicContact CB-CZ2 4.5Å; P255-W260 HydrophobicContact CG-CD2 4.33Å; P255-W260 HydrophobicContact CG-CH2 4.07Å; P255-W260 HydrophobicContact CG-CZ2 3.87Å; P255-W260 HydrophobicContact CG-CZ3 4.41Å; D257-W260 WeakPolarHBondContact O-CB 3.33Å; D257-W260 PolarHBondContact O-N 3.41Å; P258-W260 PolarHBondContact O-N 3.35Å
261	I	82.1	Confident	80.4	Confident	7 Å²	7	40.7 Å²	40.7	4%	0.036	22%	0.221	C	C	.	.			trans	-109.4	117.8	170	-56.8	-175.3	0	0	0	107.5	T66 R70 Y133 V241 R259	T66-I261 HydrophobicContact CG2-CG2 3.56Å; R70-I261 HydrophobicContact CB-CD1 4.03Å; R70-I261 HydrophobicContact CB-CG2 4.22Å; R70-I261 HydrophobicContact CG-CD1 4.38Å; Y133-I261 HydrophobicContact CD1-CD1 4.31Å; Y133-I261 HydrophobicContact CD2-CD1 4.24Å; Y133-I261 HydrophobicContact CE1-CD1 3.86Å; Y133-I261 HydrophobicContact CE1-CG1 4.31Å; Y133-I261 HydrophobicContact CE2-CD1 3.75Å; Y133-I261 HydrophobicContact CG-CD1 4.48Å; V241-I261 HydrophobicContact CB-CB 4.3Å; V241-I261 HydrophobicContact CB-CG2 4Å; V241-I261 WeakPolarHBondContact CB-O 3.41Å; V241-I261 HydrophobicContact CG1-CB 4.11Å; V241-I261 HydrophobicContact CG1-CG2 4.2Å; V241-I261 HydrophobicContact CG2-CG2 4.28Å; V241-I261 PolarHBondContact N-O 3.17Å; R259-I261 PolarHBondContact O-N 3.42Å
262	G	85.6	Confident	82	Confident	1 Å²	1	39.4 Å²	39.4	1%	0.01	22%	0.215	C	C	.	.	B	Isolated β-bridge	trans	-73	159.7	177.3	0	0	0	0	0	112.9	I239 W264	I239-G262 CarbonylContact O-C 3.42Å; I239-G262 VanDerWaalsContact O-CA 3.26Å; I239-G262 WeakPolarHBondContact O-CA 3.31Å; G262-W264 PolarHBondContact O-N 3.22Å
263	A	89.7	Confident	83.6	Confident	8 Å²	8	34.9 Å²	34.9	7%	0.066	20%	0.196	C	C	.	.			trans	-70.9	64	177.2	0	0	0	0	0	112.7	C236 I239 W265 G266	C236-A263 PolarHBondContact O-N 3.29Å; C236-A263 VanDerWaalsContact O-N 3.13Å; I239-A263 HydrophobicContact CB-CB 4.19Å; I239-A263 HydrophobicContact CG2-CB 4.18Å; I239-A263 PolarHBondContact O-N 3.12Å; A263-W265 PolarHBondContact O-N 3.1Å; A263-G266 PolarHBondContact O-N 3.3Å; A263-G266 VanDerWaalsContact O-N 3.1Å
264	W	91	Very high	84.9	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-25.8	-174.6	66	-91.8	0	0	0	113	Y59 V63 T66 L67 F71 S123 P126 E127 G262 F268	Y59-W264 VanDerWaalsContact CE1-O 3.25Å; Y59-W264 WeakPolarHBondContact CE1-O 3.29Å; Y59-W264 VanDerWaalsContact CZ-O 3.31Å; Y59-W264 PolarHBondContact OH-O 3.42Å; V63-W264 HydrophobicContact CB-CB 3.97Å; V63-W264 HydrophobicContact CG1-CB 4.15Å; V63-W264 HydrophobicContact CG2-CB 4.4Å; T66-W264 HydrophobicContact CG2-CB 4.01Å; T66-W264 HydrophobicContact CG2-CG 4.35Å; L67-W264 HydrophobicContact CD2-CD2 3.65Å; L67-W264 HydrophobicContact CD2-CE3 3.52Å; L67-W264 HydrophobicContact CD2-CG 4.24Å; L67-W264 HydrophobicContact CD2-CH2 4.32Å; L67-W264 HydrophobicContact CD2-CZ2 4.41Å; L67-W264 HydrophobicContact CD2-CZ3 3.88Å; L67-W264 HydrophobicContact CG-CE3 4.47Å; F71-W264 HydrophobicContact CE2-CZ2 4.29Å; F71-W264 HydrophobicContact CZ-CZ2 4.11Å; S123-W264 VanDerWaalsContact O-CZ3 3.24Å; S123-W264 WeakPolarHBondContact O-CZ3 3.09Å; P126-W264 HydrophobicContact CB-CH2 3.79Å; P126-W264 HydrophobicContact CB-CZ2 4.2Å; P126-W264 HydrophobicContact CG-CH2 4.16Å; E127-W264 HydrophobicContact CB-CH2 4.45Å; E127-W264 HydrophobicContact CB-CZ2 3.91Å; E127-W264 WeakPolarHBondContact OE2-CZ2 3.42Å; E127-W264 PolarHBondContact OE2-NE1 3.5Å; G262-W264 PolarHBondContact O-N 3.22Å; W264-F268 HydrophobicContact CE3-CD2 4.18Å; W264-F268 AromaticContact CE3-CE2 3.97Å; W264-F268 HydrophobicContact CE3-CE2 3.97Å; W264-F268 HydrophobicContact CZ3-CD2 4.17Å; W264-F268 HydrophobicContact CZ3-CE2 4.1Å; W264-F268 WeakPolarHBondContact O-CD2 3.48Å
265	W	92	Very high	86.2	Confident	26 Å²	26	33.7 Å²	33.7	10%	0.098	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-27.6	178.1	58	-93.5	0	0	0	113.3	A124 E127 F128 V241 V244 A263 G267 F268 L269	A124-W265 HydrophobicContact CB-CB 4.29Å; E127-W265 HydrophobicContact CB-CB 4.03Å; E127-W265 HydrophobicContact CB-CG 3.94Å; E127-W265 VanDerWaalsContact CG-CD1 3.41Å; E127-W265 HydrophobicContact CG-CG 3.97Å; F128-W265 HydrophobicContact CE2-CE3 4.16Å; F128-W265 HydrophobicContact CZ-CD2 4.3Å; F128-W265 AromaticContact CZ-CE3 3.68Å; F128-W265 HydrophobicContact CZ-CE3 3.68Å; F128-W265 HydrophobicContact CZ-CH2 4.49Å; F128-W265 AromaticContact CZ-CZ3 3.8Å; F128-W265 HydrophobicContact CZ-CZ3 3.8Å; V241-W265 PolarHBondContact O-NE1 3.11Å; V244-W265 HydrophobicContact CG2-CH2 4Å; V244-W265 HydrophobicContact CG2-CZ2 4.14Å; A263-W265 PolarHBondContact O-N 3.1Å; W265-G267 PolarHBondContact O-N 3.36Å; W265-F268 WeakPolarHBondContact O-CB 3.08Å; W265-F268 PolarHBondContact O-N 2.75Å; W265-L269 HydrophobicContact CE3-CD1 3.68Å; W265-L269 HydrophobicContact CE3-CG 4.34Å; W265-L269 HydrophobicContact CZ3-CD1 3.57Å; W265-L269 PolarHBondContact O-N 2.91Å
266	G	91.8	Very high	87.4	Confident	21 Å²	21	36 Å²	36	22%	0.216	19%	0.192	C	C	.	.	H	α-helix	trans	-64.4	-42.9	-169.8	0	0	0	0	0	113.6	A263 F268 L269 L270	A263-G266 PolarHBondContact O-N 3.3Å; A263-G266 VanDerWaalsContact O-N 3.1Å; G266-F268 VanDerWaalsContact C-N 3.29Å; G266-F268 PolarHBondContact O-N 3.36Å; G266-L269 PolarHBondContact O-N 3.23Å; G266-L270 PolarHBondContact O-N 3.37Å
267	G	93.4	Very high	88.8	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-69.6	-25	178.5	0	0	0	0	0	113.5	Y59 W265 L270 C271	Y59-G267 WeakPolarHBondContact OH-CA 3.3Å; Y59-G267 PolarHBondContact OH-N 3.24Å; W265-G267 PolarHBondContact O-N 3.36Å; G267-L270 PolarHBondContact O-N 3.1Å; G267-C271 WeakPolarHBondContact O-CB 3.41Å; G267-C271 PolarHBondContact O-N 3.05Å; G267-C271 PolarHBondContact O-SG 3.06Å
268	F	96.1	Very high	90.2	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-66.9	-36.9	172.7	-74.6	-58	0	0	0	112	V56 Y59 L60 V63 A124 W264 W265 G266 C271 G272	V56-F268 HydrophobicContact CG2-CD1 4.11Å; V56-F268 HydrophobicContact CG2-CE1 4.31Å; Y59-F268 AromaticContact CD1-CD1 3.81Å; Y59-F268 HydrophobicContact CD1-CD1 3.81Å; Y59-F268 HydrophobicContact CD1-CD2 4.26Å; Y59-F268 AromaticContact CD1-CE1 3.75Å; Y59-F268 HydrophobicContact CD1-CE1 3.75Å; Y59-F268 HydrophobicContact CD1-CE2 4.21Å; Y59-F268 HydrophobicContact CD1-CG 4.05Å; Y59-F268 AromaticContact CD1-CZ 3.95Å; Y59-F268 HydrophobicContact CD1-CZ 3.95Å; Y59-F268 HydrophobicContact CE1-CB 4.47Å; Y59-F268 HydrophobicContact CE1-CD1 4.07Å; Y59-F268 AromaticContact CE1-CD2 3.72Å; Y59-F268 HydrophobicContact CE1-CD2 3.72Å; Y59-F268 HydrophobicContact CE1-CE1 4.19Å; Y59-F268 AromaticContact CE1-CE2 3.85Å; Y59-F268 HydrophobicContact CE1-CE2 3.85Å; Y59-F268 AromaticContact CE1-CG 3.81Å; Y59-F268 HydrophobicContact CE1-CG 3.81Å; Y59-F268 HydrophobicContact CE1-CZ 4.08Å; L60-F268 HydrophobicContact CB-CE1 4.32Å; L60-F268 HydrophobicContact CB-CZ 4.22Å; L60-F268 HydrophobicContact CD1-CZ 3.99Å; V63-F268 HydrophobicContact CG2-CE2 4.16Å; V63-F268 HydrophobicContact CG2-CZ 4.25Å; A124-F268 HydrophobicContact CB-CB 3.96Å; W264-F268 HydrophobicContact CE3-CD2 4.18Å; W264-F268 AromaticContact CE3-CE2 3.97Å; W264-F268 HydrophobicContact CE3-CE2 3.97Å; W264-F268 HydrophobicContact CZ3-CD2 4.17Å; W264-F268 HydrophobicContact CZ3-CE2 4.1Å; W264-F268 WeakPolarHBondContact O-CD2 3.48Å; W265-F268 WeakPolarHBondContact O-CB 3.08Å; W265-F268 PolarHBondContact O-N 2.75Å; G266-F268 VanDerWaalsContact C-N 3.29Å; G266-F268 PolarHBondContact O-N 3.36Å; F268-C271 PolarHBondContact O-N 3.32Å; F268-G272 PolarHBondContact O-N 2.94Å
269	L	95.3	Very high	91.7	Very high	62 Å²	62	32.9 Å²	32.9	33%	0.325	17%	0.167	S	C	.	.	H	α-helix	trans	-65.1	-44.8	174.3	-62.2	-179.2	0	0	0	111.7	L121 A124 F128 W265 G266 G272 A273	L121-L269 HydrophobicContact CD2-CD2 3.72Å; A124-L269 HydrophobicContact CB-CD2 3.69Å; A124-L269 HydrophobicContact CB-CG 4.06Å; F128-L269 HydrophobicContact CZ-CD1 4.2Å; W265-L269 HydrophobicContact CE3-CD1 3.68Å; W265-L269 HydrophobicContact CE3-CG 4.34Å; W265-L269 HydrophobicContact CZ3-CD1 3.57Å; W265-L269 PolarHBondContact O-N 2.91Å; G266-L269 PolarHBondContact O-N 3.23Å; L269-G272 PolarHBondContact O-N 3.47Å; L269-A273 PolarHBondContact O-N 3.36Å
270	L	95.6	Very high	92.9	Very high	88 Å²	88	34 Å²	34	46%	0.461	18%	0.178	S	C	.	.	H	α-helix	trans	-62	-46.6	176.1	-179	62.9	0	0	0	111.1	L232 G266 G267 G272 A273 L274	L232-L270 HydrophobicContact CD1-CD2 3.67Å; L232-L270 HydrophobicContact CD2-CD2 3.97Å; G266-L270 PolarHBondContact O-N 3.37Å; G267-L270 PolarHBondContact O-N 3.1Å; L270-G272 VanDerWaalsContact C-N 3.34Å; L270-G272 PolarHBondContact O-N 3.46Å; L270-A273 PolarHBondContact O-N 3.15Å; L270-L274 HydrophobicContact CG-CD1 4.32Å; L270-L274 WeakPolarHBondContact O-CG 3.28Å; L270-L274 PolarHBondContact O-N 3.49Å
271	C	96.6	Very high	93.6	Very high	1 Å²	1	35.7 Å²	35.7	1%	0.007	19%	0.19	C	C	.	.	H	α-helix	trans	-60.6	-42.8	175.9	-71.1	0	0	0	0	111.9	V56 G267 F268 A273 L274 L275	V56-C271 HydrophobicContact CB-CB 3.86Å; V56-C271 HydrophobicContact CG2-CB 3.9Å; G267-C271 WeakPolarHBondContact O-CB 3.41Å; G267-C271 PolarHBondContact O-N 3.05Å; G267-C271 PolarHBondContact O-SG 3.06Å; F268-C271 PolarHBondContact O-N 3.32Å; C271-A273 PolarHBondContact O-N 2.9Å; C271-L274 PolarHBondContact O-N 3.26Å; C271-L275 WeakPolarHBondContact O-CB 3.46Å; C271-L275 WeakPolarHBondContact O-CD1 3.41Å; C271-L275 VanDerWaalsContact O-CG 3.25Å; C271-L275 WeakPolarHBondContact O-CG 3.46Å; C271-L275 PolarHBondContact O-N 2.95Å
272	G	96.9	Very high	94.1	Very high	2 Å²	2	35.4 Å²	35.4	2%	0.021	19%	0.188	C	C	.	.	H	α-helix	trans	-59.6	-43.6	176.1	0	0	0	0	0	112.4	A117 F268 L269 L270 L275 F276	A117-G272 WeakPolarHBondContact CB-O 3.43Å; F268-G272 PolarHBondContact O-N 2.94Å; L269-G272 PolarHBondContact O-N 3.47Å; L270-G272 VanDerWaalsContact C-N 3.34Å; L270-G272 PolarHBondContact O-N 3.46Å; G272-L275 PolarHBondContact O-N 2.89Å; G272-F276 VanDerWaalsContact O-CB 3.32Å; G272-F276 WeakPolarHBondContact O-CB 3.25Å; G272-F276 PolarHBondContact O-N 3.19Å
273	A	96.9	Very high	94.5	Very high	39 Å²	39	38.6 Å²	38.6	32%	0.322	20%	0.202	S	C	.	.	H	α-helix	trans	-62.7	-47.8	174.4	0	0	0	0	0	111.8	L269 L270 C271 L275 F276 F277	L269-A273 PolarHBondContact O-N 3.36Å; L270-A273 PolarHBondContact O-N 3.15Å; C271-A273 PolarHBondContact O-N 2.9Å; A273-L275 VanDerWaalsContact C-N 3.34Å; A273-L275 PolarHBondContact O-N 3.29Å; A273-F276 PolarHBondContact O-N 2.97Å; A273-F277 HydrophobicContact CB-CD2 4.45Å; A273-F277 HydrophobicContact CB-CE2 4.32Å; A273-F277 WeakPolarHBondContact O-CD2 3.42Å; A273-F277 PolarHBondContact O-N 3.39Å
274	L	96.1	Very high	94.4	Very high	76 Å²	76	39.9 Å²	39.9	40%	0.398	22%	0.216	S	C	.	.	H	α-helix	trans	-59.3	-44	177.9	-70.3	174.3	0	0	0	112	A52 L270 C271 S278	A52-L274 HydrophobicContact CB-CB 4.13Å; L270-L274 HydrophobicContact CG-CD1 4.32Å; L270-L274 WeakPolarHBondContact O-CG 3.28Å; L270-L274 PolarHBondContact O-N 3.49Å; C271-L274 PolarHBondContact O-N 3.26Å; L274-S278 WeakPolarHBondContact O-CB 3.42Å; L274-S278 PolarHBondContact O-N 2.81Å; L274-S278 PolarHBondContact O-OG 3.44Å
275	L	96.9	Very high	94.4	Very high	0 Å²	0	40 Å²	40	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-62.4	-45.5	175.6	-74	165.1	0	0	0	111.4	L49 A52 V56 M116 A117 A120 L187 C271 G272 A273 S279	L49-L275 HydrophobicContact CD1-CD2 4.12Å; A52-L275 HydrophobicContact CB-CD2 3.72Å; A52-L275 HydrophobicContact CB-CG 3.99Å; V56-L275 HydrophobicContact CB-CD1 4.46Å; V56-L275 HydrophobicContact CG1-CD1 4.17Å; M116-L275 HydrophobicContact CB-CD1 4Å; M116-L275 HydrophobicContact CB-CD2 4.2Å; M116-L275 HydrophobicContact CE-CD2 3.89Å; M116-L275 HydrophobicContact SD-CD2 4.27Å; A117-L275 HydrophobicContact CB-CB 3.93Å; A120-L275 HydrophobicContact CB-CD1 4.19Å; L187-L275 HydrophobicContact CD2-CD1 4.43Å; C271-L275 WeakPolarHBondContact O-CB 3.46Å; C271-L275 WeakPolarHBondContact O-CD1 3.41Å; C271-L275 VanDerWaalsContact O-CG 3.25Å; C271-L275 WeakPolarHBondContact O-CG 3.46Å; C271-L275 PolarHBondContact O-N 2.95Å; G272-L275 PolarHBondContact O-N 2.89Å; A273-L275 VanDerWaalsContact C-N 3.34Å; A273-L275 PolarHBondContact O-N 3.29Å; L275-S279 WeakPolarHBondContact O-CB 3.43Å; L275-S279 PolarHBondContact O-N 3.02Å
276	F	97.3	Very high	94.1	Very high	96 Å²	96	41 Å²	41	42%	0.421	23%	0.226	S	C	.	.	H	α-helix	trans	-62.6	-50.1	-179.5	-178.8	-100.1	0	0	0	112.3	A117 G272 A273 S279 L280	A117-F276 HydrophobicContact CB-CB 3.94Å; G272-F276 VanDerWaalsContact O-CB 3.32Å; G272-F276 WeakPolarHBondContact O-CB 3.25Å; G272-F276 PolarHBondContact O-N 3.19Å; A273-F276 PolarHBondContact O-N 2.97Å; F276-S279 WeakPolarHBondContact O-CB 3.48Å; F276-S279 PolarHBondContact O-N 2.87Å; F276-L280 PolarHBondContact O-N 2.98Å
277	F	96	Very high	93.8	Very high	134 Å²	134	45.2 Å²	45.2	59%	0.588	24%	0.24	S	C	*	.	H	α-helix	trans	-67.4	-41.9	-179.8	-71.6	-63.8	0	0	0	112.2	A273 S279 L280	A273-F277 HydrophobicContact CB-CD2 4.45Å; A273-F277 HydrophobicContact CB-CE2 4.32Å; A273-F277 WeakPolarHBondContact O-CD2 3.42Å; A273-F277 PolarHBondContact O-N 3.39Å; F277-S279 VanDerWaalsContact C-N 3.28Å; F277-S279 PolarHBondContact O-N 2.88Å; F277-L280 PolarHBondContact O-N 3.36Å
278	S	95	Very high	93.2	Very high	15 Å²	15	48.9 Å²	48.9	11%	0.105	27%	0.266	C	S	.	.	H	α-helix	trans	-63.4	-37.9	176.2	-56.8	0	0	0	0	111.4	L274 L281	L274-S278 WeakPolarHBondContact O-CB 3.42Å; L274-S278 PolarHBondContact O-N 2.81Å; L274-S278 PolarHBondContact O-OG 3.44Å; S278-L281 PolarHBondContact O-N 2.84Å
279	S	95.4	Very high	92.4	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-65.9	-40	176.3	178	0	0	0	0	113	G110 I114 L275 F276 F277 L281 M282 F283	G110-S279 VanDerWaalsContact C-OG 3.29Å; G110-S279 VanDerWaalsContact CA-OG 3.29Å; G110-S279 WeakPolarHBondContact CA-OG 3.41Å; G110-S279 PolarHBondContact O-OG 3.3Å; I114-S279 PolarHBondContact N-OG 3.28Å; L275-S279 WeakPolarHBondContact O-CB 3.43Å; L275-S279 PolarHBondContact O-N 3.02Å; F276-S279 WeakPolarHBondContact O-CB 3.48Å; F276-S279 PolarHBondContact O-N 2.87Å; F277-S279 VanDerWaalsContact C-N 3.28Å; F277-S279 PolarHBondContact O-N 2.88Å; S279-L281 PolarHBondContact O-N 3.23Å; S279-M282 VanDerWaalsContact O-CB 3.25Å; S279-M282 WeakPolarHBondContact O-CB 3.48Å; S279-M282 PolarHBondContact O-N 3.23Å; S279-F283 WeakPolarHBondContact O-CD2 3.26Å
280	L	94.5	Very high	91.3	Very high	101 Å²	101	50.5 Å²	50.5	53%	0.529	28%	0.279	S	S	.	.	H	α-helix	trans	-59.2	-34.4	-179.2	-172.2	61.8	0	0	0	112.2	F276 F277 M282 F283	F276-L280 PolarHBondContact O-N 2.98Å; F277-L280 PolarHBondContact O-N 3.36Å; L280-M282 PolarHBondContact O-N 2.77Å; L280-F283 PolarHBondContact O-N 3.37Å
281	L	91.9	Very high	89.6	Confident	73 Å²	73	52.3 Å²	52.3	38%	0.382	30%	0.296	S	S	.	.	H	α-helix	trans	-59.8	-29.3	175.6	-60.7	177.2	0	0	0	112.4	F36 S278 S279 F283 G284 F285	F36-L281 WeakPolarHBondContact CE1-O 3.39Å; F36-L281 HydrophobicContact CZ-CD2 4.48Å; S278-L281 PolarHBondContact O-N 2.84Å; S279-L281 PolarHBondContact O-N 3.23Å; L281-F283 VanDerWaalsContact C-N 3.34Å; L281-F283 PolarHBondContact O-N 2.9Å; L281-G284 PolarHBondContact O-N 3.47Å; L281-F285 VanDerWaalsContact O-CD2 3.3Å; L281-F285 WeakPolarHBondContact O-CD2 3.49Å; L281-F285 VanDerWaalsContact O-CE2 3.22Å; L281-F285 WeakPolarHBondContact O-CE2 3.39Å
282	M	92.8	Very high	87.5	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-68.6	-30	-178.2	-69	-62.7	149.3	0	0	113.8	F42 S45 E46 L49 P106 I109 S279 L280 G284 F285	F42-M282 HydrophobicContact CD2-SD 4.37Å; F42-M282 HydrophobicContact CE2-SD 3.88Å; S45-M282 WeakPolarHBondContact O-CE 3.37Å; E46-M282 HydrophobicContact CB-CE 4.06Å; L49-M282 HydrophobicContact CD2-CG 4.42Å; P106-M282 WeakPolarHBondContact O-CB 3.19Å; I109-M282 HydrophobicContact CG2-CG 4.03Å; I109-M282 HydrophobicContact CG2-SD 4.26Å; S279-M282 VanDerWaalsContact O-CB 3.25Å; S279-M282 WeakPolarHBondContact O-CB 3.48Å; S279-M282 PolarHBondContact O-N 3.23Å; L280-M282 PolarHBondContact O-N 2.77Å; M282-G284 PolarHBondContact O-N 3.19Å; M282-F285 PolarHBondContact O-N 3.5Å; M282-F285 HydrophobicContact SD-CD2 4.35Å; M282-F285 HydrophobicContact SD-CE2 4.39Å
283	F	92.5	Very high	84.8	Confident	69 Å²	69	63.3 Å²	63.3	30%	0.303	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-19	179.7	-69.3	-84.9	0	0	0	113.2	R107 I114 S279 L280 L281 F285	R107-F283 HydrophobicContact CB-CD1 4.45Å; R107-F283 HydrophobicContact CG-CD1 4.15Å; I114-F283 HydrophobicContact CD1-CE2 3.55Å; I114-F283 HydrophobicContact CD1-CZ 3.67Å; I114-F283 HydrophobicContact CG1-CE2 4.3Å; S279-F283 WeakPolarHBondContact O-CD2 3.26Å; L280-F283 PolarHBondContact O-N 3.37Å; L281-F283 VanDerWaalsContact C-N 3.34Å; L281-F283 PolarHBondContact O-N 2.9Å; F283-F285 VanDerWaalsContact C-N 3.35Å
284	G	88.6	Confident	82.1	Confident	35 Å²	35	64.4 Å²	64.4	36%	0.361	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-18.7	178.9	0	0	0	0	0	114.6	F36 L281 M282	F36-G284 WeakPolarHBondContact CB-O 3.38Å; L281-G284 PolarHBondContact O-N 3.47Å; M282-G284 PolarHBondContact O-N 3.19Å
285	F	90.1	Very high	79.5	Confident	3 Å²	3	66.5 Å²	66.5	1%	0.013	38%	0.376	C	S	.	.	S	Bend	trans	-82.7	143.4	-175.5	-66.3	-83.7	0	0	0	112.5	F36 I41 F42 H104 P106 L281 M282 F283	F36-F285 HydrophobicContact CB-CD1 4.03Å; F36-F285 HydrophobicContact CB-CE1 4.2Å; F36-F285 HydrophobicContact CB-CG 4.39Å; F36-F285 HydrophobicContact CD1-CD1 4.26Å; F36-F285 AromaticContact CD1-CD2 3.97Å; F36-F285 HydrophobicContact CD1-CD2 3.97Å; F36-F285 AromaticContact CD1-CE1 3.94Å; F36-F285 HydrophobicContact CD1-CE1 3.94Å; F36-F285 AromaticContact CD1-CE2 3.68Å; F36-F285 HydrophobicContact CD1-CE2 3.68Å; F36-F285 HydrophobicContact CD1-CG 4.26Å; F36-F285 AromaticContact CD1-CZ 3.65Å; F36-F285 HydrophobicContact CD1-CZ 3.65Å; F36-F285 HydrophobicContact CE1-CE2 4.15Å; F36-F285 HydrophobicContact CE1-CZ 4.29Å; F36-F285 WeakPolarHBondContact O-CD1 3.47Å; I41-F285 HydrophobicContact CB-CE1 4.48Å; I41-F285 HydrophobicContact CG2-CE1 4.31Å; I41-F285 HydrophobicContact CG2-CZ 4Å; F42-F285 VanDerWaalsContact CA-CE1 3.43Å; F42-F285 HydrophobicContact CB-CD1 3.93Å; F42-F285 HydrophobicContact CB-CE1 3.55Å; F42-F285 HydrophobicContact CB-CZ 3.91Å; F42-F285 HydrophobicContact CD2-CB 4.38Å; F42-F285 AromaticContact CD2-CD1 3.92Å; F42-F285 HydrophobicContact CD2-CD1 3.92Å; F42-F285 AromaticContact CD2-CD2 3.92Å; F42-F285 HydrophobicContact CD2-CD2 3.92Å; F42-F285 HydrophobicContact CD2-CE1 4.18Å; F42-F285 HydrophobicContact CD2-CE2 4.14Å; F42-F285 AromaticContact CD2-CG 3.81Å; F42-F285 HydrophobicContact CD2-CG 3.81Å; F42-F285 HydrophobicContact CD2-CZ 4.27Å; F42-F285 HydrophobicContact CG-CD1 4.43Å; F42-F285 HydrophobicContact CG-CE1 4.39Å; F42-F285 VanDerWaalsContact N-CE1 3.34Å; H104-F285 PolarHBondContact CE1-O 3.49Å; P106-F285 HydrophobicContact CB-CB 3.82Å; P106-F285 HydrophobicContact CG-CB 4.02Å; L281-F285 VanDerWaalsContact O-CD2 3.3Å; L281-F285 WeakPolarHBondContact O-CD2 3.49Å; L281-F285 VanDerWaalsContact O-CE2 3.22Å; L281-F285 WeakPolarHBondContact O-CE2 3.39Å; M282-F285 PolarHBondContact O-N 3.5Å; M282-F285 HydrophobicContact SD-CD2 4.35Å; M282-F285 HydrophobicContact SD-CE2 4.39Å; F283-F285 VanDerWaalsContact C-N 3.35Å
286	P	86.6	Confident	76.9	Confident	45 Å²	45	69.4 Å²	69.4	29%	0.292	40%	0.4	S	S	.	.			trans	-72.6	166.1	174.8	31.9	-35.4	0	0	0	112	F36 Y201 S288 L289	F36-P286 WeakPolarHBondContact O-CD 3.39Å; Y201-P286 PolarHBondContact OH-O 3.22Å; P286-S288 VanDerWaalsContact C-N 3.25Å; P286-S288 PolarHBondContact O-N 3.32Å; P286-L289 HydrophobicContact CG-CD2 3.98Å
287	Q	85.4	Confident	74.4	Confident	110 Å²	110	68.3 Å²	68.3	51%	0.514	40%	0.397	S	S	.	.	S	Bend	trans	-63.8	-32.6	176.2	-175.8	170.9	7.4	0	0	112.7	H104 Y201	H104-Q287 PolarHBondContact CE1-N 3.3Å; H104-Q287 PolarHBondContact NE2-N 2.71Å; H104-Q287 VanDerWaalsContact NE2-N 3.19Å; Y201-Q287 WeakPolarHBondContact CE2-O 3.32Å
288	S	80.8	Confident	71.6	Confident	78 Å²	78	69.7 Å²	69.7	55%	0.545	41%	0.405	S	S	.	.	S	Bend	trans	-142.4	135.1	176.6	56.7	0	0	0	0	109.1	H205 P286	H205-S288 WeakPolarHBondContact NE2-CA 3.49Å; P286-S288 VanDerWaalsContact C-N 3.25Å; P286-S288 PolarHBondContact O-N 3.32Å
289	L	80.1	Confident	68.9	Low	21 Å²	21	72.7 Å²	72.7	11%	0.11	43%	0.426	C	S	.	.	P	Polyproline II helix	trans	-73.2	139.6	174.1	-68.8	168.9	0	0	0	110.3	I39 Y201 H205 P286	I39-L289 HydrophobicContact CB-CD1 3.67Å; I39-L289 HydrophobicContact CD1-CD1 3.75Å; I39-L289 HydrophobicContact CG1-CD1 4.19Å; Y201-L289 HydrophobicContact CE1-CD1 4.27Å; Y201-L289 HydrophobicContact CE1-CG 4.49Å; H205-L289 HydrophobicContact CB-CD1 3.96Å; H205-L289 PolarHBondContact CD2-N 2.98Å; H205-L289 PolarHBondContact NE2-N 3.25Å; H205-L289 VanDerWaalsContact NE2-N 3.12Å; P286-L289 HydrophobicContact CG-CD2 3.98Å
290	P	71.6	Confident	66.3	Low	75 Å²	75	79.5 Å²	79.5	49%	0.487	46%	0.458	S	S	.	.	P	Polyproline II helix	trans	-61.7	139.2	172.8	24.5	-30.3	0	0	0	109.8	S37 H292	S37-P290 VanDerWaalsContact OG-CD 3.3Å; S37-P290 WeakPolarHBondContact OG-CD 3.36Å; S37-P290 VanDerWaalsContact OG-CG 3.26Å; S37-P290 WeakPolarHBondContact OG-CG 3.34Å; P290-H292 PolarHBondContact O-N 2.95Å
291	P	60.5	Low	63.6	Low	126 Å²	126	80.1 Å²	80.1	82%	0.818	46%	0.459	S	S	*	.	P	Polyproline II helix	trans	-59.5	126.5	178.6	21.6	-30.4	0	0	0	110	S293	P291-S293 PolarHBondContact O-N 3.49Å; P291-S293 VanDerWaalsContact O-N 3.17Å
292	H	52.6	Low	61.1	Low	134 Å²	134	80.8 Å²	80.8	62%	0.62	48%	0.475	S	S	*	.			trans	-72.7	106.7	177.6	-132.3	-80.6	0	0	0	108.5	P290 D294	P290-H292 PolarHBondContact O-N 2.95Å; H292-D294 IonicContact CE1-OD1 2.72Å; H292-D294 IonicContact ND1-OD1 3.78Å; H292-D294 PolarHBondContact ND1-OD1 3.28Å; H292-D294 PolarHBondContact O-N 3.03Å
293	S	39.5	Very low	58.5	Low	100 Å²	100	88.6 Å²	88.6	70%	0.699	51%	0.513	S	S	*	.			trans	-81.9	82.1	168.9	57.5	0	0	0	0	108.7	P291 P295	P291-S293 PolarHBondContact O-N 3.49Å; P291-S293 VanDerWaalsContact O-N 3.17Å; S293-P295 WeakPolarHBondContact O-CD 3.26Å
294	D	40.6	Very low	55.7	Low	62 Å²	62	92.1 Å²	92.1	33%	0.332	53%	0.534	S	S	.	.			trans	-75.3	126	169.5	-73.6	-22.3	0	0	0	108.7	R207 H292 A296 M297	R207-D294 IonicContact NH2-OD2 3.94Å; H292-D294 IonicContact CE1-OD1 2.72Å; H292-D294 IonicContact ND1-OD1 3.78Å; H292-D294 PolarHBondContact ND1-OD1 3.28Å; H292-D294 PolarHBondContact O-N 3.03Å; D294-A296 PolarHBondContact O-N 2.76Å; D294-A296 VanDerWaalsContact O-N 3.12Å; D294-M297 WeakPolarHBondContact O-CB 3.34Å; D294-M297 PolarHBondContact O-N 2.69Å
295	P	40.9	Very low	53.1	Low	119 Å²	119	96.2 Å²	96.2	77%	0.773	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.5	-6.2	179.4	23.9	-31.6	0	0	0	114.5	S293 M297	S293-P295 WeakPolarHBondContact O-CD 3.26Å; P295-M297 PolarHBondContact O-N 2.94Å
296	A	43.3	Very low	50.4	Low	62 Å²	62	105.9 Å²	105.9	51%	0.512	60%	0.6	S	S	.	*	T	Hydrogen-bonded Turn	trans	-75	-9.6	165.9	0	0	0	0	0	112.8	D294 S299	D294-A296 PolarHBondContact O-N 2.76Å; D294-A296 VanDerWaalsContact O-N 3.12Å; A296-S299 PolarHBondContact O-OG 3.34Å; A296-S299 VanDerWaalsContact O-OG 3.11Å
297	M	43.3	Very low	47.9	Very low	73 Å²	73	115.1 Å²	115.1	36%	0.36	63%	0.629	S	S	.	*	H	α-helix	trans	-74.7	-34.5	-177.4	-162.7	151.6	69.2	0	0	112	D294 P295 S299 Q301	D294-M297 WeakPolarHBondContact O-CB 3.34Å; D294-M297 PolarHBondContact O-N 2.69Å; P295-M297 PolarHBondContact O-N 2.94Å; M297-S299 PolarHBondContact O-N 3.26Å; M297-Q301 PolarHBondContact O-N 3.36Å; M297-Q301 PolarHBondContact O-OE1 3.25Å
298	E	38.2	Very low	45.4	Very low	162 Å²	162	118.8 Å²	118.8	76%	0.757	65%	0.646	S	S	*	*	H	α-helix	trans	-71.9	-28.9	176.7	-81.6	-178.9	146.4	0	0	113.2	A302	E298-A302 PolarHBondContact O-N 3.45Å
299	S	37.8	Very low	43.4	Very low	78 Å²	78	125.3 Å²	125.3	55%	0.545	66%	0.66	S	S	.	*	H	α-helix	trans	-78.7	-29.3	-176.5	60.9	0	0	0	0	113.9	A296 M297	A296-S299 PolarHBondContact O-OG 3.34Å; A296-S299 VanDerWaalsContact O-OG 3.11Å; M297-S299 PolarHBondContact O-N 3.26Å
300	E	40.4	Very low	41.2	Very low	144 Å²	144	131.4 Å²	131.4	67%	0.673	69%	0.688	S	S	*	*	H	α-helix	trans	-82.7	-25.3	173.9	-78	-168.2	120.9	0	0	112.4	A302	E300-A302 VanDerWaalsContact C-N 3.33Å
301	Q	37.6	Very low	39.1	Very low	114 Å²	114	138.7 Å²	138.7	53%	0.533	71%	0.706	S	S	.	*	H	α-helix	trans	-77	-14.9	176	-86.6	154.5	-20.6	0	0	113.9	M297	M297-Q301 PolarHBondContact O-N 3.36Å; M297-Q301 PolarHBondContact O-OE1 3.25Å
302	A	40.7	Very low	37.6	Very low	87 Å²	87	137.8 Å²	137.8	72%	0.719	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.4	-2.9	176.2	0	0	0	0	0	114.8	E298 E300	E298-A302 PolarHBondContact O-N 3.45Å; E300-A302 VanDerWaalsContact C-N 3.33Å
303	M	38.1	Very low	36.6	Very low	164 Å²	164	134.3 Å²	134.3	81%	0.808	68%	0.683	S	S	*	*	S	Bend	trans	-119.4	5.9	-167.7	-79.3	-99.6	-147.6	0	0	115.7
304	L	33.3	Very low	36.1	Very low	143 Å²	143	135.3 Å²	135.3	75%	0.749	69%	0.687	S	S	*	*	S	Bend	trans	-132.8	140.9	178.4	-71.4	171.6	0	0	0	112.6	E306	L304-E306 PolarHBondContact O-N 3.4Å
305	P	33.2	Very low	35.7	Very low	121 Å²	121	137.6 Å²	137.6	79%	0.786	71%	0.708	S	S	*	*			trans	-62.7	133.7	-178.7	-14.2	27.1	0	0	0	111.7	R307	P305-R307 PolarHBondContact O-N 2.03Å
306	E	34.3	Very low	35.3	Very low	205 Å²	205	135.8 Å²	135.8	96%	0.958	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.1	16.9	-167.9	-120.5	176.1	170.8	0	0	118	L304	L304-E306 PolarHBondContact O-N 3.4Å
307	R	34.6	Very low	34.9	Very low	240 Å²	240	137.1 Å²	137.1	91%	0.906	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.6	-2.2	-164.1	-105.5	-178.5	178.9	178.9	0.2	119.1	P305	P305-R307 PolarHBondContact O-N 2.03Å
308	E	32.9	Very low	34.3	Very low	186 Å²	186	139.1 Å²	139.1	87%	0.869	73%	0.727	S	S	*	*	S	Bend	trans	-145.4	5.2	-174.8	-124.9	172.5	-171.8	0	0	118.9
309	Y	38.5	Very low	33.8	Very low	215 Å²	215	138.5 Å²	138.5	84%	0.843	73%	0.728	S	S	*	*	S	Bend	trans	-138.3	81.4	-178	-124.9	-95.3	0	0	0	112.5
310	E	32.6	Very low	33.3	Very low	150 Å²	150	146.1 Å²	146.1	70%	0.701	75%	0.745	S	S	*	*			trans	177.3	87.8	135.9	-98.7	175.7	-165.9	0	0	108.6	P312	E310-P312 WeakPolarHBondContact O-CD 3.42Å
311	R	27.5	Very low	32.7	Very low	228 Å²	228	145.9 Å²	145.9	86%	0.86	74%	0.744	S	S	*	*			trans	-81.4	112.4	145.2	-117.1	-167	-87.3	-169.6	-5.7	105.1	K313	R311-K313 PolarHBondContact O-N 3.4Å
312	P	29.7	Very low	32.4	Very low	106 Å²	106	146.1 Å²	146.1	69%	0.688	76%	0.755	S	S	*	*			trans	-51.9	139.9	173	-21.1	30.8	0	0	0	108.7	E310 P314	E310-P312 WeakPolarHBondContact O-CD 3.42Å; P312-P314 WeakPolarHBondContact O-CD 3.37Å
313	K	31.3	Very low	32	Very low	62 Å²	62	148.9 Å²	148.9	27%	0.27	76%	0.757	S	S	.	*			trans	-52.4	126.9	164	-79.5	-178.9	170.1	-176.8	0	106	D203 V206 R311 S315	D203-K313 PolarHBondContact O-NZ 3.21Å; D203-K313 IonicContact OD1-NZ 2.63Å; D203-K313 PolarHBondContact OD1-NZ 3.01Å; D203-K313 VanDerWaalsContact OD1-NZ 3.14Å; D203-K313 IonicContact OD2-NZ 2.72Å; V206-K313 PolarHBondContact O-NZ 3.49Å; R311-K313 PolarHBondContact O-N 3.4Å; K313-S315 VanDerWaalsContact C-N 3.27Å; K313-S315 PolarHBondContact O-N 3.2Å
314	P	28.5	Very low	31.5	Very low	120 Å²	120	149.8 Å²	149.8	78%	0.779	76%	0.759	S	S	*	*			trans	-63.3	98.8	172.6	25.2	-30.3	0	0	0	106.8	P312 N316	P312-P314 WeakPolarHBondContact O-CD 3.37Å; P314-N316 PolarHBondContact O-N 2.94Å
315	S	32.9	Very low	31.7	Very low	110 Å²	110	148.7 Å²	148.7	77%	0.769	76%	0.761	S	S	*	*			trans	-51.8	115.1	158.5	154.3	0	0	0	0	105.2	K313	K313-S315 VanDerWaalsContact C-N 3.27Å; K313-S315 PolarHBondContact O-N 3.2Å
316	N	33.4	Very low	31.4	Very low	82 Å²	82	150.9 Å²	150.9	44%	0.439	77%	0.766	S	S	.	*	T	Hydrogen-bonded Turn	trans	9.2	116.3	169.1	-75.9	-16.8	0	0	0	115.3	P314 V318	P314-N316 PolarHBondContact O-N 2.94Å; N316-V318 VanDerWaalsContact C-N 3.27Å; N316-V318 PolarHBondContact O-N 2.88Å
317	G	33	Very low	31.6	Very low	89 Å²	89	145.9 Å²	145.9	92%	0.918	75%	0.754	S	S	*	*	T	Hydrogen-bonded Turn	trans	-28.1	76.2	172.3	0	0	0	0	0	117.3
318	V	31.1	Very low	31.7	Very low	115 Å²	115	139.6 Å²	139.6	70%	0.697	75%	0.747	S	S	*	*			trans	-123.6	76.9	160.9	-177.2	0	0	0	0	104.6	N316 R320	N316-V318 VanDerWaalsContact C-N 3.27Å; N316-V318 PolarHBondContact O-N 2.88Å; V318-R320 HydrophobicContact CG1-CG 4.17Å; V318-R320 PolarHBondContact O-N 3.35Å
319	L	28.5	Very low	31.9	Very low	150 Å²	150	135.1 Å²	135.1	79%	0.785	74%	0.741	S	S	*	*			trans	-65.4	91.9	157.9	-161.7	81.1	0	0	0	105.5	H321	L319-H321 PolarHBondContact O-N 3.34Å
320	R	27.4	Very low	32.1	Very low	237 Å²	237	127.7 Å²	127.7	89%	0.894	72%	0.72	S	S	*	*			trans	-70.8	80.5	161.1	-99	-175.6	175.4	164.4	-1.2	106.7	V318	V318-R320 HydrophobicContact CG1-CG 4.17Å; V318-R320 PolarHBondContact O-N 3.35Å
321	H	27	Very low	32.8	Very low	140 Å²	140	123.6 Å²	123.6	65%	0.648	71%	0.708	S	S	*	*			trans	-82	121	153	-118.2	-80.4	0	0	0	106.3	L319 L323	L319-H321 PolarHBondContact O-N 3.34Å; H321-L323 PolarHBondContact O-N 2.77Å; H321-L323 VanDerWaalsContact O-N 3.08Å
322	P	32.1	Very low	33.8	Very low	118 Å²	118	120.6 Å²	120.6	77%	0.766	70%	0.701	S	S	*	*			trans	-76.5	95.7	172.8	29	-27.7	0	0	0	107.5
323	L	32.1	Very low	35	Very low	146 Å²	146	122 Å²	122	76%	0.764	70%	0.699	S	S	*	*	S	Bend	trans	-166.5	107.5	160.9	-96.1	154.6	0	0	0	108	H321	H321-L323 PolarHBondContact O-N 2.77Å; H321-L323 VanDerWaalsContact O-N 3.08Å
324	E	28.4	Very low	35.8	Very low	182 Å²	182	123.9 Å²	123.9	85%	0.85	71%	0.708	S	S	*	*			trans	41.5	145.9	159.5	-66.1	-174.7	139	0	0	123.1
325	P	36.4	Very low	37.1	Very low	121 Å²	121	122.8 Å²	122.8	79%	0.786	70%	0.696	S	S	*	*			trans	-96.6	101.5	-168.4	35	-22.3	0	0	0	111.3
326	D	27.1	Very low	38.2	Very low	166 Å²	166	127 Å²	127	89%	0.888	70%	0.695	S	S	*	*			trans	-100.1	112.6	160.3	-96.6	-21	0	0	0	111.3
327	S	37.8	Very low	39.4	Very low	101 Å²	101	127 Å²	127	71%	0.706	70%	0.697	S	S	*	*			trans	-62.2	143.7	177.2	45	0	0	0	0	113.7
328	S	38.2	Very low	40.9	Very low	108 Å²	108	125.7 Å²	125.7	76%	0.755	67%	0.669	S	S	*	*			trans	80.8	57.1	152.5	75.7	0	0	0	0	120.1	S330	S328-S330 VanDerWaalsContact C-N 3.35Å; S328-S330 PolarHBondContact O-N 3.19Å; S328-S330 VanDerWaalsContact O-N 3.08Å
329	A	36.4	Very low	42.8	Very low	91 Å²	91	124.1 Å²	124.1	75%	0.752	66%	0.661	S	S	*	*			trans	-72.6	95.2	147.3	0	0	0	0	0	108.9
330	S	42.5	Very low	44.7	Very low	59 Å²	59	124.4 Å²	124.4	41%	0.413	66%	0.656	S	S	.	*			trans	-57.2	138.1	-174.7	172.6	0	0	0	0	113	S328 F332 Q333	S328-S330 VanDerWaalsContact C-N 3.35Å; S328-S330 PolarHBondContact O-N 3.19Å; S328-S330 VanDerWaalsContact O-N 3.08Å; S330-F332 PolarHBondContact O-N 3.24Å; S330-F332 PolarHBondContact OG-N 3.37Å; S330-Q333 WeakPolarHBondContact O-CB 3.38Å; S330-Q333 PolarHBondContact O-N 3.26Å
331	C	48.1	Very low	46.5	Very low	64 Å²	64	115.6 Å²	115.6	43%	0.432	63%	0.628	S	S	.	*	H	α-helix	trans	-39.5	-36.2	170.4	177.4	0	0	0	0	113.7	Q333 L335	C331-Q333 VanDerWaalsContact C-N 3.32Å; C331-Q333 PolarHBondContact O-N 3.4Å; C331-L335 PolarHBondContact O-N 2.91Å; C331-L335 VanDerWaalsContact O-N 3.15Å
332	F	48.9	Very low	48.6	Very low	165 Å²	165	110.5 Å²	110.5	72%	0.724	61%	0.607	S	S	*	*	H	α-helix	trans	-64.9	-30.2	177.7	-83.9	-87.2	0	0	0	114.3	S330 R336	S330-F332 PolarHBondContact O-N 3.24Å; S330-F332 PolarHBondContact OG-N 3.37Å; F332-R336 WeakPolarHBondContact O-CB 3.46Å; F332-R336 PolarHBondContact O-N 3.17Å
333	Q	53.3	Low	50.9	Low	137 Å²	137	112.1 Å²	112.1	64%	0.64	60%	0.602	S	S	*	*	H	α-helix	trans	-77.2	-35.9	-176	-144.1	152.3	-2.7	0	0	111.2	S330 C331 R336 V337	S330-Q333 WeakPolarHBondContact O-CB 3.38Å; S330-Q333 PolarHBondContact O-N 3.26Å; C331-Q333 VanDerWaalsContact C-N 3.32Å; C331-Q333 PolarHBondContact O-N 3.4Å; Q333-R336 PolarHBondContact O-N 3.03Å; Q333-V337 WeakPolarHBondContact O-CG2 3.09Å
