A0A077ZAR4_TRITR Loading...

CRAL TRIO 2 and RhoGAP domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZAR4, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 441 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	31.5	Very low	247 Å²	247	143.1 Å²	143.1	100%	1.217	85%	0.845	S	S	*	*				0	128.8	0	-86.7	172.2	163.3	0	0	108
2	S	35	Very low	31.5	Very low	104 Å²	104	143.3 Å²	143.3	73%	0.727	84%	0.84	S	S	*	*			trans	74	97.1	163.3	-160.6	0	0	0	0	120.1
3	D	32.9	Very low	32	Very low	138 Å²	138	141.7 Å²	141.7	74%	0.738	84%	0.836	S	S	*	*				64	103.9	118.3	-49.5	-43.2	0	0	0	122.3
4	T	31.8	Very low	32	Very low	125 Å²	125	138.3 Å²	138.3	77%	0.767	82%	0.824	S	S	*	*				41.9	103.4	114.9	-44	0	0	0	0	119
5	V	35.8	Very low	32	Very low	141 Å²	141	140.1 Å²	140.1	86%	0.855	83%	0.828	S	S	*	*				-146.7	109.6	121.7	-178.4	0	0	0	0	108.6
6	K	28.8	Very low	32.1	Very low	204 Å²	204	146.2 Å²	146.2	89%	0.887	83%	0.832	S	S	*	*			trans	-107.1	121.8	162.4	-84.4	-178	175.4	178.5	0	107.5
7	S	30.4	Very low	32	Very low	97 Å²	97	145.8 Å²	145.8	68%	0.678	83%	0.833	S	S	*	*			trans	-169.8	106.3	143.4	55.5	0	0	0	0	108.2
8	L	32.3	Very low	31.9	Very low	169 Å²	169	147.1 Å²	147.1	89%	0.885	83%	0.83	S	S	*	*				97.5	84.1	102.6	-82.2	162.1	0	0	0	111.6
9	V	27.9	Very low	32	Very low	154 Å²	154	145.1 Å²	145.1	93%	0.933	82%	0.824	S	S	*	*			trans	-72.5	133.6	155.6	172.6	0	0	0	0	108
10	G	28.1	Very low	32.2	Very low	75 Å²	75	143.5 Å²	143.5	77%	0.773	82%	0.822	S	S	*	*			trans	147.6	83.3	161.1	0	0	0	0	0	114.6
11	S	32.2	Very low	32.2	Very low	120 Å²	120	141.2 Å²	141.2	84%	0.839	82%	0.82	S	S	*	*			trans	-139.1	106.5	153.9	49.2	0	0	0	0	108.9
12	D	31	Very low	32.2	Very low	145 Å²	145	137.3 Å²	137.3	78%	0.775	80%	0.797	S	S	*	*			trans	-76.7	127.5	179.4	-160.1	-2	0	0	0	109.4	S14	D12-S14 PolarHBondContact O-N 3.43Å
13	P	37.6	Very low	31.9	Very low	123 Å²	123	140.2 Å²	140.2	80%	0.799	80%	0.803	S	S	*	*			trans	-90.7	87.1	-176.3	34.1	-30.2	0	0	0	110.5
14	S	32.4	Very low	32	Very low	94 Å²	94	139 Å²	139	66%	0.657	80%	0.797	S	S	*	*			trans	-135	49.7	171.9	75.8	0	0	0	0	113.5	D12	D12-S14 PolarHBondContact O-N 3.43Å
15	D	32.8	Very low	32.1	Very low	165 Å²	165	136.2 Å²	136.2	88%	0.882	78%	0.781	S	S	*	*			trans	-107.1	74	165.1	-88.8	-27.4	0	0	0	110.2
16	R	32.7	Very low	32.4	Very low	238 Å²	238	138.9 Å²	138.9	90%	0.898	78%	0.784	S	S	*	*			trans	-92.5	98	160.5	-76.6	-173	179.9	-177.4	1.3	107.9	H18	R16-H18 PolarHBondContact O-N 3.41Å; R16-H18 VanDerWaalsContact O-N 3.09Å
17	V	31.3	Very low	32.7	Very low	139 Å²	139	137 Å²	137	84%	0.842	78%	0.778	S	S	*	*			trans	-50.3	108.3	174.6	179.2	0	0	0	0	110.3
18	H	29.7	Very low	33.1	Very low	169 Å²	169	136.3 Å²	136.3	78%	0.782	77%	0.772	S	S	*	*			trans	-74.6	143	168.2	-108.7	-86.8	0	0	0	109.7	R16 S20	R16-H18 PolarHBondContact O-N 3.41Å; R16-H18 VanDerWaalsContact O-N 3.09Å; H18-S20 PolarHBondContact O-N 3.47Å
19	P	34.5	Very low	33.5	Very low	110 Å²	110	137.4 Å²	137.4	71%	0.714	77%	0.77	S	S	*	*			trans	-70.2	118.4	-176.2	-1	15.2	0	0	0	110.6	A21	P19-A21 PolarHBondContact O-N 3.49Å
20	S	34.8	Very low	34.2	Very low	113 Å²	113	132.5 Å²	132.5	79%	0.79	75%	0.745	S	S	*	*			trans	24.4	93.6	157.2	59.1	0	0	0	0	115.9	H18 F22	H18-S20 PolarHBondContact O-N 3.47Å; S20-F22 PolarHBondContact O-N 3.34Å
21	A	31.6	Very low	34.8	Very low	95 Å²	95	136.3 Å²	136.3	79%	0.785	75%	0.748	S	S	*	*			trans	-54.9	133.9	164.7	0	0	0	0	0	110.7	P19 L23	P19-A21 PolarHBondContact O-N 3.49Å; A21-L23 PolarHBondContact O-N 2.82Å
22	F	32.4	Very low	35.1	Very low	166 Å²	166	134.6 Å²	134.6	73%	0.728	73%	0.73	S	S	*	*			trans	-61.2	114.4	-177.2	-158.8	-94.7	0	0	0	110.6	S20	S20-F22 PolarHBondContact O-N 3.34Å
23	L	29.4	Very low	35.6	Very low	165 Å²	165	131.8 Å²	131.8	86%	0.864	71%	0.714	S	S	*	*			trans	-86.6	114.6	172	-80.9	159.7	0	0	0	108.9	A21	A21-L23 PolarHBondContact O-N 2.82Å
24	D	34.4	Very low	35.7	Very low	113 Å²	113	134 Å²	134	60%	0.604	71%	0.712	S	S	*	*			trans	-67.6	134.5	174.4	-84.1	-38.1	0	0	0	110.4
25	P	34.4	Very low	36	Very low	65 Å²	65	132.3 Å²	132.3	42%	0.422	70%	0.697	S	S	.	*			trans	-73.9	141.4	175.3	27.5	-30.5	0	0	0	111.8	E27	P25-E27 VanDerWaalsContact C-N 3.33Å; P25-E27 PolarHBondContact O-N 3.48Å
26	E	41.1	Very low	36.2	Very low	197 Å²	197	128.1 Å²	128.1	92%	0.921	68%	0.675	S	S	*	*	S	Bend	trans	-69.5	-14	-167	-72.3	-171.4	150.3	0	0	116.1
27	E	35.3	Very low	36.6	Very low	164 Å²	164	121 Å²	121	77%	0.766	66%	0.662	S	S	*	*	S	Bend	trans	-141.2	118.7	176.4	-71.5	-171.7	163.8	0	0	112.4	P25 F29	P25-E27 VanDerWaalsContact C-N 3.33Å; P25-E27 PolarHBondContact O-N 3.48Å; E27-F29 PolarHBondContact O-N 3.19Å
28	P	40	Very low	37	Very low	84 Å²	84	119.9 Å²	119.9	55%	0.545	65%	0.651	S	S	.	*			trans	-76.9	122	176	27.5	-28.6	0	0	0	111.1	A30	P28-A30 PolarHBondContact O-N 3.09Å
29	F	40.9	Very low	37.5	Very low	191 Å²	191	115.6 Å²	115.6	84%	0.838	63%	0.633	S	S	*	*	S	Bend	trans	-70.3	69.5	167	-64.1	-82.2	0	0	0	111.1	E27	E27-F29 PolarHBondContact O-N 3.19Å
30	A	41.8	Very low	37.6	Very low	51 Å²	51	116 Å²	116	42%	0.421	63%	0.628	S	S	.	*	S	Bend	trans	165.1	114.8	157.4	0	0	0	0	0	106.3	P28 N32 T169	P28-A30 PolarHBondContact O-N 3.09Å; A30-N32 PolarHBondContact O-N 3.13Å; A30-T169 HydrophobicContact CB-CG2 4.1Å
31	D	39.8	Very low	37.7	Very low	156 Å²	156	114.2 Å²	114.2	83%	0.834	61%	0.613	S	S	*	*			trans	-48.6	131.8	167.2	-78.6	-44.4	0	0	0	109.5	D33	D31-D33 VanDerWaalsContact C-N 3.26Å; D31-D33 PolarHBondContact O-N 3.42Å
32	N	39.7	Very low	38	Very low	84 Å²	84	111.8 Å²	111.8	45%	0.449	60%	0.597	S	S	.	*			trans	-66.9	88.4	-178.8	-63.9	-73.8	0	0	0	108.2	A30 F34	A30-N32 PolarHBondContact O-N 3.13Å; N32-F34 VanDerWaalsContact C-N 3.28Å; N32-F34 PolarHBondContact O-N 3.41Å
33	D	40.7	Very low	38.3	Very low	85 Å²	85	111.5 Å²	111.5	46%	0.455	60%	0.598	S	S	.	*			trans	-60.6	99.7	164.6	-79.9	-17.6	0	0	0	107.2	D31 V35	D31-D33 VanDerWaalsContact C-N 3.26Å; D31-D33 PolarHBondContact O-N 3.42Å; D33-V35 PolarHBondContact O-N 2.8Å
34	F	39.6	Very low	38.6	Very low	170 Å²	170	110.4 Å²	110.4	75%	0.746	59%	0.589	S	S	*	*			trans	-24.7	125.5	-179.7	-91	-109	0	0	0	112.3	N32 D36 R136	N32-F34 VanDerWaalsContact C-N 3.28Å; N32-F34 PolarHBondContact O-N 3.41Å; F34-D36 PolarHBondContact O-N 2.82Å; F34-D36 VanDerWaalsContact O-N 3.15Å; F34-R136 PolarHBondContact O-NH2 3.19Å
35	V	38.4	Very low	38.7	Very low	58 Å²	58	108.7 Å²	108.7	35%	0.352	58%	0.584	S	S	.	*			trans	-68.4	111.1	168.1	177.5	0	0	0	0	106	D33 S37 I39 L171 I174	D33-V35 PolarHBondContact O-N 2.8Å; V35-S37 PolarHBondContact O-N 3.23Å; V35-I39 HydrophobicContact CG1-CD1 4.46Å; V35-L171 HydrophobicContact CG2-CD1 3.93Å; V35-I174 HydrophobicContact CB-CD1 4.42Å; V35-I174 HydrophobicContact CG1-CD1 4.35Å; V35-I174 HydrophobicContact CG2-CD1 3.45Å; V35-I174 VanDerWaalsContact CG2-CD1 3.45Å
36	D	38.7	Very low	38.7	Very low	77 Å²	77	112 Å²	112	41%	0.412	60%	0.599	S	S	.	*			trans	-62.3	124.6	169	-104.1	-50.5	0	0	0	108.4	F34 N38 I39 R136	F34-D36 PolarHBondContact O-N 2.82Å; F34-D36 VanDerWaalsContact O-N 3.15Å; D36-N38 PolarHBondContact O-N 3.32Å; D36-I39 HydrophobicContact CB-CG1 4.5Å; D36-I39 WeakPolarHBondContact O-CB 3.5Å; D36-I39 WeakPolarHBondContact O-CG1 3.32Å; D36-I39 PolarHBondContact O-N 2.96Å; D36-R136 IonicContact OD2-CZ 3.43Å; D36-R136 IonicContact OD2-NH1 2.77Å; D36-R136 PolarHBondContact OD2-NH1 3.39Å; D36-R136 IonicContact OD2-NH2 2.65Å; D36-R136 PolarHBondContact OD2-NH2 3.46Å; D36-R136 VanDerWaalsContact OD2-NH2 3.16Å
37	S	40.3	Very low	38.4	Very low	89 Å²	89	106.4 Å²	106.4	62%	0.622	58%	0.581	S	S	*	*	G	3₁₀ helix	trans	-56.9	-20.4	178.9	33.6	0	0	0	0	113	V35 I39 L40	V35-S37 PolarHBondContact O-N 3.23Å; S37-I39 PolarHBondContact O-N 3.23Å; S37-L40 PolarHBondContact O-N 3.27Å
38	N	39.4	Very low	38.4	Very low	116 Å²	116	100.5 Å²	100.5	62%	0.62	56%	0.555	S	S	*	*	G	3₁₀ helix	trans	-66.5	-18.7	174.1	-69.1	-12	0	0	0	113.4	D36 L40 T41	D36-N38 PolarHBondContact O-N 3.32Å; N38-L40 PolarHBondContact O-N 3.05Å; N38-T41 PolarHBondContact O-N 3.28Å; N38-T41 PolarHBondContact O-OG1 3.11Å
39	I	41.1	Very low	38.1	Very low	79 Å²	79	105.3 Å²	105.3	41%	0.405	57%	0.57	S	S	.	*	G	3₁₀ helix	trans	-66	-25.1	175.5	-63.6	175.3	0	0	0	111.7	V35 D36 S37 L142	V35-I39 HydrophobicContact CG1-CD1 4.46Å; D36-I39 HydrophobicContact CB-CG1 4.5Å; D36-I39 WeakPolarHBondContact O-CB 3.5Å; D36-I39 WeakPolarHBondContact O-CG1 3.32Å; D36-I39 PolarHBondContact O-N 2.96Å; S37-I39 PolarHBondContact O-N 3.23Å; I39-L142 HydrophobicContact CG2-CD1 3.46Å; I39-L142 VanDerWaalsContact CG2-CD1 3.46Å; I39-L142 HydrophobicContact CG2-CG 4.36Å
40	L	36.7	Very low	37.6	Very low	118 Å²	118	103.5 Å²	103.5	62%	0.618	57%	0.569	S	S	*	*	G	3₁₀ helix	trans	-92.5	-3.3	178.5	-68.7	172.3	0	0	0	113.7	S37 N38 G42	S37-L40 PolarHBondContact O-N 3.27Å; N38-L40 PolarHBondContact O-N 3.05Å; L40-G42 PolarHBondContact O-N 3.41Å; L40-G42 VanDerWaalsContact O-N 3.09Å
41	T	35.8	Very low	37.1	Very low	75 Å²	75	105 Å²	105	46%	0.46	58%	0.576	S	S	.	*			trans	-74.1	107.9	176.7	60.7	0	0	0	0	108.8	N38 E43	N38-T41 PolarHBondContact O-N 3.28Å; N38-T41 PolarHBondContact O-OG1 3.11Å; T41-E43 PolarHBondContact O-N 3.01Å
42	G	37.9	Very low	36.7	Very low	44 Å²	44	102.8 Å²	102.8	45%	0.454	57%	0.572	S	S	.	*	T	Hydrogen-bonded Turn	trans	-61.3	9.4	-174.7	0	0	0	0	0	116	L40 Q44 C45	L40-G42 PolarHBondContact O-N 3.41Å; L40-G42 VanDerWaalsContact O-N 3.09Å; G42-Q44 VanDerWaalsContact C-N 3.32Å; G42-Q44 PolarHBondContact O-N 2.98Å; G42-C45 PolarHBondContact O-N 3.48Å
43	E	38.9	Very low	36.3	Very low	161 Å²	161	106.9 Å²	106.9	75%	0.752	59%	0.594	S	S	*	*	H	α-helix	trans	-67.5	-31.3	175.8	-69.4	-170.5	154.3	0	0	112.2	T41 C45 N46	T41-E43 PolarHBondContact O-N 3.01Å; E43-C45 VanDerWaalsContact C-N 3.29Å; E43-C45 PolarHBondContact O-N 3.27Å; E43-N46 PolarHBondContact O-N 2.96Å
44	Q	36	Very low	36	Very low	142 Å²	142	104.6 Å²	104.6	66%	0.664	59%	0.59	S	S	*	*	H	α-helix	trans	-75	-14.4	173.2	-75.1	-170.3	6.6	0	0	114.1	G42 S47	G42-Q44 VanDerWaalsContact C-N 3.32Å; G42-Q44 PolarHBondContact O-N 2.98Å; Q44-S47 PolarHBondContact O-OG 2.97Å
45	C	36	Very low	36.2	Very low	76 Å²	76	101.7 Å²	101.7	51%	0.514	58%	0.583	S	S	.	*	H	α-helix	trans	-83	-25	175.4	-73.4	0	0	0	0	112.4	G42 E43 S47 L48	G42-C45 PolarHBondContact O-N 3.48Å; E43-C45 VanDerWaalsContact C-N 3.29Å; E43-C45 PolarHBondContact O-N 3.27Å; C45-S47 PolarHBondContact O-N 2.77Å; C45-L48 HydrophobicContact CB-CD1 4.31Å; C45-L48 WeakPolarHBondContact O-CB 3.35Å; C45-L48 WeakPolarHBondContact O-CD1 3.34Å; C45-L48 PolarHBondContact O-N 3.16Å
46	N	35.1	Very low	36.1	Very low	136 Å²	136	101.3 Å²	101.3	73%	0.727	58%	0.575	S	S	*	*	H	α-helix	trans	-76.9	-20	-177.5	-73.1	-15	0	0	0	113.6	E43 L48	E43-N46 PolarHBondContact O-N 2.96Å; N46-L48 VanDerWaalsContact C-N 3.26Å; N46-L48 PolarHBondContact O-N 2.58Å
47	S	35.4	Very low	36	Very low	79 Å²	79	102.3 Å²	102.3	55%	0.552	58%	0.58	S	S	*	*	G	3₁₀ helix	trans	-81.3	-0	173.1	56.7	0	0	0	0	114	Q44 C45 Q49	Q44-S47 PolarHBondContact O-OG 2.97Å; C45-S47 PolarHBondContact O-N 2.77Å; S47-Q49 PolarHBondContact O-N 2.96Å; S47-Q49 VanDerWaalsContact O-N 3.13Å
48	L	33.8	Very low	35.8	Very low	40 Å²	40	105.1 Å²	105.1	21%	0.209	58%	0.583	C	S	.	*	G	3₁₀ helix	trans	-71.5	-0.4	-179.2	-74.8	167.2	0	0	0	115.1	C45 N46 V146	C45-L48 HydrophobicContact CB-CD1 4.31Å; C45-L48 WeakPolarHBondContact O-CB 3.35Å; C45-L48 WeakPolarHBondContact O-CD1 3.34Å; C45-L48 PolarHBondContact O-N 3.16Å; N46-L48 VanDerWaalsContact C-N 3.26Å; N46-L48 PolarHBondContact O-N 2.58Å; L48-V146 HydrophobicContact CD2-CG1 4.39Å
49	Q	34.3	Very low	35.7	Very low	185 Å²	185	108.4 Å²	108.4	86%	0.864	59%	0.587	S	S	*	*	G	3₁₀ helix	trans	-89.7	-13.1	178	-80.2	-175.7	-11.2	0	0	114.9	S47	S47-Q49 PolarHBondContact O-N 2.96Å; S47-Q49 VanDerWaalsContact O-N 3.13Å
50	N	30.1	Very low	35.7	Very low	153 Å²	153	107.2 Å²	107.2	82%	0.818	58%	0.582	S	S	*	*			trans	-120.8	17.8	-172.5	-93.2	1.3	0	0	0	116.1	S52	N50-S52 PolarHBondContact O-N 3.43Å
51	C	30.8	Very low	36.2	Very low	83 Å²	83	108.7 Å²	108.7	56%	0.561	59%	0.585	S	S	*	*			trans	-89.7	106.9	176.1	-59.7	0	0	0	0	110.9
52	S	32.3	Very low	36.8	Very low	109 Å²	109	109.9 Å²	109.9	76%	0.762	59%	0.589	S	S	*	*			trans	-48.5	142.5	-176.3	-47.7	0	0	0	0	115.4	N50 G54	N50-S52 PolarHBondContact O-N 3.43Å; S52-G54 VanDerWaalsContact C-N 3.25Å; S52-G54 PolarHBondContact O-N 3.22Å
53	N	31.7	Very low	37.1	Very low	169 Å²	169	108.2 Å²	108.2	90%	0.904	57%	0.569	S	S	*	*			trans	-63.4	74.3	171.5	-73.3	-22	0	0	0	111.9	N55	N53-N55 PolarHBondContact O-N 3.49Å
54	G	34.4	Very low	37.4	Very low	37 Å²	37	104.1 Å²	104.1	38%	0.381	55%	0.55	S	S	.	.			trans	-59.1	133.5	163.9	0	0	0	0	0	109.8	S52 Y56	S52-G54 VanDerWaalsContact C-N 3.25Å; S52-G54 PolarHBondContact O-N 3.22Å; G54-Y56 VanDerWaalsContact C-N 3.33Å; G54-Y56 WeakPolarHBondContact O-CD2 3.41Å; G54-Y56 WeakPolarHBondContact O-CE2 3.47Å; G54-Y56 PolarHBondContact O-N 3.12Å
55	N	43.3	Very low	38	Very low	109 Å²	109	105.8 Å²	105.8	58%	0.583	56%	0.556	S	S	*	*			trans	-76.8	84.1	179.4	-166.7	18.1	0	0	0	109.6	N53 L57	N53-N55 PolarHBondContact O-N 3.49Å; N55-L57 PolarHBondContact O-N 2.84Å
56	Y	35.6	Very low	38.3	Very low	50 Å²	50	107.3 Å²	107.3	20%	0.196	56%	0.555	C	S	.	*	T	Hydrogen-bonded Turn	trans	-62.2	-3.8	-177.8	-68.6	-82.3	0	0	0	115.1	G54 E107 L110 R111 I114 A151	G54-Y56 VanDerWaalsContact C-N 3.33Å; G54-Y56 WeakPolarHBondContact O-CD2 3.41Å; G54-Y56 WeakPolarHBondContact O-CE2 3.47Å; G54-Y56 PolarHBondContact O-N 3.12Å; Y56-E107 WeakPolarHBondContact CE1-OE1 3.42Å; Y56-E107 VanDerWaalsContact CZ-OE1 3.22Å; Y56-E107 PolarHBondContact OH-OE1 3.08Å; Y56-L110 HydrophobicContact CE1-CD2 3.88Å; Y56-L110 HydrophobicContact CE1-CG 4.31Å; Y56-R111 HydrophobicContact CD1-CG 4Å; Y56-I114 HydrophobicContact CD1-CD1 3.99Å; Y56-I114 HydrophobicContact CG-CD1 4.09Å; Y56-A151 HydrophobicContact CD2-CB 4.37Å; Y56-A151 HydrophobicContact CE2-CB 4.41Å
57	L	36.2	Very low	39	Very low	98 Å²	98	102 Å²	102	51%	0.513	53%	0.526	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.3	2.7	-173	-59.8	178.3	0	0	0	114	N55 R59	N55-L57 PolarHBondContact O-N 2.84Å; L57-R59 PolarHBondContact O-N 3.33Å
58	E	37.5	Very low	39.4	Very low	148 Å²	148	99.8 Å²	99.8	69%	0.692	52%	0.516	S	S	*	.			trans	-65.8	117.3	171.4	-75.6	-180	176.4	0	0	109.5	D60	E58-D60 PolarHBondContact O-N 2.99Å
59	R	36.4	Very low	39.4	Very low	185 Å²	185	100.8 Å²	100.8	70%	0.698	53%	0.526	S	S	*	.			trans	-76.5	97.8	176.9	-73.7	-177.4	175	-167.6	-4.9	108.6	L57 D118	L57-R59 PolarHBondContact O-N 3.33Å; R59-D118 IonicContact NH2-OD2 3.24Å
60	D	41.1	Very low	39.9	Very low	54 Å²	54	96.5 Å²	96.5	29%	0.289	52%	0.515	S	S	.	.			trans	-97.4	125.6	160.4	-162.2	-30.4	0	0	0	107.8	E58 N62 F63	E58-D60 PolarHBondContact O-N 2.99Å; D60-N62 VanDerWaalsContact C-N 3.32Å; D60-N62 WeakPolarHBondContact OD1-CB 3.47Å; D60-N62 PolarHBondContact OD1-N 2.93Å; D60-F63 HydrophobicContact CB-CD1 4.24Å; D60-F63 HydrophobicContact CB-CD2 4.48Å; D60-F63 HydrophobicContact CB-CE1 3.73Å; D60-F63 HydrophobicContact CB-CE2 4.01Å; D60-F63 HydrophobicContact CB-CZ 3.59Å; D60-F63 WeakPolarHBondContact O-CD2 3.47Å; D60-F63 WeakPolarHBondContact O-CE2 3.35Å
61	E	47.4	Very low	40.2	Very low	150 Å²	150	95 Å²	95	70%	0.701	51%	0.511	S	S	*	.	S	Bend	trans	-87.8	-7.3	179	-68	177.6	-178.5	0	0	111.7
62	N	48.4	Very low	40.7	Very low	100 Å²	100	98.6 Å²	98.6	54%	0.535	53%	0.525	S	S	.	.			trans	-96.1	14.6	-176.2	-67.1	-30.6	0	0	0	113.8	D60 E64 F65 E66	D60-N62 VanDerWaalsContact C-N 3.32Å; D60-N62 WeakPolarHBondContact OD1-CB 3.47Å; D60-N62 PolarHBondContact OD1-N 2.93Å; N62-E64 PolarHBondContact O-N 3.45Å; N62-E64 VanDerWaalsContact O-N 3.15Å; N62-F65 HydrophobicContact CB-CB 4.45Å; N62-F65 WeakPolarHBondContact O-CA 3.07Å; N62-F65 WeakPolarHBondContact O-CB 3.09Å; N62-F65 PolarHBondContact O-N 3.05Å; N62-E66 PolarHBondContact O-N 3.06Å
63	F	44.3	Very low	41.1	Very low	9 Å²	9	99.2 Å²	99.2	4%	0.039	52%	0.52	C	S	.	.	H	α-helix	trans	-52.6	-39.3	-178.8	-70.3	-57.4	0	0	0	113.5	D60 F65 E66 L67 L108 R111 Y112 H115	D60-F63 HydrophobicContact CB-CD1 4.24Å; D60-F63 HydrophobicContact CB-CD2 4.48Å; D60-F63 HydrophobicContact CB-CE1 3.73Å; D60-F63 HydrophobicContact CB-CE2 4.01Å; D60-F63 HydrophobicContact CB-CZ 3.59Å; D60-F63 WeakPolarHBondContact O-CD2 3.47Å; D60-F63 WeakPolarHBondContact O-CE2 3.35Å; F63-F65 VanDerWaalsContact C-N 3.29Å; F63-F65 PolarHBondContact O-N 2.95Å; F63-E66 PolarHBondContact O-N 2.93Å; F63-L67 VanDerWaalsContact O-CB 3.3Å; F63-L67 WeakPolarHBondContact O-CB 3.41Å; F63-L67 WeakPolarHBondContact O-CD1 3.43Å; F63-L67 WeakPolarHBondContact O-CG 3.44Å; F63-L67 PolarHBondContact O-N 2.92Å; F63-L108 HydrophobicContact CD1-CD1 3.72Å; F63-L108 HydrophobicContact CE1-CD1 4.11Å; F63-R111 HydrophobicContact CD1-CB 4.5Å; F63-R111 HydrophobicContact CE1-CB 3.74Å; F63-R111 HydrophobicContact CZ-CB 3.98Å; F63-Y112 HydrophobicContact CB-CD2 3.55Å; F63-Y112 HydrophobicContact CB-CE2 4.49Å; F63-Y112 HydrophobicContact CB-CG 4.14Å; F63-Y112 HydrophobicContact CD2-CD2 4.32Å; F63-Y112 HydrophobicContact CG-CD2 4.24Å; F63-H115 HydrophobicContact CD2-CB 3.98Å; F63-H115 AromaticContact CD2-CG 3.97Å; F63-H115 HydrophobicContact CE2-CB 3.6Å; F63-H115 AromaticContact CE2-CG 3.73Å
64	E	46	Very low	42.1	Very low	74 Å²	74	94.7 Å²	94.7	35%	0.346	50%	0.495	S	S	.	.	H	α-helix	trans	-66	-33.3	177.9	-64.9	-168	168.5	0	0	112.4	N62 N74 Y112	N62-E64 PolarHBondContact O-N 3.45Å; N62-E64 VanDerWaalsContact O-N 3.15Å; E64-N74 PolarHBondContact OE2-ND2 3.11Å; E64-Y112 HydrophobicContact CG-CD2 4.41Å; E64-Y112 HydrophobicContact CG-CE2 3.57Å; E64-Y112 PolarHBondContact OE1-OH 3.34Å
65	F	47.5	Very low	43.4	Very low	178 Å²	178	95.3 Å²	95.3	78%	0.781	49%	0.487	S	S	*	.	H	α-helix	trans	-73.8	-42.3	174.8	-177.8	-96.1	0	0	0	111.4	N62 F63 G68	N62-F65 HydrophobicContact CB-CB 4.45Å; N62-F65 WeakPolarHBondContact O-CA 3.07Å; N62-F65 WeakPolarHBondContact O-CB 3.09Å; N62-F65 PolarHBondContact O-N 3.05Å; F63-F65 VanDerWaalsContact C-N 3.29Å; F63-F65 PolarHBondContact O-N 2.95Å; F65-G68 PolarHBondContact O-N 3.19Å
66	E	43.1	Very low	44.7	Very low	107 Å²	107	95.1 Å²	95.1	50%	0.5	48%	0.482	S	S	.	.	H	α-helix	trans	-72.6	-30.6	180	-71.7	-163.7	152.6	0	0	113.8	N62 F63 G68 L108	N62-E66 PolarHBondContact O-N 3.06Å; F63-E66 PolarHBondContact O-N 2.93Å; E66-G68 PolarHBondContact O-N 3.06Å; E66-L108 HydrophobicContact CB-CD2 3.74Å
67	L	48.2	Very low	46.7	Very low	24 Å²	24	93.1 Å²	93.1	13%	0.126	48%	0.475	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-16.2	174.2	-77.1	167.5	0	0	0	112.5	F63 F104 L108 F109 Y112	F63-L67 VanDerWaalsContact O-CB 3.3Å; F63-L67 WeakPolarHBondContact O-CB 3.41Å; F63-L67 WeakPolarHBondContact O-CD1 3.43Å; F63-L67 WeakPolarHBondContact O-CG 3.44Å; F63-L67 PolarHBondContact O-N 2.92Å; L67-F104 HydrophobicContact CD2-CE2 3.87Å; L67-F104 HydrophobicContact CD2-CZ 3.92Å; L67-L108 HydrophobicContact CD2-CB 4.01Å; L67-L108 HydrophobicContact CD2-CD2 3.78Å; L67-L108 HydrophobicContact CD2-CG 3.76Å; L67-L108 HydrophobicContact CG-CD2 3.91Å; L67-L108 HydrophobicContact CG-CG 4.04Å; L67-F109 HydrophobicContact CD1-CD2 4.49Å; L67-F109 HydrophobicContact CD2-CB 4.05Å; L67-Y112 HydrophobicContact CD1-CD1 4.01Å; L67-Y112 HydrophobicContact CD1-CD2 4.5Å; L67-Y112 HydrophobicContact CD1-CG 3.88Å
68	G	45.7	Very low	49	Very low	33 Å²	33	88.8 Å²	88.8	34%	0.34	45%	0.453	S	S	.	.			trans	73.7	154.2	171.4	0	0	0	0	0	114.7	F65 E66 Y75	F65-G68 PolarHBondContact O-N 3.19Å; E66-G68 PolarHBondContact O-N 3.06Å; G68-Y75 WeakPolarHBondContact O-CE2 3.44Å
69	S	34	Very low	50.9	Low	61 Å²	61	83.1 Å²	83.1	43%	0.427	43%	0.427	S	S	.	.			trans	-105.6	151.8	166.1	79.3	0	0	0	0	110.3	T71 D72	S69-T71 VanDerWaalsContact C-N 3.27Å; S69-T71 VanDerWaalsContact OG-CA 3.32Å; S69-T71 WeakPolarHBondContact OG-CA 3.29Å; S69-T71 PolarHBondContact OG-N 3.15Å; S69-D72 PolarHBondContact OG-N 3.42Å
70	P	42.9	Very low	52.8	Low	95 Å²	95	74.6 Å²	74.6	62%	0.617	40%	0.396	S	S	*	.	S	Bend	trans	-71.7	-27.2	162.9	-12.8	28.9	0	0	0	111.6	Y75	P70-Y75 HydrophobicContact CG-CE1 3.9Å
71	T	38.2	Very low	54.3	Low	122 Å²	122	72.9 Å²	72.9	75%	0.748	39%	0.387	S	S	*	.	S	Bend	trans	176.9	115.3	158.3	41.8	0	0	0	0	107.1	S69 D73	S69-T71 VanDerWaalsContact C-N 3.27Å; S69-T71 VanDerWaalsContact OG-CA 3.32Å; S69-T71 WeakPolarHBondContact OG-CA 3.29Å; S69-T71 PolarHBondContact OG-N 3.15Å; T71-D73 PolarHBondContact O-N 2.89Å
72	D	40.6	Very low	55.5	Low	158 Å²	158	67 Å²	67	85%	0.845	37%	0.366	S	S	*	.	S	Bend	trans	67.2	-16.6	174.8	-99.1	-7.1	0	0	0	121.6	S69	S69-D72 PolarHBondContact OG-N 3.42Å
73	D	40.4	Very low	56.8	Low	123 Å²	123	63.3 Å²	63.3	66%	0.658	35%	0.347	S	S	*	.			trans	-102.1	113.1	-179.4	-66.2	-33.5	0	0	0	112.6	T71 Y75	T71-D73 PolarHBondContact O-N 2.89Å; D73-Y75 PolarHBondContact O-N 3.02Å
74	N	53.9	Low	58.5	Low	73 Å²	73	63.2 Å²	63.2	39%	0.39	35%	0.347	S	S	.	.			trans	-48.8	128.9	159	-163.2	-3.2	0	0	0	107.9	E64 E76	E64-N74 PolarHBondContact OE2-ND2 3.11Å; N74-E76 PolarHBondContact O-N 3.35Å
75	Y	61.2	Low	59.6	Low	51 Å²	51	62.2 Å²	62.2	20%	0.2	34%	0.341	C	S	.	.			trans	-62.2	-14.2	-171.7	-70.7	-67.9	0	0	0	113.7	G68 P70 D73 V77 R97 P99 F104	G68-Y75 WeakPolarHBondContact O-CE2 3.44Å; P70-Y75 HydrophobicContact CG-CE1 3.9Å; D73-Y75 PolarHBondContact O-N 3.02Å; Y75-V77 PolarHBondContact O-N 3.07Å; Y75-R97 WeakPolarHBondContact O-CD 3.5Å; Y75-P99 HydrophobicContact CD1-CG 3.51Å; Y75-P99 HydrophobicContact CD2-CG 4.04Å; Y75-P99 HydrophobicContact CE1-CB 4.03Å; Y75-P99 HydrophobicContact CE1-CG 3.26Å; Y75-P99 HydrophobicContact CE2-CG 3.78Å; Y75-P99 HydrophobicContact CG-CG 3.91Å; Y75-F104 AromaticContact CD2-CE2 3.91Å; Y75-F104 HydrophobicContact CD2-CE2 3.91Å; Y75-F104 HydrophobicContact CE2-CD2 4.12Å; Y75-F104 AromaticContact CE2-CE2 3.91Å; Y75-F104 HydrophobicContact CE2-CE2 3.91Å
76	E	70.2	Confident	60.8	Low	105 Å²	105	54 Å²	54	49%	0.491	31%	0.306	S	S	.	.			trans	44.4	42.4	178.7	-66.1	-178.1	177.8	0	0	111.9	N74 V78 R97	N74-E76 PolarHBondContact O-N 3.35Å; E76-V78 PolarHBondContact O-N 2.98Å; E76-R97 WeakPolarHBondContact O-CD 3.44Å; E76-R97 PolarHBondContact O-NH1 2.79Å; E76-R97 IonicContact OE2-CZ 3.74Å; E76-R97 IonicContact OE2-NH1 3.83Å; E76-R97 PolarHBondContact OE2-NH1 2.83Å; E76-R97 IonicContact OE2-NH2 3.09Å; E76-R97 PolarHBondContact OE2-NH2 3.36Å
77	V	78.6	Confident	62.2	Low	8 Å²	8	49 Å²	49	5%	0.048	28%	0.284	C	S	.	.			trans	-70.5	-28.7	-177.7	-175	0	0	0	0	110.6	Y75 F93 Y94 R97 L98 F109	Y75-V77 PolarHBondContact O-N 3.07Å; V77-F93 WeakPolarHBondContact O-CA 3.29Å; V77-Y94 PolarHBondContact O-N 3.25Å; V77-R97 HydrophobicContact CG2-CB 4.23Å; V77-L98 HydrophobicContact CG1-CD2 3.72Å; V77-L98 HydrophobicContact CG1-CG 3.94Å; V77-L98 HydrophobicContact CG2-CD2 4.41Å; V77-F109 HydrophobicContact CB-CE2 3.99Å; V77-F109 HydrophobicContact CB-CZ 4.35Å; V77-F109 HydrophobicContact CG1-CE2 3.81Å; V77-F109 HydrophobicContact CG1-CZ 3.66Å; V77-F109 HydrophobicContact CG2-CE2 4.45Å
78	V	83.2	Confident	64	Low	6 Å²	6	49.9 Å²	49.9	4%	0.036	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	133.7	-177.3	-168.2	0	0	0	0	108.8	E76 V91 V92 F93 F109 Y112 V116	E76-V78 PolarHBondContact O-N 2.98Å; V78-V91 HydrophobicContact CG1-CG1 3.73Å; V78-V92 CarbonylContact C-O 3.6Å; V78-V92 VanDerWaalsContact CA-O 3.31Å; V78-V92 WeakPolarHBondContact CA-O 3.47Å; V78-F93 HydrophobicContact CB-CD1 4.28Å; V78-F93 HydrophobicContact CB-CE1 4.03Å; V78-F93 HydrophobicContact CG1-CD1 3.99Å; V78-F93 HydrophobicContact CG1-CE1 3.39Å; V78-F93 HydrophobicContact CG1-CZ 3.95Å; V78-F93 HydrophobicContact CG2-CD1 3.68Å; V78-F93 HydrophobicContact CG2-CE1 3.51Å; V78-F109 HydrophobicContact CG2-CE2 4.22Å; V78-F109 HydrophobicContact CG2-CZ 4.43Å; V78-Y112 HydrophobicContact CB-CE1 4.22Å; V78-Y112 HydrophobicContact CG2-CD1 4.45Å; V78-Y112 HydrophobicContact CG2-CE1 3.84Å; V78-V116 HydrophobicContact CG1-CG1 3.81Å
79	D	78.5	Confident	65.8	Low	29 Å²	29	48.6 Å²	48.6	16%	0.155	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	160.3	177.5	-165.4	12.1	0	0	0	111	V91 V92 Y94	D79-V91 CarbonylContact O-C 3.36Å; D79-V91 WeakPolarHBondContact O-CA 3.43Å; D79-V92 PolarHBondContact N-O 2.92Å; D79-V92 PolarHBondContact O-N 3.42Å; D79-Y94 HydrophobicContact CB-CE2 3.87Å
80	V	76.6	Confident	68.3	Low	6 Å²	6	45.8 Å²	45.8	4%	0.036	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	100.7	176.2	176.2	0	0	0	0	108.4	G82 V91 F120 L395 L398	V80-G82 PolarHBondContact O-N 3.43Å; V80-V91 HydrophobicContact CG2-CG2 4.36Å; V80-F120 HydrophobicContact CB-CZ 4.3Å; V80-F120 HydrophobicContact CG1-CE1 4.2Å; V80-F120 HydrophobicContact CG1-CZ 3.97Å; V80-F120 HydrophobicContact CG2-CE1 4.36Å; V80-F120 HydrophobicContact CG2-CE2 3.72Å; V80-F120 HydrophobicContact CG2-CZ 3.41Å; V80-F120 VanDerWaalsContact CG2-CZ 3.41Å; V80-L395 HydrophobicContact CB-CD2 4.27Å; V80-L395 HydrophobicContact CG2-CD2 3.37Å; V80-L398 HydrophobicContact CG1-CD2 4.42Å
81	V	71.8	Confident	70.4	Confident	18 Å²	18	41.2 Å²	41.2	11%	0.109	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	-7.2	-167	173	0	0	0	0	112.7	V90 V92 C206 H209	V81-V90 PolarHBondContact N-O 3.21Å; V81-V90 VanDerWaalsContact N-O 3.09Å; V81-V92 HydrophobicContact CB-CG2 3.88Å; V81-V92 HydrophobicContact CG2-CB 3.91Å; V81-V92 HydrophobicContact CG2-CG2 3.31Å; V81-C206 VanDerWaalsContact CG1-SG 3.57Å; V81-H209 HydrophobicContact CG1-CB 3.91Å; V81-H209 VanDerWaalsContact CG1-CG 3.43Å; V81-H209 WeakPolarHBondContact CG1-ND1 3.47Å; V81-H209 WeakPolarHBondContact CG2-CE1 3.43Å; V81-H209 WeakPolarHBondContact CG2-NE2 3.36Å
82	G	73.3	Confident	72.7	Confident	26 Å²	26	35.5 Å²	35.5	27%	0.268	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	122.8	-139.6	-178.7	0	0	0	0	0	110.9	V80 P89 V90	V80-G82 PolarHBondContact O-N 3.43Å; G82-P89 CarbonylContact O-C 3.6Å; G82-P89 WeakPolarHBondContact O-CA 3.5Å; G82-V90 PolarHBondContact O-N 2.97Å
83	D	75.7	Confident	75	Confident	24 Å²	24	28.9 Å²	28.9	13%	0.128	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	147.9	-175.4	-67.2	-45.8	0	0	0	113.5	R88 P89 R205 R314	D83-R88 CarbonylContact C-O 3.56Å; D83-R88 WeakPolarHBondContact CA-O 3.25Å; D83-R88 VanDerWaalsContact OD1-C 3.29Å; D83-P89 WeakPolarHBondContact OD1-CA 3.16Å; D83-R205 PolarHBondContact O-N 3.42Å; D83-R314 WeakPolarHBondContact OD2-CD 3.43Å; D83-R314 IonicContact OD2-CZ 3.82Å; D83-R314 IonicContact OD2-NE 3.9Å; D83-R314 IonicContact OD2-NH1 2.82Å; D83-R314 PolarHBondContact OD2-NH1 3.41Å
84	D	79.2	Confident	77	Confident	6 Å²	6	23.8 Å²	23.8	3%	0.032	12%	0.122	C	C	.	.	B	Isolated β-bridge	trans	-70.6	174.8	167	78	5.8	0	0	0	110.9	A86 G87 R88 V90 S126	D84-A86 PolarHBondContact O-N 3.09Å; D84-A86 VanDerWaalsContact O-N 3.08Å; D84-A86 VanDerWaalsContact OD1-CA 3.24Å; D84-A86 WeakPolarHBondContact OD1-CA 3.38Å; D84-A86 VanDerWaalsContact OD1-CB 3.26Å; D84-A86 WeakPolarHBondContact OD1-CB 3.42Å; D84-A86 PolarHBondContact OD1-N 3.31Å; D84-G87 WeakPolarHBondContact O-CA 3.37Å; D84-G87 PolarHBondContact O-N 2.98Å; D84-G87 PolarHBondContact OD1-N 3.22Å; D84-G87 VanDerWaalsContact OD1-N 3.09Å; D84-R88 PolarHBondContact N-O 2.7Å; D84-R88 WeakPolarHBondContact OD1-CB 3.38Å; D84-R88 WeakPolarHBondContact OD1-CG 3.47Å; D84-R88 PolarHBondContact OD1-N 3.02Å; D84-R88 WeakPolarHBondContact OD2-CD 3.41Å; D84-R88 IonicContact OD2-CZ 2.95Å; D84-R88 IonicContact OD2-NE 3.84Å; D84-R88 IonicContact OD2-NH1 3.61Å; D84-R88 PolarHBondContact OD2-NH1 2.79Å; D84-V90 HydrophobicContact CB-CG2 3.76Å; D84-V90 VanDerWaalsContact N-CG2 3.33Å; D84-S126 PolarHBondContact OD2-OG 3.48Å
85	K	70.2	Confident	78.2	Confident	54 Å²	54	20.4 Å²	20.4	24%	0.235	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-14.9	177.7	-77.3	169.2	-176.7	178.2	0	114.6	G87 R201 E202 V203 R205 I278	K85-G87 VanDerWaalsContact C-N 3.32Å; K85-R201 WeakPolarHBondContact CE-O 3.35Å; K85-R201 PolarHBondContact NZ-O 2.76Å; K85-E202 WeakPolarHBondContact CD-O 3.38Å; K85-E202 VanDerWaalsContact CE-O 3.3Å; K85-E202 WeakPolarHBondContact CE-O 3.48Å; K85-E202 PolarHBondContact NZ-O 3.42Å; K85-V203 PolarHBondContact N-O 2.93Å; K85-V203 VanDerWaalsContact N-O 3.14Å; K85-R205 HydrophobicContact CG-CG 3.7Å; K85-I278 HydrophobicContact CB-CD1 3.74Å; K85-I278 HydrophobicContact CB-CG1 4.31Å; K85-I278 HydrophobicContact CB-CG2 3.95Å
86	A	71.5	Confident	78.6	Confident	5 Å²	5	20.9 Å²	20.9	4%	0.041	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.9	-0.2	172.5	0	0	0	0	0	112.4	D84 R88 I278	D84-A86 PolarHBondContact O-N 3.09Å; D84-A86 VanDerWaalsContact O-N 3.08Å; D84-A86 VanDerWaalsContact OD1-CA 3.24Å; D84-A86 WeakPolarHBondContact OD1-CA 3.38Å; D84-A86 VanDerWaalsContact OD1-CB 3.26Å; D84-A86 WeakPolarHBondContact OD1-CB 3.42Å; D84-A86 PolarHBondContact OD1-N 3.31Å; A86-R88 HydrophobicContact CB-CG 4.07Å; A86-I278 HydrophobicContact CB-CD1 3.89Å; A86-I278 HydrophobicContact CB-CG1 3.52Å
87	G	73.7	Confident	78.8	Confident	3 Å²	3	19.8 Å²	19.8	3%	0.031	10%	0.099	C	C	.	.	S	Bend	trans	75.7	27.9	-176.8	0	0	0	0	0	113.6	D84 K85 R314	D84-G87 WeakPolarHBondContact O-CA 3.37Å; D84-G87 PolarHBondContact O-N 2.98Å; D84-G87 PolarHBondContact OD1-N 3.22Å; D84-G87 VanDerWaalsContact OD1-N 3.09Å; K85-G87 VanDerWaalsContact C-N 3.32Å; G87-R314 VanDerWaalsContact CA-NH2 3.32Å; G87-R314 PolarHBondContact O-NH1 3.36Å
88	R	84.7	Confident	78.7	Confident	41 Å²	41	19.9 Å²	19.9	16%	0.155	10%	0.099	C	C	.	.			trans	-96.1	137.1	176.2	-56.2	175.9	-165.3	136.8	-2.6	109.6	D83 D84 A86 V90 D124 S275	D83-R88 CarbonylContact C-O 3.56Å; D83-R88 WeakPolarHBondContact CA-O 3.25Å; D83-R88 VanDerWaalsContact OD1-C 3.29Å; D84-R88 PolarHBondContact N-O 2.7Å; D84-R88 WeakPolarHBondContact OD1-CB 3.38Å; D84-R88 WeakPolarHBondContact OD1-CG 3.47Å; D84-R88 PolarHBondContact OD1-N 3.02Å; D84-R88 WeakPolarHBondContact OD2-CD 3.41Å; D84-R88 IonicContact OD2-CZ 2.95Å; D84-R88 IonicContact OD2-NE 3.84Å; D84-R88 IonicContact OD2-NH1 3.61Å; D84-R88 PolarHBondContact OD2-NH1 2.79Å; A86-R88 HydrophobicContact CB-CG 4.07Å; R88-V90 PolarHBondContact O-N 3.05Å; R88-D124 VanDerWaalsContact CB-O 3.3Å; R88-D124 WeakPolarHBondContact CB-O 3.42Å; R88-D124 HydrophobicContact CG-CB 4.34Å; R88-S275 WeakPolarHBondContact CD-OG 3.32Å; R88-S275 VanDerWaalsContact CG-OG 3.31Å; R88-S275 WeakPolarHBondContact CG-OG 3.48Å; R88-S275 PolarHBondContact NE-OG 3.18Å
89	P	84.4	Confident	78.1	Confident	7 Å²	7	20.4 Å²	20.4	5%	0.045	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.6	140.7	173.8	-23.2	31	0	0	0	111.7	G82 D83 F120 Q123 D124 Y125 S126	G82-P89 CarbonylContact O-C 3.6Å; G82-P89 WeakPolarHBondContact O-CA 3.5Å; D83-P89 WeakPolarHBondContact OD1-CA 3.16Å; P89-F120 HydrophobicContact CB-CD1 3.61Å; P89-F120 HydrophobicContact CB-CE1 3.86Å; P89-F120 HydrophobicContact CG-CD1 3.91Å; P89-F120 HydrophobicContact CG-CE1 4.34Å; P89-Q123 HydrophobicContact CG-CG 4.23Å; P89-D124 WeakPolarHBondContact CD-O 3.14Å; P89-Y125 WeakPolarHBondContact O-CA 3.34Å; P89-S126 PolarHBondContact O-N 3.18Å
90	V	85.7	Confident	77.7	Confident	1 Å²	1	20.5 Å²	20.5	1%	0.006	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	106.9	178.6	-178.1	0	0	0	0	108.8	V81 G82 D84 R88 V92 S126 I128 V204	V81-V90 PolarHBondContact N-O 3.21Å; V81-V90 VanDerWaalsContact N-O 3.09Å; G82-V90 PolarHBondContact O-N 2.97Å; D84-V90 HydrophobicContact CB-CG2 3.76Å; D84-V90 VanDerWaalsContact N-CG2 3.33Å; R88-V90 PolarHBondContact O-N 3.05Å; V90-V92 HydrophobicContact CG1-CG2 4.07Å; V90-S126 WeakPolarHBondContact CA-O 3.43Å; V90-I128 HydrophobicContact CG1-CD1 3.55Å; V90-I128 HydrophobicContact CG1-CG1 3.75Å; V90-V204 HydrophobicContact CG1-CG2 4.39Å; V90-V204 HydrophobicContact CG2-CG1 4.32Å
91	V	87.3	Confident	77.4	Confident	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	131.4	173.3	-171.2	0	0	0	0	108.6	V78 D79 V80 F93 L117 F120 Y125 S126 V127 I128	V78-V91 HydrophobicContact CG1-CG1 3.73Å; D79-V91 CarbonylContact O-C 3.36Å; D79-V91 WeakPolarHBondContact O-CA 3.43Å; V80-V91 HydrophobicContact CG2-CG2 4.36Å; V91-F93 HydrophobicContact CB-CE2 4.23Å; V91-F93 HydrophobicContact CB-CZ 4.47Å; V91-F93 HydrophobicContact CG1-CE1 4.29Å; V91-F93 HydrophobicContact CG1-CE2 3.68Å; V91-F93 HydrophobicContact CG1-CZ 3.52Å; V91-L117 HydrophobicContact CB-CD2 4.42Å; V91-L117 HydrophobicContact CG1-CD2 4.18Å; V91-L117 HydrophobicContact CG2-CD2 4.23Å; V91-F120 HydrophobicContact CG2-CD2 3.79Å; V91-F120 HydrophobicContact CG2-CE2 4.02Å; V91-F120 HydrophobicContact CG2-CG 4.18Å; V91-Y125 HydrophobicContact CG2-CD2 4.31Å; V91-S126 PolarHBondContact N-O 2.82Å; V91-V127 HydrophobicContact CB-CG2 4.4Å; V91-V127 CarbonylContact O-C 3.6Å; V91-V127 VanDerWaalsContact O-CA 3.23Å; V91-V127 WeakPolarHBondContact O-CA 3.19Å; V91-I128 PolarHBondContact O-N 3.47Å
92	V	86.9	Confident	77.3	Confident	1 Å²	1	30.8 Å²	30.8	1%	0.006	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	135.1	-176.2	-176.4	0	0	0	0	110.2	V78 D79 V81 V90 Y94 I128 F130	V78-V92 CarbonylContact C-O 3.6Å; V78-V92 VanDerWaalsContact CA-O 3.31Å; V78-V92 WeakPolarHBondContact CA-O 3.47Å; D79-V92 PolarHBondContact N-O 2.92Å; D79-V92 PolarHBondContact O-N 3.42Å; V81-V92 HydrophobicContact CB-CG2 3.88Å; V81-V92 HydrophobicContact CG2-CB 3.91Å; V81-V92 HydrophobicContact CG2-CG2 3.31Å; V90-V92 HydrophobicContact CG1-CG2 4.07Å; V92-Y94 HydrophobicContact CB-CE2 4.38Å; V92-Y94 HydrophobicContact CG1-CD1 4.14Å; V92-Y94 HydrophobicContact CG1-CD2 4.44Å; V92-Y94 HydrophobicContact CG1-CE1 3.56Å; V92-Y94 HydrophobicContact CG1-CE2 3.88Å; V92-Y94 VanDerWaalsContact CG1-CZ 3.42Å; V92-I128 CarbonylContact C-O 3.54Å; V92-I128 VanDerWaalsContact CA-O 3.3Å; V92-I128 WeakPolarHBondContact CA-O 3.37Å; V92-I128 HydrophobicContact CG1-CB 4.38Å; V92-I128 HydrophobicContact CG2-CB 4.09Å; V92-I128 HydrophobicContact CG2-CD1 4.37Å; V92-F130 HydrophobicContact CG1-CD2 3.57Å; V92-F130 HydrophobicContact CG1-CE2 3.45Å; V92-F130 VanDerWaalsContact CG1-CE2 3.45Å