334	Q	49.5	Very low	52.9	Low	100 Å²	100	111.9 Å²	111.9	47%	0.467	60%	0.597	S	S	.	*	H	α-helix	trans	-73.8	-35.2	173.9	-132.3	157.6	-5.3	0	0	111.7	Y98 R336 V337	Y98-Q334 PolarHBondContact OH-NE2 3.03Å; Y98-Q334 PolarHBondContact OH-OE1 2.83Å; Q334-R336 VanDerWaalsContact C-N 3.31Å; Q334-R336 PolarHBondContact O-N 3.16Å; Q334-V337 PolarHBondContact O-N 2.98Å
335	L	54.3	Low	55.1	Low	98 Å²	98	103.8 Å²	103.8	51%	0.513	56%	0.559	S	S	.	*	H	α-helix	trans	-68.6	-27.7	173.5	-145.3	77.7	0	0	0	112.6	C331 V337 I338 P339	C331-L335 PolarHBondContact O-N 2.91Å; C331-L335 VanDerWaalsContact O-N 3.15Å; L335-V337 VanDerWaalsContact C-N 3.29Å; L335-V337 PolarHBondContact O-N 3.27Å; L335-I338 HydrophobicContact CD1-CD1 3.87Å; L335-I338 HydrophobicContact CG-CD1 4.48Å; L335-I338 PolarHBondContact O-N 3.37Å; L335-P339 WeakPolarHBondContact O-CD 3.18Å
336	R	57.8	Low	57.3	Low	198 Å²	198	101 Å²	101	75%	0.747	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-18.7	177.9	-157.3	171.7	-168.3	163.5	2.6	113.7	F332 Q333 Q334	F332-R336 WeakPolarHBondContact O-CB 3.46Å; F332-R336 PolarHBondContact O-N 3.17Å; Q333-R336 PolarHBondContact O-N 3.03Å; Q334-R336 VanDerWaalsContact C-N 3.31Å; Q334-R336 PolarHBondContact O-N 3.16Å
337	V	58.2	Low	60	Low	81 Å²	81	97 Å²	97	49%	0.491	52%	0.522	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-30.2	176.1	-174.6	0	0	0	0	111.2	Q333 Q334 L335 K340 V341	Q333-V337 WeakPolarHBondContact O-CG2 3.09Å; Q334-V337 PolarHBondContact O-N 2.98Å; L335-V337 VanDerWaalsContact C-N 3.29Å; L335-V337 PolarHBondContact O-N 3.27Å; V337-K340 WeakPolarHBondContact O-CB 3.26Å; V337-K340 PolarHBondContact O-N 3Å; V337-K340 VanDerWaalsContact O-N 3.12Å; V337-V341 HydrophobicContact CG1-CG2 3.94Å; V337-V341 WeakPolarHBondContact O-CG2 3.44Å; V337-V341 PolarHBondContact O-N 2.99Å
338	I	64.4	Low	62.1	Low	63 Å²	63	94 Å²	94	32%	0.323	50%	0.498	S	S	.	.	H	α-helix	trans	-58.2	-50.2	-178.3	-59.9	174.3	0	0	0	112	L335 K340 V341 T342 Y572	L335-I338 HydrophobicContact CD1-CD1 3.87Å; L335-I338 HydrophobicContact CG-CD1 4.48Å; L335-I338 PolarHBondContact O-N 3.37Å; I338-K340 PolarHBondContact O-N 2.93Å; I338-V341 PolarHBondContact O-N 3.47Å; I338-T342 WeakPolarHBondContact O-CB 3.45Å; I338-T342 PolarHBondContact O-N 3.45Å; I338-T342 PolarHBondContact O-OG1 3.06Å; I338-Y572 PolarHBondContact O-OH 3.5Å
339	P	69.8	Low	64.3	Low	82 Å²	82	92 Å²	92	53%	0.532	48%	0.483	S	S	.	.	H	α-helix	trans	-59.5	-34.1	177.3	-23	30.8	0	0	0	113.2	L335 K343	L335-P339 WeakPolarHBondContact O-CD 3.18Å; P339-K343 WeakPolarHBondContact O-CB 3.3Å; P339-K343 PolarHBondContact O-N 3.47Å
340	K	68.8	Low	66.6	Low	156 Å²	156	87.7 Å²	87.7	68%	0.678	45%	0.447	S	S	*	.	H	α-helix	trans	-69.3	-44.3	178.7	-69.8	-175.6	176.8	-175	0	111.4	V337 I338 K343 H344	V337-K340 WeakPolarHBondContact O-CB 3.26Å; V337-K340 PolarHBondContact O-N 3Å; V337-K340 VanDerWaalsContact O-N 3.12Å; I338-K340 PolarHBondContact O-N 2.93Å; K340-K343 PolarHBondContact O-N 3.44Å; K340-H344 WeakPolarHBondContact O-CB 3.46Å; K340-H344 PolarHBondContact O-N 3.06Å
341	V	65.5	Low	68.7	Low	51 Å²	51	84.9 Å²	84.9	31%	0.309	43%	0.428	S	S	.	.	H	α-helix	trans	-70.5	-41.4	177.5	-177.1	0	0	0	0	111	V337 I338 K343 H344 L345 Y572	V337-V341 HydrophobicContact CG1-CG2 3.94Å; V337-V341 WeakPolarHBondContact O-CG2 3.44Å; V337-V341 PolarHBondContact O-N 2.99Å; I338-V341 PolarHBondContact O-N 3.47Å; V341-K343 VanDerWaalsContact C-N 3.33Å; V341-K343 PolarHBondContact O-N 3.17Å; V341-H344 PolarHBondContact O-N 3.22Å; V341-L345 WeakPolarHBondContact O-CB 3.13Å; V341-L345 PolarHBondContact O-N 2.87Å; V341-Y572 HydrophobicContact CB-CE1 4.29Å; V341-Y572 HydrophobicContact CG1-CD1 4.13Å; V341-Y572 HydrophobicContact CG1-CE1 3.57Å
342	T	71.8	Confident	70.7	Confident	33 Å²	33	83.5 Å²	83.5	20%	0.202	42%	0.417	C	S	.	.	H	α-helix	trans	-58.9	-46.1	172.5	-50.5	0	0	0	0	110.3	I338 H344 L345 L346 Y572 V576	I338-T342 WeakPolarHBondContact O-CB 3.45Å; I338-T342 PolarHBondContact O-N 3.45Å; I338-T342 PolarHBondContact O-OG1 3.06Å; T342-H344 PolarHBondContact O-N 3.41Å; T342-L345 PolarHBondContact O-N 3.39Å; T342-L346 HydrophobicContact CG2-CD1 3.75Å; T342-L346 HydrophobicContact CG2-CG 4.18Å; T342-L346 WeakPolarHBondContact O-CB 3.23Å; T342-L346 WeakPolarHBondContact O-CG 3.36Å; T342-L346 PolarHBondContact O-N 3.12Å; T342-Y572 WeakPolarHBondContact CA-OH 3.07Å; T342-Y572 PolarHBondContact N-OH 3.1Å; T342-Y572 VanDerWaalsContact N-OH 3.1Å; T342-Y572 PolarHBondContact OG1-OH 3.26Å; T342-V576 HydrophobicContact CG2-CG2 4.45Å
343	K	79	Confident	72.7	Confident	152 Å²	152	76.6 Å²	76.6	66%	0.661	39%	0.389	S	S	*	.	H	α-helix	trans	-62	-43.5	178.5	-176.8	179	-179.5	-179.3	0	111.5	P339 K340 V341 L346 S347	P339-K343 WeakPolarHBondContact O-CB 3.3Å; P339-K343 PolarHBondContact O-N 3.47Å; K340-K343 PolarHBondContact O-N 3.44Å; V341-K343 VanDerWaalsContact C-N 3.33Å; V341-K343 PolarHBondContact O-N 3.17Å; K343-L346 PolarHBondContact O-N 3.04Å; K343-S347 WeakPolarHBondContact O-CB 3.45Å; K343-S347 PolarHBondContact O-N 3.4Å; K343-S347 PolarHBondContact O-OG 3.32Å
344	H	75.4	Confident	74.5	Confident	142 Å²	142	70.2 Å²	70.2	66%	0.657	36%	0.359	S	S	*	.	H	α-helix	trans	-61.9	-44.1	176.5	-175.3	79.4	0	0	0	111.5	K340 V341 T342 S347	K340-H344 WeakPolarHBondContact O-CB 3.46Å; K340-H344 PolarHBondContact O-N 3.06Å; V341-H344 PolarHBondContact O-N 3.22Å; T342-H344 PolarHBondContact O-N 3.41Å; H344-S347 WeakPolarHBondContact O-CB 3.31Å; H344-S347 PolarHBondContact O-N 2.84Å
345	L	73.9	Confident	76.4	Confident	11 Å²	11	65.5 Å²	65.5	6%	0.058	34%	0.337	C	S	.	.	H	α-helix	trans	-66.1	-42.8	178.9	-164.4	70.7	0	0	0	112.2	V341 T342 S347 N348 F351 V565 Y572 A573 V576	V341-L345 WeakPolarHBondContact O-CB 3.13Å; V341-L345 PolarHBondContact O-N 2.87Å; T342-L345 PolarHBondContact O-N 3.39Å; L345-S347 PolarHBondContact O-N 3.47Å; L345-N348 WeakPolarHBondContact O-CB 3.44Å; L345-N348 PolarHBondContact O-N 2.87Å; L345-F351 HydrophobicContact CB-CE1 4.33Å; L345-F351 HydrophobicContact CD1-CD1 4.49Å; L345-F351 HydrophobicContact CD1-CE1 4.39Å; L345-F351 HydrophobicContact CD1-CE2 4.45Å; L345-F351 HydrophobicContact CD1-CZ 4.35Å; L345-F351 HydrophobicContact CD2-CD1 4.25Å; L345-F351 HydrophobicContact CD2-CE1 3.41Å; L345-F351 VanDerWaalsContact CD2-CE1 3.41Å; L345-F351 HydrophobicContact CD2-CE2 4.05Å; L345-F351 HydrophobicContact CD2-CZ 3.27Å; L345-F351 HydrophobicContact CG-CD1 3.71Å; L345-F351 HydrophobicContact CG-CD2 4.45Å; L345-F351 HydrophobicContact CG-CE1 3.38Å; L345-F351 HydrophobicContact CG-CE2 4.2Å; L345-F351 HydrophobicContact CG-CG 4.21Å; L345-F351 HydrophobicContact CG-CZ 3.63Å; L345-F351 VanDerWaalsContact O-CD1 3.31Å; L345-F351 WeakPolarHBondContact O-CD1 3.41Å; L345-V565 HydrophobicContact CD1-CG1 4.48Å; L345-Y572 HydrophobicContact CD2-CD1 3.97Å; L345-Y572 HydrophobicContact CD2-CE1 4.08Å; L345-A573 HydrophobicContact CD2-CB 4.06Å; L345-V576 HydrophobicContact CD2-CG2 4.23Å
346	L	81.7	Confident	78.2	Confident	63 Å²	63	63.3 Å²	63.3	33%	0.33	33%	0.326	S	S	.	.	H	α-helix	trans	-73.6	-12.2	174.9	-67	177.9	0	0	0	113.7	T342 K343 N348 F351 T352 V576 L580	T342-L346 HydrophobicContact CG2-CD1 3.75Å; T342-L346 HydrophobicContact CG2-CG 4.18Å; T342-L346 WeakPolarHBondContact O-CB 3.23Å; T342-L346 WeakPolarHBondContact O-CG 3.36Å; T342-L346 PolarHBondContact O-N 3.12Å; K343-L346 PolarHBondContact O-N 3.04Å; L346-N348 VanDerWaalsContact C-N 3.26Å; L346-F351 HydrophobicContact CD2-CD1 4.37Å; L346-F351 HydrophobicContact CD2-CE1 4.18Å; L346-T352 VanDerWaalsContact C-OG1 3.23Å; L346-T352 VanDerWaalsContact CA-OG1 3.28Å; L346-T352 WeakPolarHBondContact CA-OG1 3.49Å; L346-T352 PolarHBondContact O-OG1 3.21Å; L346-V576 HydrophobicContact CD2-CG1 4.36Å; L346-L580 HydrophobicContact CD2-CD1 4.09Å
347	S	83.9	Confident	79.9	Confident	82 Å²	82	53.9 Å²	53.9	57%	0.573	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-14.4	170.9	-60.2	0	0	0	0	111.9	K343 H344 L345 P349	K343-S347 WeakPolarHBondContact O-CB 3.45Å; K343-S347 PolarHBondContact O-N 3.4Å; K343-S347 PolarHBondContact O-OG 3.32Å; H344-S347 WeakPolarHBondContact O-CB 3.31Å; H344-S347 PolarHBondContact O-N 2.84Å; L345-S347 PolarHBondContact O-N 3.47Å; S347-P349 VanDerWaalsContact O-CD 3.29Å; S347-P349 WeakPolarHBondContact O-CD 3.33Å
348	N	83.4	Confident	81.5	Confident	38 Å²	38	50.9 Å²	50.9	20%	0.203	27%	0.274	C	S	.	.	S	Bend	trans	-76.7	111.7	172.9	-179.1	-19	0	0	0	109.7	L345 L346 V350 F351 T352 Y655	L345-N348 WeakPolarHBondContact O-CB 3.44Å; L345-N348 PolarHBondContact O-N 2.87Å; L346-N348 VanDerWaalsContact C-N 3.26Å; N348-V350 VanDerWaalsContact C-N 3.28Å; N348-V350 PolarHBondContact O-N 2.96Å; N348-V350 PolarHBondContact OD1-N 3.3Å; N348-V350 VanDerWaalsContact OD1-N 3.16Å; N348-F351 HydrophobicContact CB-CB 3.95Å; N348-F351 PolarHBondContact O-N 3.49Å; N348-F351 VanDerWaalsContact O-N 3.13Å; N348-T352 PolarHBondContact O-N 3.41Å; N348-T352 PolarHBondContact O-OG1 3.13Å; N348-Y655 PolarHBondContact OD1-OH 2.67Å
349	P	84	Confident	82.9	Confident	67 Å²	67	47.9 Å²	47.9	44%	0.435	26%	0.258	S	S	.	.	H	α-helix	trans	-64.7	-31.7	-171.8	25.9	-34.7	0	0	0	112.7	S347 C353	S347-P349 VanDerWaalsContact O-CD 3.29Å; S347-P349 WeakPolarHBondContact O-CD 3.33Å; P349-C353 VanDerWaalsContact O-CB 3.3Å; P349-C353 WeakPolarHBondContact O-CB 3.37Å; P349-C353 PolarHBondContact O-N 2.99Å; P349-C353 PolarHBondContact O-SG 3.28Å
350	V	85.5	Confident	84.1	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-67	-44	177.5	176.9	0	0	0	0	110.2	N348 I354 T564 T644 C647 Y655	N348-V350 VanDerWaalsContact C-N 3.28Å; N348-V350 PolarHBondContact O-N 2.96Å; N348-V350 PolarHBondContact OD1-N 3.3Å; N348-V350 VanDerWaalsContact OD1-N 3.16Å; V350-I354 WeakPolarHBondContact O-CG2 3.18Å; V350-I354 PolarHBondContact O-N 3.06Å; V350-I354 VanDerWaalsContact O-N 3.15Å; V350-T564 HydrophobicContact CG1-CG2 3.84Å; V350-T644 HydrophobicContact CG1-CG2 3.98Å; V350-C647 HydrophobicContact CG2-CB 3.71Å; V350-Y655 HydrophobicContact CG2-CE2 4.17Å
351	F	85.4	Confident	85.2	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-67.3	-44.9	-179.9	-178.4	-99	0	0	0	112.1	L345 L346 N348 I354 I355 L561 V565 A573 V576	L345-F351 HydrophobicContact CB-CE1 4.33Å; L345-F351 HydrophobicContact CD1-CD1 4.49Å; L345-F351 HydrophobicContact CD1-CE1 4.39Å; L345-F351 HydrophobicContact CD1-CE2 4.45Å; L345-F351 HydrophobicContact CD1-CZ 4.35Å; L345-F351 HydrophobicContact CD2-CD1 4.25Å; L345-F351 HydrophobicContact CD2-CE1 3.41Å; L345-F351 VanDerWaalsContact CD2-CE1 3.41Å; L345-F351 HydrophobicContact CD2-CE2 4.05Å; L345-F351 HydrophobicContact CD2-CZ 3.27Å; L345-F351 HydrophobicContact CG-CD1 3.71Å; L345-F351 HydrophobicContact CG-CD2 4.45Å; L345-F351 HydrophobicContact CG-CE1 3.38Å; L345-F351 HydrophobicContact CG-CE2 4.2Å; L345-F351 HydrophobicContact CG-CG 4.21Å; L345-F351 HydrophobicContact CG-CZ 3.63Å; L345-F351 VanDerWaalsContact O-CD1 3.31Å; L345-F351 WeakPolarHBondContact O-CD1 3.41Å; L346-F351 HydrophobicContact CD2-CD1 4.37Å; L346-F351 HydrophobicContact CD2-CE1 4.18Å; N348-F351 HydrophobicContact CB-CB 3.95Å; N348-F351 PolarHBondContact O-N 3.49Å; N348-F351 VanDerWaalsContact O-N 3.13Å; F351-I354 WeakPolarHBondContact O-CG2 3.06Å; F351-I354 PolarHBondContact O-N 3.01Å; F351-I355 HydrophobicContact CD1-CD1 3.91Å; F351-I355 HydrophobicContact CD2-CD1 4.39Å; F351-I355 HydrophobicContact CE1-CD1 3.21Å; F351-I355 HydrophobicContact CE1-CG1 4.34Å; F351-I355 HydrophobicContact CE2-CD1 3.76Å; F351-I355 HydrophobicContact CE2-CG1 4.46Å; F351-I355 HydrophobicContact CG-CD1 4.47Å; F351-I355 HydrophobicContact CZ-CD1 3.14Å; F351-I355 HydrophobicContact CZ-CG1 4.26Å; F351-I355 WeakPolarHBondContact O-CG1 3.22Å; F351-I355 PolarHBondContact O-N 3.41Å; F351-I355 VanDerWaalsContact O-N 3.11Å; F351-L561 HydrophobicContact CD2-CD1 3.79Å; F351-L561 HydrophobicContact CE2-CD1 3.49Å; F351-L561 VanDerWaalsContact CE2-CD1 3.49Å; F351-L561 HydrophobicContact CE2-CG 4.22Å; F351-L561 HydrophobicContact CZ-CD1 4.39Å; F351-V565 HydrophobicContact CD2-CG2 3.61Å; F351-V565 HydrophobicContact CE2-CG2 3.77Å; F351-A573 HydrophobicContact CE2-CB 3.63Å; F351-A573 HydrophobicContact CZ-CB 3.89Å; F351-V576 HydrophobicContact CE1-CG1 4.26Å; F351-V576 HydrophobicContact CZ-CG1 4.46Å
352	T	89.9	Confident	86.4	Confident	34 Å²	34	37.8 Å²	37.8	21%	0.209	20%	0.204	C	C	.	.	H	α-helix	trans	-67.8	-43.4	-179.6	-59.2	0	0	0	0	111.7	L346 N348 I354 I355 L356	L346-T352 VanDerWaalsContact C-OG1 3.23Å; L346-T352 VanDerWaalsContact CA-OG1 3.28Å; L346-T352 WeakPolarHBondContact CA-OG1 3.49Å; L346-T352 PolarHBondContact O-OG1 3.21Å; N348-T352 PolarHBondContact O-N 3.41Å; N348-T352 PolarHBondContact O-OG1 3.13Å; T352-I354 PolarHBondContact O-N 3.49Å; T352-I355 PolarHBondContact O-N 3.43Å; T352-L356 HydrophobicContact CG2-CD1 3.89Å; T352-L356 HydrophobicContact CG2-CG 4.37Å; T352-L356 WeakPolarHBondContact O-CB 3.43Å; T352-L356 VanDerWaalsContact O-CG 3.3Å; T352-L356 WeakPolarHBondContact O-CG 3.18Å; T352-L356 PolarHBondContact O-N 3.14Å
353	C	91.7	Very high	87.6	Confident	20 Å²	20	36.3 Å²	36.3	14%	0.135	20%	0.196	C	C	.	.	H	α-helix	trans	-63.4	-41.6	178.1	-67.5	0	0	0	0	112	P349 L356 A357 L640 T644	P349-C353 VanDerWaalsContact O-CB 3.3Å; P349-C353 WeakPolarHBondContact O-CB 3.37Å; P349-C353 PolarHBondContact O-N 2.99Å; P349-C353 PolarHBondContact O-SG 3.28Å; C353-L356 PolarHBondContact O-N 3.1Å; C353-A357 WeakPolarHBondContact O-CB 3.18Å; C353-A357 PolarHBondContact O-N 3.1Å; C353-L640 HydrophobicContact CB-CD2 4.44Å; C353-T644 WeakPolarHBondContact CB-OG1 3.24Å
354	I	89.9	Confident	88.3	Confident	3 Å²	3	29.1 Å²	29.1	2%	0.015	16%	0.164	C	C	.	.	H	α-helix	trans	-68.3	-38.1	-180	-165.7	70.9	0	0	0	112	V350 F351 T352 A357 A358 I421 I560 L561 Y641 T644	V350-I354 WeakPolarHBondContact O-CG2 3.18Å; V350-I354 PolarHBondContact O-N 3.06Å; V350-I354 VanDerWaalsContact O-N 3.15Å; F351-I354 WeakPolarHBondContact O-CG2 3.06Å; F351-I354 PolarHBondContact O-N 3.01Å; T352-I354 PolarHBondContact O-N 3.49Å; I354-A357 PolarHBondContact O-N 3.32Å; I354-A358 PolarHBondContact O-N 2.67Å; I354-I421 HydrophobicContact CD1-CD1 4.15Å; I354-I560 HydrophobicContact CD1-CB 4.42Å; I354-I560 HydrophobicContact CD1-CD1 4.24Å; I354-I560 HydrophobicContact CD1-CG2 4.11Å; I354-I560 HydrophobicContact CG1-CG2 4.17Å; I354-L561 HydrophobicContact CG2-CD1 3.78Å; I354-Y641 HydrophobicContact CD1-CD1 3.9Å; I354-Y641 HydrophobicContact CD1-CE1 3.66Å; I354-T644 HydrophobicContact CB-CG2 4.47Å
355	I	89.7	Confident	89.1	Confident	1 Å²	1	26.2 Å²	26.2	1%	0.005	16%	0.156	C	C	.	.	H	α-helix	trans	-67.4	-46.8	175.9	-70.5	-176.4	0	0	0	110.8	F351 T352 A357 A358 C359 L561 V576 L577 L580	F351-I355 HydrophobicContact CD1-CD1 3.91Å; F351-I355 HydrophobicContact CD2-CD1 4.39Å; F351-I355 HydrophobicContact CE1-CD1 3.21Å; F351-I355 HydrophobicContact CE1-CG1 4.34Å; F351-I355 HydrophobicContact CE2-CD1 3.76Å; F351-I355 HydrophobicContact CE2-CG1 4.46Å; F351-I355 HydrophobicContact CG-CD1 4.47Å; F351-I355 HydrophobicContact CZ-CD1 3.14Å; F351-I355 HydrophobicContact CZ-CG1 4.26Å; F351-I355 WeakPolarHBondContact O-CG1 3.22Å; F351-I355 PolarHBondContact O-N 3.41Å; F351-I355 VanDerWaalsContact O-N 3.11Å; T352-I355 PolarHBondContact O-N 3.43Å; I355-A357 VanDerWaalsContact C-N 3.26Å; I355-A357 PolarHBondContact O-N 3.24Å; I355-A358 CarbonylContact O-C 3.59Å; I355-A358 WeakPolarHBondContact O-CB 3.01Å; I355-A358 PolarHBondContact O-N 3.14Å; I355-A358 VanDerWaalsContact O-N 3.11Å; I355-C359 PolarHBondContact O-N 3.44Å; I355-C359 PolarHBondContact O-SG 3.25Å; I355-C359 VanDerWaalsContact O-SG 3.33Å; I355-L561 HydrophobicContact CD1-CD1 4.21Å; I355-L561 HydrophobicContact CG1-CD1 3.81Å; I355-V576 HydrophobicContact CD1-CG1 4.28Å; I355-L577 HydrophobicContact CB-CD1 4.44Å; I355-L577 HydrophobicContact CD1-CB 4.23Å; I355-L577 HydrophobicContact CG1-CB 4.44Å; I355-L577 HydrophobicContact CG1-CD1 4.05Å; I355-L577 HydrophobicContact CG2-CD1 4.12Å; I355-L580 HydrophobicContact CG2-CB 3.89Å; I355-L580 HydrophobicContact CG2-CD1 3.61Å; I355-L580 HydrophobicContact CG2-CG 4.4Å
356	L	92.8	Very high	89.9	Confident	52 Å²	52	26.2 Å²	26.2	27%	0.272	16%	0.158	S	C	.	.	H	α-helix	trans	-60.2	-39.7	177.6	-70.7	174.1	0	0	0	110.8	T352 C353 A358 C359 M360 L584 L640	T352-L356 HydrophobicContact CG2-CD1 3.89Å; T352-L356 HydrophobicContact CG2-CG 4.37Å; T352-L356 WeakPolarHBondContact O-CB 3.43Å; T352-L356 VanDerWaalsContact O-CG 3.3Å; T352-L356 WeakPolarHBondContact O-CG 3.18Å; T352-L356 PolarHBondContact O-N 3.14Å; C353-L356 PolarHBondContact O-N 3.1Å; L356-A358 VanDerWaalsContact C-N 3.35Å; L356-A358 PolarHBondContact O-N 3.01Å; L356-C359 WeakPolarHBondContact O-CB 3.37Å; L356-C359 PolarHBondContact O-N 3.43Å; L356-M360 VanDerWaalsContact O-CG 3.3Å; L356-M360 WeakPolarHBondContact O-CG 3.45Å; L356-M360 PolarHBondContact O-N 2.88Å; L356-L584 HydrophobicContact CD2-CD1 4.09Å; L356-L640 HydrophobicContact CB-CD1 3.63Å; L356-L640 HydrophobicContact CB-CD2 4.38Å
357	A	93.6	Very high	90.4	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-61.2	-43.8	175	0	0	0	0	0	111.6	C353 I354 I355 C359 M360 E361 L640 Y641	C353-A357 WeakPolarHBondContact O-CB 3.18Å; C353-A357 PolarHBondContact O-N 3.1Å; I354-A357 PolarHBondContact O-N 3.32Å; I355-A357 VanDerWaalsContact C-N 3.26Å; I355-A357 PolarHBondContact O-N 3.24Å; A357-C359 PolarHBondContact O-N 3.08Å; A357-M360 PolarHBondContact O-N 3.43Å; A357-E361 WeakPolarHBondContact O-CG 3.27Å; A357-E361 PolarHBondContact O-N 2.94Å; A357-L640 HydrophobicContact CB-CB 3.81Å; A357-L640 HydrophobicContact CB-CD1 4.36Å; A357-Y641 HydrophobicContact CB-CD1 3.84Å; A357-Y641 HydrophobicContact CB-CD2 4.38Å; A357-Y641 HydrophobicContact CB-CE1 3.63Å; A357-Y641 HydrophobicContact CB-CE2 4.18Å; A357-Y641 HydrophobicContact CB-CG 4.22Å
358	A	91.3	Very high	90.8	Very high	18 Å²	18	19.9 Å²	19.9	15%	0.149	12%	0.117	C	C	.	.	H	α-helix	trans	-63.5	-39.1	174.9	0	0	0	0	0	112.3	I354 I355 L356 M360 E361 I362 L577 L581	I354-A358 PolarHBondContact O-N 2.67Å; I355-A358 CarbonylContact O-C 3.59Å; I355-A358 WeakPolarHBondContact O-CB 3.01Å; I355-A358 PolarHBondContact O-N 3.14Å; I355-A358 VanDerWaalsContact O-N 3.11Å; L356-A358 VanDerWaalsContact C-N 3.35Å; L356-A358 PolarHBondContact O-N 3.01Å; A358-M360 VanDerWaalsContact C-N 3.33Å; A358-M360 PolarHBondContact O-N 2.7Å; A358-E361 PolarHBondContact O-N 2.94Å; A358-I362 WeakPolarHBondContact O-CB 3.5Å; A358-I362 WeakPolarHBondContact O-CG1 3.28Å; A358-I362 PolarHBondContact O-N 3.32Å; A358-L577 HydrophobicContact CB-CD1 4.06Å; A358-L581 HydrophobicContact CB-CD2 4.16Å
359	C	93.4	Very high	91	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-60.3	-42.2	173.9	-69.5	0	0	0	0	111.5	I355 L356 A357 I362 A363 L580 L584	I355-C359 PolarHBondContact O-N 3.44Å; I355-C359 PolarHBondContact O-SG 3.25Å; I355-C359 VanDerWaalsContact O-SG 3.33Å; L356-C359 WeakPolarHBondContact O-CB 3.37Å; L356-C359 PolarHBondContact O-N 3.43Å; A357-C359 PolarHBondContact O-N 3.08Å; C359-I362 PolarHBondContact O-N 3.24Å; C359-A363 WeakPolarHBondContact O-CB 3.5Å; C359-A363 PolarHBondContact O-N 2.85Å; C359-L580 VanDerWaalsContact SG-C 3.59Å; C359-L580 PolarHBondContact SG-O 2.92Å; C359-L580 VanDerWaalsContact SG-O 3.38Å; C359-L584 HydrophobicContact CB-CB 4.19Å
360	M	95	Very high	91.3	Very high	27 Å²	27	17 Å²	17	13%	0.133	11%	0.105	C	C	.	.	H	α-helix	trans	-68.8	-39.8	178.7	-63.2	-57.4	125.4	0	0	112.8	L356 A357 A358 A363 V364 L633 F636 A637 L640	L356-M360 VanDerWaalsContact O-CG 3.3Å; L356-M360 WeakPolarHBondContact O-CG 3.45Å; L356-M360 PolarHBondContact O-N 2.88Å; A357-M360 PolarHBondContact O-N 3.43Å; A358-M360 VanDerWaalsContact C-N 3.33Å; A358-M360 PolarHBondContact O-N 2.7Å; M360-A363 WeakPolarHBondContact O-CB 3.46Å; M360-A363 PolarHBondContact O-N 3.03Å; M360-V364 WeakPolarHBondContact O-CG2 3.14Å; M360-V364 PolarHBondContact O-N 3.1Å; M360-V364 VanDerWaalsContact O-N 3.1Å; M360-L633 HydrophobicContact SD-CD2 3.71Å; M360-F636 HydrophobicContact CE-CD1 4.36Å; M360-F636 HydrophobicContact CE-CE1 4.28Å; M360-F636 HydrophobicContact CG-CD1 3.59Å; M360-F636 HydrophobicContact CG-CE1 4.18Å; M360-F636 HydrophobicContact SD-CD1 3.64Å; M360-F636 HydrophobicContact SD-CE1 4.16Å; M360-A637 HydrophobicContact CB-CB 3.82Å; M360-L640 HydrophobicContact CG-CD1 4.35Å
361	E	92.5	Very high	91.7	Very high	20 Å²	20	17.3 Å²	17.3	9%	0.093	11%	0.106	C	C	.	.	H	α-helix	trans	-61.6	-47.4	173.6	-73.4	-75.5	-176	0	0	111.4	A357 A358 A363 V364 V365 N428 K634 A637 Y641	A357-E361 WeakPolarHBondContact O-CG 3.27Å; A357-E361 PolarHBondContact O-N 2.94Å; A358-E361 PolarHBondContact O-N 2.94Å; E361-A363 VanDerWaalsContact C-N 3.3Å; E361-A363 PolarHBondContact O-N 2.9Å; E361-V364 PolarHBondContact O-N 3.34Å; E361-V365 WeakPolarHBondContact O-CG2 3.21Å; E361-V365 PolarHBondContact O-N 2.76Å; E361-V365 VanDerWaalsContact O-N 3.16Å; E361-N428 PolarHBondContact OE1-ND2 2.92Å; E361-K634 IonicContact OE1-NZ 3.28Å; E361-K634 WeakPolarHBondContact OE2-CE 3.38Å; E361-K634 IonicContact OE2-NZ 3.66Å; E361-K634 PolarHBondContact OE2-NZ 3Å; E361-A637 HydrophobicContact CG-CB 4.4Å; E361-Y641 HydrophobicContact CG-CE2 4.38Å
362	I	91.5	Very high	92	Very high	30 Å²	30	17.8 Å²	17.8	15%	0.154	11%	0.109	C	C	.	.	H	α-helix	trans	-65.5	-35.6	176.8	-68.4	-59.4	0	0	0	111.1	A358 C359 V364 V365 A366 L581 F586	A358-I362 WeakPolarHBondContact O-CB 3.5Å; A358-I362 WeakPolarHBondContact O-CG1 3.28Å; A358-I362 PolarHBondContact O-N 3.32Å; C359-I362 PolarHBondContact O-N 3.24Å; I362-V364 VanDerWaalsContact C-N 3.32Å; I362-V364 PolarHBondContact O-N 3.3Å; I362-V365 PolarHBondContact O-N 3.25Å; I362-A366 VanDerWaalsContact O-CB 3.31Å; I362-A366 WeakPolarHBondContact O-CB 3.24Å; I362-A366 PolarHBondContact O-N 3.01Å; I362-L581 HydrophobicContact CB-CD2 4.07Å; I362-L581 HydrophobicContact CG1-CD1 4.48Å; I362-L581 HydrophobicContact CG1-CD2 3.74Å; I362-F586 HydrophobicContact CG2-CD1 4.32Å; I362-F586 HydrophobicContact CG2-CD2 3.86Å; I362-F586 HydrophobicContact CG2-CE1 3.95Å; I362-F586 HydrophobicContact CG2-CE2 3.45Å; I362-F586 VanDerWaalsContact CG2-CE2 3.45Å; I362-F586 HydrophobicContact CG2-CG 4.28Å; I362-F586 HydrophobicContact CG2-CZ 3.5Å; I362-F586 VanDerWaalsContact CG2-CZ 3.5Å
363	A	95.2	Very high	92.1	Very high	3 Å²	3	16.6 Å²	16.6	3%	0.025	10%	0.103	C	C	.	.	H	α-helix	trans	-60.2	-41.4	175.9	0	0	0	0	0	112.8	C359 M360 E361 G367 G585 P589 L633	C359-A363 WeakPolarHBondContact O-CB 3.5Å; C359-A363 PolarHBondContact O-N 2.85Å; M360-A363 WeakPolarHBondContact O-CB 3.46Å; M360-A363 PolarHBondContact O-N 3.03Å; E361-A363 VanDerWaalsContact C-N 3.3Å; E361-A363 PolarHBondContact O-N 2.9Å; A363-G367 PolarHBondContact O-N 3.23Å; A363-G585 VanDerWaalsContact CA-O 3.27Å; A363-G585 WeakPolarHBondContact CA-O 3.14Å; A363-P589 HydrophobicContact CB-CB 4.18Å; A363-P589 HydrophobicContact CB-CG 3.4Å; A363-P589 VanDerWaalsContact O-CB 3.3Å; A363-P589 WeakPolarHBondContact O-CB 3.32Å; A363-L633 HydrophobicContact CB-CD1 4.1Å
364	V	95.1	Very high	92.1	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-62.4	-48.9	174.1	174.5	0	0	0	0	110.2	M360 E361 I362 F368 Y435 A630 L633 K634	M360-V364 WeakPolarHBondContact O-CG2 3.14Å; M360-V364 PolarHBondContact O-N 3.1Å; M360-V364 VanDerWaalsContact O-N 3.1Å; E361-V364 PolarHBondContact O-N 3.34Å; I362-V364 VanDerWaalsContact C-N 3.32Å; I362-V364 PolarHBondContact O-N 3.3Å; V364-F368 HydrophobicContact CG1-CD2 4.38Å; V364-F368 VanDerWaalsContact O-CB 3.28Å; V364-F368 WeakPolarHBondContact O-CB 3.47Å; V364-F368 PolarHBondContact O-N 3.21Å; V364-Y435 HydrophobicContact CG1-CE1 4.2Å; V364-Y435 HydrophobicContact CG1-CE2 4.37Å; V364-Y435 WeakPolarHBondContact CG1-OH 3.28Å; V364-A630 HydrophobicContact CG1-CB 3.84Å; V364-A630 HydrophobicContact CG2-CB 4.38Å; V364-L633 HydrophobicContact CG2-CB 3.5Å; V364-L633 VanDerWaalsContact CG2-CB 3.5Å; V364-L633 HydrophobicContact CG2-CD1 4.02Å; V364-L633 HydrophobicContact CG2-CG 4.43Å; V364-K634 HydrophobicContact CG2-CD 4.5Å; V364-K634 HydrophobicContact CG2-CG 4.03Å
365	V	91.3	Very high	92.3	Very high	82 Å²	82	15.8 Å²	15.8	50%	0.497	10%	0.097	S	C	.	.	H	α-helix	trans	-62.5	-45.1	-179.1	175.9	0	0	0	0	111.4	E361 I362 A369	E361-V365 WeakPolarHBondContact O-CG2 3.21Å; E361-V365 PolarHBondContact O-N 2.76Å; E361-V365 VanDerWaalsContact O-N 3.16Å; I362-V365 PolarHBondContact O-N 3.25Å; V365-A369 WeakPolarHBondContact O-CB 3.1Å; V365-A369 PolarHBondContact O-N 3.12Å
366	A	91.1	Very high	92.4	Very high	11 Å²	11	16 Å²	16	9%	0.091	10%	0.098	C	C	.	.	H	α-helix	trans	-66.6	-48.2	-179.3	0	0	0	0	0	112	I362 A369 A370 G585 F586	I362-A366 VanDerWaalsContact O-CB 3.31Å; I362-A366 WeakPolarHBondContact O-CB 3.24Å; I362-A366 PolarHBondContact O-N 3.01Å; A366-A369 PolarHBondContact O-N 3.38Å; A366-A370 WeakPolarHBondContact O-CB 3.45Å; A366-A370 PolarHBondContact O-N 3.15Å; A366-G585 WeakPolarHBondContact CB-O 3.26Å; A366-F586 HydrophobicContact CB-CD1 3.7Å; A366-F586 HydrophobicContact CB-CE1 4.14Å
367	G	92.4	Very high	92.3	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-64.3	-42.8	178	0	0	0	0	0	112.7	A363	A363-G367 PolarHBondContact O-N 3.23Å
368	F	91.7	Very high	92.1	Very high	11 Å²	11	15 Å²	15	5%	0.048	9%	0.092	C	C	.	.	H	α-helix	trans	-63.9	-54.4	173.7	-97.4	-113	0	0	0	111	V364 A370 F371 L372 Y435 F593 Y626 V627 A630	V364-F368 HydrophobicContact CG1-CD2 4.38Å; V364-F368 VanDerWaalsContact O-CB 3.28Å; V364-F368 WeakPolarHBondContact O-CB 3.47Å; V364-F368 PolarHBondContact O-N 3.21Å; F368-A370 PolarHBondContact O-N 3.04Å; F368-F371 PolarHBondContact O-N 3.49Å; F368-F371 VanDerWaalsContact O-N 3.15Å; F368-L372 WeakPolarHBondContact O-CA 3.13Å; F368-L372 WeakPolarHBondContact O-CB 3.39Å; F368-L372 PolarHBondContact O-N 3.29Å; F368-Y435 HydrophobicContact CD1-CE1 4.03Å; F368-Y435 HydrophobicContact CD2-CE1 4.24Å; F368-Y435 HydrophobicContact CE1-CD1 4.23Å; F368-Y435 AromaticContact CE1-CE1 3.61Å; F368-Y435 HydrophobicContact CE1-CE1 3.61Å; F368-Y435 HydrophobicContact CE2-CD1 4.42Å; F368-Y435 AromaticContact CE2-CE1 3.89Å; F368-Y435 HydrophobicContact CE2-CE1 3.89Å; F368-Y435 HydrophobicContact CG-CE1 4.33Å; F368-Y435 AromaticContact CZ-CD1 3.9Å; F368-Y435 HydrophobicContact CZ-CD1 3.9Å; F368-Y435 AromaticContact CZ-CE1 3.54Å; F368-Y435 HydrophobicContact CZ-CE1 3.54Å; F368-F593 AromaticContact CD2-CE1 3.71Å; F368-F593 HydrophobicContact CD2-CE1 3.71Å; F368-F593 AromaticContact CD2-CZ 3.85Å; F368-F593 HydrophobicContact CD2-CZ 3.85Å; F368-F593 AromaticContact CE2-CE1 3.67Å; F368-F593 HydrophobicContact CE2-CE1 3.67Å; F368-F593 AromaticContact CE2-CZ 3.98Å; F368-F593 HydrophobicContact CE2-CZ 3.98Å; F368-Y626 VanDerWaalsContact CA-OH 3.31Å; F368-Y626 WeakPolarHBondContact CA-OH 3.19Å; F368-Y626 AromaticContact CD1-CE1 3.8Å; F368-Y626 HydrophobicContact CD1-CE1 3.8Å; F368-Y626 HydrophobicContact CD2-CE1 4.24Å; F368-Y626 HydrophobicContact CE1-CD1 4.07Å; F368-Y626 AromaticContact CE1-CE1 3.48Å; F368-Y626 HydrophobicContact CE1-CE1 3.48Å; F368-Y626 VanDerWaalsContact CE1-CE1 3.48Å; F368-Y626 HydrophobicContact CE2-CD1 4.15Å; F368-Y626 AromaticContact CE2-CE1 3.88Å; F368-Y626 HydrophobicContact CE2-CE1 3.88Å; F368-Y626 HydrophobicContact CG-CE1 4.18Å; F368-Y626 AromaticContact CZ-CD1 3.72Å; F368-Y626 HydrophobicContact CZ-CD1 3.72Å; F368-Y626 AromaticContact CZ-CE1 3.52Å; F368-Y626 HydrophobicContact CZ-CE1 3.52Å; F368-Y626 PolarHBondContact O-OH 3.06Å; F368-V627 HydrophobicContact CZ-CG2 4.45Å; F368-A630 HydrophobicContact CD2-CB 3.87Å; F368-A630 HydrophobicContact CE2-CB 3.21Å; F368-A630 HydrophobicContact CZ-CB 3.95Å
369	A	88.7	Confident	92.1	Very high	36 Å²	36	14.2 Å²	14.2	30%	0.298	9%	0.086	S	C	.	.	H	α-helix	trans	-57.6	-37.4	-175.5	0	0	0	0	0	112.9	V61 V365 A366 F371	V61-A369 WeakPolarHBondContact CG1-O 3.22Å; V365-A369 WeakPolarHBondContact O-CB 3.1Å; V365-A369 PolarHBondContact O-N 3.12Å; A366-A369 PolarHBondContact O-N 3.38Å; A369-F371 VanDerWaalsContact C-N 3.32Å; A369-F371 PolarHBondContact O-N 3.26Å
370	A	90.8	Very high	92	Very high	10 Å²	10	15 Å²	15	8%	0.083	9%	0.089	C	C	.	.	H	α-helix	trans	-61.5	-35.8	-179.7	0	0	0	0	0	113.6	A366 F368 P590	A366-A370 WeakPolarHBondContact O-CB 3.45Å; A366-A370 PolarHBondContact O-N 3.15Å; F368-A370 PolarHBondContact O-N 3.04Å; A370-P590 HydrophobicContact CB-CB 4.2Å; A370-P590 HydrophobicContact CB-CG 4.29Å
371	F	93	Very high	91.7	Very high	5 Å²	5	18.6 Å²	18.6	2%	0.022	11%	0.109	C	C	.	.	H	α-helix	trans	-123.6	3.1	-173.4	-62	-78.2	0	0	0	114.4	V78 F368 A369 G373 K374 Y375 P590 F593 I597 Y626	V78-F371 HydrophobicContact CG1-CE1 4.43Å; F368-F371 PolarHBondContact O-N 3.49Å; F368-F371 VanDerWaalsContact O-N 3.15Å; A369-F371 VanDerWaalsContact C-N 3.32Å; A369-F371 PolarHBondContact O-N 3.26Å; F371-G373 VanDerWaalsContact C-N 3.26Å; F371-G373 PolarHBondContact O-N 2.87Å; F371-K374 HydrophobicContact CD1-CD 4.43Å; F371-K374 CarbonylContact O-C 3.49Å; F371-K374 WeakPolarHBondContact O-CB 3.49Å; F371-K374 PolarHBondContact O-N 3.39Å; F371-K374 VanDerWaalsContact O-N 3.1Å; F371-Y375 WeakPolarHBondContact O-CB 3.5Å; F371-Y375 PolarHBondContact O-N 3.12Å; F371-P590 HydrophobicContact CE2-CB 4.24Å; F371-P590 WeakPolarHBondContact CE2-O 3.28Å; F371-F593 HydrophobicContact CD2-CB 3.9Å; F371-F593 HydrophobicContact CE2-CB 4.14Å; F371-I597 HydrophobicContact CB-CD1 3.63Å; F371-I597 HydrophobicContact CD1-CD1 3.7Å; F371-I597 HydrophobicContact CD2-CD1 4.13Å; F371-I597 HydrophobicContact CE1-CD1 4.39Å; F371-I597 HydrophobicContact CG-CD1 3.54Å; F371-Y626 HydrophobicContact CB-CE2 4.01Å
372	L	92.2	Very high	91.5	Very high	10 Å²	10	19.6 Å²	19.6	5%	0.052	11%	0.114	C	C	.	.	H	α-helix	trans	-62.2	-35.7	-179.2	-179.9	61.3	0	0	0	111.7	F368 Y375 L376 L391 M543 Y626	F368-L372 WeakPolarHBondContact O-CA 3.13Å; F368-L372 WeakPolarHBondContact O-CB 3.39Å; F368-L372 PolarHBondContact O-N 3.29Å; L372-Y375 HydrophobicContact CD1-CD1 4.3Å; L372-Y375 PolarHBondContact O-N 3.12Å; L372-L376 HydrophobicContact CD1-CG 4.4Å; L372-L376 HydrophobicContact CG-CD1 4.4Å; L372-L376 WeakPolarHBondContact O-CB 3.44Å; L372-L376 VanDerWaalsContact O-CG 3.28Å; L372-L376 WeakPolarHBondContact O-CG 3.32Å; L372-L376 PolarHBondContact O-N 2.86Å; L372-L391 HydrophobicContact CD2-CD1 3.83Å; L372-M543 HydrophobicContact CD1-CE 4.09Å; L372-M543 HydrophobicContact CD2-CE 3.69Å; L372-Y626 PolarHBondContact N-OH 3.23Å
373	G	91.9	Very high	91.3	Very high	9 Å²	9	19.5 Å²	19.5	9%	0.093	12%	0.115	C	C	.	.	H	α-helix	trans	-57.7	-51.7	171.6	0	0	0	0	0	111.4	F371 Y375 L376 E377	F371-G373 VanDerWaalsContact C-N 3.26Å; F371-G373 PolarHBondContact O-N 2.87Å; G373-Y375 VanDerWaalsContact C-N 3.33Å; G373-Y375 PolarHBondContact O-N 2.91Å; G373-L376 WeakPolarHBondContact O-CB 3.42Å; G373-L376 PolarHBondContact O-N 3.26Å; G373-E377 WeakPolarHBondContact O-CG 3.26Å; G373-E377 PolarHBondContact O-N 3.16Å
374	K	91.5	Very high	90.9	Very high	5 Å²	5	20.2 Å²	20.2	2%	0.022	12%	0.119	C	C	.	.	H	α-helix	trans	-59.1	-42	175.4	-170.1	173.4	-178.5	168.5	0	112.7	T65 E68 S75 F371 L376 E377 Q378 Y617	T65-K374 HydrophobicContact CG2-CB 3.53Å; T65-K374 HydrophobicContact CG2-CD 4.32Å; T65-K374 HydrophobicContact CG2-CG 3.91Å; E68-K374 IonicContact OE1-NZ 2.91Å; E68-K374 PolarHBondContact OE1-NZ 3.28Å; E68-K374 WeakPolarHBondContact OE2-CE 3.34Å; E68-K374 IonicContact OE2-NZ 3.58Å; E68-K374 PolarHBondContact OE2-NZ 3.5Å; S75-K374 PolarHBondContact OG-NZ 3.33Å; F371-K374 HydrophobicContact CD1-CD 4.43Å; F371-K374 CarbonylContact O-C 3.49Å; F371-K374 WeakPolarHBondContact O-CB 3.49Å; F371-K374 PolarHBondContact O-N 3.39Å; F371-K374 VanDerWaalsContact O-N 3.1Å; K374-L376 VanDerWaalsContact C-N 3.34Å; K374-L376 PolarHBondContact O-N 2.9Å; K374-E377 PolarHBondContact O-N 2.94Å; K374-Q378 HydrophobicContact CG-CG 4.38Å; K374-Q378 WeakPolarHBondContact O-CG 3.29Å; K374-Q378 PolarHBondContact O-N 3.4Å; K374-Y617 WeakPolarHBondContact CE-OH 3.35Å; K374-Y617 PolarHBondContact NZ-OH 3.25Å
375	Y	93.6	Very high	90.6	Very high	2 Å²	2	20.7 Å²	20.7	1%	0.008	12%	0.123	C	C	.	.	H	α-helix	trans	-60.1	-45.4	177.1	179.7	-91.6	0	0	0	111.1	F371 L372 G373 Q378 Q379 F380 F539 Y622 R623 Y626	F371-Y375 WeakPolarHBondContact O-CB 3.5Å; F371-Y375 PolarHBondContact O-N 3.12Å; L372-Y375 HydrophobicContact CD1-CD1 4.3Å; L372-Y375 PolarHBondContact O-N 3.12Å; G373-Y375 VanDerWaalsContact C-N 3.33Å; G373-Y375 PolarHBondContact O-N 2.91Å; Y375-Q378 PolarHBondContact O-N 3.26Å; Y375-Q379 HydrophobicContact CD1-CG 4.23Å; Y375-Q379 HydrophobicContact CD2-CG 4.01Å; Y375-Q379 HydrophobicContact CE1-CB 4.33Å; Y375-Q379 HydrophobicContact CE1-CG 3.86Å; Y375-Q379 HydrophobicContact CE2-CG 3.64Å; Y375-Q379 HydrophobicContact CG-CG 4.29Å; Y375-Q379 VanDerWaalsContact O-CB 3.27Å; Y375-Q379 WeakPolarHBondContact O-CB 3.38Å; Y375-Q379 WeakPolarHBondContact O-CG 3.3Å; Y375-Q379 PolarHBondContact O-N 3.01Å; Y375-F380 HydrophobicContact CE1-CE2 4.36Å; Y375-F539 HydrophobicContact CD1-CZ 4.2Å; Y375-F539 HydrophobicContact CE1-CE1 4.49Å; Y375-F539 AromaticContact CE1-CE2 3.83Å; Y375-F539 HydrophobicContact CE1-CE2 3.83Å; Y375-F539 AromaticContact CE1-CZ 3.67Å; Y375-F539 HydrophobicContact CE1-CZ 3.67Å; Y375-Y622 HydrophobicContact CD2-CD2 4.41Å; Y375-Y622 AromaticContact CD2-CE2 3.87Å; Y375-Y622 HydrophobicContact CD2-CE2 3.87Å; Y375-R623 WeakPolarHBondContact OH-CG 3.49Å; Y375-Y626 AromaticContact CD2-CD1 3.6Å; Y375-Y626 HydrophobicContact CD2-CD1 3.6Å; Y375-Y626 AromaticContact CD2-CE1 3.91Å; Y375-Y626 HydrophobicContact CD2-CE1 3.91Å; Y375-Y626 HydrophobicContact CD2-CG 4.07Å; Y375-Y626 AromaticContact CE2-CD1 3.83Å; Y375-Y626 HydrophobicContact CE2-CD1 3.83Å; Y375-Y626 HydrophobicContact CE2-CE1 4.45Å; Y375-Y626 HydrophobicContact CE2-CG 4.4Å; Y375-Y626 HydrophobicContact CG-CD1 4.2Å; Y375-Y626 HydrophobicContact CG-CE1 4.04Å
376	L	92.8	Very high	90.5	Very high	5 Å²	5	18.4 Å²	18.4	3%	0.026	11%	0.111	C	C	.	.	H	α-helix	trans	-64.3	-40.8	176.3	-73.1	174.5	0	0	0	112.4	L372 G373 K374 F380 L382 A387 L390 F539	L372-L376 HydrophobicContact CD1-CG 4.4Å; L372-L376 HydrophobicContact CG-CD1 4.4Å; L372-L376 WeakPolarHBondContact O-CB 3.44Å; L372-L376 VanDerWaalsContact O-CG 3.28Å; L372-L376 WeakPolarHBondContact O-CG 3.32Å; L372-L376 PolarHBondContact O-N 2.86Å; G373-L376 WeakPolarHBondContact O-CB 3.42Å; G373-L376 PolarHBondContact O-N 3.26Å; K374-L376 VanDerWaalsContact C-N 3.34Å; K374-L376 PolarHBondContact O-N 2.9Å; L376-F380 HydrophobicContact CD2-CD2 3.81Å; L376-F380 HydrophobicContact CD2-CE2 4.08Å; L376-F380 PolarHBondContact O-N 2.81Å; L376-L382 HydrophobicContact CB-CD1 4.3Å; L376-A387 HydrophobicContact CB-CB 3.96Å; L376-A387 HydrophobicContact CD1-CB 4.29Å; L376-L390 HydrophobicContact CD1-CD2 4.02Å; L376-L390 HydrophobicContact CD2-CD2 4.42Å; L376-F539 HydrophobicContact CD2-CD1 4.21Å; L376-F539 HydrophobicContact CD2-CE1 3.7Å
377	E	90.5	Very high	90.6	Very high	6 Å²	6	17.9 Å²	17.9	3%	0.028	11%	0.106	C	C	.	.	H	α-helix	trans	-59.4	-46.3	173.9	-69.7	176.6	-155.2	0	0	111.3	T65 R69 G373 K374 N381 L382 T384 A387	T65-E377 PolarHBondContact OG1-OE1 3.02Å; R69-E377 IonicContact CZ-OE2 3.52Å; R69-E377 IonicContact NH2-OE2 3.94Å; R69-E377 PolarHBondContact NH2-OE2 3.31Å; G373-E377 WeakPolarHBondContact O-CG 3.26Å; G373-E377 PolarHBondContact O-N 3.16Å; K374-E377 PolarHBondContact O-N 2.94Å; E377-N381 WeakPolarHBondContact O-CA 3.38Å; E377-N381 PolarHBondContact O-N 3.1Å; E377-N381 VanDerWaalsContact O-N 3.16Å; E377-L382 WeakPolarHBondContact CA-O 3.33Å; E377-L382 PolarHBondContact O-N 3.48Å; E377-T384 VanDerWaalsContact CD-OG1 3.24Å; E377-T384 WeakPolarHBondContact OE1-CA 3.37Å; E377-T384 WeakPolarHBondContact OE1-CB 3.37Å; E377-T384 WeakPolarHBondContact OE1-CG2 3.46Å; E377-T384 PolarHBondContact OE1-OG1 2.82Å; E377-T384 PolarHBondContact OE2-OG1 2.94Å; E377-A387 HydrophobicContact CG-CB 4.29Å
378	Q	89.6	Confident	90.5	Very high	25 Å²	25	18 Å²	18	12%	0.117	11%	0.107	C	C	.	.	H	α-helix	trans	-81	-41.2	-173.9	-63.8	-57.1	-29.9	0	0	114	K374 Y375 Y617 N619 Y622	K374-Q378 HydrophobicContact CG-CG 4.38Å; K374-Q378 WeakPolarHBondContact O-CG 3.29Å; K374-Q378 PolarHBondContact O-N 3.4Å; Y375-Q378 PolarHBondContact O-N 3.26Å; Q378-Y617 HydrophobicContact CG-CD2 4.12Å; Q378-Y617 HydrophobicContact CG-CE2 4.4Å; Q378-N619 PolarHBondContact O-ND2 2.89Å; Q378-Y622 HydrophobicContact CB-CE1 4.12Å; Q378-Y622 HydrophobicContact CG-CE1 4.26Å
379	Q	91.4	Very high	90.5	Very high	2 Å²	2	21.3 Å²	21.3	1%	0.009	12%	0.123	C	C	.	.	H	α-helix	trans	-77.3	-37.4	-177.1	-75	-72.3	-35.5	0	0	113.4	Y375 C443 N619	Y375-Q379 HydrophobicContact CD1-CG 4.23Å; Y375-Q379 HydrophobicContact CD2-CG 4.01Å; Y375-Q379 HydrophobicContact CE1-CB 4.33Å; Y375-Q379 HydrophobicContact CE1-CG 3.86Å; Y375-Q379 HydrophobicContact CE2-CG 3.64Å; Y375-Q379 HydrophobicContact CG-CG 4.29Å; Y375-Q379 VanDerWaalsContact O-CB 3.27Å; Y375-Q379 WeakPolarHBondContact O-CB 3.38Å; Y375-Q379 WeakPolarHBondContact O-CG 3.3Å; Y375-Q379 PolarHBondContact O-N 3.01Å; Q379-C443 WeakPolarHBondContact O-CB 3.22Å; Q379-C443 PolarHBondContact O-SG 3.46Å; Q379-C443 VanDerWaalsContact O-SG 3.4Å; Q379-C443 PolarHBondContact OE1-O 3.01Å; Q379-N619 PolarHBondContact NE2-O 3.12Å
380	F	90.6	Very high	90.6	Very high	15 Å²	15	21 Å²	21	7%	0.066	12%	0.116	C	C	.	.	H	α-helix	trans	-115.8	7.8	-172.6	-58.5	-68.1	0	0	0	112.6	Y375 L376 L382 F536 F539	Y375-F380 HydrophobicContact CE1-CE2 4.36Å; L376-F380 HydrophobicContact CD2-CD2 3.81Å; L376-F380 HydrophobicContact CD2-CE2 4.08Å; L376-F380 PolarHBondContact O-N 2.81Å; F380-L382 HydrophobicContact CB-CG 4.05Å; F380-L382 PolarHBondContact O-N 3.32Å; F380-F536 HydrophobicContact CB-CD2 3.86Å; F380-F536 HydrophobicContact CB-CE2 4.5Å; F380-F536 HydrophobicContact CB-CG 4.41Å; F380-F536 HydrophobicContact CD1-CB 3.54Å; F380-F536 AromaticContact CD1-CD2 3.85Å; F380-F536 HydrophobicContact CD1-CD2 3.85Å; F380-F536 HydrophobicContact CD1-CG 4.13Å; F380-F536 AromaticContact CD2-CD2 3.79Å; F380-F536 HydrophobicContact CD2-CD2 3.79Å; F380-F536 HydrophobicContact CD2-CE2 4.42Å; F380-F536 VanDerWaalsContact CE1-CA 3.5Å; F380-F536 HydrophobicContact CE1-CB 3.87Å; F380-F536 HydrophobicContact CE1-CD2 4.32Å; F380-F536 HydrophobicContact CE2-CD2 4.27Å; F380-F536 HydrophobicContact CG-CB 4.12Å; F380-F536 AromaticContact CG-CD2 3.55Å; F380-F536 HydrophobicContact CG-CD2 3.55Å; F380-F536 HydrophobicContact CG-CE2 4.43Å; F380-F536 HydrophobicContact CG-CG 4.21Å; F380-F539 HydrophobicContact CE1-CB 4.48Å; F380-F539 HydrophobicContact CE2-CB 4.23Å; F380-F539 AromaticContact CE2-CD1 3.64Å; F380-F539 HydrophobicContact CE2-CD1 3.64Å; F380-F539 HydrophobicContact CE2-CD2 4.21Å; F380-F539 HydrophobicContact CE2-CE1 4.01Å; F380-F539 AromaticContact CE2-CG 3.76Å; F380-F539 HydrophobicContact CE2-CG 3.76Å; F380-F539 HydrophobicContact CE2-CZ 4.45Å; F380-F539 HydrophobicContact CZ-CB 3.68Å; F380-F539 AromaticContact CZ-CD1 3.99Å; F380-F539 HydrophobicContact CZ-CD1 3.99Å; F380-F539 HydrophobicContact CZ-CD2 4.02Å; F380-F539 AromaticContact CZ-CG 3.63Å; F380-F539 HydrophobicContact CZ-CG 3.63Å
381	N	87.8	Confident	90.5	Very high	103 Å²	103	21.1 Å²	21.1	55%	0.551	12%	0.115	S	C	*	.			trans	53.6	38.2	179.4	-159.3	45.3	0	0	0	112.8	E377	E377-N381 WeakPolarHBondContact O-CA 3.38Å; E377-N381 PolarHBondContact O-N 3.1Å; E377-N381 VanDerWaalsContact O-N 3.16Å
382	L	88.3	Confident	90.1	Very high	41 Å²	41	20.9 Å²	20.9	22%	0.215	11%	0.114	C	C	.	.			trans	-82.3	150	178.1	-67	-173.4	0	0	0	111.1	L376 E377 F380 F536	L376-L382 HydrophobicContact CB-CD1 4.3Å; E377-L382 WeakPolarHBondContact CA-O 3.33Å; E377-L382 PolarHBondContact O-N 3.48Å; F380-L382 HydrophobicContact CB-CG 4.05Å; F380-L382 PolarHBondContact O-N 3.32Å; L382-F536 HydrophobicContact CD1-CE2 3.65Å; L382-F536 HydrophobicContact CD1-CZ 3.85Å; L382-F536 HydrophobicContact CD2-CZ 4.46Å
383	T	87.1	Confident	89.9	Confident	28 Å²	28	25.7 Å²	25.7	17%	0.172	14%	0.138	C	C	.	.			trans	-70.2	151.5	167.8	61.8	0	0	0	0	111.3	P255 D256 S385 S386 A387	P255-T383 WeakPolarHBondContact O-CG2 3.26Å; D256-T383 HydrophobicContact CB-CG2 4.34Å; D256-T383 WeakPolarHBondContact OD1-CG2 3.31Å; T383-S385 PolarHBondContact O-N 3.26Å; T383-S385 VanDerWaalsContact O-N 3.14Å; T383-S385 PolarHBondContact OG1-OG 3.23Å; T383-S386 PolarHBondContact N-OG 3.29Å; T383-S386 PolarHBondContact O-N 3.44Å; T383-S386 PolarHBondContact O-OG 3.3Å; T383-S386 WeakPolarHBondContact OG1-CB 3.44Å; T383-S386 PolarHBondContact OG1-N 3.14Å; T383-S386 PolarHBondContact OG1-OG 2.87Å; T383-S386 VanDerWaalsContact OG1-OG 3.06Å; T383-A387 PolarHBondContact O-N 3.16Å
384	T	87.4	Confident	89.7	Confident	18 Å²	18	27.1 Å²	27.1	11%	0.11	14%	0.144	C	C	.	.	H	α-helix	trans	-51.9	-39.4	176	-57.4	0	0	0	0	112.2	T237 E377 N388	T237-T384 HydrophobicContact CG2-CG2 3.91Å; E377-T384 VanDerWaalsContact CD-OG1 3.24Å; E377-T384 WeakPolarHBondContact OE1-CA 3.37Å; E377-T384 WeakPolarHBondContact OE1-CB 3.37Å; E377-T384 WeakPolarHBondContact OE1-CG2 3.46Å; E377-T384 PolarHBondContact OE1-OG1 2.82Å; E377-T384 PolarHBondContact OE2-OG1 2.94Å; T384-N388 WeakPolarHBondContact O-CB 3.47Å; T384-N388 VanDerWaalsContact O-CG 3.29Å; T384-N388 PolarHBondContact O-N 3.48Å; T384-N388 PolarHBondContact O-ND2 3.3Å; T384-N388 VanDerWaalsContact O-ND2 3.14Å
385	S	88.9	Confident	89.5	Confident	10 Å²	10	27.4 Å²	27.4	7%	0.07	15%	0.148	C	C	.	.	H	α-helix	trans	-67.3	-40.8	179.6	73.8	0	0	0	0	113.6	S234 K238 T383 Q389	S234-S385 WeakPolarHBondContact CB-O 3.2Å; S234-S385 PolarHBondContact OG-O 3.37Å; K238-S385 WeakPolarHBondContact CE-OG 3.44Å; K238-S385 VanDerWaalsContact CG-CB 3.41Å; T383-S385 PolarHBondContact O-N 3.26Å; T383-S385 VanDerWaalsContact O-N 3.14Å; T383-S385 PolarHBondContact OG1-OG 3.23Å; S385-Q389 WeakPolarHBondContact O-CB 3.39Å; S385-Q389 PolarHBondContact O-N 2.85Å
386	S	90.3	Very high	89.2	Confident	35 Å²	35	28.5 Å²	28.5	25%	0.245	15%	0.154	C	C	.	.	H	α-helix	trans	-71.9	-39.2	179.6	65.2	0	0	0	0	111.7	T383 Q389 L390	T383-S386 PolarHBondContact N-OG 3.29Å; T383-S386 PolarHBondContact O-N 3.44Å; T383-S386 PolarHBondContact O-OG 3.3Å; T383-S386 WeakPolarHBondContact OG1-CB 3.44Å; T383-S386 PolarHBondContact OG1-N 3.14Å; T383-S386 PolarHBondContact OG1-OG 2.87Å; T383-S386 VanDerWaalsContact OG1-OG 3.06Å; S386-Q389 PolarHBondContact O-N 3Å; S386-L390 PolarHBondContact O-N 3.18Å
387	A	91.8	Very high	89	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-60.7	-46.6	173.3	0	0	0	0	0	111.7	L376 E377 T383 Q389 L390 L391	L376-A387 HydrophobicContact CB-CB 3.96Å; L376-A387 HydrophobicContact CD1-CB 4.29Å; E377-A387 HydrophobicContact CG-CB 4.29Å; T383-A387 PolarHBondContact O-N 3.16Å; A387-Q389 PolarHBondContact O-N 3.06Å; A387-L390 WeakPolarHBondContact O-CB 3.15Å; A387-L390 PolarHBondContact O-N 3.47Å; A387-L391 PolarHBondContact O-N 3.04Å; A387-L391 VanDerWaalsContact O-N 3.09Å
388	N	91.6	Very high	89	Confident	3 Å²	3	32.3 Å²	32.3	2%	0.016	18%	0.18	C	C	.	.	H	α-helix	trans	-63.5	-39.9	176.1	-78.4	-32.2	0	0	0	112.7	S62 T384 L390 L391 G392	S62-N388 WeakPolarHBondContact CA-OD1 2.92Å; S62-N388 WeakPolarHBondContact CB-OD1 3.22Å; S62-N388 PolarHBondContact O-ND2 3.09Å; S62-N388 PolarHBondContact O-OD1 3.41Å; T384-N388 WeakPolarHBondContact O-CB 3.47Å; T384-N388 VanDerWaalsContact O-CG 3.29Å; T384-N388 PolarHBondContact O-N 3.48Å; T384-N388 PolarHBondContact O-ND2 3.3Å; T384-N388 VanDerWaalsContact O-ND2 3.14Å; N388-L390 VanDerWaalsContact C-N 3.32Å; N388-L390 PolarHBondContact O-N 3.48Å; N388-L391 PolarHBondContact O-N 3.42Å; N388-G392 PolarHBondContact O-N 3.31Å
389	Q	91.5	Very high	89	Confident	80 Å²	80	32.4 Å²	32.4	37%	0.374	19%	0.185	S	C	.	.	H	α-helix	trans	-61.1	-43.8	176.3	-172.5	174.8	-8.5	0	0	111.2	S385 S386 A387 G392 M393	S385-Q389 WeakPolarHBondContact O-CB 3.39Å; S385-Q389 PolarHBondContact O-N 2.85Å; S386-Q389 PolarHBondContact O-N 3Å; A387-Q389 PolarHBondContact O-N 3.06Å; Q389-G392 PolarHBondContact O-N 2.9Å; Q389-M393 HydrophobicContact CG-CG 4.32Å; Q389-M393 HydrophobicContact CG-SD 3.59Å; Q389-M393 VanDerWaalsContact CG-SD 3.59Å; Q389-M393 VanDerWaalsContact O-CB 3.32Å; Q389-M393 WeakPolarHBondContact O-CB 3.35Å; Q389-M393 WeakPolarHBondContact O-CG 3.4Å; Q389-M393 PolarHBondContact O-N 3.45Å
390	L	90.1	Very high	88.8	Confident	30 Å²	30	34.3 Å²	34.3	16%	0.157	20%	0.198	C	C	.	.	H	α-helix	trans	-60.8	-47.2	178.5	-164.4	61.3	0	0	0	111	L376 S386 A387 N388 G392 T394 F536 L540	L376-L390 HydrophobicContact CD1-CD2 4.02Å; L376-L390 HydrophobicContact CD2-CD2 4.42Å; S386-L390 PolarHBondContact O-N 3.18Å; A387-L390 WeakPolarHBondContact O-CB 3.15Å; A387-L390 PolarHBondContact O-N 3.47Å; N388-L390 VanDerWaalsContact C-N 3.32Å; N388-L390 PolarHBondContact O-N 3.48Å; L390-G392 PolarHBondContact O-N 3.29Å; L390-T394 HydrophobicContact CD1-CG2 3.95Å; L390-T394 WeakPolarHBondContact O-CB 3.35Å; L390-T394 PolarHBondContact O-N 2.91Å; L390-T394 PolarHBondContact O-OG1 3.47Å; L390-F536 HydrophobicContact CD2-CE2 4.02Å; L390-F536 HydrophobicContact CD2-CZ 4.02Å; L390-L540 HydrophobicContact CD1-CD1 3.45Å; L390-L540 VanDerWaalsContact CD1-CD1 3.45Å; L390-L540 HydrophobicContact CD1-CD2 3.8Å; L390-L540 HydrophobicContact CD1-CG 4.25Å; L390-L540 HydrophobicContact CD2-CD1 3.95Å; L390-L540 HydrophobicContact CG-CD1 3.82Å
391	L	88.1	Confident	88.8	Confident	11 Å²	11	37.8 Å²	37.8	6%	0.058	22%	0.217	C	C	.	.	I	π-helix	trans	-62.9	-44.2	-179.9	-172.6	45.2	0	0	0	112.2	F230 L372 A387 N388 A395 I396	F230-L391 HydrophobicContact CD1-CB 4.25Å; F230-L391 HydrophobicContact CD1-CD2 3.72Å; F230-L391 HydrophobicContact CD1-CG 3.95Å; F230-L391 HydrophobicContact CD2-CD2 4.35Å; F230-L391 HydrophobicContact CD2-CG 3.99Å; F230-L391 HydrophobicContact CE1-CD2 3.25Å; F230-L391 HydrophobicContact CE1-CG 3.91Å; F230-L391 HydrophobicContact CE2-CD2 3.92Å; F230-L391 HydrophobicContact CE2-CG 3.91Å; F230-L391 HydrophobicContact CG-CB 4.33Å; F230-L391 HydrophobicContact CG-CD2 4.26Å; F230-L391 HydrophobicContact CG-CG 4.01Å; F230-L391 HydrophobicContact CZ-CD2 3.35Å; F230-L391 HydrophobicContact CZ-CG 3.88Å; L372-L391 HydrophobicContact CD2-CD1 3.83Å; A387-L391 PolarHBondContact O-N 3.04Å; A387-L391 VanDerWaalsContact O-N 3.09Å; N388-L391 PolarHBondContact O-N 3.42Å; L391-A395 HydrophobicContact CD1-CB 3.8Å; L391-I396 PolarHBondContact O-N 3.1Å
392	G	86.1	Confident	88.9	Confident	1 Å²	1	32.9 Å²	32.9	1%	0.01	19%	0.191	C	C	.	.	I	π-helix	trans	-70.3	-38.6	179.5	0	0	0	0	0	114.5	N388 Q389 L390 P397	N388-G392 PolarHBondContact O-N 3.31Å; Q389-G392 PolarHBondContact O-N 2.9Å; L390-G392 PolarHBondContact O-N 3.29Å; G392-P397 WeakPolarHBondContact O-CD 3.47Å
393	M	88.2	Confident	88.9	Confident	111 Å²	111	32.9 Å²	32.9	55%	0.547	19%	0.19	S	C	.	.	I	π-helix	trans	-94.7	-21.8	-173.4	-66.4	-176.7	64.8	0	0	114.7	I231 Q389 P397	I231-M393 HydrophobicContact CD1-CG 4.36Å; I231-M393 HydrophobicContact CG1-CG 4.36Å; Q389-M393 HydrophobicContact CG-CG 4.32Å; Q389-M393 HydrophobicContact CG-SD 3.59Å; Q389-M393 VanDerWaalsContact CG-SD 3.59Å; Q389-M393 VanDerWaalsContact O-CB 3.32Å; Q389-M393 WeakPolarHBondContact O-CB 3.35Å; Q389-M393 WeakPolarHBondContact O-CG 3.4Å; Q389-M393 PolarHBondContact O-N 3.45Å; M393-P397 WeakPolarHBondContact O-CG 3.42Å
394	T	87.3	Confident	88.9	Confident	38 Å²	38	38.1 Å²	38.1	23%	0.233	21%	0.211	C	C	.	.	I	π-helix	trans	-115.7	-63.9	-174.6	68.1	0	0	0	0	112.4	L390 I396 P397 C398	L390-T394 HydrophobicContact CD1-CG2 3.95Å; L390-T394 WeakPolarHBondContact O-CB 3.35Å; L390-T394 PolarHBondContact O-N 2.91Å; L390-T394 PolarHBondContact O-OG1 3.47Å; T394-I396 PolarHBondContact O-N 3.3Å; T394-P397 WeakPolarHBondContact O-CD 3.39Å; T394-C398 WeakPolarHBondContact O-CB 3.4Å; T394-C398 PolarHBondContact O-N 3.03Å; T394-C398 VanDerWaalsContact O-N 3.09Å; T394-C398 PolarHBondContact O-SG 3.37Å
395	A	85.9	Confident	89.1	Confident	12 Å²	12	40.2 Å²	40.2	10%	0.099	22%	0.221	C	C	.	.	I	π-helix	trans	-63	-44.7	-171.4	0	0	0	0	0	113.2	L391 C398 A399	L391-A395 HydrophobicContact CD1-CB 3.8Å; A395-C398 PolarHBondContact O-N 3.35Å; A395-A399 PolarHBondContact O-N 2.99Å
396	I	87.9	Confident	89.1	Confident	24 Å²	24	39.8 Å²	39.8	12%	0.123	22%	0.218	C	C	.	.	H	α-helix	trans	-68.5	-49.3	-178.3	-64.4	168.1	0	0	0	112	P226 A227 F230 L391 T394 C398 A399 C400	P226-I396 HydrophobicContact CB-CD1 3.96Å; A227-I396 HydrophobicContact CB-CB 4.33Å; A227-I396 HydrophobicContact CB-CD1 4.44Å; A227-I396 HydrophobicContact CB-CG2 3.87Å; F230-I396 HydrophobicContact CD2-CD1 3.45Å; F230-I396 VanDerWaalsContact CD2-CD1 3.45Å; F230-I396 HydrophobicContact CE2-CD1 3.86Å; L391-I396 PolarHBondContact O-N 3.1Å; T394-I396 PolarHBondContact O-N 3.3Å; I396-C398 VanDerWaalsContact C-N 3.3Å; I396-C398 PolarHBondContact O-N 3.06Å; I396-A399 WeakPolarHBondContact O-CB 3.48Å; I396-A399 PolarHBondContact O-N 2.99Å; I396-A399 VanDerWaalsContact O-N 3.1Å; I396-C400 PolarHBondContact O-N 3.12Å; I396-C400 PolarHBondContact O-SG 2.87Å; I396-C400 VanDerWaalsContact O-SG 3.35Å
397	P	89	Confident	88.9	Confident	60 Å²	60	39.2 Å²	39.2	39%	0.39	22%	0.218	S	C	.	.	H	α-helix	trans	-57.2	-39.1	173.8	-29.8	38.5	0	0	0	113.9	G392 M393 T394 C400 L401	G392-P397 WeakPolarHBondContact O-CD 3.47Å; M393-P397 WeakPolarHBondContact O-CG 3.42Å; T394-P397 WeakPolarHBondContact O-CD 3.39Å; P397-C400 WeakPolarHBondContact O-CB 3.18Å; P397-C400 PolarHBondContact O-N 3.06Å; P397-L401 PolarHBondContact O-N 3.14Å
398	C	90.9	Very high	88.5	Confident	31 Å²	31	43.1 Å²	43.1	21%	0.209	24%	0.238	C	C	.	.	H	α-helix	trans	-62	-42.8	174.1	-72.6	0	0	0	0	111.8	T394 A395 I396 L401 G402 L548	T394-C398 WeakPolarHBondContact O-CB 3.4Å; T394-C398 PolarHBondContact O-N 3.03Å; T394-C398 VanDerWaalsContact O-N 3.09Å; T394-C398 PolarHBondContact O-SG 3.37Å; A395-C398 PolarHBondContact O-N 3.35Å; I396-C398 VanDerWaalsContact C-N 3.3Å; I396-C398 PolarHBondContact O-N 3.06Å; C398-L401 PolarHBondContact O-N 3.32Å; C398-G402 PolarHBondContact O-N 2.85Å; C398-L548 WeakPolarHBondContact O-CD1 3.48Å
399	A	89.6	Confident	88.4	Confident	27 Å²	27	46.4 Å²	46.4	22%	0.223	26%	0.255	C	S	.	.	H	α-helix	trans	-61.9	-44.8	174.7	0	0	0	0	0	111.9	A395 I396 L401 G402 I403 A551	A395-A399 PolarHBondContact O-N 2.99Å; I396-A399 WeakPolarHBondContact O-CB 3.48Å; I396-A399 PolarHBondContact O-N 2.99Å; I396-A399 VanDerWaalsContact O-N 3.1Å; A399-L401 VanDerWaalsContact C-N 3.34Å; A399-L401 PolarHBondContact O-N 2.71Å; A399-G402 WeakPolarHBondContact O-CA 3.49Å; A399-G402 PolarHBondContact O-N 3.48Å; A399-I403 WeakPolarHBondContact O-CG1 3.05Å; A399-I403 PolarHBondContact O-N 2.9Å; A399-A551 HydrophobicContact CB-CB 4.16Å; A399-A551 VanDerWaalsContact O-CB 3.27Å; A399-A551 WeakPolarHBondContact O-CB 3.48Å
400	C	87.1	Confident	88	Confident	43 Å²	43	43 Å²	43	29%	0.291	24%	0.24	S	C	.	.	H	α-helix	trans	-56	-46.8	175.3	-67.1	0	0	0	0	112.3	V223 I396 P397 G402 I403 F404	V223-C400 WeakPolarHBondContact CG1-SG 3.39Å; I396-C400 PolarHBondContact O-N 3.12Å; I396-C400 PolarHBondContact O-SG 2.87Å; I396-C400 VanDerWaalsContact O-SG 3.35Å; P397-C400 WeakPolarHBondContact O-CB 3.18Å; P397-C400 PolarHBondContact O-N 3.06Å; C400-G402 PolarHBondContact O-N 3.36Å; C400-I403 PolarHBondContact O-N 3.4Å; C400-F404 PolarHBondContact O-N 2.71Å; C400-F404 VanDerWaalsContact O-N 3.13Å
401	L	89.8	Confident	87.7	Confident	88 Å²	88	49.9 Å²	49.9	46%	0.461	27%	0.269	S	S	.	.	H	α-helix	trans	-61	-37.5	176.4	-176.8	62.1	0	0	0	111	P397 C398 A399 F404 L405 L548	P397-L401 PolarHBondContact O-N 3.14Å; C398-L401 PolarHBondContact O-N 3.32Å; A399-L401 VanDerWaalsContact C-N 3.34Å; A399-L401 PolarHBondContact O-N 2.71Å; L401-F404 PolarHBondContact O-N 3.34Å; L401-L405 HydrophobicContact CD1-CD1 4.41Å; L401-L405 HydrophobicContact CD1-CG 4.31Å; L401-L405 HydrophobicContact CG-CD1 4.08Å; L401-L405 HydrophobicContact CG-CG 4.38Å; L401-L405 WeakPolarHBondContact O-CB 3.32Å; L401-L405 VanDerWaalsContact O-CG 3.28Å; L401-L405 WeakPolarHBondContact O-CG 3.16Å; L401-L405 PolarHBondContact O-N 3.32Å; L401-L548 HydrophobicContact CB-CD1 3.75Å; L401-L548 HydrophobicContact CD2-CD1 3.83Å; L401-L548 HydrophobicContact CG-CD1 3.67Å
402	G	91.3	Very high	87.6	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-64.5	-46.4	178.7	0	0	0	0	0	112.7	C398 A399 C400 F404 L405 G406 L548 M552	C398-G402 PolarHBondContact O-N 2.85Å; A399-G402 WeakPolarHBondContact O-CA 3.49Å; A399-G402 PolarHBondContact O-N 3.48Å; C400-G402 PolarHBondContact O-N 3.36Å; G402-F404 VanDerWaalsContact C-N 3.32Å; G402-F404 PolarHBondContact O-N 3.44Å; G402-L405 PolarHBondContact O-N 3.02Å; G402-G406 PolarHBondContact O-N 3.42Å; G402-L548 VanDerWaalsContact CA-O 3.23Å; G402-L548 WeakPolarHBondContact CA-O 3.13Å; G402-M552 WeakPolarHBondContact O-CA 3.3Å; G402-M552 VanDerWaalsContact O-CG 3.26Å; G402-M552 WeakPolarHBondContact O-CG 3.09Å
403	I	88.3	Confident	87.7	Confident	41 Å²	41	62.2 Å²	62.2	21%	0.21	33%	0.325	C	S	.	.	H	α-helix	trans	-58.5	-47.1	175.2	-59.3	166.8	0	0	0	110	V223 A399 C400 G406 G407 A551 Q554 T555	V223-I403 HydrophobicContact CG1-CD1 4.44Å; A399-I403 WeakPolarHBondContact O-CG1 3.05Å; A399-I403 PolarHBondContact O-N 2.9Å; C400-I403 PolarHBondContact O-N 3.4Å; I403-G406 PolarHBondContact O-N 2.9Å; I403-G407 PolarHBondContact O-N 3.5Å; I403-A551 HydrophobicContact CG1-CB 3.94Å; I403-Q554 VanDerWaalsContact CG1-OE1 3.27Å; I403-T555 PolarHBondContact O-OG1 3.45Å
404	F	86.8	Confident	87.5	Confident	138 Å²	138	61.9 Å²	61.9	61%	0.605	33%	0.334	S	S	*	.	H	α-helix	trans	-61.5	-48.4	179.6	179	-99.6	0	0	0	112.2	C400 L401 G402 G406 G407 L408	C400-F404 PolarHBondContact O-N 2.71Å; C400-F404 VanDerWaalsContact O-N 3.13Å; L401-F404 PolarHBondContact O-N 3.34Å; G402-F404 VanDerWaalsContact C-N 3.32Å; G402-F404 PolarHBondContact O-N 3.44Å; F404-G406 VanDerWaalsContact C-N 3.32Å; F404-G406 PolarHBondContact O-N 3.33Å; F404-G407 PolarHBondContact O-N 3.43Å; F404-L408 WeakPolarHBondContact O-CB 3.38Å; F404-L408 PolarHBondContact O-N 2.9Å
405	L	90.3	Very high	87.2	Confident	62 Å²	62	61.6 Å²	61.6	33%	0.325	33%	0.331	S	S	.	.	H	α-helix	trans	-62.9	-38.1	176.7	-70.7	177.1	0	0	0	111.8	L401 G402 L408 L409 L548	L401-L405 HydrophobicContact CD1-CD1 4.41Å; L401-L405 HydrophobicContact CD1-CG 4.31Å; L401-L405 HydrophobicContact CG-CD1 4.08Å; L401-L405 HydrophobicContact CG-CG 4.38Å; L401-L405 WeakPolarHBondContact O-CB 3.32Å; L401-L405 VanDerWaalsContact O-CG 3.28Å; L401-L405 WeakPolarHBondContact O-CG 3.16Å; L401-L405 PolarHBondContact O-N 3.32Å; G402-L405 PolarHBondContact O-N 3.02Å; L405-L408 PolarHBondContact O-N 2.89Å; L405-L409 WeakPolarHBondContact O-CB 3.42Å; L405-L409 PolarHBondContact O-N 3.49Å; L405-L548 HydrophobicContact CD1-CD1 4.15Å
406	G	89.1	Confident	87.1	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-58.5	-48.1	174.3	0	0	0	0	0	112	G402 I403 F404 L409 V410	G402-G406 PolarHBondContact O-N 3.42Å; I403-G406 PolarHBondContact O-N 2.9Å; F404-G406 VanDerWaalsContact C-N 3.32Å; F404-G406 PolarHBondContact O-N 3.33Å; G406-L409 PolarHBondContact O-N 3Å; G406-V410 WeakPolarHBondContact O-CG2 3.47Å; G406-V410 PolarHBondContact O-N 3.47Å; G406-V410 VanDerWaalsContact O-N 3.14Å
407	G	85.6	Confident	86.7	Confident	23 Å²	23	63.1 Å²	63.1	24%	0.237	34%	0.344	C	S	.	.	H	α-helix	trans	-64.4	-41.2	174.9	0	0	0	0	0	113.7	I403 F404 L409 V410 K411	I403-G407 PolarHBondContact O-N 3.5Å; F404-G407 PolarHBondContact O-N 3.43Å; G407-L409 VanDerWaalsContact C-N 3.34Å; G407-L409 PolarHBondContact O-N 2.93Å; G407-V410 PolarHBondContact O-N 3.21Å; G407-K411 WeakPolarHBondContact O-CB 3.41Å; G407-K411 PolarHBondContact O-N 3.06Å
408	L	85.4	Confident	86.6	Confident	83 Å²	83	61.4 Å²	61.4	44%	0.435	33%	0.331	S	S	.	.	H	α-helix	trans	-62.4	-41.6	176.2	-175.7	65.7	0	0	0	111.5	F404 L405 K411 K412	F404-L408 WeakPolarHBondContact O-CB 3.38Å; F404-L408 PolarHBondContact O-N 2.9Å; L405-L408 PolarHBondContact O-N 2.89Å; L408-K411 PolarHBondContact O-N 3.48Å; L408-K412 VanDerWaalsContact O-CB 3.29Å; L408-K412 WeakPolarHBondContact O-CB 3.38Å; L408-K412 PolarHBondContact O-N 3.09Å
409	L	87.8	Confident	86.4	Confident	72 Å²	72	60.7 Å²	60.7	38%	0.377	33%	0.329	S	S	.	.	H	α-helix	trans	-64.1	-45.6	179.1	-158.2	86.8	0	0	0	111.2	L405 G406 G407 K411 K412 L413 M423	L405-L409 WeakPolarHBondContact O-CB 3.42Å; L405-L409 PolarHBondContact O-N 3.49Å; G406-L409 PolarHBondContact O-N 3Å; G407-L409 VanDerWaalsContact C-N 3.34Å; G407-L409 PolarHBondContact O-N 2.93Å; L409-K411 VanDerWaalsContact C-N 3.3Å; L409-K411 PolarHBondContact O-N 3.19Å; L409-K412 PolarHBondContact O-N 3.42Å; L409-L413 HydrophobicContact CD1-CD1 4.3Å; L409-L413 HydrophobicContact CD2-CD1 4.16Å; L409-L413 HydrophobicContact CG-CD1 3.82Å; L409-L413 HydrophobicContact CG-CG 4.43Å; L409-L413 WeakPolarHBondContact O-CB 3.21Å; L409-L413 WeakPolarHBondContact O-CG 3.33Å; L409-L413 PolarHBondContact O-N 3.04Å; L409-M423 HydrophobicContact CB-CE 4Å; L409-M423 HydrophobicContact CB-SD 4.49Å; L409-M423 HydrophobicContact CD2-CE 3.54Å; L409-M423 HydrophobicContact CD2-CG 4.29Å; L409-M423 HydrophobicContact CD2-SD 3.7Å; L409-M423 HydrophobicContact CG-CE 4.39Å
410	V	84.3	Confident	86.3	Confident	9 Å²	9	59.4 Å²	59.4	6%	0.055	32%	0.318	C	S	.	.	H	α-helix	trans	-59.9	-42.1	176.8	174.2	0	0	0	0	111.2	G406 G407 S414 L415 M423 P556 I559	G406-V410 WeakPolarHBondContact O-CG2 3.47Å; G406-V410 PolarHBondContact O-N 3.47Å; G406-V410 VanDerWaalsContact O-N 3.14Å; G407-V410 PolarHBondContact O-N 3.21Å; V410-S414 PolarHBondContact O-N 3.39Å; V410-L415 HydrophobicContact CG1-CB 4.39Å; V410-L415 HydrophobicContact CG2-CD1 4.21Å; V410-L415 PolarHBondContact O-N 3.45Å; V410-L415 VanDerWaalsContact O-N 3.11Å; V410-M423 HydrophobicContact CG2-CE 4.45Å; V410-M423 HydrophobicContact CG2-SD 3.76Å; V410-P556 HydrophobicContact CG2-CB 4.09Å; V410-I559 HydrophobicContact CB-CD1 4.29Å; V410-I559 HydrophobicContact CG1-CD1 3.6Å
411	K	83.4	Confident	86.5	Confident	173 Å²	173	57.3 Å²	57.3	75%	0.752	30%	0.304	S	S	*	.	H	α-helix	trans	-68.1	-51.1	178.3	-175.7	179.9	178.7	-178.2	0	112	G407 L408 L409 L413 S414	G407-K411 WeakPolarHBondContact O-CB 3.41Å; G407-K411 PolarHBondContact O-N 3.06Å; L408-K411 PolarHBondContact O-N 3.48Å; L409-K411 VanDerWaalsContact C-N 3.3Å; L409-K411 PolarHBondContact O-N 3.19Å; K411-L413 PolarHBondContact O-N 3.38Å; K411-S414 PolarHBondContact O-N 2.97Å; K411-S414 VanDerWaalsContact O-N 3.14Å
412	K	86.7	Confident	86.6	Confident	175 Å²	175	59.5 Å²	59.5	76%	0.761	31%	0.306	S	S	*	.	H	α-helix	trans	-66.5	-36.8	-174.4	-170.9	179.4	179.9	-177.8	0	112.4	L408 L409 S414	L408-K412 VanDerWaalsContact O-CB 3.29Å; L408-K412 WeakPolarHBondContact O-CB 3.38Å; L408-K412 PolarHBondContact O-N 3.09Å; L409-K412 PolarHBondContact O-N 3.42Å; K412-S414 VanDerWaalsContact C-N 3.3Å
413	L	87	Confident	86.6	Confident	96 Å²	96	60.3 Å²	60.3	50%	0.503	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-0.3	176.7	-60.9	179.4	0	0	0	113	L409 K411 L415	L409-L413 HydrophobicContact CD1-CD1 4.3Å; L409-L413 HydrophobicContact CD2-CD1 4.16Å; L409-L413 HydrophobicContact CG-CD1 3.82Å; L409-L413 HydrophobicContact CG-CG 4.43Å; L409-L413 WeakPolarHBondContact O-CB 3.21Å; L409-L413 WeakPolarHBondContact O-CG 3.33Å; L409-L413 PolarHBondContact O-N 3.04Å; K411-L413 PolarHBondContact O-N 3.38Å; L413-L415 HydrophobicContact CB-CD2 3.64Å; L413-L415 HydrophobicContact CB-CG 3.79Å; L413-L415 HydrophobicContact CD1-CD2 4.19Å; L413-L415 PolarHBondContact O-N 3.07Å; L413-L415 VanDerWaalsContact O-N 3.16Å
414	S	85.3	Confident	86.8	Confident	105 Å²	105	58.3 Å²	58.3	73%	0.734	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.9	44.2	-176.9	55	0	0	0	0	112.7	V410 K411 K412 S416	V410-S414 PolarHBondContact O-N 3.39Å; K411-S414 PolarHBondContact O-N 2.97Å; K411-S414 VanDerWaalsContact O-N 3.14Å; K412-S414 VanDerWaalsContact C-N 3.3Å; S414-S416 PolarHBondContact O-N 3.19Å
415	L	80.3	Confident	87.1	Confident	31 Å²	31	53.3 Å²	53.3	16%	0.162	28%	0.279	C	S	.	.			trans	-62.7	129.5	-169.8	-62.8	178.3	0	0	0	111	V410 L413 M423 R563	V410-L415 HydrophobicContact CG1-CB 4.39Å; V410-L415 HydrophobicContact CG2-CD1 4.21Å; V410-L415 PolarHBondContact O-N 3.45Å; V410-L415 VanDerWaalsContact O-N 3.11Å; L413-L415 HydrophobicContact CB-CD2 3.64Å; L413-L415 HydrophobicContact CB-CG 3.79Å; L413-L415 HydrophobicContact CD1-CD2 4.19Å; L413-L415 PolarHBondContact O-N 3.07Å; L413-L415 VanDerWaalsContact O-N 3.16Å; L415-M423 HydrophobicContact CD1-CB 4.23Å; L415-M423 HydrophobicContact CD1-SD 3.82Å; L415-R563 PolarHBondContact O-NH1 3.25Å
416	S	83.4	Confident	87.4	Confident	60 Å²	60	55.5 Å²	55.5	42%	0.42	29%	0.291	S	S	.	.			trans	-67.8	170.4	166.1	69.4	0	0	0	0	110.6	S414 L418 G419 A420	S414-S416 PolarHBondContact O-N 3.19Å; S416-L418 PolarHBondContact O-N 3.24Å; S416-G419 WeakPolarHBondContact O-CA 3.11Å; S416-G419 PolarHBondContact O-N 2.78Å; S416-G419 PolarHBondContact OG-N 2.76Å; S416-A420 PolarHBondContact O-N 2.98Å
417	A	80.4	Confident	87.6	Confident	9 Å²	9	56.1 Å²	56.1	7%	0.074	29%	0.294	C	S	.	.	H	α-helix	trans	-55.4	-35.1	175.7	0	0	0	0	0	112.3	A420 I421 L648	A417-A420 PolarHBondContact O-N 2.82Å; A417-I421 WeakPolarHBondContact O-CG2 3.4Å; A417-I421 PolarHBondContact O-N 2.8Å; A417-I421 VanDerWaalsContact O-N 3.11Å; A417-L648 HydrophobicContact CB-CD2 4.11Å
418	L	85.4	Confident	88	Confident	24 Å²	24	55 Å²	55	13%	0.126	28%	0.283	C	S	.	.	H	α-helix	trans	-71.1	-33.7	175.5	-165.8	70.2	0	0	0	112.7	S416 I421 R422 W645 L648 R649	S416-L418 PolarHBondContact O-N 3.24Å; L418-I421 HydrophobicContact CD1-CG2 4.36Å; L418-I421 VanDerWaalsContact O-CG2 3.23Å; L418-I421 WeakPolarHBondContact O-CG2 3.46Å; L418-R422 WeakPolarHBondContact O-CG 3.37Å; L418-R422 PolarHBondContact O-N 2.91Å; L418-W645 HydrophobicContact CD1-CG 4.49Å; L418-L648 HydrophobicContact CD1-CD2 4.22Å; L418-R649 HydrophobicContact CD1-CB 4.44Å
419	G	87.3	Confident	88.5	Confident	15 Å²	15	55.5 Å²	55.5	16%	0.155	29%	0.285	C	S	.	.	H	α-helix	trans	-69.4	-41.9	172.5	0	0	0	0	0	112.3	S416 R422 M423	S416-G419 WeakPolarHBondContact O-CA 3.11Å; S416-G419 PolarHBondContact O-N 2.78Å; S416-G419 PolarHBondContact OG-N 2.76Å; G419-R422 PolarHBondContact O-N 3.38Å; G419-M423 PolarHBondContact O-N 2.81Å
420	A	87.6	Confident	88.8	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-63.1	-42.9	178.6	0	0	0	0	0	112.2	S416 A417 M423 A424 P556 I560	S416-A420 PolarHBondContact O-N 2.98Å; A417-A420 PolarHBondContact O-N 2.82Å; A420-M423 WeakPolarHBondContact O-CB 3.23Å; A420-M423 PolarHBondContact O-N 3.45Å; A420-A424 PolarHBondContact O-N 2.94Å; A420-P556 HydrophobicContact CB-CB 4.03Å; A420-I560 HydrophobicContact CB-CD1 4.04Å; A420-I560 HydrophobicContact CB-CG1 3.78Å
421	I	90.6	Very high	89.3	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-67.9	-36.2	177.9	-172.4	66.7	0	0	0	111.7	I354 A417 L418 M423 A424 M425 I560 Y641 T644 W645 L648	I354-I421 HydrophobicContact CD1-CD1 4.15Å; A417-I421 WeakPolarHBondContact O-CG2 3.4Å; A417-I421 PolarHBondContact O-N 2.8Å; A417-I421 VanDerWaalsContact O-N 3.11Å; L418-I421 HydrophobicContact CD1-CG2 4.36Å; L418-I421 VanDerWaalsContact O-CG2 3.23Å; L418-I421 WeakPolarHBondContact O-CG2 3.46Å; I421-M423 VanDerWaalsContact C-N 3.34Å; I421-A424 PolarHBondContact O-N 3.2Å; I421-M425 HydrophobicContact CG1-SD 4.41Å; I421-M425 WeakPolarHBondContact O-CB 3.37Å; I421-M425 VanDerWaalsContact O-CG 3.24Å; I421-M425 WeakPolarHBondContact O-CG 3.38Å; I421-M425 PolarHBondContact O-N 3.46Å; I421-I560 HydrophobicContact CB-CD1 3.78Å; I421-I560 HydrophobicContact CD1-CD1 3.95Å; I421-I560 HydrophobicContact CG1-CD1 4.48Å; I421-Y641 HydrophobicContact CD1-CD1 3.53Å; I421-Y641 HydrophobicContact CD1-CE1 4.4Å; I421-Y641 HydrophobicContact CD1-CG 4.21Å; I421-T644 HydrophobicContact CD1-CG2 4.09Å; I421-T644 HydrophobicContact CG1-CG2 4.47Å; I421-W645 HydrophobicContact CG1-CB 3.98Å; I421-W645 HydrophobicContact CG2-CB 4.16Å; I421-W645 HydrophobicContact CG2-CG 4.39Å; I421-L648 HydrophobicContact CG2-CD2 4.43Å