93	F	87.8	Confident	77.2	Confident	20 Å²	20	35.3 Å²	35.3	9%	0.088	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	124	179.4	-65	-76.2	0	0	0	109.9	V77 V78 V91 L113 L117 V127 I128 Y129 F130	V77-F93 WeakPolarHBondContact O-CA 3.29Å; V78-F93 HydrophobicContact CB-CD1 4.28Å; V78-F93 HydrophobicContact CB-CE1 4.03Å; V78-F93 HydrophobicContact CG1-CD1 3.99Å; V78-F93 HydrophobicContact CG1-CE1 3.39Å; V78-F93 HydrophobicContact CG1-CZ 3.95Å; V78-F93 HydrophobicContact CG2-CD1 3.68Å; V78-F93 HydrophobicContact CG2-CE1 3.51Å; V91-F93 HydrophobicContact CB-CE2 4.23Å; V91-F93 HydrophobicContact CB-CZ 4.47Å; V91-F93 HydrophobicContact CG1-CE1 4.29Å; V91-F93 HydrophobicContact CG1-CE2 3.68Å; V91-F93 HydrophobicContact CG1-CZ 3.52Å; F93-L113 HydrophobicContact CD1-CD1 3.96Å; F93-L113 HydrophobicContact CE1-CD1 2.99Å; F93-L113 HydrophobicContact CE1-CG 4.47Å; F93-L113 HydrophobicContact CZ-CD1 3.37Å; F93-L117 HydrophobicContact CE2-CD2 4.46Å; F93-L117 HydrophobicContact CZ-CD1 4.43Å; F93-L117 HydrophobicContact CZ-CD2 3.98Å; F93-L117 HydrophobicContact CZ-CG 4.31Å; F93-V127 HydrophobicContact CD2-CG1 3.29Å; F93-V127 HydrophobicContact CE2-CB 4.34Å; F93-V127 HydrophobicContact CE2-CG1 3.3Å; F93-V127 HydrophobicContact CE2-CG2 4.1Å; F93-I128 PolarHBondContact N-O 3.39Å; F93-Y129 HydrophobicContact CB-CD2 3.77Å; F93-F130 PolarHBondContact O-N 2.87Å
94	Y	82.7	Confident	77.3	Confident	15 Å²	15	34.9 Å²	34.9	6%	0.059	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	93.3	-177.2	-61.4	-67.7	0	0	0	110.8	V77 D79 V92 F96 R97 F130 H209	V77-Y94 PolarHBondContact O-N 3.25Å; D79-Y94 HydrophobicContact CB-CE2 3.87Å; V92-Y94 HydrophobicContact CB-CE2 4.38Å; V92-Y94 HydrophobicContact CG1-CD1 4.14Å; V92-Y94 HydrophobicContact CG1-CD2 4.44Å; V92-Y94 HydrophobicContact CG1-CE1 3.56Å; V92-Y94 HydrophobicContact CG1-CE2 3.88Å; V92-Y94 VanDerWaalsContact CG1-CZ 3.42Å; Y94-F96 VanDerWaalsContact C-N 3.26Å; Y94-F96 AromaticContact CD1-CE1 3.63Å; Y94-F96 HydrophobicContact CD1-CE1 3.63Å; Y94-F96 HydrophobicContact CD1-CZ 4.11Å; Y94-F96 AromaticContact CG-CE1 3.95Å; Y94-F96 HydrophobicContact CG-CE1 3.95Å; Y94-F96 HydrophobicContact CG-CZ 4.28Å; Y94-F96 PolarHBondContact O-N 3.39Å; Y94-R97 WeakPolarHBondContact O-CB 3.37Å; Y94-R97 PolarHBondContact O-N 3.45Å; Y94-F130 HydrophobicContact CD1-CB 4.27Å; Y94-F130 AromaticContact CD1-CD2 3.62Å; Y94-F130 HydrophobicContact CD1-CD2 3.62Å; Y94-F130 HydrophobicContact CD1-CE2 4.3Å; Y94-F130 HydrophobicContact CD1-CG 4.15Å; Y94-F130 AromaticContact CE1-CD2 3.58Å; Y94-F130 HydrophobicContact CE1-CD2 3.58Å; Y94-F130 AromaticContact CE1-CE2 3.79Å; Y94-F130 HydrophobicContact CE1-CE2 3.79Å; Y94-F130 HydrophobicContact CE1-CG 4.41Å; Y94-H209 PolarHBondContact OH-NE2 2.88Å
95	A	78.7	Confident	77.4	Confident	2 Å²	2	38.8 Å²	38.8	2%	0.017	20%	0.199	C	C	.	.	G	3₁₀ helix	trans	-66.7	-27.5	-173.2	0	0	0	0	0	113.9	R97 L98 Y129 F130 W134	A95-R97 PolarHBondContact O-N 3.13Å; A95-L98 WeakPolarHBondContact O-CB 3.19Å; A95-L98 PolarHBondContact O-N 2.98Å; A95-Y129 HydrophobicContact CB-CE2 3.71Å; A95-Y129 WeakPolarHBondContact CB-OH 3.42Å; A95-F130 WeakPolarHBondContact CB-O 3.5Å; A95-F130 PolarHBondContact N-O 3.36Å; A95-W134 VanDerWaalsContact CB-CD1 3.49Å
96	F	71.1	Confident	78	Confident	62 Å²	62	37.2 Å²	37.2	27%	0.272	19%	0.191	S	C	.	.	G	3₁₀ helix	trans	-67.6	-17.2	174.2	67.9	-83.5	0	0	0	113.9	Y94 Y132	Y94-F96 VanDerWaalsContact C-N 3.26Å; Y94-F96 AromaticContact CD1-CE1 3.63Å; Y94-F96 HydrophobicContact CD1-CE1 3.63Å; Y94-F96 HydrophobicContact CD1-CZ 4.11Å; Y94-F96 AromaticContact CG-CE1 3.95Å; Y94-F96 HydrophobicContact CG-CE1 3.95Å; Y94-F96 HydrophobicContact CG-CZ 4.28Å; Y94-F96 PolarHBondContact O-N 3.39Å; F96-Y132 HydrophobicContact CB-CD2 4.07Å; F96-Y132 HydrophobicContact CB-CE2 3.93Å; F96-Y132 WeakPolarHBondContact CB-O 3.39Å; F96-Y132 HydrophobicContact CD1-CD1 4.4Å; F96-Y132 AromaticContact CD1-CD2 3.93Å; F96-Y132 HydrophobicContact CD1-CD2 3.93Å; F96-Y132 AromaticContact CD1-CE1 3.8Å; F96-Y132 HydrophobicContact CD1-CE1 3.8Å; F96-Y132 AromaticContact CD1-CE2 3.24Å; F96-Y132 HydrophobicContact CD1-CE2 3.24Å; F96-Y132 HydrophobicContact CD1-CG 4.47Å; F96-Y132 AromaticContact CD1-CZ 3.19Å; F96-Y132 WeakPolarHBondContact CD1-OH 3.36Å; F96-Y132 HydrophobicContact CD2-CE2 4.11Å; F96-Y132 AromaticContact CE1-CE1 3.83Å; F96-Y132 HydrophobicContact CE1-CE1 3.83Å; F96-Y132 AromaticContact CE1-CE2 3.68Å; F96-Y132 HydrophobicContact CE1-CE2 3.68Å; F96-Y132 AromaticContact CE1-CZ 3.17Å; F96-Y132 WeakPolarHBondContact CE1-OH 2.75Å; F96-Y132 HydrophobicContact CE2-CE2 4.46Å; F96-Y132 HydrophobicContact CG-CD2 4.12Å; F96-Y132 AromaticContact CG-CE2 3.49Å; F96-Y132 HydrophobicContact CG-CE2 3.49Å; F96-Y132 VanDerWaalsContact CG-CE2 3.49Å; F96-Y132 AromaticContact CG-CZ 3.92Å; F96-Y132 HydrophobicContact CZ-CE2 4.28Å; F96-Y132 AromaticContact CZ-CZ 3.88Å; F96-Y132 WeakPolarHBondContact CZ-OH 2.82Å; F96-Y132 PolarHBondContact N-O 3.37Å
97	R	74.1	Confident	78.7	Confident	82 Å²	82	39.3 Å²	39.3	31%	0.309	20%	0.2	S	C	.	.	G	3₁₀ helix	trans	-86.8	-9.7	175.8	-64.7	-175.7	170.2	-170.8	-15.7	112.6	Y75 E76 V77 Y94 A95 P99	Y75-R97 WeakPolarHBondContact O-CD 3.5Å; E76-R97 WeakPolarHBondContact O-CD 3.44Å; E76-R97 PolarHBondContact O-NH1 2.79Å; E76-R97 IonicContact OE2-CZ 3.74Å; E76-R97 IonicContact OE2-NH1 3.83Å; E76-R97 PolarHBondContact OE2-NH1 2.83Å; E76-R97 IonicContact OE2-NH2 3.09Å; E76-R97 PolarHBondContact OE2-NH2 3.36Å; V77-R97 HydrophobicContact CG2-CB 4.23Å; Y94-R97 WeakPolarHBondContact O-CB 3.37Å; Y94-R97 PolarHBondContact O-N 3.45Å; A95-R97 PolarHBondContact O-N 3.13Å; R97-P99 WeakPolarHBondContact O-CD 3.46Å
98	L	75.6	Confident	79.1	Confident	10 Å²	10	39.8 Å²	39.8	5%	0.052	20%	0.202	C	C	.	.			trans	-64.6	128.4	174.3	-75.5	168.6	0	0	0	110.2	V77 A95 F104 Y106 F109 N138	V77-L98 HydrophobicContact CG1-CD2 3.72Å; V77-L98 HydrophobicContact CG1-CG 3.94Å; V77-L98 HydrophobicContact CG2-CD2 4.41Å; A95-L98 WeakPolarHBondContact O-CB 3.19Å; A95-L98 PolarHBondContact O-N 2.98Å; L98-F104 HydrophobicContact CD2-CE1 3.93Å; L98-Y106 HydrophobicContact CD2-CE1 4.18Å; L98-F109 HydrophobicContact CD2-CD1 4.14Å; L98-F109 HydrophobicContact CD2-CE1 3.74Å; L98-F109 HydrophobicContact CD2-CE2 4.33Å; L98-F109 HydrophobicContact CD2-CZ 3.85Å; L98-N138 WeakPolarHBondContact O-CB 3.36Å; L98-N138 VanDerWaalsContact O-CG 3.24Å; L98-N138 PolarHBondContact O-ND2 3.02Å
99	P	69.8	Low	79.1	Confident	17 Å²	17	38.2 Å²	38.2	11%	0.11	20%	0.197	C	C	.	.			trans	-77	175.3	178.2	-10.9	28.1	0	0	0	112.3	Y75 R97 F104 Y106	Y75-P99 HydrophobicContact CD1-CG 3.51Å; Y75-P99 HydrophobicContact CD2-CG 4.04Å; Y75-P99 HydrophobicContact CE1-CB 4.03Å; Y75-P99 HydrophobicContact CE1-CG 3.26Å; Y75-P99 HydrophobicContact CE2-CG 3.78Å; Y75-P99 HydrophobicContact CG-CG 3.91Å; R97-P99 WeakPolarHBondContact O-CD 3.46Å; P99-F104 HydrophobicContact CB-CB 4.02Å; P99-F104 HydrophobicContact CB-CD2 4.11Å; P99-F104 HydrophobicContact CB-CG 4.17Å; P99-F104 HydrophobicContact CG-CB 4.28Å; P99-F104 HydrophobicContact CG-CD2 3.46Å; P99-F104 VanDerWaalsContact CG-CD2 3.46Å; P99-F104 HydrophobicContact CG-CE2 3.82Å; P99-F104 HydrophobicContact CG-CG 3.88Å; P99-Y106 PolarHBondContact O-OH 3.36Å
100	S	71	Confident	79.2	Confident	30 Å²	30	37.9 Å²	37.9	21%	0.21	20%	0.195	C	C	.	.			trans	-61.5	137.3	178.4	178.3	0	0	0	0	111.4	Q102 V103 F104 C137 N138	S100-Q102 PolarHBondContact O-N 3.48Å; S100-Q102 PolarHBondContact OG-N 3.18Å; S100-V103 PolarHBondContact O-N 3.15Å; S100-F104 VanDerWaalsContact O-CB 3.29Å; S100-F104 WeakPolarHBondContact O-CB 3.37Å; S100-F104 PolarHBondContact O-N 2.91Å; S100-C137 WeakPolarHBondContact CA-O 3.23Å; S100-C137 PolarHBondContact OG-O 2.82Å; S100-N138 WeakPolarHBondContact CA-OD1 3.31Å; S100-N138 PolarHBondContact N-OD1 3.06Å
101	S	70.1	Confident	79.1	Confident	62 Å²	62	43 Å²	43	43%	0.434	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-11.7	175.4	55	0	0	0	0	116	C137	S101-C137 PolarHBondContact N-O 3.03Å; S101-C137 PolarHBondContact OG-O 3.37Å; S101-C137 VanDerWaalsContact OG-O 3.11Å
102	Q	70	Confident	79	Confident	178 Å²	178	43.7 Å²	43.7	83%	0.832	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-23.2	174.7	-65	180	-7.7	0	0	113.2	S100	S100-Q102 PolarHBondContact O-N 3.48Å; S100-Q102 PolarHBondContact OG-N 3.18Å
103	V	72.2	Confident	78.9	Confident	122 Å²	122	44.4 Å²	44.4	74%	0.739	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-118.9	-28	-173.9	-172.9	0	0	0	0	111.1	S100	S100-V103 PolarHBondContact O-N 3.15Å
104	F	76	Confident	78.9	Confident	14 Å²	14	43.7 Å²	43.7	6%	0.061	22%	0.217	C	C	.	.			trans	-89.8	125.8	-173.3	-165.2	-117.9	0	0	0	112.7	L67 Y75 L98 P99 S100 Y106 F109	L67-F104 HydrophobicContact CD2-CE2 3.87Å; L67-F104 HydrophobicContact CD2-CZ 3.92Å; Y75-F104 AromaticContact CD2-CE2 3.91Å; Y75-F104 HydrophobicContact CD2-CE2 3.91Å; Y75-F104 HydrophobicContact CE2-CD2 4.12Å; Y75-F104 AromaticContact CE2-CE2 3.91Å; Y75-F104 HydrophobicContact CE2-CE2 3.91Å; L98-F104 HydrophobicContact CD2-CE1 3.93Å; P99-F104 HydrophobicContact CB-CB 4.02Å; P99-F104 HydrophobicContact CB-CD2 4.11Å; P99-F104 HydrophobicContact CB-CG 4.17Å; P99-F104 HydrophobicContact CG-CB 4.28Å; P99-F104 HydrophobicContact CG-CD2 3.46Å; P99-F104 VanDerWaalsContact CG-CD2 3.46Å; P99-F104 HydrophobicContact CG-CE2 3.82Å; P99-F104 HydrophobicContact CG-CG 3.88Å; S100-F104 VanDerWaalsContact O-CB 3.29Å; S100-F104 WeakPolarHBondContact O-CB 3.37Å; S100-F104 PolarHBondContact O-N 2.91Å; F104-Y106 HydrophobicContact CB-CD2 4.4Å; F104-Y106 HydrophobicContact CB-CE2 4.12Å; F104-Y106 HydrophobicContact CD1-CD1 4.12Å; F104-Y106 AromaticContact CD1-CD2 3.9Å; F104-Y106 HydrophobicContact CD1-CD2 3.9Å; F104-Y106 HydrophobicContact CD1-CE1 4.01Å; F104-Y106 AromaticContact CD1-CE2 3.76Å; F104-Y106 HydrophobicContact CD1-CE2 3.76Å; F104-Y106 HydrophobicContact CD1-CG 4.07Å; F104-Y106 AromaticContact CD1-CZ 3.84Å; F104-Y106 HydrophobicContact CE1-CD1 4.37Å; F104-Y106 HydrophobicContact CE1-CE1 4.32Å; F104-Y106 HydrophobicContact CG-CE2 4.45Å; F104-Y106 WeakPolarHBondContact O-CD2 3.3Å; F104-Y106 PolarHBondContact O-N 3.32Å; F104-F109 HydrophobicContact CD1-CB 4.46Å; F104-F109 HydrophobicContact CE1-CB 3.45Å; F104-F109 VanDerWaalsContact CE1-CB 3.45Å; F104-F109 HydrophobicContact CE1-CD1 4.08Å; F104-F109 HydrophobicContact CE1-CD2 4Å; F104-F109 AromaticContact CE1-CG 3.56Å; F104-F109 HydrophobicContact CE1-CG 3.56Å; F104-F109 HydrophobicContact CZ-CB 3.68Å; F104-F109 AromaticContact CZ-CD2 3.76Å; F104-F109 HydrophobicContact CZ-CD2 3.76Å; F104-F109 AromaticContact CZ-CG 3.78Å; F104-F109 HydrophobicContact CZ-CG 3.78Å
105	D	81.4	Confident	79	Confident	88 Å²	88	45.2 Å²	45.2	47%	0.471	23%	0.225	S	C	.	.			trans	-76.7	94	171.8	-169.6	-18.8	0	0	0	110.4	E107 L108 F109	D105-E107 PolarHBondContact O-N 3.44Å; D105-E107 WeakPolarHBondContact OD1-CA 3Å; D105-E107 WeakPolarHBondContact OD1-CB 3.32Å; D105-E107 PolarHBondContact OD1-N 2.91Å; D105-L108 HydrophobicContact CB-CB 3.84Å; D105-L108 PolarHBondContact O-N 3.24Å; D105-L108 PolarHBondContact OD1-N 2.89Å; D105-F109 WeakPolarHBondContact O-CB 3.43Å; D105-F109 PolarHBondContact O-N 2.91Å
106	Y	83.9	Confident	79.2	Confident	21 Å²	21	45.6 Å²	45.6	8%	0.082	23%	0.227	C	C	.	.	H	α-helix	trans	-65.4	-22.4	176	-84.8	-81.9	0	0	0	113.5	L98 P99 F104 F109 L110 N138 P140 W144	L98-Y106 HydrophobicContact CD2-CE1 4.18Å; P99-Y106 PolarHBondContact O-OH 3.36Å; F104-Y106 HydrophobicContact CB-CD2 4.4Å; F104-Y106 HydrophobicContact CB-CE2 4.12Å; F104-Y106 HydrophobicContact CD1-CD1 4.12Å; F104-Y106 AromaticContact CD1-CD2 3.9Å; F104-Y106 HydrophobicContact CD1-CD2 3.9Å; F104-Y106 HydrophobicContact CD1-CE1 4.01Å; F104-Y106 AromaticContact CD1-CE2 3.76Å; F104-Y106 HydrophobicContact CD1-CE2 3.76Å; F104-Y106 HydrophobicContact CD1-CG 4.07Å; F104-Y106 AromaticContact CD1-CZ 3.84Å; F104-Y106 HydrophobicContact CE1-CD1 4.37Å; F104-Y106 HydrophobicContact CE1-CE1 4.32Å; F104-Y106 HydrophobicContact CG-CE2 4.45Å; F104-Y106 WeakPolarHBondContact O-CD2 3.3Å; F104-Y106 PolarHBondContact O-N 3.32Å; Y106-F109 HydrophobicContact CD1-CD1 4.46Å; Y106-L110 WeakPolarHBondContact O-CB 3.47Å; Y106-L110 PolarHBondContact O-N 2.86Å; Y106-N138 PolarHBondContact OH-O 3.34Å; Y106-P140 HydrophobicContact CD1-CB 3.85Å; Y106-P140 HydrophobicContact CD1-CG 4.1Å; Y106-P140 HydrophobicContact CE1-CB 3.73Å; Y106-P140 HydrophobicContact CE1-CG 3.57Å; Y106-W144 HydrophobicContact CD1-CD2 4.38Å; Y106-W144 HydrophobicContact CD1-CZ2 4.25Å; Y106-W144 PolarHBondContact O-NE1 3.02Å
107	E	85.1	Confident	79.9	Confident	49 Å²	49	43 Å²	43	23%	0.229	22%	0.216	C	C	.	.	H	α-helix	trans	-79.1	-42.4	178.3	-162.4	65.4	-163.2	0	0	110.6	Y56 D105 F109 L110 R111	Y56-E107 WeakPolarHBondContact CE1-OE1 3.42Å; Y56-E107 VanDerWaalsContact CZ-OE1 3.22Å; Y56-E107 PolarHBondContact OH-OE1 3.08Å; D105-E107 PolarHBondContact O-N 3.44Å; D105-E107 WeakPolarHBondContact OD1-CA 3Å; D105-E107 WeakPolarHBondContact OD1-CB 3.32Å; D105-E107 PolarHBondContact OD1-N 2.91Å; E107-F109 VanDerWaalsContact C-N 3.3Å; E107-F109 PolarHBondContact O-N 3.37Å; E107-L110 PolarHBondContact O-N 3.47Å; E107-R111 PolarHBondContact O-N 3.4Å; E107-R111 VanDerWaalsContact O-N 3.12Å
108	L	82.8	Confident	80.5	Confident	14 Å²	14	40.7 Å²	40.7	7%	0.073	21%	0.209	C	C	.	.	H	α-helix	trans	-59.7	-43.1	168.7	-174.7	62.8	0	0	0	110.9	F63 E66 L67 D105 L110 R111 Y112	F63-L108 HydrophobicContact CD1-CD1 3.72Å; F63-L108 HydrophobicContact CE1-CD1 4.11Å; E66-L108 HydrophobicContact CB-CD2 3.74Å; L67-L108 HydrophobicContact CD2-CB 4.01Å; L67-L108 HydrophobicContact CD2-CD2 3.78Å; L67-L108 HydrophobicContact CD2-CG 3.76Å; L67-L108 HydrophobicContact CG-CD2 3.91Å; L67-L108 HydrophobicContact CG-CG 4.04Å; D105-L108 HydrophobicContact CB-CB 3.84Å; D105-L108 PolarHBondContact O-N 3.24Å; D105-L108 PolarHBondContact OD1-N 2.89Å; L108-L110 VanDerWaalsContact C-N 3.3Å; L108-L110 PolarHBondContact O-N 3.23Å; L108-R111 WeakPolarHBondContact O-CB 2.87Å; L108-R111 PolarHBondContact O-N 3.16Å; L108-R111 VanDerWaalsContact O-N 3.13Å; L108-Y112 PolarHBondContact O-N 3.28Å
109	F	85	Confident	80.9	Confident	8 Å²	8	41.1 Å²	41.1	4%	0.035	22%	0.217	C	C	.	.	H	α-helix	trans	-62.4	-36.6	175.9	176.8	-111.7	0	0	0	112.6	L67 V77 V78 L98 F104 D105 Y106 E107 R111 Y112 L113 W144	L67-F109 HydrophobicContact CD1-CD2 4.49Å; L67-F109 HydrophobicContact CD2-CB 4.05Å; V77-F109 HydrophobicContact CB-CE2 3.99Å; V77-F109 HydrophobicContact CB-CZ 4.35Å; V77-F109 HydrophobicContact CG1-CE2 3.81Å; V77-F109 HydrophobicContact CG1-CZ 3.66Å; V77-F109 HydrophobicContact CG2-CE2 4.45Å; V78-F109 HydrophobicContact CG2-CE2 4.22Å; V78-F109 HydrophobicContact CG2-CZ 4.43Å; L98-F109 HydrophobicContact CD2-CD1 4.14Å; L98-F109 HydrophobicContact CD2-CE1 3.74Å; L98-F109 HydrophobicContact CD2-CE2 4.33Å; L98-F109 HydrophobicContact CD2-CZ 3.85Å; F104-F109 HydrophobicContact CD1-CB 4.46Å; F104-F109 HydrophobicContact CE1-CB 3.45Å; F104-F109 VanDerWaalsContact CE1-CB 3.45Å; F104-F109 HydrophobicContact CE1-CD1 4.08Å; F104-F109 HydrophobicContact CE1-CD2 4Å; F104-F109 AromaticContact CE1-CG 3.56Å; F104-F109 HydrophobicContact CE1-CG 3.56Å; F104-F109 HydrophobicContact CZ-CB 3.68Å; F104-F109 AromaticContact CZ-CD2 3.76Å; F104-F109 HydrophobicContact CZ-CD2 3.76Å; F104-F109 AromaticContact CZ-CG 3.78Å; F104-F109 HydrophobicContact CZ-CG 3.78Å; D105-F109 WeakPolarHBondContact O-CB 3.43Å; D105-F109 PolarHBondContact O-N 2.91Å; Y106-F109 HydrophobicContact CD1-CD1 4.46Å; E107-F109 VanDerWaalsContact C-N 3.3Å; E107-F109 PolarHBondContact O-N 3.37Å; F109-R111 VanDerWaalsContact C-N 3.34Å; F109-Y112 HydrophobicContact CD2-CD1 4.07Å; F109-Y112 HydrophobicContact CE2-CD1 4.11Å; F109-Y112 PolarHBondContact O-N 3.41Å; F109-L113 VanDerWaalsContact O-CB 3.29Å; F109-L113 WeakPolarHBondContact O-CB 3.37Å; F109-L113 PolarHBondContact O-N 2.84Å; F109-W144 HydrophobicContact CD1-CH2 4.08Å; F109-W144 AromaticContact CD1-CZ2 3.85Å; F109-W144 HydrophobicContact CD1-CZ2 3.85Å; F109-W144 HydrophobicContact CE1-CH2 4.07Å; F109-W144 HydrophobicContact CE1-CZ2 4.31Å
110	L	86.3	Confident	81.6	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-64.6	-39.7	174.8	178.6	56.7	0	0	0	111.5	Y56 Y106 E107 L108 L113 I114 W144 A148 A151	Y56-L110 HydrophobicContact CE1-CD2 3.88Å; Y56-L110 HydrophobicContact CE1-CG 4.31Å; Y106-L110 WeakPolarHBondContact O-CB 3.47Å; Y106-L110 PolarHBondContact O-N 2.86Å; E107-L110 PolarHBondContact O-N 3.47Å; L108-L110 VanDerWaalsContact C-N 3.3Å; L108-L110 PolarHBondContact O-N 3.23Å; L110-L113 HydrophobicContact CD1-CD2 4.34Å; L110-L113 PolarHBondContact O-N 2.94Å; L110-I114 HydrophobicContact CD1-CD1 4.05Å; L110-I114 HydrophobicContact CD1-CG1 4.26Å; L110-I114 HydrophobicContact CG-CD1 4.04Å; L110-I114 WeakPolarHBondContact O-CB 3.2Å; L110-I114 VanDerWaalsContact O-CG1 3.25Å; L110-I114 WeakPolarHBondContact O-CG1 3.47Å; L110-I114 PolarHBondContact O-N 3.44Å; L110-W144 HydrophobicContact CB-CZ2 3.98Å; L110-W144 HydrophobicContact CD1-CZ2 4.38Å; L110-A148 HydrophobicContact CD1-CB 3.65Å; L110-A148 HydrophobicContact CD2-CB 4.25Å; L110-A151 HydrophobicContact CD2-CB 4.22Å
111	R	84.3	Confident	82.3	Confident	108 Å²	108	39.3 Å²	39.3	41%	0.408	20%	0.203	S	C	.	.	H	α-helix	trans	-64.2	-45.6	174.8	-66.7	176	-170.7	163.7	3.6	111.4	Y56 F63 E107 L108 F109 L113 I114 H115	Y56-R111 HydrophobicContact CD1-CG 4Å; F63-R111 HydrophobicContact CD1-CB 4.5Å; F63-R111 HydrophobicContact CE1-CB 3.74Å; F63-R111 HydrophobicContact CZ-CB 3.98Å; E107-R111 PolarHBondContact O-N 3.4Å; E107-R111 VanDerWaalsContact O-N 3.12Å; L108-R111 WeakPolarHBondContact O-CB 2.87Å; L108-R111 PolarHBondContact O-N 3.16Å; L108-R111 VanDerWaalsContact O-N 3.13Å; F109-R111 VanDerWaalsContact C-N 3.34Å; R111-L113 PolarHBondContact O-N 3.09Å; R111-I114 PolarHBondContact O-N 3.19Å; R111-H115 WeakPolarHBondContact O-CB 3.38Å; R111-H115 PolarHBondContact O-N 2.96Å
112	Y	83.9	Confident	83	Confident	14 Å²	14	38.7 Å²	38.7	6%	0.055	19%	0.193	C	C	.	.	H	α-helix	trans	-56.1	-48.5	172.7	173.5	-111.9	0	0	0	111.9	F63 E64 L67 V78 L108 F109 I114 H115 V116 L395	F63-Y112 HydrophobicContact CB-CD2 3.55Å; F63-Y112 HydrophobicContact CB-CE2 4.49Å; F63-Y112 HydrophobicContact CB-CG 4.14Å; F63-Y112 HydrophobicContact CD2-CD2 4.32Å; F63-Y112 HydrophobicContact CG-CD2 4.24Å; E64-Y112 HydrophobicContact CG-CD2 4.41Å; E64-Y112 HydrophobicContact CG-CE2 3.57Å; E64-Y112 PolarHBondContact OE1-OH 3.34Å; L67-Y112 HydrophobicContact CD1-CD1 4.01Å; L67-Y112 HydrophobicContact CD1-CD2 4.5Å; L67-Y112 HydrophobicContact CD1-CG 3.88Å; V78-Y112 HydrophobicContact CB-CE1 4.22Å; V78-Y112 HydrophobicContact CG2-CD1 4.45Å; V78-Y112 HydrophobicContact CG2-CE1 3.84Å; L108-Y112 PolarHBondContact O-N 3.28Å; F109-Y112 HydrophobicContact CD2-CD1 4.07Å; F109-Y112 HydrophobicContact CE2-CD1 4.11Å; F109-Y112 PolarHBondContact O-N 3.41Å; Y112-I114 VanDerWaalsContact C-N 3.31Å; Y112-I114 PolarHBondContact O-N 2.67Å; Y112-H115 WeakPolarHBondContact O-CB 3.33Å; Y112-H115 PolarHBondContact O-N 3.4Å; Y112-H115 VanDerWaalsContact O-N 3.12Å; Y112-V116 HydrophobicContact CD1-CG2 4.44Å; Y112-V116 HydrophobicContact CD2-CG2 3.99Å; Y112-V116 HydrophobicContact CE1-CG2 4.05Å; Y112-V116 HydrophobicContact CE2-CG2 3.59Å; Y112-V116 HydrophobicContact CG-CG2 4.44Å; Y112-V116 WeakPolarHBondContact O-CG2 3.41Å; Y112-V116 PolarHBondContact O-N 3.34Å; Y112-L395 WeakPolarHBondContact OH-CD1 3.42Å
113	L	85.8	Confident	83.8	Confident	17 Å²	17	30.5 Å²	30.5	9%	0.089	16%	0.155	C	C	.	.	H	α-helix	trans	-57.8	-44.5	178.3	174.3	62.5	0	0	0	112	F93 F109 L110 R111 L117	F93-L113 HydrophobicContact CD1-CD1 3.96Å; F93-L113 HydrophobicContact CE1-CD1 2.99Å; F93-L113 HydrophobicContact CE1-CG 4.47Å; F93-L113 HydrophobicContact CZ-CD1 3.37Å; F109-L113 VanDerWaalsContact O-CB 3.29Å; F109-L113 WeakPolarHBondContact O-CB 3.37Å; F109-L113 PolarHBondContact O-N 2.84Å; L110-L113 HydrophobicContact CD1-CD2 4.34Å; L110-L113 PolarHBondContact O-N 2.94Å; R111-L113 PolarHBondContact O-N 3.09Å; L113-L117 HydrophobicContact CD1-CD1 3.9Å; L113-L117 HydrophobicContact CD1-CG 4.19Å; L113-L117 HydrophobicContact CG-CD1 4.13Å; L113-L117 WeakPolarHBondContact O-CB 3.29Å; L113-L117 VanDerWaalsContact O-CG 3.27Å; L113-L117 WeakPolarHBondContact O-CG 3.43Å; L113-L117 PolarHBondContact O-N 2.73Å
114	I	87.7	Confident	84.6	Confident	5 Å²	5	25 Å²	25	3%	0.026	12%	0.122	C	C	.	.	H	α-helix	trans	-63.5	-44.3	176.8	-71.8	167.7	0	0	0	110.1	Y56 L110 R111 Y112 L117 D118 A151 L152 F156	Y56-I114 HydrophobicContact CD1-CD1 3.99Å; Y56-I114 HydrophobicContact CG-CD1 4.09Å; L110-I114 HydrophobicContact CD1-CD1 4.05Å; L110-I114 HydrophobicContact CD1-CG1 4.26Å; L110-I114 HydrophobicContact CG-CD1 4.04Å; L110-I114 WeakPolarHBondContact O-CB 3.2Å; L110-I114 VanDerWaalsContact O-CG1 3.25Å; L110-I114 WeakPolarHBondContact O-CG1 3.47Å; L110-I114 PolarHBondContact O-N 3.44Å; R111-I114 PolarHBondContact O-N 3.19Å; Y112-I114 VanDerWaalsContact C-N 3.31Å; Y112-I114 PolarHBondContact O-N 2.67Å; I114-L117 PolarHBondContact O-N 2.83Å; I114-D118 WeakPolarHBondContact O-CB 3.14Å; I114-D118 PolarHBondContact O-N 3.3Å; I114-A151 HydrophobicContact CD1-CB 3.8Å; I114-L152 HydrophobicContact CG1-CD2 4.13Å; I114-F156 HydrophobicContact CG2-CE1 4.24Å; I114-F156 HydrophobicContact CG2-CE2 4.49Å; I114-F156 HydrophobicContact CG2-CZ 3.73Å
115	H	84.4	Confident	85.4	Confident	46 Å²	46	24.6 Å²	24.6	21%	0.213	12%	0.12	C	C	.	.	H	α-helix	trans	-59.4	-50.9	177.7	177.1	81.8	0	0	0	112	F63 R111 Y112 L117 D118 G119	F63-H115 HydrophobicContact CD2-CB 3.98Å; F63-H115 AromaticContact CD2-CG 3.97Å; F63-H115 HydrophobicContact CE2-CB 3.6Å; F63-H115 AromaticContact CE2-CG 3.73Å; R111-H115 WeakPolarHBondContact O-CB 3.38Å; R111-H115 PolarHBondContact O-N 2.96Å; Y112-H115 WeakPolarHBondContact O-CB 3.33Å; Y112-H115 PolarHBondContact O-N 3.4Å; Y112-H115 VanDerWaalsContact O-N 3.12Å; H115-L117 VanDerWaalsContact C-N 3.33Å; H115-L117 PolarHBondContact O-N 2.97Å; H115-D118 WeakPolarHBondContact O-CB 3.34Å; H115-D118 PolarHBondContact O-N 2.75Å; H115-G119 PolarHBondContact O-N 3.07Å
116	V	83.3	Confident	85.8	Confident	10 Å²	10	20.4 Å²	20.4	6%	0.061	10%	0.098	C	C	.	.	H	α-helix	trans	-59	-45.5	177.2	174.4	0	0	0	0	111	V78 Y112 D118 G119 F120 L395	V78-V116 HydrophobicContact CG1-CG1 3.81Å; Y112-V116 HydrophobicContact CD1-CG2 4.44Å; Y112-V116 HydrophobicContact CD2-CG2 3.99Å; Y112-V116 HydrophobicContact CE1-CG2 4.05Å; Y112-V116 HydrophobicContact CE2-CG2 3.59Å; Y112-V116 HydrophobicContact CG-CG2 4.44Å; Y112-V116 WeakPolarHBondContact O-CG2 3.41Å; Y112-V116 PolarHBondContact O-N 3.34Å; V116-D118 VanDerWaalsContact C-N 3.34Å; V116-D118 PolarHBondContact O-N 3.29Å; V116-G119 PolarHBondContact O-N 2.8Å; V116-F120 HydrophobicContact CG1-CE2 4.42Å; V116-F120 VanDerWaalsContact O-CD2 3.23Å; V116-F120 WeakPolarHBondContact O-CD2 3.4Å; V116-F120 WeakPolarHBondContact O-CE2 3.39Å; V116-L395 HydrophobicContact CB-CD1 4.5Å; V116-L395 HydrophobicContact CG1-CD1 3.87Å; V116-L395 HydrophobicContact CG1-CD2 3.75Å; V116-L395 HydrophobicContact CG1-CG 4.49Å; V116-L395 HydrophobicContact CG2-CD1 3.75Å
117	L	86.5	Confident	86.1	Confident	7 Å²	7	19.9 Å²	19.9	4%	0.037	10%	0.097	C	C	.	.	H	α-helix	trans	-69.2	-30.9	179.7	-70.7	176.6	0	0	0	112.9	V91 F93 L113 I114 H115 G119 F120 V121 Y125 L152 F156	V91-L117 HydrophobicContact CB-CD2 4.42Å; V91-L117 HydrophobicContact CG1-CD2 4.18Å; V91-L117 HydrophobicContact CG2-CD2 4.23Å; F93-L117 HydrophobicContact CE2-CD2 4.46Å; F93-L117 HydrophobicContact CZ-CD1 4.43Å; F93-L117 HydrophobicContact CZ-CD2 3.98Å; F93-L117 HydrophobicContact CZ-CG 4.31Å; L113-L117 HydrophobicContact CD1-CD1 3.9Å; L113-L117 HydrophobicContact CD1-CG 4.19Å; L113-L117 HydrophobicContact CG-CD1 4.13Å; L113-L117 WeakPolarHBondContact O-CB 3.29Å; L113-L117 VanDerWaalsContact O-CG 3.27Å; L113-L117 WeakPolarHBondContact O-CG 3.43Å; L113-L117 PolarHBondContact O-N 2.73Å; I114-L117 PolarHBondContact O-N 2.83Å; H115-L117 VanDerWaalsContact C-N 3.33Å; H115-L117 PolarHBondContact O-N 2.97Å; L117-G119 PolarHBondContact O-N 2.81Å; L117-F120 PolarHBondContact O-N 2.81Å; L117-V121 WeakPolarHBondContact O-CG1 3.38Å; L117-V121 PolarHBondContact O-N 3.35Å; L117-Y125 HydrophobicContact CD2-CE2 3.91Å; L117-L152 HydrophobicContact CD1-CD2 3.79Å; L117-F156 HydrophobicContact CB-CD1 3.68Å; L117-F156 HydrophobicContact CB-CE1 3.76Å; L117-F156 HydrophobicContact CD1-CD1 4.37Å
118	D	86.4	Confident	86.3	Confident	34 Å²	34	17.9 Å²	17.9	18%	0.182	9%	0.087	C	C	.	.	H	α-helix	trans	-59.8	-28.6	176.6	-163.4	62.8	0	0	0	111.2	R59 I114 H115 V116 F120 R155 F156	R59-D118 IonicContact NH2-OD2 3.24Å; I114-D118 WeakPolarHBondContact O-CB 3.14Å; I114-D118 PolarHBondContact O-N 3.3Å; H115-D118 WeakPolarHBondContact O-CB 3.34Å; H115-D118 PolarHBondContact O-N 2.75Å; V116-D118 VanDerWaalsContact C-N 3.34Å; V116-D118 PolarHBondContact O-N 3.29Å; D118-F120 PolarHBondContact O-N 3.26Å; D118-R155 IonicContact OD1-CZ 3.38Å; D118-R155 IonicContact OD1-NH1 3.57Å; D118-R155 PolarHBondContact OD1-NH1 3.24Å; D118-R155 IonicContact OD1-NH2 3.46Å; D118-R155 PolarHBondContact OD1-NH2 3.36Å; D118-F156 HydrophobicContact CB-CE1 4.4Å; D118-F156 HydrophobicContact CB-CZ 4.46Å
119	G	83.6	Confident	86.6	Confident	20 Å²	20	19.3 Å²	19.3	21%	0.206	9%	0.092	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-15.3	170.2	0	0	0	0	0	114.9	H115 V116 L117 L379	H115-G119 PolarHBondContact O-N 3.07Å; V116-G119 PolarHBondContact O-N 2.8Å; L117-G119 PolarHBondContact O-N 2.81Å; G119-L379 WeakPolarHBondContact O-CD1 3.47Å; G119-L379 WeakPolarHBondContact O-CD2 3.46Å
120	F	84.1	Confident	86.5	Confident	8 Å²	8	19.1 Å²	19.1	4%	0.035	9%	0.091	C	C	.	.	T	Hydrogen-bonded Turn	trans	-122	-15.9	-178	-56.4	-78.6	0	0	0	114.2	V80 P89 V91 V116 L117 D118 E122 Q123 Y125 L398	V80-F120 HydrophobicContact CB-CZ 4.3Å; V80-F120 HydrophobicContact CG1-CE1 4.2Å; V80-F120 HydrophobicContact CG1-CZ 3.97Å; V80-F120 HydrophobicContact CG2-CE1 4.36Å; V80-F120 HydrophobicContact CG2-CE2 3.72Å; V80-F120 HydrophobicContact CG2-CZ 3.41Å; V80-F120 VanDerWaalsContact CG2-CZ 3.41Å; P89-F120 HydrophobicContact CB-CD1 3.61Å; P89-F120 HydrophobicContact CB-CE1 3.86Å; P89-F120 HydrophobicContact CG-CD1 3.91Å; P89-F120 HydrophobicContact CG-CE1 4.34Å; V91-F120 HydrophobicContact CG2-CD2 3.79Å; V91-F120 HydrophobicContact CG2-CE2 4.02Å; V91-F120 HydrophobicContact CG2-CG 4.18Å; V116-F120 HydrophobicContact CG1-CE2 4.42Å; V116-F120 VanDerWaalsContact O-CD2 3.23Å; V116-F120 WeakPolarHBondContact O-CD2 3.4Å; V116-F120 WeakPolarHBondContact O-CE2 3.39Å; L117-F120 PolarHBondContact O-N 2.81Å; D118-F120 PolarHBondContact O-N 3.26Å; F120-E122 PolarHBondContact O-N 2.82Å; F120-Q123 WeakPolarHBondContact O-CG 3.35Å; F120-Q123 PolarHBondContact O-N 3.46Å; F120-Y125 HydrophobicContact CB-CD1 4.47Å; F120-Y125 HydrophobicContact CB-CG 4.21Å; F120-L398 HydrophobicContact CE1-CD2 3.61Å; F120-L398 HydrophobicContact CE2-CD2 4.49Å; F120-L398 HydrophobicContact CZ-CD2 3.32Å
121	V	86	Confident	85.9	Confident	0 Å²	0	19.1 Å²	19.1	0%	0	9%	0.091	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-21.7	-171.5	-64.9	0	0	0	0	114.2	L117 Q123 F156 N159	L117-V121 WeakPolarHBondContact O-CG1 3.38Å; L117-V121 PolarHBondContact O-N 3.35Å; V121-Q123 VanDerWaalsContact C-N 3.31Å; V121-F156 HydrophobicContact CG1-CB 4.14Å; V121-F156 HydrophobicContact CG1-CD1 3.13Å; V121-F156 HydrophobicContact CG1-CD2 4.39Å; V121-F156 HydrophobicContact CG1-CE1 3.39Å; V121-F156 HydrophobicContact CG1-CG 3.66Å; V121-F156 HydrophobicContact CG1-CZ 4.11Å; V121-N159 PolarHBondContact O-ND2 3.3Å
122	E	84.5	Confident	85.2	Confident	49 Å²	49	18.4 Å²	18.4	23%	0.229	9%	0.089	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-8.9	-180	-62.6	-59.1	152.1	0	0	113.4	F120 R155 R273 N376 L379	F120-E122 PolarHBondContact O-N 2.82Å; E122-R155 IonicContact OE1-NE 2.81Å; E122-R155 IonicContact OE1-NH2 3.16Å; E122-R273 WeakPolarHBondContact O-CD 3.32Å; E122-N376 WeakPolarHBondContact CG-OD1 3.45Å; E122-L379 HydrophobicContact CB-CD1 4.34Å
123	Q	86.5	Confident	84.2	Confident	7 Å²	7	19.2 Å²	19.2	3%	0.033	10%	0.102	C	C	.	.	S	Bend	trans	-122.4	159.2	173.7	62.5	-177.1	-24.7	0	0	113.1	P89 F120 V121 Y125 N159 R273 L379 V380	P89-Q123 HydrophobicContact CG-CG 4.23Å; F120-Q123 WeakPolarHBondContact O-CG 3.35Å; F120-Q123 PolarHBondContact O-N 3.46Å; V121-Q123 VanDerWaalsContact C-N 3.31Å; Q123-Y125 WeakPolarHBondContact O-CD1 3.29Å; Q123-Y125 PolarHBondContact O-N 3.49Å; Q123-N159 VanDerWaalsContact O-CB 3.3Å; Q123-N159 WeakPolarHBondContact O-CB 3.39Å; Q123-R273 HydrophobicContact CB-CB 4.29Å; Q123-L379 PolarHBondContact NE2-O 3.06Å; Q123-V380 HydrophobicContact CB-CG2 4.04Å
124	D	90.1	Very high	82.8	Confident	7 Å²	7	19.6 Å²	19.6	4%	0.037	10%	0.102	C	C	.	.			trans	-65.2	123.7	173.2	-72.6	-20	0	0	0	109.5	R88 P89 N159 K161 R273 R274 S275	R88-D124 VanDerWaalsContact CB-O 3.3Å; R88-D124 WeakPolarHBondContact CB-O 3.42Å; R88-D124 HydrophobicContact CG-CB 4.34Å; P89-D124 WeakPolarHBondContact CD-O 3.14Å; D124-N159 WeakPolarHBondContact CA-O 3.21Å; D124-K161 VanDerWaalsContact CB-CE 3.49Å; D124-K161 HydrophobicContact CB-CG 4.13Å; D124-K161 WeakPolarHBondContact OD1-CE 3.5Å; D124-K161 IonicContact OD1-NZ 2.92Å; D124-K161 PolarHBondContact OD1-NZ 3.39Å; D124-K161 WeakPolarHBondContact OD2-CE 3.37Å; D124-K161 IonicContact OD2-NZ 3.22Å; D124-K161 PolarHBondContact OD2-NZ 3.11Å; D124-K161 VanDerWaalsContact OD2-NZ 3.13Å; D124-R273 WeakPolarHBondContact CB-O 3.39Å; D124-R273 PolarHBondContact N-O 2.79Å; D124-R274 WeakPolarHBondContact OD2-CA 3.38Å; D124-S275 WeakPolarHBondContact CB-OG 3.41Å; D124-S275 WeakPolarHBondContact OD2-CB 3.44Å; D124-S275 PolarHBondContact OD2-N 3.26Å; D124-S275 PolarHBondContact OD2-OG 3.22Å; D124-S275 VanDerWaalsContact OD2-OG 3.06Å
125	Y	91.6	Very high	81.3	Confident	5 Å²	5	26.7 Å²	26.7	2%	0.02	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	163.6	-176.3	75.3	-78.3	0	0	0	111.7	P89 V91 L117 F120 Q123 V127 F156 N159 L160 K161	P89-Y125 WeakPolarHBondContact O-CA 3.34Å; V91-Y125 HydrophobicContact CG2-CD2 4.31Å; L117-Y125 HydrophobicContact CD2-CE2 3.91Å; F120-Y125 HydrophobicContact CB-CD1 4.47Å; F120-Y125 HydrophobicContact CB-CG 4.21Å; Q123-Y125 WeakPolarHBondContact O-CD1 3.29Å; Q123-Y125 PolarHBondContact O-N 3.49Å; Y125-V127 HydrophobicContact CD2-CG2 3.9Å; Y125-V127 HydrophobicContact CE2-CG2 3.5Å; Y125-F156 PolarHBondContact OH-O 3.02Å; Y125-N159 HydrophobicContact CD1-CB 4.48Å; Y125-N159 PolarHBondContact N-O 3.25Å; Y125-L160 HydrophobicContact CD2-CD1 4.11Å; Y125-L160 HydrophobicContact CE1-CB 4.08Å; Y125-L160 HydrophobicContact CE2-CD1 3.71Å; Y125-L160 CarbonylContact O-C 3.45Å; Y125-L160 WeakPolarHBondContact O-CA 3.11Å; Y125-K161 PolarHBondContact O-N 2.96Å
126	S	90.3	Very high	80.1	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	153.6	175.5	-66.9	0	0	0	0	109.9	D84 P89 V90 V91 S162	D84-S126 PolarHBondContact OD2-OG 3.48Å; P89-S126 PolarHBondContact O-N 3.18Å; V90-S126 WeakPolarHBondContact CA-O 3.43Å; V91-S126 PolarHBondContact N-O 2.82Å; S126-S162 CarbonylContact C-O 3.54Å; S126-S162 WeakPolarHBondContact CA-O 3.4Å
127	V	91.1	Very high	78.9	Confident	10 Å²	10	32.9 Å²	32.9	6%	0.061	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	137.8	178.2	173.5	0	0	0	0	109.7	V91 F93 Y125 L160 S162 L163 Y164	V91-V127 HydrophobicContact CB-CG2 4.4Å; V91-V127 CarbonylContact O-C 3.6Å; V91-V127 VanDerWaalsContact O-CA 3.23Å; V91-V127 WeakPolarHBondContact O-CA 3.19Å; F93-V127 HydrophobicContact CD2-CG1 3.29Å; F93-V127 HydrophobicContact CE2-CB 4.34Å; F93-V127 HydrophobicContact CE2-CG1 3.3Å; F93-V127 HydrophobicContact CE2-CG2 4.1Å; Y125-V127 HydrophobicContact CD2-CG2 3.9Å; Y125-V127 HydrophobicContact CE2-CG2 3.5Å; V127-L160 HydrophobicContact CB-CD1 3.95Å; V127-L160 HydrophobicContact CG2-CD1 3.5Å; V127-L160 VanDerWaalsContact CG2-CD1 3.5Å; V127-S162 PolarHBondContact N-O 3.32Å; V127-L163 HydrophobicContact CB-CD1 3.76Å; V127-L163 HydrophobicContact CG1-CD1 3.43Å; V127-L163 VanDerWaalsContact CG1-CD1 3.43Å; V127-L163 CarbonylContact O-C 3.43Å; V127-L163 WeakPolarHBondContact O-CA 3.3Å; V127-Y164 PolarHBondContact O-N 3.43Å
128	I	89.2	Confident	77.8	Confident	7 Å²	7	33.5 Å²	33.5	4%	0.036	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	127.1	168	-56	177.9	0	0	0	108	V90 V91 V92 F93 F130 Y164 V166 L200 V204	V90-I128 HydrophobicContact CG1-CD1 3.55Å; V90-I128 HydrophobicContact CG1-CG1 3.75Å; V91-I128 PolarHBondContact O-N 3.47Å; V92-I128 CarbonylContact C-O 3.54Å; V92-I128 VanDerWaalsContact CA-O 3.3Å; V92-I128 WeakPolarHBondContact CA-O 3.37Å; V92-I128 HydrophobicContact CG1-CB 4.38Å; V92-I128 HydrophobicContact CG2-CB 4.09Å; V92-I128 HydrophobicContact CG2-CD1 4.37Å; F93-I128 PolarHBondContact N-O 3.39Å; I128-F130 HydrophobicContact CG2-CD2 4.04Å; I128-F130 HydrophobicContact CG2-CE2 3.63Å; I128-F130 HydrophobicContact CG2-CZ 4.03Å; I128-Y164 CarbonylContact C-O 3.55Å; I128-Y164 WeakPolarHBondContact CA-O 3.27Å; I128-Y164 HydrophobicContact CG1-CD2 4.18Å; I128-V166 HydrophobicContact CG2-CG2 3.55Å; I128-L200 HydrophobicContact CD1-CD2 4.33Å; I128-L200 HydrophobicContact CG2-CD1 4.42Å; I128-V204 HydrophobicContact CD1-CG2 3.55Å
129	Y	88.1	Confident	76.9	Confident	44 Å²	44	34.2 Å²	34.2	17%	0.173	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	110.5	177.5	173.4	-101.3	0	0	0	109.1	F93 A95 H131 W134 Y164 I165 V166	F93-Y129 HydrophobicContact CB-CD2 3.77Å; A95-Y129 HydrophobicContact CB-CE2 3.71Å; A95-Y129 WeakPolarHBondContact CB-OH 3.42Å; Y129-H131 HydrophobicContact CD1-CB 4.08Å; Y129-H131 HydrophobicContact CE1-CB 3.59Å; Y129-H131 AromaticContact CE1-CG 3.89Å; Y129-H131 AromaticContact CE1-ND1 3.43Å; Y129-H131 WeakPolarHBondContact CE1-ND1 3.43Å; Y129-H131 AromaticContact CZ-ND1 3.91Å; Y129-H131 PolarHBondContact O-N 3.01Å; Y129-H131 PolarHBondContact OH-ND1 3.35Å; Y129-W134 WeakPolarHBondContact OH-CZ2 3.4Å; Y129-W134 PolarHBondContact OH-NE1 2.76Å; Y129-Y164 PolarHBondContact N-O 3.12Å; Y129-I165 HydrophobicContact CD1-CB 4.49Å; Y129-I165 HydrophobicContact CD1-CG1 4.25Å; Y129-I165 HydrophobicContact CD1-CG2 3.87Å; Y129-I165 HydrophobicContact CE1-CG2 4.42Å; Y129-I165 WeakPolarHBondContact O-CA 3.43Å; Y129-V166 PolarHBondContact O-N 3.12Å
130	F	83.3	Confident	76.3	Confident	3 Å²	3	33.8 Å²	33.8	1%	0.013	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	103.6	174.2	-74.5	-82.1	0	0	0	109.6	V92 F93 Y94 A95 I128 Y132 V166 L197 L200 L213	V92-F130 HydrophobicContact CG1-CD2 3.57Å; V92-F130 HydrophobicContact CG1-CE2 3.45Å; V92-F130 VanDerWaalsContact CG1-CE2 3.45Å; F93-F130 PolarHBondContact O-N 2.87Å; Y94-F130 HydrophobicContact CD1-CB 4.27Å; Y94-F130 AromaticContact CD1-CD2 3.62Å; Y94-F130 HydrophobicContact CD1-CD2 3.62Å; Y94-F130 HydrophobicContact CD1-CE2 4.3Å; Y94-F130 HydrophobicContact CD1-CG 4.15Å; Y94-F130 AromaticContact CE1-CD2 3.58Å; Y94-F130 HydrophobicContact CE1-CD2 3.58Å; Y94-F130 AromaticContact CE1-CE2 3.79Å; Y94-F130 HydrophobicContact CE1-CE2 3.79Å; Y94-F130 HydrophobicContact CE1-CG 4.41Å; A95-F130 WeakPolarHBondContact CB-O 3.5Å; A95-F130 PolarHBondContact N-O 3.36Å; I128-F130 HydrophobicContact CG2-CD2 4.04Å; I128-F130 HydrophobicContact CG2-CE2 3.63Å; I128-F130 HydrophobicContact CG2-CZ 4.03Å; F130-Y132 HydrophobicContact CB-CD1 3.94Å; F130-Y132 HydrophobicContact CB-CE1 3.77Å; F130-Y132 HydrophobicContact CD1-CD1 4.1Å; F130-Y132 AromaticContact CD1-CE1 3.73Å; F130-Y132 HydrophobicContact CD1-CE1 3.73Å; F130-Y132 HydrophobicContact CG-CD1 4.48Å; F130-Y132 HydrophobicContact CG-CE1 4.05Å; F130-V166 HydrophobicContact CD1-CB 3.72Å; F130-V166 HydrophobicContact CD1-CG1 3.81Å; F130-V166 HydrophobicContact CD1-CG2 4.05Å; F130-V166 HydrophobicContact CE1-CB 3.97Å; F130-V166 HydrophobicContact CE1-CG1 3.75Å; F130-V166 HydrophobicContact CE1-CG2 3.96Å; F130-V166 HydrophobicContact CG-CB 4.4Å; F130-V166 HydrophobicContact CZ-CG2 4.35Å; F130-L197 HydrophobicContact CE1-CD2 3.65Å; F130-L197 HydrophobicContact CZ-CD2 4.44Å; F130-L200 HydrophobicContact CE1-CD1 4.22Å; F130-L200 HydrophobicContact CZ-CD1 3.98Å; F130-L213 HydrophobicContact CE1-CD2 4.38Å; F130-L213 HydrophobicContact CZ-CD1 3.77Å; F130-L213 HydrophobicContact CZ-CD2 4.11Å
131	H	74.1	Confident	76.1	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	17%	0.174	C	C	.	.			trans	-80.9	-16.3	-173.6	-175.8	67.3	0	0	0	114.1	Y129 W134 I165 V166 T169	Y129-H131 HydrophobicContact CD1-CB 4.08Å; Y129-H131 HydrophobicContact CE1-CB 3.59Å; Y129-H131 AromaticContact CE1-CG 3.89Å; Y129-H131 AromaticContact CE1-ND1 3.43Å; Y129-H131 WeakPolarHBondContact CE1-ND1 3.43Å; Y129-H131 AromaticContact CZ-ND1 3.91Å; Y129-H131 PolarHBondContact O-N 3.01Å; Y129-H131 PolarHBondContact OH-ND1 3.35Å; H131-W134 AromaticContact CE1-CD2 3.46Å; H131-W134 VanDerWaalsContact CE1-CD2 3.46Å; H131-W134 AromaticContact CE1-CE2 3.87Å; H131-W134 AromaticContact CE1-CE3 3.51Å; H131-W134 AromaticContact CE1-CG 3.89Å; H131-W134 AromaticContact CE1-CZ3 3.94Å; H131-W134 AromaticContact ND1-CD2 3.93Å; H131-W134 AromaticContact ND1-CE2 3.93Å; H131-I165 HydrophobicContact CB-CG2 4.12Å; H131-V166 WeakPolarHBondContact CB-O 3.41Å; H131-V166 PolarHBondContact N-O 3.31Å; H131-V166 VanDerWaalsContact N-O 3.08Å; H131-T169 PolarHBondContact CD2-N 3.21Å; H131-T169 PolarHBondContact NE2-OG1 3.37Å
132	Y	69.9	Low	75.8	Confident	93 Å²	93	38.5 Å²	38.5	37%	0.365	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	155.9	-178.7	74.6	-94.1	0	0	0	111.8	F96 F130 W134	F96-Y132 HydrophobicContact CB-CD2 4.07Å; F96-Y132 HydrophobicContact CB-CE2 3.93Å; F96-Y132 WeakPolarHBondContact CB-O 3.39Å; F96-Y132 HydrophobicContact CD1-CD1 4.4Å; F96-Y132 AromaticContact CD1-CD2 3.93Å; F96-Y132 HydrophobicContact CD1-CD2 3.93Å; F96-Y132 AromaticContact CD1-CE1 3.8Å; F96-Y132 HydrophobicContact CD1-CE1 3.8Å; F96-Y132 AromaticContact CD1-CE2 3.24Å; F96-Y132 HydrophobicContact CD1-CE2 3.24Å; F96-Y132 HydrophobicContact CD1-CG 4.47Å; F96-Y132 AromaticContact CD1-CZ 3.19Å; F96-Y132 WeakPolarHBondContact CD1-OH 3.36Å; F96-Y132 HydrophobicContact CD2-CE2 4.11Å; F96-Y132 AromaticContact CE1-CE1 3.83Å; F96-Y132 HydrophobicContact CE1-CE1 3.83Å; F96-Y132 AromaticContact CE1-CE2 3.68Å; F96-Y132 HydrophobicContact CE1-CE2 3.68Å; F96-Y132 AromaticContact CE1-CZ 3.17Å; F96-Y132 WeakPolarHBondContact CE1-OH 2.75Å; F96-Y132 HydrophobicContact CE2-CE2 4.46Å; F96-Y132 HydrophobicContact CG-CD2 4.12Å; F96-Y132 AromaticContact CG-CE2 3.49Å; F96-Y132 HydrophobicContact CG-CE2 3.49Å; F96-Y132 VanDerWaalsContact CG-CE2 3.49Å; F96-Y132 AromaticContact CG-CZ 3.92Å; F96-Y132 HydrophobicContact CZ-CE2 4.28Å; F96-Y132 AromaticContact CZ-CZ 3.88Å; F96-Y132 WeakPolarHBondContact CZ-OH 2.82Å; F96-Y132 PolarHBondContact N-O 3.37Å; F130-Y132 HydrophobicContact CB-CD1 3.94Å; F130-Y132 HydrophobicContact CB-CE1 3.77Å; F130-Y132 HydrophobicContact CD1-CD1 4.1Å; F130-Y132 AromaticContact CD1-CE1 3.73Å; F130-Y132 HydrophobicContact CD1-CE1 3.73Å; F130-Y132 HydrophobicContact CG-CD1 4.48Å; F130-Y132 HydrophobicContact CG-CE1 4.05Å; Y132-W134 VanDerWaalsContact C-N 3.34Å; Y132-W134 PolarHBondContact O-N 2.84Å
133	G	62.1	Low	75.7	Confident	31 Å²	31	37 Å²	37	32%	0.32	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.2	7.3	178.4	0	0	0	0	0	115.7	R135	G133-R135 VanDerWaalsContact C-N 3.34Å; G133-R135 PolarHBondContact O-N 2.79Å
134	W	56	Low	75.6	Confident	25 Å²	25	37.5 Å²	37.5	10%	0.095	18%	0.184	C	C	.	.			trans	-62.9	85.7	169.9	-99.4	39.8	0	0	0	112.6	A95 Y129 H131 Y132 R139 L145 L171 I175	A95-W134 VanDerWaalsContact CB-CD1 3.49Å; Y129-W134 WeakPolarHBondContact OH-CZ2 3.4Å; Y129-W134 PolarHBondContact OH-NE1 2.76Å; H131-W134 AromaticContact CE1-CD2 3.46Å; H131-W134 VanDerWaalsContact CE1-CD2 3.46Å; H131-W134 AromaticContact CE1-CE2 3.87Å; H131-W134 AromaticContact CE1-CE3 3.51Å; H131-W134 AromaticContact CE1-CG 3.89Å; H131-W134 AromaticContact CE1-CZ3 3.94Å; H131-W134 AromaticContact ND1-CD2 3.93Å; H131-W134 AromaticContact ND1-CE2 3.93Å; Y132-W134 VanDerWaalsContact C-N 3.34Å; Y132-W134 PolarHBondContact O-N 2.84Å; W134-R139 HydrophobicContact CB-CG 4.46Å; W134-R139 HydrophobicContact CD2-CG 3.9Å; W134-R139 HydrophobicContact CE3-CG 3.69Å; W134-R139 HydrophobicContact CG-CG 4.25Å; W134-R139 HydrophobicContact CZ3-CG 4.27Å; W134-R139 PolarHBondContact O-NE 3.01Å; W134-R139 PolarHBondContact O-NH2 2.7Å; W134-L145 HydrophobicContact CH2-CD1 4.16Å; W134-L171 HydrophobicContact CE3-CD2 4.16Å; W134-L171 HydrophobicContact CZ3-CD2 4.34Å; W134-I175 HydrophobicContact CH2-CD1 3.9Å; W134-I175 HydrophobicContact CZ3-CD1 3.52Å
135	R	56.3	Low	75.3	Confident	155 Å²	155	38.9 Å²	38.9	59%	0.585	19%	0.191	S	C	*	.			trans	-84.4	150.2	168.8	-59.6	-173.8	-171.6	105.8	-1.9	110.4	G133 C137 N138 R139	G133-R135 VanDerWaalsContact C-N 3.34Å; G133-R135 PolarHBondContact O-N 2.79Å; R135-C137 PolarHBondContact O-N 2.78Å; R135-N138 PolarHBondContact O-N 2.92Å; R135-R139 WeakPolarHBondContact O-CG 3.42Å
136	R	59.4	Low	74.9	Confident	123 Å²	123	39.1 Å²	39.1	46%	0.464	19%	0.193	S	C	.	.	G	3₁₀ helix	trans	-48.5	-36.7	179.7	-77.7	-175	173.8	-148.9	-0	113.6	F34 D36	F34-R136 PolarHBondContact O-NH2 3.19Å; D36-R136 IonicContact OD2-CZ 3.43Å; D36-R136 IonicContact OD2-NH1 2.77Å; D36-R136 PolarHBondContact OD2-NH1 3.39Å; D36-R136 IonicContact OD2-NH2 2.65Å; D36-R136 PolarHBondContact OD2-NH2 3.46Å; D36-R136 VanDerWaalsContact OD2-NH2 3.16Å
137	C	57.4	Low	74.7	Confident	62 Å²	62	42.7 Å²	42.7	42%	0.419	21%	0.207	S	C	.	.	G	3₁₀ helix	trans	-69.2	-30.4	179.6	46.5	0	0	0	0	114.7	S100 S101 R135	S100-C137 WeakPolarHBondContact CA-O 3.23Å; S100-C137 PolarHBondContact OG-O 2.82Å; S101-C137 PolarHBondContact N-O 3.03Å; S101-C137 PolarHBondContact OG-O 3.37Å; S101-C137 VanDerWaalsContact OG-O 3.11Å; R135-C137 PolarHBondContact O-N 2.78Å
138	N	63.5	Low	74.6	Confident	21 Å²	21	42.6 Å²	42.6	11%	0.112	21%	0.207	C	C	.	.	G	3₁₀ helix	trans	-103.2	14.1	-172.7	-64	13.7	0	0	0	112.5	L98 S100 Y106 R135	L98-N138 WeakPolarHBondContact O-CB 3.36Å; L98-N138 VanDerWaalsContact O-CG 3.24Å; L98-N138 PolarHBondContact O-ND2 3.02Å; S100-N138 WeakPolarHBondContact CA-OD1 3.31Å; S100-N138 PolarHBondContact N-OD1 3.06Å; Y106-N138 PolarHBondContact OH-O 3.34Å; R135-N138 PolarHBondContact O-N 2.92Å
139	R	68.7	Low	74.4	Confident	48 Å²	48	44 Å²	44	18%	0.181	21%	0.212	C	C	.	.	P	Polyproline II helix	trans	-90.5	125.6	-178.7	-74.4	173.9	-168.8	171.6	2.2	110.3	W134 R135	W134-R139 HydrophobicContact CB-CG 4.46Å; W134-R139 HydrophobicContact CD2-CG 3.9Å; W134-R139 HydrophobicContact CE3-CG 3.69Å; W134-R139 HydrophobicContact CG-CG 4.25Å; W134-R139 HydrophobicContact CZ3-CG 4.27Å; W134-R139 PolarHBondContact O-NE 3.01Å; W134-R139 PolarHBondContact O-NH2 2.7Å; R135-R139 WeakPolarHBondContact O-CG 3.42Å
140	P	70.8	Confident	74.3	Confident	11 Å²	11	48 Å²	48	7%	0.071	23%	0.227	C	C	.	.	P	Polyproline II helix	trans	-59.6	146.3	163.1	-0.6	7	0	0	0	109.9	Y106 W144	Y106-P140 HydrophobicContact CD1-CB 3.85Å; Y106-P140 HydrophobicContact CD1-CG 4.1Å; Y106-P140 HydrophobicContact CE1-CB 3.73Å; Y106-P140 HydrophobicContact CE1-CG 3.57Å; P140-W144 HydrophobicContact CB-CB 4.23Å; P140-W144 HydrophobicContact CB-CD2 3.72Å; P140-W144 HydrophobicContact CB-CE3 3.24Å; P140-W144 HydrophobicContact CB-CG 4.16Å; P140-W144 HydrophobicContact CB-CZ3 3.82Å; P140-W144 HydrophobicContact CG-CE3 3.76Å; P140-W144 HydrophobicContact CG-CZ3 3.78Å
141	S	79.4	Confident	74.6	Confident	62 Å²	62	49 Å²	49	43%	0.434	24%	0.235	S	C	.	.	P	Polyproline II helix	trans	-62.2	154.1	175	65.1	0	0	0	0	111.7	G143 W144 L145	S141-G143 PolarHBondContact O-N 3.04Å; S141-W144 WeakPolarHBondContact O-CA 3.38Å; S141-W144 WeakPolarHBondContact O-CB 3.05Å; S141-W144 PolarHBondContact O-N 3.3Å; S141-W144 WeakPolarHBondContact OG-CB 3.4Å; S141-W144 PolarHBondContact OG-N 3.48Å; S141-W144 VanDerWaalsContact OG-N 3.11Å; S141-L145 PolarHBondContact O-N 3.44Å
142	L	78.6	Confident	75.2	Confident	46 Å²	46	50.6 Å²	50.6	24%	0.241	24%	0.244	C	C	.	.	H	α-helix	trans	-56.2	-38.6	172.5	-69.8	-176.9	0	0	0	111.6	I39 W144 L145 V146 I175 F179	I39-L142 HydrophobicContact CG2-CD1 3.46Å; I39-L142 VanDerWaalsContact CG2-CD1 3.46Å; I39-L142 HydrophobicContact CG2-CG 4.36Å; L142-W144 VanDerWaalsContact C-N 3.29Å; L142-W144 PolarHBondContact O-N 2.92Å; L142-L145 HydrophobicContact CD2-CD1 4.27Å; L142-L145 PolarHBondContact O-N 2.89Å; L142-V146 WeakPolarHBondContact O-CG2 3.46Å; L142-V146 PolarHBondContact O-N 3.47Å; L142-I175 HydrophobicContact CD2-CD1 4.34Å; L142-I175 HydrophobicContact CD2-CG1 3.87Å; L142-I175 HydrophobicContact CD2-CG2 4.41Å; L142-F179 HydrophobicContact CD2-CE2 4.38Å
143	G	83.1	Confident	76	Confident	17 Å²	17	49.2 Å²	49.2	18%	0.175	24%	0.243	C	C	.	.	H	α-helix	trans	-59	-40	174.2	0	0	0	0	0	112.4	S141 V146 R147	S141-G143 PolarHBondContact O-N 3.04Å; G143-V146 PolarHBondContact O-N 3.33Å; G143-R147 WeakPolarHBondContact O-CG 3.16Å; G143-R147 PolarHBondContact O-N 3.07Å
144	W	85.7	Confident	77.2	Confident	18 Å²	18	57 Å²	57	7%	0.068	26%	0.263	C	S	.	.	H	α-helix	trans	-65.7	-45	174	-177.6	91.1	0	0	0	112	Y106 F109 L110 P140 S141 L142 V146 R147 A148	Y106-W144 HydrophobicContact CD1-CD2 4.38Å; Y106-W144 HydrophobicContact CD1-CZ2 4.25Å; Y106-W144 PolarHBondContact O-NE1 3.02Å; F109-W144 HydrophobicContact CD1-CH2 4.08Å; F109-W144 AromaticContact CD1-CZ2 3.85Å; F109-W144 HydrophobicContact CD1-CZ2 3.85Å; F109-W144 HydrophobicContact CE1-CH2 4.07Å; F109-W144 HydrophobicContact CE1-CZ2 4.31Å; L110-W144 HydrophobicContact CB-CZ2 3.98Å; L110-W144 HydrophobicContact CD1-CZ2 4.38Å; P140-W144 HydrophobicContact CB-CB 4.23Å; P140-W144 HydrophobicContact CB-CD2 3.72Å; P140-W144 HydrophobicContact CB-CE3 3.24Å; P140-W144 HydrophobicContact CB-CG 4.16Å; P140-W144 HydrophobicContact CB-CZ3 3.82Å; P140-W144 HydrophobicContact CG-CE3 3.76Å; P140-W144 HydrophobicContact CG-CZ3 3.78Å; S141-W144 WeakPolarHBondContact O-CA 3.38Å; S141-W144 WeakPolarHBondContact O-CB 3.05Å; S141-W144 PolarHBondContact O-N 3.3Å; S141-W144 WeakPolarHBondContact OG-CB 3.4Å; S141-W144 PolarHBondContact OG-N 3.48Å; S141-W144 VanDerWaalsContact OG-N 3.11Å; L142-W144 VanDerWaalsContact C-N 3.29Å; L142-W144 PolarHBondContact O-N 2.92Å; W144-V146 VanDerWaalsContact C-N 3.27Å; W144-V146 PolarHBondContact O-N 3.41Å; W144-R147 CarbonylContact O-C 3.59Å; W144-R147 PolarHBondContact O-N 3.27Å; W144-R147 VanDerWaalsContact O-N 3.09Å; W144-A148 HydrophobicContact CD2-CB 4.37Å; W144-A148 HydrophobicContact CE3-CB 4.16Å; W144-A148 HydrophobicContact CH2-CB 4.13Å; W144-A148 HydrophobicContact CZ2-CB 4.29Å; W144-A148 HydrophobicContact CZ3-CB 4.05Å; W144-A148 WeakPolarHBondContact O-CB 3.46Å; W144-A148 PolarHBondContact O-N 3.01Å
145	L	83.5	Confident	78.6	Confident	35 Å²	35	60 Å²	60	18%	0.183	27%	0.274	C	S	.	.	H	α-helix	trans	-59.7	-38.8	177.8	-71.9	169.7	0	0	0	112	W134 S141 L142 Y149 I175 F179	W134-L145 HydrophobicContact CH2-CD1 4.16Å; S141-L145 PolarHBondContact O-N 3.44Å; L142-L145 HydrophobicContact CD2-CD1 4.27Å; L142-L145 PolarHBondContact O-N 2.89Å; L145-Y149 WeakPolarHBondContact O-CB 3.11Å; L145-Y149 PolarHBondContact O-N 3Å; L145-I175 HydrophobicContact CD1-CD1 4.46Å; L145-I175 HydrophobicContact CD1-CG2 4.33Å; L145-F179 HydrophobicContact CB-CE1 4.12Å; L145-F179 HydrophobicContact CB-CE2 4.29Å; L145-F179 HydrophobicContact CB-CZ 3.43Å; L145-F179 VanDerWaalsContact CB-CZ 3.43Å
146	V	83	Confident	80.1	Confident	11 Å²	11	52.8 Å²	52.8	7%	0.067	25%	0.247	C	C	.	.	H	α-helix	trans	-65.2	-45.1	174.3	172	0	0	0	0	111	L48 L142 G143 W144 Y149 R150 F179 M182	L48-V146 HydrophobicContact CD2-CG1 4.39Å; L142-V146 WeakPolarHBondContact O-CG2 3.46Å; L142-V146 PolarHBondContact O-N 3.47Å; G143-V146 PolarHBondContact O-N 3.33Å; W144-V146 VanDerWaalsContact C-N 3.27Å; W144-V146 PolarHBondContact O-N 3.41Å; V146-Y149 PolarHBondContact O-N 3.08Å; V146-R150 WeakPolarHBondContact O-CG 3.5Å; V146-R150 PolarHBondContact O-N 3.37Å; V146-F179 HydrophobicContact CB-CE1 4.35Å; V146-F179 HydrophobicContact CB-CZ 4.3Å; V146-F179 HydrophobicContact CG2-CE1 3.66Å; V146-F179 HydrophobicContact CG2-CE2 4.1Å; V146-F179 HydrophobicContact CG2-CZ 3.4Å; V146-M182 HydrophobicContact CG1-CE 3.6Å; V146-M182 HydrophobicContact CG1-SD 4.36Å; V146-M182 HydrophobicContact CG2-SD 4.47Å
147	R	86.6	Confident	81.6	Confident	75 Å²	75	48.9 Å²	48.9	28%	0.283	23%	0.233	S	C	.	.	H	α-helix	trans	-62.3	-46.3	176.1	-74.3	-166.6	-58	-87.2	4.6	111.6	G143 W144 Y149 R150 A151	G143-R147 WeakPolarHBondContact O-CG 3.16Å; G143-R147 PolarHBondContact O-N 3.07Å; W144-R147 CarbonylContact O-C 3.59Å; W144-R147 PolarHBondContact O-N 3.27Å; W144-R147 VanDerWaalsContact O-N 3.09Å; R147-Y149 PolarHBondContact O-N 3.36Å; R147-R150 CarbonylContact O-C 3.58Å; R147-R150 PolarHBondContact O-N 2.87Å; R147-A151 WeakPolarHBondContact O-CB 3.36Å; R147-A151 PolarHBondContact O-N 3.19Å
148	A	87.6	Confident	83	Confident	8 Å²	8	51.3 Å²	51.3	7%	0.066	24%	0.237	C	C	.	.	H	α-helix	trans	-57.6	-47.2	176	0	0	0	0	0	111.5	L110 W144 R150 A151 L152	L110-A148 HydrophobicContact CD1-CB 3.65Å; L110-A148 HydrophobicContact CD2-CB 4.25Å; W144-A148 HydrophobicContact CD2-CB 4.37Å; W144-A148 HydrophobicContact CE3-CB 4.16Å; W144-A148 HydrophobicContact CH2-CB 4.13Å; W144-A148 HydrophobicContact CZ2-CB 4.29Å; W144-A148 HydrophobicContact CZ3-CB 4.05Å; W144-A148 WeakPolarHBondContact O-CB 3.46Å; W144-A148 PolarHBondContact O-N 3.01Å; A148-R150 VanDerWaalsContact C-N 3.31Å; A148-R150 PolarHBondContact O-N 3.14Å; A148-A151 PolarHBondContact O-N 2.87Å; A148-L152 WeakPolarHBondContact O-CG 2.84Å; A148-L152 PolarHBondContact O-N 3.32Å
149	Y	85.9	Confident	84.2	Confident	37 Å²	37	51 Å²	51	15%	0.145	24%	0.235	C	C	.	.	H	α-helix	trans	-60.6	-38.6	174.8	179.6	-98.9	0	0	0	112.5	L145 V146 R147 K157 V183 F187	L145-Y149 WeakPolarHBondContact O-CB 3.11Å; L145-Y149 PolarHBondContact O-N 3Å; V146-Y149 PolarHBondContact O-N 3.08Å; R147-Y149 PolarHBondContact O-N 3.36Å; Y149-K157 HydrophobicContact CE2-CD 4.46Å; Y149-K157 WeakPolarHBondContact O-CE 3.21Å; Y149-K157 PolarHBondContact O-NZ 2.87Å; Y149-V183 HydrophobicContact CE1-CG2 4.44Å; Y149-V183 HydrophobicContact CE2-CG2 4.07Å; Y149-F187 HydrophobicContact CE2-CD1 4.26Å; Y149-F187 HydrophobicContact CE2-CE1 4.17Å; Y149-F187 HydrophobicContact CE2-CZ 4.36Å
150	R	86.4	Confident	85.3	Confident	127 Å²	127	49 Å²	49	48%	0.479	23%	0.228	S	C	.	.	H	α-helix	trans	-72.5	-38.9	178.6	-73.4	178.2	-176.3	175.6	2.2	112.4	V146 R147 A148 L152	V146-R150 WeakPolarHBondContact O-CG 3.5Å; V146-R150 PolarHBondContact O-N 3.37Å; R147-R150 CarbonylContact O-C 3.58Å; R147-R150 PolarHBondContact O-N 2.87Å; A148-R150 VanDerWaalsContact C-N 3.31Å; A148-R150 PolarHBondContact O-N 3.14Å; R150-L152 VanDerWaalsContact C-N 3.32Å
151	A	89	Confident	86.2	Confident	23 Å²	23	51.9 Å²	51.9	19%	0.19	24%	0.239	C	C	.	.	H	α-helix	trans	-66.1	-34.2	178.2	0	0	0	0	0	112.1	Y56 L110 I114 R147 A148 D153	Y56-A151 HydrophobicContact CD2-CB 4.37Å; Y56-A151 HydrophobicContact CE2-CB 4.41Å; L110-A151 HydrophobicContact CD2-CB 4.22Å; I114-A151 HydrophobicContact CD1-CB 3.8Å; R147-A151 WeakPolarHBondContact O-CB 3.36Å; R147-A151 PolarHBondContact O-N 3.19Å; A148-A151 PolarHBondContact O-N 2.87Å; A151-D153 VanDerWaalsContact C-N 3.26Å; A151-D153 PolarHBondContact O-N 3.25Å
152	L	87.4	Confident	86.6	Confident	35 Å²	35	49.3 Å²	49.3	18%	0.183	22%	0.222	C	C	.	.	S	Bend	trans	-71.3	83.9	166.6	-64.2	174.9	0	0	0	109.6	I114 L117 A148 R150 F156 K157	I114-L152 HydrophobicContact CG1-CD2 4.13Å; L117-L152 HydrophobicContact CD1-CD2 3.79Å; A148-L152 WeakPolarHBondContact O-CG 2.84Å; A148-L152 PolarHBondContact O-N 3.32Å; R150-L152 VanDerWaalsContact C-N 3.32Å; L152-F156 HydrophobicContact CB-CB 4.12Å; L152-F156 HydrophobicContact CB-CG 4.36Å; L152-F156 HydrophobicContact CD2-CB 4.03Å; L152-F156 HydrophobicContact CD2-CD1 3.66Å; L152-F156 HydrophobicContact CD2-CD2 4.23Å; L152-F156 HydrophobicContact CD2-CE1 4.26Å; L152-F156 HydrophobicContact CD2-CG 3.69Å; L152-K157 WeakPolarHBondContact O-CD 3.42Å; L152-K157 WeakPolarHBondContact O-CE 3.23Å; L152-K157 PolarHBondContact O-NZ 3.02Å
153	D	85.8	Confident	87.2	Confident	64 Å²	64	48.5 Å²	48.5	34%	0.342	22%	0.217	S	C	.	.			trans	-66.9	-164.5	-176.7	78.4	3.4	0	0	0	113.3	A151 R155 F156 K157	A151-D153 VanDerWaalsContact C-N 3.26Å; A151-D153 PolarHBondContact O-N 3.25Å; D153-R155 PolarHBondContact O-N 2.86Å; D153-R155 WeakPolarHBondContact OD1-CA 3.08Å; D153-R155 WeakPolarHBondContact OD1-CB 3.17Å; D153-R155 PolarHBondContact OD1-N 3.03Å; D153-F156 VanDerWaalsContact OD1-CD2 3.29Å; D153-F156 WeakPolarHBondContact OD1-CD2 3.3Å; D153-K157 WeakPolarHBondContact O-CG 3.35Å; D153-K157 PolarHBondContact O-N 2.92Å
154	R	86.3	Confident	87.4	Confident	193 Å²	193	49.2 Å²	49.2	73%	0.728	22%	0.215	S	C	*	.	H	α-helix	trans	-59.9	-32.2	179	-176.1	177.4	176.5	90	-4.9	113	K157 K158	R154-K157 PolarHBondContact O-N 3.47Å; R154-K158 WeakPolarHBondContact O-CB 3.29Å; R154-K158 PolarHBondContact O-N 3.01Å
155	R	86.2	Confident	87.3	Confident	90 Å²	90	48.9 Å²	48.9	34%	0.34	21%	0.214	S	C	.	.	H	α-helix	trans	-61.3	-51.4	-176.4	-62.2	172	60.2	-137.8	-9.7	110.2	D118 E122 D153	D118-R155 IonicContact OD1-CZ 3.38Å; D118-R155 IonicContact OD1-NH1 3.57Å; D118-R155 PolarHBondContact OD1-NH1 3.24Å; D118-R155 IonicContact OD1-NH2 3.46Å; D118-R155 PolarHBondContact OD1-NH2 3.36Å; E122-R155 IonicContact OE1-NE 2.81Å; E122-R155 IonicContact OE1-NH2 3.16Å; D153-R155 PolarHBondContact O-N 2.86Å; D153-R155 WeakPolarHBondContact OD1-CA 3.08Å; D153-R155 WeakPolarHBondContact OD1-CB 3.17Å; D153-R155 PolarHBondContact OD1-N 3.03Å
156	F	88.6	Confident	87.2	Confident	3 Å²	3	47.2 Å²	47.2	1%	0.013	21%	0.206	C	C	.	.	H	α-helix	trans	-62.8	-45.1	176.4	-57.3	-90.6	0	0	0	112	I114 L117 D118 V121 Y125 L152 D153 K158	I114-F156 HydrophobicContact CG2-CE1 4.24Å; I114-F156 HydrophobicContact CG2-CE2 4.49Å; I114-F156 HydrophobicContact CG2-CZ 3.73Å; L117-F156 HydrophobicContact CB-CD1 3.68Å; L117-F156 HydrophobicContact CB-CE1 3.76Å; L117-F156 HydrophobicContact CD1-CD1 4.37Å; D118-F156 HydrophobicContact CB-CE1 4.4Å; D118-F156 HydrophobicContact CB-CZ 4.46Å; V121-F156 HydrophobicContact CG1-CB 4.14Å; V121-F156 HydrophobicContact CG1-CD1 3.13Å; V121-F156 HydrophobicContact CG1-CD2 4.39Å; V121-F156 HydrophobicContact CG1-CE1 3.39Å; V121-F156 HydrophobicContact CG1-CG 3.66Å; V121-F156 HydrophobicContact CG1-CZ 4.11Å; Y125-F156 PolarHBondContact OH-O 3.02Å; L152-F156 HydrophobicContact CB-CB 4.12Å; L152-F156 HydrophobicContact CB-CG 4.36Å; L152-F156 HydrophobicContact CD2-CB 4.03Å; L152-F156 HydrophobicContact CD2-CD1 3.66Å; L152-F156 HydrophobicContact CD2-CD2 4.23Å; L152-F156 HydrophobicContact CD2-CE1 4.26Å; L152-F156 HydrophobicContact CD2-CG 3.69Å; D153-F156 VanDerWaalsContact OD1-CD2 3.29Å; D153-F156 WeakPolarHBondContact OD1-CD2 3.3Å; F156-K158 PolarHBondContact O-N 2.88Å
157	K	89.5	Confident	86.7	Confident	41 Å²	41	49.3 Å²	49.3	18%	0.178	22%	0.215	C	C	.	.	H	α-helix	trans	-75.9	-25.7	-173.7	-69.4	168.3	176.1	151.5	0	114.4	Y149 L152 D153 R154 F187 K190	Y149-K157 HydrophobicContact CE2-CD 4.46Å; Y149-K157 WeakPolarHBondContact O-CE 3.21Å; Y149-K157 PolarHBondContact O-NZ 2.87Å; L152-K157 WeakPolarHBondContact O-CD 3.42Å; L152-K157 WeakPolarHBondContact O-CE 3.23Å; L152-K157 PolarHBondContact O-NZ 3.02Å; D153-K157 WeakPolarHBondContact O-CG 3.35Å; D153-K157 PolarHBondContact O-N 2.92Å; R154-K157 PolarHBondContact O-N 3.47Å; K157-F187 HydrophobicContact CB-CD2 4.27Å; K157-F187 HydrophobicContact CG-CD2 4.02Å; K157-F187 HydrophobicContact CG-CE2 4.06Å; K157-K190 PolarHBondContact O-NZ 3.02Å
158	K	87.6	Confident	86	Confident	112 Å²	112	47.4 Å²	47.4	49%	0.487	21%	0.212	S	C	.	.	H	α-helix	trans	-71.4	-48.9	-172.9	179.5	-173.6	172.1	-169.4	0	111.3	R154 F156 K190	R154-K158 WeakPolarHBondContact O-CB 3.29Å; R154-K158 PolarHBondContact O-N 3.01Å; F156-K158 PolarHBondContact O-N 2.88Å; K158-K190 PolarHBondContact O-NZ 3.35Å; K158-K190 VanDerWaalsContact O-NZ 3.15Å
159	N	89	Confident	85.1	Confident	14 Å²	14	48.6 Å²	48.6	8%	0.075	22%	0.219	C	C	.	.	H	α-helix	trans	-91.2	-13.8	-171.9	-65.8	-17.9	0	0	0	113.6	V121 Q123 D124 Y125 K161	V121-N159 PolarHBondContact O-ND2 3.3Å; Q123-N159 VanDerWaalsContact O-CB 3.3Å; Q123-N159 WeakPolarHBondContact O-CB 3.39Å; D124-N159 WeakPolarHBondContact CA-O 3.21Å; Y125-N159 HydrophobicContact CD1-CB 4.48Å; Y125-N159 PolarHBondContact N-O 3.25Å; N159-K161 PolarHBondContact O-N 3.42Å
160	L	91.6	Very high	84.3	Confident	8 Å²	8	53.7 Å²	53.7	4%	0.042	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-53.8	123.5	164	-177.3	67.2	0	0	0	110.3	Y125 V127 S162 L163 F187 K190	Y125-L160 HydrophobicContact CD2-CD1 4.11Å; Y125-L160 HydrophobicContact CE1-CB 4.08Å; Y125-L160 HydrophobicContact CE2-CD1 3.71Å; Y125-L160 CarbonylContact O-C 3.45Å; Y125-L160 WeakPolarHBondContact O-CA 3.11Å; V127-L160 HydrophobicContact CB-CD1 3.95Å; V127-L160 HydrophobicContact CG2-CD1 3.5Å; V127-L160 VanDerWaalsContact CG2-CD1 3.5Å; L160-S162 WeakPolarHBondContact CD1-O 3.44Å; L160-L163 HydrophobicContact CD2-CB 4.34Å; L160-F187 HydrophobicContact CD2-CD2 4.45Å; L160-F187 HydrophobicContact CD2-CE2 3.62Å; L160-F187 HydrophobicContact CD2-CZ 4.16Å; L160-K190 VanDerWaalsContact O-CD 3.23Å; L160-K190 WeakPolarHBondContact O-CD 3.36Å; L160-K190 WeakPolarHBondContact O-CE 3.39Å; L160-K190 PolarHBondContact O-NZ 2.81Å
161	K	89.3	Confident	83.4	Confident	70 Å²	70	48.6 Å²	48.6	30%	0.304	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	-42.4	177.9	-64	-54.5	179.9	-168.3	0	112.9	D124 Y125 N159	D124-K161 VanDerWaalsContact CB-CE 3.49Å; D124-K161 HydrophobicContact CB-CG 4.13Å; D124-K161 WeakPolarHBondContact OD1-CE 3.5Å; D124-K161 IonicContact OD1-NZ 2.92Å; D124-K161 PolarHBondContact OD1-NZ 3.39Å; D124-K161 WeakPolarHBondContact OD2-CE 3.37Å; D124-K161 IonicContact OD2-NZ 3.22Å; D124-K161 PolarHBondContact OD2-NZ 3.11Å; D124-K161 VanDerWaalsContact OD2-NZ 3.13Å; Y125-K161 PolarHBondContact O-N 2.96Å; N159-K161 PolarHBondContact O-N 3.42Å
162	S	88.7	Confident	82.5	Confident	9 Å²	9	48.3 Å²	48.3	6%	0.063	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	137.4	-178.6	-57.4	0	0	0	0	109.9	S126 V127 L160 Y164 K190	S126-S162 CarbonylContact C-O 3.54Å; S126-S162 WeakPolarHBondContact CA-O 3.4Å; V127-S162 PolarHBondContact N-O 3.32Å; L160-S162 WeakPolarHBondContact CD1-O 3.44Å; S162-Y164 PolarHBondContact OG-OH 3.35Å; S162-K190 CarbonylContact C-O 3.58Å; S162-K190 WeakPolarHBondContact CA-O 3.23Å
163	L	89.9	Confident	81.5	Confident	29 Å²	29	53.7 Å²	53.7	15%	0.152	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	100.6	167.2	171.9	57.4	0	0	0	107.1	V127 L160 I165 F187 K190 V191 F192	V127-L163 HydrophobicContact CB-CD1 3.76Å; V127-L163 HydrophobicContact CG1-CD1 3.43Å; V127-L163 VanDerWaalsContact CG1-CD1 3.43Å; V127-L163 CarbonylContact O-C 3.43Å; V127-L163 WeakPolarHBondContact O-CA 3.3Å; L160-L163 HydrophobicContact CD2-CB 4.34Å; L163-I165 HydrophobicContact CG-CG1 4.31Å; L163-F187 HydrophobicContact CD2-CE1 4.42Å; L163-F187 HydrophobicContact CD2-CZ 4.12Å; L163-K190 PolarHBondContact N-O 3.25Å; L163-V191 HydrophobicContact CD2-CG2 4.21Å; L163-V191 CarbonylContact O-C 3.52Å; L163-V191 WeakPolarHBondContact O-CA 3.35Å; L163-F192 PolarHBondContact O-N 3.31Å
164	Y	87.2	Confident	80.7	Confident	31 Å²	31	53.4 Å²	53.4	12%	0.122	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	120.1	177.1	-62.9	-80.5	0	0	0	109.4	V127 I128 Y129 S162 F192 V194 L200 V203	V127-Y164 PolarHBondContact O-N 3.43Å; I128-Y164 CarbonylContact C-O 3.55Å; I128-Y164 WeakPolarHBondContact CA-O 3.27Å; I128-Y164 HydrophobicContact CG1-CD2 4.18Å; Y129-Y164 PolarHBondContact N-O 3.12Å; S162-Y164 PolarHBondContact OG-OH 3.35Å; Y164-F192 CarbonylContact C-O 3.6Å; Y164-F192 WeakPolarHBondContact CA-O 3.37Å; Y164-F192 HydrophobicContact CD1-CB 3.65Å; Y164-F192 HydrophobicContact CD1-CD2 4.39Å; Y164-F192 HydrophobicContact CD1-CG 4.33Å; Y164-F192 HydrophobicContact CE1-CB 3.8Å; Y164-F192 AromaticContact CE1-CD2 3.98Å; Y164-F192 HydrophobicContact CE1-CD2 3.98Å; Y164-F192 HydrophobicContact CE1-CG 4.02Å; Y164-V194 HydrophobicContact CD1-CG2 3.77Å; Y164-V194 HydrophobicContact CG-CG2 4.49Å; Y164-L200 HydrophobicContact CG-CD2 4.37Å; Y164-V203 HydrophobicContact CD2-CG1 4.11Å; Y164-V203 HydrophobicContact CE1-CG1 4.08Å; Y164-V203 HydrophobicContact CE1-CG2 3.84Å; Y164-V203 HydrophobicContact CE2-CG1 3.32Å; Y164-V203 WeakPolarHBondContact OH-CG1 3.43Å
165	I	84.7	Confident	80.1	Confident	12 Å²	12	45 Å²	45	6%	0.062	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	111.6	173.4	-58.7	172.1	0	0	0	108.4	Y129 H131 L163 P168 L172 V191 F192 Y193 V194	Y129-I165 HydrophobicContact CD1-CB 4.49Å; Y129-I165 HydrophobicContact CD1-CG1 4.25Å; Y129-I165 HydrophobicContact CD1-CG2 3.87Å; Y129-I165 HydrophobicContact CE1-CG2 4.42Å; Y129-I165 WeakPolarHBondContact O-CA 3.43Å; H131-I165 HydrophobicContact CB-CG2 4.12Å; L163-I165 HydrophobicContact CG-CG1 4.31Å; I165-P168 HydrophobicContact CG2-CB 4.34Å; I165-L172 HydrophobicContact CB-CD2 4.48Å; I165-L172 HydrophobicContact CD1-CD2 4.22Å; I165-L172 HydrophobicContact CG2-CD2 3.47Å; I165-L172 VanDerWaalsContact CG2-CD2 3.47Å; I165-V191 HydrophobicContact CD1-CG1 3.59Å; I165-V191 HydrophobicContact CG1-CG1 4.25Å; I165-F192 PolarHBondContact N-O 3.26Å; I165-Y193 HydrophobicContact CB-CD1 3.89Å; I165-Y193 HydrophobicContact CB-CE1 4.06Å; I165-Y193 HydrophobicContact CD1-CD1 4.46Å; I165-Y193 HydrophobicContact CD1-CE1 3.82Å; I165-Y193 HydrophobicContact CG1-CE1 4.49Å; I165-Y193 HydrophobicContact CG2-CD1 4.25Å; I165-Y193 HydrophobicContact CG2-CE1 4.3Å; I165-V194 PolarHBondContact O-N 2.78Å
166	V	82.1	Confident	79.4	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	130.6	-172.9	-168.7	0	0	0	0	109.9	I128 Y129 F130 H131 V194 L197 L200	I128-V166 HydrophobicContact CG2-CG2 3.55Å; Y129-V166 PolarHBondContact O-N 3.12Å; F130-V166 HydrophobicContact CD1-CB 3.72Å; F130-V166 HydrophobicContact CD1-CG1 3.81Å; F130-V166 HydrophobicContact CD1-CG2 4.05Å; F130-V166 HydrophobicContact CE1-CB 3.97Å; F130-V166 HydrophobicContact CE1-CG1 3.75Å; F130-V166 HydrophobicContact CE1-CG2 3.96Å; F130-V166 HydrophobicContact CG-CB 4.4Å; F130-V166 HydrophobicContact CZ-CG2 4.35Å; H131-V166 WeakPolarHBondContact CB-O 3.41Å; H131-V166 PolarHBondContact N-O 3.31Å; H131-V166 VanDerWaalsContact N-O 3.08Å; V166-V194 CarbonylContact C-O 3.53Å; V166-V194 WeakPolarHBondContact CA-O 3.5Å; V166-V194 HydrophobicContact CG2-CB 4.46Å; V166-L197 HydrophobicContact CG1-CD2 3.82Å; V166-L200 HydrophobicContact CG1-CD1 4.31Å; V166-L200 HydrophobicContact CG2-CD1 3.77Å; V166-L200 HydrophobicContact CG2-CD2 4.19Å; V166-L200 HydrophobicContact CG2-CG 4.45Å
167	H	72	Confident	78.6	Confident	55 Å²	55	46.4 Å²	46.4	26%	0.255	22%	0.219	S	C	.	.	S	Bend	trans	54.4	58.6	-176.6	-55.9	-54.4	0	0	0	113.3	T169 V194 N195	H167-T169 PolarHBondContact O-N 3.22Å; H167-V194 PolarHBondContact N-O 2.96Å; H167-N195 PolarHBondContact CE1-O 2.83Å; H167-N195 PolarHBondContact ND1-O 2.86Å
168	P	70.6	Confident	77.9	Confident	34 Å²	34	47.2 Å²	47.2	22%	0.221	23%	0.228	C	C	.	.			trans	-63.4	135.3	179.1	29.2	-36.2	0	0	0	111.5	I165 L172 Y193	I165-P168 HydrophobicContact CG2-CB 4.34Å; P168-L172 HydrophobicContact CB-CD2 3.63Å; P168-Y193 HydrophobicContact CB-CD1 3.69Å; P168-Y193 HydrophobicContact CB-CE1 4.08Å; P168-Y193 HydrophobicContact CG-CD1 3.8Å; P168-Y193 HydrophobicContact CG-CG 4.19Å
169	T	70	Confident	77.3	Confident	34 Å²	34	42.6 Å²	42.6	21%	0.209	21%	0.208	C	C	.	.			trans	-94.8	167.4	173.3	65.3	0	0	0	0	112.1	A30 H131 H167 L171 L172	A30-T169 HydrophobicContact CB-CG2 4.1Å; H131-T169 PolarHBondContact CD2-N 3.21Å; H131-T169 PolarHBondContact NE2-OG1 3.37Å; H167-T169 PolarHBondContact O-N 3.22Å; T169-L171 PolarHBondContact O-N 2.92Å; T169-L172 VanDerWaalsContact O-CB 3.29Å; T169-L172 WeakPolarHBondContact O-CB 3.34Å; T169-L172 PolarHBondContact O-N 3.42Å
170	R	68.5	Low	76.5	Confident	143 Å²	143	47.6 Å²	47.6	54%	0.54	23%	0.229	S	C	.	.	H	α-helix	trans	-58.8	-35.8	176.2	-68.9	-174.3	177.9	-178	-0.8	112.7	L172 R173 I174	R170-L172 PolarHBondContact O-N 2.95Å; R170-R173 WeakPolarHBondContact O-CB 3.37Å; R170-R173 PolarHBondContact O-N 3.28Å; R170-I174 PolarHBondContact O-N 3.21Å
171	L	68.5	Low	75.8	Confident	21 Å²	21	52.8 Å²	52.8	11%	0.11	26%	0.263	C	S	.	.	H	α-helix	trans	-58	-38.8	175.2	179.2	65.9	0	0	0	112	V35 W134 T169 R173 I174 I175	V35-L171 HydrophobicContact CG2-CD1 3.93Å; W134-L171 HydrophobicContact CE3-CD2 4.16Å; W134-L171 HydrophobicContact CZ3-CD2 4.34Å; T169-L171 PolarHBondContact O-N 2.92Å; L171-R173 PolarHBondContact O-N 3.28Å; L171-I174 WeakPolarHBondContact O-CB 3.32Å; L171-I174 PolarHBondContact O-N 3.32Å; L171-I174 VanDerWaalsContact O-N 3.07Å; L171-I175 HydrophobicContact CG-CD1 4.12Å; L171-I175 WeakPolarHBondContact O-CG1 3.47Å; L171-I175 PolarHBondContact O-N 3.15Å
172	L	69.2	Low	75.2	Confident	16 Å²	16	52.9 Å²	52.9	8%	0.084	27%	0.266	C	S	.	.	H	α-helix	trans	-61.4	-34	177.6	-171.8	71.4	0	0	0	111.6	I165 P168 T169 R170 I174 I175 W176 Y193	I165-L172 HydrophobicContact CB-CD2 4.48Å; I165-L172 HydrophobicContact CD1-CD2 4.22Å; I165-L172 HydrophobicContact CG2-CD2 3.47Å; I165-L172 VanDerWaalsContact CG2-CD2 3.47Å; P168-L172 HydrophobicContact CB-CD2 3.63Å; T169-L172 VanDerWaalsContact O-CB 3.29Å; T169-L172 WeakPolarHBondContact O-CB 3.34Å; T169-L172 PolarHBondContact O-N 3.42Å; R170-L172 PolarHBondContact O-N 2.95Å; L172-I174 VanDerWaalsContact C-N 3.34Å; L172-I175 PolarHBondContact O-N 2.69Å; L172-W176 WeakPolarHBondContact O-CB 3.36Å; L172-W176 PolarHBondContact O-N 3.05Å; L172-Y193 HydrophobicContact CD2-CD1 4.47Å; L172-Y193 HydrophobicContact CD2-CE1 3.73Å
173	R	66.9	Low	74.9	Confident	148 Å²	148	53.1 Å²	53.1	56%	0.558	27%	0.266	S	S	*	.	H	α-helix	trans	-66.2	-37.6	175.1	-51.7	-173.9	-149.6	168.4	-0.6	111.9	R170 L171 W176 A177	R170-R173 WeakPolarHBondContact O-CB 3.37Å; R170-R173 PolarHBondContact O-N 3.28Å; L171-R173 PolarHBondContact O-N 3.28Å; R173-W176 PolarHBondContact O-N 2.92Å; R173-A177 PolarHBondContact O-N 3.07Å
174	I	69.6	Low	74.6	Confident	59 Å²	59	54.7 Å²	54.7	30%	0.303	28%	0.28	S	S	.	.	H	α-helix	trans	-65.7	-46.5	176.3	-61.5	169.7	0	0	0	109.6	V35 R170 L171 L172 W176 A177 V178	V35-I174 HydrophobicContact CB-CD1 4.42Å; V35-I174 HydrophobicContact CG1-CD1 4.35Å; V35-I174 HydrophobicContact CG2-CD1 3.45Å; V35-I174 VanDerWaalsContact CG2-CD1 3.45Å; R170-I174 PolarHBondContact O-N 3.21Å; L171-I174 WeakPolarHBondContact O-CB 3.32Å; L171-I174 PolarHBondContact O-N 3.32Å; L171-I174 VanDerWaalsContact O-N 3.07Å; L172-I174 VanDerWaalsContact C-N 3.34Å; I174-W176 VanDerWaalsContact C-N 3.3Å; I174-W176 PolarHBondContact O-N 3.23Å; I174-A177 WeakPolarHBondContact O-CB 3.31Å; I174-A177 PolarHBondContact O-N 2.89Å; I174-V178 PolarHBondContact O-N 3.15Å; I174-V178 VanDerWaalsContact O-N 3.16Å