422	R	91.8	Very high	89.8	Confident	134 Å²	134	47 Å²	47	51%	0.506	25%	0.251	S	S	.	.	H	α-helix	trans	-63.6	-41.3	173.9	-76.6	176.6	176.2	162.3	2.6	111.7	L418 G419 M425 L426	L418-R422 WeakPolarHBondContact O-CG 3.37Å; L418-R422 PolarHBondContact O-N 2.91Å; G419-R422 PolarHBondContact O-N 3.38Å; R422-M425 PolarHBondContact O-N 2.94Å; R422-L426 WeakPolarHBondContact O-CB 3.45Å; R422-L426 PolarHBondContact O-N 3.38Å
423	M	92.3	Very high	90.1	Very high	16 Å²	16	41.5 Å²	41.5	8%	0.079	24%	0.238	C	C	.	.	H	α-helix	trans	-61.7	-47.7	173.8	178.1	-172.9	170.5	0	0	111.1	L409 V410 L415 G419 A420 I421 M425 L426 V427 M552 P556	L409-M423 HydrophobicContact CB-CE 4Å; L409-M423 HydrophobicContact CB-SD 4.49Å; L409-M423 HydrophobicContact CD2-CE 3.54Å; L409-M423 HydrophobicContact CD2-CG 4.29Å; L409-M423 HydrophobicContact CD2-SD 3.7Å; L409-M423 HydrophobicContact CG-CE 4.39Å; V410-M423 HydrophobicContact CG2-CE 4.45Å; V410-M423 HydrophobicContact CG2-SD 3.76Å; L415-M423 HydrophobicContact CD1-CB 4.23Å; L415-M423 HydrophobicContact CD1-SD 3.82Å; G419-M423 PolarHBondContact O-N 2.81Å; A420-M423 WeakPolarHBondContact O-CB 3.23Å; A420-M423 PolarHBondContact O-N 3.45Å; I421-M423 VanDerWaalsContact C-N 3.34Å; M423-M425 VanDerWaalsContact C-N 3.34Å; M423-M425 PolarHBondContact O-N 3.38Å; M423-L426 PolarHBondContact O-N 3.26Å; M423-V427 HydrophobicContact CG-CG2 4.36Å; M423-V427 WeakPolarHBondContact O-CB 3.49Å; M423-V427 VanDerWaalsContact O-CG2 3.32Å; M423-V427 WeakPolarHBondContact O-CG2 3.4Å; M423-V427 PolarHBondContact O-N 2.96Å; M423-M552 HydrophobicContact CE-CB 4.49Å; M423-M552 HydrophobicContact CE-CE 4.33Å; M423-P556 HydrophobicContact CE-CG 4.33Å; M423-P556 HydrophobicContact SD-CB 4.39Å; M423-P556 HydrophobicContact SD-CG 4.19Å
424	A	92.4	Very high	90.4	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-59.6	-43.3	177.7	0	0	0	0	0	112	A420 I421 V427 N428 P556 Y641	A420-A424 PolarHBondContact O-N 2.94Å; I421-A424 PolarHBondContact O-N 3.2Å; A424-V427 PolarHBondContact O-N 3.15Å; A424-N428 VanDerWaalsContact O-CB 3.27Å; A424-N428 WeakPolarHBondContact O-CB 3.43Å; A424-N428 PolarHBondContact O-N 2.95Å; A424-P556 HydrophobicContact CB-CG 4.46Å; A424-Y641 HydrophobicContact CB-CD1 4.46Å; A424-Y641 HydrophobicContact CB-CE1 4.25Å
425	M	93.9	Very high	90.8	Very high	33 Å²	33	33.9 Å²	33.9	16%	0.163	19%	0.189	C	C	.	.	H	α-helix	trans	-60.1	-46.5	174.3	-71.9	171.2	57.8	0	0	112.5	I421 R422 M423 N428 L429 F638 T642 W645	I421-M425 HydrophobicContact CG1-SD 4.41Å; I421-M425 WeakPolarHBondContact O-CB 3.37Å; I421-M425 VanDerWaalsContact O-CG 3.24Å; I421-M425 WeakPolarHBondContact O-CG 3.38Å; I421-M425 PolarHBondContact O-N 3.46Å; R422-M425 PolarHBondContact O-N 2.94Å; M423-M425 VanDerWaalsContact C-N 3.34Å; M423-M425 PolarHBondContact O-N 3.38Å; M425-N428 PolarHBondContact O-N 3.35Å; M425-L429 WeakPolarHBondContact O-CB 3.39Å; M425-L429 PolarHBondContact O-N 3.14Å; M425-F638 HydrophobicContact CB-CE2 4.35Å; M425-T642 HydrophobicContact CE-CG2 3.45Å; M425-T642 VanDerWaalsContact CE-CG2 3.45Å; M425-T642 HydrophobicContact SD-CG2 4.43Å; M425-W645 HydrophobicContact SD-CB 3.69Å; M425-W645 HydrophobicContact SD-CG 4.1Å
426	L	94.5	Very high	91.5	Very high	108 Å²	108	35.2 Å²	35.2	57%	0.565	20%	0.198	S	C	*	.	H	α-helix	trans	-63.6	-46.6	179.4	177.8	64.2	0	0	0	111.2	R422 M423 L429 V430	R422-L426 WeakPolarHBondContact O-CB 3.45Å; R422-L426 PolarHBondContact O-N 3.38Å; M423-L426 PolarHBondContact O-N 3.26Å; L426-L429 PolarHBondContact O-N 2.78Å; L426-V430 HydrophobicContact CD1-CG2 4.26Å; L426-V430 WeakPolarHBondContact O-CG2 3.38Å; L426-V430 PolarHBondContact O-N 2.92Å
427	V	94.2	Very high	91.9	Very high	12 Å²	12	34.8 Å²	34.8	7%	0.073	20%	0.195	C	C	.	.	H	α-helix	trans	-62.6	-44.5	178.8	169.9	0	0	0	0	111.1	M423 A424 L429 V430 S431 I549 M552 A553	M423-V427 HydrophobicContact CG-CG2 4.36Å; M423-V427 WeakPolarHBondContact O-CB 3.49Å; M423-V427 VanDerWaalsContact O-CG2 3.32Å; M423-V427 WeakPolarHBondContact O-CG2 3.4Å; M423-V427 PolarHBondContact O-N 2.96Å; A424-V427 PolarHBondContact O-N 3.15Å; V427-L429 VanDerWaalsContact C-N 3.35Å; V427-L429 PolarHBondContact O-N 3.11Å; V427-V430 PolarHBondContact O-N 3.31Å; V427-S431 WeakPolarHBondContact O-CB 3.49Å; V427-S431 PolarHBondContact O-N 3.17Å; V427-I549 HydrophobicContact CG1-CG2 4.05Å; V427-I549 WeakPolarHBondContact CG1-O 3.29Å; V427-M552 HydrophobicContact CG1-CB 4.2Å; V427-M552 HydrophobicContact CG2-CB 4.17Å; V427-A553 HydrophobicContact CB-CB 4.19Å; V427-A553 HydrophobicContact CG1-CB 3.71Å
428	N	94.8	Very high	92.5	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-62.3	-41.9	176.7	174	-79.1	0	0	0	111.4	E361 A424 M425 S431 T432 K634 F638 Y641	E361-N428 PolarHBondContact OE1-ND2 2.92Å; A424-N428 VanDerWaalsContact O-CB 3.27Å; A424-N428 WeakPolarHBondContact O-CB 3.43Å; A424-N428 PolarHBondContact O-N 2.95Å; M425-N428 PolarHBondContact O-N 3.35Å; N428-S431 PolarHBondContact O-N 3.31Å; N428-T432 WeakPolarHBondContact O-CB 3.29Å; N428-T432 PolarHBondContact O-N 2.97Å; N428-T432 PolarHBondContact O-OG1 3.16Å; N428-K634 PolarHBondContact ND2-O 3.48Å; N428-K634 PolarHBondContact OD1-O 3.05Å; N428-F638 WeakPolarHBondContact OD1-CB 3.18Å; N428-Y641 HydrophobicContact CB-CD2 4.25Å; N428-Y641 HydrophobicContact CB-CE2 4.22Å
429	L	95.1	Very high	92.9	Very high	93 Å²	93	34.3 Å²	34.3	49%	0.487	19%	0.191	S	C	.	.	H	α-helix	trans	-61.8	-48.6	176.5	-178.4	66.6	0	0	0	112	M425 L426 V427 T432 A433 F638	M425-L429 WeakPolarHBondContact O-CB 3.39Å; M425-L429 PolarHBondContact O-N 3.14Å; L426-L429 PolarHBondContact O-N 2.78Å; V427-L429 VanDerWaalsContact C-N 3.35Å; V427-L429 PolarHBondContact O-N 3.11Å; L429-T432 PolarHBondContact O-N 3.03Å; L429-A433 PolarHBondContact O-N 2.76Å; L429-F638 HydrophobicContact CB-CD2 4.39Å; L429-F638 HydrophobicContact CB-CE2 4.07Å; L429-F638 HydrophobicContact CD1-CE2 4.4Å
430	V	94.9	Very high	93.1	Very high	59 Å²	59	40.6 Å²	40.6	36%	0.358	22%	0.215	S	C	.	.	H	α-helix	trans	-65.1	-43.1	178.6	177.1	0	0	0	0	110.7	L426 V427 T432 A433 C434 I549	L426-V430 HydrophobicContact CD1-CG2 4.26Å; L426-V430 WeakPolarHBondContact O-CG2 3.38Å; L426-V430 PolarHBondContact O-N 2.92Å; V427-V430 PolarHBondContact O-N 3.31Å; V430-T432 VanDerWaalsContact C-N 3.32Å; V430-T432 PolarHBondContact O-N 3.44Å; V430-A433 WeakPolarHBondContact O-CB 3.24Å; V430-A433 PolarHBondContact O-N 2.8Å; V430-C434 PolarHBondContact O-N 3.29Å; V430-C434 PolarHBondContact O-SG 2.8Å; V430-C434 VanDerWaalsContact O-SG 3.37Å; V430-I549 HydrophobicContact CB-CG2 4.22Å; V430-I549 HydrophobicContact CG1-CD1 3.88Å; V430-I549 HydrophobicContact CG1-CG2 4.01Å
431	S	93.9	Very high	93.3	Very high	1 Å²	1	41.9 Å²	41.9	1%	0.007	22%	0.222	C	C	.	.	H	α-helix	trans	-59	-43.9	174.7	177.4	0	0	0	0	111.1	V427 N428 A433 C434 Y435 K634	V427-S431 WeakPolarHBondContact O-CB 3.49Å; V427-S431 PolarHBondContact O-N 3.17Å; N428-S431 PolarHBondContact O-N 3.31Å; S431-A433 VanDerWaalsContact C-N 3.33Å; S431-A433 PolarHBondContact O-N 3.34Å; S431-C434 WeakPolarHBondContact O-CB 3.42Å; S431-C434 PolarHBondContact O-N 3.11Å; S431-C434 VanDerWaalsContact O-N 3.1Å; S431-Y435 VanDerWaalsContact O-CD2 3.28Å; S431-Y435 WeakPolarHBondContact O-CD2 3.4Å; S431-Y435 PolarHBondContact O-N 3.14Å; S431-K634 PolarHBondContact OG-NZ 2.8Å; S431-K634 VanDerWaalsContact OG-NZ 3.09Å
432	T	94.6	Very high	93.2	Very high	17 Å²	17	42.5 Å²	42.5	10%	0.104	23%	0.228	C	C	.	.	H	α-helix	trans	-59.9	-42.8	176.4	-53.8	0	0	0	0	111.5	N428 L429 V430 C434 Y435 V436 I631 K634	N428-T432 WeakPolarHBondContact O-CB 3.29Å; N428-T432 PolarHBondContact O-N 2.97Å; N428-T432 PolarHBondContact O-OG1 3.16Å; L429-T432 PolarHBondContact O-N 3.03Å; V430-T432 VanDerWaalsContact C-N 3.32Å; V430-T432 PolarHBondContact O-N 3.44Å; T432-C434 VanDerWaalsContact C-N 3.31Å; T432-C434 PolarHBondContact O-N 2.85Å; T432-Y435 PolarHBondContact O-N 3.23Å; T432-Y435 VanDerWaalsContact O-N 3.14Å; T432-V436 WeakPolarHBondContact O-CG2 3.4Å; T432-V436 PolarHBondContact O-N 2.99Å; T432-I631 HydrophobicContact CG2-CG2 4.25Å; T432-K634 HydrophobicContact CG2-CB 4.26Å; T432-K634 WeakPolarHBondContact OG1-CB 2.99Å
433	A	93.3	Very high	93.2	Very high	58 Å²	58	36.6 Å²	36.6	48%	0.479	21%	0.207	S	C	.	.	H	α-helix	trans	-61.5	-38.2	174.8	0	0	0	0	0	112.2	L429 V430 S431 V436 S437	L429-A433 PolarHBondContact O-N 2.76Å; V430-A433 WeakPolarHBondContact O-CB 3.24Å; V430-A433 PolarHBondContact O-N 2.8Å; S431-A433 VanDerWaalsContact C-N 3.33Å; S431-A433 PolarHBondContact O-N 3.34Å; A433-V436 WeakPolarHBondContact O-CB 3.43Å; A433-V436 PolarHBondContact O-N 2.59Å; A433-S437 PolarHBondContact O-N 2.96Å; A433-S437 PolarHBondContact O-OG 2.01Å
434	C	92.3	Very high	93.1	Very high	19 Å²	19	40 Å²	40	13%	0.128	23%	0.226	C	C	.	.	H	α-helix	trans	-63.5	-38.7	173	-63.8	0	0	0	0	112.6	V430 S431 T432 V436 S437 C546	V430-C434 PolarHBondContact O-N 3.29Å; V430-C434 PolarHBondContact O-SG 2.8Å; V430-C434 VanDerWaalsContact O-SG 3.37Å; S431-C434 WeakPolarHBondContact O-CB 3.42Å; S431-C434 PolarHBondContact O-N 3.11Å; S431-C434 VanDerWaalsContact O-N 3.1Å; T432-C434 VanDerWaalsContact C-N 3.31Å; T432-C434 PolarHBondContact O-N 2.85Å; C434-V436 VanDerWaalsContact C-N 3.34Å; C434-S437 WeakPolarHBondContact O-CB 3.43Å; C434-S437 PolarHBondContact O-N 3.26Å; C434-C546 HydrophobicContact CB-CB 3.78Å; C434-C546 VanDerWaalsContact CB-SG 3.57Å
435	Y	93	Very high	92.9	Very high	23 Å²	23	41 Å²	41	9%	0.09	23%	0.232	C	C	.	.	H	α-helix	trans	-64.3	-37.2	174.6	-84.6	-86.9	0	0	0	112.2	V364 F368 S431 T432 S437 F438 C546 V627 A630	V364-Y435 HydrophobicContact CG1-CE1 4.2Å; V364-Y435 HydrophobicContact CG1-CE2 4.37Å; V364-Y435 WeakPolarHBondContact CG1-OH 3.28Å; F368-Y435 HydrophobicContact CD1-CE1 4.03Å; F368-Y435 HydrophobicContact CD2-CE1 4.24Å; F368-Y435 HydrophobicContact CE1-CD1 4.23Å; F368-Y435 AromaticContact CE1-CE1 3.61Å; F368-Y435 HydrophobicContact CE1-CE1 3.61Å; F368-Y435 HydrophobicContact CE2-CD1 4.42Å; F368-Y435 AromaticContact CE2-CE1 3.89Å; F368-Y435 HydrophobicContact CE2-CE1 3.89Å; F368-Y435 HydrophobicContact CG-CE1 4.33Å; F368-Y435 AromaticContact CZ-CD1 3.9Å; F368-Y435 HydrophobicContact CZ-CD1 3.9Å; F368-Y435 AromaticContact CZ-CE1 3.54Å; F368-Y435 HydrophobicContact CZ-CE1 3.54Å; S431-Y435 VanDerWaalsContact O-CD2 3.28Å; S431-Y435 WeakPolarHBondContact O-CD2 3.4Å; S431-Y435 PolarHBondContact O-N 3.14Å; T432-Y435 PolarHBondContact O-N 3.23Å; T432-Y435 VanDerWaalsContact O-N 3.14Å; Y435-S437 PolarHBondContact O-N 2.69Å; Y435-F438 AromaticContact CD1-CD2 3.89Å; Y435-F438 HydrophobicContact CD1-CD2 3.89Å; Y435-F438 HydrophobicContact CD1-CE2 4.06Å; Y435-F438 HydrophobicContact CE1-CD2 4.46Å; Y435-F438 HydrophobicContact CE1-CE2 4.31Å; Y435-F438 HydrophobicContact CG-CD2 4.36Å; Y435-F438 HydrophobicContact CG-CE2 4.4Å; Y435-F438 WeakPolarHBondContact O-CB 3.5Å; Y435-F438 PolarHBondContact O-N 3.14Å; Y435-C546 VanDerWaalsContact CE2-SG 3.57Å; Y435-V627 WeakPolarHBondContact O-CG1 3.07Å; Y435-A630 HydrophobicContact CD1-CB 3.94Å; Y435-A630 HydrophobicContact CE1-CB 3.94Å
436	V	94.8	Very high	92.6	Very high	58 Å²	58	40.9 Å²	40.9	35%	0.352	24%	0.239	S	C	.	.	H	α-helix	trans	-58.4	-37.3	174.8	174	0	0	0	0	111.1	T432 A433 C434 F438 L439 F440 I631	T432-V436 WeakPolarHBondContact O-CG2 3.4Å; T432-V436 PolarHBondContact O-N 2.99Å; A433-V436 WeakPolarHBondContact O-CB 3.43Å; A433-V436 PolarHBondContact O-N 2.59Å; C434-V436 VanDerWaalsContact C-N 3.34Å; V436-F438 PolarHBondContact O-N 3.14Å; V436-L439 HydrophobicContact CG1-CD1 4.48Å; V436-L439 WeakPolarHBondContact O-CB 3.35Å; V436-L439 PolarHBondContact O-N 3.37Å; V436-L439 VanDerWaalsContact O-N 3.09Å; V436-F440 HydrophobicContact CG1-CE2 4.37Å; V436-I631 HydrophobicContact CB-CD1 4.48Å; V436-I631 HydrophobicContact CG2-CD1 3.84Å; V436-I631 HydrophobicContact CG2-CG1 4.37Å
437	S	93.3	Very high	92.5	Very high	51 Å²	51	38.2 Å²	38.2	36%	0.357	23%	0.228	S	C	.	.	H	α-helix	trans	-58.9	-31.7	175.3	-55.1	0	0	0	0	113	A433 C434 Y435 L439 F440 L441	A433-S437 PolarHBondContact O-N 2.96Å; A433-S437 PolarHBondContact O-OG 2.01Å; C434-S437 WeakPolarHBondContact O-CB 3.43Å; C434-S437 PolarHBondContact O-N 3.26Å; Y435-S437 PolarHBondContact O-N 2.69Å; S437-L439 PolarHBondContact O-N 3.12Å; S437-F440 PolarHBondContact O-N 3.48Å; S437-F440 VanDerWaalsContact O-N 3.14Å; S437-L441 WeakPolarHBondContact O-CG 3.38Å; S437-L441 PolarHBondContact O-N 3.05Å
438	F	93.1	Very high	92.3	Very high	1 Å²	1	37.8 Å²	37.8	0%	0.004	23%	0.225	C	C	.	.	H	α-helix	trans	-66.5	-19.3	178.1	-60	-37.6	0	0	0	113.8	Y435 V436 F440 L441 F539 V542 M543 C546 R623 V627	Y435-F438 AromaticContact CD1-CD2 3.89Å; Y435-F438 HydrophobicContact CD1-CD2 3.89Å; Y435-F438 HydrophobicContact CD1-CE2 4.06Å; Y435-F438 HydrophobicContact CE1-CD2 4.46Å; Y435-F438 HydrophobicContact CE1-CE2 4.31Å; Y435-F438 HydrophobicContact CG-CD2 4.36Å; Y435-F438 HydrophobicContact CG-CE2 4.4Å; Y435-F438 WeakPolarHBondContact O-CB 3.5Å; Y435-F438 PolarHBondContact O-N 3.14Å; V436-F438 PolarHBondContact O-N 3.14Å; F438-F440 PolarHBondContact O-N 3.45Å; F438-L441 HydrophobicContact CD1-CD1 4.33Å; F438-L441 PolarHBondContact O-N 3.02Å; F438-F539 HydrophobicContact CB-CE2 4.32Å; F438-F539 AromaticContact CD1-CD2 3.61Å; F438-F539 HydrophobicContact CD1-CD2 3.61Å; F438-F539 AromaticContact CD1-CE2 3.52Å; F438-F539 HydrophobicContact CD1-CE2 3.52Å; F438-F539 HydrophobicContact CE1-CD2 4.04Å; F438-F539 AromaticContact CE1-CE2 3.96Å; F438-F539 HydrophobicContact CE1-CE2 3.96Å; F438-F539 HydrophobicContact CG-CD2 4.39Å; F438-F539 AromaticContact CG-CE2 3.93Å; F438-F539 HydrophobicContact CG-CE2 3.93Å; F438-V542 HydrophobicContact CD1-CG1 4.19Å; F438-V542 HydrophobicContact CE1-CB 3.85Å; F438-V542 HydrophobicContact CE1-CG1 3.43Å; F438-V542 VanDerWaalsContact CE1-CG1 3.43Å; F438-V542 HydrophobicContact CZ-CG1 3.91Å; F438-M543 HydrophobicContact CD1-SD 4.5Å; F438-M543 HydrophobicContact CD2-SD 4.26Å; F438-M543 HydrophobicContact CE1-CG 3.75Å; F438-M543 HydrophobicContact CE1-SD 3.68Å; F438-M543 HydrophobicContact CE2-SD 3.4Å; F438-M543 WeakPolarHBondContact CE2-SD 3.42Å; F438-M543 HydrophobicContact CZ-CB 4.38Å; F438-M543 HydrophobicContact CZ-CG 3.69Å; F438-M543 HydrophobicContact CZ-SD 3.09Å; F438-M543 WeakPolarHBondContact CZ-SD 3.48Å; F438-C546 HydrophobicContact CE2-CB 4.45Å; F438-C546 HydrophobicContact CZ-CB 4.06Å; F438-R623 WeakPolarHBondContact O-CD 3.35Å; F438-V627 HydrophobicContact CB-CG1 4.05Å; F438-V627 HydrophobicContact CB-CG2 3.79Å
439	L	93.3	Very high	92.1	Very high	22 Å²	22	37.9 Å²	37.9	12%	0.115	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-27.7	173.8	-63.2	174.1	0	0	0	112.2	V436 S437 R623 Y624 V627 I631	V436-L439 HydrophobicContact CG1-CD1 4.48Å; V436-L439 WeakPolarHBondContact O-CB 3.35Å; V436-L439 PolarHBondContact O-N 3.37Å; V436-L439 VanDerWaalsContact O-N 3.09Å; S437-L439 PolarHBondContact O-N 3.12Å; L439-R623 PolarHBondContact O-NE 2.92Å; L439-Y624 HydrophobicContact CB-CE1 4.22Å; L439-Y624 HydrophobicContact CD2-CD1 3.8Å; L439-Y624 HydrophobicContact CD2-CE1 4.33Å; L439-Y624 HydrophobicContact CD2-CG 4.49Å; L439-V627 HydrophobicContact CD2-CB 3.65Å; L439-V627 HydrophobicContact CD2-CG1 3.61Å; L439-V627 HydrophobicContact CG-CB 4.4Å; L439-V627 HydrophobicContact CG-CG1 3.84Å; L439-I631 HydrophobicContact CD1-CD1 3.92Å; L439-I631 HydrophobicContact CG-CD1 4.27Å
440	F	91.4	Very high	91.7	Very high	148 Å²	148	33.5 Å²	33.5	65%	0.649	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.9	-8.3	-178.5	-53.8	-77.9	0	0	0	113.2	V436 S437 F438	V436-F440 HydrophobicContact CG1-CE2 4.37Å; S437-F440 PolarHBondContact O-N 3.48Å; S437-F440 VanDerWaalsContact O-N 3.14Å; F438-F440 PolarHBondContact O-N 3.45Å
441	L	91.3	Very high	91.4	Very high	26 Å²	26	31.6 Å²	31.6	14%	0.136	19%	0.192	C	C	.	.	S	Bend	trans	-110.1	94.1	-175.1	-62.7	173	0	0	0	110.2	S437 F438 T538 F539 V542	S437-L441 WeakPolarHBondContact O-CG 3.38Å; S437-L441 PolarHBondContact O-N 3.05Å; F438-L441 HydrophobicContact CD1-CD1 4.33Å; F438-L441 PolarHBondContact O-N 3.02Å; L441-T538 HydrophobicContact CD1-CG2 4.12Å; L441-T538 HydrophobicContact CD2-CG2 3.65Å; L441-F539 HydrophobicContact CB-CB 4.29Å; L441-F539 HydrophobicContact CB-CD2 4.12Å; L441-V542 HydrophobicContact CD1-CB 4.29Å; L441-V542 HydrophobicContact CD1-CG2 4.03Å
442	G	89.3	Confident	91.1	Very high	14 Å²	14	34 Å²	34	14%	0.144	21%	0.207	C	C	.	.	S	Bend	trans	-176	-178	172.7	0	0	0	0	0	111	R623	G442-R623 VanDerWaalsContact CA-NH1 3.3Å
443	C	91.8	Very high	90.8	Very high	9 Å²	9	35.2 Å²	35.2	6%	0.061	21%	0.214	C	C	.	.			trans	-119.6	138.2	179.7	-43.5	0	0	0	0	110.1	Q379 C532 N619	Q379-C443 WeakPolarHBondContact O-CB 3.22Å; Q379-C443 PolarHBondContact O-SG 3.46Å; Q379-C443 VanDerWaalsContact O-SG 3.4Å; Q379-C443 PolarHBondContact OE1-O 3.01Å; C443-C532 HydrophobicContact CB-CB 3.85Å; C443-C532 WeakPolarHBondContact CB-SG 3.32Å; C443-C532 WeakPolarHBondContact SG-CA 3.12Å; C443-C532 WeakPolarHBondContact SG-CB 3.34Å; C443-C532 CovalentContact SG-SG 2.03Å; C443-C532 PolarHBondContact SG-SG 3.28Å; C443-N619 VanDerWaalsContact O-CB 3.23Å; C443-N619 WeakPolarHBondContact O-CB 3.3Å; C443-N619 PolarHBondContact O-ND2 3.23Å
444	D	90.6	Very high	90.5	Very high	89 Å²	89	34.4 Å²	34.4	48%	0.476	20%	0.204	S	C	.	.			trans	-75.3	157	-178.2	-58.6	-14.5	0	0	0	110.1	G446 S529 V620 R623	D444-G446 PolarHBondContact O-N 2.97Å; D444-S529 PolarHBondContact O-OG 3.47Å; D444-V620 HydrophobicContact CB-CG2 4.14Å; D444-V620 WeakPolarHBondContact OD1-CG2 3.37Å; D444-R623 IonicContact OD1-NH1 3.66Å; D444-R623 IonicContact OD1-NH2 2.69Å
445	T	88.4	Confident	90.1	Very high	21 Å²	21	34.8 Å²	34.8	13%	0.129	20%	0.203	C	C	.	.			trans	-63.2	-24.5	-177.8	-56.7	0	0	0	0	112.4	V448 L602 L616 Y617 N619	T445-V448 HydrophobicContact CG2-CG2 4.28Å; T445-L602 HydrophobicContact CG2-CD1 4.4Å; T445-L616 HydrophobicContact CG2-CD1 3.77Å; T445-L616 HydrophobicContact CG2-CG 4.31Å; T445-Y617 WeakPolarHBondContact CG2-O 3.11Å; T445-Y617 PolarHBondContact OG1-O 3.12Å; T445-N619 WeakPolarHBondContact OG1-CB 3.08Å; T445-N619 PolarHBondContact OG1-N 2.98Å
446	G	87.9	Confident	89.2	Confident	29 Å²	29	35.3 Å²	35.3	30%	0.299	22%	0.215	S	C	.	.			trans	73.2	175.6	-174.2	0	0	0	0	0	112.9	D444 V448	D444-G446 PolarHBondContact O-N 2.97Å; G446-V448 PolarHBondContact O-N 3.06Å
447	P	90.8	Very high	87.6	Confident	52 Å²	52	38.9 Å²	38.9	34%	0.338	23%	0.232	S	C	.	.			trans	-73.6	123.6	178.4	29.5	-32.8	0	0	0	111	V453 I491 T492	P447-V453 HydrophobicContact CB-CG1 3.95Å; P447-V453 HydrophobicContact CB-CG2 3.94Å; P447-I491 HydrophobicContact CB-CG1 4.43Å; P447-I491 HydrophobicContact CG-CG1 4.4Å; P447-T492 PolarHBondContact O-N 3.2Å
448	V	91.1	Very high	85.8	Confident	3 Å²	3	42.4 Å²	42.4	2%	0.018	25%	0.247	C	C	.	.	B	Isolated β-bridge	trans	-119.7	119.3	174.9	-174	0	0	0	0	109.6	T445 G446 V451 T452 V453 T492 L494 L616	T445-V448 HydrophobicContact CG2-CG2 4.28Å; G446-V448 PolarHBondContact O-N 3.06Å; V448-V451 HydrophobicContact CB-CB 4.4Å; V448-V451 HydrophobicContact CG1-CB 4.15Å; V448-V451 HydrophobicContact CG1-CG2 4.24Å; V448-V451 PolarHBondContact O-N 3.41Å; V448-T452 WeakPolarHBondContact CA-OG1 3.48Å; V448-T452 HydrophobicContact CB-CG2 4.47Å; V448-T452 PolarHBondContact N-OG1 2.89Å; V448-T452 PolarHBondContact O-N 3.12Å; V448-T452 PolarHBondContact O-OG1 3.48Å; V448-V453 PolarHBondContact O-N 2.94Å; V448-V453 VanDerWaalsContact O-N 3.11Å; V448-T492 CarbonylContact C-O 3.39Å; V448-T492 VanDerWaalsContact CA-O 3.26Å; V448-T492 WeakPolarHBondContact CA-O 3.24Å; V448-L494 HydrophobicContact CG1-CD2 4.23Å; V448-L616 HydrophobicContact CB-CD2 4.2Å; V448-L616 HydrophobicContact CG1-CD2 3.93Å; V448-L616 HydrophobicContact CG2-CD2 3.94Å
449	A	89.9	Confident	84	Confident	2 Å²	2	48 Å²	48	2%	0.017	28%	0.281	C	S	.	.	B	Isolated β-bridge	trans	-61.4	134.2	-177.7	0	0	0	0	0	111.7	V451 V453 Y455 I491 T492 Y493	A449-V451 PolarHBondContact O-N 2.66Å; A449-V451 VanDerWaalsContact O-N 3.14Å; A449-V453 CarbonylContact C-O 3.59Å; A449-Y455 HydrophobicContact CB-CD1 4.25Å; A449-Y455 HydrophobicContact CB-CD2 4.32Å; A449-Y455 HydrophobicContact CB-CE1 3.88Å; A449-Y455 HydrophobicContact CB-CE2 3.92Å; A449-Y455 HydrophobicContact CB-CG 4.46Å; A449-I491 HydrophobicContact CB-CG2 3.91Å; A449-T492 PolarHBondContact N-O 3.42Å; A449-Y493 HydrophobicContact CB-CD1 3.63Å; A449-Y493 HydrophobicContact CB-CE1 3.61Å; A449-Y493 HydrophobicContact CB-CG 4.38Å
450	G	87.3	Confident	82.1	Confident	2 Å²	2	49.8 Å²	49.8	2%	0.021	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	73.7	-6	179.2	0	0	0	0	0	115.5	V453 L465 D466	G450-V453 PolarHBondContact N-O 2.72Å; G450-L465 CarbonylContact O-C 3.51Å; G450-L465 VanDerWaalsContact O-C 3.27Å; G450-D466 WeakPolarHBondContact CA-O 3.49Å; G450-D466 CarbonylContact O-C 3.55Å; G450-D466 PolarHBondContact O-N 2.87Å
451	V	88.1	Confident	79.9	Confident	18 Å²	18	49.4 Å²	49.4	11%	0.109	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-120.6	-44.9	-178.4	-175.8	0	0	0	0	112.6	V448 A449 L465 L494 L602 F603 L616	V448-V451 HydrophobicContact CB-CB 4.4Å; V448-V451 HydrophobicContact CG1-CB 4.15Å; V448-V451 HydrophobicContact CG1-CG2 4.24Å; V448-V451 PolarHBondContact O-N 3.41Å; A449-V451 PolarHBondContact O-N 2.66Å; A449-V451 VanDerWaalsContact O-N 3.14Å; V451-L465 WeakPolarHBondContact O-CD1 3.29Å; V451-L494 HydrophobicContact CG2-CD1 4.48Å; V451-L494 HydrophobicContact CG2-CD2 4.12Å; V451-L602 HydrophobicContact CG1-CB 3.81Å; V451-F603 HydrophobicContact CG2-CD2 4.15Å; V451-L616 HydrophobicContact CB-CD2 4.46Å; V451-L616 HydrophobicContact CG1-CD2 4.03Å
452	T	88.7	Confident	78.1	Confident	52 Å²	52	52.1 Å²	52.1	32%	0.319	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.7	-27.4	178.7	58.2	0	0	0	0	112.1	V448 L602	V448-T452 WeakPolarHBondContact CA-OG1 3.48Å; V448-T452 HydrophobicContact CB-CG2 4.47Å; V448-T452 PolarHBondContact N-OG1 2.89Å; V448-T452 PolarHBondContact O-N 3.12Å; V448-T452 PolarHBondContact O-OG1 3.48Å; T452-L602 HydrophobicContact CG2-CD1 3.8Å
453	V	88.4	Confident	76.8	Confident	43 Å²	43	53.9 Å²	53.9	26%	0.261	36%	0.357	S	S	.	.	B	Isolated β-bridge	trans	-131.1	143.3	174.8	-62.1	0	0	0	0	109.9	P447 V448 A449 G450 I491	P447-V453 HydrophobicContact CB-CG1 3.95Å; P447-V453 HydrophobicContact CB-CG2 3.94Å; V448-V453 PolarHBondContact O-N 2.94Å; V448-V453 VanDerWaalsContact O-N 3.11Å; A449-V453 CarbonylContact C-O 3.59Å; G450-V453 PolarHBondContact N-O 2.72Å; V453-I491 HydrophobicContact CG2-CG2 4.19Å
454	P	85.7	Confident	75.4	Confident	40 Å²	40	57.7 Å²	57.7	26%	0.26	39%	0.389	S	S	.	.			trans	-68.5	158.4	175.9	29.7	-34.8	0	0	0	111.3
455	Y	84.4	Confident	74.9	Confident	27 Å²	27	58 Å²	58	11%	0.106	39%	0.389	C	S	.	.	S	Bend	trans	-68.5	132.2	171.5	-80.6	-96.3	0	0	0	111.2	A449 P467 S469 N472 Y493 F498 C511	A449-Y455 HydrophobicContact CB-CD1 4.25Å; A449-Y455 HydrophobicContact CB-CD2 4.32Å; A449-Y455 HydrophobicContact CB-CE1 3.88Å; A449-Y455 HydrophobicContact CB-CE2 3.92Å; A449-Y455 HydrophobicContact CB-CG 4.46Å; Y455-P467 VanDerWaalsContact CE2-O 3.29Å; Y455-P467 WeakPolarHBondContact CE2-O 3.45Å; Y455-P467 PolarHBondContact OH-O 2.63Å; Y455-S469 VanDerWaalsContact CB-OG 3.28Å; Y455-S469 WeakPolarHBondContact CB-OG 3.37Å; Y455-S469 VanDerWaalsContact CG-CB 3.44Å; Y455-N472 PolarHBondContact OH-ND2 3.07Å; Y455-Y493 HydrophobicContact CD1-CE1 4.17Å; Y455-Y493 AromaticContact CE1-CD1 3.84Å; Y455-Y493 HydrophobicContact CE1-CD1 3.84Å; Y455-Y493 AromaticContact CE1-CE1 3.62Å; Y455-Y493 HydrophobicContact CE1-CE1 3.62Å; Y455-F498 WeakPolarHBondContact CE1-O 3.24Å; Y455-F498 PolarHBondContact OH-O 3.26Å; Y455-C511 HydrophobicContact CD1-CB 3.98Å; Y455-C511 HydrophobicContact CE1-CB 3.87Å
456	G	72.9	Confident	74.6	Confident	34 Å²	34	60.8 Å²	60.8	35%	0.351	40%	0.404	S	S	.	.	S	Bend	trans	72.9	-170.8	179	0	0	0	0	0	114.2	N458	G456-N458 VanDerWaalsContact C-N 3.27Å; G456-N458 PolarHBondContact O-N 2.65Å
457	N	63.1	Low	74.4	Confident	133 Å²	133	60.3 Å²	60.3	71%	0.711	40%	0.395	S	S	*	.	S	Bend	trans	-87.6	14	-171.9	-150.4	12	0	0	0	114.2	T459	N457-T459 VanDerWaalsContact C-N 3.27Å; N457-T459 PolarHBondContact O-N 3.3Å
458	N	55.6	Low	74.2	Confident	125 Å²	125	61.9 Å²	61.9	67%	0.668	40%	0.395	S	S	*	.			trans	-81.2	74.6	-176.8	-70	-21.8	0	0	0	110.4	G456 A460	G456-N458 VanDerWaalsContact C-N 3.27Å; G456-N458 PolarHBondContact O-N 2.65Å; N458-A460 PolarHBondContact O-N 3.27Å
459	T	53.8	Low	74	Confident	118 Å²	118	62.7 Å²	62.7	72%	0.724	40%	0.401	S	S	*	.			trans	-75.3	42.1	172.1	42.9	0	0	0	0	112.1	N457 P461	N457-T459 VanDerWaalsContact C-N 3.27Å; N457-T459 PolarHBondContact O-N 3.3Å; T459-P461 WeakPolarHBondContact O-CD 3.39Å
460	A	53.1	Low	73.8	Confident	61 Å²	61	68.5 Å²	68.5	50%	0.504	44%	0.439	S	S	.	.			trans	-70.1	120.6	171.4	0	0	0	0	0	108.2	N458 G462 S463	N458-A460 PolarHBondContact O-N 3.27Å; A460-G462 PolarHBondContact O-N 3.23Å; A460-S463 PolarHBondContact O-N 3.04Å
461	P	46.1	Very low	73.7	Confident	140 Å²	140	70 Å²	70	91%	0.909	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	109.7	179.6	23.6	-30.3	0	0	0	109	T459	T459-P461 WeakPolarHBondContact O-CD 3.39Å
462	G	54.3	Low	73.7	Confident	82 Å²	82	69.2 Å²	69.2	85%	0.845	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	112.7	7.8	-178.3	0	0	0	0	0	116.2	A460 A464	A460-G462 PolarHBondContact O-N 3.23Å; G462-A464 PolarHBondContact O-N 2.9Å
463	S	60	Low	73.5	Confident	52 Å²	52	71.5 Å²	71.5	36%	0.364	45%	0.454	S	S	.	.			trans	-61	121.9	166.1	55.6	0	0	0	0	109.8	A460 L465	A460-S463 PolarHBondContact O-N 3.04Å; S463-L465 PolarHBondContact O-N 3.39Å
464	A	62.7	Low	73.3	Confident	89 Å²	89	75.2 Å²	75.2	74%	0.736	47%	0.472	S	S	*	.			trans	-57.2	131.2	173.2	0	0	0	0	0	109.5	G462 D466	G462-A464 PolarHBondContact O-N 2.9Å; A464-D466 PolarHBondContact O-N 3.25Å
465	L	81.6	Confident	73	Confident	94 Å²	94	73.8 Å²	73.8	49%	0.492	46%	0.463	S	S	.	.			trans	-75.5	108.2	172.9	-71.2	158.7	0	0	0	106.9	G450 V451 S463	G450-L465 CarbonylContact O-C 3.51Å; G450-L465 VanDerWaalsContact O-C 3.27Å; V451-L465 WeakPolarHBondContact O-CD1 3.29Å; S463-L465 PolarHBondContact O-N 3.39Å
466	D	82.1	Confident	72.8	Confident	80 Å²	80	78.9 Å²	78.9	43%	0.428	49%	0.488	S	S	.	.			trans	-127.5	128.9	179.2	-164.1	-29.6	0	0	0	108.5	G450 A464 Y468	G450-D466 WeakPolarHBondContact CA-O 3.49Å; G450-D466 CarbonylContact O-C 3.55Å; G450-D466 PolarHBondContact O-N 2.87Å; A464-D466 PolarHBondContact O-N 3.25Å; D466-Y468 PolarHBondContact O-N 2.91Å; D466-Y468 WeakPolarHBondContact OD1-CD2 3.3Å; D466-Y468 PolarHBondContact OD1-N 3.09Å
467	P	83.6	Confident	73.2	Confident	19 Å²	19	77.4 Å²	77.4	12%	0.123	47%	0.472	C	S	.	.	S	Bend	trans	-53.3	-27.1	168.9	-26.6	34.4	0	0	0	113.4	Y455 N472 L494 F498 F603	Y455-P467 VanDerWaalsContact CE2-O 3.29Å; Y455-P467 WeakPolarHBondContact CE2-O 3.45Å; Y455-P467 PolarHBondContact OH-O 2.63Å; P467-N472 PolarHBondContact O-ND2 3.31Å; P467-L494 HydrophobicContact CB-CD1 3.93Å; P467-L494 HydrophobicContact CG-CD1 4.25Å; P467-F498 HydrophobicContact CB-CD1 4.25Å; P467-F498 HydrophobicContact CB-CE1 3.8Å; P467-F498 WeakPolarHBondContact O-CD1 3.34Å; P467-F603 HydrophobicContact CG-CE2 3.76Å; P467-F603 HydrophobicContact CG-CZ 4.45Å
468	Y	86.3	Confident	73.7	Confident	85 Å²	85	75.6 Å²	75.6	33%	0.333	46%	0.46	S	S	.	.			trans	-91.5	136.6	178.2	-60.8	-80.9	0	0	0	112.1	D466 N472 C477 T479 F498	D466-Y468 PolarHBondContact O-N 2.91Å; D466-Y468 WeakPolarHBondContact OD1-CD2 3.3Å; D466-Y468 PolarHBondContact OD1-N 3.09Å; Y468-N472 WeakPolarHBondContact CA-OD1 2.88Å; Y468-C477 PolarHBondContact OH-O 3.27Å; Y468-T479 HydrophobicContact CE2-CG2 4.4Å; Y468-F498 HydrophobicContact CD1-CE1 4.35Å; Y468-F498 HydrophobicContact CE1-CE1 4.01Å; Y468-F498 HydrophobicContact CE1-CZ 4.49Å
469	S	85.4	Confident	74.5	Confident	21 Å²	21	71.5 Å²	71.5	15%	0.147	44%	0.439	C	S	.	.			trans	-144.2	156.4	-176.1	172.9	0	0	0	0	109.1	Y455 C471 N472 N473	Y455-S469 VanDerWaalsContact CB-OG 3.28Å; Y455-S469 WeakPolarHBondContact CB-OG 3.37Å; Y455-S469 VanDerWaalsContact CG-CB 3.44Å; S469-C471 PolarHBondContact O-N 2.04Å; S469-C471 PolarHBondContact OG-SG 3.48Å; S469-N472 PolarHBondContact N-OD1 3.09Å; S469-N472 PolarHBondContact O-N 3.07Å; S469-N472 PolarHBondContact O-OD1 3.04Å; S469-N473 WeakPolarHBondContact O-CB 3.35Å; S469-N473 PolarHBondContact O-N 2.72Å
470	P	86.3	Confident	74.9	Confident	123 Å²	123	69.5 Å²	69.5	80%	0.799	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.2	-25.1	179	-29	36	0	0	0	114.9
471	C	86.3	Confident	75.4	Confident	35 Å²	35	68.5 Å²	68.5	24%	0.236	41%	0.413	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-22	177.9	64	0	0	0	0	114.6	S469 A510 C511	S469-C471 PolarHBondContact O-N 2.04Å; S469-C471 PolarHBondContact OG-SG 3.48Å; C471-A510 HydrophobicContact CB-CB 4.4Å; C471-C511 HydrophobicContact CB-CB 3.96Å; C471-C511 WeakPolarHBondContact CB-SG 3.25Å; C471-C511 WeakPolarHBondContact SG-CA 3.49Å; C471-C511 WeakPolarHBondContact SG-CB 3.46Å; C471-C511 CovalentContact SG-SG 2.04Å; C471-C511 PolarHBondContact SG-SG 3.45Å
472	N	87.8	Confident	76.9	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	-123.3	-3.6	-178.4	68	15.6	0	0	0	113.8	Y455 P467 Y468 S469 N474 C475 F498	Y455-N472 PolarHBondContact OH-ND2 3.07Å; P467-N472 PolarHBondContact O-ND2 3.31Å; Y468-N472 WeakPolarHBondContact CA-OD1 2.88Å; S469-N472 PolarHBondContact N-OD1 3.09Å; S469-N472 PolarHBondContact O-N 3.07Å; S469-N472 PolarHBondContact O-OD1 3.04Å; N472-N474 PolarHBondContact O-N 3.13Å; N472-C475 VanDerWaalsContact CA-SG 3.52Å; N472-C475 WeakPolarHBondContact O-CB 3.26Å; N472-C475 PolarHBondContact O-N 2.87Å; N472-C475 PolarHBondContact O-SG 3.32Å; N472-F498 PolarHBondContact ND2-O 3.44Å; N472-F498 VanDerWaalsContact ND2-O 3.09Å
473	N	84.5	Confident	78.1	Confident	101 Å²	101	60.6 Å²	60.6	54%	0.54	34%	0.343	S	S	.	.	G	3₁₀ helix	trans	-63.4	-27.3	-174.9	-157.3	34.1	0	0	0	113.4	S469 C475	S469-N473 WeakPolarHBondContact O-CB 3.35Å; S469-N473 PolarHBondContact O-N 2.72Å; N473-C475 VanDerWaalsContact C-N 3.28Å; N473-C475 PolarHBondContact O-N 3.38Å
474	N	83.6	Confident	79.4	Confident	120 Å²	120	58.7 Å²	58.7	64%	0.642	33%	0.33	S	S	*	.	G	3₁₀ helix	trans	-88	5.4	178.8	-61	-27.3	0	0	0	113.1	N472	N472-N474 PolarHBondContact O-N 3.13Å
475	C	79.7	Confident	80.6	Confident	11 Å²	11	54.8 Å²	54.8	7%	0.074	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-96.8	-12.5	-174.9	-50.6	0	0	0	0	113.4	C150 N472 N473 C477 C497	C150-C475 HydrophobicContact CB-CB 3.61Å; C150-C475 WeakPolarHBondContact CB-SG 3.3Å; C150-C475 WeakPolarHBondContact SG-CB 2.89Å; C150-C475 CovalentContact SG-SG 2Å; C150-C475 PolarHBondContact SG-SG 3.31Å; N472-C475 VanDerWaalsContact CA-SG 3.52Å; N472-C475 WeakPolarHBondContact O-CB 3.26Å; N472-C475 PolarHBondContact O-N 2.87Å; N472-C475 PolarHBondContact O-SG 3.32Å; N473-C475 VanDerWaalsContact C-N 3.28Å; N473-C475 PolarHBondContact O-N 3.38Å; C475-C477 VanDerWaalsContact CB-SG 3.52Å; C475-C477 PolarHBondContact O-N 3.28Å; C475-C497 VanDerWaalsContact CB-SG 3.53Å