175	I	72.8	Confident	74.3	Confident	17 Å²	17	56.2 Å²	56.2	9%	0.087	30%	0.295	C	S	.	.	H	α-helix	trans	-56.3	-48.4	173.4	-65.1	171.5	0	0	0	109.4	W134 L142 L145 L171 L172 A177 V178 F179	W134-I175 HydrophobicContact CH2-CD1 3.9Å; W134-I175 HydrophobicContact CZ3-CD1 3.52Å; L142-I175 HydrophobicContact CD2-CD1 4.34Å; L142-I175 HydrophobicContact CD2-CG1 3.87Å; L142-I175 HydrophobicContact CD2-CG2 4.41Å; L145-I175 HydrophobicContact CD1-CD1 4.46Å; L145-I175 HydrophobicContact CD1-CG2 4.33Å; L171-I175 HydrophobicContact CG-CD1 4.12Å; L171-I175 WeakPolarHBondContact O-CG1 3.47Å; L171-I175 PolarHBondContact O-N 3.15Å; L172-I175 PolarHBondContact O-N 2.69Å; I175-A177 VanDerWaalsContact C-N 3.29Å; I175-A177 PolarHBondContact O-N 2.85Å; I175-V178 PolarHBondContact O-N 3.46Å; I175-V178 VanDerWaalsContact O-N 3.09Å; I175-F179 HydrophobicContact CG2-CD2 3.67Å; I175-F179 HydrophobicContact CG2-CE2 3.69Å; I175-F179 WeakPolarHBondContact O-CD2 3.46Å; I175-F179 PolarHBondContact O-N 3.4Å
176	W	72	Confident	74.2	Confident	54 Å²	54	62.6 Å²	62.6	21%	0.205	32%	0.322	C	S	.	.	H	α-helix	trans	-60.1	-38.1	179.4	-163.4	-111.7	0	0	0	113.1	L172 R173 I174 V178 F179 K180 V183 F187 E188 V191	L172-W176 WeakPolarHBondContact O-CB 3.36Å; L172-W176 PolarHBondContact O-N 3.05Å; R173-W176 PolarHBondContact O-N 2.92Å; I174-W176 VanDerWaalsContact C-N 3.3Å; I174-W176 PolarHBondContact O-N 3.23Å; W176-V178 VanDerWaalsContact C-N 3.32Å; W176-V178 PolarHBondContact O-N 2.75Å; W176-F179 PolarHBondContact O-N 3Å; W176-K180 WeakPolarHBondContact O-CB 3.12Å; W176-K180 PolarHBondContact O-N 3.34Å; W176-V183 HydrophobicContact CH2-CB 4.42Å; W176-V183 HydrophobicContact CH2-CG1 3.87Å; W176-V183 HydrophobicContact CH2-CG2 4.18Å; W176-V183 HydrophobicContact CZ2-CG1 4.23Å; W176-V183 HydrophobicContact CZ3-CG2 4.33Å; W176-F187 HydrophobicContact CH2-CD1 4.5Å; W176-E188 HydrophobicContact CZ2-CB 4.18Å; W176-E188 HydrophobicContact CZ2-CG 4Å; W176-V191 HydrophobicContact CH2-CG2 3.9Å; W176-V191 HydrophobicContact CZ2-CG2 4.41Å
177	A	71.1	Confident	74.4	Confident	67 Å²	67	63.7 Å²	63.7	55%	0.554	33%	0.327	S	S	*	.	H	α-helix	trans	-61.8	-39.8	175.7	0	0	0	0	0	112.4	R173 I174 I175	R173-A177 PolarHBondContact O-N 3.07Å; I174-A177 WeakPolarHBondContact O-CB 3.31Å; I174-A177 PolarHBondContact O-N 2.89Å; I175-A177 VanDerWaalsContact C-N 3.29Å; I175-A177 PolarHBondContact O-N 2.85Å
178	V	74.9	Confident	74.8	Confident	58 Å²	58	64.4 Å²	64.4	35%	0.352	33%	0.331	S	S	.	.	H	α-helix	trans	-68.6	-37.9	175.2	175.9	0	0	0	0	111.4	I174 I175 W176 P181	I174-V178 PolarHBondContact O-N 3.15Å; I174-V178 VanDerWaalsContact O-N 3.16Å; I175-V178 PolarHBondContact O-N 3.46Å; I175-V178 VanDerWaalsContact O-N 3.09Å; W176-V178 VanDerWaalsContact C-N 3.32Å; W176-V178 PolarHBondContact O-N 2.75Å; V178-P181 WeakPolarHBondContact O-CD 3.43Å
179	F	74.2	Confident	75.4	Confident	15 Å²	15	70.4 Å²	70.4	7%	0.066	35%	0.349	C	S	.	.	H	α-helix	trans	-81.8	-21.4	-177.4	-82.8	-107.6	0	0	0	113.8	L142 L145 V146 I175 W176 P181 M182 V183	L142-F179 HydrophobicContact CD2-CE2 4.38Å; L145-F179 HydrophobicContact CB-CE1 4.12Å; L145-F179 HydrophobicContact CB-CE2 4.29Å; L145-F179 HydrophobicContact CB-CZ 3.43Å; L145-F179 VanDerWaalsContact CB-CZ 3.43Å; V146-F179 HydrophobicContact CB-CE1 4.35Å; V146-F179 HydrophobicContact CB-CZ 4.3Å; V146-F179 HydrophobicContact CG2-CE1 3.66Å; V146-F179 HydrophobicContact CG2-CE2 4.1Å; V146-F179 HydrophobicContact CG2-CZ 3.4Å; I175-F179 HydrophobicContact CG2-CD2 3.67Å; I175-F179 HydrophobicContact CG2-CE2 3.69Å; I175-F179 WeakPolarHBondContact O-CD2 3.46Å; I175-F179 PolarHBondContact O-N 3.4Å; W176-F179 PolarHBondContact O-N 3Å; F179-P181 VanDerWaalsContact C-CD 3.46Å; F179-M182 WeakPolarHBondContact O-CA 3.35Å; F179-M182 WeakPolarHBondContact O-CB 3.16Å; F179-M182 PolarHBondContact O-N 2.79Å; F179-V183 HydrophobicContact CB-CG2 4.21Å; F179-V183 WeakPolarHBondContact O-CG2 3.2Å; F179-V183 PolarHBondContact O-N 2.68Å; F179-V183 VanDerWaalsContact O-N 3.08Å
180	K	72.8	Confident	76.3	Confident	119 Å²	119	70.6 Å²	70.6	52%	0.517	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.7	-42.6	-173.6	-167.3	175.6	-175	178.8	0	114.6	W176 M182 V183	W176-K180 WeakPolarHBondContact O-CB 3.12Å; W176-K180 PolarHBondContact O-N 3.34Å; K180-M182 PolarHBondContact O-N 2.86Å; K180-V183 PolarHBondContact O-N 3.24Å
181	P	78	Confident	77	Confident	117 Å²	117	64.7 Å²	64.7	76%	0.76	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-23.7	176.8	-21.6	34.3	0	0	0	113.8	V178 F179	V178-P181 WeakPolarHBondContact O-CD 3.43Å; F179-P181 VanDerWaalsContact C-CD 3.46Å
182	M	76.8	Confident	77.7	Confident	73 Å²	73	67.8 Å²	67.8	36%	0.36	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.2	-20.8	-176.1	-58.6	-177.1	61.9	0	0	112.8	V146 F179 K180	V146-M182 HydrophobicContact CG1-CE 3.6Å; V146-M182 HydrophobicContact CG1-SD 4.36Å; V146-M182 HydrophobicContact CG2-SD 4.47Å; F179-M182 WeakPolarHBondContact O-CA 3.35Å; F179-M182 WeakPolarHBondContact O-CB 3.16Å; F179-M182 PolarHBondContact O-N 2.79Å; K180-M182 PolarHBondContact O-N 2.86Å
183	V	80.7	Confident	78.2	Confident	13 Å²	13	71.8 Å²	71.8	8%	0.079	35%	0.354	C	S	.	.	S	Bend	trans	-89.7	126.5	-176.7	174.7	0	0	0	0	110.2	Y149 W176 F179 K180 S185 F187 E188	Y149-V183 HydrophobicContact CE1-CG2 4.44Å; Y149-V183 HydrophobicContact CE2-CG2 4.07Å; W176-V183 HydrophobicContact CH2-CB 4.42Å; W176-V183 HydrophobicContact CH2-CG1 3.87Å; W176-V183 HydrophobicContact CH2-CG2 4.18Å; W176-V183 HydrophobicContact CZ2-CG1 4.23Å; W176-V183 HydrophobicContact CZ3-CG2 4.33Å; F179-V183 HydrophobicContact CB-CG2 4.21Å; F179-V183 WeakPolarHBondContact O-CG2 3.2Å; F179-V183 PolarHBondContact O-N 2.68Å; F179-V183 VanDerWaalsContact O-N 3.08Å; K180-V183 PolarHBondContact O-N 3.24Å; V183-S185 PolarHBondContact O-N 3.23Å; V183-F187 HydrophobicContact CG1-CB 4.01Å; V183-F187 HydrophobicContact CG1-CD1 3.55Å; V183-F187 HydrophobicContact CG1-CE1 4.48Å; V183-F187 HydrophobicContact CG1-CG 4.19Å; V183-E188 HydrophobicContact CG1-CB 4.45Å
184	S	83.6	Confident	78.5	Confident	62 Å²	62	65.1 Å²	65.1	43%	0.434	33%	0.33	S	S	.	.			trans	-60.1	138.1	173.3	179.7	0	0	0	0	111.2	K186 F187 E188	S184-K186 PolarHBondContact O-N 2.8Å; S184-K186 PolarHBondContact OG-N 2.8Å; S184-F187 WeakPolarHBondContact O-CA 3.48Å; S184-F187 WeakPolarHBondContact O-CB 3.47Å; S184-F187 PolarHBondContact O-N 2.88Å; S184-E188 PolarHBondContact O-N 2.8Å
185	S	81.3	Confident	78.4	Confident	64 Å²	64	64.8 Å²	64.8	45%	0.448	33%	0.329	S	S	.	.	H	α-helix	trans	-55.9	-27	173.2	66.3	0	0	0	0	113.3	V183 F187 R189	V183-S185 PolarHBondContact O-N 3.23Å; S185-F187 VanDerWaalsContact C-N 3.34Å; S185-R189 WeakPolarHBondContact O-CG 3.43Å; S185-R189 PolarHBondContact O-N 2.8Å; S185-R189 PolarHBondContact O-NH1 3.3Å
186	K	83.7	Confident	78.3	Confident	145 Å²	145	68.9 Å²	68.9	63%	0.63	34%	0.344	S	S	*	.	H	α-helix	trans	-67.8	-33.5	173	-73.5	-179.8	-179.1	179.7	0	112.7	S184	S184-K186 PolarHBondContact O-N 2.8Å; S184-K186 PolarHBondContact OG-N 2.8Å
187	F	84.6	Confident	78	Confident	24 Å²	24	68.2 Å²	68.2	11%	0.105	34%	0.344	C	S	.	.	H	α-helix	trans	-79.5	-41.3	177.2	-175.8	-87.3	0	0	0	110.9	Y149 K157 L160 L163 W176 V183 S184 S185 R189 K190 V191	Y149-F187 HydrophobicContact CE2-CD1 4.26Å; Y149-F187 HydrophobicContact CE2-CE1 4.17Å; Y149-F187 HydrophobicContact CE2-CZ 4.36Å; K157-F187 HydrophobicContact CB-CD2 4.27Å; K157-F187 HydrophobicContact CG-CD2 4.02Å; K157-F187 HydrophobicContact CG-CE2 4.06Å; L160-F187 HydrophobicContact CD2-CD2 4.45Å; L160-F187 HydrophobicContact CD2-CE2 3.62Å; L160-F187 HydrophobicContact CD2-CZ 4.16Å; L163-F187 HydrophobicContact CD2-CE1 4.42Å; L163-F187 HydrophobicContact CD2-CZ 4.12Å; W176-F187 HydrophobicContact CH2-CD1 4.5Å; V183-F187 HydrophobicContact CG1-CB 4.01Å; V183-F187 HydrophobicContact CG1-CD1 3.55Å; V183-F187 HydrophobicContact CG1-CE1 4.48Å; V183-F187 HydrophobicContact CG1-CG 4.19Å; S184-F187 WeakPolarHBondContact O-CA 3.48Å; S184-F187 WeakPolarHBondContact O-CB 3.47Å; S184-F187 PolarHBondContact O-N 2.88Å; S185-F187 VanDerWaalsContact C-N 3.34Å; F187-R189 PolarHBondContact O-N 2.82Å; F187-K190 WeakPolarHBondContact O-CA 3.39Å; F187-K190 VanDerWaalsContact O-CB 3.29Å; F187-K190 WeakPolarHBondContact O-CB 3.45Å; F187-K190 PolarHBondContact O-N 2.79Å; F187-V191 HydrophobicContact CD1-CG2 4.27Å; F187-V191 HydrophobicContact CE1-CG2 4.02Å
188	E	80.7	Confident	77.8	Confident	69 Å²	69	70.1 Å²	70.1	32%	0.322	34%	0.341	S	S	.	.	H	α-helix	trans	-53.6	-40.6	176	178.6	171.8	-148.8	0	0	112.2	W176 V183 S184 K190 V191	W176-E188 HydrophobicContact CZ2-CB 4.18Å; W176-E188 HydrophobicContact CZ2-CG 4Å; V183-E188 HydrophobicContact CG1-CB 4.45Å; S184-E188 PolarHBondContact O-N 2.8Å; E188-K190 PolarHBondContact O-N 3.17Å; E188-V191 PolarHBondContact O-N 2.98Å
189	R	84.4	Confident	77.2	Confident	161 Å²	161	70.8 Å²	70.8	61%	0.608	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-9.7	175.9	-72.1	-170.7	-65.9	-92.2	10.7	115.4	S185 F187	S185-R189 WeakPolarHBondContact O-CG 3.43Å; S185-R189 PolarHBondContact O-N 2.8Å; S185-R189 PolarHBondContact O-NH1 3.3Å; F187-R189 PolarHBondContact O-N 2.82Å
190	K	87.4	Confident	77.2	Confident	37 Å²	37	70.4 Å²	70.4	16%	0.161	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.1	-10.9	177.3	-55.8	174.7	175.7	-163.4	0	111.8	K157 K158 L160 S162 L163 F187 E188 F192	K157-K190 PolarHBondContact O-NZ 3.02Å; K158-K190 PolarHBondContact O-NZ 3.35Å; K158-K190 VanDerWaalsContact O-NZ 3.15Å; L160-K190 VanDerWaalsContact O-CD 3.23Å; L160-K190 WeakPolarHBondContact O-CD 3.36Å; L160-K190 WeakPolarHBondContact O-CE 3.39Å; L160-K190 PolarHBondContact O-NZ 2.81Å; S162-K190 CarbonylContact C-O 3.58Å; S162-K190 WeakPolarHBondContact CA-O 3.23Å; L163-K190 PolarHBondContact N-O 3.25Å; F187-K190 WeakPolarHBondContact O-CA 3.39Å; F187-K190 VanDerWaalsContact O-CB 3.29Å; F187-K190 WeakPolarHBondContact O-CB 3.45Å; F187-K190 PolarHBondContact O-N 2.79Å; E188-K190 PolarHBondContact O-N 3.17Å; K190-F192 WeakPolarHBondContact O-CD2 3.3Å; K190-F192 WeakPolarHBondContact O-CE2 3.5Å
191	V	84.3	Confident	76.9	Confident	19 Å²	19	69.6 Å²	69.6	12%	0.115	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	121.9	-176.7	-173.9	0	0	0	0	109.3	L163 I165 W176 F187 E188	L163-V191 HydrophobicContact CD2-CG2 4.21Å; L163-V191 CarbonylContact O-C 3.52Å; L163-V191 WeakPolarHBondContact O-CA 3.35Å; I165-V191 HydrophobicContact CD1-CG1 3.59Å; I165-V191 HydrophobicContact CG1-CG1 4.25Å; W176-V191 HydrophobicContact CH2-CG2 3.9Å; W176-V191 HydrophobicContact CZ2-CG2 4.41Å; F187-V191 HydrophobicContact CD1-CG2 4.27Å; F187-V191 HydrophobicContact CE1-CG2 4.02Å; E188-V191 PolarHBondContact O-N 2.98Å
192	F	82	Confident	76.2	Confident	86 Å²	86	71 Å²	71	38%	0.377	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	124.9	-178.6	-59.7	-80.2	0	0	0	109.6	L163 Y164 I165 K190	L163-F192 PolarHBondContact O-N 3.31Å; Y164-F192 CarbonylContact C-O 3.6Å; Y164-F192 WeakPolarHBondContact CA-O 3.37Å; Y164-F192 HydrophobicContact CD1-CB 3.65Å; Y164-F192 HydrophobicContact CD1-CD2 4.39Å; Y164-F192 HydrophobicContact CD1-CG 4.33Å; Y164-F192 HydrophobicContact CE1-CB 3.8Å; Y164-F192 AromaticContact CE1-CD2 3.98Å; Y164-F192 HydrophobicContact CE1-CD2 3.98Å; Y164-F192 HydrophobicContact CE1-CG 4.02Å; I165-F192 PolarHBondContact N-O 3.26Å; K190-F192 WeakPolarHBondContact O-CD2 3.3Å; K190-F192 WeakPolarHBondContact O-CE2 3.5Å
193	Y	79.5	Confident	75.6	Confident	100 Å²	100	68.9 Å²	68.9	39%	0.392	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	129.6	174.2	-67.1	-58.6	0	0	0	110.4	I165 P168 L172	I165-Y193 HydrophobicContact CB-CD1 3.89Å; I165-Y193 HydrophobicContact CB-CE1 4.06Å; I165-Y193 HydrophobicContact CD1-CD1 4.46Å; I165-Y193 HydrophobicContact CD1-CE1 3.82Å; I165-Y193 HydrophobicContact CG1-CE1 4.49Å; I165-Y193 HydrophobicContact CG2-CD1 4.25Å; I165-Y193 HydrophobicContact CG2-CE1 4.3Å; P168-Y193 HydrophobicContact CB-CD1 3.69Å; P168-Y193 HydrophobicContact CB-CE1 4.08Å; P168-Y193 HydrophobicContact CG-CD1 3.8Å; P168-Y193 HydrophobicContact CG-CG 4.19Å; L172-Y193 HydrophobicContact CD2-CD1 4.47Å; L172-Y193 HydrophobicContact CD2-CE1 3.73Å
194	V	74.2	Confident	75	Confident	8 Å²	8	68.9 Å²	68.9	5%	0.048	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	113.4	179.7	175.4	0	0	0	0	108.7	Y164 I165 V166 H167 Y196 Q199 L200	Y164-V194 HydrophobicContact CD1-CG2 3.77Å; Y164-V194 HydrophobicContact CG-CG2 4.49Å; I165-V194 PolarHBondContact O-N 2.78Å; V166-V194 CarbonylContact C-O 3.53Å; V166-V194 WeakPolarHBondContact CA-O 3.5Å; V166-V194 HydrophobicContact CG2-CB 4.46Å; H167-V194 PolarHBondContact N-O 2.96Å; V194-Y196 VanDerWaalsContact CG1-O 3.22Å; V194-Y196 WeakPolarHBondContact CG1-O 3.14Å; V194-Q199 HydrophobicContact CG1-CB 3.86Å; V194-L200 HydrophobicContact CB-CD2 4.36Å; V194-L200 HydrophobicContact CG1-CD2 4.05Å; V194-L200 HydrophobicContact CG1-CG 3.97Å; V194-L200 HydrophobicContact CG2-CD2 4.04Å
195	N	68	Low	73.8	Confident	53 Å²	53	71.4 Å²	71.4	28%	0.283	32%	0.32	S	S	.	.	S	Bend	trans	-87.5	-22.1	-177.5	-68.3	-30.7	0	0	0	112.3	H167	H167-N195 PolarHBondContact CE1-O 2.83Å; H167-N195 PolarHBondContact ND1-O 2.86Å
196	Y	69.2	Low	72.3	Confident	102 Å²	102	69.6 Å²	69.6	40%	0.4	31%	0.307	S	S	.	.	S	Bend	trans	-135.6	136.1	-176.5	-53.1	-79.6	0	0	0	111.5	V194 H198 Q199	V194-Y196 VanDerWaalsContact CG1-O 3.22Å; V194-Y196 WeakPolarHBondContact CG1-O 3.14Å; Y196-H198 WeakPolarHBondContact CB-CE1 3.37Å; Y196-H198 VanDerWaalsContact CB-ND1 3.28Å; Y196-H198 WeakPolarHBondContact CB-ND1 3.41Å; Y196-H198 AromaticContact CD2-CE1 3.89Å; Y196-H198 AromaticContact CG-CE1 3.64Å; Y196-H198 PolarHBondContact O-N 2.75Å; Y196-H198 VanDerWaalsContact O-N 3.13Å; Y196-Q199 WeakPolarHBondContact O-CB 3.29Å; Y196-Q199 PolarHBondContact O-N 2.82Å
197	L	67.5	Low	70.8	Confident	41 Å²	41	69.6 Å²	69.6	22%	0.215	31%	0.314	C	S	.	.	H	α-helix	trans	-57.6	-30.7	-179.1	-61.8	178.5	0	0	0	113.4	F130 V166 Q199 L200 F214	F130-L197 HydrophobicContact CE1-CD2 3.65Å; F130-L197 HydrophobicContact CZ-CD2 4.44Å; V166-L197 HydrophobicContact CG1-CD2 3.82Å; L197-Q199 PolarHBondContact O-N 2.85Å; L197-L200 HydrophobicContact CD2-CD1 4.08Å; L197-L200 WeakPolarHBondContact O-CB 3.48Å; L197-L200 PolarHBondContact O-N 3.28Å; L197-F214 HydrophobicContact CB-CD1 4.27Å; L197-F214 HydrophobicContact CB-CE1 3.38Å; L197-F214 HydrophobicContact CB-CZ 3.73Å; L197-F214 WeakPolarHBondContact O-CZ 3.3Å
198	H	65	Low	69	Low	107 Å²	107	71.5 Å²	71.5	50%	0.495	32%	0.323	S	S	.	.	H	α-helix	trans	-61.2	-27.3	178.5	70.6	-99.9	0	0	0	112.6	Y196 L200 R201	Y196-H198 WeakPolarHBondContact CB-CE1 3.37Å; Y196-H198 VanDerWaalsContact CB-ND1 3.28Å; Y196-H198 WeakPolarHBondContact CB-ND1 3.41Å; Y196-H198 AromaticContact CD2-CE1 3.89Å; Y196-H198 AromaticContact CG-CE1 3.64Å; Y196-H198 PolarHBondContact O-N 2.75Å; Y196-H198 VanDerWaalsContact O-N 3.13Å; H198-L200 PolarHBondContact O-N 3.14Å; H198-R201 VanDerWaalsContact O-CB 3.32Å; H198-R201 WeakPolarHBondContact O-CB 3.38Å; H198-R201 PolarHBondContact O-N 3.27Å
199	Q	64	Low	67.3	Low	71 Å²	71	68.7 Å²	68.7	33%	0.332	31%	0.31	S	S	.	.	H	α-helix	trans	-68	-27	175.4	-58.6	176.1	-40.1	0	0	111.3	V194 Y196 L197 R201 E202	V194-Q199 HydrophobicContact CG1-CB 3.86Å; Y196-Q199 WeakPolarHBondContact O-CB 3.29Å; Y196-Q199 PolarHBondContact O-N 2.82Å; L197-Q199 PolarHBondContact O-N 2.85Å; Q199-R201 VanDerWaalsContact C-N 3.32Å; Q199-E202 PolarHBondContact O-N 2.76Å
200	L	72.5	Confident	65.4	Low	7 Å²	7	63.8 Å²	63.8	4%	0.037	30%	0.296	C	S	.	.	H	α-helix	trans	-70.8	-27.1	173.8	-62.9	174.1	0	0	0	112.4	I128 F130 Y164 V166 V194 L197 H198 E202 V203 V204	I128-L200 HydrophobicContact CD1-CD2 4.33Å; I128-L200 HydrophobicContact CG2-CD1 4.42Å; F130-L200 HydrophobicContact CE1-CD1 4.22Å; F130-L200 HydrophobicContact CZ-CD1 3.98Å; Y164-L200 HydrophobicContact CG-CD2 4.37Å; V166-L200 HydrophobicContact CG1-CD1 4.31Å; V166-L200 HydrophobicContact CG2-CD1 3.77Å; V166-L200 HydrophobicContact CG2-CD2 4.19Å; V166-L200 HydrophobicContact CG2-CG 4.45Å; V194-L200 HydrophobicContact CB-CD2 4.36Å; V194-L200 HydrophobicContact CG1-CD2 4.05Å; V194-L200 HydrophobicContact CG1-CG 3.97Å; V194-L200 HydrophobicContact CG2-CD2 4.04Å; L197-L200 HydrophobicContact CD2-CD1 4.08Å; L197-L200 WeakPolarHBondContact O-CB 3.48Å; L197-L200 PolarHBondContact O-N 3.28Å; H198-L200 PolarHBondContact O-N 3.14Å; L200-E202 PolarHBondContact O-N 3Å; L200-V203 WeakPolarHBondContact O-CA 3.37Å; L200-V203 WeakPolarHBondContact O-CB 3.42Å; L200-V203 PolarHBondContact O-N 3.07Å; L200-V204 PolarHBondContact O-N 2.98Å
201	R	67.2	Low	63.2	Low	102 Å²	102	71 Å²	71	39%	0.385	32%	0.322	S	S	.	.	H	α-helix	trans	-63	-27.7	174.3	-62	175.6	169.9	-115.4	-7.5	111.7	K85 H198 Q199 V203 D210 F214	K85-R201 WeakPolarHBondContact CE-O 3.35Å; K85-R201 PolarHBondContact NZ-O 2.76Å; H198-R201 VanDerWaalsContact O-CB 3.32Å; H198-R201 WeakPolarHBondContact O-CB 3.38Å; H198-R201 PolarHBondContact O-N 3.27Å; Q199-R201 VanDerWaalsContact C-N 3.32Å; R201-V203 PolarHBondContact O-N 3.16Å; R201-D210 VanDerWaalsContact CZ-CG 3.49Å; R201-D210 IonicContact CZ-OD1 2.78Å; R201-D210 IonicContact CZ-OD2 3.13Å; R201-D210 VanDerWaalsContact CZ-OD2 3.24Å; R201-D210 IonicContact NE-OD1 3.25Å; R201-D210 PolarHBondContact NE-OD1 3.24Å; R201-D210 IonicContact NH1-OD1 3.94Å; R201-D210 PolarHBondContact NH1-OD1 3.33Å; R201-D210 IonicContact NH1-OD2 3.93Å; R201-D210 PolarHBondContact NH1-OD2 3.44Å; R201-D210 IonicContact NH2-OD1 3.04Å; R201-D210 PolarHBondContact NH2-OD1 3.3Å; R201-D210 VanDerWaalsContact NH2-OD1 3.13Å; R201-D210 IonicContact NH2-OD2 3.27Å; R201-D210 PolarHBondContact NH2-OD2 3.3Å; R201-F214 HydrophobicContact CG-CE1 4.23Å; R201-F214 HydrophobicContact CG-CE2 4.13Å; R201-F214 HydrophobicContact CG-CZ 3.66Å; R201-F214 VanDerWaalsContact NE-CE1 3.34Å
202	E	63.8	Low	61.2	Low	148 Å²	148	77 Å²	77	69%	0.692	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-18	173.9	-64.6	-166.1	170.6	0	0	112.7	K85 Q199 L200	K85-E202 WeakPolarHBondContact CD-O 3.38Å; K85-E202 VanDerWaalsContact CE-O 3.3Å; K85-E202 WeakPolarHBondContact CE-O 3.48Å; K85-E202 PolarHBondContact NZ-O 3.42Å; Q199-E202 PolarHBondContact O-N 2.76Å; L200-E202 PolarHBondContact O-N 3Å
203	V	64.2	Low	59.4	Low	27 Å²	27	75 Å²	75	16%	0.164	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.4	-51	-172.6	175.2	0	0	0	0	112.3	K85 Y164 L200 R201	K85-V203 PolarHBondContact N-O 2.93Å; K85-V203 VanDerWaalsContact N-O 3.14Å; Y164-V203 HydrophobicContact CD2-CG1 4.11Å; Y164-V203 HydrophobicContact CE1-CG1 4.08Å; Y164-V203 HydrophobicContact CE1-CG2 3.84Å; Y164-V203 HydrophobicContact CE2-CG1 3.32Å; Y164-V203 WeakPolarHBondContact OH-CG1 3.43Å; L200-V203 WeakPolarHBondContact O-CA 3.37Å; L200-V203 WeakPolarHBondContact O-CB 3.42Å; L200-V203 PolarHBondContact O-N 3.07Å; R201-V203 PolarHBondContact O-N 3.16Å
204	V	68.2	Low	57.8	Low	13 Å²	13	72.2 Å²	72.2	8%	0.079	33%	0.334	C	S	.	.	B	Isolated β-bridge	trans	-98.2	134.3	-175.3	-165	0	0	0	0	109.8	V90 I128 L200 C206	V90-V204 HydrophobicContact CG1-CG2 4.39Å; V90-V204 HydrophobicContact CG2-CG1 4.32Å; I128-V204 HydrophobicContact CD1-CG2 3.55Å; L200-V204 PolarHBondContact O-N 2.98Å; V204-C206 WeakPolarHBondContact CG1-SG 3.39Å; V204-C206 PolarHBondContact O-N 2.76Å
205	R	59.1	Low	55.9	Low	115 Å²	115	80.3 Å²	80.3	43%	0.434	37%	0.371	S	S	.	.			trans	-82	103.3	163.9	-85.4	-160.7	174.8	164.5	1.2	107.2	D83 K85 E315	D83-R205 PolarHBondContact O-N 3.42Å; K85-R205 HydrophobicContact CG-CG 3.7Å; R205-E315 IonicContact CZ-OE1 2.69Å; R205-E315 IonicContact NH1-OE1 2.86Å; R205-E315 PolarHBondContact NH1-OE1 3.09Å; R205-E315 IonicContact NH2-OE1 2.69Å; R205-E315 PolarHBondContact NH2-OE1 3.1Å
206	C	49.7	Very low	54.2	Low	26 Å²	26	83.2 Å²	83.2	18%	0.176	39%	0.393	C	S	.	.			trans	-121.6	97.3	171.9	-79.8	0	0	0	0	109.3	V81 V204 H209	V81-C206 VanDerWaalsContact CG1-SG 3.57Å; V204-C206 WeakPolarHBondContact CG1-SG 3.39Å; V204-C206 PolarHBondContact O-N 2.76Å; C206-H209 HydrophobicContact CB-CB 3.52Å; C206-H209 WeakPolarHBondContact SG-CB 3.35Å
207	D	50.7	Low	52.5	Low	145 Å²	145	90 Å²	90	78%	0.775	42%	0.418	S	S	*	.	S	Bend	trans	-66.5	-27.2	157.4	-73.5	-30.4	0	0	0	109.9
208	H	46.9	Very low	50.6	Low	65 Å²	65	97.2 Å²	97.2	30%	0.301	45%	0.447	S	S	.	.	S	Bend	trans	-93.9	-49	-172	-55.7	63.2	0	0	0	114.1	D210 R211 G389 D390	H208-D210 VanDerWaalsContact C-N 3.26Å; H208-D210 PolarHBondContact O-N 2.79Å; H208-R211 PolarHBondContact O-N 3.19Å; H208-G389 PolarHBondContact NE2-O 3.22Å; H208-D390 PolarHBondContact CD2-O 3.47Å; H208-D390 VanDerWaalsContact NE2-CA 3.32Å; H208-D390 WeakPolarHBondContact NE2-CA 3.45Å
209	H	45.8	Very low	48.7	Very low	10 Å²	10	103 Å²	103	5%	0.046	47%	0.465	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-13.7	-173.4	-124	64.3	0	0	0	113.7	V81 Y94 C206 R211 M212 L213 Q392	V81-H209 HydrophobicContact CG1-CB 3.91Å; V81-H209 VanDerWaalsContact CG1-CG 3.43Å; V81-H209 WeakPolarHBondContact CG1-ND1 3.47Å; V81-H209 WeakPolarHBondContact CG2-CE1 3.43Å; V81-H209 WeakPolarHBondContact CG2-NE2 3.36Å; Y94-H209 PolarHBondContact OH-NE2 2.88Å; C206-H209 HydrophobicContact CB-CB 3.52Å; C206-H209 WeakPolarHBondContact SG-CB 3.35Å; H209-R211 PolarHBondContact O-N 2.91Å; H209-R211 VanDerWaalsContact O-N 3.15Å; H209-M212 PolarHBondContact O-N 2.89Å; H209-L213 VanDerWaalsContact CD2-CD1 3.48Å; H209-L213 WeakPolarHBondContact CD2-CD1 3.41Å; H209-L213 PolarHBondContact O-N 3.11Å; H209-Q392 PolarHBondContact CE1-NE2 3.13Å; H209-Q392 PolarHBondContact ND1-NE2 3.28Å
210	D	44.6	Very low	47.1	Very low	57 Å²	57	106.2 Å²	106.2	31%	0.305	49%	0.49	S	S	.	.	H	α-helix	trans	-55.7	-26.8	167.1	-108.7	19.7	0	0	0	111.3	R201 H208 F214	R201-D210 VanDerWaalsContact CZ-CG 3.49Å; R201-D210 IonicContact CZ-OD1 2.78Å; R201-D210 IonicContact CZ-OD2 3.13Å; R201-D210 VanDerWaalsContact CZ-OD2 3.24Å; R201-D210 IonicContact NE-OD1 3.25Å; R201-D210 PolarHBondContact NE-OD1 3.24Å; R201-D210 IonicContact NH1-OD1 3.94Å; R201-D210 PolarHBondContact NH1-OD1 3.33Å; R201-D210 IonicContact NH1-OD2 3.93Å; R201-D210 PolarHBondContact NH1-OD2 3.44Å; R201-D210 IonicContact NH2-OD1 3.04Å; R201-D210 PolarHBondContact NH2-OD1 3.3Å; R201-D210 VanDerWaalsContact NH2-OD1 3.13Å; R201-D210 IonicContact NH2-OD2 3.27Å; R201-D210 PolarHBondContact NH2-OD2 3.3Å; H208-D210 VanDerWaalsContact C-N 3.26Å; H208-D210 PolarHBondContact O-N 2.79Å; D210-F214 CarbonylContact O-C 3.33Å; D210-F214 WeakPolarHBondContact O-CB 3.41Å; D210-F214 PolarHBondContact O-N 3.16Å; D210-F214 WeakPolarHBondContact OD1-CD2 3.19Å
211	R	41.4	Very low	44.9	Very low	188 Å²	188	114.4 Å²	114.4	71%	0.709	53%	0.528	S	S	*	.	H	α-helix	trans	-81.6	-34.4	177.2	-73.2	-176.7	169.3	163.2	-0.7	115.1	H208 H209	H208-R211 PolarHBondContact O-N 3.19Å; H209-R211 PolarHBondContact O-N 2.91Å; H209-R211 VanDerWaalsContact O-N 3.15Å
212	M	41.6	Very low	43.2	Very low	146 Å²	146	118.6 Å²	118.6	72%	0.719	55%	0.549	S	S	*	.	H	α-helix	trans	-88.7	-38.9	-177.2	-78.9	-167.1	129	0	0	113.2	H209	H209-M212 PolarHBondContact O-N 2.89Å
213	L	45.1	Very low	41.7	Very low	45 Å²	45	117.2 Å²	117.2	24%	0.236	55%	0.553	C	S	.	*	H	α-helix	trans	-86	-24.6	179.7	-71.5	-179.4	0	0	0	113.3	F130 H209	F130-L213 HydrophobicContact CE1-CD2 4.38Å; F130-L213 HydrophobicContact CZ-CD1 3.77Å; F130-L213 HydrophobicContact CZ-CD2 4.11Å; H209-L213 VanDerWaalsContact CD2-CD1 3.48Å; H209-L213 WeakPolarHBondContact CD2-CD1 3.41Å; H209-L213 PolarHBondContact O-N 3.11Å
214	F	45.4	Very low	40.2	Very low	41 Å²	41	121.2 Å²	121.2	18%	0.18	58%	0.582	C	S	.	*	S	Bend	trans	-123.6	90	-175	-49.1	-97.9	0	0	0	109.2	L197 R201 D210	L197-F214 HydrophobicContact CB-CD1 4.27Å; L197-F214 HydrophobicContact CB-CE1 3.38Å; L197-F214 HydrophobicContact CB-CZ 3.73Å; L197-F214 WeakPolarHBondContact O-CZ 3.3Å; R201-F214 HydrophobicContact CG-CE1 4.23Å; R201-F214 HydrophobicContact CG-CE2 4.13Å; R201-F214 HydrophobicContact CG-CZ 3.66Å; R201-F214 VanDerWaalsContact NE-CE1 3.34Å; D210-F214 CarbonylContact O-C 3.33Å; D210-F214 WeakPolarHBondContact O-CB 3.41Å; D210-F214 PolarHBondContact O-N 3.16Å; D210-F214 WeakPolarHBondContact OD1-CD2 3.19Å
215	Q	33.3	Very low	39.2	Very low	177 Å²	177	128.4 Å²	128.4	83%	0.827	62%	0.619	S	S	*	*			trans	-46.8	136.5	167.8	-71.6	-177.6	3.9	0	0	110	R217	Q215-R217 PolarHBondContact O-N 3.01Å
216	P	33.7	Very low	38.9	Very low	115 Å²	115	127.7 Å²	127.7	75%	0.747	63%	0.631	S	S	*	*			trans	-75	101.9	-157.8	29.3	-34	0	0	0	110.6	K218	P216-K218 PolarHBondContact O-N 3.19Å
217	R	32.2	Very low	39.9	Very low	245 Å²	245	132 Å²	132	93%	0.925	66%	0.659	S	S	*	*			trans	-78.5	106.1	155.7	-76.3	-171.5	172.8	-179.5	-0.7	107.6	Q215	Q215-R217 PolarHBondContact O-N 3.01Å
218	K	27.5	Very low	41.4	Very low	192 Å²	192	130 Å²	130	84%	0.835	65%	0.647	S	S	*	*			trans	20.3	104.8	166.6	-75.1	-178.1	175.2	-179.2	0	115.3	P216 T220	P216-K218 PolarHBondContact O-N 3.19Å; K218-T220 PolarHBondContact O-N 3.06Å
219	W	26.8	Very low	43.4	Very low	228 Å²	228	130.2 Å²	130.2	86%	0.864	65%	0.649	S	S	*	*			trans	-14	95.6	157.2	-59.4	80.8	0	0	0	113
220	T	28.6	Very low	45.6	Very low	138 Å²	138	133.8 Å²	133.8	85%	0.847	67%	0.673	S	S	*	*			trans	-79.5	114.9	150.5	17.1	0	0	0	0	104.4	K218 K222	K218-T220 PolarHBondContact O-N 3.06Å; T220-K222 PolarHBondContact O-N 3.34Å
221	E	27.9	Very low	48	Very low	179 Å²	179	133.3 Å²	133.3	84%	0.836	67%	0.673	S	S	*	*			trans	-40.4	133.9	178.3	-68.2	169.5	152.9	0	0	110.1	P223	E221-P223 VanDerWaalsContact O-N 3.1Å
222	K	30.2	Very low	50.6	Low	191 Å²	191	126.3 Å²	126.3	83%	0.83	65%	0.648	S	S	*	*			trans	-43.7	125.5	168.9	-93.8	-178.4	173.7	-179.5	0	106.5	T220 S224	T220-K222 PolarHBondContact O-N 3.34Å; K222-S224 PolarHBondContact O-N 3.26Å; K222-S224 VanDerWaalsContact O-N 3.09Å
223	P	34.1	Very low	53.2	Low	119 Å²	119	119.6 Å²	119.6	77%	0.773	62%	0.615	S	S	*	*			trans	-45.7	126.5	179.5	-25.6	31.8	0	0	0	107.9	E221 L225	E221-P223 VanDerWaalsContact O-N 3.1Å; P223-L225 PolarHBondContact O-N 3.02Å
224	S	32.5	Very low	55.6	Low	110 Å²	110	117.6 Å²	117.6	77%	0.769	60%	0.604	S	S	*	*			trans	-38.6	117.3	-177.7	46.3	0	0	0	0	108.9	K222 S226	K222-S224 PolarHBondContact O-N 3.26Å; K222-S224 VanDerWaalsContact O-N 3.09Å; S224-S226 PolarHBondContact O-N 3.45Å
225	L	46.7	Very low	57.8	Low	164 Å²	164	117.7 Å²	117.7	86%	0.859	62%	0.617	S	S	*	*			trans	-47.9	108.6	179.2	-78.1	160.5	0	0	0	106.5	P223	P223-L225 PolarHBondContact O-N 3.02Å
226	S	53.3	Low	60.6	Low	100 Å²	100	109.5 Å²	109.5	70%	0.699	58%	0.579	S	S	*	*	P	Polyproline II helix	trans	-51.8	131.5	170.9	-36	0	0	0	0	105.5	S224 M228	S224-S226 PolarHBondContact O-N 3.45Å; S226-M228 PolarHBondContact O-N 3.21Å
227	P	70.5	Confident	63.6	Low	118 Å²	118	106.5 Å²	106.5	77%	0.766	56%	0.559	S	S	*	*	P	Polyproline II helix	trans	-50.9	122.8	-177.2	16.3	-28.1	0	0	0	108.8	L229	P227-L229 PolarHBondContact O-N 2.94Å; P227-L229 VanDerWaalsContact O-N 3.16Å
228	M	80.7	Confident	66.7	Low	103 Å²	103	95.1 Å²	95.1	51%	0.507	52%	0.516	S	S	.	.	P	Polyproline II helix	trans	-58.1	121.8	-175.3	-65.9	168.7	73.8	0	0	108.5	S226 V236 F240	S226-M228 PolarHBondContact O-N 3.21Å; M228-V236 HydrophobicContact CE-CB 4.08Å; M228-V236 HydrophobicContact CE-CG1 3.42Å; M228-V236 VanDerWaalsContact CE-CG1 3.42Å; M228-F240 HydrophobicContact CB-CZ 4.18Å; M228-F240 HydrophobicContact CE-CD1 4.35Å; M228-F240 HydrophobicContact CE-CD2 3.88Å; M228-F240 HydrophobicContact CE-CE1 4.28Å; M228-F240 HydrophobicContact CE-CE2 3.77Å; M228-F240 HydrophobicContact CE-CG 4.17Å; M228-F240 HydrophobicContact CE-CZ 3.99Å
229	L	90.6	Very high	69.9	Low	68 Å²	68	89.7 Å²	89.7	36%	0.356	49%	0.494	S	S	.	.	P	Polyproline II helix	trans	-66.6	140.1	177.8	-61.9	173.9	0	0	0	108.9	P227 T231 Q232 R290	P227-L229 PolarHBondContact O-N 2.94Å; P227-L229 VanDerWaalsContact O-N 3.16Å; L229-T231 PolarHBondContact O-N 3.17Å; L229-T231 VanDerWaalsContact O-N 3.13Å; L229-Q232 HydrophobicContact CB-CB 4.29Å; L229-Q232 WeakPolarHBondContact O-CB 3.26Å; L229-Q232 PolarHBondContact O-N 3.49Å; L229-R290 HydrophobicContact CD1-CG 4.02Å
230	P	91.8	Very high	73.2	Confident	85 Å²	85	81.1 Å²	81.1	55%	0.552	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-29.7	173.5	-26	35	0	0	0	112.7	Q232 N244	P230-Q232 VanDerWaalsContact C-N 3.34Å; P230-N244 WeakPolarHBondContact O-CB 3.29Å
231	T	94.9	Very high	76.5	Confident	48 Å²	48	74.5 Å²	74.5	29%	0.294	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-2.6	178.1	44.6	0	0	0	0	114.1	L229 Q233 N289	L229-T231 PolarHBondContact O-N 3.17Å; L229-T231 VanDerWaalsContact O-N 3.13Å; T231-Q233 WeakPolarHBondContact O-CG 3.47Å; T231-Q233 PolarHBondContact O-N 3.37Å; T231-Q233 PolarHBondContact O-NE2 2.81Å; T231-N289 CarbonylContact C-O 3.49Å; T231-N289 PolarHBondContact OG1-O 3.5Å
232	Q	95.9	Very high	79.8	Confident	40 Å²	40	67.3 Å²	67.3	19%	0.187	39%	0.389	C	S	.	.			trans	-56.7	129.7	-177.1	-171.8	78.4	14.7	0	0	111.4	L229 P230 F234 V236 F240 N289	L229-Q232 HydrophobicContact CB-CB 4.29Å; L229-Q232 WeakPolarHBondContact O-CB 3.26Å; L229-Q232 PolarHBondContact O-N 3.49Å; P230-Q232 VanDerWaalsContact C-N 3.34Å; Q232-F234 WeakPolarHBondContact CG-O 3.32Å; Q232-F234 PolarHBondContact NE2-O 3.33Å; Q232-V236 HydrophobicContact CB-CG1 4.29Å; Q232-V236 HydrophobicContact CG-CG1 3.46Å; Q232-V236 VanDerWaalsContact CG-CG1 3.46Å; Q232-V236 HydrophobicContact CG-CG2 4.35Å; Q232-F240 HydrophobicContact CB-CE1 4.07Å; Q232-N289 PolarHBondContact N-O 3.31Å; Q232-N289 PolarHBondContact NE2-ND2 3.45Å; Q232-N289 PolarHBondContact NE2-OD1 3.45Å
233	Q	96.8	Very high	82.9	Confident	5 Å²	5	68.4 Å²	68.4	2%	0.023	39%	0.388	C	S	.	.			trans	-112.8	-37	-179.5	-58.6	-64.5	-65.9	0	0	112.2	T231 I241 H245 A253 I288 N289 F312	T231-Q233 WeakPolarHBondContact O-CG 3.47Å; T231-Q233 PolarHBondContact O-N 3.37Å; T231-Q233 PolarHBondContact O-NE2 2.81Å; Q233-I241 VanDerWaalsContact O-CD1 3.23Å; Q233-I241 WeakPolarHBondContact O-CD1 3.07Å; Q233-H245 PolarHBondContact NE2-CE1 3.01Å; Q233-H245 PolarHBondContact NE2-NE2 3.44Å; Q233-A253 HydrophobicContact CB-CB 3.99Å; Q233-A253 HydrophobicContact CG-CB 3.94Å; Q233-I288 HydrophobicContact CB-CG2 3.97Å; Q233-I288 HydrophobicContact CG-CG2 3.68Å; Q233-N289 PolarHBondContact N-OD1 2.96Å; Q233-F312 HydrophobicContact CB-CE2 4.4Å; Q233-F312 WeakPolarHBondContact O-CE2 3.34Å
234	F	95	Very high	85.9	Confident	3 Å²	3	65.6 Å²	65.6	1%	0.013	37%	0.367	C	S	.	.	S	Bend	trans	-98.8	149	-177	-65.7	-94.7	0	0	0	111.5	Q232 V236 Q285 I288 N289 L308 T311 F312 E315	Q232-F234 WeakPolarHBondContact CG-O 3.32Å; Q232-F234 PolarHBondContact NE2-O 3.33Å; F234-V236 VanDerWaalsContact C-N 3.31Å; F234-V236 PolarHBondContact O-N 2.93Å; F234-Q285 HydrophobicContact CD1-CG 4.05Å; F234-Q285 HydrophobicContact CD2-CB 4.24Å; F234-Q285 HydrophobicContact CD2-CG 4.2Å; F234-Q285 HydrophobicContact CE1-CG 3.95Å; F234-Q285 HydrophobicContact CE2-CB 4.36Å; F234-Q285 HydrophobicContact CE2-CG 4.12Å; F234-Q285 HydrophobicContact CG-CB 4.49Å; F234-Q285 HydrophobicContact CG-CG 4.17Å; F234-Q285 HydrophobicContact CZ-CG 4.01Å; F234-I288 HydrophobicContact CD2-CG2 4.34Å; F234-I288 HydrophobicContact CE2-CB 3.93Å; F234-I288 HydrophobicContact CE2-CD1 3.98Å; F234-I288 HydrophobicContact CE2-CG2 3.73Å; F234-I288 HydrophobicContact CZ-CD1 4.27Å; F234-N289 WeakPolarHBondContact CD2-OD1 3.5Å; F234-N289 PolarHBondContact N-OD1 3.35Å; F234-L308 HydrophobicContact CZ-CD2 4.12Å; F234-T311 HydrophobicContact CD1-CG2 4.5Å; F234-T311 HydrophobicContact CE1-CG2 4.48Å; F234-F312 HydrophobicContact CD1-CB 4.09Å; F234-F312 HydrophobicContact CD1-CD2 4.43Å; F234-F312 HydrophobicContact CE1-CB 3.63Å; F234-F312 HydrophobicContact CE1-CD2 4.41Å; F234-F312 HydrophobicContact CZ-CB 4.3Å; F234-E315 WeakPolarHBondContact CB-OE2 3.02Å
235	G	90.7	Very high	88.8	Confident	44 Å²	44	62.5 Å²	62.5	45%	0.454	34%	0.34	S	S	.	.	S	Bend	trans	76.2	14.6	174.3	0	0	0	0	0	114.8	E315	G235-E315 CarbonylContact C-O 3.56Å; G235-E315 WeakPolarHBondContact CA-O 3.02Å; G235-E315 PolarHBondContact N-O 3.08Å
236	V	93.3	Very high	90.9	Very high	5 Å²	5	60.4 Å²	60.4	3%	0.03	34%	0.336	C	S	.	.	S	Bend	trans	-132.5	170	-172.7	-60	0	0	0	0	111.3	M228 Q232 F234 F240 I241 L316 S317	M228-V236 HydrophobicContact CE-CB 4.08Å; M228-V236 HydrophobicContact CE-CG1 3.42Å; M228-V236 VanDerWaalsContact CE-CG1 3.42Å; Q232-V236 HydrophobicContact CB-CG1 4.29Å; Q232-V236 HydrophobicContact CG-CG1 3.46Å; Q232-V236 VanDerWaalsContact CG-CG1 3.46Å; Q232-V236 HydrophobicContact CG-CG2 4.35Å; F234-V236 VanDerWaalsContact C-N 3.31Å; F234-V236 PolarHBondContact O-N 2.93Å; V236-F240 HydrophobicContact CB-CD1 3.94Å; V236-F240 HydrophobicContact CB-CG 4.4Å; V236-F240 HydrophobicContact CG1-CD1 4.28Å; V236-F240 HydrophobicContact CG1-CE1 4.45Å; V236-F240 HydrophobicContact CG2-CD1 3.85Å; V236-F240 HydrophobicContact CG2-CE1 4.49Å; V236-I241 HydrophobicContact CG2-CD1 3.87Å; V236-I241 HydrophobicContact CG2-CG1 3.5Å; V236-I241 VanDerWaalsContact CG2-CG1 3.5Å; V236-L316 WeakPolarHBondContact O-CA 3.38Å; V236-L316 WeakPolarHBondContact O-CD2 3.49Å; V236-S317 VanDerWaalsContact C-OG 3.23Å; V236-S317 WeakPolarHBondContact CA-OG 3.31Å; V236-S317 PolarHBondContact O-N 3.2Å
237	T	95.5	Very high	92.7	Very high	51 Å²	51	59.6 Å²	59.6	31%	0.313	34%	0.344	S	S	.	.			trans	-73.8	151.3	177.2	64.5	0	0	0	0	111.5	Q239 F240 I241 S317	T237-Q239 PolarHBondContact O-N 3.11Å; T237-F240 WeakPolarHBondContact O-CB 3.43Å; T237-F240 PolarHBondContact O-N 3.43Å; T237-F240 VanDerWaalsContact O-N 3.14Å; T237-F240 VanDerWaalsContact OG1-CB 3.25Å; T237-F240 WeakPolarHBondContact OG1-CB 3.44Å; T237-F240 PolarHBondContact OG1-N 2.9Å; T237-F240 VanDerWaalsContact OG1-N 3.08Å; T237-I241 WeakPolarHBondContact O-CG1 3.43Å; T237-I241 PolarHBondContact O-N 2.76Å; T237-S317 PolarHBondContact N-OG 3.02Å
238	L	96.9	Very high	93.9	Very high	6 Å²	6	55.9 Å²	55.9	3%	0.031	32%	0.323	C	S	.	.	H	α-helix	trans	-58	-39.8	174.1	-177.9	57.6	0	0	0	111.5	F240 I241 L242 P251 E350 L354	L238-F240 PolarHBondContact O-N 2.84Å; L238-I241 PolarHBondContact O-N 2.8Å; L238-L242 HydrophobicContact CD1-CD1 4.14Å; L238-L242 HydrophobicContact CD1-CG 4.34Å; L238-L242 HydrophobicContact CG-CD1 4.1Å; L238-L242 WeakPolarHBondContact O-CG 3.49Å; L238-L242 PolarHBondContact O-N 3.06Å; L238-L242 VanDerWaalsContact O-N 3.13Å; L238-P251 HydrophobicContact CD1-CG 3.44Å; L238-P251 VanDerWaalsContact CD1-CG 3.44Å; L238-E350 HydrophobicContact CD2-CB 3.81Å; L238-E350 HydrophobicContact CG-CB 4.17Å; L238-L354 HydrophobicContact CD1-CD2 3.95Å; L238-L354 HydrophobicContact CD2-CB 4.33Å; L238-L354 HydrophobicContact CD2-CD2 3.95Å
239	Q	95.2	Very high	94.5	Very high	79 Å²	79	59.3 Å²	59.3	37%	0.369	34%	0.335	S	S	.	.	H	α-helix	trans	-64.7	-37.7	177.9	-59.6	84.5	-0.4	0	0	112.1	T237 R243	T237-Q239 PolarHBondContact O-N 3.11Å; Q239-R243 WeakPolarHBondContact O-CB 3.39Å; Q239-R243 PolarHBondContact O-N 3.37Å
240	F	96.1	Very high	94.8	Very high	47 Å²	47	57.3 Å²	57.3	21%	0.206	32%	0.324	C	S	.	.	H	α-helix	trans	-61	-45.6	175.9	174.3	-85.8	0	0	0	111.1	M228 Q232 V236 T237 L238 R243 N244	M228-F240 HydrophobicContact CB-CZ 4.18Å; M228-F240 HydrophobicContact CE-CD1 4.35Å; M228-F240 HydrophobicContact CE-CD2 3.88Å; M228-F240 HydrophobicContact CE-CE1 4.28Å; M228-F240 HydrophobicContact CE-CE2 3.77Å; M228-F240 HydrophobicContact CE-CG 4.17Å; M228-F240 HydrophobicContact CE-CZ 3.99Å; Q232-F240 HydrophobicContact CB-CE1 4.07Å; V236-F240 HydrophobicContact CB-CD1 3.94Å; V236-F240 HydrophobicContact CB-CG 4.4Å; V236-F240 HydrophobicContact CG1-CD1 4.28Å; V236-F240 HydrophobicContact CG1-CE1 4.45Å; V236-F240 HydrophobicContact CG2-CD1 3.85Å; V236-F240 HydrophobicContact CG2-CE1 4.49Å; T237-F240 WeakPolarHBondContact O-CB 3.43Å; T237-F240 PolarHBondContact O-N 3.43Å; T237-F240 VanDerWaalsContact O-N 3.14Å; T237-F240 VanDerWaalsContact OG1-CB 3.25Å; T237-F240 WeakPolarHBondContact OG1-CB 3.44Å; T237-F240 PolarHBondContact OG1-N 2.9Å; T237-F240 VanDerWaalsContact OG1-N 3.08Å; L238-F240 PolarHBondContact O-N 2.84Å; F240-R243 PolarHBondContact O-N 2.94Å; F240-N244 WeakPolarHBondContact CE1-ND2 3.34Å; F240-N244 WeakPolarHBondContact CE2-ND2 3.33Å; F240-N244 VanDerWaalsContact CZ-ND2 3.3Å; F240-N244 WeakPolarHBondContact CZ-ND2 3.45Å; F240-N244 PolarHBondContact O-N 3.35Å; F240-N244 PolarHBondContact O-ND2 3.05Å
241	I	97.6	Very high	95.1	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-61.5	-52.2	-179.1	-59	164.7	0	0	0	109.8	Q233 V236 T237 L238 R243 N244 H245 P251 F312 L316	Q233-I241 VanDerWaalsContact O-CD1 3.23Å; Q233-I241 WeakPolarHBondContact O-CD1 3.07Å; V236-I241 HydrophobicContact CG2-CD1 3.87Å; V236-I241 HydrophobicContact CG2-CG1 3.5Å; V236-I241 VanDerWaalsContact CG2-CG1 3.5Å; T237-I241 WeakPolarHBondContact O-CG1 3.43Å; T237-I241 PolarHBondContact O-N 2.76Å; L238-I241 PolarHBondContact O-N 2.8Å; I241-R243 VanDerWaalsContact C-N 3.35Å; I241-R243 PolarHBondContact O-N 3.09Å; I241-N244 PolarHBondContact O-N 3.1Å; I241-H245 PolarHBondContact O-N 3.24Å; I241-H245 PolarHBondContact O-ND1 3.34Å; I241-P251 HydrophobicContact CD1-CG 4.43Å; I241-P251 HydrophobicContact CG2-CB 3.94Å; I241-P251 HydrophobicContact CG2-CG 4.34Å; I241-F312 HydrophobicContact CD1-CE2 3.69Å; I241-F312 HydrophobicContact CD1-CZ 3.68Å; I241-L316 HydrophobicContact CD1-CD2 4.13Å
242	L	97.1	Very high	95.2	Very high	27 Å²	27	52.7 Å²	52.7	14%	0.141	30%	0.295	C	S	.	.	H	α-helix	trans	-67.1	-35.4	-175.8	-64.9	175.5	0	0	0	112.3	L238 N244 H245 E350	L238-L242 HydrophobicContact CD1-CD1 4.14Å; L238-L242 HydrophobicContact CD1-CG 4.34Å; L238-L242 HydrophobicContact CG-CD1 4.1Å; L238-L242 WeakPolarHBondContact O-CG 3.49Å; L238-L242 PolarHBondContact O-N 3.06Å; L238-L242 VanDerWaalsContact O-N 3.13Å; L242-N244 VanDerWaalsContact C-N 3.31Å; L242-N244 PolarHBondContact O-N 3.19Å; L242-H245 CarbonylContact O-C 3.4Å; L242-H245 PolarHBondContact O-N 3.39Å; L242-E350 HydrophobicContact CD1-CB 3.7Å; L242-E350 HydrophobicContact CD1-CG 3.52Å
243	R	95.8	Very high	95.2	Very high	215 Å²	215	51 Å²	51	81%	0.811	29%	0.288	S	S	*	.	H	α-helix	trans	-62.5	-37.1	174.3	179.2	178.3	172.1	-178.8	-2.3	112.6	Q239 F240 I241 H245	Q239-R243 WeakPolarHBondContact O-CB 3.39Å; Q239-R243 PolarHBondContact O-N 3.37Å; F240-R243 PolarHBondContact O-N 2.94Å; I241-R243 VanDerWaalsContact C-N 3.35Å; I241-R243 PolarHBondContact O-N 3.09Å; R243-H245 VanDerWaalsContact C-N 3.31Å
244	N	96.2	Very high	95.3	Very high	60 Å²	60	50.8 Å²	50.8	32%	0.321	29%	0.287	S	S	.	.	H	α-helix	trans	-83.9	-4.5	178.7	-72.3	-69.1	0	0	0	113.7	P230 F240 I241 L242 P246	P230-N244 WeakPolarHBondContact O-CB 3.29Å; F240-N244 WeakPolarHBondContact CE1-ND2 3.34Å; F240-N244 WeakPolarHBondContact CE2-ND2 3.33Å; F240-N244 VanDerWaalsContact CZ-ND2 3.3Å; F240-N244 WeakPolarHBondContact CZ-ND2 3.45Å; F240-N244 PolarHBondContact O-N 3.35Å; F240-N244 PolarHBondContact O-ND2 3.05Å; I241-N244 PolarHBondContact O-N 3.1Å; L242-N244 VanDerWaalsContact C-N 3.31Å; L242-N244 PolarHBondContact O-N 3.19Å; N244-P246 VanDerWaalsContact C-CD 3.49Å; N244-P246 WeakPolarHBondContact O-CD 3.32Å
245	H	95	Very high	95.3	Very high	44 Å²	44	53.5 Å²	53.5	20%	0.204	30%	0.304	C	S	.	.	S	Bend	trans	-126.1	71.3	176.3	-60.3	81	0	0	0	110.3	Q233 I241 L242 R243 G247 A248 P252	Q233-H245 PolarHBondContact NE2-CE1 3.01Å; Q233-H245 PolarHBondContact NE2-NE2 3.44Å; I241-H245 PolarHBondContact O-N 3.24Å; I241-H245 PolarHBondContact O-ND1 3.34Å; L242-H245 CarbonylContact O-C 3.4Å; L242-H245 PolarHBondContact O-N 3.39Å; R243-H245 VanDerWaalsContact C-N 3.31Å; H245-G247 PolarHBondContact O-N 2.91Å; H245-A248 HydrophobicContact CB-CB 3.95Å; H245-A248 VanDerWaalsContact O-CB 3.24Å; H245-A248 WeakPolarHBondContact O-CB 3.24Å; H245-A248 PolarHBondContact O-N 3.03Å; H245-P252 HydrophobicContact CB-CG 4.2Å
246	P	91	Very high	95.6	Very high	121 Å²	121	55.5 Å²	55.5	79%	0.786	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	132.4	-178.3	-23.3	32.9	0	0	0	112	N244 A248	N244-P246 VanDerWaalsContact C-CD 3.49Å; N244-P246 WeakPolarHBondContact O-CD 3.32Å; P246-A248 VanDerWaalsContact C-N 3.3Å; P246-A248 PolarHBondContact O-N 3.39Å
247	G	91.2	Very high	95.8	Very high	83 Å²	83	55.3 Å²	55.3	86%	0.856	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.6	-15.9	-178.1	0	0	0	0	0	114.6	H245	H245-G247 PolarHBondContact O-N 2.91Å
248	A	94.1	Very high	95.9	Very high	39 Å²	39	52.9 Å²	52.9	32%	0.322	29%	0.288	S	S	.	.			trans	-73.5	128.8	171.1	0	0	0	0	0	110.1	H245 P246	H245-A248 HydrophobicContact CB-CB 3.95Å; H245-A248 VanDerWaalsContact O-CB 3.24Å; H245-A248 WeakPolarHBondContact O-CB 3.24Å; H245-A248 PolarHBondContact O-N 3.03Å; P246-A248 VanDerWaalsContact C-N 3.3Å; P246-A248 PolarHBondContact O-N 3.39Å
249	K	93.1	Very high	95.8	Very high	175 Å²	175	54.5 Å²	54.5	76%	0.761	31%	0.307	S	S	*	.	S	Bend	trans	-85.9	-17.2	172.6	-64.8	-175	-179.2	-179.6	0	112.9
250	L	97.2	Very high	95.9	Very high	26 Å²	26	51.6 Å²	51.6	14%	0.136	29%	0.293	C	S	.	.	S	Bend	trans	-140.3	154.3	-176.4	-66.9	170.1	0	0	0	108.6	L354 F357	L250-L354 HydrophobicContact CD2-CB 4.18Å; L250-L354 HydrophobicContact CD2-CD1 4.18Å; L250-F357 HydrophobicContact CD1-CB 3.8Å; L250-F357 HydrophobicContact CD1-CD1 3.65Å; L250-F357 HydrophobicContact CD1-CD2 3.46Å; L250-F357 VanDerWaalsContact CD1-CD2 3.46Å; L250-F357 HydrophobicContact CD1-CE1 4Å; L250-F357 HydrophobicContact CD1-CE2 3.84Å; L250-F357 HydrophobicContact CD1-CG 3.34Å; L250-F357 HydrophobicContact CD1-CZ 4.09Å; L250-F357 HydrophobicContact CD2-CB 4.1Å; L250-F357 HydrophobicContact CD2-CG 4.41Å
251	P	98	Very high	96	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	28%	0.283	C	S	.	.			trans	-51.3	130.3	171.5	-28.8	37.1	0	0	0	111.5	L238 I241 A253 V254 T255 F312	L238-P251 HydrophobicContact CD1-CG 3.44Å; L238-P251 VanDerWaalsContact CD1-CG 3.44Å; I241-P251 HydrophobicContact CD1-CG 4.43Å; I241-P251 HydrophobicContact CG2-CB 3.94Å; I241-P251 HydrophobicContact CG2-CG 4.34Å; P251-A253 VanDerWaalsContact C-N 3.27Å; P251-A253 PolarHBondContact O-N 2.98Å; P251-V254 HydrophobicContact CB-CB 4.09Å; P251-V254 HydrophobicContact CB-CG2 3.87Å; P251-V254 HydrophobicContact CG-CG2 4.17Å; P251-V254 PolarHBondContact O-N 3.24Å; P251-T255 PolarHBondContact O-N 3.47Å; P251-T255 PolarHBondContact O-OG1 2.82Å; P251-F312 HydrophobicContact CB-CE1 4.39Å; P251-F312 HydrophobicContact CB-CE2 3.98Å; P251-F312 HydrophobicContact CB-CZ 3.57Å; P251-F312 HydrophobicContact CG-CE1 4.12Å; P251-F312 HydrophobicContact CG-CE2 4.38Å; P251-F312 HydrophobicContact CG-CZ 3.51Å
252	P	96.6	Very high	95.9	Very high	37 Å²	37	53 Å²	53	24%	0.24	30%	0.297	C	S	.	.	H	α-helix	trans	-52.2	-45	176.8	-29	32.9	0	0	0	112.9	H245 V254 T255 D256	H245-P252 HydrophobicContact CB-CG 4.2Å; P252-V254 VanDerWaalsContact C-N 3.3Å; P252-V254 PolarHBondContact O-N 3.43Å; P252-T255 PolarHBondContact O-N 3.37Å; P252-T255 VanDerWaalsContact O-N 3.1Å; P252-D256 PolarHBondContact O-N 2.69Å
253	A	97.1	Very high	95.9	Very high	4 Å²	4	59.6 Å²	59.6	3%	0.033	32%	0.324	C	S	.	.	H	α-helix	trans	-57.1	-42.2	177.5	0	0	0	0	0	112.7	Q233 P251 I257 I288 F312	Q233-A253 HydrophobicContact CB-CB 3.99Å; Q233-A253 HydrophobicContact CG-CB 3.94Å; P251-A253 VanDerWaalsContact C-N 3.27Å; P251-A253 PolarHBondContact O-N 2.98Å; A253-I257 VanDerWaalsContact O-CB 3.25Å; A253-I257 WeakPolarHBondContact O-CB 3.34Å; A253-I257 VanDerWaalsContact O-CD1 3.28Å; A253-I257 WeakPolarHBondContact O-CD1 3.43Å; A253-I257 WeakPolarHBondContact O-CG1 3.4Å; A253-I257 PolarHBondContact O-N 3.26Å; A253-I288 HydrophobicContact CB-CG2 3.81Å; A253-F312 HydrophobicContact CB-CD2 4.49Å
254	V	97.8	Very high	96	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-66.7	-42.7	177.9	172.3	0	0	0	0	110.8	P251 P252 V258 L309 F312 L354 F357 L358	P251-V254 HydrophobicContact CB-CB 4.09Å; P251-V254 HydrophobicContact CB-CG2 3.87Å; P251-V254 HydrophobicContact CG-CG2 4.17Å; P251-V254 PolarHBondContact O-N 3.24Å; P252-V254 VanDerWaalsContact C-N 3.3Å; P252-V254 PolarHBondContact O-N 3.43Å; V254-V258 HydrophobicContact CG1-CG2 4.19Å; V254-V258 VanDerWaalsContact O-CB 3.28Å; V254-V258 WeakPolarHBondContact O-CB 3.19Å; V254-V258 VanDerWaalsContact O-CG2 3.28Å; V254-V258 WeakPolarHBondContact O-CG2 3.42Å; V254-V258 PolarHBondContact O-N 3.12Å; V254-L309 HydrophobicContact CB-CD1 4.49Å; V254-L309 HydrophobicContact CG1-CD1 4.15Å; V254-L309 HydrophobicContact CG2-CD1 4.17Å; V254-F312 HydrophobicContact CG2-CD1 3.37Å; V254-F312 HydrophobicContact CG2-CD2 4.31Å; V254-F312 HydrophobicContact CG2-CE1 3.26Å; V254-F312 HydrophobicContact CG2-CE2 4.18Å; V254-F312 HydrophobicContact CG2-CG 3.94Å; V254-F312 HydrophobicContact CG2-CZ 3.71Å; V254-L354 HydrophobicContact CB-CD1 4.48Å; V254-L354 HydrophobicContact CG1-CD1 3.83Å; V254-L354 HydrophobicContact CG2-CD1 4.29Å; V254-F357 HydrophobicContact CG1-CD1 4Å; V254-F357 HydrophobicContact CG1-CE1 3.83Å; V254-L358 HydrophobicContact CG1-CD2 4.26Å
255	T	96.2	Very high	96	Very high	61 Å²	61	49.7 Å²	49.7	37%	0.374	29%	0.285	S	S	.	.	H	α-helix	trans	-62.5	-46.9	-180	-54.4	0	0	0	0	111.2	P251 P252 G259	P251-T255 PolarHBondContact O-N 3.47Å; P251-T255 PolarHBondContact O-OG1 2.82Å; P252-T255 PolarHBondContact O-N 3.37Å; P252-T255 VanDerWaalsContact O-N 3.1Å; T255-G259 PolarHBondContact O-N 3.23Å
256	D	96.5	Very high	96	Very high	86 Å²	86	49 Å²	49	46%	0.46	28%	0.283	S	S	.	.	H	α-helix	trans	-65.3	-48	-179.8	-69.2	-13.2	0	0	0	111.5	P252 G259 F260 Y296	P252-D256 PolarHBondContact O-N 2.69Å; D256-G259 PolarHBondContact O-N 2.86Å; D256-F260 WeakPolarHBondContact O-CB 3.31Å; D256-F260 PolarHBondContact O-N 2.98Å; D256-Y296 HydrophobicContact CB-CE2 4.21Å
257	I	97.6	Very high	96.3	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-63	-49.7	-179.9	-70	166.6	0	0	0	110.8	A253 G259 F260 L261 Y296 S305 L308 L309	A253-I257 VanDerWaalsContact O-CB 3.25Å; A253-I257 WeakPolarHBondContact O-CB 3.34Å; A253-I257 VanDerWaalsContact O-CD1 3.28Å; A253-I257 WeakPolarHBondContact O-CD1 3.43Å; A253-I257 WeakPolarHBondContact O-CG1 3.4Å; A253-I257 PolarHBondContact O-N 3.26Å; I257-G259 VanDerWaalsContact C-N 3.34Å; I257-G259 PolarHBondContact O-N 3.23Å; I257-F260 PolarHBondContact O-N 3.17Å; I257-L261 HydrophobicContact CG2-CD1 3.8Å; I257-L261 HydrophobicContact CG2-CG 4.33Å; I257-L261 WeakPolarHBondContact O-CB 3.38Å; I257-L261 VanDerWaalsContact O-CG 3.27Å; I257-L261 WeakPolarHBondContact O-CG 3.44Å; I257-L261 PolarHBondContact O-N 3.15Å; I257-Y296 HydrophobicContact CG1-CE1 4.29Å; I257-Y296 WeakPolarHBondContact CG1-OH 3.43Å; I257-S305 VanDerWaalsContact CG2-O 3.24Å; I257-S305 WeakPolarHBondContact CG2-O 3.49Å; I257-L308 HydrophobicContact CD1-CB 3.84Å; I257-L309 HydrophobicContact CG2-CB 3.82Å; I257-L309 HydrophobicContact CG2-CD1 4.42Å
258	V	97.1	Very high	96.5	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-67.3	-37.4	-179.8	173.3	0	0	0	0	110.8	V254 F260 L261 R262 L309 F357 L358 F361	V254-V258 HydrophobicContact CG1-CG2 4.19Å; V254-V258 VanDerWaalsContact O-CB 3.28Å; V254-V258 WeakPolarHBondContact O-CB 3.19Å; V254-V258 VanDerWaalsContact O-CG2 3.28Å; V254-V258 WeakPolarHBondContact O-CG2 3.42Å; V254-V258 PolarHBondContact O-N 3.12Å; V258-F260 PolarHBondContact O-N 3.32Å; V258-L261 PolarHBondContact O-N 3.06Å; V258-R262 HydrophobicContact CG1-CG 4.19Å; V258-R262 WeakPolarHBondContact O-CB 3.35Å; V258-R262 WeakPolarHBondContact O-CG 3.37Å; V258-R262 PolarHBondContact O-N 2.81Å; V258-L309 HydrophobicContact CG2-CD1 4.16Å; V258-L309 HydrophobicContact CG2-CD2 3.81Å; V258-F357 HydrophobicContact CB-CE1 3.6Å; V258-F357 HydrophobicContact CB-CZ 3.8Å; V258-F357 HydrophobicContact CG1-CE1 3.61Å; V258-F357 HydrophobicContact CG1-CE2 4.49Å; V258-F357 HydrophobicContact CG1-CZ 3.54Å; V258-F357 HydrophobicContact CG2-CE1 3.71Å; V258-F357 HydrophobicContact CG2-CZ 4.42Å; V258-L358 HydrophobicContact CG2-CD2 4.44Å; V258-F361 HydrophobicContact CG1-CD2 3.83Å; V258-F361 HydrophobicContact CG1-CE2 4.34Å; V258-F361 HydrophobicContact CG1-CG 4.18Å
259	G	95.9	Very high	96.4	Very high	41 Å²	41	45.6 Å²	45.6	42%	0.423	24%	0.237	S	C	.	.	H	α-helix	trans	-58.4	-47	174.2	0	0	0	0	0	112.4	T255 D256 I257 K263	T255-G259 PolarHBondContact O-N 3.23Å; D256-G259 PolarHBondContact O-N 2.86Å; I257-G259 VanDerWaalsContact C-N 3.34Å; I257-G259 PolarHBondContact O-N 3.23Å; G259-K263 PolarHBondContact O-N 2.78Å
260	F	97.7	Very high	96.1	Very high	18 Å²	18	37.3 Å²	37.3	8%	0.079	20%	0.201	C	C	.	.	H	α-helix	trans	-63.1	-46.8	174.8	170.9	-105.8	0	0	0	112.4	D256 I257 V258 R262 K263 H264 Y296 P298 H301 I302 S305	D256-F260 WeakPolarHBondContact O-CB 3.31Å; D256-F260 PolarHBondContact O-N 2.98Å; I257-F260 PolarHBondContact O-N 3.17Å; V258-F260 PolarHBondContact O-N 3.32Å; F260-R262 PolarHBondContact O-N 3.13Å; F260-K263 PolarHBondContact O-N 2.76Å; F260-H264 AromaticContact CD2-CD2 3.56Å; F260-H264 HydrophobicContact CE2-CB 4.25Å; F260-H264 AromaticContact CE2-CD2 3.56Å; F260-H264 HydrophobicContact CZ-CB 4.45Å; F260-H264 PolarHBondContact O-N 2.86Å; F260-Y296 HydrophobicContact CB-CD2 4.21Å; F260-Y296 HydrophobicContact CB-CG 4.14Å; F260-Y296 HydrophobicContact CD1-CD1 4.05Å; F260-Y296 HydrophobicContact CD1-CG 4.08Å; F260-Y296 HydrophobicContact CD2-CG 4.03Å; F260-Y296 HydrophobicContact CE1-CD1 4.37Å; F260-Y296 HydrophobicContact CE1-CG 4.48Å; F260-Y296 HydrophobicContact CE2-CG 4.46Å; F260-Y296 HydrophobicContact CG-CD1 4.24Å; F260-Y296 HydrophobicContact CG-CD2 4.34Å; F260-Y296 AromaticContact CG-CG 3.81Å; F260-Y296 HydrophobicContact CG-CG 3.81Å; F260-P298 HydrophobicContact CE2-CG 4.16Å; F260-H301 HydrophobicContact CE1-CB 4.47Å; F260-H301 HydrophobicContact CZ-CB 4.43Å; F260-I302 HydrophobicContact CE1-CG1 4.22Å; F260-I302 HydrophobicContact CZ-CG1 4.12Å; F260-S305 WeakPolarHBondContact CD1-OG 2.94Å; F260-S305 WeakPolarHBondContact CE1-OG 2.92Å
261	L	97.8	Very high	95.9	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-68.4	-32.3	-178.3	-68.2	176.4	0	0	0	112.8	I257 V258 K263 G265 L266 I271 F272 I302 A306 F361	I257-L261 HydrophobicContact CG2-CD1 3.8Å; I257-L261 HydrophobicContact CG2-CG 4.33Å; I257-L261 WeakPolarHBondContact O-CB 3.38Å; I257-L261 VanDerWaalsContact O-CG 3.27Å; I257-L261 WeakPolarHBondContact O-CG 3.44Å; I257-L261 PolarHBondContact O-N 3.15Å; V258-L261 PolarHBondContact O-N 3.06Å; L261-K263 VanDerWaalsContact C-N 3.29Å; L261-K263 PolarHBondContact O-N 3.29Å; L261-G265 CarbonylContact O-C 3.59Å; L261-G265 VanDerWaalsContact O-CA 3.24Å; L261-G265 WeakPolarHBondContact O-CA 3.29Å; L261-G265 PolarHBondContact O-N 3.48Å; L261-L266 PolarHBondContact O-N 3.21Å; L261-I271 HydrophobicContact CD2-CD1 4.02Å; L261-F272 HydrophobicContact CD1-CE1 4.29Å; L261-F272 HydrophobicContact CD1-CZ 3.93Å; L261-I302 HydrophobicContact CD2-CG2 4.27Å; L261-I302 WeakPolarHBondContact CD2-O 3.45Å; L261-A306 HydrophobicContact CD1-CB 4.48Å; L261-F361 HydrophobicContact CB-CE1 4.04Å; L261-F361 HydrophobicContact CB-CE2 4.07Å; L261-F361 HydrophobicContact CB-CZ 3.37Å; L261-F361 HydrophobicContact CD1-CE1 4.23Å; L261-F361 HydrophobicContact CD1-CZ 4.38Å
262	R	95.8	Very high	95.6	Very high	76 Å²	76	36 Å²	36	29%	0.287	19%	0.194	S	C	.	.	H	α-helix	trans	-60.6	-40.5	171	-81.9	-176.3	166.8	175.4	-7.7	111.6	V258 F260 R360 F361 D421	V258-R262 HydrophobicContact CG1-CG 4.19Å; V258-R262 WeakPolarHBondContact O-CB 3.35Å; V258-R262 WeakPolarHBondContact O-CG 3.37Å; V258-R262 PolarHBondContact O-N 2.81Å; F260-R262 PolarHBondContact O-N 3.13Å; R262-R360 PolarHBondContact NH2-O 3.21Å; R262-F361 HydrophobicContact CB-CE2 4.1Å; R262-F361 HydrophobicContact CG-CD2 3.43Å; R262-F361 VanDerWaalsContact CG-CD2 3.43Å; R262-F361 HydrophobicContact CG-CE2 3.32Å; R262-D421 IonicContact NH2-OD2 3.81Å
263	K	96	Very high	95.1	Very high	165 Å²	165	35.5 Å²	35.5	72%	0.717	19%	0.188	S	C	*	.	H	α-helix	trans	-78.1	-33.8	-177.2	-169	176.2	173.7	-176.3	0	113.5	G259 F260 L261	G259-K263 PolarHBondContact O-N 2.78Å; F260-K263 PolarHBondContact O-N 2.76Å; L261-K263 VanDerWaalsContact C-N 3.29Å; L261-K263 PolarHBondContact O-N 3.29Å
264	H	97.1	Very high	94.4	Very high	68 Å²	68	41.3 Å²	41.3	32%	0.315	21%	0.209	S	C	.	.	H	α-helix	trans	-128.7	-23.2	-168.3	-60	-67.3	0	0	0	115	F260 P298 I302	F260-H264 AromaticContact CD2-CD2 3.56Å; F260-H264 HydrophobicContact CE2-CB 4.25Å; F260-H264 AromaticContact CE2-CD2 3.56Å; F260-H264 HydrophobicContact CZ-CB 4.45Å; F260-H264 PolarHBondContact O-N 2.86Å; H264-P298 HydrophobicContact CB-CB 4.26Å; H264-I302 HydrophobicContact CB-CD1 4.42Å; H264-I302 WeakPolarHBondContact O-CD1 3.49Å
265	G	96.4	Very high	93.5	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.6	-21.8	-167.4	0	0	0	0	0	115.8	L261 L267 T268	L261-G265 CarbonylContact O-C 3.59Å; L261-G265 VanDerWaalsContact O-CA 3.24Å; L261-G265 WeakPolarHBondContact O-CA 3.29Å; L261-G265 PolarHBondContact O-N 3.48Å; G265-L267 VanDerWaalsContact C-N 3.26Å; G265-L267 PolarHBondContact O-N 2.82Å; G265-T268 VanDerWaalsContact O-CB 3.31Å; G265-T268 WeakPolarHBondContact O-CB 3.49Å; G265-T268 PolarHBondContact O-N 2.83Å; G265-T268 PolarHBondContact O-OG1 3.29Å
266	L	96.3	Very high	92.9	Very high	28 Å²	28	40.8 Å²	40.8	15%	0.147	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-29.7	-170.3	-71	179.8	0	0	0	114.8	L261 F361 V363 H366 N370	L261-L266 PolarHBondContact O-N 3.21Å; L266-F361 HydrophobicContact CD2-CD2 4.1Å; L266-F361 HydrophobicContact CD2-CE1 4.37Å; L266-F361 HydrophobicContact CD2-CE2 3.42Å; L266-F361 VanDerWaalsContact CD2-CE2 3.42Å; L266-F361 HydrophobicContact CD2-CZ 3.54Å; L266-F361 WeakPolarHBondContact CD2-O 3.3Å; L266-F361 HydrophobicContact CG-CE2 4.11Å; L266-F361 HydrophobicContact CG-CZ 4.37Å; L266-V363 HydrophobicContact CD2-CG2 4.08Å; L266-H366 WeakPolarHBondContact O-CB 3.3Å; L266-N370 VanDerWaalsContact O-CB 3.29Å; L266-N370 WeakPolarHBondContact O-CB 3.28Å; L266-N370 PolarHBondContact O-ND2 3.33Å
267	L	96	Very high	92.1	Very high	84 Å²	84	39.4 Å²	39.4	44%	0.44	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.3	3.8	178.7	-56.6	-177.1	0	0	0	113	G265 P269 H366 V369	G265-L267 VanDerWaalsContact C-N 3.26Å; G265-L267 PolarHBondContact O-N 2.82Å; L267-P269 WeakPolarHBondContact O-CD 3.49Å; L267-H366 HydrophobicContact CD2-CB 4.04Å; L267-V369 HydrophobicContact CB-CG1 4.15Å; L267-V369 HydrophobicContact CD2-CB 4.32Å; L267-V369 HydrophobicContact CD2-CG1 4.47Å; L267-V369 HydrophobicContact CD2-CG2 4.5Å
268	T	95.3	Very high	91.1	Very high	25 Å²	25	41.7 Å²	41.7	15%	0.153	22%	0.215	C	C	.	.	S	Bend	trans	-80	120.7	-174.7	-63.8	0	0	0	0	111.3	G265 G270 I271 I302 N370	G265-T268 VanDerWaalsContact O-CB 3.31Å; G265-T268 WeakPolarHBondContact O-CB 3.49Å; G265-T268 PolarHBondContact O-N 2.83Å; G265-T268 PolarHBondContact O-OG1 3.29Å; T268-G270 PolarHBondContact O-N 2.86Å; T268-I271 PolarHBondContact O-N 2.76Å; T268-I271 VanDerWaalsContact O-N 3.12Å; T268-I302 HydrophobicContact CG2-CG2 3.87Å; T268-I302 WeakPolarHBondContact OG1-CD1 3.5Å; T268-N370 WeakPolarHBondContact O-CB 3.32Å
269	P	93	Very high	90.3	Very high	64 Å²	64	49.2 Å²	49.2	42%	0.416	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	123.8	-179.2	-26.8	36.5	0	0	0	113.3	L267 N370 L371	L267-P269 WeakPolarHBondContact O-CD 3.49Å; P269-N370 CarbonylContact C-O 3.58Å; P269-N370 WeakPolarHBondContact CA-O 3.27Å; P269-L371 HydrophobicContact CB-CD1 4.5Å
270	G	87	Confident	90	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	71	30.8	-179	0	0	0	0	0	114.3	T268 R273 R274 N370	T268-G270 PolarHBondContact O-N 2.86Å; G270-R273 VanDerWaalsContact CA-NE 3.31Å; G270-R273 WeakPolarHBondContact O-CG 3.35Å; G270-R273 PolarHBondContact O-N 3.02Å; G270-R274 PolarHBondContact O-N 2.93Å; G270-R274 VanDerWaalsContact O-N 3.15Å; G270-N370 PolarHBondContact N-O 2.99Å
271	I	93	Very high	89.5	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.7	141.4	166	-170.4	67.7	0	0	0	110.2	L261 T268 R273 I302 A306 V363 N370 M372	L261-I271 HydrophobicContact CD2-CD1 4.02Å; T268-I271 PolarHBondContact O-N 2.76Å; T268-I271 VanDerWaalsContact O-N 3.12Å; I271-R273 PolarHBondContact O-N 3.32Å; I271-I302 HydrophobicContact CD1-CG2 3.59Å; I271-A306 HydrophobicContact CD1-CB 3.59Å; I271-A306 HydrophobicContact CG1-CB 4.27Å; I271-V363 HydrophobicContact CG2-CG1 3.59Å; I271-N370 HydrophobicContact CG2-CB 4.23Å; I271-M372 HydrophobicContact CG2-CG 4.14Å; I271-M372 WeakPolarHBondContact O-CG 3.3Å
272	F	90.8	Very high	89	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	64.1	-29.5	-172.1	-60.4	-68.7	0	0	0	118.1	L261 A306 L309 K310 F361 V363 L377 V380 F381	L261-F272 HydrophobicContact CD1-CE1 4.29Å; L261-F272 HydrophobicContact CD1-CZ 3.93Å; F272-A306 HydrophobicContact CD1-CB 3.7Å; F272-A306 HydrophobicContact CE1-CB 3.8Å; F272-A306 HydrophobicContact CG-CB 4.28Å; F272-A306 HydrophobicContact CZ-CB 4.46Å; F272-L309 HydrophobicContact CE1-CB 4.25Å; F272-L309 HydrophobicContact CE1-CD2 3.87Å; F272-L309 HydrophobicContact CZ-CD2 3.96Å; F272-K310 HydrophobicContact CB-CD 4.36Å; F272-K310 HydrophobicContact CD1-CD 4.21Å; F272-K310 HydrophobicContact CD1-CG 3.93Å; F272-K310 VanDerWaalsContact O-CE 3.28Å; F272-K310 WeakPolarHBondContact O-CE 3.22Å; F272-K310 PolarHBondContact O-NZ 3.06Å; F272-F361 HydrophobicContact CE2-CD1 4.01Å; F272-F361 AromaticContact CE2-CE1 3.52Å; F272-F361 HydrophobicContact CE2-CE1 3.52Å; F272-F361 AromaticContact CZ-CD1 3.96Å; F272-F361 HydrophobicContact CZ-CD1 3.96Å; F272-F361 AromaticContact CZ-CE1 3.49Å; F272-F361 HydrophobicContact CZ-CE1 3.49Å; F272-F361 VanDerWaalsContact CZ-CE1 3.49Å; F272-V363 HydrophobicContact CD2-CG1 4.31Å; F272-V363 HydrophobicContact CD2-CG2 4.37Å; F272-V363 HydrophobicContact CE2-CG1 4.38Å; F272-V363 HydrophobicContact CE2-CG2 3.71Å; F272-L377 HydrophobicContact CD2-CD2 4.08Å; F272-V380 HydrophobicContact CB-CG1 3.96Å; F272-F381 HydrophobicContact CB-CE2 4.49Å; F272-F381 HydrophobicContact CD1-CE1 4.45Å; F272-F381 HydrophobicContact CD1-CE2 4.24Å; F272-F381 AromaticContact CD1-CZ 3.68Å; F272-F381 HydrophobicContact CD1-CZ 3.68Å; F272-F381 AromaticContact CD2-CE2 3.92Å; F272-F381 HydrophobicContact CD2-CE2 3.92Å; F272-F381 AromaticContact CD2-CZ 4Å; F272-F381 HydrophobicContact CD2-CZ 4Å; F272-F381 HydrophobicContact CE1-CE1 4.39Å; F272-F381 HydrophobicContact CE1-CE2 4.5Å; F272-F381 AromaticContact CE1-CZ 3.65Å; F272-F381 HydrophobicContact CE1-CZ 3.65Å; F272-F381 HydrophobicContact CE2-CE2 4.2Å; F272-F381 AromaticContact CE2-CZ 3.97Å; F272-F381 HydrophobicContact CE2-CZ 3.97Å; F272-F381 AromaticContact CG-CE2 3.94Å; F272-F381 HydrophobicContact CG-CE2 3.94Å; F272-F381 AromaticContact CG-CZ 3.85Å; F272-F381 HydrophobicContact CG-CZ 3.85Å; F272-F381 HydrophobicContact CZ-CE2 4.46Å; F272-F381 AromaticContact CZ-CZ 3.78Å; F272-F381 HydrophobicContact CZ-CZ 3.78Å
273	R	86.8	Confident	88.9	Confident	26 Å²	26	56.5 Å²	56.5	10%	0.098	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-33.5	177.6	90.5	175.9	168.3	-165.7	-9.7	113	E122 Q123 D124 G270 I271 M372	E122-R273 WeakPolarHBondContact O-CD 3.32Å; Q123-R273 HydrophobicContact CB-CB 4.29Å; D124-R273 WeakPolarHBondContact CB-O 3.39Å; D124-R273 PolarHBondContact N-O 2.79Å; G270-R273 VanDerWaalsContact CA-NE 3.31Å; G270-R273 WeakPolarHBondContact O-CG 3.35Å; G270-R273 PolarHBondContact O-N 3.02Å; I271-R273 PolarHBondContact O-N 3.32Å; R273-M372 HydrophobicContact CB-CE 3.86Å; R273-M372 HydrophobicContact CB-SD 3.82Å; R273-M372 HydrophobicContact CG-SD 4.05Å
274	R	82	Confident	88.9	Confident	125 Å²	125	49.8 Å²	49.8	47%	0.472	25%	0.246	S	C	.	.	S	Bend	trans	-78.4	135.7	-175.5	-80.9	-178.2	149.9	-171.9	-3	111.6	D124 G270 H303 V307	D124-R274 WeakPolarHBondContact OD2-CA 3.38Å; G270-R274 PolarHBondContact O-N 2.93Å; G270-R274 VanDerWaalsContact O-N 3.15Å; R274-H303 WeakPolarHBondContact CD-CE1 3.4Å; R274-H303 WeakPolarHBondContact CD-NE2 3.19Å; R274-H303 PolarHBondContact NH1-NE2 2.67Å; R274-V307 WeakPolarHBondContact O-CG2 3.41Å
275	S	78.7	Confident	88.8	Confident	27 Å²	27	47.3 Å²	47.3	19%	0.189	23%	0.234	C	C	.	.			trans	-88.9	155.2	177.1	-56.3	0	0	0	0	112.6	R88 D124	R88-S275 WeakPolarHBondContact CD-OG 3.32Å; R88-S275 VanDerWaalsContact CG-OG 3.31Å; R88-S275 WeakPolarHBondContact CG-OG 3.48Å; R88-S275 PolarHBondContact NE-OG 3.18Å; D124-S275 WeakPolarHBondContact CB-OG 3.41Å; D124-S275 WeakPolarHBondContact OD2-CB 3.44Å; D124-S275 PolarHBondContact OD2-N 3.26Å; D124-S275 PolarHBondContact OD2-OG 3.22Å; D124-S275 VanDerWaalsContact OD2-OG 3.06Å
276	V	83.9	Confident	88.6	Confident	24 Å²	24	51.8 Å²	51.8	15%	0.145	26%	0.255	C	S	.	.			trans	-121.8	-179	173.6	-62.3	0	0	0	0	111	I278 V281 H303 L304 V307	V276-I278 PolarHBondContact O-N 3.48Å; V276-V281 HydrophobicContact CG2-CG2 3.36Å; V276-H303 HydrophobicContact CG1-CB 3.63Å; V276-L304 HydrophobicContact CG1-CB 4.38Å; V276-L304 HydrophobicContact CG2-CD1 3.92Å; V276-V307 HydrophobicContact CG2-CB 3.87Å; V276-V307 HydrophobicContact CG2-CG1 3.95Å; V276-V307 HydrophobicContact CG2-CG2 3.96Å
277	S	81	Confident	88.6	Confident	56 Å²	56	55.6 Å²	55.6	39%	0.392	27%	0.267	S	S	.	.			trans	-64.4	128.7	175.1	175.4	0	0	0	0	111.1	Q279 E280 V281	S277-Q279 PolarHBondContact O-N 2.77Å; S277-Q279 PolarHBondContact OG-N 2.77Å; S277-E280 WeakPolarHBondContact O-CB 3.31Å; S277-E280 PolarHBondContact O-N 2.78Å; S277-V281 WeakPolarHBondContact O-CG2 3.42Å; S277-V281 PolarHBondContact O-N 3.31Å
278	I	76.2	Confident	88.7	Confident	49 Å²	49	52.2 Å²	52.2	25%	0.251	25%	0.25	S	C	.	.	H	α-helix	trans	-61	-37.9	176.1	-62.9	163.8	0	0	0	110.8	K85 A86 V276 E280 V281 R282	K85-I278 HydrophobicContact CB-CD1 3.74Å; K85-I278 HydrophobicContact CB-CG1 4.31Å; K85-I278 HydrophobicContact CB-CG2 3.95Å; A86-I278 HydrophobicContact CB-CD1 3.89Å; A86-I278 HydrophobicContact CB-CG1 3.52Å; V276-I278 PolarHBondContact O-N 3.48Å; I278-E280 VanDerWaalsContact C-N 3.3Å; I278-E280 PolarHBondContact O-N 3.49Å; I278-V281 PolarHBondContact O-N 3Å; I278-R282 HydrophobicContact CG2-CG 4.5Å; I278-R282 WeakPolarHBondContact O-CG 3.43Å; I278-R282 PolarHBondContact O-N 2.94Å
279	Q	80.3	Confident	88.8	Confident	157 Å²	157	52 Å²	52	73%	0.734	25%	0.248	S	C	*	.	H	α-helix	trans	-64.5	-40.2	179.6	-66.9	177.4	-17.4	0	0	110.8	S277 R282 L283	S277-Q279 PolarHBondContact O-N 2.77Å; S277-Q279 PolarHBondContact OG-N 2.77Å; Q279-R282 PolarHBondContact O-N 2.87Å; Q279-L283 WeakPolarHBondContact O-CB 3.28Å; Q279-L283 PolarHBondContact O-N 3.08Å
280	E	88.3	Confident	88.9	Confident	66 Å²	66	55.8 Å²	55.8	31%	0.308	25%	0.254	S	S	.	.	H	α-helix	trans	-66.8	-44.7	176.7	-171.2	176.2	-152.9	0	0	111.3	S277 I278 R282 L283 W284 L304	S277-E280 WeakPolarHBondContact O-CB 3.31Å; S277-E280 PolarHBondContact O-N 2.78Å; I278-E280 VanDerWaalsContact C-N 3.3Å; I278-E280 PolarHBondContact O-N 3.49Å; E280-R282 VanDerWaalsContact C-N 3.32Å; E280-R282 PolarHBondContact O-N 2.94Å; E280-L283 PolarHBondContact O-N 3.02Å; E280-W284 PolarHBondContact O-N 3.05Å; E280-L304 HydrophobicContact CG-CD1 3.99Å; E280-L304 HydrophobicContact CG-CD2 3.81Å
281	V	87.9	Confident	89.3	Confident	8 Å²	8	58 Å²	58	5%	0.048	28%	0.276	C	S	.	.	H	α-helix	trans	-56.1	-48	174.6	175	0	0	0	0	110.8	V276 S277 I278 L283 W284 Q285 L304 V307 L308	V276-V281 HydrophobicContact CG2-CG2 3.36Å; S277-V281 WeakPolarHBondContact O-CG2 3.42Å; S277-V281 PolarHBondContact O-N 3.31Å; I278-V281 PolarHBondContact O-N 3Å; V281-L283 PolarHBondContact O-N 3.18Å; V281-W284 PolarHBondContact O-N 3.46Å; V281-Q285 HydrophobicContact CG1-CG 4.26Å; V281-Q285 VanDerWaalsContact O-CG 3.32Å; V281-Q285 WeakPolarHBondContact O-CG 3.33Å; V281-Q285 PolarHBondContact O-N 3.15Å; V281-L304 HydrophobicContact CG2-CD1 3.87Å; V281-V307 HydrophobicContact CG2-CG1 3.69Å; V281-L308 HydrophobicContact CG1-CD2 4.11Å
282	R	88.1	Confident	89.4	Confident	113 Å²	113	61.5 Å²	61.5	43%	0.426	30%	0.295	S	S	.	.	H	α-helix	trans	-61.8	-43.8	179.6	-73.6	174.3	178.5	-167.8	-4.6	112.8	I278 Q279 E280 W284 Q285 E286	I278-R282 HydrophobicContact CG2-CG 4.5Å; I278-R282 WeakPolarHBondContact O-CG 3.43Å; I278-R282 PolarHBondContact O-N 2.94Å; Q279-R282 PolarHBondContact O-N 2.87Å; E280-R282 VanDerWaalsContact C-N 3.32Å; E280-R282 PolarHBondContact O-N 2.94Å; R282-W284 VanDerWaalsContact C-N 3.27Å; R282-W284 PolarHBondContact O-N 2.67Å; R282-Q285 PolarHBondContact O-N 2.9Å; R282-E286 WeakPolarHBondContact O-CB 3.43Å; R282-E286 PolarHBondContact O-N 3.31Å
283	L	92.4	Very high	89.4	Confident	102 Å²	102	66.2 Å²	66.2	53%	0.534	33%	0.325	S	S	.	.	H	α-helix	trans	-58.5	-42.6	176.6	177.3	64.7	0	0	0	111.1	Q279 E280 V281 E286 R287	Q279-L283 WeakPolarHBondContact O-CB 3.28Å; Q279-L283 PolarHBondContact O-N 3.08Å; E280-L283 PolarHBondContact O-N 3.02Å; V281-L283 PolarHBondContact O-N 3.18Å; L283-E286 PolarHBondContact O-N 3.17Å; L283-R287 PolarHBondContact O-N 3.09Å
284	W	96.3	Very high	89.6	Confident	24 Å²	24	66.4 Å²	66.4	9%	0.091	33%	0.329	C	S	.	.	H	α-helix	trans	-70.7	-42.6	178.4	-83.9	70.2	0	0	0	112.8	E280 V281 R282 E286 R287 I288 V294 Y296 H301 L304 L308	E280-W284 PolarHBondContact O-N 3.05Å; V281-W284 PolarHBondContact O-N 3.46Å; R282-W284 VanDerWaalsContact C-N 3.27Å; R282-W284 PolarHBondContact O-N 2.67Å; W284-E286 VanDerWaalsContact C-N 3.28Å; W284-E286 PolarHBondContact O-N 3.05Å; W284-R287 PolarHBondContact O-N 3.23Å; W284-I288 WeakPolarHBondContact O-CB 3.42Å; W284-I288 VanDerWaalsContact O-CG1 3.24Å; W284-I288 WeakPolarHBondContact O-CG1 3.4Å; W284-I288 PolarHBondContact O-N 2.97Å; W284-V294 HydrophobicContact CE3-CB 4.29Å; W284-V294 HydrophobicContact CE3-CG1 4.1Å; W284-V294 HydrophobicContact CH2-CB 4.42Å; W284-V294 HydrophobicContact CZ3-CB 3.75Å; W284-V294 HydrophobicContact CZ3-CG1 4.06Å; W284-V294 HydrophobicContact CZ3-CG2 4.45Å; W284-Y296 HydrophobicContact CE3-CE1 4.26Å; W284-Y296 AromaticContact CH2-CD1 3.95Å; W284-Y296 HydrophobicContact CH2-CD1 3.95Å; W284-Y296 HydrophobicContact CH2-CE1 4.24Å; W284-Y296 AromaticContact CZ3-CD1 3.64Å; W284-Y296 HydrophobicContact CZ3-CD1 3.64Å; W284-Y296 AromaticContact CZ3-CE1 3.46Å; W284-Y296 HydrophobicContact CZ3-CE1 3.46Å; W284-Y296 VanDerWaalsContact CZ3-CE1 3.46Å; W284-Y296 HydrophobicContact CZ3-CG 4.45Å; W284-H301 AromaticContact CH2-CE1 3.97Å; W284-H301 AromaticContact CH2-ND1 3.51Å; W284-H301 AromaticContact CZ2-CE1 3.47Å; W284-H301 VanDerWaalsContact CZ2-CE1 3.47Å; W284-H301 WeakPolarHBondContact CZ2-CE1 3.24Å; W284-H301 AromaticContact CZ2-CG 3.83Å; W284-H301 AromaticContact CZ2-ND1 3.43Å; W284-H301 WeakPolarHBondContact CZ2-ND1 3.48Å; W284-H301 AromaticContact CZ2-NE2 3.79Å; W284-L304 HydrophobicContact CD2-CD2 3.74Å; W284-L304 HydrophobicContact CD2-CG 4.49Å; W284-L304 VanDerWaalsContact CE2-CD2 3.42Å; W284-L304 HydrophobicContact CG-CD2 3.88Å; W284-L304 HydrophobicContact CG-CG 4.5Å; W284-L304 HydrophobicContact CZ2-CD2 3.95Å; W284-L308 HydrophobicContact CB-CD1 3.81Å; W284-L308 HydrophobicContact CB-CD2 3.9Å; W284-L308 HydrophobicContact CB-CG 4.44Å; W284-L308 HydrophobicContact CD2-CD1 4.13Å; W284-L308 HydrophobicContact CE3-CD1 3.77Å; W284-L308 HydrophobicContact CG-CD1 4.19Å