476	E	81.1	Confident	81.1	Confident	133 Å²	133	51.3 Å²	51.3	62%	0.621	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.2	40.4	-174.9	-63.7	178.9	-168.2	0	0	113.1	R141 Q478	R141-E476 IonicContact CZ-OE2 3.54Å; R141-E476 IonicContact NH1-OE2 2.65Å; R141-E476 PolarHBondContact NH1-OE2 3.08Å; R141-E476 IonicContact NH2-OE2 3.55Å; E476-Q478 PolarHBondContact O-N 3.37Å
477	C	79.6	Confident	81.5	Confident	3 Å²	3	47.7 Å²	47.7	2%	0.02	26%	0.262	C	S	.	.			trans	-62.2	136.5	-179.1	-51.4	0	0	0	0	111.4	Y468 C475 C497 F498	Y468-C477 PolarHBondContact OH-O 3.27Å; C475-C477 VanDerWaalsContact CB-SG 3.52Å; C475-C477 PolarHBondContact O-N 3.28Å; C477-C497 WeakPolarHBondContact CA-SG 3.33Å; C477-C497 HydrophobicContact CB-CB 3.9Å; C477-C497 WeakPolarHBondContact CB-SG 3.42Å; C477-C497 WeakPolarHBondContact SG-CB 3.4Å; C477-C497 PolarHBondContact SG-O 2.87Å; C477-C497 VanDerWaalsContact SG-O 3.36Å; C477-C497 CovalentContact SG-SG 2.04Å; C477-C497 PolarHBondContact SG-SG 3.18Å; C477-F498 HydrophobicContact CB-CD1 4.14Å; C477-F498 HydrophobicContact CB-CD2 4.02Å; C477-F498 HydrophobicContact CB-CE1 3.83Å; C477-F498 HydrophobicContact CB-CE2 3.7Å; C477-F498 HydrophobicContact CB-CG 4.22Å; C477-F498 HydrophobicContact CB-CZ 3.59Å
478	Q	74.3	Confident	81.8	Confident	96 Å²	96	49.6 Å²	49.6	45%	0.449	28%	0.279	S	S	.	.			trans	-92.1	142	179	-58.1	-177.3	-30.9	0	0	111.5	E476 D480 F498	E476-Q478 PolarHBondContact O-N 3.37Å; Q478-D480 WeakPolarHBondContact CB-OD1 3.46Å; Q478-D480 PolarHBondContact OE1-OD1 3.39Å; Q478-F498 WeakPolarHBondContact O-CE2 3.02Å
479	T	72.8	Confident	82	Confident	38 Å²	38	47.2 Å²	47.2	23%	0.233	27%	0.272	C	S	.	.	S	Bend	trans	-94.2	0.8	-179.3	53.5	0	0	0	0	113.8	Y468 F498 F603	Y468-T479 HydrophobicContact CE2-CG2 4.4Å; T479-F498 HydrophobicContact CG2-CZ 3.88Å; T479-F603 HydrophobicContact CG2-CZ 3.93Å
480	D	62.1	Low	82.2	Confident	77 Å²	77	48 Å²	48	41%	0.412	28%	0.283	S	S	.	.	S	Bend	trans	-81	-23	-179.9	58.3	-8	0	0	0	113.1	Q478	Q478-D480 WeakPolarHBondContact CB-OD1 3.46Å; Q478-D480 PolarHBondContact OE1-OD1 3.39Å
481	S	63.4	Low	82.4	Confident	39 Å²	39	44.1 Å²	44.1	27%	0.273	26%	0.255	S	S	.	.			trans	-111.8	137.5	175.7	80.2	0	0	0	0	112
482	F	76.4	Confident	82.7	Confident	34 Å²	34	42.7 Å²	42.7	15%	0.149	25%	0.246	C	C	.	.			trans	-123.9	108	178.7	-179.3	-109.5	0	0	0	110.5	P484 L494 V615 L616	F482-P484 HydrophobicContact CD1-CG 4.14Å; F482-P484 HydrophobicContact CE1-CB 4.09Å; F482-P484 HydrophobicContact CE1-CG 3.57Å; F482-P484 HydrophobicContact CE2-CB 4.17Å; F482-P484 HydrophobicContact CE2-CG 4.5Å; F482-P484 HydrophobicContact CZ-CB 3.75Å; F482-P484 HydrophobicContact CZ-CG 3.79Å; F482-L494 HydrophobicContact CD2-CB 4.33Å; F482-L494 HydrophobicContact CD2-CD2 3.92Å; F482-L494 HydrophobicContact CE2-CB 4.48Å; F482-L494 HydrophobicContact CE2-CD2 3.59Å; F482-V615 HydrophobicContact CB-CB 4.5Å; F482-V615 HydrophobicContact CB-CG1 3.17Å; F482-V615 HydrophobicContact CD1-CG1 3.21Å; F482-V615 HydrophobicContact CD2-CG1 3.49Å; F482-V615 VanDerWaalsContact CD2-CG1 3.49Å; F482-V615 HydrophobicContact CE1-CG1 3.85Å; F482-V615 HydrophobicContact CE2-CG1 4.09Å; F482-V615 HydrophobicContact CG-CB 4.49Å; F482-V615 HydrophobicContact CG-CG1 2.99Å; F482-V615 HydrophobicContact CZ-CG1 4.25Å; F482-L616 HydrophobicContact CZ-CD1 4.43Å
483	T	80.3	Confident	82.8	Confident	23 Å²	23	43 Å²	43	14%	0.141	25%	0.247	C	C	.	.			trans	-129.4	70.8	-178.7	47.5	0	0	0	0	108.4	R259 V485 L494 S495	R259-T483 HydrophobicContact CG-CG2 3.9Å; T483-V485 PolarHBondContact O-N 2.92Å; T483-L494 CarbonylContact C-O 3.59Å; T483-L494 VanDerWaalsContact C-O 3.25Å; T483-L494 PolarHBondContact N-O 3.02Å; T483-L494 VanDerWaalsContact N-O 3.1Å; T483-S495 WeakPolarHBondContact O-CA 3.31Å; T483-S495 WeakPolarHBondContact OG1-CB 3.36Å
484	P	87.3	Confident	82.9	Confident	11 Å²	11	38.2 Å²	38.2	7%	0.071	22%	0.222	C	C	.	.			trans	-59	141	-168	24.1	-35.8	0	0	0	111.3	F482 T492 Y493 G525 K526	F482-P484 HydrophobicContact CD1-CG 4.14Å; F482-P484 HydrophobicContact CE1-CB 4.09Å; F482-P484 HydrophobicContact CE1-CG 3.57Å; F482-P484 HydrophobicContact CE2-CB 4.17Å; F482-P484 HydrophobicContact CE2-CG 4.5Å; F482-P484 HydrophobicContact CZ-CB 3.75Å; F482-P484 HydrophobicContact CZ-CG 3.79Å; P484-T492 HydrophobicContact CB-CG2 3.91Å; P484-Y493 VanDerWaalsContact CA-O 3.24Å; P484-Y493 WeakPolarHBondContact CA-O 3.17Å; P484-G525 CarbonylContact O-C 3.27Å; P484-G525 WeakPolarHBondContact O-CA 3.07Å; P484-G525 PolarHBondContact O-N 3.49Å; P484-K526 HydrophobicContact CB-CG 4.24Å; P484-K526 HydrophobicContact CG-CG 4.19Å
485	V	88.7	Confident	83.1	Confident	8 Å²	8	32.5 Å²	32.5	5%	0.048	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	142.5	174.4	-60.9	0	0	0	0	110	T483 T492 Y493 A496 A499 V522 V523 G525	T483-V485 PolarHBondContact O-N 2.92Å; V485-T492 WeakPolarHBondContact O-CA 3.45Å; V485-Y493 PolarHBondContact N-O 3.14Å; V485-Y493 VanDerWaalsContact N-O 3.07Å; V485-Y493 PolarHBondContact O-N 2.63Å; V485-A496 HydrophobicContact CG1-CB 4.3Å; V485-A499 HydrophobicContact CG2-CB 4.29Å; V485-V522 HydrophobicContact CB-CB 3.97Å; V485-V522 HydrophobicContact CB-CG2 4Å; V485-V522 HydrophobicContact CG1-CG2 4.32Å; V485-V522 HydrophobicContact CG2-CB 3.93Å; V485-V522 HydrophobicContact CG2-CG1 4.18Å; V485-V522 HydrophobicContact CG2-CG2 3.96Å; V485-V523 CarbonylContact C-O 3.5Å; V485-V523 VanDerWaalsContact CA-O 3.3Å; V485-V523 WeakPolarHBondContact CA-O 3.48Å; V485-G525 CarbonylContact C-O 3.37Å; V485-G525 VanDerWaalsContact C-O 3.29Å; V485-G525 WeakPolarHBondContact CA-O 3.45Å
486	C	91.2	Very high	83.4	Confident	20 Å²	20	32.2 Å²	32.2	14%	0.135	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	120.5	174.6	-176.7	0	0	0	0	109.8	V522 V523 G525 C527	C486-V522 CarbonylContact O-C 3.53Å; C486-V522 VanDerWaalsContact O-CA 3.25Å; C486-V522 WeakPolarHBondContact O-CA 3.41Å; C486-V523 PolarHBondContact N-O 3.28Å; C486-V523 PolarHBondContact O-N 3.46Å; C486-G525 PolarHBondContact N-O 3.34Å; C486-C527 WeakPolarHBondContact CA-SG 3.41Å; C486-C527 HydrophobicContact CB-CB 4Å; C486-C527 WeakPolarHBondContact CB-SG 3.39Å; C486-C527 WeakPolarHBondContact SG-CA 3.17Å; C486-C527 WeakPolarHBondContact SG-CB 2.99Å; C486-C527 CovalentContact SG-SG 2.04Å; C486-C527 PolarHBondContact SG-SG 3.3Å
487	G	91.7	Very high	83.7	Confident	5 Å²	5	26 Å²	26	5%	0.052	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	156.8	173.7	0	0	0	0	0	112.9	D489 G490 I491	G487-D489 VanDerWaalsContact CA-OD1 3.31Å; G487-D489 WeakPolarHBondContact CA-OD1 3.43Å; G487-D489 PolarHBondContact O-N 2.96Å; G487-D489 VanDerWaalsContact O-N 3.09Å; G487-G490 PolarHBondContact O-N 2.8Å; G487-I491 PolarHBondContact N-O 3.14Å
488	A	89.9	Confident	84.1	Confident	59 Å²	59	25.8 Å²	25.8	49%	0.488	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-14.7	172	0	0	0	0	0	113.5	G490 L512 V515 T521	A488-G490 VanDerWaalsContact C-N 3.28Å; A488-L512 HydrophobicContact CB-CD2 4.46Å; A488-V515 HydrophobicContact CB-CG1 4.37Å; A488-V515 HydrophobicContact CB-CG2 4.25Å; A488-T521 PolarHBondContact N-O 3.35Å; A488-T521 VanDerWaalsContact N-O 3.09Å
489	D	89.1	Confident	84.9	Confident	35 Å²	35	21.2 Å²	21.2	19%	0.187	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-4.9	171.7	60.4	-7.2	0	0	0	114	G487 I491 Y493 T514 V515	G487-D489 VanDerWaalsContact CA-OD1 3.31Å; G487-D489 WeakPolarHBondContact CA-OD1 3.43Å; G487-D489 PolarHBondContact O-N 2.96Å; G487-D489 VanDerWaalsContact O-N 3.09Å; D489-I491 VanDerWaalsContact C-N 3.32Å; D489-I491 PolarHBondContact OD1-N 3.36Å; D489-I491 VanDerWaalsContact OD1-N 3.12Å; D489-Y493 PolarHBondContact OD2-OH 3.24Å; D489-T514 WeakPolarHBondContact CB-OG1 3.24Å; D489-V515 HydrophobicContact CB-CG2 4.05Å
490	G	89.3	Confident	85.6	Confident	37 Å²	37	19.6 Å²	19.6	38%	0.381	13%	0.128	S	C	.	.	S	Bend	trans	77.8	13.7	-177.5	0	0	0	0	0	114.1	G487 A488	G487-G490 PolarHBondContact O-N 2.8Å; A488-G490 VanDerWaalsContact C-N 3.28Å
491	I	91.5	Very high	86.8	Confident	41 Å²	41	15.9 Å²	15.9	21%	0.21	11%	0.108	C	C	.	.			trans	-103.2	137.9	177.7	-58.7	177.4	0	0	0	109.4	P447 A449 V453 G487 D489 Y493 C527	P447-I491 HydrophobicContact CB-CG1 4.43Å; P447-I491 HydrophobicContact CG-CG1 4.4Å; A449-I491 HydrophobicContact CB-CG2 3.91Å; V453-I491 HydrophobicContact CG2-CG2 4.19Å; G487-I491 PolarHBondContact N-O 3.14Å; D489-I491 VanDerWaalsContact C-N 3.32Å; D489-I491 PolarHBondContact OD1-N 3.36Å; D489-I491 VanDerWaalsContact OD1-N 3.12Å; I491-Y493 HydrophobicContact CB-CE2 4.1Å; I491-Y493 HydrophobicContact CG2-CE2 4.24Å; I491-Y493 WeakPolarHBondContact O-CD2 3.31Å; I491-Y493 WeakPolarHBondContact O-CE2 3.46Å; I491-C527 VanDerWaalsContact C-SG 3.52Å; I491-C527 PolarHBondContact O-SG 2.82Å
492	T	91.9	Very high	87.6	Confident	5 Å²	5	19.6 Å²	19.6	3%	0.031	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	133.7	174.5	-56.5	0	0	0	0	110	P447 V448 A449 P484 V485 K526 C527	P447-T492 PolarHBondContact O-N 3.2Å; V448-T492 CarbonylContact C-O 3.39Å; V448-T492 VanDerWaalsContact CA-O 3.26Å; V448-T492 WeakPolarHBondContact CA-O 3.24Å; A449-T492 PolarHBondContact N-O 3.42Å; P484-T492 HydrophobicContact CB-CG2 3.91Å; V485-T492 WeakPolarHBondContact O-CA 3.45Å; T492-K526 HydrophobicContact CG2-CB 4.46Å; T492-K526 HydrophobicContact CG2-CG 4.37Å; T492-C527 PolarHBondContact OG1-N 3.49Å
493	Y	90.6	Very high	87.6	Confident	6 Å²	6	19.8 Å²	19.8	2%	0.024	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	149.1	175.1	-63.2	-96.5	0	0	0	109.5	A449 Y455 P484 V485 D489 I491 S495 A499 C511 L512	A449-Y493 HydrophobicContact CB-CD1 3.63Å; A449-Y493 HydrophobicContact CB-CE1 3.61Å; A449-Y493 HydrophobicContact CB-CG 4.38Å; Y455-Y493 HydrophobicContact CD1-CE1 4.17Å; Y455-Y493 AromaticContact CE1-CD1 3.84Å; Y455-Y493 HydrophobicContact CE1-CD1 3.84Å; Y455-Y493 AromaticContact CE1-CE1 3.62Å; Y455-Y493 HydrophobicContact CE1-CE1 3.62Å; P484-Y493 VanDerWaalsContact CA-O 3.24Å; P484-Y493 WeakPolarHBondContact CA-O 3.17Å; V485-Y493 PolarHBondContact N-O 3.14Å; V485-Y493 VanDerWaalsContact N-O 3.07Å; V485-Y493 PolarHBondContact O-N 2.63Å; D489-Y493 PolarHBondContact OD2-OH 3.24Å; I491-Y493 HydrophobicContact CB-CE2 4.1Å; I491-Y493 HydrophobicContact CG2-CE2 4.24Å; I491-Y493 WeakPolarHBondContact O-CD2 3.31Å; I491-Y493 WeakPolarHBondContact O-CE2 3.46Å; Y493-S495 VanDerWaalsContact C-N 3.28Å; Y493-S495 PolarHBondContact O-N 3.04Å; Y493-A499 HydrophobicContact CD1-CB 3.97Å; Y493-A499 HydrophobicContact CD2-CB 4.15Å; Y493-A499 HydrophobicContact CG-CB 3.75Å; Y493-C511 HydrophobicContact CE1-CB 3.97Å; Y493-L512 HydrophobicContact CE2-CD1 3.88Å; Y493-L512 HydrophobicContact CE2-CG 4.49Å
494	L	87.3	Confident	87	Confident	2 Å²	2	20.5 Å²	20.5	1%	0.01	14%	0.135	C	C	.	.	S	Bend	trans	-61.1	-35.9	-176.8	-62.6	178.7	0	0	0	113	V448 V451 P467 F482 T483 F498 F603	V448-L494 HydrophobicContact CG1-CD2 4.23Å; V451-L494 HydrophobicContact CG2-CD1 4.48Å; V451-L494 HydrophobicContact CG2-CD2 4.12Å; P467-L494 HydrophobicContact CB-CD1 3.93Å; P467-L494 HydrophobicContact CG-CD1 4.25Å; F482-L494 HydrophobicContact CD2-CB 4.33Å; F482-L494 HydrophobicContact CD2-CD2 3.92Å; F482-L494 HydrophobicContact CE2-CB 4.48Å; F482-L494 HydrophobicContact CE2-CD2 3.59Å; T483-L494 CarbonylContact C-O 3.59Å; T483-L494 VanDerWaalsContact C-O 3.25Å; T483-L494 PolarHBondContact N-O 3.02Å; T483-L494 VanDerWaalsContact N-O 3.1Å; L494-F498 HydrophobicContact CB-CB 4.25Å; L494-F498 HydrophobicContact CB-CD2 3.62Å; L494-F498 HydrophobicContact CB-CE2 4.18Å; L494-F498 HydrophobicContact CB-CG 4.01Å; L494-F498 HydrophobicContact CD1-CD2 4.33Å; L494-F498 HydrophobicContact CD1-CE2 4.31Å; L494-F498 HydrophobicContact CD1-CG 4.45Å; L494-F498 HydrophobicContact CD1-CZ 4.41Å; L494-F603 HydrophobicContact CD1-CE1 4.26Å; L494-F603 HydrophobicContact CD1-CE2 4.17Å; L494-F603 HydrophobicContact CD1-CZ 3.95Å
495	S	86.9	Confident	86.3	Confident	0 Å²	0	25.6 Å²	25.6	0%	0	16%	0.162	C	C	.	.	S	Bend	trans	-153.6	173.6	171.8	79	0	0	0	0	110.6	D148 T483 Y493 C497 F498 A499	D148-S495 VanDerWaalsContact OD2-CB 3.28Å; D148-S495 WeakPolarHBondContact OD2-CB 3.41Å; D148-S495 PolarHBondContact OD2-OG 3.43Å; T483-S495 WeakPolarHBondContact O-CA 3.31Å; T483-S495 WeakPolarHBondContact OG1-CB 3.36Å; Y493-S495 VanDerWaalsContact C-N 3.28Å; Y493-S495 PolarHBondContact O-N 3.04Å; S495-C497 PolarHBondContact O-N 3.15Å; S495-C497 WeakPolarHBondContact OG-CB 3.42Å; S495-C497 PolarHBondContact OG-N 2.84Å; S495-F498 PolarHBondContact O-N 3.43Å; S495-F498 VanDerWaalsContact OG-CD2 3.32Å; S495-F498 WeakPolarHBondContact OG-CD2 3.44Å; S495-F498 PolarHBondContact OG-N 3.19Å; S495-A499 PolarHBondContact O-N 2.95Å; S495-A499 VanDerWaalsContact O-N 3.15Å
496	A	86.8	Confident	85.9	Confident	4 Å²	4	25.9 Å²	25.9	3%	0.033	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-26.5	172.3	0	0	0	0	0	112.5	D148 V149 V485 A499 G500 C501 L506	D148-A496 CarbonylContact O-C 3.31Å; D148-A496 VanDerWaalsContact O-C 3.31Å; D148-A496 WeakPolarHBondContact O-CB 3.26Å; V149-A496 HydrophobicContact CG1-CB 4.41Å; V485-A496 HydrophobicContact CG1-CB 4.3Å; A496-A499 PolarHBondContact O-N 3.37Å; A496-G500 PolarHBondContact O-N 2.82Å; A496-C501 HydrophobicContact CB-CB 4.32Å; A496-C501 WeakPolarHBondContact O-CB 3.35Å; A496-C501 PolarHBondContact O-N 2.96Å; A496-L506 HydrophobicContact CB-CD2 3.67Å
497	C	87.1	Confident	85.4	Confident	2 Å²	2	27.5 Å²	27.5	1%	0.014	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-46.9	172.6	-175.9	0	0	0	0	110.3	D148 C475 C477 S495 A499 G500	D148-C497 HydrophobicContact CB-CB 4.47Å; D148-C497 WeakPolarHBondContact O-CB 3.48Å; D148-C497 PolarHBondContact O-N 3.46Å; D148-C497 WeakPolarHBondContact OD1-CB 3.49Å; D148-C497 WeakPolarHBondContact OD2-CB 3.02Å; C475-C497 VanDerWaalsContact CB-SG 3.53Å; C477-C497 WeakPolarHBondContact CA-SG 3.33Å; C477-C497 HydrophobicContact CB-CB 3.9Å; C477-C497 WeakPolarHBondContact CB-SG 3.42Å; C477-C497 WeakPolarHBondContact SG-CB 3.4Å; C477-C497 PolarHBondContact SG-O 2.87Å; C477-C497 VanDerWaalsContact SG-O 3.36Å; C477-C497 CovalentContact SG-SG 2.04Å; C477-C497 PolarHBondContact SG-SG 3.18Å; S495-C497 PolarHBondContact O-N 3.15Å; S495-C497 WeakPolarHBondContact OG-CB 3.42Å; S495-C497 PolarHBondContact OG-N 2.84Å; C497-A499 PolarHBondContact O-N 3.41Å; C497-G500 WeakPolarHBondContact O-CA 3.43Å; C497-G500 PolarHBondContact O-N 3.47Å
498	F	88.4	Confident	84.9	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-20.5	176	-76.7	-75	0	0	0	113.5	Y455 P467 Y468 N472 C477 Q478 T479 L494 S495 G500 C511	Y455-F498 WeakPolarHBondContact CE1-O 3.24Å; Y455-F498 PolarHBondContact OH-O 3.26Å; P467-F498 HydrophobicContact CB-CD1 4.25Å; P467-F498 HydrophobicContact CB-CE1 3.8Å; P467-F498 WeakPolarHBondContact O-CD1 3.34Å; Y468-F498 HydrophobicContact CD1-CE1 4.35Å; Y468-F498 HydrophobicContact CE1-CE1 4.01Å; Y468-F498 HydrophobicContact CE1-CZ 4.49Å; N472-F498 PolarHBondContact ND2-O 3.44Å; N472-F498 VanDerWaalsContact ND2-O 3.09Å; C477-F498 HydrophobicContact CB-CD1 4.14Å; C477-F498 HydrophobicContact CB-CD2 4.02Å; C477-F498 HydrophobicContact CB-CE1 3.83Å; C477-F498 HydrophobicContact CB-CE2 3.7Å; C477-F498 HydrophobicContact CB-CG 4.22Å; C477-F498 HydrophobicContact CB-CZ 3.59Å; Q478-F498 WeakPolarHBondContact O-CE2 3.02Å; T479-F498 HydrophobicContact CG2-CZ 3.88Å; L494-F498 HydrophobicContact CB-CB 4.25Å; L494-F498 HydrophobicContact CB-CD2 3.62Å; L494-F498 HydrophobicContact CB-CE2 4.18Å; L494-F498 HydrophobicContact CB-CG 4.01Å; L494-F498 HydrophobicContact CD1-CD2 4.33Å; L494-F498 HydrophobicContact CD1-CE2 4.31Å; L494-F498 HydrophobicContact CD1-CG 4.45Å; L494-F498 HydrophobicContact CD1-CZ 4.41Å; S495-F498 PolarHBondContact O-N 3.43Å; S495-F498 VanDerWaalsContact OG-CD2 3.32Å; S495-F498 WeakPolarHBondContact OG-CD2 3.44Å; S495-F498 PolarHBondContact OG-N 3.19Å; F498-G500 VanDerWaalsContact C-N 3.34Å; F498-C511 PolarHBondContact O-SG 3.2Å
499	A	89.3	Confident	84.8	Confident	0 Å²	0	26.9 Å²	26.9	0%	0	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-7.8	169.1	0	0	0	0	0	113.5	V485 Y493 S495 A496 C497 C509 A510 C511 L512 V522	V485-A499 HydrophobicContact CG2-CB 4.29Å; Y493-A499 HydrophobicContact CD1-CB 3.97Å; Y493-A499 HydrophobicContact CD2-CB 4.15Å; Y493-A499 HydrophobicContact CG-CB 3.75Å; S495-A499 PolarHBondContact O-N 2.95Å; S495-A499 VanDerWaalsContact O-N 3.15Å; A496-A499 PolarHBondContact O-N 3.37Å; C497-A499 PolarHBondContact O-N 3.41Å; A499-C509 CarbonylContact O-C 3.53Å; A499-C509 WeakPolarHBondContact O-CB 3.4Å; A499-A510 PolarHBondContact O-N 3.28Å; A499-C511 VanDerWaalsContact O-CB 3.26Å; A499-C511 WeakPolarHBondContact O-CB 3.34Å; A499-C511 PolarHBondContact O-N 3.39Å; A499-L512 HydrophobicContact CB-CD1 4.29Å; A499-V522 HydrophobicContact CB-CG1 4.08Å
500	G	88.6	Confident	84.8	Confident	3 Å²	3	28.3 Å²	28.3	3%	0.031	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.8	26.2	-179.7	0	0	0	0	0	113.7	A496 C497 F498 C509 A510	A496-G500 PolarHBondContact O-N 2.82Å; C497-G500 WeakPolarHBondContact O-CA 3.43Å; C497-G500 PolarHBondContact O-N 3.47Å; F498-G500 VanDerWaalsContact C-N 3.34Å; G500-C509 WeakPolarHBondContact O-CA 3.4Å; G500-A510 PolarHBondContact O-N 2.87Å
501	C	87.2	Confident	84.7	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	17%	0.169	C	C	.	.	B	Isolated β-bridge	trans	-73.6	129.1	-179.8	-55.9	0	0	0	0	111	V149 C150 A496 C509	V149-C501 WeakPolarHBondContact CB-O 3.19Å; C150-C501 PolarHBondContact N-O 3.27Å; A496-C501 HydrophobicContact CB-CB 4.32Å; A496-C501 WeakPolarHBondContact O-CB 3.35Å; A496-C501 PolarHBondContact O-N 2.96Å; C501-C509 HydrophobicContact CB-CB 4.09Å; C501-C509 WeakPolarHBondContact CB-SG 3.42Å; C501-C509 WeakPolarHBondContact SG-CB 3.35Å; C501-C509 CovalentContact SG-SG 2.04Å; C501-C509 PolarHBondContact SG-SG 3.49Å
502	N	81.1	Confident	84.6	Confident	117 Å²	117	24.9 Å²	24.9	63%	0.626	16%	0.161	S	C	*	.			trans	-101	-8.7	-174.7	-155.7	16.6	0	0	0	113.2	C150	C150-N502 PolarHBondContact O-OD1 3.29Å; C150-N502 VanDerWaalsContact O-OD1 3.07Å
503	S	74.6	Confident	84	Confident	37 Å²	37	29 Å²	29	26%	0.259	19%	0.186	S	C	.	.	S	Bend	trans	-119.2	143	-179.8	-178.1	0	0	0	0	111.5	N505 L506	S503-N505 PolarHBondContact O-N 2.67Å; S503-N505 PolarHBondContact OG-N 3.32Å; S503-L506 PolarHBondContact O-N 3.38Å
504	T	69.2	Low	83.4	Confident	39 Å²	39	33.2 Å²	33.2	24%	0.239	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-23	171.3	55.2	0	0	0	0	112.7	R147 L506	R147-T504 PolarHBondContact NH1-O 3.29Å; T504-L506 PolarHBondContact O-N 3.39Å; T504-L506 VanDerWaalsContact O-N 3.07Å
505	N	72.8	Confident	83	Confident	117 Å²	117	34.5 Å²	34.5	63%	0.626	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.5	10.5	170.6	-70.4	-29.8	0	0	0	113.7	S503 T507	S503-N505 PolarHBondContact O-N 2.67Å; S503-N505 PolarHBondContact OG-N 3.32Å; N505-T507 VanDerWaalsContact C-N 3.25Å; N505-T507 WeakPolarHBondContact O-CG2 3.34Å; N505-T507 PolarHBondContact O-N 2.88Å
506	L	78.9	Confident	82.7	Confident	14 Å²	14	38.7 Å²	38.7	7%	0.073	25%	0.248	C	C	.	.	S	Bend	trans	56.5	38.9	176	-62.8	170.5	0	0	0	112.9	R147 A496 S503 T504 T521 V522 P524	R147-L506 VanDerWaalsContact NH1-CD1 3.35Å; A496-L506 HydrophobicContact CB-CD2 3.67Å; S503-L506 PolarHBondContact O-N 3.38Å; T504-L506 PolarHBondContact O-N 3.39Å; T504-L506 VanDerWaalsContact O-N 3.07Å; L506-T521 WeakPolarHBondContact O-CA 3.5Å; L506-V522 HydrophobicContact CB-CG2 3.73Å; L506-V522 WeakPolarHBondContact CB-O 3.15Å; L506-V522 HydrophobicContact CD2-CG2 3.77Å; L506-V522 HydrophobicContact CG-CG2 4.22Å; L506-V522 PolarHBondContact O-N 3.43Å; L506-P524 HydrophobicContact CD1-CG 3.99Å
507	T	80.6	Confident	82	Confident	55 Å²	55	42.6 Å²	42.6	34%	0.337	28%	0.28	S	S	.	.	B	Isolated β-bridge	trans	-126.1	160.5	-176.9	51.8	0	0	0	0	110.6	N505 T521	N505-T507 VanDerWaalsContact C-N 3.25Å; N505-T507 WeakPolarHBondContact O-CG2 3.34Å; N505-T507 PolarHBondContact O-N 2.88Å; T507-T521 HydrophobicContact CG2-CG2 3.58Å
508	G	82.2	Confident	81.3	Confident	46 Å²	46	51.4 Å²	51.4	47%	0.474	32%	0.321	S	S	.	.			trans	71.4	41.4	177.2	0	0	0	0	0	112.6	A520	G508-A520 PolarHBondContact N-O 2.72Å
509	C	88	Confident	80.9	Confident	5 Å²	5	56.4 Å²	56.4	3%	0.034	35%	0.347	C	S	.	.	B	Isolated β-bridge	trans	-84.6	111.9	-174.5	-51.9	0	0	0	0	111.5	A499 G500 C501 C511 L512 A520 V522	A499-C509 CarbonylContact O-C 3.53Å; A499-C509 WeakPolarHBondContact O-CB 3.4Å; G500-C509 WeakPolarHBondContact O-CA 3.4Å; C501-C509 HydrophobicContact CB-CB 4.09Å; C501-C509 WeakPolarHBondContact CB-SG 3.42Å; C501-C509 WeakPolarHBondContact SG-CB 3.35Å; C501-C509 CovalentContact SG-SG 2.04Å; C501-C509 PolarHBondContact SG-SG 3.49Å; C509-C511 VanDerWaalsContact C-N 3.28Å; C509-C511 PolarHBondContact O-N 3.49Å; C509-L512 HydrophobicContact CB-CD1 3.69Å; C509-L512 HydrophobicContact CB-CD2 4.43Å; C509-L512 PolarHBondContact O-N 3.14Å; C509-A520 PolarHBondContact N-O 3.02Å; C509-V522 HydrophobicContact CB-CG1 4.39Å
510	A	88.1	Confident	80.6	Confident	64 Å²	64	56.5 Å²	56.5	53%	0.529	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-22.9	-171.2	0	0	0	0	0	114.5	C471 A499 G500	C471-A510 HydrophobicContact CB-CB 4.4Å; A499-A510 PolarHBondContact O-N 3.28Å; G500-A510 PolarHBondContact O-N 2.87Å
511	C	88.3	Confident	80.6	Confident	1 Å²	1	59 Å²	59	1%	0.007	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-10.9	-177.5	-63.8	0	0	0	0	114.1	Y455 C471 Y493 F498 A499 C509 T513	Y455-C511 HydrophobicContact CD1-CB 3.98Å; Y455-C511 HydrophobicContact CE1-CB 3.87Å; C471-C511 HydrophobicContact CB-CB 3.96Å; C471-C511 WeakPolarHBondContact CB-SG 3.25Å; C471-C511 WeakPolarHBondContact SG-CA 3.49Å; C471-C511 WeakPolarHBondContact SG-CB 3.46Å; C471-C511 CovalentContact SG-SG 2.04Å; C471-C511 PolarHBondContact SG-SG 3.45Å; Y493-C511 HydrophobicContact CE1-CB 3.97Å; F498-C511 PolarHBondContact O-SG 3.2Å; A499-C511 VanDerWaalsContact O-CB 3.26Å; A499-C511 WeakPolarHBondContact O-CB 3.34Å; A499-C511 PolarHBondContact O-N 3.39Å; C509-C511 VanDerWaalsContact C-N 3.28Å; C509-C511 PolarHBondContact O-N 3.49Å; C511-T513 VanDerWaalsContact C-N 3.26Å; C511-T513 PolarHBondContact O-N 2.87Å
512	L	88.9	Confident	80.7	Confident	5 Å²	5	59.3 Å²	59.3	3%	0.026	37%	0.365	C	S	.	.			trans	-80.7	71.3	178.2	-79.8	63.5	0	0	0	110.5	A488 Y493 A499 C509 T514 V515 A520 T521 V522	A488-L512 HydrophobicContact CB-CD2 4.46Å; Y493-L512 HydrophobicContact CE2-CD1 3.88Å; Y493-L512 HydrophobicContact CE2-CG 4.49Å; A499-L512 HydrophobicContact CB-CD1 4.29Å; C509-L512 HydrophobicContact CB-CD1 3.69Å; C509-L512 HydrophobicContact CB-CD2 4.43Å; C509-L512 PolarHBondContact O-N 3.14Å; L512-T514 VanDerWaalsContact C-N 3.28Å; L512-T514 PolarHBondContact O-N 3.48Å; L512-V515 PolarHBondContact O-N 3.42Å; L512-A520 HydrophobicContact CB-CB 4.15Å; L512-A520 HydrophobicContact CD2-CB 4.24Å; L512-T521 WeakPolarHBondContact CD2-O 3.22Å; L512-V522 HydrophobicContact CD1-CG1 4.17Å; L512-V522 HydrophobicContact CD2-CG1 4.24Å
513	T	79.1	Confident	81	Confident	92 Å²	92	58.1 Å²	58.1	56%	0.564	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-16.7	-173	56.1	0	0	0	0	115	C511	C511-T513 VanDerWaalsContact C-N 3.26Å; C511-T513 PolarHBondContact O-N 2.87Å
514	T	77.3	Confident	81.4	Confident	94 Å²	94	60.6 Å²	60.6	58%	0.577	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	-9.3	-178.4	53.8	0	0	0	0	113.3	D489 L512	D489-T514 WeakPolarHBondContact CB-OG1 3.24Å; L512-T514 VanDerWaalsContact C-N 3.28Å; L512-T514 PolarHBondContact O-N 3.48Å
515	V	80.3	Confident	82	Confident	30 Å²	30	60 Å²	60	18%	0.182	38%	0.379	C	S	.	.	S	Bend	trans	-116.2	139.4	-176.2	-174.8	0	0	0	0	108.9	A488 D489 L512 N519	A488-V515 HydrophobicContact CB-CG1 4.37Å; A488-V515 HydrophobicContact CB-CG2 4.25Å; D489-V515 HydrophobicContact CB-CG2 4.05Å; L512-V515 PolarHBondContact O-N 3.42Å; V515-N519 HydrophobicContact CG1-CB 3.63Å; V515-N519 WeakPolarHBondContact CG1-O 3.48Å
516	P	79.6	Confident	82.7	Confident	88 Å²	88	56.7 Å²	56.7	57%	0.571	36%	0.359	S	S	*	.			trans	-55.5	143.7	173	-23.5	33.1	0	0	0	111.3	E518 N519 A520	P516-E518 PolarHBondContact O-N 3.47Å; P516-N519 CarbonylContact O-C 3.29Å; P516-N519 PolarHBondContact O-N 3.28Å; P516-A520 PolarHBondContact O-N 2.91Å; P516-A520 VanDerWaalsContact O-N 3.17Å
517	A	71.6	Confident	83.2	Confident	86 Å²	86	56.9 Å²	56.9	71%	0.711	36%	0.361	S	S	*	.	G	3₁₀ helix	trans	-54.8	-30.3	-175.7	0	0	0	0	0	114.1	N519 A520	A517-N519 VanDerWaalsContact C-N 3.29Å; A517-N519 PolarHBondContact O-N 2.88Å; A517-A520 PolarHBondContact O-N 3.19Å
518	E	72.5	Confident	83.4	Confident	187 Å²	187	60 Å²	60	87%	0.874	38%	0.382	S	S	*	.	G	3₁₀ helix	trans	-69.3	-24	176.9	-62.5	-178.3	176	0	0	113.4	P516	P516-E518 PolarHBondContact O-N 3.47Å
519	N	80.1	Confident	83.5	Confident	104 Å²	104	59.7 Å²	59.7	56%	0.556	37%	0.373	S	S	*	.	G	3₁₀ helix	trans	-110	7.2	179.9	-69.3	-16.5	0	0	0	112.6	V515 P516 A517 T521	V515-N519 HydrophobicContact CG1-CB 3.63Å; V515-N519 WeakPolarHBondContact CG1-O 3.48Å; P516-N519 CarbonylContact O-C 3.29Å; P516-N519 PolarHBondContact O-N 3.28Å; A517-N519 VanDerWaalsContact C-N 3.29Å; A517-N519 PolarHBondContact O-N 2.88Å; N519-T521 VanDerWaalsContact C-N 3.27Å; N519-T521 PolarHBondContact O-N 2.6Å
520	A	84.7	Confident	83.2	Confident	3 Å²	3	65.8 Å²	65.8	3%	0.025	41%	0.413	C	S	.	.			trans	-76.4	78.3	-179.9	0	0	0	0	0	110.5	G508 C509 L512 P516 A517	G508-A520 PolarHBondContact N-O 2.72Å; C509-A520 PolarHBondContact N-O 3.02Å; L512-A520 HydrophobicContact CB-CB 4.15Å; L512-A520 HydrophobicContact CD2-CB 4.24Å; P516-A520 PolarHBondContact O-N 2.91Å; P516-A520 VanDerWaalsContact O-N 3.17Å; A517-A520 PolarHBondContact O-N 3.19Å
521	T	87.8	Confident	83	Confident	55 Å²	55	65.1 Å²	65.1	34%	0.337	41%	0.412	S	S	.	.	B	Isolated β-bridge	trans	-117.3	155.5	178.3	64.2	0	0	0	0	111.4	A488 L506 T507 L512 N519	A488-T521 PolarHBondContact N-O 3.35Å; A488-T521 VanDerWaalsContact N-O 3.09Å; L506-T521 WeakPolarHBondContact O-CA 3.5Å; T507-T521 HydrophobicContact CG2-CG2 3.58Å; L512-T521 WeakPolarHBondContact CD2-O 3.22Å; N519-T521 VanDerWaalsContact C-N 3.27Å; N519-T521 PolarHBondContact O-N 2.6Å
522	V	88.4	Confident	83	Confident	6 Å²	6	66.4 Å²	66.4	4%	0.036	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	150.7	175.6	-56.2	0	0	0	0	110.5	V485 C486 A499 L506 C509 L512	V485-V522 HydrophobicContact CB-CB 3.97Å; V485-V522 HydrophobicContact CB-CG2 4Å; V485-V522 HydrophobicContact CG1-CG2 4.32Å; V485-V522 HydrophobicContact CG2-CB 3.93Å; V485-V522 HydrophobicContact CG2-CG1 4.18Å; V485-V522 HydrophobicContact CG2-CG2 3.96Å; C486-V522 CarbonylContact O-C 3.53Å; C486-V522 VanDerWaalsContact O-CA 3.25Å; C486-V522 WeakPolarHBondContact O-CA 3.41Å; A499-V522 HydrophobicContact CB-CG1 4.08Å; L506-V522 HydrophobicContact CB-CG2 3.73Å; L506-V522 WeakPolarHBondContact CB-O 3.15Å; L506-V522 HydrophobicContact CD2-CG2 3.77Å; L506-V522 HydrophobicContact CG-CG2 4.22Å; L506-V522 PolarHBondContact O-N 3.43Å; C509-V522 HydrophobicContact CB-CG1 4.39Å; L512-V522 HydrophobicContact CD1-CG1 4.17Å; L512-V522 HydrophobicContact CD2-CG1 4.24Å
523	V	88.3	Confident	83	Confident	93 Å²	93	74.1 Å²	74.1	56%	0.564	46%	0.456	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.8	139.7	177.5	-177.9	0	0	0	0	109.2	V485 C486	V485-V523 CarbonylContact C-O 3.5Å; V485-V523 VanDerWaalsContact CA-O 3.3Å; V485-V523 WeakPolarHBondContact CA-O 3.48Å; C486-V523 PolarHBondContact N-O 3.28Å; C486-V523 PolarHBondContact O-N 3.46Å
524	P	83	Confident	83.5	Confident	89 Å²	89	76.9 Å²	76.9	58%	0.578	46%	0.463	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-58.5	140.8	176	-24.1	34.7	0	0	0	113	L506	L506-P524 HydrophobicContact CD1-CG 3.99Å
525	G	82.1	Confident	84.2	Confident	27 Å²	27	73.3 Å²	73.3	28%	0.278	44%	0.443	S	S	.	.	S	Bend	trans	101.9	170.3	-179.5	0	0	0	0	0	113.7	P484 V485 C486	P484-G525 CarbonylContact O-C 3.27Å; P484-G525 WeakPolarHBondContact O-CA 3.07Å; P484-G525 PolarHBondContact O-N 3.49Å; V485-G525 CarbonylContact C-O 3.37Å; V485-G525 VanDerWaalsContact C-O 3.29Å; V485-G525 WeakPolarHBondContact CA-O 3.45Å; C486-G525 PolarHBondContact N-O 3.34Å
526	K	87.3	Confident	84.7	Confident	46 Å²	46	74.2 Å²	74.2	20%	0.2	45%	0.445	C	S	.	.	P	Polyproline II helix	trans	-71.3	150.4	174.8	-62.2	179.9	-178.6	175.2	0	110.3	P484 T492	P484-K526 HydrophobicContact CB-CG 4.24Å; P484-K526 HydrophobicContact CG-CG 4.19Å; T492-K526 HydrophobicContact CG2-CB 4.46Å; T492-K526 HydrophobicContact CG2-CG 4.37Å
527	C	88.9	Confident	85.3	Confident	19 Å²	19	75.1 Å²	75.1	13%	0.128	44%	0.444	C	S	.	.	P	Polyproline II helix	trans	-62	140	175.3	-69	0	0	0	0	112.1	C486 I491 T492 S529	C486-C527 WeakPolarHBondContact CA-SG 3.41Å; C486-C527 HydrophobicContact CB-CB 4Å; C486-C527 WeakPolarHBondContact CB-SG 3.39Å; C486-C527 WeakPolarHBondContact SG-CA 3.17Å; C486-C527 WeakPolarHBondContact SG-CB 2.99Å; C486-C527 CovalentContact SG-SG 2.04Å; C486-C527 PolarHBondContact SG-SG 3.3Å; I491-C527 VanDerWaalsContact C-SG 3.52Å; I491-C527 PolarHBondContact O-SG 2.82Å; T492-C527 PolarHBondContact OG1-N 3.49Å; C527-S529 PolarHBondContact O-N 3.23Å
528	P	85.4	Confident	86.3	Confident	119 Å²	119	74.3 Å²	74.3	77%	0.773	43%	0.43	S	S	*	.	P	Polyproline II helix	trans	-66.9	130.1	-179.3	27	-33.3	0	0	0	110.6
529	S	83.6	Confident	87.3	Confident	40 Å²	40	65.6 Å²	65.6	28%	0.28	39%	0.389	S	S	.	.	P	Polyproline II helix	trans	-88.7	128.5	173.7	-70.6	0	0	0	0	110.7	D444 C527 G531 C532	D444-S529 PolarHBondContact O-OG 3.47Å; C527-S529 PolarHBondContact O-N 3.23Å; S529-G531 PolarHBondContact O-N 3.36Å; S529-C532 VanDerWaalsContact O-CB 3.24Å; S529-C532 WeakPolarHBondContact O-CB 3.31Å; S529-C532 PolarHBondContact O-N 3.44Å
530	P	82.6	Confident	87.9	Confident	134 Å²	134	62.2 Å²	62.2	87%	0.87	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	135.9	-179.2	24.9	-32.9	0	0	0	111	C532	P530-C532 PolarHBondContact O-N 3.29Å
531	G	84	Confident	88.3	Confident	50 Å²	50	65.5 Å²	65.5	52%	0.515	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	77	-2.5	179.8	0	0	0	0	0	115.8	S529 Q533 E534 A535	S529-G531 PolarHBondContact O-N 3.36Å; G531-Q533 VanDerWaalsContact C-N 3.33Å; G531-Q533 PolarHBondContact O-N 3.04Å; G531-E534 PolarHBondContact O-N 3.2Å; G531-A535 PolarHBondContact O-N 3.31Å
532	C	87.9	Confident	88.5	Confident	28 Å²	28	64.3 Å²	64.3	19%	0.189	39%	0.386	C	S	.	.	H	α-helix	trans	-62.2	-37	-176.7	-176.9	0	0	0	0	113.3	C443 S529 P530 A535 F536	C443-C532 HydrophobicContact CB-CB 3.85Å; C443-C532 WeakPolarHBondContact CB-SG 3.32Å; C443-C532 WeakPolarHBondContact SG-CA 3.12Å; C443-C532 WeakPolarHBondContact SG-CB 3.34Å; C443-C532 CovalentContact SG-SG 2.03Å; C443-C532 PolarHBondContact SG-SG 3.28Å; S529-C532 VanDerWaalsContact O-CB 3.24Å; S529-C532 WeakPolarHBondContact O-CB 3.31Å; S529-C532 PolarHBondContact O-N 3.44Å; P530-C532 PolarHBondContact O-N 3.29Å; C532-A535 PolarHBondContact O-N 2.93Å; C532-F536 WeakPolarHBondContact O-CB 3.37Å; C532-F536 PolarHBondContact O-N 3Å
533	Q	88.1	Confident	88.7	Confident	166 Å²	166	64.8 Å²	64.8	78%	0.776	39%	0.388	S	S	*	.	H	α-helix	trans	-67.6	-38.4	179.3	-172.2	173.9	-10.2	0	0	112.7	G531 F536 L537	G531-Q533 VanDerWaalsContact C-N 3.33Å; G531-Q533 PolarHBondContact O-N 3.04Å; Q533-F536 PolarHBondContact O-N 2.84Å; Q533-L537 PolarHBondContact O-N 3.27Å; Q533-L537 VanDerWaalsContact O-N 3.12Å
534	E	89.8	Confident	88.9	Confident	151 Å²	151	61.7 Å²	61.7	71%	0.706	37%	0.37	S	S	*	.	H	α-helix	trans	-70.1	-40.2	175.2	-64.6	-171.1	172.6	0	0	111.4	G531 F536 L537 T538	G531-E534 PolarHBondContact O-N 3.2Å; E534-F536 VanDerWaalsContact C-N 3.31Å; E534-F536 PolarHBondContact O-N 3.26Å; E534-L537 PolarHBondContact O-N 3.23Å; E534-T538 WeakPolarHBondContact O-CB 3.5Å; E534-T538 PolarHBondContact O-N 2.95Å; E534-T538 PolarHBondContact O-OG1 3.46Å