285	Q	94.3	Very high	90.2	Very high	15 Å²	15	66.4 Å²	66.4	7%	0.07	34%	0.343	C	S	.	.	H	α-helix	trans	-56.3	-45	172.9	-72.4	-179.6	-69.5	0	0	111.1	F234 V281 R282 I288 N289 L308 E315	F234-Q285 HydrophobicContact CD1-CG 4.05Å; F234-Q285 HydrophobicContact CD2-CB 4.24Å; F234-Q285 HydrophobicContact CD2-CG 4.2Å; F234-Q285 HydrophobicContact CE1-CG 3.95Å; F234-Q285 HydrophobicContact CE2-CB 4.36Å; F234-Q285 HydrophobicContact CE2-CG 4.12Å; F234-Q285 HydrophobicContact CG-CB 4.49Å; F234-Q285 HydrophobicContact CG-CG 4.17Å; F234-Q285 HydrophobicContact CZ-CG 4.01Å; V281-Q285 HydrophobicContact CG1-CG 4.26Å; V281-Q285 VanDerWaalsContact O-CG 3.32Å; V281-Q285 WeakPolarHBondContact O-CG 3.33Å; V281-Q285 PolarHBondContact O-N 3.15Å; R282-Q285 PolarHBondContact O-N 2.9Å; Q285-I288 PolarHBondContact O-N 3.3Å; Q285-N289 VanDerWaalsContact O-CB 3.26Å; Q285-N289 WeakPolarHBondContact O-CB 3.34Å; Q285-N289 VanDerWaalsContact O-CG 3.26Å; Q285-N289 PolarHBondContact O-N 3.46Å; Q285-N289 PolarHBondContact O-ND2 2.77Å; Q285-L308 HydrophobicContact CG-CD2 3.92Å; Q285-E315 PolarHBondContact NE2-OE1 3.49Å; Q285-E315 PolarHBondContact NE2-OE2 2.89Å
286	E	93.5	Very high	91	Very high	95 Å²	95	66.7 Å²	66.7	44%	0.444	34%	0.34	S	S	.	.	H	α-helix	trans	-63.3	-45.6	178.2	-174	177.2	-178.8	0	0	112.2	R282 L283 W284 I288 N289 R290	R282-E286 WeakPolarHBondContact O-CB 3.43Å; R282-E286 PolarHBondContact O-N 3.31Å; L283-E286 PolarHBondContact O-N 3.17Å; W284-E286 VanDerWaalsContact C-N 3.28Å; W284-E286 PolarHBondContact O-N 3.05Å; E286-I288 PolarHBondContact O-N 3.24Å; E286-N289 PolarHBondContact O-N 3.4Å; E286-R290 WeakPolarHBondContact O-CB 3.41Å; E286-R290 VanDerWaalsContact O-CG 3.29Å; E286-R290 WeakPolarHBondContact O-CG 3.33Å; E286-R290 PolarHBondContact O-N 2.95Å; E286-R290 IonicContact OE1-CZ 3.5Å; E286-R290 VanDerWaalsContact OE1-CZ 3.27Å; E286-R290 IonicContact OE1-NE 2.76Å; E286-R290 PolarHBondContact OE1-NE 3.25Å; E286-R290 IonicContact OE1-NH2 3.54Å; E286-R290 PolarHBondContact OE1-NH2 3.23Å
287	R	96.9	Very high	91.6	Very high	107 Å²	107	67.8 Å²	67.8	40%	0.404	35%	0.345	S	S	.	.	H	α-helix	trans	-58.3	-48.6	174.9	-86.9	-170.5	82	97.4	-6.7	111.9	L283 W284 R290 G291 L292 P293 V294	L283-R287 PolarHBondContact O-N 3.09Å; W284-R287 PolarHBondContact O-N 3.23Å; R287-R290 PolarHBondContact O-N 2.94Å; R287-G291 PolarHBondContact O-N 3.34Å; R287-L292 HydrophobicContact CB-CB 4.35Å; R287-L292 HydrophobicContact CG-CB 4.47Å; R287-L292 HydrophobicContact CG-CD1 4.1Å; R287-L292 WeakPolarHBondContact O-CB 3.31Å; R287-L292 PolarHBondContact O-N 2.93Å; R287-P293 PolarHBondContact NE-O 3.09Å; R287-P293 PolarHBondContact NH2-O 2.8Å; R287-V294 HydrophobicContact CB-CG1 4.28Å
288	I	97.6	Very high	92.3	Very high	14 Å²	14	67.3 Å²	67.3	7%	0.072	34%	0.341	C	S	.	.	H	α-helix	trans	-63.6	-45.1	-177.7	-67.2	166.1	0	0	0	110.4	Q233 F234 A253 W284 Q285 E286 R290 G291 V294 L308	Q233-I288 HydrophobicContact CB-CG2 3.97Å; Q233-I288 HydrophobicContact CG-CG2 3.68Å; F234-I288 HydrophobicContact CD2-CG2 4.34Å; F234-I288 HydrophobicContact CE2-CB 3.93Å; F234-I288 HydrophobicContact CE2-CD1 3.98Å; F234-I288 HydrophobicContact CE2-CG2 3.73Å; F234-I288 HydrophobicContact CZ-CD1 4.27Å; A253-I288 HydrophobicContact CB-CG2 3.81Å; W284-I288 WeakPolarHBondContact O-CB 3.42Å; W284-I288 VanDerWaalsContact O-CG1 3.24Å; W284-I288 WeakPolarHBondContact O-CG1 3.4Å; W284-I288 PolarHBondContact O-N 2.97Å; Q285-I288 PolarHBondContact O-N 3.3Å; E286-I288 PolarHBondContact O-N 3.24Å; I288-R290 VanDerWaalsContact C-N 3.26Å; I288-R290 PolarHBondContact O-N 3.44Å; I288-G291 WeakPolarHBondContact O-CA 3.45Å; I288-G291 PolarHBondContact O-N 3.41Å; I288-V294 HydrophobicContact CG1-CG1 3.89Å; I288-L308 HydrophobicContact CD1-CD1 4.33Å
289	N	96.9	Very high	93.1	Very high	21 Å²	21	72.1 Å²	72.1	11%	0.112	37%	0.367	C	S	.	.	H	α-helix	trans	-61.8	-32.6	176.8	-79.9	-25.5	0	0	0	113.3	T231 Q232 Q233 F234 Q285 E286 G291	T231-N289 CarbonylContact C-O 3.49Å; T231-N289 PolarHBondContact OG1-O 3.5Å; Q232-N289 PolarHBondContact N-O 3.31Å; Q232-N289 PolarHBondContact NE2-ND2 3.45Å; Q232-N289 PolarHBondContact NE2-OD1 3.45Å; Q233-N289 PolarHBondContact N-OD1 2.96Å; F234-N289 WeakPolarHBondContact CD2-OD1 3.5Å; F234-N289 PolarHBondContact N-OD1 3.35Å; Q285-N289 VanDerWaalsContact O-CB 3.26Å; Q285-N289 WeakPolarHBondContact O-CB 3.34Å; Q285-N289 VanDerWaalsContact O-CG 3.26Å; Q285-N289 PolarHBondContact O-N 3.46Å; Q285-N289 PolarHBondContact O-ND2 2.77Å; E286-N289 PolarHBondContact O-N 3.4Å; N289-G291 PolarHBondContact O-N 3.17Å
290	R	96	Very high	93.7	Very high	142 Å²	142	70.8 Å²	70.8	54%	0.536	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-0.6	173.4	-69.6	173.4	-177.9	-103.4	6.2	113.1	L229 E286 R287 I288 L292	L229-R290 HydrophobicContact CD1-CG 4.02Å; E286-R290 WeakPolarHBondContact O-CB 3.41Å; E286-R290 VanDerWaalsContact O-CG 3.29Å; E286-R290 WeakPolarHBondContact O-CG 3.33Å; E286-R290 PolarHBondContact O-N 2.95Å; E286-R290 IonicContact OE1-CZ 3.5Å; E286-R290 VanDerWaalsContact OE1-CZ 3.27Å; E286-R290 IonicContact OE1-NE 2.76Å; E286-R290 PolarHBondContact OE1-NE 3.25Å; E286-R290 IonicContact OE1-NH2 3.54Å; E286-R290 PolarHBondContact OE1-NH2 3.23Å; R287-R290 PolarHBondContact O-N 2.94Å; I288-R290 VanDerWaalsContact C-N 3.26Å; I288-R290 PolarHBondContact O-N 3.44Å; R290-L292 HydrophobicContact CB-CD1 4.15Å; R290-L292 HydrophobicContact CB-CG 3.9Å; R290-L292 PolarHBondContact O-N 2.86Å
291	G	94.5	Very high	94.1	Very high	46 Å²	46	68.9 Å²	68.9	47%	0.474	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.9	21.1	-175.8	0	0	0	0	0	113.2	R287 I288 N289	R287-G291 PolarHBondContact O-N 3.34Å; I288-G291 WeakPolarHBondContact O-CA 3.45Å; I288-G291 PolarHBondContact O-N 3.41Å; N289-G291 PolarHBondContact O-N 3.17Å
292	L	95.3	Very high	94.6	Very high	75 Å²	75	69.5 Å²	69.5	39%	0.393	36%	0.355	S	S	.	.			trans	-76	142.6	178.8	-63.9	176.3	0	0	0	109.8	R287 R290 V294	R287-L292 HydrophobicContact CB-CB 4.35Å; R287-L292 HydrophobicContact CG-CB 4.47Å; R287-L292 HydrophobicContact CG-CD1 4.1Å; R287-L292 WeakPolarHBondContact O-CB 3.31Å; R287-L292 PolarHBondContact O-N 2.93Å; R290-L292 HydrophobicContact CB-CD1 4.15Å; R290-L292 HydrophobicContact CB-CG 3.9Å; R290-L292 PolarHBondContact O-N 2.86Å; L292-V294 PolarHBondContact O-N 3.08Å
293	P	91	Very high	94.8	Very high	98 Å²	98	65.9 Å²	65.9	64%	0.636	34%	0.342	S	S	*	.			trans	-61	137.5	177.2	25.4	-33.7	0	0	0	110.4	R287	R287-P293 PolarHBondContact NE-O 3.09Å; R287-P293 PolarHBondContact NH2-O 2.8Å
294	V	91.5	Very high	94.9	Very high	30 Å²	30	61 Å²	61	18%	0.182	32%	0.317	C	S	.	.			trans	-117.8	131.6	176.7	-71.1	0	0	0	0	109.4	W284 R287 I288 L292 Y296	W284-V294 HydrophobicContact CE3-CB 4.29Å; W284-V294 HydrophobicContact CE3-CG1 4.1Å; W284-V294 HydrophobicContact CH2-CB 4.42Å; W284-V294 HydrophobicContact CZ3-CB 3.75Å; W284-V294 HydrophobicContact CZ3-CG1 4.06Å; W284-V294 HydrophobicContact CZ3-CG2 4.45Å; R287-V294 HydrophobicContact CB-CG1 4.28Å; I288-V294 HydrophobicContact CG1-CG1 3.89Å; L292-V294 PolarHBondContact O-N 3.08Å; V294-Y296 HydrophobicContact CB-CE2 4.48Å; V294-Y296 HydrophobicContact CG2-CE2 3.69Å; V294-Y296 WeakPolarHBondContact CG2-OH 3.4Å
295	V	93.8	Very high	95	Very high	125 Å²	125	59.9 Å²	59.9	76%	0.758	31%	0.313	S	S	*	.			trans	-112.7	114.8	179	-178	0	0	0	0	107.7	H301	V295-H301 PolarHBondContact O-ND1 3.3Å
296	Y	95.8	Very high	95	Very high	33 Å²	33	59.2 Å²	59.2	13%	0.129	31%	0.309	C	S	.	.			trans	-86.7	119.4	-178.6	-57.5	-87.6	0	0	0	110.3	D256 I257 F260 W284 V294 S305	D256-Y296 HydrophobicContact CB-CE2 4.21Å; I257-Y296 HydrophobicContact CG1-CE1 4.29Å; I257-Y296 WeakPolarHBondContact CG1-OH 3.43Å; F260-Y296 HydrophobicContact CB-CD2 4.21Å; F260-Y296 HydrophobicContact CB-CG 4.14Å; F260-Y296 HydrophobicContact CD1-CD1 4.05Å; F260-Y296 HydrophobicContact CD1-CG 4.08Å; F260-Y296 HydrophobicContact CD2-CG 4.03Å; F260-Y296 HydrophobicContact CE1-CD1 4.37Å; F260-Y296 HydrophobicContact CE1-CG 4.48Å; F260-Y296 HydrophobicContact CE2-CG 4.46Å; F260-Y296 HydrophobicContact CG-CD1 4.24Å; F260-Y296 HydrophobicContact CG-CD2 4.34Å; F260-Y296 AromaticContact CG-CG 3.81Å; F260-Y296 HydrophobicContact CG-CG 3.81Å; W284-Y296 HydrophobicContact CE3-CE1 4.26Å; W284-Y296 AromaticContact CH2-CD1 3.95Å; W284-Y296 HydrophobicContact CH2-CD1 3.95Å; W284-Y296 HydrophobicContact CH2-CE1 4.24Å; W284-Y296 AromaticContact CZ3-CD1 3.64Å; W284-Y296 HydrophobicContact CZ3-CD1 3.64Å; W284-Y296 AromaticContact CZ3-CE1 3.46Å; W284-Y296 HydrophobicContact CZ3-CE1 3.46Å; W284-Y296 VanDerWaalsContact CZ3-CE1 3.46Å; W284-Y296 HydrophobicContact CZ3-CG 4.45Å; V294-Y296 HydrophobicContact CB-CE2 4.48Å; V294-Y296 HydrophobicContact CG2-CE2 3.69Å; V294-Y296 WeakPolarHBondContact CG2-OH 3.4Å; Y296-S305 WeakPolarHBondContact CD1-OG 3.49Å; Y296-S305 WeakPolarHBondContact CE1-OG 3.33Å
297	N	95.8	Very high	94.8	Very high	48 Å²	48	54.8 Å²	54.8	26%	0.257	29%	0.289	S	S	.	.			trans	-88.8	118.6	173.9	-178.9	-10.8	0	0	0	108.5	N299 E300 H301	N297-N299 PolarHBondContact O-N 3.43Å; N297-N299 VanDerWaalsContact O-N 3.12Å; N297-N299 PolarHBondContact OD1-N 2.9Å; N297-E300 HydrophobicContact CB-CB 4.22Å; N297-E300 PolarHBondContact ND2-OE2 2.85Å; N297-E300 PolarHBondContact O-N 3.17Å; N297-E300 VanDerWaalsContact O-N 3.14Å; N297-H301 PolarHBondContact N-ND1 3.14Å; N297-H301 WeakPolarHBondContact O-CB 3.37Å; N297-H301 PolarHBondContact O-N 3.27Å
298	P	95.5	Very high	94.8	Very high	45 Å²	45	49.7 Å²	49.7	29%	0.292	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-27.7	177.7	-26.2	35.4	0	0	0	114.1	F260 H264 I302	F260-P298 HydrophobicContact CE2-CG 4.16Å; H264-P298 HydrophobicContact CB-CB 4.26Å; P298-I302 WeakPolarHBondContact O-CD1 3.48Å; P298-I302 VanDerWaalsContact O-CG1 3.28Å; P298-I302 WeakPolarHBondContact O-CG1 3.41Å
299	N	93.5	Very high	94.7	Very high	151 Å²	151	49 Å²	49	81%	0.807	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-18.6	-177.5	-62.6	-37	0	0	0	113.5	N297	N297-N299 PolarHBondContact O-N 3.43Å; N297-N299 VanDerWaalsContact O-N 3.12Å; N297-N299 PolarHBondContact OD1-N 2.9Å
300	E	93.2	Very high	94.5	Very high	129 Å²	129	48.3 Å²	48.3	60%	0.603	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.2	-37.5	-169.6	-65.7	171.1	167.3	0	0	111.9	N297	N297-E300 HydrophobicContact CB-CB 4.22Å; N297-E300 PolarHBondContact ND2-OE2 2.85Å; N297-E300 PolarHBondContact O-N 3.17Å; N297-E300 VanDerWaalsContact O-N 3.14Å
301	H	97.2	Very high	94.1	Very high	25 Å²	25	41.8 Å²	41.8	12%	0.116	24%	0.238	C	C	.	.	S	Bend	trans	-102	5.6	-163.3	-56.3	155.3	0	0	0	114.5	F260 W284 V295 N297 L304 S305	F260-H301 HydrophobicContact CE1-CB 4.47Å; F260-H301 HydrophobicContact CZ-CB 4.43Å; W284-H301 AromaticContact CH2-CE1 3.97Å; W284-H301 AromaticContact CH2-ND1 3.51Å; W284-H301 AromaticContact CZ2-CE1 3.47Å; W284-H301 VanDerWaalsContact CZ2-CE1 3.47Å; W284-H301 WeakPolarHBondContact CZ2-CE1 3.24Å; W284-H301 AromaticContact CZ2-CG 3.83Å; W284-H301 AromaticContact CZ2-ND1 3.43Å; W284-H301 WeakPolarHBondContact CZ2-ND1 3.48Å; W284-H301 AromaticContact CZ2-NE2 3.79Å; V295-H301 PolarHBondContact O-ND1 3.3Å; N297-H301 PolarHBondContact N-ND1 3.14Å; N297-H301 WeakPolarHBondContact O-CB 3.37Å; N297-H301 PolarHBondContact O-N 3.27Å; H301-L304 PolarHBondContact O-N 3.33Å; H301-S305 VanDerWaalsContact O-CB 3.24Å; H301-S305 WeakPolarHBondContact O-CB 3.15Å; H301-S305 PolarHBondContact O-N 3.4Å; H301-S305 PolarHBondContact O-OG 2.94Å
302	I	97.2	Very high	94.2	Very high	22 Å²	22	39.7 Å²	39.7	11%	0.113	22%	0.216	C	C	.	.	H	α-helix	trans	-60.5	-55.4	-179.5	-67.2	173.2	0	0	0	111.9	F260 L261 H264 T268 I271 P298 L304 S305 A306	F260-I302 HydrophobicContact CE1-CG1 4.22Å; F260-I302 HydrophobicContact CZ-CG1 4.12Å; L261-I302 HydrophobicContact CD2-CG2 4.27Å; L261-I302 WeakPolarHBondContact CD2-O 3.45Å; H264-I302 HydrophobicContact CB-CD1 4.42Å; H264-I302 WeakPolarHBondContact O-CD1 3.49Å; T268-I302 HydrophobicContact CG2-CG2 3.87Å; T268-I302 WeakPolarHBondContact OG1-CD1 3.5Å; I271-I302 HydrophobicContact CD1-CG2 3.59Å; P298-I302 WeakPolarHBondContact O-CD1 3.48Å; P298-I302 VanDerWaalsContact O-CG1 3.28Å; P298-I302 WeakPolarHBondContact O-CG1 3.41Å; I302-L304 VanDerWaalsContact C-N 3.3Å; I302-L304 PolarHBondContact O-N 3.43Å; I302-S305 PolarHBondContact O-N 3.18Å; I302-A306 PolarHBondContact O-N 3.02Å; I302-A306 VanDerWaalsContact O-N 3.08Å
303	H	93.2	Very high	94.2	Very high	36 Å²	36	36.1 Å²	36.1	17%	0.167	20%	0.197	C	C	.	.	H	α-helix	trans	-68.8	-32.4	179.7	-67.9	-50.5	0	0	0	111.9	R274 V276 A306 V307	R274-H303 WeakPolarHBondContact CD-CE1 3.4Å; R274-H303 WeakPolarHBondContact CD-NE2 3.19Å; R274-H303 PolarHBondContact NH1-NE2 2.67Å; V276-H303 HydrophobicContact CG1-CB 3.63Å; H303-A306 WeakPolarHBondContact O-CB 3.31Å; H303-A306 PolarHBondContact O-N 3.13Å; H303-V307 WeakPolarHBondContact O-CG2 3.24Å; H303-V307 PolarHBondContact O-N 2.79Å
304	L	94.4	Very high	94.1	Very high	1 Å²	1	33.6 Å²	33.6	1%	0.005	18%	0.175	C	C	.	.	H	α-helix	trans	-63.3	-49.1	175.7	176.2	61.5	0	0	0	111.3	V276 E280 V281 W284 H301 I302 A306 V307 L308	V276-L304 HydrophobicContact CG1-CB 4.38Å; V276-L304 HydrophobicContact CG2-CD1 3.92Å; E280-L304 HydrophobicContact CG-CD1 3.99Å; E280-L304 HydrophobicContact CG-CD2 3.81Å; V281-L304 HydrophobicContact CG2-CD1 3.87Å; W284-L304 HydrophobicContact CD2-CD2 3.74Å; W284-L304 HydrophobicContact CD2-CG 4.49Å; W284-L304 VanDerWaalsContact CE2-CD2 3.42Å; W284-L304 HydrophobicContact CG-CD2 3.88Å; W284-L304 HydrophobicContact CG-CG 4.5Å; W284-L304 HydrophobicContact CZ2-CD2 3.95Å; H301-L304 PolarHBondContact O-N 3.33Å; I302-L304 VanDerWaalsContact C-N 3.3Å; I302-L304 PolarHBondContact O-N 3.43Å; L304-A306 VanDerWaalsContact C-N 3.29Å; L304-A306 PolarHBondContact O-N 3.27Å; L304-V307 PolarHBondContact O-N 2.91Å; L304-V307 VanDerWaalsContact O-N 3.16Å; L304-L308 HydrophobicContact CD1-CD1 4.21Å; L304-L308 HydrophobicContact CD1-CG 4.24Å; L304-L308 HydrophobicContact CG-CD1 3.97Å; L304-L308 HydrophobicContact CG-CG 4.45Å; L304-L308 WeakPolarHBondContact O-CB 3.39Å; L304-L308 WeakPolarHBondContact O-CG 3.48Å; L304-L308 PolarHBondContact O-N 2.89Å
305	S	97.2	Very high	94	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-58.2	-41.1	174.9	-67.8	0	0	0	0	111.9	I257 F260 Y296 H301 I302 L308 L309	I257-S305 VanDerWaalsContact CG2-O 3.24Å; I257-S305 WeakPolarHBondContact CG2-O 3.49Å; F260-S305 WeakPolarHBondContact CD1-OG 2.94Å; F260-S305 WeakPolarHBondContact CE1-OG 2.92Å; Y296-S305 WeakPolarHBondContact CD1-OG 3.49Å; Y296-S305 WeakPolarHBondContact CE1-OG 3.33Å; H301-S305 VanDerWaalsContact O-CB 3.24Å; H301-S305 WeakPolarHBondContact O-CB 3.15Å; H301-S305 PolarHBondContact O-N 3.4Å; H301-S305 PolarHBondContact O-OG 2.94Å; I302-S305 PolarHBondContact O-N 3.18Å; S305-L308 PolarHBondContact O-N 3.41Å; S305-L309 PolarHBondContact O-N 2.76Å
306	A	95.5	Very high	93.9	Very high	0 Å²	0	28 Å²	28	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-61.8	-44.9	175.7	0	0	0	0	0	112.1	L261 I271 F272 I302 H303 L304 L309 K310	L261-A306 HydrophobicContact CD1-CB 4.48Å; I271-A306 HydrophobicContact CD1-CB 3.59Å; I271-A306 HydrophobicContact CG1-CB 4.27Å; F272-A306 HydrophobicContact CD1-CB 3.7Å; F272-A306 HydrophobicContact CE1-CB 3.8Å; F272-A306 HydrophobicContact CG-CB 4.28Å; F272-A306 HydrophobicContact CZ-CB 4.46Å; I302-A306 PolarHBondContact O-N 3.02Å; I302-A306 VanDerWaalsContact O-N 3.08Å; H303-A306 WeakPolarHBondContact O-CB 3.31Å; H303-A306 PolarHBondContact O-N 3.13Å; L304-A306 VanDerWaalsContact C-N 3.29Å; L304-A306 PolarHBondContact O-N 3.27Å; A306-L309 PolarHBondContact O-N 3.43Å; A306-K310 WeakPolarHBondContact O-CG 3.47Å; A306-K310 PolarHBondContact O-N 3.37Å
307	V	90.1	Very high	93.6	Very high	2 Å²	2	29.6 Å²	29.6	1%	0.012	16%	0.155	C	C	.	.	H	α-helix	trans	-68.5	-39.1	177.5	171.5	0	0	0	0	111.5	R274 V276 V281 H303 L304 L309 K310 T311	R274-V307 WeakPolarHBondContact O-CG2 3.41Å; V276-V307 HydrophobicContact CG2-CB 3.87Å; V276-V307 HydrophobicContact CG2-CG1 3.95Å; V276-V307 HydrophobicContact CG2-CG2 3.96Å; V281-V307 HydrophobicContact CG2-CG1 3.69Å; H303-V307 WeakPolarHBondContact O-CG2 3.24Å; H303-V307 PolarHBondContact O-N 2.79Å; L304-V307 PolarHBondContact O-N 2.91Å; L304-V307 VanDerWaalsContact O-N 3.16Å; V307-L309 VanDerWaalsContact C-N 3.34Å; V307-L309 PolarHBondContact O-N 3.37Å; V307-K310 PolarHBondContact O-N 3.47Å; V307-T311 VanDerWaalsContact O-CB 3.26Å; V307-T311 WeakPolarHBondContact O-CB 3.46Å; V307-T311 PolarHBondContact O-N 3.34Å; V307-T311 PolarHBondContact O-OG1 3.04Å
308	L	95.3	Very high	93.5	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-60.3	-41.5	173.6	-74.4	167.8	0	0	0	111.8	F234 I257 V281 W284 Q285 I288 L304 S305 T311 F312	F234-L308 HydrophobicContact CZ-CD2 4.12Å; I257-L308 HydrophobicContact CD1-CB 3.84Å; V281-L308 HydrophobicContact CG1-CD2 4.11Å; W284-L308 HydrophobicContact CB-CD1 3.81Å; W284-L308 HydrophobicContact CB-CD2 3.9Å; W284-L308 HydrophobicContact CB-CG 4.44Å; W284-L308 HydrophobicContact CD2-CD1 4.13Å; W284-L308 HydrophobicContact CE3-CD1 3.77Å; W284-L308 HydrophobicContact CG-CD1 4.19Å; Q285-L308 HydrophobicContact CG-CD2 3.92Å; I288-L308 HydrophobicContact CD1-CD1 4.33Å; L304-L308 HydrophobicContact CD1-CD1 4.21Å; L304-L308 HydrophobicContact CD1-CG 4.24Å; L304-L308 HydrophobicContact CG-CD1 3.97Å; L304-L308 HydrophobicContact CG-CG 4.45Å; L304-L308 WeakPolarHBondContact O-CB 3.39Å; L304-L308 WeakPolarHBondContact O-CG 3.48Å; L304-L308 PolarHBondContact O-N 2.89Å; S305-L308 PolarHBondContact O-N 3.41Å; L308-T311 PolarHBondContact O-N 3.15Å; L308-F312 WeakPolarHBondContact O-CB 3.26Å; L308-F312 PolarHBondContact O-N 3.44Å
309	L	96.9	Very high	93.5	Very high	0 Å²	0	28 Å²	28	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-61.5	-50.8	175.5	-172.6	59.7	0	0	0	111.4	V254 I257 V258 F272 S305 A306 V307 T311 F312 L313 L358	V254-L309 HydrophobicContact CB-CD1 4.49Å; V254-L309 HydrophobicContact CG1-CD1 4.15Å; V254-L309 HydrophobicContact CG2-CD1 4.17Å; I257-L309 HydrophobicContact CG2-CB 3.82Å; I257-L309 HydrophobicContact CG2-CD1 4.42Å; V258-L309 HydrophobicContact CG2-CD1 4.16Å; V258-L309 HydrophobicContact CG2-CD2 3.81Å; F272-L309 HydrophobicContact CE1-CB 4.25Å; F272-L309 HydrophobicContact CE1-CD2 3.87Å; F272-L309 HydrophobicContact CZ-CD2 3.96Å; S305-L309 PolarHBondContact O-N 2.76Å; A306-L309 PolarHBondContact O-N 3.43Å; V307-L309 VanDerWaalsContact C-N 3.34Å; V307-L309 PolarHBondContact O-N 3.37Å; L309-T311 PolarHBondContact O-N 3.23Å; L309-F312 WeakPolarHBondContact O-CB 3.24Å; L309-F312 PolarHBondContact O-N 2.99Å; L309-L313 HydrophobicContact CG-CD1 4.39Å; L309-L313 VanDerWaalsContact O-CG 3.3Å; L309-L313 WeakPolarHBondContact O-CG 3.45Å; L309-L313 PolarHBondContact O-N 3.07Å; L309-L313 VanDerWaalsContact O-N 3.1Å; L309-L358 HydrophobicContact CD1-CD2 4.03Å; L309-L358 HydrophobicContact CD2-CD2 4.08Å; L309-L358 HydrophobicContact CG-CD2 4.38Å
310	K	91.3	Very high	93.7	Very high	7 Å²	7	20.8 Å²	20.8	3%	0.03	10%	0.103	C	C	.	.	H	α-helix	trans	-57	-43.9	177	-65.1	-169.4	-52.8	171.7	0	111.3	F272 A306 V307 F312 L313 R314 V380 N384	F272-K310 HydrophobicContact CB-CD 4.36Å; F272-K310 HydrophobicContact CD1-CD 4.21Å; F272-K310 HydrophobicContact CD1-CG 3.93Å; F272-K310 VanDerWaalsContact O-CE 3.28Å; F272-K310 WeakPolarHBondContact O-CE 3.22Å; F272-K310 PolarHBondContact O-NZ 3.06Å; A306-K310 WeakPolarHBondContact O-CG 3.47Å; A306-K310 PolarHBondContact O-N 3.37Å; V307-K310 PolarHBondContact O-N 3.47Å; K310-F312 PolarHBondContact O-N 2.83Å; K310-L313 PolarHBondContact O-N 2.99Å; K310-R314 PolarHBondContact O-N 3.49Å; K310-V380 HydrophobicContact CD-CG1 3.24Å; K310-V380 HydrophobicContact CG-CG1 4.35Å; K310-N384 PolarHBondContact O-OD1 3.15Å; K310-N384 VanDerWaalsContact O-OD1 3.13Å
311	T	87.6	Confident	93.9	Very high	5 Å²	5	14.8 Å²	14.8	3%	0.031	8%	0.075	C	C	.	.	H	α-helix	trans	-65.1	-40.9	-178.5	-55.9	0	0	0	0	111.1	F234 V307 L308 L309 L313 R314 E315	F234-T311 HydrophobicContact CD1-CG2 4.5Å; F234-T311 HydrophobicContact CE1-CG2 4.48Å; V307-T311 VanDerWaalsContact O-CB 3.26Å; V307-T311 WeakPolarHBondContact O-CB 3.46Å; V307-T311 PolarHBondContact O-N 3.34Å; V307-T311 PolarHBondContact O-OG1 3.04Å; L308-T311 PolarHBondContact O-N 3.15Å; L309-T311 PolarHBondContact O-N 3.23Å; T311-L313 VanDerWaalsContact C-N 3.35Å; T311-L313 PolarHBondContact O-N 3.44Å; T311-R314 PolarHBondContact O-N 3.44Å; T311-R314 PolarHBondContact OG1-NH2 3.29Å; T311-E315 HydrophobicContact CG2-CG 4.06Å; T311-E315 VanDerWaalsContact CG2-OE1 3.31Å; T311-E315 WeakPolarHBondContact CG2-OE1 3.32Å; T311-E315 VanDerWaalsContact O-CB 3.23Å; T311-E315 WeakPolarHBondContact O-CB 3.46Å; T311-E315 VanDerWaalsContact O-CG 3.28Å; T311-E315 WeakPolarHBondContact O-CG 3.5Å; T311-E315 PolarHBondContact O-N 3.02Å
312	F	96.5	Very high	93.9	Very high	1 Å²	1	13.7 Å²	13.7	0%	0.004	7%	0.07	C	C	.	.	H	α-helix	trans	-55.5	-51.2	172.5	173.5	-86.1	0	0	0	110.8	Q233 F234 I241 P251 A253 V254 L308 L309 K310 R314 E315 L316 L354	Q233-F312 HydrophobicContact CB-CE2 4.4Å; Q233-F312 WeakPolarHBondContact O-CE2 3.34Å; F234-F312 HydrophobicContact CD1-CB 4.09Å; F234-F312 HydrophobicContact CD1-CD2 4.43Å; F234-F312 HydrophobicContact CE1-CB 3.63Å; F234-F312 HydrophobicContact CE1-CD2 4.41Å; F234-F312 HydrophobicContact CZ-CB 4.3Å; I241-F312 HydrophobicContact CD1-CE2 3.69Å; I241-F312 HydrophobicContact CD1-CZ 3.68Å; P251-F312 HydrophobicContact CB-CE1 4.39Å; P251-F312 HydrophobicContact CB-CE2 3.98Å; P251-F312 HydrophobicContact CB-CZ 3.57Å; P251-F312 HydrophobicContact CG-CE1 4.12Å; P251-F312 HydrophobicContact CG-CE2 4.38Å; P251-F312 HydrophobicContact CG-CZ 3.51Å; A253-F312 HydrophobicContact CB-CD2 4.49Å; V254-F312 HydrophobicContact CG2-CD1 3.37Å; V254-F312 HydrophobicContact CG2-CD2 4.31Å; V254-F312 HydrophobicContact CG2-CE1 3.26Å; V254-F312 HydrophobicContact CG2-CE2 4.18Å; V254-F312 HydrophobicContact CG2-CG 3.94Å; V254-F312 HydrophobicContact CG2-CZ 3.71Å; L308-F312 WeakPolarHBondContact O-CB 3.26Å; L308-F312 PolarHBondContact O-N 3.44Å; L309-F312 WeakPolarHBondContact O-CB 3.24Å; L309-F312 PolarHBondContact O-N 2.99Å; K310-F312 PolarHBondContact O-N 2.83Å; F312-R314 PolarHBondContact O-N 2.86Å; F312-E315 PolarHBondContact O-N 2.85Å; F312-L316 HydrophobicContact CE1-CD1 4.23Å; F312-L316 HydrophobicContact CE1-CD2 4.05Å; F312-L316 HydrophobicContact CE1-CG 4.3Å; F312-L316 HydrophobicContact CE2-CD2 4.48Å; F312-L316 HydrophobicContact CZ-CD2 3.87Å; F312-L316 PolarHBondContact O-N 2.97Å; F312-L354 HydrophobicContact CE1-CD2 4.4Å
313	L	95.6	Very high	93.8	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-63.4	-43.7	-175.7	-60.1	170.6	0	0	0	112	L309 K310 T311 V320 L354 L358 F381 N384 L385 W387	L309-L313 HydrophobicContact CG-CD1 4.39Å; L309-L313 VanDerWaalsContact O-CG 3.3Å; L309-L313 WeakPolarHBondContact O-CG 3.45Å; L309-L313 PolarHBondContact O-N 3.07Å; L309-L313 VanDerWaalsContact O-N 3.1Å; K310-L313 PolarHBondContact O-N 2.99Å; T311-L313 VanDerWaalsContact C-N 3.35Å; T311-L313 PolarHBondContact O-N 3.44Å; L313-V320 HydrophobicContact CD2-CG2 3.8Å; L313-L354 HydrophobicContact CD2-CD2 4.46Å; L313-L358 HydrophobicContact CD1-CD1 3.99Å; L313-L358 HydrophobicContact CD1-CD2 4.41Å; L313-L358 HydrophobicContact CD2-CD1 3.45Å; L313-L358 VanDerWaalsContact CD2-CD1 3.45Å; L313-L358 HydrophobicContact CD2-CD2 4.45Å; L313-L358 HydrophobicContact CG-CD1 4.38Å; L313-F381 HydrophobicContact CD1-CD1 4.06Å; L313-F381 HydrophobicContact CD1-CE1 3.95Å; L313-N384 CarbonylContact C-O 3.48Å; L313-N384 HydrophobicContact CB-CB 4.33Å; L313-N384 VanDerWaalsContact CB-O 3.24Å; L313-N384 WeakPolarHBondContact CB-O 3.4Å; L313-L385 HydrophobicContact CD1-CD2 4.17Å; L313-W387 WeakPolarHBondContact O-CH2 3.24Å
314	R	88.9	Confident	93.9	Very high	46 Å²	46	19.1 Å²	19.1	17%	0.174	10%	0.104	C	C	.	.	H	α-helix	trans	-72.5	-29.6	179	178.9	178.7	60.8	-133.8	-11.1	114.3	D83 G87 K310 T311 F312 N384 W387	D83-R314 WeakPolarHBondContact OD2-CD 3.43Å; D83-R314 IonicContact OD2-CZ 3.82Å; D83-R314 IonicContact OD2-NE 3.9Å; D83-R314 IonicContact OD2-NH1 2.82Å; D83-R314 PolarHBondContact OD2-NH1 3.41Å; G87-R314 VanDerWaalsContact CA-NH2 3.32Å; G87-R314 PolarHBondContact O-NH1 3.36Å; K310-R314 PolarHBondContact O-N 3.49Å; T311-R314 PolarHBondContact O-N 3.44Å; T311-R314 PolarHBondContact OG1-NH2 3.29Å; F312-R314 PolarHBondContact O-N 2.86Å; R314-N384 HydrophobicContact CB-CB 4.41Å; R314-N384 VanDerWaalsContact CB-OD1 3.31Å; R314-N384 WeakPolarHBondContact CB-OD1 3.32Å; R314-N384 PolarHBondContact NH1-OD1 2.98Å; R314-W387 WeakPolarHBondContact O-CH2 3.28Å
315	E	89.7	Confident	94	Very high	32 Å²	32	20 Å²	20	15%	0.15	11%	0.109	C	C	.	.	H	α-helix	trans	-89.1	-0.4	-179.2	-70.9	-175.4	179.1	0	0	113.5	R205 F234 G235 Q285 T311 F312 S317	R205-E315 IonicContact CZ-OE1 2.69Å; R205-E315 IonicContact NH1-OE1 2.86Å; R205-E315 PolarHBondContact NH1-OE1 3.09Å; R205-E315 IonicContact NH2-OE1 2.69Å; R205-E315 PolarHBondContact NH2-OE1 3.1Å; F234-E315 WeakPolarHBondContact CB-OE2 3.02Å; G235-E315 CarbonylContact C-O 3.56Å; G235-E315 WeakPolarHBondContact CA-O 3.02Å; G235-E315 PolarHBondContact N-O 3.08Å; Q285-E315 PolarHBondContact NE2-OE1 3.49Å; Q285-E315 PolarHBondContact NE2-OE2 2.89Å; T311-E315 HydrophobicContact CG2-CG 4.06Å; T311-E315 VanDerWaalsContact CG2-OE1 3.31Å; T311-E315 WeakPolarHBondContact CG2-OE1 3.32Å; T311-E315 VanDerWaalsContact O-CB 3.23Å; T311-E315 WeakPolarHBondContact O-CB 3.46Å; T311-E315 VanDerWaalsContact O-CG 3.28Å; T311-E315 WeakPolarHBondContact O-CG 3.5Å; T311-E315 PolarHBondContact O-N 3.02Å; F312-E315 PolarHBondContact O-N 2.85Å; E315-S317 PolarHBondContact O-N 3.17Å
316	L	91.5	Very high	93.9	Very high	6 Å²	6	20.7 Å²	20.7	3%	0.031	11%	0.112	C	C	.	.	S	Bend	trans	-56.8	141.9	168.5	-69.8	175.1	0	0	0	109.5	V236 I241 F312 E318 V320 L354 W387	V236-L316 WeakPolarHBondContact O-CA 3.38Å; V236-L316 WeakPolarHBondContact O-CD2 3.49Å; I241-L316 HydrophobicContact CD1-CD2 4.13Å; F312-L316 HydrophobicContact CE1-CD1 4.23Å; F312-L316 HydrophobicContact CE1-CD2 4.05Å; F312-L316 HydrophobicContact CE1-CG 4.3Å; F312-L316 HydrophobicContact CE2-CD2 4.48Å; F312-L316 HydrophobicContact CZ-CD2 3.87Å; F312-L316 PolarHBondContact O-N 2.97Å; L316-E318 WeakPolarHBondContact CB-O 3.24Å; L316-E318 PolarHBondContact O-N 3.43Å; L316-E318 VanDerWaalsContact O-N 3.11Å; L316-V320 HydrophobicContact CD1-CG2 3.7Å; L316-L354 HydrophobicContact CD1-CD2 4.47Å; L316-W387 WeakPolarHBondContact O-CZ2 3.49Å
317	S	89.8	Confident	93.8	Very high	65 Å²	65	23.1 Å²	23.1	46%	0.455	13%	0.132	S	C	.	.	S	Bend	trans	-63.3	-19.1	178.6	-48.7	0	0	0	0	113.1	V236 T237 E315	V236-S317 VanDerWaalsContact C-OG 3.23Å; V236-S317 WeakPolarHBondContact CA-OG 3.31Å; V236-S317 PolarHBondContact O-N 3.2Å; T237-S317 PolarHBondContact N-OG 3.02Å; E315-S317 PolarHBondContact O-N 3.17Å
318	E	93.2	Very high	94.1	Very high	60 Å²	60	25.8 Å²	25.8	28%	0.28	14%	0.144	S	C	.	.	S	Bend	trans	-138.1	140.9	170.9	-176.9	176.9	-158.4	0	0	108.2	L316 T322 F323	L316-E318 WeakPolarHBondContact CB-O 3.24Å; L316-E318 PolarHBondContact O-N 3.43Å; L316-E318 VanDerWaalsContact O-N 3.11Å; E318-T322 WeakPolarHBondContact OE1-CB 3.49Å; E318-F323 HydrophobicContact CB-CD2 4.41Å; E318-F323 HydrophobicContact CB-CE2 4.02Å; E318-F323 HydrophobicContact CG-CD2 3.67Å; E318-F323 HydrophobicContact CG-CE2 3.75Å; E318-F323 HydrophobicContact CG-CG 4.22Å; E318-F323 HydrophobicContact CG-CZ 4.34Å; E318-F323 PolarHBondContact OE1-N 3.11Å
319	P	94.9	Very high	94.2	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	15%	0.145	C	C	.	.			trans	-56.5	152.5	177	18.5	-30.4	0	0	0	113.1	M321 T322 F323 L385 W387	P319-M321 PolarHBondContact O-N 3.33Å; P319-T322 WeakPolarHBondContact O-CA 3.28Å; P319-T322 PolarHBondContact O-N 3.46Å; P319-F323 HydrophobicContact CG-CD1 3.76Å; P319-F323 HydrophobicContact CG-CE1 3.68Å; P319-F323 HydrophobicContact CG-CG 4.47Å; P319-F323 HydrophobicContact CG-CZ 4.38Å; P319-L385 VanDerWaalsContact CB-O 3.31Å; P319-L385 WeakPolarHBondContact CB-O 3.28Å; P319-W387 HydrophobicContact CB-CD2 3.97Å; P319-W387 HydrophobicContact CB-CE3 3.7Å; P319-W387 HydrophobicContact CB-CH2 3.79Å; P319-W387 HydrophobicContact CB-CZ2 4.05Å; P319-W387 HydrophobicContact CB-CZ3 3.6Å; P319-W387 HydrophobicContact CG-CD2 4.19Å; P319-W387 HydrophobicContact CG-CE3 4.42Å; P319-W387 HydrophobicContact CG-CZ2 4.34Å
320	V	98	Very high	93.9	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-38	173.7	179	0	0	0	0	110.7	L313 L316 T322 N351 L354 L355 L385	L313-V320 HydrophobicContact CD2-CG2 3.8Å; L316-V320 HydrophobicContact CD1-CG2 3.7Å; V320-T322 VanDerWaalsContact C-N 3.28Å; V320-T322 PolarHBondContact O-N 3.24Å; V320-N351 WeakPolarHBondContact O-CB 3.42Å; V320-N351 PolarHBondContact O-ND2 2.87Å; V320-L354 HydrophobicContact CG1-CB 4.49Å; V320-L354 HydrophobicContact CG1-CD2 4.25Å; V320-L354 HydrophobicContact CG1-CG 4.24Å; V320-L354 HydrophobicContact CG2-CD2 3.76Å; V320-L354 HydrophobicContact CG2-CG 4.41Å; V320-L355 HydrophobicContact CG1-CB 3.91Å; V320-L355 HydrophobicContact CG1-CD1 4.39Å; V320-L385 HydrophobicContact CB-CD2 4.15Å; V320-L385 HydrophobicContact CG1-CD2 4.49Å; V320-L385 HydrophobicContact CG2-CD2 4.28Å; V320-L385 PolarHBondContact N-O 3.2Å
321	M	97.8	Very high	94.1	Very high	3 Å²	3	32.7 Å²	32.7	2%	0.015	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.7	13.1	177.4	-55	-166.1	-71.1	0	0	114.7	P319 I329 L355 L385 A386 L401 F404 L408	P319-M321 PolarHBondContact O-N 3.33Å; M321-I329 HydrophobicContact CB-CD1 3.71Å; M321-I329 HydrophobicContact CE-CD1 4.21Å; M321-I329 HydrophobicContact SD-CD1 4.2Å; M321-L355 HydrophobicContact CG-CD1 4.39Å; M321-L355 HydrophobicContact CG-CD2 4.16Å; M321-L355 HydrophobicContact SD-CD1 4.49Å; M321-L355 HydrophobicContact SD-CD2 4.33Å; M321-L385 HydrophobicContact CE-CB 3.68Å; M321-L385 HydrophobicContact CG-CB 4.28Å; M321-L385 PolarHBondContact N-O 2.96Å; M321-L385 HydrophobicContact SD-CB 4.38Å; M321-A386 HydrophobicContact CB-CB 4.16Å; M321-A386 HydrophobicContact CE-CB 3.49Å; M321-A386 VanDerWaalsContact CE-CB 3.49Å; M321-L401 HydrophobicContact CE-CD1 3.87Å; M321-F404 HydrophobicContact CE-CD1 4.24Å; M321-F404 HydrophobicContact CE-CE1 4.39Å; M321-F404 HydrophobicContact SD-CD1 4.14Å; M321-F404 HydrophobicContact SD-CE1 3.73Å; M321-L408 HydrophobicContact SD-CD1 3.91Å
322	T	97.2	Very high	94.4	Very high	2 Å²	2	32.6 Å²	32.6	1%	0.012	17%	0.174	C	C	.	.			trans	58.3	156.6	177	74	0	0	0	0	116.5	E318 P319 V320 S324 L347 P348	E318-T322 WeakPolarHBondContact OE1-CB 3.49Å; P319-T322 WeakPolarHBondContact O-CA 3.28Å; P319-T322 PolarHBondContact O-N 3.46Å; V320-T322 VanDerWaalsContact C-N 3.28Å; V320-T322 PolarHBondContact O-N 3.24Å; T322-S324 VanDerWaalsContact C-N 3.33Å; T322-S324 PolarHBondContact OG1-OG 3.37Å; T322-L347 HydrophobicContact CG2-CD2 3.96Å; T322-P348 HydrophobicContact CG2-CG 4.13Å
323	F	94.7	Very high	94	Very high	80 Å²	80	37.8 Å²	37.8	35%	0.351	20%	0.198	S	C	.	.	H	α-helix	trans	-71.6	-33.4	173.9	-64	-49.4	0	0	0	111.8	E318 P319 L325 Y326 W387	E318-F323 HydrophobicContact CB-CD2 4.41Å; E318-F323 HydrophobicContact CB-CE2 4.02Å; E318-F323 HydrophobicContact CG-CD2 3.67Å; E318-F323 HydrophobicContact CG-CE2 3.75Å; E318-F323 HydrophobicContact CG-CG 4.22Å; E318-F323 HydrophobicContact CG-CZ 4.34Å; E318-F323 PolarHBondContact OE1-N 3.11Å; P319-F323 HydrophobicContact CG-CD1 3.76Å; P319-F323 HydrophobicContact CG-CE1 3.68Å; P319-F323 HydrophobicContact CG-CG 4.47Å; P319-F323 HydrophobicContact CG-CZ 4.38Å; F323-L325 VanDerWaalsContact C-N 3.25Å; F323-L325 PolarHBondContact O-N 3.13Å; F323-Y326 WeakPolarHBondContact O-CB 3.33Å; F323-Y326 PolarHBondContact O-N 3.27Å; F323-W387 WeakPolarHBondContact CD1-O 3.1Å; F323-W387 AromaticContact CE1-CD1 3.84Å; F323-W387 AromaticContact CE1-NE1 3.65Å; F323-W387 WeakPolarHBondContact CE1-O 3.25Å; F323-W387 AromaticContact CZ-NE1 3.87Å
324	S	95.5	Very high	93.7	Very high	92 Å²	92	41 Å²	41	64%	0.643	23%	0.232	S	C	*	.	H	α-helix	trans	-62.8	-28.4	-177.4	56.2	0	0	0	0	113.9	T322	T322-S324 VanDerWaalsContact C-N 3.33Å; T322-S324 PolarHBondContact OG1-OG 3.37Å
325	L	97.1	Very high	93.8	Very high	20 Å²	20	44.3 Å²	44.3	11%	0.105	25%	0.247	C	C	.	.	H	α-helix	trans	-99.3	-8.1	-178.4	-61	176.7	0	0	0	113.6	F323 A327 E328 I329 I343 S346 L347	F323-L325 VanDerWaalsContact C-N 3.25Å; F323-L325 PolarHBondContact O-N 3.13Å; L325-A327 VanDerWaalsContact C-N 3.32Å; L325-A327 PolarHBondContact O-N 2.64Å; L325-E328 PolarHBondContact O-N 2.9Å; L325-I329 HydrophobicContact CB-CD1 4.33Å; L325-I329 WeakPolarHBondContact O-CG1 3.36Å; L325-I329 PolarHBondContact O-N 3.09Å; L325-I343 HydrophobicContact CB-CG2 4.5Å; L325-I343 HydrophobicContact CD1-CG2 4.37Å; L325-S346 WeakPolarHBondContact CD1-OG 3.45Å; L325-S346 WeakPolarHBondContact CD2-OG 3.24Å; L325-L347 HydrophobicContact CD1-CD2 3.47Å; L325-L347 VanDerWaalsContact CD1-CD2 3.47Å; L325-L347 HydrophobicContact CD1-CG 3.77Å