535	A	91.6	Very high	89.4	Confident	19 Å²	19	61.9 Å²	61.9	16%	0.157	37%	0.365	C	S	.	.	H	α-helix	trans	-60.6	-41.7	174.2	0	0	0	0	0	111.4	G531 C532 T538 F539	G531-A535 PolarHBondContact O-N 3.31Å; C532-A535 PolarHBondContact O-N 2.93Å; A535-T538 PolarHBondContact O-N 3.01Å; A535-F539 VanDerWaalsContact O-CB 3.25Å; A535-F539 WeakPolarHBondContact O-CB 3.38Å; A535-F539 PolarHBondContact O-N 3.32Å
536	F	91.8	Very high	89.9	Confident	49 Å²	49	60.8 Å²	60.8	22%	0.215	35%	0.353	C	S	.	.	H	α-helix	trans	-61	-49.7	175.2	172.6	-115.4	0	0	0	112.5	F380 L382 L390 C532 Q533 E534 T538 F539 L540	F380-F536 HydrophobicContact CB-CD2 3.86Å; F380-F536 HydrophobicContact CB-CE2 4.5Å; F380-F536 HydrophobicContact CB-CG 4.41Å; F380-F536 HydrophobicContact CD1-CB 3.54Å; F380-F536 AromaticContact CD1-CD2 3.85Å; F380-F536 HydrophobicContact CD1-CD2 3.85Å; F380-F536 HydrophobicContact CD1-CG 4.13Å; F380-F536 AromaticContact CD2-CD2 3.79Å; F380-F536 HydrophobicContact CD2-CD2 3.79Å; F380-F536 HydrophobicContact CD2-CE2 4.42Å; F380-F536 VanDerWaalsContact CE1-CA 3.5Å; F380-F536 HydrophobicContact CE1-CB 3.87Å; F380-F536 HydrophobicContact CE1-CD2 4.32Å; F380-F536 HydrophobicContact CE2-CD2 4.27Å; F380-F536 HydrophobicContact CG-CB 4.12Å; F380-F536 AromaticContact CG-CD2 3.55Å; F380-F536 HydrophobicContact CG-CD2 3.55Å; F380-F536 HydrophobicContact CG-CE2 4.43Å; F380-F536 HydrophobicContact CG-CG 4.21Å; L382-F536 HydrophobicContact CD1-CE2 3.65Å; L382-F536 HydrophobicContact CD1-CZ 3.85Å; L382-F536 HydrophobicContact CD2-CZ 4.46Å; L390-F536 HydrophobicContact CD2-CE2 4.02Å; L390-F536 HydrophobicContact CD2-CZ 4.02Å; C532-F536 WeakPolarHBondContact O-CB 3.37Å; C532-F536 PolarHBondContact O-N 3Å; Q533-F536 PolarHBondContact O-N 2.84Å; E534-F536 VanDerWaalsContact C-N 3.31Å; E534-F536 PolarHBondContact O-N 3.26Å; F536-T538 VanDerWaalsContact C-N 3.3Å; F536-T538 PolarHBondContact O-N 3.25Å; F536-F539 WeakPolarHBondContact O-CB 3.46Å; F536-F539 PolarHBondContact O-N 2.94Å; F536-L540 PolarHBondContact O-N 3Å
537	L	91.4	Very high	90.1	Very high	107 Å²	107	60 Å²	60	56%	0.56	35%	0.353	S	S	*	.	H	α-helix	trans	-62.4	-41.5	179.7	-176.4	62.5	0	0	0	111.3	Q533 E534 L540 C541	Q533-L537 PolarHBondContact O-N 3.27Å; Q533-L537 VanDerWaalsContact O-N 3.12Å; E534-L537 PolarHBondContact O-N 3.23Å; L537-L540 PolarHBondContact O-N 3.39Å; L537-C541 PolarHBondContact O-N 2.86Å; L537-C541 VanDerWaalsContact O-N 3.11Å; L537-C541 PolarHBondContact O-SG 2.87Å
538	T	93	Very high	90.3	Very high	68 Å²	68	61.1 Å²	61.1	42%	0.417	36%	0.358	S	S	.	.	H	α-helix	trans	-63.6	-44.9	176.1	-55.3	0	0	0	0	111.1	L441 E534 A535 F536 L540 C541 V542	L441-T538 HydrophobicContact CD1-CG2 4.12Å; L441-T538 HydrophobicContact CD2-CG2 3.65Å; E534-T538 WeakPolarHBondContact O-CB 3.5Å; E534-T538 PolarHBondContact O-N 2.95Å; E534-T538 PolarHBondContact O-OG1 3.46Å; A535-T538 PolarHBondContact O-N 3.01Å; F536-T538 VanDerWaalsContact C-N 3.3Å; F536-T538 PolarHBondContact O-N 3.25Å; T538-L540 VanDerWaalsContact C-N 3.32Å; T538-L540 PolarHBondContact O-N 2.85Å; T538-C541 PolarHBondContact O-N 3.42Å; T538-V542 HydrophobicContact CG2-CG2 4.4Å; T538-V542 VanDerWaalsContact O-CG2 3.32Å; T538-V542 WeakPolarHBondContact O-CG2 3.25Å; T538-V542 PolarHBondContact O-N 3.25Å
539	F	93.4	Very high	90.7	Very high	4 Å²	4	57.1 Å²	57.1	2%	0.018	33%	0.33	C	S	.	.	H	α-helix	trans	-56.2	-46.6	175.4	178.9	-91.7	0	0	0	111.2	Y375 L376 F380 F438 L441 A535 F536 C541 V542 M543	Y375-F539 HydrophobicContact CD1-CZ 4.2Å; Y375-F539 HydrophobicContact CE1-CE1 4.49Å; Y375-F539 AromaticContact CE1-CE2 3.83Å; Y375-F539 HydrophobicContact CE1-CE2 3.83Å; Y375-F539 AromaticContact CE1-CZ 3.67Å; Y375-F539 HydrophobicContact CE1-CZ 3.67Å; L376-F539 HydrophobicContact CD2-CD1 4.21Å; L376-F539 HydrophobicContact CD2-CE1 3.7Å; F380-F539 HydrophobicContact CE1-CB 4.48Å; F380-F539 HydrophobicContact CE2-CB 4.23Å; F380-F539 AromaticContact CE2-CD1 3.64Å; F380-F539 HydrophobicContact CE2-CD1 3.64Å; F380-F539 HydrophobicContact CE2-CD2 4.21Å; F380-F539 HydrophobicContact CE2-CE1 4.01Å; F380-F539 AromaticContact CE2-CG 3.76Å; F380-F539 HydrophobicContact CE2-CG 3.76Å; F380-F539 HydrophobicContact CE2-CZ 4.45Å; F380-F539 HydrophobicContact CZ-CB 3.68Å; F380-F539 AromaticContact CZ-CD1 3.99Å; F380-F539 HydrophobicContact CZ-CD1 3.99Å; F380-F539 HydrophobicContact CZ-CD2 4.02Å; F380-F539 AromaticContact CZ-CG 3.63Å; F380-F539 HydrophobicContact CZ-CG 3.63Å; F438-F539 HydrophobicContact CB-CE2 4.32Å; F438-F539 AromaticContact CD1-CD2 3.61Å; F438-F539 HydrophobicContact CD1-CD2 3.61Å; F438-F539 AromaticContact CD1-CE2 3.52Å; F438-F539 HydrophobicContact CD1-CE2 3.52Å; F438-F539 HydrophobicContact CE1-CD2 4.04Å; F438-F539 AromaticContact CE1-CE2 3.96Å; F438-F539 HydrophobicContact CE1-CE2 3.96Å; F438-F539 HydrophobicContact CG-CD2 4.39Å; F438-F539 AromaticContact CG-CE2 3.93Å; F438-F539 HydrophobicContact CG-CE2 3.93Å; L441-F539 HydrophobicContact CB-CB 4.29Å; L441-F539 HydrophobicContact CB-CD2 4.12Å; A535-F539 VanDerWaalsContact O-CB 3.25Å; A535-F539 WeakPolarHBondContact O-CB 3.38Å; A535-F539 PolarHBondContact O-N 3.32Å; F536-F539 WeakPolarHBondContact O-CB 3.46Å; F536-F539 PolarHBondContact O-N 2.94Å; F539-C541 PolarHBondContact O-N 3.1Å; F539-V542 PolarHBondContact O-N 2.87Å; F539-M543 HydrophobicContact CD1-CG 3.77Å; F539-M543 HydrophobicContact CD2-CG 4.45Å; F539-M543 HydrophobicContact CE1-CG 3.34Å; F539-M543 HydrophobicContact CE1-SD 4.09Å; F539-M543 HydrophobicContact CE2-CG 4.09Å; F539-M543 HydrophobicContact CE2-SD 4.25Å; F539-M543 HydrophobicContact CG-CG 4.3Å; F539-M543 HydrophobicContact CZ-CG 3.52Å; F539-M543 HydrophobicContact CZ-SD 3.69Å; F539-M543 WeakPolarHBondContact O-CB 3.07Å; F539-M543 VanDerWaalsContact O-CG 3.26Å; F539-M543 WeakPolarHBondContact O-CG 3.49Å; F539-M543 PolarHBondContact O-N 3.41Å
540	L	92.4	Very high	91	Very high	34 Å²	34	55.9 Å²	55.9	18%	0.178	32%	0.323	C	S	.	.	H	α-helix	trans	-59.9	-47.5	178.4	177.6	56.1	0	0	0	112.4	L390 F536 L537 T538 V542 M543 C544	L390-L540 HydrophobicContact CD1-CD1 3.45Å; L390-L540 VanDerWaalsContact CD1-CD1 3.45Å; L390-L540 HydrophobicContact CD1-CD2 3.8Å; L390-L540 HydrophobicContact CD1-CG 4.25Å; L390-L540 HydrophobicContact CD2-CD1 3.95Å; L390-L540 HydrophobicContact CG-CD1 3.82Å; F536-L540 PolarHBondContact O-N 3Å; L537-L540 PolarHBondContact O-N 3.39Å; T538-L540 VanDerWaalsContact C-N 3.32Å; T538-L540 PolarHBondContact O-N 2.85Å; L540-V542 PolarHBondContact O-N 2.99Å; L540-M543 PolarHBondContact O-N 3.5Å; L540-C544 PolarHBondContact O-N 3.35Å; L540-C544 PolarHBondContact O-SG 3.07Å; L540-C544 VanDerWaalsContact O-SG 3.42Å
541	C	92.6	Very high	91.4	Very high	71 Å²	71	50.4 Å²	50.4	48%	0.48	29%	0.289	S	S	.	.	H	α-helix	trans	-61.1	-45.5	177.6	-70.2	0	0	0	0	111.9	L537 T538 F539 C544 I545	L537-C541 PolarHBondContact O-N 2.86Å; L537-C541 VanDerWaalsContact O-N 3.11Å; L537-C541 PolarHBondContact O-SG 2.87Å; T538-C541 PolarHBondContact O-N 3.42Å; F539-C541 PolarHBondContact O-N 3.1Å; C541-C544 PolarHBondContact O-N 3.04Å; C541-I545 WeakPolarHBondContact O-CG1 3.21Å; C541-I545 PolarHBondContact O-N 3.38Å; C541-I545 VanDerWaalsContact O-N 3.17Å
542	V	93	Very high	91.7	Very high	30 Å²	30	49.7 Å²	49.7	18%	0.182	27%	0.273	C	S	.	.	H	α-helix	trans	-66.5	-38.7	179.1	178	0	0	0	0	111	F438 L441 T538 F539 L540 I545 C546	F438-V542 HydrophobicContact CD1-CG1 4.19Å; F438-V542 HydrophobicContact CE1-CB 3.85Å; F438-V542 HydrophobicContact CE1-CG1 3.43Å; F438-V542 VanDerWaalsContact CE1-CG1 3.43Å; F438-V542 HydrophobicContact CZ-CG1 3.91Å; L441-V542 HydrophobicContact CD1-CB 4.29Å; L441-V542 HydrophobicContact CD1-CG2 4.03Å; T538-V542 HydrophobicContact CG2-CG2 4.4Å; T538-V542 VanDerWaalsContact O-CG2 3.32Å; T538-V542 WeakPolarHBondContact O-CG2 3.25Å; T538-V542 PolarHBondContact O-N 3.25Å; F539-V542 PolarHBondContact O-N 2.87Å; L540-V542 PolarHBondContact O-N 2.99Å; V542-I545 PolarHBondContact O-N 2.83Å; V542-C546 WeakPolarHBondContact O-CB 3.38Å; V542-C546 PolarHBondContact O-N 3.25Å
543	M	92.4	Very high	91.7	Very high	17 Å²	17	48.6 Å²	48.6	8%	0.084	27%	0.266	C	S	.	.	H	α-helix	trans	-58.4	-48.8	173.7	-80.1	-64.8	-65.1	0	0	111.8	L372 F438 F539 L540 I545 C546 S547	L372-M543 HydrophobicContact CD1-CE 4.09Å; L372-M543 HydrophobicContact CD2-CE 3.69Å; F438-M543 HydrophobicContact CD1-SD 4.5Å; F438-M543 HydrophobicContact CD2-SD 4.26Å; F438-M543 HydrophobicContact CE1-CG 3.75Å; F438-M543 HydrophobicContact CE1-SD 3.68Å; F438-M543 HydrophobicContact CE2-SD 3.4Å; F438-M543 WeakPolarHBondContact CE2-SD 3.42Å; F438-M543 HydrophobicContact CZ-CB 4.38Å; F438-M543 HydrophobicContact CZ-CG 3.69Å; F438-M543 HydrophobicContact CZ-SD 3.09Å; F438-M543 WeakPolarHBondContact CZ-SD 3.48Å; F539-M543 HydrophobicContact CD1-CG 3.77Å; F539-M543 HydrophobicContact CD2-CG 4.45Å; F539-M543 HydrophobicContact CE1-CG 3.34Å; F539-M543 HydrophobicContact CE1-SD 4.09Å; F539-M543 HydrophobicContact CE2-CG 4.09Å; F539-M543 HydrophobicContact CE2-SD 4.25Å; F539-M543 HydrophobicContact CG-CG 4.3Å; F539-M543 HydrophobicContact CZ-CG 3.52Å; F539-M543 HydrophobicContact CZ-SD 3.69Å; F539-M543 WeakPolarHBondContact O-CB 3.07Å; F539-M543 VanDerWaalsContact O-CG 3.26Å; F539-M543 WeakPolarHBondContact O-CG 3.49Å; F539-M543 PolarHBondContact O-N 3.41Å; L540-M543 PolarHBondContact O-N 3.5Å; M543-I545 VanDerWaalsContact C-N 3.35Å; M543-I545 PolarHBondContact O-N 3.47Å; M543-C546 PolarHBondContact O-N 2.91Å; M543-S547 WeakPolarHBondContact O-CB 3.48Å; M543-S547 PolarHBondContact O-N 3.28Å; M543-S547 PolarHBondContact O-OG 3.38Å; M543-S547 VanDerWaalsContact O-OG 3.09Å
544	C	93.1	Very high	91.5	Very high	28 Å²	28	45 Å²	45	19%	0.189	25%	0.249	C	C	.	.	H	α-helix	trans	-58.6	-45.5	177.7	-72.1	0	0	0	0	112.3	L540 C541 L548	L540-C544 PolarHBondContact O-N 3.35Å; L540-C544 PolarHBondContact O-SG 3.07Å; L540-C544 VanDerWaalsContact O-SG 3.42Å; C541-C544 PolarHBondContact O-N 3.04Å; C544-L548 WeakPolarHBondContact O-CB 3.15Å; C544-L548 PolarHBondContact O-N 3.27Å
545	I	93.4	Very high	91.2	Very high	92 Å²	92	39.4 Å²	39.4	47%	0.472	23%	0.225	S	C	.	.	H	α-helix	trans	-65.2	-43.4	177.6	-65.6	168.2	0	0	0	110.6	C541 V542 M543 L548 I549	C541-I545 WeakPolarHBondContact O-CG1 3.21Å; C541-I545 PolarHBondContact O-N 3.38Å; C541-I545 VanDerWaalsContact O-N 3.17Å; V542-I545 PolarHBondContact O-N 2.83Å; M543-I545 VanDerWaalsContact C-N 3.35Å; M543-I545 PolarHBondContact O-N 3.47Å; I545-L548 WeakPolarHBondContact O-CB 3.25Å; I545-L548 PolarHBondContact O-N 3.22Å; I545-I549 HydrophobicContact CG2-CD1 3.59Å; I545-I549 HydrophobicContact CG2-CG1 4.32Å; I545-I549 WeakPolarHBondContact O-CB 3.29Å; I545-I549 VanDerWaalsContact O-CG1 3.3Å; I545-I549 WeakPolarHBondContact O-CG1 3.35Å; I545-I549 PolarHBondContact O-N 2.84Å
546	C	92.5	Very high	90.7	Very high	4 Å²	4	38.5 Å²	38.5	3%	0.027	22%	0.217	C	C	.	.	H	α-helix	trans	-64.3	-45.6	179.8	-171	0	0	0	0	111.6	C434 Y435 F438 V542 M543 L548 I549 G550	C434-C546 HydrophobicContact CB-CB 3.78Å; C434-C546 VanDerWaalsContact CB-SG 3.57Å; Y435-C546 VanDerWaalsContact CE2-SG 3.57Å; F438-C546 HydrophobicContact CE2-CB 4.45Å; F438-C546 HydrophobicContact CZ-CB 4.06Å; V542-C546 WeakPolarHBondContact O-CB 3.38Å; V542-C546 PolarHBondContact O-N 3.25Å; M543-C546 PolarHBondContact O-N 2.91Å; C546-L548 VanDerWaalsContact C-N 3.35Å; C546-L548 PolarHBondContact O-N 3.49Å; C546-I549 PolarHBondContact O-N 3.45Å; C546-G550 PolarHBondContact O-N 3.48Å
547	S	91.4	Very high	90.2	Very high	29 Å²	29	36.7 Å²	36.7	20%	0.203	21%	0.211	C	C	.	.	H	α-helix	trans	-61.2	-42.6	175.4	-65.2	0	0	0	0	111.6	M543 A551	M543-S547 WeakPolarHBondContact O-CB 3.48Å; M543-S547 PolarHBondContact O-N 3.28Å; M543-S547 PolarHBondContact O-OG 3.38Å; M543-S547 VanDerWaalsContact O-OG 3.09Å; S547-A551 WeakPolarHBondContact O-CB 3.12Å; S547-A551 PolarHBondContact O-N 3.47Å; S547-A551 VanDerWaalsContact O-N 3.15Å
548	L	93.2	Very high	89.5	Confident	44 Å²	44	34.3 Å²	34.3	23%	0.23	20%	0.201	C	C	.	.	H	α-helix	trans	-60.6	-55.2	175.6	-177.9	75.5	0	0	0	111.2	C398 L401 G402 L405 C544 I545 C546 M552	C398-L548 WeakPolarHBondContact O-CD1 3.48Å; L401-L548 HydrophobicContact CB-CD1 3.75Å; L401-L548 HydrophobicContact CD2-CD1 3.83Å; L401-L548 HydrophobicContact CG-CD1 3.67Å; G402-L548 VanDerWaalsContact CA-O 3.23Å; G402-L548 WeakPolarHBondContact CA-O 3.13Å; L405-L548 HydrophobicContact CD1-CD1 4.15Å; C544-L548 WeakPolarHBondContact O-CB 3.15Å; C544-L548 PolarHBondContact O-N 3.27Å; I545-L548 WeakPolarHBondContact O-CB 3.25Å; I545-L548 PolarHBondContact O-N 3.22Å; C546-L548 VanDerWaalsContact C-N 3.35Å; C546-L548 PolarHBondContact O-N 3.49Å; L548-M552 WeakPolarHBondContact O-CG 3.33Å; L548-M552 PolarHBondContact O-N 2.99Å
549	I	93.4	Very high	88.8	Confident	35 Å²	35	33 Å²	33	18%	0.179	19%	0.191	C	C	.	.	H	α-helix	trans	-63.8	-52.5	-177.1	-67.2	171.5	0	0	0	109.9	V427 V430 I545 C546 A551 M552	V427-I549 HydrophobicContact CG1-CG2 4.05Å; V427-I549 WeakPolarHBondContact CG1-O 3.29Å; V430-I549 HydrophobicContact CB-CG2 4.22Å; V430-I549 HydrophobicContact CG1-CD1 3.88Å; V430-I549 HydrophobicContact CG1-CG2 4.01Å; I545-I549 HydrophobicContact CG2-CD1 3.59Å; I545-I549 HydrophobicContact CG2-CG1 4.32Å; I545-I549 WeakPolarHBondContact O-CB 3.29Å; I545-I549 VanDerWaalsContact O-CG1 3.3Å; I545-I549 WeakPolarHBondContact O-CG1 3.35Å; I545-I549 PolarHBondContact O-N 2.84Å; C546-I549 PolarHBondContact O-N 3.45Å; I549-A551 PolarHBondContact O-N 2.98Å; I549-M552 VanDerWaalsContact O-CB 3.26Å; I549-M552 WeakPolarHBondContact O-CB 3.41Å; I549-M552 PolarHBondContact O-N 3.29Å
550	G	90.4	Very high	88.1	Confident	14 Å²	14	32.8 Å²	32.8	14%	0.144	19%	0.19	C	C	.	.	H	α-helix	trans	-55.6	-39.9	-177.3	0	0	0	0	0	112.7	C546 M552 A553	C546-G550 PolarHBondContact O-N 3.48Å; G550-M552 VanDerWaalsContact C-N 3.28Å; G550-M552 PolarHBondContact O-N 3.17Å; G550-A553 PolarHBondContact O-N 2.86Å
551	A	90.3	Very high	87.3	Confident	18 Å²	18	31.4 Å²	31.4	15%	0.149	18%	0.183	C	C	.	.	H	α-helix	trans	-70.3	-20.7	179.5	0	0	0	0	0	113.8	A399 I403 S547 I549 A553 Q554	A399-A551 HydrophobicContact CB-CB 4.16Å; A399-A551 VanDerWaalsContact O-CB 3.27Å; A399-A551 WeakPolarHBondContact O-CB 3.48Å; I403-A551 HydrophobicContact CG1-CB 3.94Å; S547-A551 WeakPolarHBondContact O-CB 3.12Å; S547-A551 PolarHBondContact O-N 3.47Å; S547-A551 VanDerWaalsContact O-N 3.15Å; I549-A551 PolarHBondContact O-N 2.98Å; A551-A553 PolarHBondContact O-N 3.04Å; A551-Q554 WeakPolarHBondContact O-CB 3.22Å; A551-Q554 PolarHBondContact O-N 2.85Å; A551-Q554 VanDerWaalsContact O-N 3.16Å
552	M	90.8	Very high	86.4	Confident	36 Å²	36	31 Å²	31	18%	0.177	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-21.6	175.6	-64.6	173.6	70	0	0	113.2	G402 M423 V427 L548 I549 G550 Q554 P556	G402-M552 WeakPolarHBondContact O-CA 3.3Å; G402-M552 VanDerWaalsContact O-CG 3.26Å; G402-M552 WeakPolarHBondContact O-CG 3.09Å; M423-M552 HydrophobicContact CE-CB 4.49Å; M423-M552 HydrophobicContact CE-CE 4.33Å; V427-M552 HydrophobicContact CG1-CB 4.2Å; V427-M552 HydrophobicContact CG2-CB 4.17Å; L548-M552 WeakPolarHBondContact O-CG 3.33Å; L548-M552 PolarHBondContact O-N 2.99Å; I549-M552 VanDerWaalsContact O-CB 3.26Å; I549-M552 WeakPolarHBondContact O-CB 3.41Å; I549-M552 PolarHBondContact O-N 3.29Å; G550-M552 VanDerWaalsContact C-N 3.28Å; G550-M552 PolarHBondContact O-N 3.17Å; M552-Q554 VanDerWaalsContact C-N 3.3Å; M552-P556 WeakPolarHBondContact O-CD 3.46Å; M552-P556 WeakPolarHBondContact O-CG 3.24Å
553	A	87.4	Confident	85.5	Confident	4 Å²	4	35.2 Å²	35.2	3%	0.033	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-16.4	178.6	0	0	0	0	0	113.2	V427 G550 A551 P556 S557	V427-A553 HydrophobicContact CB-CB 4.19Å; V427-A553 HydrophobicContact CG1-CB 3.71Å; G550-A553 PolarHBondContact O-N 2.86Å; A551-A553 PolarHBondContact O-N 3.04Å; A553-P556 WeakPolarHBondContact O-CD 3.39Å; A553-P556 WeakPolarHBondContact O-CG 3.19Å; A553-S557 WeakPolarHBondContact O-CB 3.46Å; A553-S557 PolarHBondContact O-N 3.45Å; A553-S557 PolarHBondContact O-OG 2.91Å
554	Q	84.5	Confident	84.5	Confident	91 Å²	91	35.1 Å²	35.1	43%	0.425	19%	0.188	S	C	.	.	H	α-helix	trans	-66.9	-50	-173.5	-162.7	179.5	31.2	0	0	112	I403 A551 M552 S557 V558	I403-Q554 VanDerWaalsContact CG1-OE1 3.27Å; A551-Q554 WeakPolarHBondContact O-CB 3.22Å; A551-Q554 PolarHBondContact O-N 2.85Å; A551-Q554 VanDerWaalsContact O-N 3.16Å; M552-Q554 VanDerWaalsContact C-N 3.3Å; Q554-S557 PolarHBondContact O-N 3.34Å; Q554-V558 PolarHBondContact O-N 2.78Å
555	T	82.9	Confident	83.5	Confident	33 Å²	33	34.1 Å²	34.1	20%	0.202	18%	0.181	C	C	.	.	H	α-helix	trans	-61.1	-50.4	179.4	-46.7	0	0	0	0	114.2	I403 S557 V558 I559	I403-T555 PolarHBondContact O-OG1 3.45Å; T555-S557 VanDerWaalsContact C-N 3.26Å; T555-S557 PolarHBondContact O-N 3.41Å; T555-V558 PolarHBondContact O-N 2.91Å; T555-I559 HydrophobicContact CG2-CD1 3.83Å; T555-I559 WeakPolarHBondContact O-CG1 3.34Å; T555-I559 PolarHBondContact O-N 3.03Å; T555-I559 VanDerWaalsContact O-N 3.08Å
556	P	81.4	Confident	82.3	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-61.2	-35.2	177.9	21.4	-30.9	0	0	0	112.2	V410 A420 M423 A424 M552 A553 I559 I560	V410-P556 HydrophobicContact CG2-CB 4.09Å; A420-P556 HydrophobicContact CB-CB 4.03Å; M423-P556 HydrophobicContact CE-CG 4.33Å; M423-P556 HydrophobicContact SD-CB 4.39Å; M423-P556 HydrophobicContact SD-CG 4.19Å; A424-P556 HydrophobicContact CB-CG 4.46Å; M552-P556 WeakPolarHBondContact O-CD 3.46Å; M552-P556 WeakPolarHBondContact O-CG 3.24Å; A553-P556 WeakPolarHBondContact O-CD 3.39Å; A553-P556 WeakPolarHBondContact O-CG 3.19Å; P556-I559 PolarHBondContact O-N 2.81Å; P556-I560 VanDerWaalsContact O-CD1 3.28Å; P556-I560 WeakPolarHBondContact O-CD1 3.48Å; P556-I560 WeakPolarHBondContact O-CG1 3.36Å; P556-I560 PolarHBondContact O-N 2.83Å
557	S	81.3	Confident	80.7	Confident	11 Å²	11	36 Å²	36	8%	0.077	20%	0.201	C	C	.	.	H	α-helix	trans	-62	-44.8	177.8	-59.6	0	0	0	0	112.6	A553 Q554 T555 I560 L561 Y641	A553-S557 WeakPolarHBondContact O-CB 3.46Å; A553-S557 PolarHBondContact O-N 3.45Å; A553-S557 PolarHBondContact O-OG 2.91Å; Q554-S557 PolarHBondContact O-N 3.34Å; T555-S557 VanDerWaalsContact C-N 3.26Å; T555-S557 PolarHBondContact O-N 3.41Å; S557-I560 PolarHBondContact O-N 3.14Å; S557-L561 PolarHBondContact O-N 2.92Å; S557-Y641 PolarHBondContact OG-OH 3.36Å; S557-Y641 VanDerWaalsContact OG-OH 3.12Å
558	V	77.6	Confident	79.1	Confident	58 Å²	58	41.9 Å²	41.9	35%	0.352	23%	0.225	S	C	.	.	H	α-helix	trans	-65.8	-39.9	175.5	176.2	0	0	0	0	111.5	Q554 T555 I560 L561 I562	Q554-V558 PolarHBondContact O-N 2.78Å; T555-V558 PolarHBondContact O-N 2.91Å; V558-I560 PolarHBondContact O-N 2.9Å; V558-L561 WeakPolarHBondContact O-CB 3.41Å; V558-L561 PolarHBondContact O-N 2.89Å; V558-I562 HydrophobicContact CG1-CD1 3.86Å; V558-I562 HydrophobicContact CG1-CG1 4.49Å; V558-I562 WeakPolarHBondContact O-CG1 3.27Å; V558-I562 PolarHBondContact O-N 3.06Å
559	I	77.3	Confident	77.8	Confident	40 Å²	40	42.6 Å²	42.6	21%	0.205	23%	0.228	C	C	.	.	H	α-helix	trans	-64.4	-39.7	178.9	-69.9	170.2	0	0	0	111.6	V410 T555 P556 I562 R563	V410-I559 HydrophobicContact CB-CD1 4.29Å; V410-I559 HydrophobicContact CG1-CD1 3.6Å; T555-I559 HydrophobicContact CG2-CD1 3.83Å; T555-I559 WeakPolarHBondContact O-CG1 3.34Å; T555-I559 PolarHBondContact O-N 3.03Å; T555-I559 VanDerWaalsContact O-N 3.08Å; P556-I559 PolarHBondContact O-N 2.81Å; I559-I562 PolarHBondContact O-N 3.15Å; I559-R563 HydrophobicContact CG2-CG 4.46Å; I559-R563 WeakPolarHBondContact O-CB 3.43Å; I559-R563 WeakPolarHBondContact O-CG 3.25Å; I559-R563 PolarHBondContact O-N 2.95Å
560	I	79.5	Confident	76.5	Confident	0 Å²	0	44 Å²	44	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-61.8	-46	176.2	-66.3	155.9	0	0	0	110	I354 A420 I421 P556 S557 V558 I562 R563 T564	I354-I560 HydrophobicContact CD1-CB 4.42Å; I354-I560 HydrophobicContact CD1-CD1 4.24Å; I354-I560 HydrophobicContact CD1-CG2 4.11Å; I354-I560 HydrophobicContact CG1-CG2 4.17Å; A420-I560 HydrophobicContact CB-CD1 4.04Å; A420-I560 HydrophobicContact CB-CG1 3.78Å; I421-I560 HydrophobicContact CB-CD1 3.78Å; I421-I560 HydrophobicContact CD1-CD1 3.95Å; I421-I560 HydrophobicContact CG1-CD1 4.48Å; P556-I560 VanDerWaalsContact O-CD1 3.28Å; P556-I560 WeakPolarHBondContact O-CD1 3.48Å; P556-I560 WeakPolarHBondContact O-CG1 3.36Å; P556-I560 PolarHBondContact O-N 2.83Å; S557-I560 PolarHBondContact O-N 3.14Å; V558-I560 PolarHBondContact O-N 2.9Å; I560-I562 PolarHBondContact O-N 3.39Å; I560-R563 PolarHBondContact O-N 2.61Å; I560-T564 HydrophobicContact CG2-CG2 4.03Å; I560-T564 WeakPolarHBondContact O-CB 3.3Å; I560-T564 WeakPolarHBondContact O-CG2 3.39Å; I560-T564 PolarHBondContact O-N 3.45Å; I560-T564 PolarHBondContact O-OG1 2.85Å
561	L	75.9	Confident	75.2	Confident	5 Å²	5	48.2 Å²	48.2	3%	0.026	26%	0.261	C	S	.	.	H	α-helix	trans	-56.9	-49.2	177.2	-168.8	88.6	0	0	0	111.4	F351 I354 I355 S557 V558 R563 T564 V565 L574 L577	F351-L561 HydrophobicContact CD2-CD1 3.79Å; F351-L561 HydrophobicContact CE2-CD1 3.49Å; F351-L561 VanDerWaalsContact CE2-CD1 3.49Å; F351-L561 HydrophobicContact CE2-CG 4.22Å; F351-L561 HydrophobicContact CZ-CD1 4.39Å; I354-L561 HydrophobicContact CG2-CD1 3.78Å; I355-L561 HydrophobicContact CD1-CD1 4.21Å; I355-L561 HydrophobicContact CG1-CD1 3.81Å; S557-L561 PolarHBondContact O-N 2.92Å; V558-L561 WeakPolarHBondContact O-CB 3.41Å; V558-L561 PolarHBondContact O-N 2.89Å; L561-R563 VanDerWaalsContact C-N 3.29Å; L561-R563 PolarHBondContact O-N 2.73Å; L561-T564 PolarHBondContact O-N 3.33Å; L561-T564 PolarHBondContact O-OG1 3.14Å; L561-T564 VanDerWaalsContact O-OG1 3.08Å; L561-V565 WeakPolarHBondContact O-CG2 3.34Å; L561-V565 PolarHBondContact O-N 2.95Å; L561-L574 HydrophobicContact CD2-CD2 3.68Å; L561-L574 HydrophobicContact CD2-CG 4.35Å; L561-L577 HydrophobicContact CD2-CB 4.2Å; L561-L577 HydrophobicContact CD2-CD2 3.78Å
562	I	72.5	Confident	74.2	Confident	63 Å²	63	50.6 Å²	50.6	32%	0.323	27%	0.266	S	S	.	.	H	α-helix	trans	-64.5	-34.7	-177.8	-66.4	169.2	0	0	0	111.7	V558 I559 I560 K570	V558-I562 HydrophobicContact CG1-CD1 3.86Å; V558-I562 HydrophobicContact CG1-CG1 4.49Å; V558-I562 WeakPolarHBondContact O-CG1 3.27Å; V558-I562 PolarHBondContact O-N 3.06Å; I559-I562 PolarHBondContact O-N 3.15Å; I560-I562 PolarHBondContact O-N 3.39Å; I562-K570 HydrophobicContact CG2-CD 4.11Å; I562-K570 VanDerWaalsContact O-CE 3.22Å; I562-K570 WeakPolarHBondContact O-CE 3.45Å
563	R	74.4	Confident	73.2	Confident	118 Å²	118	49 Å²	49	45%	0.445	26%	0.258	S	S	.	.	H	α-helix	trans	-84.5	-16.6	-178.6	-72	-178.3	174.4	169.2	-3.9	114.2	L415 I559 I560 L561	L415-R563 PolarHBondContact O-NH1 3.25Å; I559-R563 HydrophobicContact CG2-CG 4.46Å; I559-R563 WeakPolarHBondContact O-CB 3.43Å; I559-R563 WeakPolarHBondContact O-CG 3.25Å; I559-R563 PolarHBondContact O-N 2.95Å; I560-R563 PolarHBondContact O-N 2.61Å; L561-R563 VanDerWaalsContact C-N 3.29Å; L561-R563 PolarHBondContact O-N 2.73Å
564	T	71.5	Confident	72.5	Confident	14 Å²	14	51 Å²	51	9%	0.086	27%	0.269	C	S	.	.	H	α-helix	trans	-93.4	-10.1	-178.9	50.6	0	0	0	0	113.4	V350 I560 L561 L648	V350-T564 HydrophobicContact CG1-CG2 3.84Å; I560-T564 HydrophobicContact CG2-CG2 4.03Å; I560-T564 WeakPolarHBondContact O-CB 3.3Å; I560-T564 WeakPolarHBondContact O-CG2 3.39Å; I560-T564 PolarHBondContact O-N 3.45Å; I560-T564 PolarHBondContact O-OG1 2.85Å; L561-T564 PolarHBondContact O-N 3.33Å; L561-T564 PolarHBondContact O-OG1 3.14Å; L561-T564 VanDerWaalsContact O-OG1 3.08Å; T564-L648 HydrophobicContact CG2-CD1 4.5Å
565	V	71.4	Confident	71.8	Confident	7 Å²	7	48.6 Å²	48.6	4%	0.042	27%	0.268	C	S	.	.	S	Bend	trans	-111.2	141.6	-178.8	-179.4	0	0	0	0	110.1	L345 F351 L561 L569 A573	L345-V565 HydrophobicContact CD1-CG1 4.48Å; F351-V565 HydrophobicContact CD2-CG2 3.61Å; F351-V565 HydrophobicContact CE2-CG2 3.77Å; L561-V565 WeakPolarHBondContact O-CG2 3.34Å; L561-V565 PolarHBondContact O-N 2.95Å; V565-L569 HydrophobicContact CG1-CB 3.59Å; V565-A573 HydrophobicContact CB-CB 4.34Å; V565-A573 HydrophobicContact CG1-CB 3.88Å; V565-A573 HydrophobicContact CG2-CB 3.96Å
566	S	68.4	Low	71.7	Confident	53 Å²	53	47.5 Å²	47.5	37%	0.371	26%	0.261	S	S	.	.			trans	-57.9	146.2	177.2	60.4	0	0	0	0	111.3	E568 L569 K570	S566-E568 PolarHBondContact O-N 3.39Å; S566-L569 PolarHBondContact O-N 3.34Å; S566-L569 WeakPolarHBondContact OG-CD1 3.49Å; S566-L569 WeakPolarHBondContact OG-CG 3.29Å; S566-K570 PolarHBondContact O-N 3.45Å
567	P	59.9	Low	71.7	Confident	84 Å²	84	48.1 Å²	48.1	55%	0.545	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52	-33.5	-177.3	-26.5	34	0	0	0	114.6	L569	P567-L569 VanDerWaalsContact C-N 3.34Å
568	E	58	Low	71.6	Confident	151 Å²	151	51.1 Å²	51.1	71%	0.706	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-25.1	-178.3	-62.8	170.3	-169.4	0	0	112.8	S566	S566-E568 PolarHBondContact O-N 3.39Å
569	L	64.9	Low	71.9	Confident	59 Å²	59	50.7 Å²	50.7	31%	0.309	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.4	-2.1	-177.5	-64	177.1	0	0	0	113.7	V565 S566 P567 S571 Y572 A573	V565-L569 HydrophobicContact CG1-CB 3.59Å; S566-L569 PolarHBondContact O-N 3.34Å; S566-L569 WeakPolarHBondContact OG-CD1 3.49Å; S566-L569 WeakPolarHBondContact OG-CG 3.29Å; P567-L569 VanDerWaalsContact C-N 3.34Å; L569-S571 PolarHBondContact O-N 2.94Å; L569-Y572 PolarHBondContact O-N 2.97Å; L569-A573 WeakPolarHBondContact O-CB 3.48Å; L569-A573 PolarHBondContact O-N 3.16Å
570	K	65.9	Low	72.3	Confident	66 Å²	66	50.1 Å²	50.1	29%	0.287	27%	0.269	S	S	.	.	H	α-helix	trans	-55.3	-49.7	-174.9	-77	174.7	-178.6	171.5	0	113.7	I562 S566 Y572 A573 L574	I562-K570 HydrophobicContact CG2-CD 4.11Å; I562-K570 VanDerWaalsContact O-CE 3.22Å; I562-K570 WeakPolarHBondContact O-CE 3.45Å; S566-K570 PolarHBondContact O-N 3.45Å; K570-Y572 VanDerWaalsContact C-N 3.31Å; K570-Y572 PolarHBondContact O-N 3.43Å; K570-A573 PolarHBondContact O-N 3.29Å; K570-L574 WeakPolarHBondContact O-CG 3.38Å; K570-L574 PolarHBondContact O-N 2.9Å
571	S	63.7	Low	72.7	Confident	102 Å²	102	51 Å²	51	71%	0.713	27%	0.273	S	S	*	.	H	α-helix	trans	-66.8	-36.2	-178.2	-53	0	0	0	0	111.8	L569 G575	L569-S571 PolarHBondContact O-N 2.94Å; S571-G575 PolarHBondContact O-N 3.02Å
572	Y	68.8	Low	73.2	Confident	68 Å²	68	51.9 Å²	51.9	27%	0.267	28%	0.276	S	S	.	.	H	α-helix	trans	-68.2	-43.7	175.4	-179	-102.4	0	0	0	111.8	I338 V341 T342 L345 L569 K570 L574 G575 V576	I338-Y572 PolarHBondContact O-OH 3.5Å; V341-Y572 HydrophobicContact CB-CE1 4.29Å; V341-Y572 HydrophobicContact CG1-CD1 4.13Å; V341-Y572 HydrophobicContact CG1-CE1 3.57Å; T342-Y572 WeakPolarHBondContact CA-OH 3.07Å; T342-Y572 PolarHBondContact N-OH 3.1Å; T342-Y572 VanDerWaalsContact N-OH 3.1Å; T342-Y572 PolarHBondContact OG1-OH 3.26Å; L345-Y572 HydrophobicContact CD2-CD1 3.97Å; L345-Y572 HydrophobicContact CD2-CE1 4.08Å; L569-Y572 PolarHBondContact O-N 2.97Å; K570-Y572 VanDerWaalsContact C-N 3.31Å; K570-Y572 PolarHBondContact O-N 3.43Å; Y572-L574 PolarHBondContact O-N 3.02Å; Y572-G575 WeakPolarHBondContact O-CA 3.37Å; Y572-G575 PolarHBondContact O-N 2.92Å; Y572-G575 VanDerWaalsContact O-N 3.08Å; Y572-V576 HydrophobicContact CD1-CG2 4.33Å; Y572-V576 HydrophobicContact CE1-CG2 3.96Å; Y572-V576 PolarHBondContact O-N 2.89Å
573	A	70.6	Confident	74	Confident	1 Å²	1	52.9 Å²	52.9	1%	0.008	28%	0.282	C	S	.	.	H	α-helix	trans	-59.9	-41.4	175	0	0	0	0	0	113.2	L345 F351 V565 L569 K570 G575 V576 L577	L345-A573 HydrophobicContact CD2-CB 4.06Å; F351-A573 HydrophobicContact CE2-CB 3.63Å; F351-A573 HydrophobicContact CZ-CB 3.89Å; V565-A573 HydrophobicContact CB-CB 4.34Å; V565-A573 HydrophobicContact CG1-CB 3.88Å; V565-A573 HydrophobicContact CG2-CB 3.96Å; L569-A573 WeakPolarHBondContact O-CB 3.48Å; L569-A573 PolarHBondContact O-N 3.16Å; K570-A573 PolarHBondContact O-N 3.29Å; A573-G575 VanDerWaalsContact C-N 3.33Å; A573-V576 PolarHBondContact O-N 3.43Å; A573-L577 PolarHBondContact O-N 3.39Å
574	L	71.6	Confident	74.9	Confident	48 Å²	48	50.2 Å²	50.2	25%	0.251	28%	0.276	S	S	.	.	H	α-helix	trans	-63.6	-39.1	172.2	-73.3	168.4	0	0	0	111.6	L561 K570 Y572 L577 F578	L561-L574 HydrophobicContact CD2-CD2 3.68Å; L561-L574 HydrophobicContact CD2-CG 4.35Å; K570-L574 WeakPolarHBondContact O-CG 3.38Å; K570-L574 PolarHBondContact O-N 2.9Å; Y572-L574 PolarHBondContact O-N 3.02Å; L574-L577 WeakPolarHBondContact O-CB 3.34Å; L574-L577 PolarHBondContact O-N 3.13Å; L574-F578 WeakPolarHBondContact O-CD2 3.47Å; L574-F578 PolarHBondContact O-N 3.1Å
575	G	71.4	Confident	75.8	Confident	39 Å²	39	49.6 Å²	49.6	40%	0.402	27%	0.272	S	S	.	.	H	α-helix	trans	-60.3	-44.1	173.1	0	0	0	0	0	113	S571 Y572 A573 F578 L579	S571-G575 PolarHBondContact O-N 3.02Å; Y572-G575 WeakPolarHBondContact O-CA 3.37Å; Y572-G575 PolarHBondContact O-N 2.92Å; Y572-G575 VanDerWaalsContact O-N 3.08Å; A573-G575 VanDerWaalsContact C-N 3.33Å; G575-F578 PolarHBondContact O-N 2.99Å; G575-L579 WeakPolarHBondContact O-CB 3.43Å; G575-L579 PolarHBondContact O-N 3.2Å
576	V	79.3	Confident	76.7	Confident	10 Å²	10	52.7 Å²	52.7	6%	0.061	29%	0.285	C	S	.	.	H	α-helix	trans	-64.3	-40.8	174.9	174.9	0	0	0	0	111.4	T342 L345 L346 F351 I355 Y572 A573 L579 L580	T342-V576 HydrophobicContact CG2-CG2 4.45Å; L345-V576 HydrophobicContact CD2-CG2 4.23Å; L346-V576 HydrophobicContact CD2-CG1 4.36Å; F351-V576 HydrophobicContact CE1-CG1 4.26Å; F351-V576 HydrophobicContact CZ-CG1 4.46Å; I355-V576 HydrophobicContact CD1-CG1 4.28Å; Y572-V576 HydrophobicContact CD1-CG2 4.33Å; Y572-V576 HydrophobicContact CE1-CG2 3.96Å; Y572-V576 PolarHBondContact O-N 2.89Å; A573-V576 PolarHBondContact O-N 3.43Å; V576-L579 PolarHBondContact O-N 3.24Å; V576-L580 HydrophobicContact CG1-CD1 3.94Å; V576-L580 HydrophobicContact CG1-CG 4.48Å; V576-L580 WeakPolarHBondContact O-CG 3.11Å; V576-L580 PolarHBondContact O-N 3.42Å
577	L	82.1	Confident	77.9	Confident	14 Å²	14	51.6 Å²	51.6	7%	0.073	28%	0.275	C	S	.	.	H	α-helix	trans	-56.7	-55.5	173.5	170.1	66.8	0	0	0	110.6	I355 A358 L561 A573 L574 L579 L580 L581	I355-L577 HydrophobicContact CB-CD1 4.44Å; I355-L577 HydrophobicContact CD1-CB 4.23Å; I355-L577 HydrophobicContact CG1-CB 4.44Å; I355-L577 HydrophobicContact CG1-CD1 4.05Å; I355-L577 HydrophobicContact CG2-CD1 4.12Å; A358-L577 HydrophobicContact CB-CD1 4.06Å; L561-L577 HydrophobicContact CD2-CB 4.2Å; L561-L577 HydrophobicContact CD2-CD2 3.78Å; A573-L577 PolarHBondContact O-N 3.39Å; L574-L577 WeakPolarHBondContact O-CB 3.34Å; L574-L577 PolarHBondContact O-N 3.13Å; L577-L579 VanDerWaalsContact C-N 3.29Å; L577-L579 PolarHBondContact O-N 3.25Å; L577-L580 PolarHBondContact O-N 3.43Å; L577-L580 VanDerWaalsContact O-N 3.16Å; L577-L581 HydrophobicContact CD1-CD1 3.92Å; L577-L581 HydrophobicContact CD1-CD2 4.09Å; L577-L581 HydrophobicContact CD1-CG 3.77Å; L577-L581 HydrophobicContact CD2-CD1 4.48Å; L577-L581 HydrophobicContact CG-CD1 3.92Å; L577-L581 HydrophobicContact CG-CG 4.14Å; L577-L581 WeakPolarHBondContact O-CB 3.3Å; L577-L581 VanDerWaalsContact O-CG 3.29Å; L577-L581 WeakPolarHBondContact O-CG 3.25Å; L577-L581 PolarHBondContact O-N 3.32Å
578	F	79.6	Confident	79.5	Confident	73 Å²	73	49.9 Å²	49.9	32%	0.32	26%	0.264	S	S	.	.	H	α-helix	trans	-61.9	-37.1	-177.9	-72.7	-60.4	0	0	0	112.9	F219 L574 G575 L581 R582	F219-F578 HydrophobicContact CZ-CZ 4.44Å; L574-F578 WeakPolarHBondContact O-CD2 3.47Å; L574-F578 PolarHBondContact O-N 3.1Å; G575-F578 PolarHBondContact O-N 2.99Å; F578-L581 HydrophobicContact CD1-CD1 4.3Å; F578-L581 PolarHBondContact O-N 2.82Å; F578-R582 WeakPolarHBondContact O-CG 3.33Å; F578-R582 PolarHBondContact O-N 3.39Å
579	L	82.8	Confident	81.2	Confident	49 Å²	49	43 Å²	43	26%	0.257	23%	0.232	S	C	.	.	H	α-helix	trans	-59.4	-49.3	174.1	-177	73.9	0	0	0	111.3	L90 I93 G575 V576 L577 R582 L583	L90-L579 HydrophobicContact CD2-CD1 3.72Å; I93-L579 HydrophobicContact CG2-CD1 4.08Å; G575-L579 WeakPolarHBondContact O-CB 3.43Å; G575-L579 PolarHBondContact O-N 3.2Å; V576-L579 PolarHBondContact O-N 3.24Å; L577-L579 VanDerWaalsContact C-N 3.29Å; L577-L579 PolarHBondContact O-N 3.25Å; L579-R582 PolarHBondContact O-N 2.87Å; L579-L583 WeakPolarHBondContact O-CB 3.33Å; L579-L583 PolarHBondContact O-N 2.92Å
580	L	86.8	Confident	82.5	Confident	29 Å²	29	40.5 Å²	40.5	15%	0.152	22%	0.219	C	C	.	.	H	α-helix	trans	-72	-32.3	-179.3	-71.1	175.2	0	0	0	112.7	L346 I355 C359 V576 L577 R582 L583 L584	L346-L580 HydrophobicContact CD2-CD1 4.09Å; I355-L580 HydrophobicContact CG2-CB 3.89Å; I355-L580 HydrophobicContact CG2-CD1 3.61Å; I355-L580 HydrophobicContact CG2-CG 4.4Å; C359-L580 VanDerWaalsContact SG-C 3.59Å; C359-L580 PolarHBondContact SG-O 2.92Å; C359-L580 VanDerWaalsContact SG-O 3.38Å; V576-L580 HydrophobicContact CG1-CD1 3.94Å; V576-L580 HydrophobicContact CG1-CG 4.48Å; V576-L580 WeakPolarHBondContact O-CG 3.11Å; V576-L580 PolarHBondContact O-N 3.42Å; L577-L580 PolarHBondContact O-N 3.43Å; L577-L580 VanDerWaalsContact O-N 3.16Å; L580-R582 VanDerWaalsContact C-N 3.34Å; L580-L583 PolarHBondContact O-N 3.28Å; L580-L584 HydrophobicContact CD2-CD1 4.32Å; L580-L584 WeakPolarHBondContact O-CB 3.42Å; L580-L584 PolarHBondContact O-N 3.25Å
581	L	86.7	Confident	83.9	Confident	18 Å²	18	40.5 Å²	40.5	9%	0.094	22%	0.222	C	C	.	.	I	π-helix	trans	-60.5	-44.7	171.4	-72.7	-177.6	0	0	0	110.8	A358 I362 L577 F578 G585 F586	A358-L581 HydrophobicContact CB-CD2 4.16Å; I362-L581 HydrophobicContact CB-CD2 4.07Å; I362-L581 HydrophobicContact CG1-CD1 4.48Å; I362-L581 HydrophobicContact CG1-CD2 3.74Å; L577-L581 HydrophobicContact CD1-CD1 3.92Å; L577-L581 HydrophobicContact CD1-CD2 4.09Å; L577-L581 HydrophobicContact CD1-CG 3.77Å; L577-L581 HydrophobicContact CD2-CD1 4.48Å; L577-L581 HydrophobicContact CG-CD1 3.92Å; L577-L581 HydrophobicContact CG-CG 4.14Å; L577-L581 WeakPolarHBondContact O-CB 3.3Å; L577-L581 VanDerWaalsContact O-CG 3.29Å; L577-L581 WeakPolarHBondContact O-CG 3.25Å; L577-L581 PolarHBondContact O-N 3.32Å; F578-L581 HydrophobicContact CD1-CD1 4.3Å; F578-L581 PolarHBondContact O-N 2.82Å; L581-G585 CarbonylContact O-C 3.34Å; L581-G585 WeakPolarHBondContact O-CA 3.46Å; L581-G585 PolarHBondContact O-N 3.23Å; L581-F586 HydrophobicContact CB-CE2 4.5Å; L581-F586 WeakPolarHBondContact O-CD2 3.43Å; L581-F586 PolarHBondContact O-N 3.46Å
582	R	87.8	Confident	85.3	Confident	23 Å²	23	40.1 Å²	40.1	9%	0.087	21%	0.211	C	C	.	.	I	π-helix	trans	-65.4	-48.3	175.9	-70.7	-173.7	172.2	149.3	3.7	112.3	E86 N89 L90 F578 L579 L580 F586 I587	E86-R582 WeakPolarHBondContact OE2-CD 3.33Å; E86-R582 WeakPolarHBondContact OE2-CG 3.47Å; E86-R582 IonicContact OE2-NE 3.14Å; E86-R582 PolarHBondContact OE2-NE 3.47Å; N89-R582 VanDerWaalsContact CG-CZ 3.48Å; N89-R582 VanDerWaalsContact CG-NH1 3.31Å; N89-R582 VanDerWaalsContact ND2-CZ 3.28Å; N89-R582 PolarHBondContact ND2-NH2 3.44Å; N89-R582 PolarHBondContact OD1-NH1 2.96Å; L90-R582 HydrophobicContact CD1-CB 4.42Å; L90-R582 HydrophobicContact CD2-CB 3.73Å; L90-R582 HydrophobicContact CG-CB 4.08Å; F578-R582 WeakPolarHBondContact O-CG 3.33Å; F578-R582 PolarHBondContact O-N 3.39Å; L579-R582 PolarHBondContact O-N 2.87Å; L580-R582 VanDerWaalsContact C-N 3.34Å; R582-F586 HydrophobicContact CG-CD2 4.49Å; R582-I587 PolarHBondContact O-N 3.29Å
583	L	89.6	Confident	86.6	Confident	84 Å²	84	37 Å²	37	44%	0.44	20%	0.199	S	C	.	.	I	π-helix	trans	-67.3	-42.8	-175.5	-175.7	65.6	0	0	0	113.5	L90 L579 L580 P588	L90-L583 HydrophobicContact CD1-CB 4.39Å; L90-L583 HydrophobicContact CD1-CD1 4.12Å; L579-L583 WeakPolarHBondContact O-CB 3.33Å; L579-L583 PolarHBondContact O-N 2.92Å; L580-L583 PolarHBondContact O-N 3.28Å; L583-P588 WeakPolarHBondContact O-CD 3.45Å
584	L	92.3	Very high	87.6	Confident	63 Å²	63	36.9 Å²	36.9	33%	0.33	20%	0.198	S	C	.	.	I	π-helix	trans	-107.7	-30.8	-173.2	-58.3	179.1	0	0	0	113.2	L356 C359 L580	L356-L584 HydrophobicContact CD2-CD1 4.09Å; C359-L584 HydrophobicContact CB-CB 4.19Å; L580-L584 HydrophobicContact CD2-CD1 4.32Å; L580-L584 WeakPolarHBondContact O-CB 3.42Å; L580-L584 PolarHBondContact O-N 3.25Å
585	G	91.2	Very high	88.7	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	21%	0.207	C	C	.	.	I	π-helix	trans	-93.4	-24.3	-174.2	0	0	0	0	0	114.7	A363 A366 L581 P589	A363-G585 VanDerWaalsContact CA-O 3.27Å; A363-G585 WeakPolarHBondContact CA-O 3.14Å; A366-G585 WeakPolarHBondContact CB-O 3.26Å; L581-G585 CarbonylContact O-C 3.34Å; L581-G585 WeakPolarHBondContact O-CA 3.46Å; L581-G585 PolarHBondContact O-N 3.23Å; G585-P589 WeakPolarHBondContact O-CG 3.08Å
586	F	90.6	Very high	89.8	Confident	73 Å²	73	35.7 Å²	35.7	32%	0.32	19%	0.193	S	C	.	.	I	π-helix	trans	-114.1	-32.8	-178.5	-71.5	-77.7	0	0	0	114.3	E86 I362 A366 L581 R582 P590	E86-F586 HydrophobicContact CG-CB 3.78Å; E86-F586 HydrophobicContact CG-CG 4.47Å; I362-F586 HydrophobicContact CG2-CD1 4.32Å; I362-F586 HydrophobicContact CG2-CD2 3.86Å; I362-F586 HydrophobicContact CG2-CE1 3.95Å; I362-F586 HydrophobicContact CG2-CE2 3.45Å; I362-F586 VanDerWaalsContact CG2-CE2 3.45Å; I362-F586 HydrophobicContact CG2-CG 4.28Å; I362-F586 HydrophobicContact CG2-CZ 3.5Å; I362-F586 VanDerWaalsContact CG2-CZ 3.5Å; A366-F586 HydrophobicContact CB-CD1 3.7Å; A366-F586 HydrophobicContact CB-CE1 4.14Å; L581-F586 HydrophobicContact CB-CE2 4.5Å; L581-F586 WeakPolarHBondContact O-CD2 3.43Å; L581-F586 PolarHBondContact O-N 3.46Å; R582-F586 HydrophobicContact CG-CD2 4.49Å; F586-P590 WeakPolarHBondContact O-CD 3.39Å; F586-P590 WeakPolarHBondContact O-CG 3.38Å
587	I	91.9	Very high	90.5	Very high	30 Å²	30	35.3 Å²	35.3	15%	0.154	19%	0.19	C	C	.	.	S	Bend	trans	-79.7	-63.5	-177.5	-67.8	169	0	0	0	112.4	S83 E86 I87 L90 R582 P589 P590 L591	S83-I587 PolarHBondContact OG-O 2.96Å; E86-I587 HydrophobicContact CB-CD1 4.07Å; E86-I587 HydrophobicContact CB-CG1 3.7Å; I87-I587 HydrophobicContact CG1-CD1 3.97Å; I87-I587 HydrophobicContact CG1-CG1 4.43Å; L90-I587 HydrophobicContact CD1-CD1 3.35Å; L90-I587 HydrophobicContact CG-CD1 4.5Å; R582-I587 PolarHBondContact O-N 3.29Å; I587-P589 VanDerWaalsContact C-CD 3.43Å; I587-P590 WeakPolarHBondContact O-CD 3.43Å; I587-L591 HydrophobicContact CG2-CD1 4.47Å; I587-L591 WeakPolarHBondContact O-CD1 3.47Å
588	P	94.4	Very high	91	Very high	47 Å²	47	35.2 Å²	35.2	31%	0.305	19%	0.19	S	C	.	.	H	α-helix	trans	-57.5	-39.6	-177.5	-23.1	30.1	0	0	0	116	L583 L591 I592	L583-P588 WeakPolarHBondContact O-CD 3.45Å; P588-L591 PolarHBondContact O-N 2.96Å; P588-I592 HydrophobicContact CB-CD1 4.11Å; P588-I592 WeakPolarHBondContact O-CG1 3.05Å; P588-I592 PolarHBondContact O-N 2.91Å
589	P	94.3	Very high	91.7	Very high	6 Å²	6	35.8 Å²	35.8	4%	0.039	20%	0.203	C	C	.	.	H	α-helix	trans	-63.7	-49.3	-168.6	-24.3	36.1	0	0	0	114.4	A363 G585 I587 L591 I592 F593	A363-P589 HydrophobicContact CB-CB 4.18Å; A363-P589 HydrophobicContact CB-CG 3.4Å; A363-P589 VanDerWaalsContact O-CB 3.3Å; A363-P589 WeakPolarHBondContact O-CB 3.32Å; G585-P589 WeakPolarHBondContact O-CG 3.08Å; I587-P589 VanDerWaalsContact C-CD 3.43Å; P589-L591 PolarHBondContact O-N 3.44Å; P589-I592 PolarHBondContact O-N 2.91Å; P589-I592 VanDerWaalsContact O-N 3.14Å; P589-F593 HydrophobicContact CB-CD2 4.42Å; P589-F593 WeakPolarHBondContact O-CB 3.03Å; P589-F593 VanDerWaalsContact O-CD2 3.26Å; P589-F593 WeakPolarHBondContact O-CD2 3.46Å; P589-F593 PolarHBondContact O-N 2.77Å
590	P	92.1	Very high	92.2	Very high	7 Å²	7	33.8 Å²	33.8	5%	0.045	19%	0.193	C	C	.	.	H	α-helix	trans	-56.9	-35.6	175.6	-26	36.1	0	0	0	113.4	A370 F371 F586 I587 G594	A370-P590 HydrophobicContact CB-CB 4.2Å; A370-P590 HydrophobicContact CB-CG 4.29Å; F371-P590 HydrophobicContact CE2-CB 4.24Å; F371-P590 WeakPolarHBondContact CE2-O 3.28Å; F586-P590 WeakPolarHBondContact O-CD 3.39Å; F586-P590 WeakPolarHBondContact O-CG 3.38Å; I587-P590 WeakPolarHBondContact O-CD 3.43Å; P590-G594 PolarHBondContact O-N 2.9Å
591	L	93.6	Very high	92.5	Very high	67 Å²	67	33.4 Å²	33.4	35%	0.351	19%	0.192	S	C	.	.	H	α-helix	trans	-67.2	-45.2	175.7	-70.8	92.4	0	0	0	112	V80 S83 I587 P588 P589 G594 A595	V80-L591 HydrophobicContact CG2-CD2 4.04Å; V80-L591 HydrophobicContact CG2-CG 4.44Å; S83-L591 VanDerWaalsContact OG-CD1 3.22Å; S83-L591 WeakPolarHBondContact OG-CD1 3.45Å; I587-L591 HydrophobicContact CG2-CD1 4.47Å; I587-L591 WeakPolarHBondContact O-CD1 3.47Å; P588-L591 PolarHBondContact O-N 2.96Å; P589-L591 PolarHBondContact O-N 3.44Å; L591-G594 PolarHBondContact O-N 2.89Å; L591-A595 WeakPolarHBondContact O-CB 3.43Å; L591-A595 PolarHBondContact O-N 2.89Å
592	I	94.9	Very high	92.7	Very high	93 Å²	93	35.5 Å²	35.5	48%	0.477	20%	0.203	S	C	.	.	H	α-helix	trans	-64.9	-45.4	-179.7	-66.4	165.7	0	0	0	110.7	P588 P589 G596 I629	P588-I592 HydrophobicContact CB-CD1 4.11Å; P588-I592 WeakPolarHBondContact O-CG1 3.05Å; P588-I592 PolarHBondContact O-N 2.91Å; P589-I592 PolarHBondContact O-N 2.91Å; P589-I592 VanDerWaalsContact O-N 3.14Å; I592-G596 PolarHBondContact O-N 2.91Å; I592-I629 HydrophobicContact CG2-CD1 4.27Å; I592-I629 HydrophobicContact CG2-CG2 4.41Å
593	F	94.9	Very high	92.7	Very high	2 Å²	2	35.9 Å²	35.9	1%	0.009	21%	0.205	C	C	.	.	H	α-helix	trans	-64.9	-44.5	177.4	-84.7	-97.2	0	0	0	111.1	F368 F371 P589 G596 I597 Y626 I629 A630 L633	F368-F593 AromaticContact CD2-CE1 3.71Å; F368-F593 HydrophobicContact CD2-CE1 3.71Å; F368-F593 AromaticContact CD2-CZ 3.85Å; F368-F593 HydrophobicContact CD2-CZ 3.85Å; F368-F593 AromaticContact CE2-CE1 3.67Å; F368-F593 HydrophobicContact CE2-CE1 3.67Å; F368-F593 AromaticContact CE2-CZ 3.98Å; F368-F593 HydrophobicContact CE2-CZ 3.98Å; F371-F593 HydrophobicContact CD2-CB 3.9Å; F371-F593 HydrophobicContact CE2-CB 4.14Å; P589-F593 HydrophobicContact CB-CD2 4.42Å; P589-F593 WeakPolarHBondContact O-CB 3.03Å; P589-F593 VanDerWaalsContact O-CD2 3.26Å; P589-F593 WeakPolarHBondContact O-CD2 3.46Å; P589-F593 PolarHBondContact O-N 2.77Å; F593-G596 PolarHBondContact O-N 3.06Å; F593-I597 WeakPolarHBondContact O-CG1 3.27Å; F593-I597 PolarHBondContact O-N 3.45Å; F593-Y626 AromaticContact CD1-CD2 3.48Å; F593-Y626 HydrophobicContact CD1-CD2 3.48Å; F593-Y626 VanDerWaalsContact CD1-CD2 3.48Å; F593-Y626 AromaticContact CD1-CE2 3.4Å; F593-Y626 HydrophobicContact CD1-CE2 3.4Å; F593-Y626 HydrophobicContact CD1-CG 4.37Å; F593-Y626 AromaticContact CE1-CD2 3.9Å; F593-Y626 HydrophobicContact CE1-CD2 3.9Å; F593-Y626 AromaticContact CE1-CE2 3.87Å; F593-Y626 HydrophobicContact CE1-CE2 3.87Å; F593-Y626 HydrophobicContact CE1-CG 4.39Å; F593-Y626 WeakPolarHBondContact CE1-O 3.21Å; F593-Y626 HydrophobicContact CG-CE2 4.48Å; F593-I629 HydrophobicContact CD2-CG2 4.03Å; F593-I629 HydrophobicContact CE1-CB 4.28Å; F593-I629 HydrophobicContact CE1-CG2 4.23Å; F593-I629 HydrophobicContact CE2-CB 4.33Å; F593-I629 HydrophobicContact CE2-CG2 3.42Å; F593-I629 VanDerWaalsContact CE2-CG2 3.42Å; F593-I629 HydrophobicContact CZ-CB 3.99Å; F593-I629 HydrophobicContact CZ-CG2 3.54Å; F593-A630 HydrophobicContact CZ-CB 4.4Å; F593-L633 HydrophobicContact CE2-CD1 4.25Å
594	G	92.4	Very high	92.5	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-58.7	-51.8	176.3	0	0	0	0	0	112.7	S75 P590 L591 G596 I597 D598	S75-G594 WeakPolarHBondContact CB-O 3.38Å; P590-G594 PolarHBondContact O-N 2.9Å; L591-G594 PolarHBondContact O-N 2.89Å; G594-G596 VanDerWaalsContact C-N 3.26Å; G594-G596 PolarHBondContact O-N 2.04Å; G594-I597 WeakPolarHBondContact O-CB 3.47Å; G594-I597 PolarHBondContact O-N 3.09Å; G594-I597 VanDerWaalsContact O-N 3.1Å; G594-D598 PolarHBondContact O-N 3.01Å
595	A	93.1	Very high	91.9	Very high	53 Å²	53	32 Å²	32	44%	0.438	18%	0.181	S	C	.	.	H	α-helix	trans	-61.1	-36	176.4	0	0	0	0	0	112.5	L591 S599	L591-A595 WeakPolarHBondContact O-CB 3.43Å; L591-A595 PolarHBondContact O-N 2.89Å; A595-S599 PolarHBondContact O-N 3.48Å; A595-S599 VanDerWaalsContact O-N 3.1Å
596	G	94.7	Very high	90.8	Very high	9 Å²	9	35 Å²	35	9%	0.093	20%	0.2	C	C	.	.	H	α-helix	trans	-60.6	-44.4	172.9	0	0	0	0	0	112.8	I592 F593 G594 S599 L625	I592-G596 PolarHBondContact O-N 2.91Å; F593-G596 PolarHBondContact O-N 3.06Å; G594-G596 VanDerWaalsContact C-N 3.26Å; G594-G596 PolarHBondContact O-N 2.04Å; G596-S599 PolarHBondContact O-N 3.28Å; G596-S599 PolarHBondContact O-OG 3.45Å; G596-L625 VanDerWaalsContact CA-CD2 3.41Å
597	I	93.9	Very high	89.5	Confident	1 Å²	1	34.4 Å²	34.4	1%	0.005	20%	0.197	C	C	.	.	H	α-helix	trans	-62.8	-49.4	177.5	-65.6	164.4	0	0	0	110.5	F371 F593 G594 S599 T600 Y617 Y622 Y626	F371-I597 HydrophobicContact CB-CD1 3.63Å; F371-I597 HydrophobicContact CD1-CD1 3.7Å; F371-I597 HydrophobicContact CD2-CD1 4.13Å; F371-I597 HydrophobicContact CE1-CD1 4.39Å; F371-I597 HydrophobicContact CG-CD1 3.54Å; F593-I597 WeakPolarHBondContact O-CG1 3.27Å; F593-I597 PolarHBondContact O-N 3.45Å; G594-I597 WeakPolarHBondContact O-CB 3.47Å; G594-I597 PolarHBondContact O-N 3.09Å; G594-I597 VanDerWaalsContact O-N 3.1Å; I597-S599 PolarHBondContact O-N 3.06Å; I597-T600 PolarHBondContact O-N 3.03Å; I597-T600 PolarHBondContact O-OG1 3.21Å; I597-Y617 HydrophobicContact CG2-CD1 4.09Å; I597-Y617 HydrophobicContact CG2-CE1 3.55Å; I597-Y622 HydrophobicContact CB-CE2 4.36Å; I597-Y622 HydrophobicContact CD1-CE2 4.11Å; I597-Y622 WeakPolarHBondContact CD1-OH 3.29Å; I597-Y622 HydrophobicContact CG1-CD2 4.21Å; I597-Y622 HydrophobicContact CG1-CE2 3.48Å; I597-Y622 VanDerWaalsContact CG1-CE2 3.48Å; I597-Y622 HydrophobicContact CG2-CE1 3.91Å; I597-Y622 HydrophobicContact CG2-CE2 4.26Å; I597-Y626 HydrophobicContact CD1-CD2 4.42Å; I597-Y626 HydrophobicContact CD1-CE2 4.4Å; I597-Y626 HydrophobicContact CG1-CD2 4.45Å
598	D	93.1	Very high	88.3	Confident	13 Å²	13	35.5 Å²	35.5	7%	0.07	21%	0.207	C	C	.	.	H	α-helix	trans	-59	-34.6	-179.8	-73.7	-23.1	0	0	0	112.5	S75 A76 G594 T600 C601 W604	S75-D598 WeakPolarHBondContact CA-OD2 3.26Å; S75-D598 VanDerWaalsContact CB-CG 3.49Å; S75-D598 WeakPolarHBondContact CB-OD1 3.45Å; S75-D598 WeakPolarHBondContact CB-OD2 3.41Å; S75-D598 PolarHBondContact N-OD1 2.63Å; S75-D598 PolarHBondContact N-OD2 3.13Å; S75-D598 PolarHBondContact OG-OD1 3.05Å; A76-D598 WeakPolarHBondContact CB-OD2 3.43Å; A76-D598 PolarHBondContact N-OD2 3.3Å; G594-D598 PolarHBondContact O-N 3.01Å; D598-T600 PolarHBondContact O-N 2.82Å; D598-T600 VanDerWaalsContact O-N 3.1Å; D598-C601 VanDerWaalsContact O-CB 3.3Å; D598-C601 WeakPolarHBondContact O-CB 3.32Å; D598-C601 PolarHBondContact O-N 3.34Å; D598-C601 VanDerWaalsContact O-N 3.14Å; D598-W604 HydrophobicContact CB-CH2 3.88Å; D598-W604 WeakPolarHBondContact O-CZ2 3.48Å
599	S	93.8	Very high	86.9	Confident	85 Å²	85	36.9 Å²	36.9	59%	0.594	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-15.2	177	77.5	0	0	0	0	114.6	A595 G596 I597	A595-S599 PolarHBondContact O-N 3.48Å; A595-S599 VanDerWaalsContact O-N 3.1Å; G596-S599 PolarHBondContact O-N 3.28Å; G596-S599 PolarHBondContact O-OG 3.45Å; I597-S599 PolarHBondContact O-N 3.06Å
600	T	94.7	Very high	85.7	Confident	7 Å²	7	42.8 Å²	42.8	4%	0.043	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.3	8.2	179.7	69.3	0	0	0	0	113.3	I597 D598 L602 D618 V621 L625	I597-T600 PolarHBondContact O-N 3.03Å; I597-T600 PolarHBondContact O-OG1 3.21Å; D598-T600 PolarHBondContact O-N 2.82Å; D598-T600 VanDerWaalsContact O-N 3.1Å; T600-L602 PolarHBondContact O-N 3.26Å; T600-D618 PolarHBondContact O-N 3.26Å; T600-V621 HydrophobicContact CG2-CB 4.2Å; T600-V621 HydrophobicContact CG2-CG1 3.72Å; T600-L625 HydrophobicContact CG2-CD1 4.34Å
601	C	92.6	Very high	85.1	Confident	21 Å²	21	47.9 Å²	47.9	14%	0.142	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	129.2	-179.8	-168.3	0	0	0	0	112.3	D598 F603 W604 C614	D598-C601 VanDerWaalsContact O-CB 3.3Å; D598-C601 WeakPolarHBondContact O-CB 3.32Å; D598-C601 PolarHBondContact O-N 3.34Å; D598-C601 VanDerWaalsContact O-N 3.14Å; C601-F603 PolarHBondContact SG-O 3.15Å; C601-W604 HydrophobicContact CB-CD2 4.12Å; C601-W604 VanDerWaalsContact CB-CE2 3.4Å; C601-W604 HydrophobicContact CB-CH2 4.1Å; C601-W604 HydrophobicContact CB-CZ2 3.4Å; C601-W604 VanDerWaalsContact CB-CZ2 3.4Å; C601-W604 VanDerWaalsContact SG-CD2 3.53Å; C601-C614 WeakPolarHBondContact CA-SG 3.39Å; C601-C614 HydrophobicContact CB-CB 3.64Å; C601-C614 WeakPolarHBondContact CB-SG 3.41Å; C601-C614 WeakPolarHBondContact SG-CB 3.28Å; C601-C614 CovalentContact SG-SG 2.01Å; C601-C614 PolarHBondContact SG-SG 3.44Å
602	L	90.5	Very high	84.4	Confident	62 Å²	62	44.8 Å²	44.8	33%	0.325	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	-34.6	171.4	-66.5	174.4	0	0	0	111.9	T445 V451 T452 T600 L616 D618	T445-L602 HydrophobicContact CG2-CD1 4.4Å; V451-L602 HydrophobicContact CG1-CB 3.81Å; T452-L602 HydrophobicContact CG2-CD1 3.8Å; T600-L602 PolarHBondContact O-N 3.26Å; L602-L616 HydrophobicContact CB-CD2 4.43Å; L602-L616 HydrophobicContact CB-CG 4.39Å; L602-L616 HydrophobicContact CD1-CG 4.46Å; L602-L616 PolarHBondContact N-O 2.04Å; L602-D618 HydrophobicContact CD1-CB 3.97Å; L602-D618 HydrophobicContact CD2-CB 4.13Å; L602-D618 HydrophobicContact CG-CB 3.96Å
603	F	87.5	Confident	83.9	Confident	30 Å²	30	40.7 Å²	40.7	13%	0.132	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	116	-178.3	-161.9	-102	0	0	0	111.5	V451 P467 T479 L494 C601 V615 L616	V451-F603 HydrophobicContact CG2-CD2 4.15Å; P467-F603 HydrophobicContact CG-CE2 3.76Å; P467-F603 HydrophobicContact CG-CZ 4.45Å; T479-F603 HydrophobicContact CG2-CZ 3.93Å; L494-F603 HydrophobicContact CD1-CE1 4.26Å; L494-F603 HydrophobicContact CD1-CE2 4.17Å; L494-F603 HydrophobicContact CD1-CZ 3.95Å; C601-F603 PolarHBondContact SG-O 3.15Å; F603-V615 HydrophobicContact CD1-CB 4.44Å; F603-V615 PolarHBondContact O-N 3.37Å; F603-L616 HydrophobicContact CB-CB 3.9Å; F603-L616 PolarHBondContact N-O 3.06Å; F603-L616 VanDerWaalsContact N-O 3.16Å; F603-L616 PolarHBondContact O-N 3.06Å
604	W	86.3	Confident	83.6	Confident	62 Å²	62	40.9 Å²	40.9	24%	0.235	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	139.4	177.6	-68.3	96.1	0	0	0	110.2	Q74 D598 C601 G612 C614	Q74-W604 HydrophobicContact CG-CZ3 4.06Å; D598-W604 HydrophobicContact CB-CH2 3.88Å; D598-W604 WeakPolarHBondContact O-CZ2 3.48Å; C601-W604 HydrophobicContact CB-CD2 4.12Å; C601-W604 VanDerWaalsContact CB-CE2 3.4Å; C601-W604 HydrophobicContact CB-CH2 4.1Å; C601-W604 HydrophobicContact CB-CZ2 3.4Å; C601-W604 VanDerWaalsContact CB-CZ2 3.4Å; C601-W604 VanDerWaalsContact SG-CD2 3.53Å; W604-G612 WeakPolarHBondContact CZ3-O 3.41Å; W604-C614 HydrophobicContact CD2-CB 4.24Å; W604-C614 HydrophobicContact CE3-CB 3.74Å; W604-C614 HydrophobicContact CH2-CB 4.06Å; W604-C614 HydrophobicContact CZ3-CB 3.65Å
605	S	78.5	Confident	83.1	Confident	5 Å²	5	42.3 Å²	42.3	4%	0.035	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	145.8	161.8	73.5	0	0	0	0	109.2	N72 G612 A613	N72-S605 VanDerWaalsContact CG-OG 3.24Å; N72-S605 PolarHBondContact ND2-OG 3.27Å; N72-S605 PolarHBondContact OD1-OG 3.18Å; S605-G612 PolarHBondContact O-N 3.43Å; S605-A613 WeakPolarHBondContact CB-O 3.11Å; S605-A613 PolarHBondContact N-O 3.3Å; S605-A613 PolarHBondContact OG-N 3.17Å; S605-A613 PolarHBondContact OG-O 2.96Å
606	T	69.6	Low	82.9	Confident	63 Å²	63	40 Å²	40	39%	0.387	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	124.3	173.9	51.8	0	0	0	0	108.7	E610	T606-E610 WeakPolarHBondContact CA-O 3.42Å
607	F	63.7	Low	82.8	Confident	59 Å²	59	39.6 Å²	39.6	26%	0.259	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	118.1	174.7	-169.7	-92.7	0	0	0	108.3	I166 G609 E610	I166-F607 HydrophobicContact CG2-CE1 4.26Å; I166-F607 HydrophobicContact CG2-CE2 3.71Å; I166-F607 HydrophobicContact CG2-CZ 3.44Å; I166-F607 VanDerWaalsContact CG2-CZ 3.44Å; F607-G609 VanDerWaalsContact C-N 3.32Å; F607-G609 PolarHBondContact O-N 2.73Å; F607-E610 PolarHBondContact N-O 3.36Å; F607-E610 PolarHBondContact O-N 2.69Å
608	C	65.4	Low	82.8	Confident	53 Å²	53	41.8 Å²	41.8	36%	0.358	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.1	37.4	-176.8	-70.2	0	0	0	0	114.9	C167 E610	C167-C608 WeakPolarHBondContact CA-SG 3.48Å; C167-C608 HydrophobicContact CB-CB 3.96Å; C167-C608 WeakPolarHBondContact CB-SG 3.39Å; C167-C608 PolarHBondContact N-SG 3.4Å; C167-C608 WeakPolarHBondContact SG-CB 3.31Å; C167-C608 CovalentContact SG-SG 2.03Å; C167-C608 PolarHBondContact SG-SG 2.85Å; C608-E610 PolarHBondContact O-N 3.44Å
609	G	64.9	Low	82.8	Confident	77 Å²	77	41.5 Å²	41.5	79%	0.794	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	75.8	-2.1	179.4	0	0	0	0	0	115.1	F607	F607-G609 VanDerWaalsContact C-N 3.32Å; F607-G609 PolarHBondContact O-N 2.73Å
610	E	70.3	Confident	82.8	Confident	129 Å²	129	39.7 Å²	39.7	60%	0.603	23%	0.226	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-103.9	151.1	176.5	-69.9	-70.5	158.1	0	0	111.2	T606 F607 C608	T606-E610 WeakPolarHBondContact CA-O 3.42Å; F607-E610 PolarHBondContact N-O 3.36Å; F607-E610 PolarHBondContact O-N 2.69Å; C608-E610 PolarHBondContact O-N 3.44Å
611	Q	78.9	Confident	82.8	Confident	115 Å²	115	42.7 Å²	42.7	54%	0.537	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	131.3	178	-69.8	-178	-25.1	0	0	111.2
612	G	78.9	Confident	82.9	Confident	1 Å²	1	41.7 Å²	41.7	1%	0.01	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	-143.3	179.9	0	0	0	0	0	113.7	N72 Q74 W604 S605	N72-G612 WeakPolarHBondContact O-CA 3.37Å; Q74-G612 WeakPolarHBondContact CG-O 3.35Å; W604-G612 WeakPolarHBondContact CZ3-O 3.41Å; S605-G612 PolarHBondContact O-N 3.43Å
613	A	84.2	Confident	83.1	Confident	7 Å²	7	39.5 Å²	39.5	6%	0.058	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	144.4	174.2	0	0	0	0	0	111.1	E68 N72 L73 S605	E68-A613 HydrophobicContact CG-CB 4.2Å; N72-A613 PolarHBondContact O-N 2.78Å; N72-A613 VanDerWaalsContact OD1-CB 3.27Å; N72-A613 WeakPolarHBondContact OD1-CB 3.19Å; N72-A613 PolarHBondContact OD1-N 2.93Å; L73-A613 VanDerWaalsContact O-CA 3.3Å; L73-A613 WeakPolarHBondContact O-CA 3.49Å; L73-A613 VanDerWaalsContact O-CB 3.22Å; L73-A613 WeakPolarHBondContact O-CB 3.45Å; S605-A613 WeakPolarHBondContact CB-O 3.11Å; S605-A613 PolarHBondContact N-O 3.3Å; S605-A613 PolarHBondContact OG-N 3.17Å; S605-A613 PolarHBondContact OG-O 2.96Å
614	C	88.4	Confident	83.5	Confident	6 Å²	6	43 Å²	43	4%	0.041	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	128.9	172.2	176.7	0	0	0	0	110.8	C601 W604 L616 Y617	C601-C614 WeakPolarHBondContact CA-SG 3.39Å; C601-C614 HydrophobicContact CB-CB 3.64Å; C601-C614 WeakPolarHBondContact CB-SG 3.41Å; C601-C614 WeakPolarHBondContact SG-CB 3.28Å; C601-C614 CovalentContact SG-SG 2.01Å; C601-C614 PolarHBondContact SG-SG 3.44Å; W604-C614 HydrophobicContact CD2-CB 4.24Å; W604-C614 HydrophobicContact CE3-CB 3.74Å; W604-C614 HydrophobicContact CH2-CB 4.06Å; W604-C614 HydrophobicContact CZ3-CB 3.65Å; C614-L616 PolarHBondContact SG-O 3.41Å; C614-Y617 HydrophobicContact CB-CD1 4.47Å; C614-Y617 HydrophobicContact CB-CE1 3.65Å; C614-Y617 HydrophobicContact CB-CE2 4.11Å; C614-Y617 VanDerWaalsContact CB-CZ 3.43Å; C614-Y617 VanDerWaalsContact CB-OH 3.3Å; C614-Y617 WeakPolarHBondContact CB-OH 3.48Å; C614-Y617 VanDerWaalsContact O-CE2 3.26Å; C614-Y617 WeakPolarHBondContact O-CE2 3.46Å; C614-Y617 PolarHBondContact O-OH 3.42Å; C614-Y617 VanDerWaalsContact O-OH 3.11Å; C614-Y617 VanDerWaalsContact SG-CE1 3.5Å; C614-Y617 VanDerWaalsContact SG-CZ 3.55Å
615	V	83.1	Confident	83.9	Confident	31 Å²	31	42.3 Å²	42.3	19%	0.188	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	-38	-171.3	172.2	0	0	0	0	111.5	F482 F603	F482-V615 HydrophobicContact CB-CB 4.5Å; F482-V615 HydrophobicContact CB-CG1 3.17Å; F482-V615 HydrophobicContact CD1-CG1 3.21Å; F482-V615 HydrophobicContact CD2-CG1 3.49Å; F482-V615 VanDerWaalsContact CD2-CG1 3.49Å; F482-V615 HydrophobicContact CE1-CG1 3.85Å; F482-V615 HydrophobicContact CE2-CG1 4.09Å; F482-V615 HydrophobicContact CG-CB 4.49Å; F482-V615 HydrophobicContact CG-CG1 2.99Å; F482-V615 HydrophobicContact CZ-CG1 4.25Å; F603-V615 HydrophobicContact CD1-CB 4.44Å; F603-V615 PolarHBondContact O-N 3.37Å
616	L	88.4	Confident	84.7	Confident	3 Å²	3	42.2 Å²	42.2	2%	0.016	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	127.1	-179.2	-176.1	67.4	0	0	0	110	T445 V448 V451 F482 L602 F603 C614	T445-L616 HydrophobicContact CG2-CD1 3.77Å; T445-L616 HydrophobicContact CG2-CG 4.31Å; V448-L616 HydrophobicContact CB-CD2 4.2Å; V448-L616 HydrophobicContact CG1-CD2 3.93Å; V448-L616 HydrophobicContact CG2-CD2 3.94Å; V451-L616 HydrophobicContact CB-CD2 4.46Å; V451-L616 HydrophobicContact CG1-CD2 4.03Å; F482-L616 HydrophobicContact CZ-CD1 4.43Å; L602-L616 HydrophobicContact CB-CD2 4.43Å; L602-L616 HydrophobicContact CB-CG 4.39Å; L602-L616 HydrophobicContact CD1-CG 4.46Å; L602-L616 PolarHBondContact N-O 2.04Å; F603-L616 HydrophobicContact CB-CB 3.9Å; F603-L616 PolarHBondContact N-O 3.06Å; F603-L616 VanDerWaalsContact N-O 3.16Å; F603-L616 PolarHBondContact O-N 3.06Å; C614-L616 PolarHBondContact SG-O 3.41Å
617	Y	92.1	Very high	85.9	Confident	1 Å²	1	39.2 Å²	39.2	0%	0.004	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	152.9	179.6	-60.1	-95.4	0	0	0	110.9	K374 Q378 T445 I597 C614 N619 Y622	K374-Y617 WeakPolarHBondContact CE-OH 3.35Å; K374-Y617 PolarHBondContact NZ-OH 3.25Å; Q378-Y617 HydrophobicContact CG-CD2 4.12Å; Q378-Y617 HydrophobicContact CG-CE2 4.4Å; T445-Y617 WeakPolarHBondContact CG2-O 3.11Å; T445-Y617 PolarHBondContact OG1-O 3.12Å; I597-Y617 HydrophobicContact CG2-CD1 4.09Å; I597-Y617 HydrophobicContact CG2-CE1 3.55Å; C614-Y617 HydrophobicContact CB-CD1 4.47Å; C614-Y617 HydrophobicContact CB-CE1 3.65Å; C614-Y617 HydrophobicContact CB-CE2 4.11Å; C614-Y617 VanDerWaalsContact CB-CZ 3.43Å; C614-Y617 VanDerWaalsContact CB-OH 3.3Å; C614-Y617 WeakPolarHBondContact CB-OH 3.48Å; C614-Y617 VanDerWaalsContact O-CE2 3.26Å; C614-Y617 WeakPolarHBondContact O-CE2 3.46Å; C614-Y617 PolarHBondContact O-OH 3.42Å; C614-Y617 VanDerWaalsContact O-OH 3.11Å; C614-Y617 VanDerWaalsContact SG-CE1 3.5Å; C614-Y617 VanDerWaalsContact SG-CZ 3.55Å; Y617-N619 PolarHBondContact O-N 2.89Å; Y617-Y622 HydrophobicContact CD1-CD1 4.39Å; Y617-Y622 HydrophobicContact CG-CD1 4.24Å
618	D	93.9	Very high	87.5	Confident	47 Å²	47	39 Å²	39	25%	0.251	22%	0.224	S	C	.	.			trans	-75.6	102.1	161.6	-173.8	-37	0	0	0	108.3	T600 L602 V620 V621 Y622	T600-D618 PolarHBondContact O-N 3.26Å; L602-D618 HydrophobicContact CD1-CB 3.97Å; L602-D618 HydrophobicContact CD2-CB 4.13Å; L602-D618 HydrophobicContact CG-CB 3.96Å; D618-V620 PolarHBondContact O-N 3.25Å; D618-V620 WeakPolarHBondContact OD1-CA 2.92Å; D618-V620 WeakPolarHBondContact OD1-CB 3.39Å; D618-V620 PolarHBondContact OD1-N 2.9Å; D618-V621 HydrophobicContact CB-CB 4.22Å; D618-V621 HydrophobicContact CB-CG2 4.3Å; D618-V621 PolarHBondContact O-N 3.17Å; D618-V621 PolarHBondContact OD1-N 3.07Å; D618-V621 WeakPolarHBondContact OD2-CG2 3.1Å; D618-Y622 WeakPolarHBondContact O-CB 3.32Å; D618-Y622 PolarHBondContact O-N 2.94Å
619	N	92.9	Very high	88.9	Confident	7 Å²	7	38.2 Å²	38.2	4%	0.037	22%	0.216	C	C	.	.	H	α-helix	trans	-63.6	-29.2	-177.6	-78.5	-2.9	0	0	0	112.1	Q378 Q379 C443 T445 Y617 R623	Q378-N619 PolarHBondContact O-ND2 2.89Å; Q379-N619 PolarHBondContact NE2-O 3.12Å; C443-N619 VanDerWaalsContact O-CB 3.23Å; C443-N619 WeakPolarHBondContact O-CB 3.3Å; C443-N619 PolarHBondContact O-ND2 3.23Å; T445-N619 WeakPolarHBondContact OG1-CB 3.08Å; T445-N619 PolarHBondContact OG1-N 2.98Å; Y617-N619 PolarHBondContact O-N 2.89Å; N619-R623 VanDerWaalsContact O-CB 3.26Å; N619-R623 WeakPolarHBondContact O-CB 3.37Å; N619-R623 PolarHBondContact O-N 3.09Å
620	V	93.4	Very high	90.4	Very high	48 Å²	48	34.5 Å²	34.5	29%	0.291	18%	0.179	S	C	.	.	H	α-helix	trans	-70	-56.7	179.6	-177.4	0	0	0	0	108.4	D444 D618 Y622 R623 Y624	D444-V620 HydrophobicContact CB-CG2 4.14Å; D444-V620 WeakPolarHBondContact OD1-CG2 3.37Å; D618-V620 PolarHBondContact O-N 3.25Å; D618-V620 WeakPolarHBondContact OD1-CA 2.92Å; D618-V620 WeakPolarHBondContact OD1-CB 3.39Å; D618-V620 PolarHBondContact OD1-N 2.9Å; V620-Y622 VanDerWaalsContact C-N 3.29Å; V620-Y622 PolarHBondContact O-N 3.4Å; V620-R623 PolarHBondContact O-N 3.12Å; V620-Y624 HydrophobicContact CG1-CD2 3.82Å; V620-Y624 HydrophobicContact CG1-CE2 3.66Å; V620-Y624 WeakPolarHBondContact O-CD2 3.24Å; V620-Y624 PolarHBondContact O-N 2.84Å
621	V	95.1	Very high	91.6	Very high	69 Å²	69	29.7 Å²	29.7	42%	0.418	16%	0.157	S	C	.	.	H	α-helix	trans	-61.5	-40.8	-179.9	-176.8	0	0	0	0	110.8	T600 D618 Y624 L625	T600-V621 HydrophobicContact CG2-CB 4.2Å; T600-V621 HydrophobicContact CG2-CG1 3.72Å; D618-V621 HydrophobicContact CB-CB 4.22Å; D618-V621 HydrophobicContact CB-CG2 4.3Å; D618-V621 PolarHBondContact O-N 3.17Å; D618-V621 PolarHBondContact OD1-N 3.07Å; D618-V621 WeakPolarHBondContact OD2-CG2 3.1Å; V621-Y624 PolarHBondContact O-N 3.36Å; V621-L625 VanDerWaalsContact O-CB 3.26Å; V621-L625 WeakPolarHBondContact O-CB 3.32Å; V621-L625 PolarHBondContact O-N 2.8Å
622	Y	94.7	Very high	92.5	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-56.4	-53.5	174.7	-174	173.8	0	0	0	110.5	Y375 Q378 I597 Y617 D618 V620 Y624 L625 Y626	Y375-Y622 HydrophobicContact CD2-CD2 4.41Å; Y375-Y622 AromaticContact CD2-CE2 3.87Å; Y375-Y622 HydrophobicContact CD2-CE2 3.87Å; Q378-Y622 HydrophobicContact CB-CE1 4.12Å; Q378-Y622 HydrophobicContact CG-CE1 4.26Å; I597-Y622 HydrophobicContact CB-CE2 4.36Å; I597-Y622 HydrophobicContact CD1-CE2 4.11Å; I597-Y622 WeakPolarHBondContact CD1-OH 3.29Å; I597-Y622 HydrophobicContact CG1-CD2 4.21Å; I597-Y622 HydrophobicContact CG1-CE2 3.48Å; I597-Y622 VanDerWaalsContact CG1-CE2 3.48Å; I597-Y622 HydrophobicContact CG2-CE1 3.91Å; I597-Y622 HydrophobicContact CG2-CE2 4.26Å; Y617-Y622 HydrophobicContact CD1-CD1 4.39Å; Y617-Y622 HydrophobicContact CG-CD1 4.24Å; D618-Y622 WeakPolarHBondContact O-CB 3.32Å; D618-Y622 PolarHBondContact O-N 2.94Å; V620-Y622 VanDerWaalsContact C-N 3.29Å; V620-Y622 PolarHBondContact O-N 3.4Å; Y622-Y624 PolarHBondContact O-N 3.32Å; Y622-L625 PolarHBondContact O-N 3.01Å; Y622-Y626 AromaticContact CE2-CD2 3.94Å; Y622-Y626 HydrophobicContact CE2-CD2 3.94Å; Y622-Y626 HydrophobicContact CE2-CG 4.05Å; Y622-Y626 WeakPolarHBondContact O-CB 3.22Å; Y622-Y626 PolarHBondContact O-N 3.16Å
623	R	95.4	Very high	93.3	Very high	17 Å²	17	29 Å²	29	6%	0.064	16%	0.164	C	C	.	.	H	α-helix	trans	-55.8	-49.3	178.7	179.9	167.7	78	-131.7	3.6	112.3	Y375 F438 L439 G442 D444 N619 V620 V627	Y375-R623 WeakPolarHBondContact OH-CG 3.49Å; F438-R623 WeakPolarHBondContact O-CD 3.35Å; L439-R623 PolarHBondContact O-NE 2.92Å; G442-R623 VanDerWaalsContact CA-NH1 3.3Å; D444-R623 IonicContact OD1-NH1 3.66Å; D444-R623 IonicContact OD1-NH2 2.69Å; N619-R623 VanDerWaalsContact O-CB 3.26Å; N619-R623 WeakPolarHBondContact O-CB 3.37Å; N619-R623 PolarHBondContact O-N 3.09Å; V620-R623 PolarHBondContact O-N 3.12Å; R623-V627 WeakPolarHBondContact O-CB 3.28Å; R623-V627 VanDerWaalsContact O-CG2 3.31Å; R623-V627 WeakPolarHBondContact O-CG2 3.38Å; R623-V627 PolarHBondContact O-N 3.27Å; R623-V627 VanDerWaalsContact O-N 3.1Å
624	Y	95.6	Very high	93.8	Very high	102 Å²	102	28.9 Å²	28.9	40%	0.4	16%	0.163	S	C	.	.	H	α-helix	trans	-61.4	-47.8	179.5	-81	-77.8	0	0	0	111.8	L439 V620 V621 Y622 S628	L439-Y624 HydrophobicContact CB-CE1 4.22Å; L439-Y624 HydrophobicContact CD2-CD1 3.8Å; L439-Y624 HydrophobicContact CD2-CE1 4.33Å; L439-Y624 HydrophobicContact CD2-CG 4.49Å; V620-Y624 HydrophobicContact CG1-CD2 3.82Å; V620-Y624 HydrophobicContact CG1-CE2 3.66Å; V620-Y624 WeakPolarHBondContact O-CD2 3.24Å; V620-Y624 PolarHBondContact O-N 2.84Å; V621-Y624 PolarHBondContact O-N 3.36Å; Y622-Y624 PolarHBondContact O-N 3.32Å; Y624-S628 WeakPolarHBondContact O-CB 3.45Å; Y624-S628 PolarHBondContact O-N 3.18Å; Y624-S628 PolarHBondContact O-OG 2.73Å