326	Y	94.8	Very high	94	Very high	13 Å²	13	50.7 Å²	50.7	5%	0.051	28%	0.275	C	S	.	.	H	α-helix	trans	-53.4	-46.3	-176.1	-170.3	-99.2	0	0	0	112.8	F323 E328 I329 L330 A386 P388 I393	F323-Y326 WeakPolarHBondContact O-CB 3.33Å; F323-Y326 PolarHBondContact O-N 3.27Å; Y326-E328 VanDerWaalsContact C-N 3.29Å; Y326-E328 PolarHBondContact O-N 3.01Å; Y326-I329 WeakPolarHBondContact O-CB 3.23Å; Y326-I329 PolarHBondContact O-N 3.21Å; Y326-L330 HydrophobicContact CD1-CD1 3.96Å; Y326-L330 HydrophobicContact CD1-CG 4.33Å; Y326-L330 HydrophobicContact CE1-CD1 3.45Å; Y326-L330 VanDerWaalsContact CE1-CD1 3.45Å; Y326-L330 HydrophobicContact CE1-CD2 4.33Å; Y326-L330 HydrophobicContact CE1-CG 3.97Å; Y326-L330 WeakPolarHBondContact O-CG 3.36Å; Y326-L330 PolarHBondContact O-N 2.83Å; Y326-L330 VanDerWaalsContact O-N 3.09Å; Y326-A386 HydrophobicContact CD2-CB 4Å; Y326-A386 HydrophobicContact CE2-CB 4.17Å; Y326-P388 HydrophobicContact CD1-CB 3.84Å; Y326-P388 HydrophobicContact CE1-CB 3.5Å; Y326-P388 VanDerWaalsContact CE1-CB 3.5Å; Y326-P388 HydrophobicContact CE1-CG 3.98Å; Y326-I393 VanDerWaalsContact OH-CD1 3.31Å; Y326-I393 WeakPolarHBondContact OH-CD1 3.48Å
327	A	93.9	Very high	94.2	Very high	52 Å²	52	51.5 Å²	51.5	43%	0.43	28%	0.279	S	S	.	.	H	α-helix	trans	-64.8	-31.6	178.7	0	0	0	0	0	113.3	L325 K331	L325-A327 VanDerWaalsContact C-N 3.32Å; L325-A327 PolarHBondContact O-N 2.64Å; A327-K331 VanDerWaalsContact O-CG 3.32Å; A327-K331 WeakPolarHBondContact O-CG 3.31Å; A327-K331 PolarHBondContact O-N 3.14Å
328	E	96.3	Very high	94.4	Very high	58 Å²	58	51.4 Å²	51.4	27%	0.271	28%	0.278	S	S	.	.	H	α-helix	trans	-78	-30.6	177.2	-67.6	-56.7	123	0	0	112.2	L325 Y326 K331 F332 R339 I343	L325-E328 PolarHBondContact O-N 2.9Å; Y326-E328 VanDerWaalsContact C-N 3.29Å; Y326-E328 PolarHBondContact O-N 3.01Å; E328-K331 PolarHBondContact O-N 3.38Å; E328-K331 IonicContact OE1-NZ 2.78Å; E328-K331 PolarHBondContact OE1-NZ 3Å; E328-F332 PolarHBondContact O-N 3.46Å; E328-R339 IonicContact OE2-CZ 3.73Å; E328-R339 IonicContact OE2-NH2 3.37Å; E328-R339 PolarHBondContact OE2-NH2 3.37Å; E328-I343 HydrophobicContact CB-CD1 4.45Å
329	I	97	Very high	94.6	Very high	1 Å²	1	52.2 Å²	52.2	1%	0.005	28%	0.279	C	S	.	.	H	α-helix	trans	-62.5	-47.5	171.4	-69.9	166.6	0	0	0	110.3	M321 L325 Y326 K331 F332 I343 L401 F404	M321-I329 HydrophobicContact CB-CD1 3.71Å; M321-I329 HydrophobicContact CE-CD1 4.21Å; M321-I329 HydrophobicContact SD-CD1 4.2Å; L325-I329 HydrophobicContact CB-CD1 4.33Å; L325-I329 WeakPolarHBondContact O-CG1 3.36Å; L325-I329 PolarHBondContact O-N 3.09Å; Y326-I329 WeakPolarHBondContact O-CB 3.23Å; Y326-I329 PolarHBondContact O-N 3.21Å; I329-K331 VanDerWaalsContact C-N 3.3Å; I329-K331 PolarHBondContact O-N 2.97Å; I329-F332 WeakPolarHBondContact O-CB 3.21Å; I329-F332 PolarHBondContact O-N 3.12Å; I329-I343 HydrophobicContact CG1-CG2 4.08Å; I329-L401 HydrophobicContact CG2-CD1 3.96Å; I329-F404 HydrophobicContact CB-CD1 4.21Å; I329-F404 HydrophobicContact CB-CE1 4.43Å; I329-F404 HydrophobicContact CD1-CD1 4.43Å; I329-F404 HydrophobicContact CD1-CE1 4.1Å; I329-F404 HydrophobicContact CG1-CD1 3.95Å; I329-F404 HydrophobicContact CG1-CE1 3.68Å; I329-F404 HydrophobicContact CG1-CZ 4.18Å; I329-F404 HydrophobicContact CG2-CB 3.9Å; I329-F404 HydrophobicContact CG2-CD1 3.46Å; I329-F404 VanDerWaalsContact CG2-CD1 3.46Å; I329-F404 HydrophobicContact CG2-CE1 4.13Å; I329-F404 HydrophobicContact CG2-CG 3.77Å
330	L	90.8	Very high	94.7	Very high	19 Å²	19	52.2 Å²	52.2	10%	0.099	28%	0.279	C	S	.	.	H	α-helix	trans	-63.1	-35	179.3	-65.6	-177.1	0	0	0	113	Y326 F332 Q397 E400 L401	Y326-L330 HydrophobicContact CD1-CD1 3.96Å; Y326-L330 HydrophobicContact CD1-CG 4.33Å; Y326-L330 HydrophobicContact CE1-CD1 3.45Å; Y326-L330 VanDerWaalsContact CE1-CD1 3.45Å; Y326-L330 HydrophobicContact CE1-CD2 4.33Å; Y326-L330 HydrophobicContact CE1-CG 3.97Å; Y326-L330 WeakPolarHBondContact O-CG 3.36Å; Y326-L330 PolarHBondContact O-N 2.83Å; Y326-L330 VanDerWaalsContact O-N 3.09Å; L330-F332 PolarHBondContact O-N 3.4Å; L330-Q397 HydrophobicContact CD1-CB 4.26Å; L330-Q397 HydrophobicContact CD1-CG 3.72Å; L330-Q397 HydrophobicContact CD2-CB 3.98Å; L330-Q397 HydrophobicContact CD2-CG 4.3Å; L330-Q397 VanDerWaalsContact CD2-O 3.29Å; L330-Q397 WeakPolarHBondContact CD2-O 3.36Å; L330-E400 HydrophobicContact CD2-CB 3.93Å; L330-L401 HydrophobicContact CD2-CB 4.46Å
331	K	94.8	Very high	94.6	Very high	132 Å²	132	54.7 Å²	54.7	57%	0.574	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.5	-1.2	176.1	-66	172.1	-163.5	165	0	114.1	A327 E328 I329 H333	A327-K331 VanDerWaalsContact O-CG 3.32Å; A327-K331 WeakPolarHBondContact O-CG 3.31Å; A327-K331 PolarHBondContact O-N 3.14Å; E328-K331 PolarHBondContact O-N 3.38Å; E328-K331 IonicContact OE1-NZ 2.78Å; E328-K331 PolarHBondContact OE1-NZ 3Å; I329-K331 VanDerWaalsContact C-N 3.3Å; I329-K331 PolarHBondContact O-N 2.97Å; K331-H333 VanDerWaalsContact C-N 3.29Å; K331-H333 PolarHBondContact O-N 3.08Å
332	F	94.8	Very high	94.5	Very high	2 Å²	2	59.5 Å²	59.5	1%	0.009	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-20.4	-175.3	177.8	-95.3	0	0	0	113.7	E328 I329 L330 G334 K335 R339 A340 I343 F404 R407	E328-F332 PolarHBondContact O-N 3.46Å; I329-F332 WeakPolarHBondContact O-CB 3.21Å; I329-F332 PolarHBondContact O-N 3.12Å; L330-F332 PolarHBondContact O-N 3.4Å; F332-G334 PolarHBondContact O-N 3.46Å; F332-K335 HydrophobicContact CD2-CB 3.97Å; F332-K335 HydrophobicContact CE2-CB 3.87Å; F332-K335 HydrophobicContact CZ-CB 4.4Å; F332-K335 WeakPolarHBondContact O-CB 3.32Å; F332-K335 WeakPolarHBondContact O-CG 3.37Å; F332-K335 PolarHBondContact O-N 2.95Å; F332-R339 HydrophobicContact CD2-CB 4.31Å; F332-R339 HydrophobicContact CD2-CG 4.03Å; F332-R339 HydrophobicContact CE2-CB 4.08Å; F332-R339 HydrophobicContact CE2-CG 4.32Å; F332-A340 HydrophobicContact CD2-CB 4.35Å; F332-A340 HydrophobicContact CE2-CB 3.6Å; F332-A340 HydrophobicContact CZ-CB 3.91Å; F332-I343 HydrophobicContact CD2-CD1 4.23Å; F332-F404 HydrophobicContact CB-CD2 3.82Å; F332-F404 HydrophobicContact CB-CE2 4.43Å; F332-F404 HydrophobicContact CD1-CB 4.2Å; F332-F404 AromaticContact CD1-CD2 3.51Å; F332-F404 HydrophobicContact CD1-CD2 3.51Å; F332-F404 HydrophobicContact CD1-CE2 4.38Å; F332-F404 HydrophobicContact CD1-CG 4.35Å; F332-F404 AromaticContact CD2-CD2 3.91Å; F332-F404 HydrophobicContact CD2-CD2 3.91Å; F332-F404 AromaticContact CD2-CE2 4Å; F332-F404 HydrophobicContact CD2-CE2 4Å; F332-F404 HydrophobicContact CE1-CD2 4.07Å; F332-F404 HydrophobicContact CE2-CD2 4.44Å; F332-F404 HydrophobicContact CE2-CE2 4.45Å; F332-F404 AromaticContact CG-CD2 3.42Å; F332-F404 HydrophobicContact CG-CD2 3.42Å; F332-F404 VanDerWaalsContact CG-CD2 3.42Å; F332-F404 AromaticContact CG-CE2 3.98Å; F332-F404 HydrophobicContact CG-CE2 3.98Å; F332-F404 HydrophobicContact CG-CG 4.43Å; F332-R407 HydrophobicContact CE1-CB 3.98Å; F332-R407 HydrophobicContact CE1-CG 3.79Å; F332-R407 HydrophobicContact CZ-CB 4.44Å; F332-R407 HydrophobicContact CZ-CG 3.76Å
333	H	88.7	Confident	94.5	Very high	110 Å²	110	59.6 Å²	59.6	51%	0.509	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51	132.1	-173.2	-170.8	66.9	0	0	0	112.8	K331 K335 D403	K331-H333 VanDerWaalsContact C-N 3.29Å; K331-H333 PolarHBondContact O-N 3.08Å; H333-K335 VanDerWaalsContact C-N 3.25Å; H333-K335 PolarHBondContact O-N 2.84Å; H333-D403 IonicContact CE1-OD2 3.35Å; H333-D403 IonicContact CG-OD2 3.39Å; H333-D403 IonicContact ND1-OD2 2.74Å; H333-D403 PolarHBondContact ND1-OD2 3.01Å
334	G	87.7	Confident	94.7	Very high	68 Å²	68	55.9 Å²	55.9	70%	0.701	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.1	8	-177.4	0	0	0	0	0	116.1	F332	F332-G334 PolarHBondContact O-N 3.46Å
335	K	92.4	Very high	94.7	Very high	115 Å²	115	55.8 Å²	55.8	50%	0.5	29%	0.288	S	S	.	.			trans	-89.3	163.2	177.3	-52.9	-59.8	175.5	-172.6	0	112.2	F332 H333 R339	F332-K335 HydrophobicContact CD2-CB 3.97Å; F332-K335 HydrophobicContact CE2-CB 3.87Å; F332-K335 HydrophobicContact CZ-CB 4.4Å; F332-K335 WeakPolarHBondContact O-CB 3.32Å; F332-K335 WeakPolarHBondContact O-CG 3.37Å; F332-K335 PolarHBondContact O-N 2.95Å; H333-K335 VanDerWaalsContact C-N 3.25Å; H333-K335 PolarHBondContact O-N 2.84Å; K335-R339 HydrophobicContact CB-CB 4.04Å; K335-R339 HydrophobicContact CB-CG 4.17Å; K335-R339 HydrophobicContact CG-CG 4.45Å
336	K	93.7	Very high	94.7	Very high	167 Å²	167	58 Å²	58	73%	0.726	31%	0.306	S	S	*	.			trans	-78.4	160.2	-179.8	-64.2	-176.5	179	-179	0	112.3	S338 R339	K336-S338 PolarHBondContact O-N 3.36Å; K336-S338 VanDerWaalsContact O-N 3.1Å; K336-R339 WeakPolarHBondContact O-CB 3.43Å; K336-R339 PolarHBondContact O-N 3.32Å
337	N	94.5	Very high	94.9	Very high	22 Å²	22	58.1 Å²	58.1	12%	0.118	31%	0.307	C	S	.	.	H	α-helix	trans	-53.8	-31.1	175.7	-64.2	6.5	0	0	0	113.2	R339 A340 K341 R407 N411 E414 I415	N337-R339 VanDerWaalsContact C-N 3.28Å; N337-R339 PolarHBondContact O-N 3.47Å; N337-A340 PolarHBondContact O-N 3.5Å; N337-K341 WeakPolarHBondContact O-CB 3.45Å; N337-K341 PolarHBondContact O-N 3.02Å; N337-R407 VanDerWaalsContact OD1-CD 3.3Å; N337-R407 WeakPolarHBondContact OD1-CD 3.3Å; N337-R407 PolarHBondContact OD1-NH1 3.21Å; N337-N411 VanDerWaalsContact ND2-CG 3.34Å; N337-N411 PolarHBondContact ND2-OD1 3.32Å; N337-E414 VanDerWaalsContact CB-OE1 3.26Å; N337-E414 WeakPolarHBondContact CB-OE1 3.5Å; N337-E414 PolarHBondContact ND2-OE2 2.96Å; N337-I415 HydrophobicContact CB-CG1 4.49Å
338	S	95	Very high	95.1	Very high	64 Å²	64	57.8 Å²	57.8	45%	0.448	30%	0.301	S	S	.	.	H	α-helix	trans	-58.3	-37.8	174.2	61	0	0	0	0	112.8	K336 K341 E342	K336-S338 PolarHBondContact O-N 3.36Å; K336-S338 VanDerWaalsContact O-N 3.1Å; S338-K341 WeakPolarHBondContact O-CB 3.49Å; S338-K341 PolarHBondContact O-N 3.47Å; S338-E342 WeakPolarHBondContact O-CG 3.43Å; S338-E342 PolarHBondContact O-N 3.18Å
339	R	96.5	Very high	95	Very high	76 Å²	76	59.2 Å²	59.2	29%	0.287	32%	0.315	S	S	.	.	H	α-helix	trans	-70	-39.9	176.8	-179.3	58.3	-176.8	157.3	2.6	111.5	E328 F332 K335 K336 N337 K341 E342 I343	E328-R339 IonicContact OE2-CZ 3.73Å; E328-R339 IonicContact OE2-NH2 3.37Å; E328-R339 PolarHBondContact OE2-NH2 3.37Å; F332-R339 HydrophobicContact CD2-CB 4.31Å; F332-R339 HydrophobicContact CD2-CG 4.03Å; F332-R339 HydrophobicContact CE2-CB 4.08Å; F332-R339 HydrophobicContact CE2-CG 4.32Å; K335-R339 HydrophobicContact CB-CB 4.04Å; K335-R339 HydrophobicContact CB-CG 4.17Å; K335-R339 HydrophobicContact CG-CG 4.45Å; K336-R339 WeakPolarHBondContact O-CB 3.43Å; K336-R339 PolarHBondContact O-N 3.32Å; N337-R339 VanDerWaalsContact C-N 3.28Å; N337-R339 PolarHBondContact O-N 3.47Å; R339-K341 PolarHBondContact O-N 2.82Å; R339-E342 WeakPolarHBondContact CD-OE2 3.16Å; R339-E342 IonicContact CZ-OE2 3.29Å; R339-E342 IonicContact NH1-OE2 2.93Å; R339-E342 PolarHBondContact NH1-OE2 3.16Å; R339-E342 WeakPolarHBondContact O-CB 3.36Å; R339-E342 PolarHBondContact O-N 2.93Å; R339-I343 HydrophobicContact CG-CD1 4.28Å; R339-I343 WeakPolarHBondContact O-CG1 3.27Å; R339-I343 PolarHBondContact O-N 3.32Å
340	A	96.8	Very high	95	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-61.1	-40	175.5	0	0	0	0	0	110.9	F332 N337 I343 V344 F404 L408 I415	F332-A340 HydrophobicContact CD2-CB 4.35Å; F332-A340 HydrophobicContact CE2-CB 3.6Å; F332-A340 HydrophobicContact CZ-CB 3.91Å; N337-A340 PolarHBondContact O-N 3.5Å; A340-I343 PolarHBondContact O-N 2.8Å; A340-V344 WeakPolarHBondContact O-CG2 3.44Å; A340-V344 PolarHBondContact O-N 2.88Å; A340-F404 HydrophobicContact CB-CE2 3.9Å; A340-L408 HydrophobicContact CB-CD2 4.3Å; A340-I415 HydrophobicContact CB-CD1 3.89Å
341	K	96.3	Very high	95.4	Very high	52 Å²	52	62 Å²	62	23%	0.226	33%	0.328	C	S	.	.	H	α-helix	trans	-63.4	-41.3	175.1	-176.5	172.1	-170.5	168.9	0	113.5	N337 S338 R339 V344 N345 I415 N417	N337-K341 WeakPolarHBondContact O-CB 3.45Å; N337-K341 PolarHBondContact O-N 3.02Å; S338-K341 WeakPolarHBondContact O-CB 3.49Å; S338-K341 PolarHBondContact O-N 3.47Å; R339-K341 PolarHBondContact O-N 2.82Å; K341-V344 WeakPolarHBondContact O-CG2 3.35Å; K341-N345 WeakPolarHBondContact CG-ND2 3.42Å; K341-N345 VanDerWaalsContact O-CB 3.24Å; K341-N345 WeakPolarHBondContact O-CB 3.42Å; K341-N345 PolarHBondContact O-N 3.38Å; K341-N345 PolarHBondContact O-ND2 2.95Å; K341-N345 VanDerWaalsContact O-ND2 3.09Å; K341-I415 HydrophobicContact CB-CG2 4.41Å; K341-I415 WeakPolarHBondContact CG-O 3.3Å; K341-N417 WeakPolarHBondContact CE-ND2 3.44Å; K341-N417 PolarHBondContact NZ-ND2 3.02Å; K341-N417 PolarHBondContact NZ-OD1 2.81Å
342	E	96.7	Very high	95.5	Very high	104 Å²	104	57.7 Å²	57.7	49%	0.486	31%	0.308	S	S	.	.	H	α-helix	trans	-60.4	-46.8	172.7	-71.5	163.8	-160.3	0	0	111.5	S338 R339 N345 S346	S338-E342 WeakPolarHBondContact O-CG 3.43Å; S338-E342 PolarHBondContact O-N 3.18Å; R339-E342 WeakPolarHBondContact CD-OE2 3.16Å; R339-E342 IonicContact CZ-OE2 3.29Å; R339-E342 IonicContact NH1-OE2 2.93Å; R339-E342 PolarHBondContact NH1-OE2 3.16Å; R339-E342 WeakPolarHBondContact O-CB 3.36Å; R339-E342 PolarHBondContact O-N 2.93Å; E342-N345 PolarHBondContact O-N 3.39Å; E342-S346 PolarHBondContact O-N 2.8Å
343	I	97.8	Very high	95.5	Very high	5 Å²	5	61.2 Å²	61.2	3%	0.026	33%	0.327	C	S	.	.	H	α-helix	trans	-60.4	-52	178.6	-65.4	168.4	0	0	0	109.9	L325 E328 I329 F332 R339 A340 N345 S346 F404	L325-I343 HydrophobicContact CB-CG2 4.5Å; L325-I343 HydrophobicContact CD1-CG2 4.37Å; E328-I343 HydrophobicContact CB-CD1 4.45Å; I329-I343 HydrophobicContact CG1-CG2 4.08Å; F332-I343 HydrophobicContact CD2-CD1 4.23Å; R339-I343 HydrophobicContact CG-CD1 4.28Å; R339-I343 WeakPolarHBondContact O-CG1 3.27Å; R339-I343 PolarHBondContact O-N 3.32Å; A340-I343 PolarHBondContact O-N 2.8Å; I343-N345 VanDerWaalsContact C-N 3.34Å; I343-N345 PolarHBondContact O-N 3.47Å; I343-S346 PolarHBondContact O-N 3.48Å; I343-S346 VanDerWaalsContact O-N 3.11Å; I343-S346 PolarHBondContact O-OG 2.82Å; I343-F404 HydrophobicContact CB-CZ 4.3Å; I343-F404 HydrophobicContact CD1-CE2 4.13Å; I343-F404 HydrophobicContact CD1-CZ 4.46Å; I343-F404 HydrophobicContact CG2-CZ 3.9Å
344	V	97.1	Very high	96	Very high	1 Å²	1	56 Å²	56	1%	0.006	30%	0.303	C	S	.	.	H	α-helix	trans	-65.5	-36	-178.7	-63	0	0	0	0	112.4	A340 K341 S346 L347 Y352 L355 F404 L408 I415 F416	A340-V344 WeakPolarHBondContact O-CG2 3.44Å; A340-V344 PolarHBondContact O-N 2.88Å; K341-V344 WeakPolarHBondContact O-CG2 3.35Å; V344-S346 PolarHBondContact O-N 3.23Å; V344-L347 HydrophobicContact CB-CD1 4.29Å; V344-L347 VanDerWaalsContact O-CB 3.27Å; V344-L347 WeakPolarHBondContact O-CB 3.28Å; V344-L347 WeakPolarHBondContact O-CD1 3.47Å; V344-L347 WeakPolarHBondContact O-CG 3.06Å; V344-L347 PolarHBondContact O-N 2.91Å; V344-L347 VanDerWaalsContact O-N 3.13Å; V344-Y352 HydrophobicContact CG2-CE2 4.38Å; V344-Y352 VanDerWaalsContact O-CD2 3.3Å; V344-Y352 WeakPolarHBondContact O-CD2 3.27Å; V344-L355 HydrophobicContact CG1-CD2 3.96Å; V344-F404 HydrophobicContact CG1-CZ 4.49Å; V344-L408 HydrophobicContact CG1-CD1 4.36Å; V344-L408 HydrophobicContact CG1-CD2 3.75Å; V344-I415 HydrophobicContact CG2-CG2 3.57Å; V344-F416 HydrophobicContact CB-CE1 4.29Å; V344-F416 HydrophobicContact CB-CZ 4.25Å; V344-F416 HydrophobicContact CG1-CZ 4.1Å; V344-F416 HydrophobicContact CG2-CE1 4.25Å; V344-F416 HydrophobicContact CG2-CZ 4.29Å
345	N	96.8	Very high	96.4	Very high	90 Å²	90	52.8 Å²	52.8	48%	0.481	27%	0.27	S	S	.	.	H	α-helix	trans	-70	-14.6	177.6	-71.9	-24.9	0	0	0	113.4	K341 E342 I343 L347 Y352	K341-N345 WeakPolarHBondContact CG-ND2 3.42Å; K341-N345 VanDerWaalsContact O-CB 3.24Å; K341-N345 WeakPolarHBondContact O-CB 3.42Å; K341-N345 PolarHBondContact O-N 3.38Å; K341-N345 PolarHBondContact O-ND2 2.95Å; K341-N345 VanDerWaalsContact O-ND2 3.09Å; E342-N345 PolarHBondContact O-N 3.39Å; I343-N345 VanDerWaalsContact C-N 3.34Å; I343-N345 PolarHBondContact O-N 3.47Å; N345-L347 VanDerWaalsContact C-N 3.34Å; N345-Y352 WeakPolarHBondContact OD1-CE2 3.45Å
346	S	97.5	Very high	96.6	Very high	68 Å²	68	49.5 Å²	49.5	48%	0.476	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-4.5	173.6	71.5	0	0	0	0	113.9	L325 E342 I343 V344	L325-S346 WeakPolarHBondContact CD1-OG 3.45Å; L325-S346 WeakPolarHBondContact CD2-OG 3.24Å; E342-S346 PolarHBondContact O-N 2.8Å; I343-S346 PolarHBondContact O-N 3.48Å; I343-S346 VanDerWaalsContact O-N 3.11Å; I343-S346 PolarHBondContact O-OG 2.82Å; V344-S346 PolarHBondContact O-N 3.23Å
347	L	98	Very high	96.7	Very high	14 Å²	14	43.2 Å²	43.2	7%	0.073	23%	0.228	C	C	.	.	S	Bend	trans	-66.3	148.8	174.6	-72.8	165.8	0	0	0	111.5	T322 L325 V344 N345 N351 L355	T322-L347 HydrophobicContact CG2-CD2 3.96Å; L325-L347 HydrophobicContact CD1-CD2 3.47Å; L325-L347 VanDerWaalsContact CD1-CD2 3.47Å; L325-L347 HydrophobicContact CD1-CG 3.77Å; V344-L347 HydrophobicContact CB-CD1 4.29Å; V344-L347 VanDerWaalsContact O-CB 3.27Å; V344-L347 WeakPolarHBondContact O-CB 3.28Å; V344-L347 WeakPolarHBondContact O-CD1 3.47Å; V344-L347 WeakPolarHBondContact O-CG 3.06Å; V344-L347 PolarHBondContact O-N 2.91Å; V344-L347 VanDerWaalsContact O-N 3.13Å; N345-L347 VanDerWaalsContact C-N 3.34Å; L347-N351 HydrophobicContact CB-CB 4.24Å; L347-N351 HydrophobicContact CD2-CB 4.23Å; L347-L355 HydrophobicContact CD1-CD2 3.6Å
348	P	97.7	Very high	96.7	Very high	45 Å²	45	43 Å²	43	29%	0.292	23%	0.227	S	C	.	.			trans	-52.2	147.2	165	-24.6	33.6	0	0	0	111.5	T322 E350 N351 Y352	T322-P348 HydrophobicContact CG2-CG 4.13Å; P348-E350 VanDerWaalsContact C-N 3.27Å; P348-E350 PolarHBondContact O-N 3.32Å; P348-E350 VanDerWaalsContact O-N 3.17Å; P348-N351 HydrophobicContact CB-CB 4.32Å; P348-N351 WeakPolarHBondContact O-CB 3.37Å; P348-N351 PolarHBondContact O-N 3.34Å; P348-Y352 PolarHBondContact O-N 3Å
349	P	95.7	Very high	96.5	Very high	89 Å²	89	40.9 Å²	40.9	58%	0.578	21%	0.211	S	C	*	.	H	α-helix	trans	-53.8	-40.7	-174.7	-28.1	35.5	0	0	0	114	N353	P349-N353 WeakPolarHBondContact O-CB 3.35Å; P349-N353 PolarHBondContact O-N 3.21Å; P349-N353 PolarHBondContact O-ND2 3.1Å
350	E	96.4	Very high	96.1	Very high	73 Å²	73	38.8 Å²	38.8	34%	0.341	20%	0.202	S	C	.	.	H	α-helix	trans	-64.1	-46.5	179.1	-60.2	78.9	-175.3	0	0	111.2	L238 L242 P348 N353 L354	L238-E350 HydrophobicContact CD2-CB 3.81Å; L238-E350 HydrophobicContact CG-CB 4.17Å; L242-E350 HydrophobicContact CD1-CB 3.7Å; L242-E350 HydrophobicContact CD1-CG 3.52Å; P348-E350 VanDerWaalsContact C-N 3.27Å; P348-E350 PolarHBondContact O-N 3.32Å; P348-E350 VanDerWaalsContact O-N 3.17Å; E350-N353 PolarHBondContact O-N 3.13Å; E350-L354 WeakPolarHBondContact O-CB 3.24Å; E350-L354 PolarHBondContact O-N 2.66Å
351	N	98	Very high	95.3	Very high	4 Å²	4	39 Å²	39	2%	0.021	20%	0.204	C	C	.	.	H	α-helix	trans	-64.1	-46	177.9	-70.1	70.3	0	0	0	111.5	V320 L347 P348 N353 L354 L355	V320-N351 WeakPolarHBondContact O-CB 3.42Å; V320-N351 PolarHBondContact O-ND2 2.87Å; L347-N351 HydrophobicContact CB-CB 4.24Å; L347-N351 HydrophobicContact CD2-CB 4.23Å; P348-N351 HydrophobicContact CB-CB 4.32Å; P348-N351 WeakPolarHBondContact O-CB 3.37Å; P348-N351 PolarHBondContact O-N 3.34Å; N351-N353 PolarHBondContact O-N 3.35Å; N351-L354 PolarHBondContact O-N 2.65Å; N351-L355 WeakPolarHBondContact O-CB 3.33Å; N351-L355 PolarHBondContact O-N 3.39Å
352	Y	97.4	Very high	94.7	Very high	42 Å²	42	39.3 Å²	39.3	17%	0.165	21%	0.206	C	C	.	.	H	α-helix	trans	-57.7	-48	175.6	178.4	-93.3	0	0	0	111.6	V344 N345 P348 L354 L355 K356 F416	V344-Y352 HydrophobicContact CG2-CE2 4.38Å; V344-Y352 VanDerWaalsContact O-CD2 3.3Å; V344-Y352 WeakPolarHBondContact O-CD2 3.27Å; N345-Y352 WeakPolarHBondContact OD1-CE2 3.45Å; P348-Y352 PolarHBondContact O-N 3Å; Y352-L354 PolarHBondContact O-N 2.74Å; Y352-L355 PolarHBondContact O-N 3.49Å; Y352-K356 HydrophobicContact CE1-CD 3.95Å; Y352-K356 WeakPolarHBondContact O-CB 3.46Å; Y352-K356 PolarHBondContact O-N 2.93Å; Y352-F416 HydrophobicContact CD2-CD1 4.48Å; Y352-F416 HydrophobicContact CD2-CE1 4.15Å; Y352-F416 HydrophobicContact CE1-CD1 4.4Å; Y352-F416 AromaticContact CE2-CD1 3.71Å; Y352-F416 HydrophobicContact CE2-CD1 3.71Å; Y352-F416 AromaticContact CE2-CE1 3.76Å; Y352-F416 HydrophobicContact CE2-CE1 3.76Å; Y352-F416 AromaticContact CZ-CD1 3.66Å
353	N	95.8	Very high	94.6	Very high	77 Å²	77	34.8 Å²	34.8	41%	0.412	19%	0.185	S	C	.	.	H	α-helix	trans	-63.6	-42.3	-179.3	-73.2	-32.9	0	0	0	111.8	P349 E350 N351 F357	P349-N353 WeakPolarHBondContact O-CB 3.35Å; P349-N353 PolarHBondContact O-N 3.21Å; P349-N353 PolarHBondContact O-ND2 3.1Å; E350-N353 PolarHBondContact O-N 3.13Å; N351-N353 PolarHBondContact O-N 3.35Å; N353-F357 VanDerWaalsContact O-CB 3.3Å; N353-F357 WeakPolarHBondContact O-CB 3.3Å; N353-F357 PolarHBondContact O-N 2.98Å
354	L	97.5	Very high	94.4	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-63.8	-49.4	175.7	177.4	57.8	0	0	0	111.5	L238 L250 V254 F312 L313 L316 V320 E350 N351 Y352 K356 F357 L358	L238-L354 HydrophobicContact CD1-CD2 3.95Å; L238-L354 HydrophobicContact CD2-CB 4.33Å; L238-L354 HydrophobicContact CD2-CD2 3.95Å; L250-L354 HydrophobicContact CD2-CB 4.18Å; L250-L354 HydrophobicContact CD2-CD1 4.18Å; V254-L354 HydrophobicContact CB-CD1 4.48Å; V254-L354 HydrophobicContact CG1-CD1 3.83Å; V254-L354 HydrophobicContact CG2-CD1 4.29Å; F312-L354 HydrophobicContact CE1-CD2 4.4Å; L313-L354 HydrophobicContact CD2-CD2 4.46Å; L316-L354 HydrophobicContact CD1-CD2 4.47Å; V320-L354 HydrophobicContact CG1-CB 4.49Å; V320-L354 HydrophobicContact CG1-CD2 4.25Å; V320-L354 HydrophobicContact CG1-CG 4.24Å; V320-L354 HydrophobicContact CG2-CD2 3.76Å; V320-L354 HydrophobicContact CG2-CG 4.41Å; E350-L354 WeakPolarHBondContact O-CB 3.24Å; E350-L354 PolarHBondContact O-N 2.66Å; N351-L354 PolarHBondContact O-N 2.65Å; Y352-L354 PolarHBondContact O-N 2.74Å; L354-K356 PolarHBondContact O-N 2.68Å; L354-F357 PolarHBondContact O-N 3.28Å; L354-L358 HydrophobicContact CD1-CD1 3.93Å; L354-L358 HydrophobicContact CD1-CG 4.1Å; L354-L358 HydrophobicContact CG-CD1 3.96Å; L354-L358 VanDerWaalsContact O-CG 3.27Å; L354-L358 WeakPolarHBondContact O-CG 3.16Å; L354-L358 PolarHBondContact O-N 3.47Å
355	L	97.4	Very high	94.3	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-59.6	-46.8	178.9	-175.6	61.8	0	0	0	111.4	V320 M321 V344 L347 N351 Y352 F357 L358 L359 L385 L408 F416	V320-L355 HydrophobicContact CG1-CB 3.91Å; V320-L355 HydrophobicContact CG1-CD1 4.39Å; M321-L355 HydrophobicContact CG-CD1 4.39Å; M321-L355 HydrophobicContact CG-CD2 4.16Å; M321-L355 HydrophobicContact SD-CD1 4.49Å; M321-L355 HydrophobicContact SD-CD2 4.33Å; V344-L355 HydrophobicContact CG1-CD2 3.96Å; L347-L355 HydrophobicContact CD1-CD2 3.6Å; N351-L355 WeakPolarHBondContact O-CB 3.33Å; N351-L355 PolarHBondContact O-N 3.39Å; Y352-L355 PolarHBondContact O-N 3.49Å; L355-F357 VanDerWaalsContact C-N 3.33Å; L355-F357 PolarHBondContact O-N 3.29Å; L355-L358 PolarHBondContact O-N 3.5Å; L355-L359 HydrophobicContact CD1-CD1 3.93Å; L355-L359 HydrophobicContact CD1-CG 4.25Å; L355-L359 HydrophobicContact CG-CD1 3.92Å; L355-L359 WeakPolarHBondContact O-CG 3.4Å; L355-L359 PolarHBondContact O-N 3.48Å; L355-L385 HydrophobicContact CD1-CD1 4.16Å; L355-L385 HydrophobicContact CD1-CD2 4.16Å; L355-L408 HydrophobicContact CD2-CD1 4.3Å; L355-F416 HydrophobicContact CD2-CZ 4.05Å; L355-F416 HydrophobicContact CG-CZ 4.02Å
356	K	95.7	Very high	94.2	Very high	46 Å²	46	39.9 Å²	39.9	20%	0.2	21%	0.205	C	C	.	.	H	α-helix	trans	-58.1	-44.8	176	-178.5	173.2	177.3	169.8	0	111.6	Y352 L354 L359 R360 F416 S418	Y352-K356 HydrophobicContact CE1-CD 3.95Å; Y352-K356 WeakPolarHBondContact O-CB 3.46Å; Y352-K356 PolarHBondContact O-N 2.93Å; L354-K356 PolarHBondContact O-N 2.68Å; K356-L359 PolarHBondContact O-N 3.27Å; K356-R360 WeakPolarHBondContact O-CB 3.32Å; K356-R360 VanDerWaalsContact O-CG 3.23Å; K356-R360 WeakPolarHBondContact O-CG 3.36Å; K356-R360 PolarHBondContact O-N 2.93Å; K356-F416 HydrophobicContact CB-CD1 3.58Å; K356-F416 HydrophobicContact CB-CE1 3.77Å; K356-F416 HydrophobicContact CB-CG 4.29Å; K356-F416 HydrophobicContact CD-CB 4.15Å; K356-F416 HydrophobicContact CD-CD1 3.96Å; K356-F416 HydrophobicContact CD-CG 4.39Å; K356-F416 HydrophobicContact CG-CB 4.11Å; K356-F416 HydrophobicContact CG-CD1 3.7Å; K356-F416 HydrophobicContact CG-CE1 4.38Å; K356-F416 HydrophobicContact CG-CG 4.01Å; K356-F416 PolarHBondContact NZ-O 3.13Å; K356-S418 VanDerWaalsContact NZ-CB 3.31Å; K356-S418 PolarHBondContact NZ-OG 3.04Å
357	F	95.4	Very high	94.1	Very high	36 Å²	36	38.6 Å²	38.6	16%	0.158	20%	0.196	C	C	.	.	H	α-helix	trans	-62.2	-44.5	178.5	176.9	-103.8	0	0	0	112.2	L250 V254 V258 N353 L354 L355 R360	L250-F357 HydrophobicContact CD1-CB 3.8Å; L250-F357 HydrophobicContact CD1-CD1 3.65Å; L250-F357 HydrophobicContact CD1-CD2 3.46Å; L250-F357 VanDerWaalsContact CD1-CD2 3.46Å; L250-F357 HydrophobicContact CD1-CE1 4Å; L250-F357 HydrophobicContact CD1-CE2 3.84Å; L250-F357 HydrophobicContact CD1-CG 3.34Å; L250-F357 HydrophobicContact CD1-CZ 4.09Å; L250-F357 HydrophobicContact CD2-CB 4.1Å; L250-F357 HydrophobicContact CD2-CG 4.41Å; V254-F357 HydrophobicContact CG1-CD1 4Å; V254-F357 HydrophobicContact CG1-CE1 3.83Å; V258-F357 HydrophobicContact CB-CE1 3.6Å; V258-F357 HydrophobicContact CB-CZ 3.8Å; V258-F357 HydrophobicContact CG1-CE1 3.61Å; V258-F357 HydrophobicContact CG1-CE2 4.49Å; V258-F357 HydrophobicContact CG1-CZ 3.54Å; V258-F357 HydrophobicContact CG2-CE1 3.71Å; V258-F357 HydrophobicContact CG2-CZ 4.42Å; N353-F357 VanDerWaalsContact O-CB 3.3Å; N353-F357 WeakPolarHBondContact O-CB 3.3Å; N353-F357 PolarHBondContact O-N 2.98Å; L354-F357 PolarHBondContact O-N 3.28Å; L355-F357 VanDerWaalsContact C-N 3.33Å; L355-F357 PolarHBondContact O-N 3.29Å; F357-R360 PolarHBondContact O-N 3.31Å
358	L	95	Very high	94	Very high	17 Å²	17	43.8 Å²	43.8	9%	0.089	22%	0.223	C	C	.	.	H	α-helix	trans	-64.8	-41.8	179	-66.9	166	0	0	0	112.1	V254 V258 L309 L313 L354 L355 R360 F361 L385	V254-L358 HydrophobicContact CG1-CD2 4.26Å; V258-L358 HydrophobicContact CG2-CD2 4.44Å; L309-L358 HydrophobicContact CD1-CD2 4.03Å; L309-L358 HydrophobicContact CD2-CD2 4.08Å; L309-L358 HydrophobicContact CG-CD2 4.38Å; L313-L358 HydrophobicContact CD1-CD1 3.99Å; L313-L358 HydrophobicContact CD1-CD2 4.41Å; L313-L358 HydrophobicContact CD2-CD1 3.45Å; L313-L358 VanDerWaalsContact CD2-CD1 3.45Å; L313-L358 HydrophobicContact CD2-CD2 4.45Å; L313-L358 HydrophobicContact CG-CD1 4.38Å; L354-L358 HydrophobicContact CD1-CD1 3.93Å; L354-L358 HydrophobicContact CD1-CG 4.1Å; L354-L358 HydrophobicContact CG-CD1 3.96Å; L354-L358 VanDerWaalsContact O-CG 3.27Å; L354-L358 WeakPolarHBondContact O-CG 3.16Å; L354-L358 PolarHBondContact O-N 3.47Å; L355-L358 PolarHBondContact O-N 3.5Å; L358-R360 VanDerWaalsContact C-N 3.31Å; L358-R360 PolarHBondContact O-N 3.13Å; L358-F361 WeakPolarHBondContact O-CB 3.28Å; L358-F361 PolarHBondContact O-N 2.96Å; L358-L385 HydrophobicContact CD1-CD2 4.13Å
359	L	91.6	Very high	93.8	Very high	20 Å²	20	44.8 Å²	44.8	11%	0.105	23%	0.229	C	C	.	.	H	α-helix	trans	-74.8	-21.9	-179.6	-64	173.9	0	0	0	112.9	L355 K356 F361 L408 I409 A412 F416	L355-L359 HydrophobicContact CD1-CD1 3.93Å; L355-L359 HydrophobicContact CD1-CG 4.25Å; L355-L359 HydrophobicContact CG-CD1 3.92Å; L355-L359 WeakPolarHBondContact O-CG 3.4Å; L355-L359 PolarHBondContact O-N 3.48Å; K356-L359 PolarHBondContact O-N 3.27Å; L359-F361 PolarHBondContact O-N 3.36Å; L359-L408 HydrophobicContact CD1-CB 3.79Å; L359-L408 HydrophobicContact CD1-CD1 4.25Å; L359-L408 HydrophobicContact CD2-CB 4.47Å; L359-I409 HydrophobicContact CD2-CG1 3.58Å; L359-A412 HydrophobicContact CB-CB 4.25Å; L359-F416 HydrophobicContact CD1-CD2 4.49Å; L359-F416 HydrophobicContact CD1-CE2 3.42Å; L359-F416 VanDerWaalsContact CD1-CE2 3.42Å; L359-F416 HydrophobicContact CD1-CZ 3.72Å
360	R	86.8	Confident	93.8	Very high	31 Å²	31	40.6 Å²	40.6	12%	0.117	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	3.3	166.4	-70.5	171.7	82	93.6	-6.3	113.2	R262 K356 F357 L358 Q362 S418 P419 D421	R262-R360 PolarHBondContact NH2-O 3.21Å; K356-R360 WeakPolarHBondContact O-CB 3.32Å; K356-R360 VanDerWaalsContact O-CG 3.23Å; K356-R360 WeakPolarHBondContact O-CG 3.36Å; K356-R360 PolarHBondContact O-N 2.93Å; F357-R360 PolarHBondContact O-N 3.31Å; L358-R360 VanDerWaalsContact C-N 3.31Å; L358-R360 PolarHBondContact O-N 3.13Å; R360-Q362 PolarHBondContact O-N 3.4Å; R360-S418 PolarHBondContact NH1-OG 3.34Å; R360-P419 VanDerWaalsContact CZ-O 3.22Å; R360-P419 PolarHBondContact NH1-O 3.21Å; R360-P419 PolarHBondContact NH2-O 3.2Å; R360-D421 IonicContact CZ-OD1 3.31Å; R360-D421 IonicContact CZ-OD2 3.71Å; R360-D421 IonicContact NE-OD1 3.29Å; R360-D421 IonicContact NE-OD2 2.68Å; R360-D421 PolarHBondContact NE-OD2 3.21Å; R360-D421 IonicContact NH2-OD1 3.13Å; R360-D421 PolarHBondContact NH2-OD1 3.42Å; R360-D421 IonicContact NH2-OD2 3.61Å; R360-D421 PolarHBondContact NH2-OD2 3.18Å
361	F	80.7	Confident	93.5	Very high	6 Å²	6	41.3 Å²	41.3	3%	0.026	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-12.2	178.1	-171.5	-145.2	0	0	0	112.7	V258 L261 R262 L266 F272 L358 L359 V363	V258-F361 HydrophobicContact CG1-CD2 3.83Å; V258-F361 HydrophobicContact CG1-CE2 4.34Å; V258-F361 HydrophobicContact CG1-CG 4.18Å; L261-F361 HydrophobicContact CB-CE1 4.04Å; L261-F361 HydrophobicContact CB-CE2 4.07Å; L261-F361 HydrophobicContact CB-CZ 3.37Å; L261-F361 HydrophobicContact CD1-CE1 4.23Å; L261-F361 HydrophobicContact CD1-CZ 4.38Å; R262-F361 HydrophobicContact CB-CE2 4.1Å; R262-F361 HydrophobicContact CG-CD2 3.43Å; R262-F361 VanDerWaalsContact CG-CD2 3.43Å; R262-F361 HydrophobicContact CG-CE2 3.32Å; L266-F361 HydrophobicContact CD2-CD2 4.1Å; L266-F361 HydrophobicContact CD2-CE1 4.37Å; L266-F361 HydrophobicContact CD2-CE2 3.42Å; L266-F361 VanDerWaalsContact CD2-CE2 3.42Å; L266-F361 HydrophobicContact CD2-CZ 3.54Å; L266-F361 WeakPolarHBondContact CD2-O 3.3Å; L266-F361 HydrophobicContact CG-CE2 4.11Å; L266-F361 HydrophobicContact CG-CZ 4.37Å; F272-F361 HydrophobicContact CE2-CD1 4.01Å; F272-F361 AromaticContact CE2-CE1 3.52Å; F272-F361 HydrophobicContact CE2-CE1 3.52Å; F272-F361 AromaticContact CZ-CD1 3.96Å; F272-F361 HydrophobicContact CZ-CD1 3.96Å; F272-F361 AromaticContact CZ-CE1 3.49Å; F272-F361 HydrophobicContact CZ-CE1 3.49Å; F272-F361 VanDerWaalsContact CZ-CE1 3.49Å; L358-F361 WeakPolarHBondContact O-CB 3.28Å; L358-F361 PolarHBondContact O-N 2.96Å; L359-F361 PolarHBondContact O-N 3.36Å; F361-V363 HydrophobicContact CB-CG2 4.42Å; F361-V363 HydrophobicContact CD1-CG2 3.26Å; F361-V363 HydrophobicContact CE1-CG2 3.35Å; F361-V363 HydrophobicContact CG-CG2 3.88Å; F361-V363 HydrophobicContact CZ-CG2 4Å; F361-V363 PolarHBondContact O-N 3Å
362	Q	84.9	Confident	93.2	Very high	58 Å²	58	41.1 Å²	41.1	27%	0.271	21%	0.206	S	C	.	.			trans	52.1	30.1	169.7	-65.6	-175.6	-71.9	0	0	115.6	R360 A364 Y365 L420	R360-Q362 PolarHBondContact O-N 3.4Å; Q362-A364 VanDerWaalsContact C-N 3.26Å; Q362-A364 PolarHBondContact O-N 2.88Å; Q362-Y365 WeakPolarHBondContact O-CB 3.4Å; Q362-Y365 PolarHBondContact O-N 3.49Å; Q362-Y365 VanDerWaalsContact O-N 3.14Å; Q362-L420 HydrophobicContact CG-CD1 4.42Å; Q362-L420 HydrophobicContact CG-CD2 4.15Å
363	V	93.5	Very high	93	Very high	8 Å²	8	42.4 Å²	42.4	5%	0.048	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-60.1	-40	177.8	-176.6	0	0	0	0	111.1	L266 I271 F272 F361 Y365 H366 N370 M372 L377	L266-V363 HydrophobicContact CD2-CG2 4.08Å; I271-V363 HydrophobicContact CG2-CG1 3.59Å; F272-V363 HydrophobicContact CD2-CG1 4.31Å; F272-V363 HydrophobicContact CD2-CG2 4.37Å; F272-V363 HydrophobicContact CE2-CG1 4.38Å; F272-V363 HydrophobicContact CE2-CG2 3.71Å; F361-V363 HydrophobicContact CB-CG2 4.42Å; F361-V363 HydrophobicContact CD1-CG2 3.26Å; F361-V363 HydrophobicContact CE1-CG2 3.35Å; F361-V363 HydrophobicContact CG-CG2 3.88Å; F361-V363 HydrophobicContact CZ-CG2 4Å; F361-V363 PolarHBondContact O-N 3Å; V363-Y365 PolarHBondContact O-N 3.36Å; V363-H366 PolarHBondContact O-N 3.11Å; V363-N370 PolarHBondContact O-ND2 3.27Å; V363-M372 HydrophobicContact CG1-CB 4.44Å; V363-L377 HydrophobicContact CB-CD1 3.76Å; V363-L377 HydrophobicContact CB-CD2 4.31Å; V363-L377 HydrophobicContact CG1-CD1 3.87Å; V363-L377 HydrophobicContact CG1-CD2 3.83Å; V363-L377 HydrophobicContact CG1-CG 4.46Å
364	A	93.7	Very high	92.9	Very high	23 Å²	23	38.9 Å²	38.9	19%	0.19	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-62.6	-28.5	179.1	0	0	0	0	0	113.4	Q362 H366 S367 M372 A374 L377 I409	Q362-A364 VanDerWaalsContact C-N 3.26Å; Q362-A364 PolarHBondContact O-N 2.88Å; A364-H366 PolarHBondContact O-N 3.31Å; A364-S367 WeakPolarHBondContact O-CB 3.26Å; A364-S367 PolarHBondContact O-N 3.47Å; A364-S367 PolarHBondContact O-OG 2.88Å; A364-M372 WeakPolarHBondContact CA-O 3.28Å; A364-A374 HydrophobicContact CB-CB 4.26Å; A364-L377 HydrophobicContact CB-CD1 3.81Å; A364-I409 HydrophobicContact CB-CG2 4.03Å
365	Y	94	Very high	92.5	Very high	139 Å²	139	41.7 Å²	41.7	55%	0.545	22%	0.217	S	C	.	.	G	3₁₀ helix	trans	-64.6	-29.7	179.5	-179.4	-99.4	0	0	0	111.9	Q362 V363 S367	Q362-Y365 WeakPolarHBondContact O-CB 3.4Å; Q362-Y365 PolarHBondContact O-N 3.49Å; Q362-Y365 VanDerWaalsContact O-N 3.14Å; V363-Y365 PolarHBondContact O-N 3.36Å; Y365-S367 VanDerWaalsContact C-N 3.35Å
366	H	95.4	Very high	92	Very high	42 Å²	42	42.6 Å²	42.6	19%	0.194	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-97.4	23.1	177.9	-63.2	-74	0	0	0	113	L266 L267 V363 A364 D368 V369 N370	L266-H366 WeakPolarHBondContact O-CB 3.3Å; L267-H366 HydrophobicContact CD2-CB 4.04Å; V363-H366 PolarHBondContact O-N 3.11Å; A364-H366 PolarHBondContact O-N 3.31Å; H366-D368 PolarHBondContact O-N 2.84Å; H366-V369 PolarHBondContact O-N 3.07Å; H366-V369 VanDerWaalsContact O-N 3.15Å; H366-N370 PolarHBondContact O-N 2.84Å; H366-N370 PolarHBondContact O-ND2 3.42Å; H366-N370 PolarHBondContact O-OD1 2.98Å
367	S	95.1	Very high	91.8	Very high	40 Å²	40	40.6 Å²	40.6	28%	0.28	21%	0.213	S	C	.	.	H	α-helix	trans	-68.8	-19.3	-173.2	57.4	0	0	0	0	114.6	A364 Y365 V369 N370 L371 M372	A364-S367 WeakPolarHBondContact O-CB 3.26Å; A364-S367 PolarHBondContact O-N 3.47Å; A364-S367 PolarHBondContact O-OG 2.88Å; Y365-S367 VanDerWaalsContact C-N 3.35Å; S367-V369 VanDerWaalsContact C-N 3.28Å; S367-V369 PolarHBondContact O-N 3.27Å; S367-N370 WeakPolarHBondContact CA-OD1 3.4Å; S367-L371 WeakPolarHBondContact O-CA 3.35Å; S367-L371 PolarHBondContact O-N 3.01Å; S367-M372 WeakPolarHBondContact CB-O 3.31Å