625	L	95.1	Very high	94.2	Very high	49 Å²	49	30.9 Å²	30.9	26%	0.257	18%	0.177	S	C	.	.	H	α-helix	trans	-66.2	-49.7	-177.1	-169.7	151.4	0	0	0	111.3	G596 T600 V621 Y622 V627 S628 I629	G596-L625 VanDerWaalsContact CA-CD2 3.41Å; T600-L625 HydrophobicContact CG2-CD1 4.34Å; V621-L625 VanDerWaalsContact O-CB 3.26Å; V621-L625 WeakPolarHBondContact O-CB 3.32Å; V621-L625 PolarHBondContact O-N 2.8Å; Y622-L625 PolarHBondContact O-N 3.01Å; L625-V627 PolarHBondContact O-N 3.39Å; L625-S628 PolarHBondContact O-N 3.01Å; L625-I629 HydrophobicContact CD2-CD1 3.53Å; L625-I629 HydrophobicContact CD2-CG1 4.43Å; L625-I629 HydrophobicContact CG-CD1 4.43Å; L625-I629 VanDerWaalsContact O-CG1 3.31Å; L625-I629 WeakPolarHBondContact O-CG1 3.21Å; L625-I629 PolarHBondContact O-N 3.28Å
626	Y	94.7	Very high	94.9	Very high	2 Å²	2	34 Å²	34	1%	0.008	19%	0.188	C	C	.	.	H	α-helix	trans	-58.9	-47.7	-178.6	-173.1	-104.7	0	0	0	112.2	F368 F371 L372 Y375 F593 I597 Y622	F368-Y626 VanDerWaalsContact CA-OH 3.31Å; F368-Y626 WeakPolarHBondContact CA-OH 3.19Å; F368-Y626 AromaticContact CD1-CE1 3.8Å; F368-Y626 HydrophobicContact CD1-CE1 3.8Å; F368-Y626 HydrophobicContact CD2-CE1 4.24Å; F368-Y626 HydrophobicContact CE1-CD1 4.07Å; F368-Y626 AromaticContact CE1-CE1 3.48Å; F368-Y626 HydrophobicContact CE1-CE1 3.48Å; F368-Y626 VanDerWaalsContact CE1-CE1 3.48Å; F368-Y626 HydrophobicContact CE2-CD1 4.15Å; F368-Y626 AromaticContact CE2-CE1 3.88Å; F368-Y626 HydrophobicContact CE2-CE1 3.88Å; F368-Y626 HydrophobicContact CG-CE1 4.18Å; F368-Y626 AromaticContact CZ-CD1 3.72Å; F368-Y626 HydrophobicContact CZ-CD1 3.72Å; F368-Y626 AromaticContact CZ-CE1 3.52Å; F368-Y626 HydrophobicContact CZ-CE1 3.52Å; F368-Y626 PolarHBondContact O-OH 3.06Å; F371-Y626 HydrophobicContact CB-CE2 4.01Å; L372-Y626 PolarHBondContact N-OH 3.23Å; Y375-Y626 AromaticContact CD2-CD1 3.6Å; Y375-Y626 HydrophobicContact CD2-CD1 3.6Å; Y375-Y626 AromaticContact CD2-CE1 3.91Å; Y375-Y626 HydrophobicContact CD2-CE1 3.91Å; Y375-Y626 HydrophobicContact CD2-CG 4.07Å; Y375-Y626 AromaticContact CE2-CD1 3.83Å; Y375-Y626 HydrophobicContact CE2-CD1 3.83Å; Y375-Y626 HydrophobicContact CE2-CE1 4.45Å; Y375-Y626 HydrophobicContact CE2-CG 4.4Å; Y375-Y626 HydrophobicContact CG-CD1 4.2Å; Y375-Y626 HydrophobicContact CG-CE1 4.04Å; F593-Y626 AromaticContact CD1-CD2 3.48Å; F593-Y626 HydrophobicContact CD1-CD2 3.48Å; F593-Y626 VanDerWaalsContact CD1-CD2 3.48Å; F593-Y626 AromaticContact CD1-CE2 3.4Å; F593-Y626 HydrophobicContact CD1-CE2 3.4Å; F593-Y626 HydrophobicContact CD1-CG 4.37Å; F593-Y626 AromaticContact CE1-CD2 3.9Å; F593-Y626 HydrophobicContact CE1-CD2 3.9Å; F593-Y626 AromaticContact CE1-CE2 3.87Å; F593-Y626 HydrophobicContact CE1-CE2 3.87Å; F593-Y626 HydrophobicContact CE1-CG 4.39Å; F593-Y626 WeakPolarHBondContact CE1-O 3.21Å; F593-Y626 HydrophobicContact CG-CE2 4.48Å; I597-Y626 HydrophobicContact CD1-CD2 4.42Å; I597-Y626 HydrophobicContact CD1-CE2 4.4Å; I597-Y626 HydrophobicContact CG1-CD2 4.45Å; Y622-Y626 AromaticContact CE2-CD2 3.94Å; Y622-Y626 HydrophobicContact CE2-CD2 3.94Å; Y622-Y626 HydrophobicContact CE2-CG 4.05Å; Y622-Y626 WeakPolarHBondContact O-CB 3.22Å; Y622-Y626 PolarHBondContact O-N 3.16Å
627	V	95.8	Very high	95.2	Very high	1 Å²	1	33.9 Å²	33.9	1%	0.006	19%	0.187	C	C	.	.	H	α-helix	trans	-75	-36.9	-179.8	176.2	0	0	0	0	111.5	F368 Y435 F438 L439 R623 L625 I629 A630 I631	F368-V627 HydrophobicContact CZ-CG2 4.45Å; Y435-V627 WeakPolarHBondContact O-CG1 3.07Å; F438-V627 HydrophobicContact CB-CG1 4.05Å; F438-V627 HydrophobicContact CB-CG2 3.79Å; L439-V627 HydrophobicContact CD2-CB 3.65Å; L439-V627 HydrophobicContact CD2-CG1 3.61Å; L439-V627 HydrophobicContact CG-CB 4.4Å; L439-V627 HydrophobicContact CG-CG1 3.84Å; R623-V627 WeakPolarHBondContact O-CB 3.28Å; R623-V627 VanDerWaalsContact O-CG2 3.31Å; R623-V627 WeakPolarHBondContact O-CG2 3.38Å; R623-V627 PolarHBondContact O-N 3.27Å; R623-V627 VanDerWaalsContact O-N 3.1Å; L625-V627 PolarHBondContact O-N 3.39Å; V627-I629 PolarHBondContact O-N 3.5Å; V627-A630 PolarHBondContact O-N 2.89Å; V627-I631 HydrophobicContact CG1-CD1 3.77Å; V627-I631 HydrophobicContact CG1-CG1 4.29Å; V627-I631 WeakPolarHBondContact O-CG1 3.37Å; V627-I631 PolarHBondContact O-N 3.47Å
628	S	95.7	Very high	95.4	Very high	53 Å²	53	36.8 Å²	36.8	37%	0.371	20%	0.2	S	C	.	.	H	α-helix	trans	-65.7	-35.7	179.8	-63.5	0	0	0	0	112.7	Y624 L625 A630 I631 A632	Y624-S628 WeakPolarHBondContact O-CB 3.45Å; Y624-S628 PolarHBondContact O-N 3.18Å; Y624-S628 PolarHBondContact O-OG 2.73Å; L625-S628 PolarHBondContact O-N 3.01Å; S628-A630 VanDerWaalsContact C-N 3.31Å; S628-A630 PolarHBondContact O-N 3.28Å; S628-I631 PolarHBondContact O-N 3.47Å; S628-A632 WeakPolarHBondContact O-CB 3.29Å; S628-A632 PolarHBondContact O-N 2.98Å
629	I	95.9	Very high	95.5	Very high	37 Å²	37	39 Å²	39	19%	0.19	21%	0.211	C	C	.	.	H	α-helix	trans	-58.7	-45.4	173.1	-67.6	167.2	0	0	0	110.1	I592 F593 L625 V627 A632 L633	I592-I629 HydrophobicContact CG2-CD1 4.27Å; I592-I629 HydrophobicContact CG2-CG2 4.41Å; F593-I629 HydrophobicContact CD2-CG2 4.03Å; F593-I629 HydrophobicContact CE1-CB 4.28Å; F593-I629 HydrophobicContact CE1-CG2 4.23Å; F593-I629 HydrophobicContact CE2-CB 4.33Å; F593-I629 HydrophobicContact CE2-CG2 3.42Å; F593-I629 VanDerWaalsContact CE2-CG2 3.42Å; F593-I629 HydrophobicContact CZ-CB 3.99Å; F593-I629 HydrophobicContact CZ-CG2 3.54Å; L625-I629 HydrophobicContact CD2-CD1 3.53Å; L625-I629 HydrophobicContact CD2-CG1 4.43Å; L625-I629 HydrophobicContact CG-CD1 4.43Å; L625-I629 VanDerWaalsContact O-CG1 3.31Å; L625-I629 WeakPolarHBondContact O-CG1 3.21Å; L625-I629 PolarHBondContact O-N 3.28Å; V627-I629 PolarHBondContact O-N 3.5Å; I629-A632 PolarHBondContact O-N 3.38Å; I629-L633 HydrophobicContact CG2-CD1 4.15Å; I629-L633 WeakPolarHBondContact O-CG 3.46Å; I629-L633 PolarHBondContact O-N 3.36Å
630	A	95.3	Very high	95.6	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-65.9	-41.5	176.4	0	0	0	0	0	113.3	V364 F368 Y435 F593 V627 S628 A632 L633 K634	V364-A630 HydrophobicContact CG1-CB 3.84Å; V364-A630 HydrophobicContact CG2-CB 4.38Å; F368-A630 HydrophobicContact CD2-CB 3.87Å; F368-A630 HydrophobicContact CE2-CB 3.21Å; F368-A630 HydrophobicContact CZ-CB 3.95Å; Y435-A630 HydrophobicContact CD1-CB 3.94Å; Y435-A630 HydrophobicContact CE1-CB 3.94Å; F593-A630 HydrophobicContact CZ-CB 4.4Å; V627-A630 PolarHBondContact O-N 2.89Å; S628-A630 VanDerWaalsContact C-N 3.31Å; S628-A630 PolarHBondContact O-N 3.28Å; A630-A632 VanDerWaalsContact C-N 3.29Å; A630-A632 PolarHBondContact O-N 3.41Å; A630-L633 PolarHBondContact O-N 2Å; A630-K634 WeakPolarHBondContact O-CB 3.04Å; A630-K634 VanDerWaalsContact O-CG 3.27Å; A630-K634 WeakPolarHBondContact O-CG 3.46Å; A630-K634 PolarHBondContact O-N 2.04Å
631	I	96.4	Very high	95.7	Very high	28 Å²	28	37.3 Å²	37.3	14%	0.144	20%	0.2	C	C	.	.	H	α-helix	trans	-60.7	-41.6	176.2	-67.5	165.8	0	0	0	110.4	T432 V436 L439 V627 S628 K634 S635	T432-I631 HydrophobicContact CG2-CG2 4.25Å; V436-I631 HydrophobicContact CB-CD1 4.48Å; V436-I631 HydrophobicContact CG2-CD1 3.84Å; V436-I631 HydrophobicContact CG2-CG1 4.37Å; L439-I631 HydrophobicContact CD1-CD1 3.92Å; L439-I631 HydrophobicContact CG-CD1 4.27Å; V627-I631 HydrophobicContact CG1-CD1 3.77Å; V627-I631 HydrophobicContact CG1-CG1 4.29Å; V627-I631 WeakPolarHBondContact O-CG1 3.37Å; V627-I631 PolarHBondContact O-N 3.47Å; S628-I631 PolarHBondContact O-N 3.47Å; I631-K634 PolarHBondContact O-N 3.23Å; I631-S635 VanDerWaalsContact O-CB 3.26Å; I631-S635 WeakPolarHBondContact O-CB 3.4Å; I631-S635 PolarHBondContact O-N 3.03Å; I631-S635 PolarHBondContact O-OG 2.96Å
632	A	96.9	Very high	95.6	Very high	61 Å²	61	35.4 Å²	35.4	50%	0.504	19%	0.188	S	C	.	.	H	α-helix	trans	-62.8	-47.7	177.5	0	0	0	0	0	111.6	S628 I629 A630 S635 F636	S628-A632 WeakPolarHBondContact O-CB 3.29Å; S628-A632 PolarHBondContact O-N 2.98Å; I629-A632 PolarHBondContact O-N 3.38Å; A630-A632 VanDerWaalsContact C-N 3.29Å; A630-A632 PolarHBondContact O-N 3.41Å; A632-S635 PolarHBondContact O-N 3.42Å; A632-F636 PolarHBondContact O-N 2.88Å
633	L	96.1	Very high	95.5	Very high	39 Å²	39	37.6 Å²	37.6	20%	0.204	20%	0.202	C	C	.	.	H	α-helix	trans	-62.3	-43.5	176.6	-69	172.5	0	0	0	111.9	M360 A363 V364 F593 I629 A630 F636 A637	M360-L633 HydrophobicContact SD-CD2 3.71Å; A363-L633 HydrophobicContact CB-CD1 4.1Å; V364-L633 HydrophobicContact CG2-CB 3.5Å; V364-L633 VanDerWaalsContact CG2-CB 3.5Å; V364-L633 HydrophobicContact CG2-CD1 4.02Å; V364-L633 HydrophobicContact CG2-CG 4.43Å; F593-L633 HydrophobicContact CE2-CD1 4.25Å; I629-L633 HydrophobicContact CG2-CD1 4.15Å; I629-L633 WeakPolarHBondContact O-CG 3.46Å; I629-L633 PolarHBondContact O-N 3.36Å; A630-L633 PolarHBondContact O-N 2Å; L633-F636 PolarHBondContact O-N 3.1Å; L633-A637 PolarHBondContact O-N 3.21Å
634	K	95.4	Very high	95.3	Very high	5 Å²	5	36.8 Å²	36.8	2%	0.022	20%	0.199	C	C	.	.	H	α-helix	trans	-62.1	-43.4	175	-75.7	-78.4	179	167.7	0	112.1	E361 V364 N428 S431 T432 A630 I631 F636 A637 F638	E361-K634 IonicContact OE1-NZ 3.28Å; E361-K634 WeakPolarHBondContact OE2-CE 3.38Å; E361-K634 IonicContact OE2-NZ 3.66Å; E361-K634 PolarHBondContact OE2-NZ 3Å; V364-K634 HydrophobicContact CG2-CD 4.5Å; V364-K634 HydrophobicContact CG2-CG 4.03Å; N428-K634 PolarHBondContact ND2-O 3.48Å; N428-K634 PolarHBondContact OD1-O 3.05Å; S431-K634 PolarHBondContact OG-NZ 2.8Å; S431-K634 VanDerWaalsContact OG-NZ 3.09Å; T432-K634 HydrophobicContact CG2-CB 4.26Å; T432-K634 WeakPolarHBondContact OG1-CB 2.99Å; A630-K634 WeakPolarHBondContact O-CB 3.04Å; A630-K634 VanDerWaalsContact O-CG 3.27Å; A630-K634 WeakPolarHBondContact O-CG 3.46Å; A630-K634 PolarHBondContact O-N 2.04Å; I631-K634 PolarHBondContact O-N 3.23Å; K634-F636 VanDerWaalsContact C-N 3.32Å; K634-F636 PolarHBondContact O-N 3.26Å; K634-A637 WeakPolarHBondContact O-CB 3.1Å; K634-A637 PolarHBondContact O-N 3.35Å; K634-F638 PolarHBondContact O-N 2.98Å
635	S	96.3	Very high	95.2	Very high	49 Å²	49	34.4 Å²	34.4	34%	0.343	19%	0.189	S	C	.	.	H	α-helix	trans	-63.6	-40.1	178	-60.8	0	0	0	0	111.1	I631 A632 F638 I639	I631-S635 VanDerWaalsContact O-CB 3.26Å; I631-S635 WeakPolarHBondContact O-CB 3.4Å; I631-S635 PolarHBondContact O-N 3.03Å; I631-S635 PolarHBondContact O-OG 2.96Å; A632-S635 PolarHBondContact O-N 3.42Å; S635-F638 WeakPolarHBondContact O-CB 3.48Å; S635-F638 PolarHBondContact O-N 3.11Å; S635-I639 WeakPolarHBondContact O-CG1 3.5Å; S635-I639 PolarHBondContact O-N 2.9Å
636	F	96.6	Very high	95	Very high	96 Å²	96	36.8 Å²	36.8	42%	0.421	20%	0.199	S	C	.	.	H	α-helix	trans	-65.3	-40.6	173.5	-171.7	-120	0	0	0	111.7	M360 A632 L633 K634 F638 I639 L640	M360-F636 HydrophobicContact CE-CD1 4.36Å; M360-F636 HydrophobicContact CE-CE1 4.28Å; M360-F636 HydrophobicContact CG-CD1 3.59Å; M360-F636 HydrophobicContact CG-CE1 4.18Å; M360-F636 HydrophobicContact SD-CD1 3.64Å; M360-F636 HydrophobicContact SD-CE1 4.16Å; A632-F636 PolarHBondContact O-N 2.88Å; L633-F636 PolarHBondContact O-N 3.1Å; K634-F636 VanDerWaalsContact C-N 3.32Å; K634-F636 PolarHBondContact O-N 3.26Å; F636-F638 VanDerWaalsContact C-N 3.33Å; F636-F638 PolarHBondContact O-N 3.26Å; F636-I639 PolarHBondContact O-N 3.1Å; F636-L640 HydrophobicContact CD1-CD1 3.94Å; F636-L640 HydrophobicContact CE1-CD1 3.68Å; F636-L640 HydrophobicContact CE1-CG 4.4Å; F636-L640 HydrophobicContact CZ-CD1 4.11Å; F636-L640 HydrophobicContact CZ-CD2 4.4Å; F636-L640 HydrophobicContact CZ-CG 4.39Å; F636-L640 WeakPolarHBondContact O-CG 3.04Å; F636-L640 PolarHBondContact O-N 3.09Å
637	A	95.5	Very high	94.8	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-59.4	-41.1	171.9	0	0	0	0	0	112.3	M360 E361 L633 K634 I639 L640 Y641	M360-A637 HydrophobicContact CB-CB 3.82Å; E361-A637 HydrophobicContact CG-CB 4.4Å; L633-A637 PolarHBondContact O-N 3.21Å; K634-A637 WeakPolarHBondContact O-CB 3.1Å; K634-A637 PolarHBondContact O-N 3.35Å; A637-I639 PolarHBondContact O-N 2.86Å; A637-L640 PolarHBondContact O-N 3.21Å; A637-Y641 HydrophobicContact CB-CE2 4.4Å; A637-Y641 WeakPolarHBondContact O-CD2 3.3Å; A637-Y641 PolarHBondContact O-N 2.85Å
638	F	96	Very high	94.3	Very high	63 Å²	63	38.1 Å²	38.1	28%	0.276	21%	0.209	S	C	.	.	H	α-helix	trans	-59.3	-46.2	174.7	-174.2	-104.3	0	0	0	112	M425 N428 L429 K634 S635 F636 L640 Y641 T642	M425-F638 HydrophobicContact CB-CE2 4.35Å; N428-F638 WeakPolarHBondContact OD1-CB 3.18Å; L429-F638 HydrophobicContact CB-CD2 4.39Å; L429-F638 HydrophobicContact CB-CE2 4.07Å; L429-F638 HydrophobicContact CD1-CE2 4.4Å; K634-F638 PolarHBondContact O-N 2.98Å; S635-F638 WeakPolarHBondContact O-CB 3.48Å; S635-F638 PolarHBondContact O-N 3.11Å; F636-F638 VanDerWaalsContact C-N 3.33Å; F636-F638 PolarHBondContact O-N 3.26Å; F638-L640 VanDerWaalsContact C-N 3.28Å; F638-L640 PolarHBondContact O-N 3.21Å; F638-Y641 PolarHBondContact O-N 2.95Å; F638-T642 HydrophobicContact CD1-CG2 3.9Å; F638-T642 HydrophobicContact CD2-CG2 4.48Å; F638-T642 HydrophobicContact CE1-CG2 3.57Å; F638-T642 HydrophobicContact CE2-CG2 4.18Å; F638-T642 HydrophobicContact CG-CG2 4.35Å; F638-T642 WeakPolarHBondContact O-CG2 3.31Å; F638-T642 HydrophobicContact CZ-CG2 3.72Å; F638-T642 PolarHBondContact O-OG1 3.08Å; F638-T642 PolarHBondContact O-N 3.23Å
639	I	96.7	Very high	93.9	Very high	94 Å²	94	42.9 Å²	42.9	48%	0.482	22%	0.218	S	C	.	.	H	α-helix	trans	-60.2	-40.4	176.6	-65.5	166	0	0	0	110.6	S635 F636 A637 T642 T643	S635-I639 WeakPolarHBondContact O-CG1 3.5Å; S635-I639 PolarHBondContact O-N 2.9Å; F636-I639 PolarHBondContact O-N 3.1Å; A637-I639 PolarHBondContact O-N 2.86Å; I639-T642 WeakPolarHBondContact CA-OG1 3.42Å; I639-T642 PolarHBondContact O-OG1 3.5Å; I639-T643 WeakPolarHBondContact O-CB 3.45Å; I639-T643 PolarHBondContact O-N 2.9Å; I639-T643 PolarHBondContact O-OG1 2.94Å
640	L	95.4	Very high	93.4	Very high	16 Å²	16	49.4 Å²	49.4	8%	0.084	25%	0.245	C	C	.	.	H	α-helix	trans	-68.6	-41.2	177.1	-67.4	169	0	0	0	112.4	C353 L356 A357 M360 F636 A637 F638 T643 T644	C353-L640 HydrophobicContact CB-CD2 4.44Å; L356-L640 HydrophobicContact CB-CD1 3.63Å; L356-L640 HydrophobicContact CB-CD2 4.38Å; A357-L640 HydrophobicContact CB-CB 3.81Å; A357-L640 HydrophobicContact CB-CD1 4.36Å; M360-L640 HydrophobicContact CG-CD1 4.35Å; F636-L640 HydrophobicContact CD1-CD1 3.94Å; F636-L640 HydrophobicContact CE1-CD1 3.68Å; F636-L640 HydrophobicContact CE1-CG 4.4Å; F636-L640 HydrophobicContact CZ-CD1 4.11Å; F636-L640 HydrophobicContact CZ-CD2 4.4Å; F636-L640 HydrophobicContact CZ-CG 4.39Å; F636-L640 WeakPolarHBondContact O-CG 3.04Å; F636-L640 PolarHBondContact O-N 3.09Å; A637-L640 PolarHBondContact O-N 3.21Å; F638-L640 VanDerWaalsContact C-N 3.28Å; F638-L640 PolarHBondContact O-N 3.21Å; L640-T643 PolarHBondContact O-N 3.2Å; L640-T644 WeakPolarHBondContact O-CB 3.41Å; L640-T644 PolarHBondContact O-N 3.36Å; L640-T644 PolarHBondContact O-OG1 2.99Å
641	Y	94.4	Very high	92.6	Very high	3 Å²	3	52.6 Å²	52.6	1%	0.012	26%	0.262	C	S	.	.	H	α-helix	trans	-64.9	-42.3	174.9	-73.1	-50.6	0	0	0	112.2	I354 A357 E361 I421 A424 N428 S557 A637 F638 T644 W645	I354-Y641 HydrophobicContact CD1-CD1 3.9Å; I354-Y641 HydrophobicContact CD1-CE1 3.66Å; A357-Y641 HydrophobicContact CB-CD1 3.84Å; A357-Y641 HydrophobicContact CB-CD2 4.38Å; A357-Y641 HydrophobicContact CB-CE1 3.63Å; A357-Y641 HydrophobicContact CB-CE2 4.18Å; A357-Y641 HydrophobicContact CB-CG 4.22Å; E361-Y641 HydrophobicContact CG-CE2 4.38Å; I421-Y641 HydrophobicContact CD1-CD1 3.53Å; I421-Y641 HydrophobicContact CD1-CE1 4.4Å; I421-Y641 HydrophobicContact CD1-CG 4.21Å; A424-Y641 HydrophobicContact CB-CD1 4.46Å; A424-Y641 HydrophobicContact CB-CE1 4.25Å; N428-Y641 HydrophobicContact CB-CD2 4.25Å; N428-Y641 HydrophobicContact CB-CE2 4.22Å; S557-Y641 PolarHBondContact OG-OH 3.36Å; S557-Y641 VanDerWaalsContact OG-OH 3.12Å; A637-Y641 HydrophobicContact CB-CE2 4.4Å; A637-Y641 WeakPolarHBondContact O-CD2 3.3Å; A637-Y641 PolarHBondContact O-N 2.85Å; F638-Y641 PolarHBondContact O-N 2.95Å; Y641-T644 WeakPolarHBondContact O-CB 2.91Å; Y641-T644 PolarHBondContact O-N 3.22Å; Y641-W645 PolarHBondContact O-N 3.24Å
642	T	94	Very high	91.2	Very high	28 Å²	28	56.3 Å²	56.3	17%	0.172	28%	0.275	C	S	.	.	H	α-helix	trans	-62.9	-43.3	176.5	59.3	0	0	0	0	111.1	M425 F638 I639 T644 W645 Q646	M425-T642 HydrophobicContact CE-CG2 3.45Å; M425-T642 VanDerWaalsContact CE-CG2 3.45Å; M425-T642 HydrophobicContact SD-CG2 4.43Å; F638-T642 HydrophobicContact CD1-CG2 3.9Å; F638-T642 HydrophobicContact CD2-CG2 4.48Å; F638-T642 HydrophobicContact CE1-CG2 3.57Å; F638-T642 HydrophobicContact CE2-CG2 4.18Å; F638-T642 HydrophobicContact CG-CG2 4.35Å; F638-T642 WeakPolarHBondContact O-CG2 3.31Å; F638-T642 HydrophobicContact CZ-CG2 3.72Å; F638-T642 PolarHBondContact O-OG1 3.08Å; F638-T642 PolarHBondContact O-N 3.23Å; I639-T642 WeakPolarHBondContact CA-OG1 3.42Å; I639-T642 PolarHBondContact O-OG1 3.5Å; T642-T644 VanDerWaalsContact C-N 3.33Å; T642-T644 PolarHBondContact O-N 3.41Å; T642-W645 PolarHBondContact O-N 3.15Å; T642-Q646 WeakPolarHBondContact O-CG 3.47Å; T642-Q646 PolarHBondContact O-N 2.98Å
643	T	93.1	Very high	89.5	Confident	47 Å²	47	60.9 Å²	60.9	29%	0.288	28%	0.284	S	S	.	.	H	α-helix	trans	-60.4	-44	174.7	-58.1	0	0	0	0	111	I639 L640 W645 Q646 C647	I639-T643 WeakPolarHBondContact O-CB 3.45Å; I639-T643 PolarHBondContact O-N 2.9Å; I639-T643 PolarHBondContact O-OG1 2.94Å; L640-T643 PolarHBondContact O-N 3.2Å; T643-W645 PolarHBondContact O-N 2.03Å; T643-Q646 PolarHBondContact O-N 2.98Å; T643-C647 PolarHBondContact O-N 3.49Å; T643-C647 PolarHBondContact O-SG 3Å; T643-C647 VanDerWaalsContact O-SG 3.39Å; T643-C647 WeakPolarHBondContact O-CB 3.41Å
644	T	91.3	Very high	88	Confident	0 Å²	0	68.1 Å²	68.1	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-60.2	-45.9	176.2	-56.4	0	0	0	0	111.4	V350 C353 I354 I421 L640 Y641 T642 Q646 C647 L648	V350-T644 HydrophobicContact CG1-CG2 3.98Å; C353-T644 WeakPolarHBondContact CB-OG1 3.24Å; I354-T644 HydrophobicContact CB-CG2 4.47Å; I421-T644 HydrophobicContact CD1-CG2 4.09Å; I421-T644 HydrophobicContact CG1-CG2 4.47Å; L640-T644 WeakPolarHBondContact O-CB 3.41Å; L640-T644 PolarHBondContact O-N 3.36Å; L640-T644 PolarHBondContact O-OG1 2.99Å; Y641-T644 WeakPolarHBondContact O-CB 2.91Å; Y641-T644 PolarHBondContact O-N 3.22Å; T642-T644 VanDerWaalsContact C-N 3.33Å; T642-T644 PolarHBondContact O-N 3.41Å; T644-Q646 VanDerWaalsContact C-N 3.35Å; T644-Q646 PolarHBondContact O-N 3.22Å; T644-C647 PolarHBondContact O-N 3.5Å; T644-L648 VanDerWaalsContact O-CB 3.28Å; T644-L648 WeakPolarHBondContact O-CB 3.14Å; T644-L648 PolarHBondContact O-N 3.03Å
645	W	92.3	Very high	86.3	Confident	52 Å²	52	70 Å²	70	20%	0.197	32%	0.316	C	S	.	.	H	α-helix	trans	-60.6	-42.9	175.9	172.7	92.5	0	0	0	111.9	L418 I421 M425 Y641 T642 T643 L648 R649	L418-W645 HydrophobicContact CD1-CG 4.49Å; I421-W645 HydrophobicContact CG1-CB 3.98Å; I421-W645 HydrophobicContact CG2-CB 4.16Å; I421-W645 HydrophobicContact CG2-CG 4.39Å; M425-W645 HydrophobicContact SD-CB 3.69Å; M425-W645 HydrophobicContact SD-CG 4.1Å; Y641-W645 PolarHBondContact O-N 3.24Å; T642-W645 PolarHBondContact O-N 3.15Å; T643-W645 PolarHBondContact O-N 2.03Å; W645-L648 PolarHBondContact O-N 3.31Å; W645-R649 VanDerWaalsContact O-CB 3.27Å; W645-R649 WeakPolarHBondContact O-CB 3.36Å; W645-R649 PolarHBondContact O-N 3Å
646	Q	91.8	Very high	84.5	Confident	99 Å²	99	69.2 Å²	69.2	46%	0.463	31%	0.307	S	S	.	.	H	α-helix	trans	-63.7	-46.4	179	-71.4	-178.2	9.6	0	0	111.3	T642 T643 T644 R649 K650	T642-Q646 WeakPolarHBondContact O-CG 3.47Å; T642-Q646 PolarHBondContact O-N 2.98Å; T643-Q646 PolarHBondContact O-N 2.98Å; T644-Q646 VanDerWaalsContact C-N 3.35Å; T644-Q646 PolarHBondContact O-N 3.22Å; Q646-R649 PolarHBondContact O-N 2.94Å; Q646-K650 WeakPolarHBondContact O-CB 3.48Å; Q646-K650 WeakPolarHBondContact O-CG 3.29Å; Q646-K650 PolarHBondContact O-N 3.15Å
647	C	89.1	Confident	82	Confident	30 Å²	30	71.2 Å²	71.2	20%	0.203	32%	0.316	C	S	.	.	H	α-helix	trans	-62.1	-44	177.1	-73.1	0	0	0	0	111.8	V350 T643 T644 K650 N651	V350-C647 HydrophobicContact CG2-CB 3.71Å; T643-C647 PolarHBondContact O-N 3.49Å; T643-C647 PolarHBondContact O-SG 3Å; T643-C647 VanDerWaalsContact O-SG 3.39Å; T643-C647 WeakPolarHBondContact O-CB 3.41Å; T644-C647 PolarHBondContact O-N 3.5Å; C647-K650 PolarHBondContact O-N 3.2Å; C647-N651 WeakPolarHBondContact O-CB 3.03Å; C647-N651 PolarHBondContact O-ND2 3.5Å; C647-N651 PolarHBondContact O-N 3.44Å
648	L	86.3	Confident	79.5	Confident	1 Å²	1	77.4 Å²	77.4	1%	0.005	35%	0.349	C	S	.	.	H	α-helix	trans	-67.3	-38.4	178.8	-168.7	67.8	0	0	0	111.8	A417 L418 I421 T564 T644 W645 Y652 Y655	A417-L648 HydrophobicContact CB-CD2 4.11Å; L418-L648 HydrophobicContact CD1-CD2 4.22Å; I421-L648 HydrophobicContact CG2-CD2 4.43Å; T564-L648 HydrophobicContact CG2-CD1 4.5Å; T644-L648 VanDerWaalsContact O-CB 3.28Å; T644-L648 WeakPolarHBondContact O-CB 3.14Å; T644-L648 PolarHBondContact O-N 3.03Å; W645-L648 PolarHBondContact O-N 3.31Å; L648-Y652 WeakPolarHBondContact O-CA 3.15Å; L648-Y652 VanDerWaalsContact O-N 3.07Å; L648-Y652 PolarHBondContact O-N 3.07Å; L648-Y655 HydrophobicContact CD1-CG 4.41Å
649	R	86.9	Confident	77.1	Confident	153 Å²	153	79.4 Å²	79.4	58%	0.577	36%	0.359	S	S	*	.	H	α-helix	trans	-66.5	-45	176.4	-174.4	179.5	-179.7	-167.9	0.9	111.7	L418 W645 Q646	L418-R649 HydrophobicContact CD1-CB 4.44Å; W645-R649 VanDerWaalsContact O-CB 3.27Å; W645-R649 WeakPolarHBondContact O-CB 3.36Å; W645-R649 PolarHBondContact O-N 3Å; Q646-R649 PolarHBondContact O-N 2.94Å
650	K	85.5	Confident	74.3	Confident	174 Å²	174	82.9 Å²	82.9	76%	0.757	37%	0.373	S	S	*	.	H	α-helix	trans	-65.9	-39.5	179	-74.9	-178.4	179.3	179.5	0	112.1	Q646 C647	Q646-K650 WeakPolarHBondContact O-CB 3.48Å; Q646-K650 WeakPolarHBondContact O-CG 3.29Å; Q646-K650 PolarHBondContact O-N 3.15Å; C647-K650 PolarHBondContact O-N 3.2Å
651	N	77.6	Confident	71.1	Confident	66 Å²	66	84.5 Å²	84.5	35%	0.353	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.3	23.7	-176.8	-65.6	-49.7	0	0	0	113.8	C647 K653 R654 Y655	C647-N651 WeakPolarHBondContact O-CB 3.03Å; C647-N651 PolarHBondContact O-ND2 3.5Å; C647-N651 PolarHBondContact O-N 3.44Å; N651-K653 PolarHBondContact O-N 3.1Å; N651-K653 VanDerWaalsContact O-N 3.09Å; N651-R654 HydrophobicContact CB-CB 4.4Å; N651-R654 PolarHBondContact O-N 3.45Å; N651-Y655 PolarHBondContact O-N 2.67Å; N651-Y655 HydrophobicContact CB-CE2 3.74Å; N651-Y655 HydrophobicContact CB-CD2 3.72Å
652	Y	68.7	Low	68.4	Low	106 Å²	106	87.9 Å²	87.9	42%	0.416	43%	0.43	S	S	.	.	H	α-helix	trans	-50.1	-41.7	-173.8	-174.9	-91.6	0	0	0	113.1	L648 R654 I656	L648-Y652 WeakPolarHBondContact O-CA 3.15Å; L648-Y652 VanDerWaalsContact O-N 3.07Å; L648-Y652 PolarHBondContact O-N 3.07Å; Y652-R654 PolarHBondContact O-N 2.67Å; Y652-I656 HydrophobicContact CD2-CD1 3.67Å; Y652-I656 HydrophobicContact CE1-CG2 4.39Å; Y652-I656 HydrophobicContact CE2-CD1 3.38Å; Y652-I656 HydrophobicContact CG-CD1 4.48Å; Y652-I656 WeakPolarHBondContact O-CB 3.3Å; Y652-I656 PolarHBondContact O-N 2.7Å
653	K	61.2	Low	65.4	Low	158 Å²	158	94.2 Å²	94.2	69%	0.687	46%	0.462	S	S	*	.	I	π-helix	trans	-66	-35.2	178	-69.6	-177.9	-179.2	176.4	0	113.3	N651 K657	N651-K653 PolarHBondContact O-N 3.1Å; N651-K653 VanDerWaalsContact O-N 3.09Å; K653-K657 PolarHBondContact O-N 3.28Å; K653-K657 WeakPolarHBondContact O-CB 3.33Å
654	R	63.9	Low	62.4	Low	191 Å²	191	96 Å²	96	72%	0.721	48%	0.476	S	S	*	.	I	π-helix	trans	-74.9	-34.5	-176.9	-166.3	175.7	-176.1	171.1	1.4	112.6	N651 Y652	N651-R654 HydrophobicContact CB-CB 4.4Å; N651-R654 PolarHBondContact O-N 3.45Å; Y652-R654 PolarHBondContact O-N 2.67Å
655	Y	60.4	Low	59.5	Low	44 Å²	44	101.5 Å²	101.5	17%	0.173	51%	0.51	C	S	.	.	I	π-helix	trans	-95.1	-28.5	-177.3	-72.8	-85.4	0	0	0	114.1	N348 V350 L648 N651	N348-Y655 PolarHBondContact OD1-OH 2.67Å; V350-Y655 HydrophobicContact CG2-CE2 4.17Å; L648-Y655 HydrophobicContact CD1-CG 4.41Å; N651-Y655 PolarHBondContact O-N 2.67Å; N651-Y655 HydrophobicContact CB-CE2 3.74Å; N651-Y655 HydrophobicContact CB-CD2 3.72Å
656	I	57.6	Low	56.4	Low	32 Å²	32	103.4 Å²	103.4	16%	0.164	53%	0.531	C	S	.	.	I	π-helix	trans	-112.7	-35.4	-172.6	-65	169.8	0	0	0	112.6	Y652 N658 H659	Y652-I656 HydrophobicContact CD2-CD1 3.67Å; Y652-I656 HydrophobicContact CE1-CG2 4.39Å; Y652-I656 HydrophobicContact CE2-CD1 3.38Å; Y652-I656 HydrophobicContact CG-CD1 4.48Å; Y652-I656 WeakPolarHBondContact O-CB 3.3Å; Y652-I656 PolarHBondContact O-N 2.7Å; I656-N658 VanDerWaalsContact C-N 3.34Å; I656-N658 PolarHBondContact O-N 3.36Å; I656-H659 WeakPolarHBondContact O-CB 3.48Å; I656-H659 PolarHBondContact O-N 3.44Å; I656-H659 VanDerWaalsContact O-N 3.07Å
657	K	44.3	Very low	53.5	Low	139 Å²	139	103.3 Å²	103.3	60%	0.604	54%	0.537	S	S	*	.	I	π-helix	trans	-71.2	-27.4	-177.7	-154.7	179	179.9	-173.7	0	113.3	K653 H659 G661	K653-K657 PolarHBondContact O-N 3.28Å; K653-K657 WeakPolarHBondContact O-CB 3.33Å; K657-H659 PolarHBondContact O-N 3.03Å; K657-G661 PolarHBondContact O-N 2.65Å
658	N	43.8	Very low	50.6	Low	129 Å²	129	109.5 Å²	109.5	69%	0.69	56%	0.563	S	S	*	*	H	α-helix	trans	-73.1	-8.1	172.1	-72	1.3	0	0	0	113.4	I656	I656-N658 VanDerWaalsContact C-N 3.34Å; I656-N658 PolarHBondContact O-N 3.36Å
659	H	45.2	Very low	47.8	Very low	106 Å²	106	119 Å²	119	49%	0.491	60%	0.6	S	S	.	*	H	α-helix	trans	-95.5	-19.2	178.7	-111.9	-58.7	0	0	0	113.4	I656 K657	I656-H659 WeakPolarHBondContact O-CB 3.48Å; I656-H659 PolarHBondContact O-N 3.44Å; I656-H659 VanDerWaalsContact O-N 3.07Å; K657-H659 PolarHBondContact O-N 3.03Å
660	E	36.9	Very low	45	Very low	166 Å²	166	117.8 Å²	117.8	78%	0.776	60%	0.601	S	S	*	*	H	α-helix	trans	-101.6	-16.3	178.8	-73.6	178.5	162.7	0	0	113.4
661	G	27.9	Very low	42.3	Very low	50 Å²	50	115.1 Å²	115.1	52%	0.515	60%	0.595	S	S	.	*	S	Bend	trans	-101.1	100.9	170.6	0	0	0	0	0	110.3	K657 L663	K657-G661 PolarHBondContact O-N 2.65Å; G661-L663 PolarHBondContact O-N 3.29Å
662	G	39.8	Very low	40.2	Very low	75 Å²	75	118.8 Å²	118.8	77%	0.773	61%	0.613	S	S	*	*			trans	-63.2	121.2	168.3	0	0	0	0	0	110.1
663	L	30.8	Very low	38.3	Very low	161 Å²	161	121.4 Å²	121.4	84%	0.843	63%	0.629	S	S	*	*			trans	-168.5	133.7	143.1	-135.6	70.8	0	0	0	113.7	G661	G661-L663 PolarHBondContact O-N 3.29Å
664	S	30.1	Very low	36.8	Very low	84 Å²	84	118.4 Å²	118.4	59%	0.587	62%	0.624	S	S	*	*			trans	43.1	90.9	144.4	60.1	0	0	0	0	119.6	S666	S664-S666 PolarHBondContact O-N 3.43Å
665	T	29.7	Very low	35.2	Very low	116 Å²	116	117.8 Å²	117.8	71%	0.712	63%	0.63	S	S	*	*			trans	-83.8	90.5	152.8	30.9	0	0	0	0	110
666	S	28.2	Very low	33.9	Very low	92 Å²	92	124.9 Å²	124.9	64%	0.643	66%	0.661	S	S	*	*			trans	-134.3	10.4	163.6	56.3	0	0	0	0	113.4	S664	S664-S666 PolarHBondContact O-N 3.43Å
667	T	28.9	Very low	32.6	Very low	97 Å²	97	129.2 Å²	129.2	60%	0.595	69%	0.69	S	S	*	*	S	Bend	trans	-116.9	-17.5	-174.2	-28.3	0	0	0	0	114.4
668	E	28.9	Very low	31.7	Very low	160 Å²	160	128.4 Å²	128.4	75%	0.748	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.5	-4	-173.9	-143.3	170.3	178.6	0	0	114.3
669	Y	28.1	Very low	31	Very low	199 Å²	199	128.3 Å²	128.3	78%	0.78	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.1	-12.6	173.6	-105.8	-88.5	0	0	0	113.9
670	Q	28.6	Very low	30.1	Very low	128 Å²	128	131.9 Å²	131.9	60%	0.598	72%	0.724	S	S	*	*	S	Bend	trans	-83.2	-19.8	178.8	-101.1	174.5	-30	0	0	113.6	I672 E673 T674	Q670-I672 VanDerWaalsContact C-N 3.28Å; Q670-I672 PolarHBondContact O-N 2.81Å; Q670-E673 PolarHBondContact O-N 3.18Å; Q670-T674 PolarHBondContact O-N 2.81Å; Q670-T674 PolarHBondContact O-OG1 3.19Å
671	D	28.6	Very low	29.6	Very low	119 Å²	119	129.5 Å²	129.5	64%	0.636	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.4	-7.6	-179.4	-71.4	-19.4	0	0	0	113.5
672	I	31.8	Very low	29.6	Very low	142 Å²	142	136.3 Å²	136.3	73%	0.728	74%	0.743	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.3	-17.1	174.9	-59.3	177.8	0	0	0	111.5	Q670	Q670-I672 VanDerWaalsContact C-N 3.28Å; Q670-I672 PolarHBondContact O-N 2.81Å
673	E	29.8	Very low	28.9	Very low	161 Å²	161	137.7 Å²	137.7	75%	0.752	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.8	-15.1	-176.7	-141.8	164.9	-153.9	0	0	113.4	Q670	Q670-E673 PolarHBondContact O-N 3.18Å
674	T	29.7	Very low	28.7	Very low	95 Å²	95	136.2 Å²	136.2	58%	0.583	74%	0.741	S	S	*	*	G	3₁₀ helix	trans	-88.2	-5.5	-178.3	36.8	0	0	0	0	115.1	Q670 K676	Q670-T674 PolarHBondContact O-N 2.81Å; Q670-T674 PolarHBondContact O-OG1 3.19Å; T674-K676 VanDerWaalsContact C-N 3.26Å; T674-K676 PolarHBondContact O-N 3.49Å
675	E	30.4	Very low	28.5	Very low	179 Å²	179	137.8 Å²	137.8	84%	0.836	75%	0.752	S	S	*	*	G	3₁₀ helix	trans	-88.2	19.8	177	-146.8	179.9	-179.3	0	0	113.5
676	K	33.6	Very low	28.5	Very low	192 Å²	192	140.7 Å²	140.7	84%	0.835	76%	0.758	S	S	*	*	G	3₁₀ helix	trans	-131.8	22.7	-176.1	-86.9	-165.9	178.9	-175.5	0	116.8	T674	T674-K676 VanDerWaalsContact C-N 3.26Å; T674-K676 PolarHBondContact O-N 3.49Å
677	T	28.9	Very low	28.4	Very low	123 Å²	123	143.7 Å²	143.7	76%	0.755	77%	0.766	S	S	*	*			trans	-117.6	108.7	166.2	31.8	0	0	0	0	110.4
678	C	26	Very low	28.4	Very low	122 Å²	122	144.1 Å²	144.1	82%	0.824	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-55.4	145.9	170.4	-67.4	0	0	0	0	110.9	E680	C678-E680 PolarHBondContact O-N 3.21Å
679	P	28.2	Very low	28.2	Very low	127 Å²	127	146.4 Å²	146.4	83%	0.825	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-73.5	123.6	174.9	28.3	-30.4	0	0	0	110.5
680	E	27.3	Very low	28.4	Very low	182 Å²	182	143.6 Å²	143.6	85%	0.85	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-64	136.2	164.4	-81.4	-179.2	147.5	0	0	110	C678 H682	C678-E680 PolarHBondContact O-N 3.21Å; E680-H682 PolarHBondContact O-N 3.18Å
681	S	26.5	Very low	28.7	Very low	115 Å²	115	148.3 Å²	148.3	80%	0.804	80%	0.797	S	S	*	*			trans	-65	115.2	173.5	50.4	0	0	0	0	111.2	S683	S681-S683 PolarHBondContact O-N 3.31Å
682	H	27	Very low	28.7	Very low	194 Å²	194	151.8 Å²	151.8	90%	0.898	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-75.4	116.6	164.6	-91.1	-74.8	0	0	0	110.3	E680	E680-H682 PolarHBondContact O-N 3.18Å
683	S	24.9	Very low	28.5	Very low	103 Å²	103	152.3 Å²	152.3	72%	0.72	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-84.1	144.3	154.7	50.1	0	0	0	0	109.6	S681	S681-S683 PolarHBondContact O-N 3.31Å
684	P	28	Very low	28.5	Very low	130 Å²	130	151.8 Å²	151.8	84%	0.844	84%	0.84	S	S	*	*	P	Polyproline II helix	trans	-88.6	123.6	175.7	32.4	-27.2	0	0	0	110
685	S	26.1	Very low	28.4	Very low	118 Å²	118	155 Å²	155	83%	0.825	85%	0.854	S	S	*	*	P	Polyproline II helix	trans	-98.3	123.2	163.1	53.7	0	0	0	0	109.4
686	E	28.1	Very low	28.3	Very low	177 Å²	177	153.6 Å²	153.6	83%	0.827	86%	0.855	S	S	*	*	P	Polyproline II helix	trans	-63.2	162.9	167.6	-70.4	173.1	123.1	0	0	112.2
687	D	28	Very low	27.9	Very low	155 Å²	155	151.2 Å²	151.2	83%	0.829	86%	0.857	S	S	*	*			trans	71.9	127.5	168	-60.5	-24.5	0	0	0	116.5
688	S	27.7	Very low	27.9	Very low	106 Å²	106	153.1 Å²	153.1	74%	0.741	86%	0.863	S	S	*	*			cis	-173.3	141.2	24.9	41.3	0	0	0	0	108.2
689	F	25.7	Very low	28	Very low	208 Å²	208	155.3 Å²	155.3	91%	0.912	87%	0.866	S	S	*	*			trans	-145	94.4	162.2	-131.3	-90.3	0	0	0	109.8
690	V	30.8	Very low	28	Very low	140 Å²	140	157.5 Å²	157.5	85%	0.848	87%	0.869	S	S	*	*			trans	-111.9	103.6	160.8	174.7	0	0	0	0	107.6
691	R	35.8	Very low	28	Very low	226 Å²	226	155.4 Å²	155.4	85%	0.853	87%	0.871	S	S	*	*			trans	35.3	134.4	150.4	-72.6	-178.5	-179.8	171.5	0.8	121.3
692	S	28	Very low	28.2	Very low	193 Å²	193	159.1 Å²	159.1	100%	1.35	88%	0.877	S	S	*	*			trans	102.2	0	156.5	-38.2	0	0	0	0	114.6

Retrieved 692 of 692 residues in 130.4 ms (Link to these results)

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