368	D	95.4	Very high	91.6	Very high	123 Å²	123	39 Å²	39	66%	0.658	21%	0.206	S	C	*	.	H	α-helix	trans	-61.3	-34.7	170.2	63.9	-39.5	0	0	0	112.5	H366	H366-D368 PolarHBondContact O-N 2.84Å
369	V	95.3	Very high	91	Very high	67 Å²	67	39.2 Å²	39.2	41%	0.406	21%	0.208	S	C	.	.	H	α-helix	trans	-100.3	-50.9	178.3	-175.6	0	0	0	0	111.6	L267 H366 S367 L371	L267-V369 HydrophobicContact CB-CG1 4.15Å; L267-V369 HydrophobicContact CD2-CB 4.32Å; L267-V369 HydrophobicContact CD2-CG1 4.47Å; L267-V369 HydrophobicContact CD2-CG2 4.5Å; H366-V369 PolarHBondContact O-N 3.07Å; H366-V369 VanDerWaalsContact O-N 3.15Å; S367-V369 VanDerWaalsContact C-N 3.28Å; S367-V369 PolarHBondContact O-N 3.27Å; V369-L371 VanDerWaalsContact C-N 3.28Å; V369-L371 PolarHBondContact O-N 3.47Å
370	N	94.8	Very high	90.7	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-79.7	-10.7	-173.5	75.8	30.4	0	0	0	113.4	L266 T268 P269 G270 I271 V363 H366 S367 M372	L266-N370 VanDerWaalsContact O-CB 3.29Å; L266-N370 WeakPolarHBondContact O-CB 3.28Å; L266-N370 PolarHBondContact O-ND2 3.33Å; T268-N370 WeakPolarHBondContact O-CB 3.32Å; P269-N370 CarbonylContact C-O 3.58Å; P269-N370 WeakPolarHBondContact CA-O 3.27Å; G270-N370 PolarHBondContact N-O 2.99Å; I271-N370 HydrophobicContact CG2-CB 4.23Å; V363-N370 PolarHBondContact O-ND2 3.27Å; H366-N370 PolarHBondContact O-N 2.84Å; H366-N370 PolarHBondContact O-ND2 3.42Å; H366-N370 PolarHBondContact O-OD1 2.98Å; S367-N370 WeakPolarHBondContact CA-OD1 3.4Å; N370-M372 PolarHBondContact O-N 3.43Å; N370-M372 WeakPolarHBondContact OD1-CA 3.28Å; N370-M372 VanDerWaalsContact OD1-CB 3.31Å; N370-M372 WeakPolarHBondContact OD1-CB 3.43Å; N370-M372 PolarHBondContact OD1-N 3.39Å
371	L	90.9	Very high	90.9	Very high	88 Å²	88	37.7 Å²	37.7	46%	0.461	20%	0.201	S	C	.	.			trans	64.6	21.6	177.6	-46.1	177.2	0	0	0	114.8	P269 S367 V369 N376	P269-L371 HydrophobicContact CB-CD1 4.5Å; S367-L371 WeakPolarHBondContact O-CA 3.35Å; S367-L371 PolarHBondContact O-N 3.01Å; V369-L371 VanDerWaalsContact C-N 3.28Å; V369-L371 PolarHBondContact O-N 3.47Å; L371-N376 PolarHBondContact O-ND2 2.85Å
372	M	90.7	Very high	91.3	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.2	C	C	.	.			trans	-120.3	81.4	-179.1	-63.2	-61.3	-60.5	0	0	110.2	I271 R273 V363 A364 S367 N370 N376 L377 V380	I271-M372 HydrophobicContact CG2-CG 4.14Å; I271-M372 WeakPolarHBondContact O-CG 3.3Å; R273-M372 HydrophobicContact CB-CE 3.86Å; R273-M372 HydrophobicContact CB-SD 3.82Å; R273-M372 HydrophobicContact CG-SD 4.05Å; V363-M372 HydrophobicContact CG1-CB 4.44Å; A364-M372 WeakPolarHBondContact CA-O 3.28Å; S367-M372 WeakPolarHBondContact CB-O 3.31Å; N370-M372 PolarHBondContact O-N 3.43Å; N370-M372 WeakPolarHBondContact OD1-CA 3.28Å; N370-M372 VanDerWaalsContact OD1-CB 3.31Å; N370-M372 WeakPolarHBondContact OD1-CB 3.43Å; N370-M372 PolarHBondContact OD1-N 3.39Å; M372-N376 HydrophobicContact CE-CB 3.73Å; M372-N376 HydrophobicContact SD-CB 4.22Å; M372-L377 HydrophobicContact CB-CD1 4.48Å; M372-L377 HydrophobicContact CB-CD2 3.93Å; M372-L377 HydrophobicContact CB-CG 4.02Å; M372-L377 HydrophobicContact CE-CD2 3.94Å; M372-L377 HydrophobicContact CE-CG 4.35Å; M372-L377 WeakPolarHBondContact O-CD1 3.23Å; M372-V380 HydrophobicContact CE-CG2 4.17Å
373	N	93.4	Very high	91.3	Very high	70 Å²	70	36.1 Å²	36.1	37%	0.374	20%	0.196	S	C	.	.			trans	-67.5	172.8	171.6	66.3	29.9	0	0	0	111.4	S375 N376 L377	N373-S375 PolarHBondContact O-N 3.02Å; N373-S375 WeakPolarHBondContact OD1-CB 3.14Å; N373-S375 PolarHBondContact OD1-N 3.44Å; N373-S375 VanDerWaalsContact OD1-N 3.14Å; N373-N376 PolarHBondContact O-N 3.38Å; N373-N376 PolarHBondContact OD1-N 2.99Å; N373-L377 WeakPolarHBondContact O-CG 3.45Å; N373-L377 PolarHBondContact O-N 3.49Å
374	A	94.3	Very high	91	Very high	3 Å²	3	35.9 Å²	35.9	3%	0.025	20%	0.195	C	C	.	.	H	α-helix	trans	-57.3	-36.5	-178.4	0	0	0	0	0	113.1	A364 L377 A378 I409 E410	A364-A374 HydrophobicContact CB-CB 4.26Å; A374-L377 PolarHBondContact O-N 2.87Å; A374-A378 WeakPolarHBondContact O-CB 3.45Å; A374-A378 PolarHBondContact O-N 3.1Å; A374-I409 HydrophobicContact CB-CB 4.26Å; A374-I409 HydrophobicContact CB-CG2 3.68Å; A374-E410 HydrophobicContact CB-CB 4.41Å; A374-E410 WeakPolarHBondContact CB-OE2 3.46Å
375	S	89.3	Confident	91.1	Very high	58 Å²	58	34.9 Å²	34.9	41%	0.406	19%	0.187	S	C	.	.	H	α-helix	trans	-66.4	-48.9	179.6	180	0	0	0	0	111	N373 L377 A378 L379	N373-S375 PolarHBondContact O-N 3.02Å; N373-S375 WeakPolarHBondContact OD1-CB 3.14Å; N373-S375 PolarHBondContact OD1-N 3.44Å; N373-S375 VanDerWaalsContact OD1-N 3.14Å; S375-L377 VanDerWaalsContact C-N 3.28Å; S375-L377 PolarHBondContact O-N 3.02Å; S375-A378 WeakPolarHBondContact O-CB 3.36Å; S375-A378 PolarHBondContact O-N 2.98Å; S375-A378 VanDerWaalsContact O-N 3.07Å; S375-L379 PolarHBondContact O-N 3.48Å; S375-L379 VanDerWaalsContact O-N 3.16Å
376	N	86.2	Confident	91	Very high	19 Å²	19	28.3 Å²	28.3	10%	0.102	16%	0.161	C	C	.	.	H	α-helix	trans	-60.5	-39	176.4	-69.5	-3.1	0	0	0	111.9	E122 L371 M372 N373 A378 V380	E122-N376 WeakPolarHBondContact CG-OD1 3.45Å; L371-N376 PolarHBondContact O-ND2 2.85Å; M372-N376 HydrophobicContact CE-CB 3.73Å; M372-N376 HydrophobicContact SD-CB 4.22Å; N373-N376 PolarHBondContact O-N 3.38Å; N373-N376 PolarHBondContact OD1-N 2.99Å; N376-A378 VanDerWaalsContact C-N 3.35Å; N376-V380 WeakPolarHBondContact O-CG2 3.35Å; N376-V380 PolarHBondContact O-N 3.41Å
377	L	91.2	Very high	90.5	Very high	4 Å²	4	28.5 Å²	28.5	2%	0.021	16%	0.16	C	C	.	.	H	α-helix	trans	-69.5	-33.8	176.5	-69.6	168.1	0	0	0	112	F272 V363 A364 M372 N373 A374 S375 V380 F381 I409	F272-L377 HydrophobicContact CD2-CD2 4.08Å; V363-L377 HydrophobicContact CB-CD1 3.76Å; V363-L377 HydrophobicContact CB-CD2 4.31Å; V363-L377 HydrophobicContact CG1-CD1 3.87Å; V363-L377 HydrophobicContact CG1-CD2 3.83Å; V363-L377 HydrophobicContact CG1-CG 4.46Å; A364-L377 HydrophobicContact CB-CD1 3.81Å; M372-L377 HydrophobicContact CB-CD1 4.48Å; M372-L377 HydrophobicContact CB-CD2 3.93Å; M372-L377 HydrophobicContact CB-CG 4.02Å; M372-L377 HydrophobicContact CE-CD2 3.94Å; M372-L377 HydrophobicContact CE-CG 4.35Å; M372-L377 WeakPolarHBondContact O-CD1 3.23Å; N373-L377 WeakPolarHBondContact O-CG 3.45Å; N373-L377 PolarHBondContact O-N 3.49Å; A374-L377 PolarHBondContact O-N 2.87Å; S375-L377 VanDerWaalsContact C-N 3.28Å; S375-L377 PolarHBondContact O-N 3.02Å; L377-V380 PolarHBondContact O-N 2.79Å; L377-F381 HydrophobicContact CB-CD2 4.29Å; L377-F381 HydrophobicContact CD2-CD2 4.37Å; L377-F381 HydrophobicContact CD2-CE2 4.04Å; L377-F381 WeakPolarHBondContact O-CB 3.43Å; L377-F381 WeakPolarHBondContact O-CD2 3.5Å; L377-F381 PolarHBondContact O-N 2.91Å; L377-I409 HydrophobicContact CB-CD1 3.86Å
378	A	90.4	Very high	89.7	Confident	2 Å²	2	27.6 Å²	27.6	2%	0.017	15%	0.153	C	C	.	.	H	α-helix	trans	-64	-44	176.4	0	0	0	0	0	112.1	A374 S375 N376 V380 F381 G382 N402 T405 W406 I409	A374-A378 WeakPolarHBondContact O-CB 3.45Å; A374-A378 PolarHBondContact O-N 3.1Å; S375-A378 WeakPolarHBondContact O-CB 3.36Å; S375-A378 PolarHBondContact O-N 2.98Å; S375-A378 VanDerWaalsContact O-N 3.07Å; N376-A378 VanDerWaalsContact C-N 3.35Å; A378-V380 PolarHBondContact O-N 3.01Å; A378-F381 PolarHBondContact O-N 3.02Å; A378-G382 WeakPolarHBondContact O-CA 3.48Å; A378-G382 PolarHBondContact O-N 3.29Å; A378-N402 WeakPolarHBondContact CB-O 3.41Å; A378-N402 PolarHBondContact O-OD1 3.45Å; A378-T405 HydrophobicContact CB-CG2 4.18Å; A378-W406 HydrophobicContact CB-CB 3.66Å; A378-I409 HydrophobicContact CB-CD1 4.32Å
379	L	84	Confident	88.7	Confident	22 Å²	22	22.3 Å²	22.3	12%	0.115	13%	0.128	C	C	.	.	H	α-helix	trans	-57.6	-32.1	174.5	-61.6	176.4	0	0	0	112.6	G119 E122 Q123 S375 N402	G119-L379 WeakPolarHBondContact O-CD1 3.47Å; G119-L379 WeakPolarHBondContact O-CD2 3.46Å; E122-L379 HydrophobicContact CB-CD1 4.34Å; Q123-L379 PolarHBondContact NE2-O 3.06Å; S375-L379 PolarHBondContact O-N 3.48Å; S375-L379 VanDerWaalsContact O-N 3.16Å; L379-N402 HydrophobicContact CD2-CB 4.23Å; L379-N402 WeakPolarHBondContact CD2-ND2 3.49Å
380	V	85	Confident	87.2	Confident	0 Å²	0	26 Å²	26	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-83	-48.5	178.7	178.4	0	0	0	0	111	Q123 F272 K310 M372 N376 L377 A378 N384	Q123-V380 HydrophobicContact CB-CG2 4.04Å; F272-V380 HydrophobicContact CB-CG1 3.96Å; K310-V380 HydrophobicContact CD-CG1 3.24Å; K310-V380 HydrophobicContact CG-CG1 4.35Å; M372-V380 HydrophobicContact CE-CG2 4.17Å; N376-V380 WeakPolarHBondContact O-CG2 3.35Å; N376-V380 PolarHBondContact O-N 3.41Å; L377-V380 PolarHBondContact O-N 2.79Å; A378-V380 PolarHBondContact O-N 3.01Å; V380-N384 PolarHBondContact O-ND2 3.29Å
381	F	89.9	Confident	85.7	Confident	20 Å²	20	32.2 Å²	32.2	9%	0.088	17%	0.174	C	C	.	.	H	α-helix	trans	-85	-29.6	-171.5	-81.7	-71.7	0	0	0	113.9	F272 L313 L377 A378 N384 L385 T405	F272-F381 HydrophobicContact CB-CE2 4.49Å; F272-F381 HydrophobicContact CD1-CE1 4.45Å; F272-F381 HydrophobicContact CD1-CE2 4.24Å; F272-F381 AromaticContact CD1-CZ 3.68Å; F272-F381 HydrophobicContact CD1-CZ 3.68Å; F272-F381 AromaticContact CD2-CE2 3.92Å; F272-F381 HydrophobicContact CD2-CE2 3.92Å; F272-F381 AromaticContact CD2-CZ 4Å; F272-F381 HydrophobicContact CD2-CZ 4Å; F272-F381 HydrophobicContact CE1-CE1 4.39Å; F272-F381 HydrophobicContact CE1-CE2 4.5Å; F272-F381 AromaticContact CE1-CZ 3.65Å; F272-F381 HydrophobicContact CE1-CZ 3.65Å; F272-F381 HydrophobicContact CE2-CE2 4.2Å; F272-F381 AromaticContact CE2-CZ 3.97Å; F272-F381 HydrophobicContact CE2-CZ 3.97Å; F272-F381 AromaticContact CG-CE2 3.94Å; F272-F381 HydrophobicContact CG-CE2 3.94Å; F272-F381 AromaticContact CG-CZ 3.85Å; F272-F381 HydrophobicContact CG-CZ 3.85Å; F272-F381 HydrophobicContact CZ-CE2 4.46Å; F272-F381 AromaticContact CZ-CZ 3.78Å; F272-F381 HydrophobicContact CZ-CZ 3.78Å; L313-F381 HydrophobicContact CD1-CD1 4.06Å; L313-F381 HydrophobicContact CD1-CE1 3.95Å; L377-F381 HydrophobicContact CB-CD2 4.29Å; L377-F381 HydrophobicContact CD2-CD2 4.37Å; L377-F381 HydrophobicContact CD2-CE2 4.04Å; L377-F381 WeakPolarHBondContact O-CB 3.43Å; L377-F381 WeakPolarHBondContact O-CD2 3.5Å; L377-F381 PolarHBondContact O-N 2.91Å; A378-F381 PolarHBondContact O-N 3.02Å; F381-N384 CarbonylContact O-C 3.52Å; F381-N384 WeakPolarHBondContact O-CA 3.12Å; F381-N384 PolarHBondContact O-N 3.14Å; F381-L385 HydrophobicContact CB-CD1 3.93Å; F381-L385 HydrophobicContact CB-CG 4.33Å; F381-L385 WeakPolarHBondContact O-CB 3.47Å; F381-L385 VanDerWaalsContact O-CG 3.28Å; F381-L385 WeakPolarHBondContact O-CG 3.33Å; F381-L385 PolarHBondContact O-N 3.3Å; F381-T405 HydrophobicContact CB-CG2 4.21Å
382	G	89.8	Confident	84.1	Confident	0 Å²	0	31 Å²	31	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-50.8	-59.1	-176.4	0	0	0	0	0	112.2	A378 N384 L385 A386 T405	A378-G382 WeakPolarHBondContact O-CA 3.48Å; A378-G382 PolarHBondContact O-N 3.29Å; G382-N384 PolarHBondContact O-N 3.42Å; G382-N384 VanDerWaalsContact O-N 3.15Å; G382-L385 PolarHBondContact O-N 3.47Å; G382-A386 PolarHBondContact O-N 2.95Å; G382-A386 VanDerWaalsContact O-N 3.08Å; G382-T405 VanDerWaalsContact CA-OG1 3.31Å; G382-T405 WeakPolarHBondContact CA-OG1 3.46Å
383	P	85	Confident	82.9	Confident	30 Å²	30	32.2 Å²	32.2	20%	0.195	17%	0.172	C	C	.	.	H	α-helix	trans	-61.4	-23.5	176.9	-25.4	35.6	0	0	0	114.7	L398	P383-L398 HydrophobicContact CG-CD1 3.56Å
384	N	87.7	Confident	81.8	Confident	4 Å²	4	31.4 Å²	31.4	2%	0.021	17%	0.172	C	C	.	.	H	α-helix	trans	-89.2	-12.6	179.1	-67.4	-90.5	0	0	0	112.2	K310 L313 R314 V380 F381 G382	K310-N384 PolarHBondContact O-OD1 3.15Å; K310-N384 VanDerWaalsContact O-OD1 3.13Å; L313-N384 CarbonylContact C-O 3.48Å; L313-N384 HydrophobicContact CB-CB 4.33Å; L313-N384 VanDerWaalsContact CB-O 3.24Å; L313-N384 WeakPolarHBondContact CB-O 3.4Å; R314-N384 HydrophobicContact CB-CB 4.41Å; R314-N384 VanDerWaalsContact CB-OD1 3.31Å; R314-N384 WeakPolarHBondContact CB-OD1 3.32Å; R314-N384 PolarHBondContact NH1-OD1 2.98Å; V380-N384 PolarHBondContact O-ND2 3.29Å; F381-N384 CarbonylContact O-C 3.52Å; F381-N384 WeakPolarHBondContact O-CA 3.12Å; F381-N384 PolarHBondContact O-N 3.14Å; G382-N384 PolarHBondContact O-N 3.42Å; G382-N384 VanDerWaalsContact O-N 3.15Å
385	L	94.8	Very high	80.4	Confident	2 Å²	2	32.3 Å²	32.3	1%	0.01	18%	0.176	C	C	.	.	H	α-helix	trans	-104.2	-24.8	-179.5	-70.3	174.5	0	0	0	112.7	L313 P319 V320 M321 L355 L358 F381 G382 T405	L313-L385 HydrophobicContact CD1-CD2 4.17Å; P319-L385 VanDerWaalsContact CB-O 3.31Å; P319-L385 WeakPolarHBondContact CB-O 3.28Å; V320-L385 HydrophobicContact CB-CD2 4.15Å; V320-L385 HydrophobicContact CG1-CD2 4.49Å; V320-L385 HydrophobicContact CG2-CD2 4.28Å; V320-L385 PolarHBondContact N-O 3.2Å; M321-L385 HydrophobicContact CE-CB 3.68Å; M321-L385 HydrophobicContact CG-CB 4.28Å; M321-L385 PolarHBondContact N-O 2.96Å; M321-L385 HydrophobicContact SD-CB 4.38Å; L355-L385 HydrophobicContact CD1-CD1 4.16Å; L355-L385 HydrophobicContact CD1-CD2 4.16Å; L358-L385 HydrophobicContact CD1-CD2 4.13Å; F381-L385 HydrophobicContact CB-CD1 3.93Å; F381-L385 HydrophobicContact CB-CG 4.33Å; F381-L385 WeakPolarHBondContact O-CB 3.47Å; F381-L385 VanDerWaalsContact O-CG 3.28Å; F381-L385 WeakPolarHBondContact O-CG 3.33Å; F381-L385 PolarHBondContact O-N 3.3Å; G382-L385 PolarHBondContact O-N 3.47Å; L385-T405 HydrophobicContact CD1-CG2 4.13Å
386	A	91.7	Very high	79.7	Confident	0 Å²	0	38 Å²	38	0%	0	19%	0.189	C	C	.	.			trans	-151.5	144.7	178.4	0	0	0	0	0	112.8	M321 Y326 G382 L401	M321-A386 HydrophobicContact CB-CB 4.16Å; M321-A386 HydrophobicContact CE-CB 3.49Å; M321-A386 VanDerWaalsContact CE-CB 3.49Å; Y326-A386 HydrophobicContact CD2-CB 4Å; Y326-A386 HydrophobicContact CE2-CB 4.17Å; G382-A386 PolarHBondContact O-N 2.95Å; G382-A386 VanDerWaalsContact O-N 3.08Å; A386-L401 HydrophobicContact CB-CD1 3.73Å; A386-L401 HydrophobicContact CB-CD2 4.45Å; A386-L401 WeakPolarHBondContact O-CD2 3.24Å
387	W	85.1	Confident	79.4	Confident	47 Å²	47	39.2 Å²	39.2	18%	0.178	19%	0.194	C	C	.	.			trans	-157.7	157.1	172.5	58	94.6	0	0	0	110	L313 R314 L316 P319 F323 G389	L313-W387 WeakPolarHBondContact O-CH2 3.24Å; R314-W387 WeakPolarHBondContact O-CH2 3.28Å; L316-W387 WeakPolarHBondContact O-CZ2 3.49Å; P319-W387 HydrophobicContact CB-CD2 3.97Å; P319-W387 HydrophobicContact CB-CE3 3.7Å; P319-W387 HydrophobicContact CB-CH2 3.79Å; P319-W387 HydrophobicContact CB-CZ2 4.05Å; P319-W387 HydrophobicContact CB-CZ3 3.6Å; P319-W387 HydrophobicContact CG-CD2 4.19Å; P319-W387 HydrophobicContact CG-CE3 4.42Å; P319-W387 HydrophobicContact CG-CZ2 4.34Å; F323-W387 WeakPolarHBondContact CD1-O 3.1Å; F323-W387 AromaticContact CE1-CD1 3.84Å; F323-W387 AromaticContact CE1-NE1 3.65Å; F323-W387 WeakPolarHBondContact CE1-O 3.25Å; F323-W387 AromaticContact CZ-NE1 3.87Å; W387-G389 PolarHBondContact O-N 3.17Å
388	P	79.7	Confident	78.6	Confident	20 Å²	20	39.3 Å²	39.3	13%	0.13	19%	0.194	C	C	.	.			trans	-82	34.3	-173.7	30.5	-30.8	0	0	0	114.8	Y326 D390 Q391	Y326-P388 HydrophobicContact CD1-CB 3.84Å; Y326-P388 HydrophobicContact CE1-CB 3.5Å; Y326-P388 VanDerWaalsContact CE1-CB 3.5Å; Y326-P388 HydrophobicContact CE1-CG 3.98Å; P388-D390 PolarHBondContact O-N 3.48Å; P388-Q391 HydrophobicContact CB-CB 4.01Å; P388-Q391 HydrophobicContact CG-CB 3.94Å; P388-Q391 PolarHBondContact O-N 3.4Å
389	G	72.9	Confident	78	Confident	13 Å²	13	43 Å²	43	13%	0.134	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.6	-121.2	-176.4	0	0	0	0	0	112.3	H208 W387 Q391	H208-G389 PolarHBondContact NE2-O 3.22Å; W387-G389 PolarHBondContact O-N 3.17Å; G389-Q391 PolarHBondContact O-N 2.93Å
390	D	65.3	Low	78.2	Confident	143 Å²	143	43.7 Å²	43.7	77%	0.765	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.7	9.1	-177.1	-73.2	-8.9	0	0	0	113.9	H208 P388	H208-D390 PolarHBondContact CD2-O 3.47Å; H208-D390 VanDerWaalsContact NE2-CA 3.32Å; H208-D390 WeakPolarHBondContact NE2-CA 3.45Å; P388-D390 PolarHBondContact O-N 3.48Å
391	Q	62.6	Low	78.3	Confident	131 Å²	131	43.7 Å²	43.7	61%	0.612	22%	0.217	S	C	*	.	S	Bend	trans	-97.5	150.7	178.1	-59.7	179.3	6.4	0	0	111.4	P388 G389	P388-Q391 HydrophobicContact CB-CB 4.01Å; P388-Q391 HydrophobicContact CG-CB 3.94Å; P388-Q391 PolarHBondContact O-N 3.4Å; G389-Q391 PolarHBondContact O-N 2.93Å
392	Q	57.3	Low	78.2	Confident	63 Å²	63	43.2 Å²	43.2	29%	0.294	22%	0.215	S	C	.	.	P	Polyproline II helix	trans	-73.9	145.3	168.9	-70.4	171.6	6.6	0	0	109.5	H209	H209-Q392 PolarHBondContact CE1-NE2 3.13Å; H209-Q392 PolarHBondContact ND1-NE2 3.28Å
393	I	65.2	Low	78.2	Confident	26 Å²	26	45 Å²	45	13%	0.133	22%	0.224	C	C	.	.	P	Polyproline II helix	trans	-87.3	121.6	175	-167.7	167.1	0	0	0	108.5	Y326 Q397 L398 L401	Y326-I393 VanDerWaalsContact OH-CD1 3.31Å; Y326-I393 WeakPolarHBondContact OH-CD1 3.48Å; I393-Q397 HydrophobicContact CD1-CB 4.43Å; I393-Q397 HydrophobicContact CG1-CB 3.72Å; I393-L398 HydrophobicContact CD1-CB 4.03Å; I393-L398 HydrophobicContact CD1-CD1 4.13Å; I393-L398 HydrophobicContact CG1-CB 4.19Å; I393-L401 HydrophobicContact CD1-CD2 3.8Å
394	S	70.2	Confident	78.8	Confident	53 Å²	53	43.6 Å²	43.6	37%	0.371	22%	0.215	S	C	.	.	P	Polyproline II helix	trans	-73	160.2	172.7	72.8	0	0	0	0	110.8	R396 Q397 L398	S394-R396 VanDerWaalsContact C-N 3.3Å; S394-R396 PolarHBondContact O-N 3.28Å; S394-Q397 PolarHBondContact O-N 3.35Å; S394-Q397 VanDerWaalsContact O-N 3.11Å; S394-Q397 WeakPolarHBondContact OG-CG 3.39Å; S394-Q397 PolarHBondContact OG-N 3.39Å; S394-L398 PolarHBondContact O-N 2.94Å
395	L	65.8	Low	79.2	Confident	21 Å²	21	43.4 Å²	43.4	11%	0.11	21%	0.214	C	C	.	.	H	α-helix	trans	-53.5	-47.6	176.5	-70.1	174.5	0	0	0	112.2	V80 Y112 V116 Q397 L398 D399	V80-L395 HydrophobicContact CB-CD2 4.27Å; V80-L395 HydrophobicContact CG2-CD2 3.37Å; Y112-L395 WeakPolarHBondContact OH-CD1 3.42Å; V116-L395 HydrophobicContact CB-CD1 4.5Å; V116-L395 HydrophobicContact CG1-CD1 3.87Å; V116-L395 HydrophobicContact CG1-CD2 3.75Å; V116-L395 HydrophobicContact CG1-CG 4.49Å; V116-L395 HydrophobicContact CG2-CD1 3.75Å; L395-Q397 PolarHBondContact O-N 3.5Å; L395-L398 WeakPolarHBondContact O-CB 3.17Å; L395-L398 PolarHBondContact O-N 3.41Å; L395-L398 VanDerWaalsContact O-N 3.12Å; L395-D399 PolarHBondContact O-N 3.3Å
396	R	74.3	Confident	79.2	Confident	178 Å²	178	46.9 Å²	46.9	67%	0.672	23%	0.227	S	C	*	.	H	α-helix	trans	-58.4	-44.4	176.2	179.4	-179.9	171.9	162.9	6.7	112.9	S394 L398 D399 E400	S394-R396 VanDerWaalsContact C-N 3.3Å; S394-R396 PolarHBondContact O-N 3.28Å; R396-L398 VanDerWaalsContact C-N 3.27Å; R396-L398 PolarHBondContact O-N 3.06Å; R396-D399 PolarHBondContact O-N 2.89Å; R396-E400 IonicContact CZ-OE1 3.99Å; R396-E400 IonicContact NE-OE1 3.49Å; R396-E400 PolarHBondContact NE-OE1 3.06Å; R396-E400 IonicContact NH2-OE1 3.5Å; R396-E400 WeakPolarHBondContact O-CG 3.1Å; R396-E400 PolarHBondContact O-N 3.24Å
397	Q	79	Confident	79.4	Confident	44 Å²	44	49.9 Å²	49.9	21%	0.206	24%	0.239	C	C	.	.	H	α-helix	trans	-64.5	-36.4	178.1	-72.9	-179.1	-35.8	0	0	111.6	L330 I393 S394 L395 L401	L330-Q397 HydrophobicContact CD1-CB 4.26Å; L330-Q397 HydrophobicContact CD1-CG 3.72Å; L330-Q397 HydrophobicContact CD2-CB 3.98Å; L330-Q397 HydrophobicContact CD2-CG 4.3Å; L330-Q397 VanDerWaalsContact CD2-O 3.29Å; L330-Q397 WeakPolarHBondContact CD2-O 3.36Å; I393-Q397 HydrophobicContact CD1-CB 4.43Å; I393-Q397 HydrophobicContact CG1-CB 3.72Å; S394-Q397 PolarHBondContact O-N 3.35Å; S394-Q397 VanDerWaalsContact O-N 3.11Å; S394-Q397 WeakPolarHBondContact OG-CG 3.39Å; S394-Q397 PolarHBondContact OG-N 3.39Å; L395-Q397 PolarHBondContact O-N 3.5Å; Q397-L401 WeakPolarHBondContact O-CB 3.46Å; Q397-L401 PolarHBondContact O-N 3.5Å
398	L	76.2	Confident	79.9	Confident	6 Å²	6	47.7 Å²	47.7	3%	0.031	23%	0.23	C	C	.	.	H	α-helix	trans	-65	-42.2	176	178.8	63.9	0	0	0	111.5	V80 F120 P383 I393 S394 L395 R396 L401 N402	V80-L398 HydrophobicContact CG1-CD2 4.42Å; F120-L398 HydrophobicContact CE1-CD2 3.61Å; F120-L398 HydrophobicContact CE2-CD2 4.49Å; F120-L398 HydrophobicContact CZ-CD2 3.32Å; P383-L398 HydrophobicContact CG-CD1 3.56Å; I393-L398 HydrophobicContact CD1-CB 4.03Å; I393-L398 HydrophobicContact CD1-CD1 4.13Å; I393-L398 HydrophobicContact CG1-CB 4.19Å; S394-L398 PolarHBondContact O-N 2.94Å; L395-L398 WeakPolarHBondContact O-CB 3.17Å; L395-L398 PolarHBondContact O-N 3.41Å; L395-L398 VanDerWaalsContact O-N 3.12Å; R396-L398 VanDerWaalsContact C-N 3.27Å; R396-L398 PolarHBondContact O-N 3.06Å; L398-L401 PolarHBondContact O-N 3.06Å; L398-N402 VanDerWaalsContact O-CB 3.29Å; L398-N402 WeakPolarHBondContact O-CB 3.45Å; L398-N402 PolarHBondContact O-N 3.36Å; L398-N402 PolarHBondContact O-ND2 2.84Å; L398-N402 VanDerWaalsContact O-ND2 3.13Å
399	D	77	Confident	80.7	Confident	81 Å²	81	48 Å²	48	43%	0.433	23%	0.231	S	C	.	.	H	α-helix	trans	-63.7	-46	175.9	-68.6	-28.6	0	0	0	111.8	L395 R396 L401 N402 D403	L395-D399 PolarHBondContact O-N 3.3Å; R396-D399 PolarHBondContact O-N 2.89Å; D399-L401 VanDerWaalsContact C-N 3.33Å; D399-L401 PolarHBondContact O-N 2.85Å; D399-N402 PolarHBondContact O-N 3.38Å; D399-D403 WeakPolarHBondContact O-CB 3.26Å; D399-D403 PolarHBondContact O-N 2.88Å
400	E	87.9	Confident	81.7	Confident	35 Å²	35	52.7 Å²	52.7	16%	0.164	25%	0.249	C	C	.	.	H	α-helix	trans	-60	-41.5	175.2	-71.4	168.4	177	0	0	111.6	L330 R396 F404	L330-E400 HydrophobicContact CD2-CB 3.93Å; R396-E400 IonicContact CZ-OE1 3.99Å; R396-E400 IonicContact NE-OE1 3.49Å; R396-E400 PolarHBondContact NE-OE1 3.06Å; R396-E400 IonicContact NH2-OE1 3.5Å; R396-E400 WeakPolarHBondContact O-CG 3.1Å; R396-E400 PolarHBondContact O-N 3.24Å; E400-F404 PolarHBondContact O-N 3.09Å; E400-F404 VanDerWaalsContact O-N 3.11Å
401	L	88	Confident	83	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-66.4	-42.2	175.8	172.5	59.1	0	0	0	112.4	M321 I329 L330 A386 I393 Q397 L398 D399 F404 T405	M321-L401 HydrophobicContact CE-CD1 3.87Å; I329-L401 HydrophobicContact CG2-CD1 3.96Å; L330-L401 HydrophobicContact CD2-CB 4.46Å; A386-L401 HydrophobicContact CB-CD1 3.73Å; A386-L401 HydrophobicContact CB-CD2 4.45Å; A386-L401 WeakPolarHBondContact O-CD2 3.24Å; I393-L401 HydrophobicContact CD1-CD2 3.8Å; Q397-L401 WeakPolarHBondContact O-CB 3.46Å; Q397-L401 PolarHBondContact O-N 3.5Å; L398-L401 PolarHBondContact O-N 3.06Å; D399-L401 VanDerWaalsContact C-N 3.33Å; D399-L401 PolarHBondContact O-N 2.85Å; L401-F404 PolarHBondContact O-N 3.41Å; L401-T405 WeakPolarHBondContact O-CB 3.34Å; L401-T405 PolarHBondContact O-N 3.13Å; L401-T405 PolarHBondContact O-OG1 3.06Å
402	N	87	Confident	84.5	Confident	11 Å²	11	41.8 Å²	41.8	6%	0.059	20%	0.197	C	C	.	.	H	α-helix	trans	-67	-38.9	178.4	-71.7	-25.7	0	0	0	110.9	A378 L379 L398 D399 T405 W406	A378-N402 WeakPolarHBondContact CB-O 3.41Å; A378-N402 PolarHBondContact O-OD1 3.45Å; L379-N402 HydrophobicContact CD2-CB 4.23Å; L379-N402 WeakPolarHBondContact CD2-ND2 3.49Å; L398-N402 VanDerWaalsContact O-CB 3.29Å; L398-N402 WeakPolarHBondContact O-CB 3.45Å; L398-N402 PolarHBondContact O-N 3.36Å; L398-N402 PolarHBondContact O-ND2 2.84Å; L398-N402 VanDerWaalsContact O-ND2 3.13Å; D399-N402 PolarHBondContact O-N 3.38Å; N402-T405 PolarHBondContact O-N 3.47Å; N402-W406 VanDerWaalsContact O-CB 3.3Å; N402-W406 WeakPolarHBondContact O-CB 3.23Å; N402-W406 PolarHBondContact O-N 3.14Å
403	D	90.6	Very high	86.1	Confident	36 Å²	36	42 Å²	42	19%	0.193	20%	0.202	C	C	.	.	H	α-helix	trans	-60.7	-47.3	173.4	178.9	49.8	0	0	0	111.7	H333 D399 T405 W406 R407	H333-D403 IonicContact CE1-OD2 3.35Å; H333-D403 IonicContact CG-OD2 3.39Å; H333-D403 IonicContact ND1-OD2 2.74Å; H333-D403 PolarHBondContact ND1-OD2 3.01Å; D399-D403 WeakPolarHBondContact O-CB 3.26Å; D399-D403 PolarHBondContact O-N 2.88Å; D403-T405 VanDerWaalsContact C-N 3.35Å; D403-T405 PolarHBondContact O-N 3.31Å; D403-W406 PolarHBondContact O-N 3.32Å; D403-R407 WeakPolarHBondContact O-CB 3.49Å; D403-R407 PolarHBondContact O-N 2.8Å
404	F	96.9	Very high	87.3	Confident	1 Å²	1	45.8 Å²	45.8	0%	0.004	22%	0.219	C	C	.	.	H	α-helix	trans	-60.3	-45.2	175.2	-177.9	-112.5	0	0	0	112	M321 I329 F332 A340 I343 V344 E400 L401 W406 R407 L408	M321-F404 HydrophobicContact CE-CD1 4.24Å; M321-F404 HydrophobicContact CE-CE1 4.39Å; M321-F404 HydrophobicContact SD-CD1 4.14Å; M321-F404 HydrophobicContact SD-CE1 3.73Å; I329-F404 HydrophobicContact CB-CD1 4.21Å; I329-F404 HydrophobicContact CB-CE1 4.43Å; I329-F404 HydrophobicContact CD1-CD1 4.43Å; I329-F404 HydrophobicContact CD1-CE1 4.1Å; I329-F404 HydrophobicContact CG1-CD1 3.95Å; I329-F404 HydrophobicContact CG1-CE1 3.68Å; I329-F404 HydrophobicContact CG1-CZ 4.18Å; I329-F404 HydrophobicContact CG2-CB 3.9Å; I329-F404 HydrophobicContact CG2-CD1 3.46Å; I329-F404 VanDerWaalsContact CG2-CD1 3.46Å; I329-F404 HydrophobicContact CG2-CE1 4.13Å; I329-F404 HydrophobicContact CG2-CG 3.77Å; F332-F404 HydrophobicContact CB-CD2 3.82Å; F332-F404 HydrophobicContact CB-CE2 4.43Å; F332-F404 HydrophobicContact CD1-CB 4.2Å; F332-F404 AromaticContact CD1-CD2 3.51Å; F332-F404 HydrophobicContact CD1-CD2 3.51Å; F332-F404 HydrophobicContact CD1-CE2 4.38Å; F332-F404 HydrophobicContact CD1-CG 4.35Å; F332-F404 AromaticContact CD2-CD2 3.91Å; F332-F404 HydrophobicContact CD2-CD2 3.91Å; F332-F404 AromaticContact CD2-CE2 4Å; F332-F404 HydrophobicContact CD2-CE2 4Å; F332-F404 HydrophobicContact CE1-CD2 4.07Å; F332-F404 HydrophobicContact CE2-CD2 4.44Å; F332-F404 HydrophobicContact CE2-CE2 4.45Å; F332-F404 AromaticContact CG-CD2 3.42Å; F332-F404 HydrophobicContact CG-CD2 3.42Å; F332-F404 VanDerWaalsContact CG-CD2 3.42Å; F332-F404 AromaticContact CG-CE2 3.98Å; F332-F404 HydrophobicContact CG-CE2 3.98Å; F332-F404 HydrophobicContact CG-CG 4.43Å; A340-F404 HydrophobicContact CB-CE2 3.9Å; I343-F404 HydrophobicContact CB-CZ 4.3Å; I343-F404 HydrophobicContact CD1-CE2 4.13Å; I343-F404 HydrophobicContact CD1-CZ 4.46Å; I343-F404 HydrophobicContact CG2-CZ 3.9Å; V344-F404 HydrophobicContact CG1-CZ 4.49Å; E400-F404 PolarHBondContact O-N 3.09Å; E400-F404 VanDerWaalsContact O-N 3.11Å; L401-F404 PolarHBondContact O-N 3.41Å; F404-W406 PolarHBondContact O-N 2.94Å; F404-R407 WeakPolarHBondContact O-CB 3.24Å; F404-R407 PolarHBondContact O-N 3.43Å; F404-L408 HydrophobicContact CD1-CD1 4.03Å; F404-L408 HydrophobicContact CD1-CG 4.36Å; F404-L408 HydrophobicContact CE1-CD1 3.55Å; F404-L408 HydrophobicContact CE1-CD2 4.43Å; F404-L408 HydrophobicContact CE1-CG 4.05Å; F404-L408 HydrophobicContact CE2-CD2 4.35Å; F404-L408 HydrophobicContact CE2-CG 4.48Å; F404-L408 HydrophobicContact CZ-CD1 4Å; F404-L408 HydrophobicContact CZ-CD2 4.05Å; F404-L408 HydrophobicContact CZ-CG 4.13Å; F404-L408 WeakPolarHBondContact O-CG 3.47Å; F404-L408 PolarHBondContact O-N 3.01Å
405	T	95.3	Very high	88.5	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-65	-42	-179.8	-55.9	0	0	0	0	111.5	A378 F381 G382 L385 L401 N402 D403 R407 L408 I409	A378-T405 HydrophobicContact CB-CG2 4.18Å; F381-T405 HydrophobicContact CB-CG2 4.21Å; G382-T405 VanDerWaalsContact CA-OG1 3.31Å; G382-T405 WeakPolarHBondContact CA-OG1 3.46Å; L385-T405 HydrophobicContact CD1-CG2 4.13Å; L401-T405 WeakPolarHBondContact O-CB 3.34Å; L401-T405 PolarHBondContact O-N 3.13Å; L401-T405 PolarHBondContact O-OG1 3.06Å; N402-T405 PolarHBondContact O-N 3.47Å; D403-T405 VanDerWaalsContact C-N 3.35Å; D403-T405 PolarHBondContact O-N 3.31Å; T405-R407 VanDerWaalsContact C-N 3.31Å; T405-R407 PolarHBondContact O-N 3.41Å; T405-L408 PolarHBondContact O-N 3.34Å; T405-I409 HydrophobicContact CG2-CD1 3.98Å; T405-I409 WeakPolarHBondContact O-CG1 3.45Å; T405-I409 PolarHBondContact O-N 3.24Å
406	W	95	Very high	89.7	Confident	76 Å²	76	42.6 Å²	42.6	29%	0.288	20%	0.198	S	C	.	.	H	α-helix	trans	-57.3	-47	173.1	168.9	73.5	0	0	0	110.8	A378 N402 D403 F404 L408 I409 E410	A378-W406 HydrophobicContact CB-CB 3.66Å; N402-W406 VanDerWaalsContact O-CB 3.3Å; N402-W406 WeakPolarHBondContact O-CB 3.23Å; N402-W406 PolarHBondContact O-N 3.14Å; D403-W406 PolarHBondContact O-N 3.32Å; F404-W406 PolarHBondContact O-N 2.94Å; W406-L408 VanDerWaalsContact C-N 3.3Å; W406-L408 PolarHBondContact O-N 3.34Å; W406-I409 PolarHBondContact O-N 3.08Å; W406-E410 HydrophobicContact CZ2-CB 4.4Å; W406-E410 HydrophobicContact CZ2-CG 4.15Å; W406-E410 WeakPolarHBondContact O-CB 3.49Å; W406-E410 PolarHBondContact O-N 3.04Å
407	R	96.1	Very high	90.1	Very high	63 Å²	63	39.9 Å²	39.9	24%	0.238	20%	0.196	C	C	.	.	H	α-helix	trans	-57.3	-44	178.4	-175.8	64.2	66.1	167.5	-3.3	112.2	F332 N337 D403 F404 T405 N411 I415	F332-R407 HydrophobicContact CE1-CB 3.98Å; F332-R407 HydrophobicContact CE1-CG 3.79Å; F332-R407 HydrophobicContact CZ-CB 4.44Å; F332-R407 HydrophobicContact CZ-CG 3.76Å; N337-R407 VanDerWaalsContact OD1-CD 3.3Å; N337-R407 WeakPolarHBondContact OD1-CD 3.3Å; N337-R407 PolarHBondContact OD1-NH1 3.21Å; D403-R407 WeakPolarHBondContact O-CB 3.49Å; D403-R407 PolarHBondContact O-N 2.8Å; F404-R407 WeakPolarHBondContact O-CB 3.24Å; F404-R407 PolarHBondContact O-N 3.43Å; T405-R407 VanDerWaalsContact C-N 3.31Å; T405-R407 PolarHBondContact O-N 3.41Å; R407-N411 WeakPolarHBondContact CD-ND2 3.46Å; R407-N411 WeakPolarHBondContact O-CB 3.25Å; R407-N411 PolarHBondContact O-N 3.03Å; R407-N411 PolarHBondContact O-ND2 2.91Å; R407-N411 VanDerWaalsContact O-ND2 3.11Å; R407-I415 HydrophobicContact CG-CD1 4.48Å
408	L	96.4	Very high	89.6	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-63.2	-43.3	177.2	-69.6	-174.1	0	0	0	112.4	M321 A340 V344 L355 L359 F404 T405 W406 A412 I415	M321-L408 HydrophobicContact SD-CD1 3.91Å; A340-L408 HydrophobicContact CB-CD2 4.3Å; V344-L408 HydrophobicContact CG1-CD1 4.36Å; V344-L408 HydrophobicContact CG1-CD2 3.75Å; L355-L408 HydrophobicContact CD2-CD1 4.3Å; L359-L408 HydrophobicContact CD1-CB 3.79Å; L359-L408 HydrophobicContact CD1-CD1 4.25Å; L359-L408 HydrophobicContact CD2-CB 4.47Å; F404-L408 HydrophobicContact CD1-CD1 4.03Å; F404-L408 HydrophobicContact CD1-CG 4.36Å; F404-L408 HydrophobicContact CE1-CD1 3.55Å; F404-L408 HydrophobicContact CE1-CD2 4.43Å; F404-L408 HydrophobicContact CE1-CG 4.05Å; F404-L408 HydrophobicContact CE2-CD2 4.35Å; F404-L408 HydrophobicContact CE2-CG 4.48Å; F404-L408 HydrophobicContact CZ-CD1 4Å; F404-L408 HydrophobicContact CZ-CD2 4.05Å; F404-L408 HydrophobicContact CZ-CG 4.13Å; F404-L408 WeakPolarHBondContact O-CG 3.47Å; F404-L408 PolarHBondContact O-N 3.01Å; T405-L408 PolarHBondContact O-N 3.34Å; W406-L408 VanDerWaalsContact C-N 3.3Å; W406-L408 PolarHBondContact O-N 3.34Å; L408-A412 WeakPolarHBondContact O-CA 3.29Å; L408-A412 WeakPolarHBondContact O-CB 3.47Å; L408-A412 PolarHBondContact O-N 2.94Å; L408-A412 VanDerWaalsContact O-N 3.15Å; L408-I415 HydrophobicContact CD2-CD1 3.94Å; L408-I415 HydrophobicContact CD2-CG2 4.09Å
409	I	95.1	Very high	89.1	Confident	27 Å²	27	43.9 Å²	43.9	14%	0.138	23%	0.227	C	C	.	.	H	α-helix	trans	-66	-48.5	179.6	-66.7	165.5	0	0	0	110.4	L359 A364 A374 L377 A378 T405 W406 N411	L359-I409 HydrophobicContact CD2-CG1 3.58Å; A364-I409 HydrophobicContact CB-CG2 4.03Å; A374-I409 HydrophobicContact CB-CB 4.26Å; A374-I409 HydrophobicContact CB-CG2 3.68Å; L377-I409 HydrophobicContact CB-CD1 3.86Å; A378-I409 HydrophobicContact CB-CD1 4.32Å; T405-I409 HydrophobicContact CG2-CD1 3.98Å; T405-I409 WeakPolarHBondContact O-CG1 3.45Å; T405-I409 PolarHBondContact O-N 3.24Å; W406-I409 PolarHBondContact O-N 3.08Å; I409-N411 PolarHBondContact O-N 3.24Å
410	E	94.1	Very high	88.3	Confident	112 Å²	112	42.8 Å²	42.8	52%	0.523	22%	0.221	S	C	.	.	H	α-helix	trans	-68.4	-34.4	-175.2	-169.1	68.1	-166.4	0	0	112.4	A374 W406	A374-E410 HydrophobicContact CB-CB 4.41Å; A374-E410 WeakPolarHBondContact CB-OE2 3.46Å; W406-E410 HydrophobicContact CZ2-CB 4.4Å; W406-E410 HydrophobicContact CZ2-CG 4.15Å; W406-E410 WeakPolarHBondContact O-CB 3.49Å; W406-E410 PolarHBondContact O-N 3.04Å
411	N	93.8	Very high	86.8	Confident	35 Å²	35	44 Å²	44	19%	0.187	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.4	25.7	-172.4	-57.2	-95.7	0	0	0	112.8	N337 R407 I409 V413 E414 I415	N337-N411 VanDerWaalsContact ND2-CG 3.34Å; N337-N411 PolarHBondContact ND2-OD1 3.32Å; R407-N411 WeakPolarHBondContact CD-ND2 3.46Å; R407-N411 WeakPolarHBondContact O-CB 3.25Å; R407-N411 PolarHBondContact O-N 3.03Å; R407-N411 PolarHBondContact O-ND2 2.91Å; R407-N411 VanDerWaalsContact O-ND2 3.11Å; I409-N411 PolarHBondContact O-N 3.24Å; N411-V413 VanDerWaalsContact C-N 3.26Å; N411-V413 PolarHBondContact O-N 3.46Å; N411-V413 VanDerWaalsContact O-N 3.16Å; N411-E414 PolarHBondContact O-N 2.69Å; N411-I415 HydrophobicContact CB-CD1 3.84Å; N411-I415 HydrophobicContact CB-CG1 4.18Å; N411-I415 WeakPolarHBondContact O-CB 3.19Å; N411-I415 WeakPolarHBondContact O-CG1 3.45Å; N411-I415 PolarHBondContact O-N 3.35Å
412	A	93.4	Very high	84.6	Confident	10 Å²	10	53.6 Å²	53.6	8%	0.083	27%	0.274	C	S	.	.	H	α-helix	trans	-54.6	-38.6	-173.6	0	0	0	0	0	113.4	L359 L408 F416	L359-A412 HydrophobicContact CB-CB 4.25Å; L408-A412 WeakPolarHBondContact O-CA 3.29Å; L408-A412 WeakPolarHBondContact O-CB 3.47Å; L408-A412 PolarHBondContact O-N 2.94Å; L408-A412 VanDerWaalsContact O-N 3.15Å; A412-F416 WeakPolarHBondContact O-CB 3.13Å; A412-F416 WeakPolarHBondContact O-CD2 3.07Å; A412-F416 PolarHBondContact O-N 3.48Å
413	V	90.1	Very high	82.4	Confident	68 Å²	68	57.7 Å²	57.7	41%	0.412	30%	0.299	S	S	.	.	H	α-helix	trans	-62.3	-48.2	-179.4	-171.9	0	0	0	0	111.9	N411 N417 S418 L420	N411-V413 VanDerWaalsContact C-N 3.26Å; N411-V413 PolarHBondContact O-N 3.46Å; N411-V413 VanDerWaalsContact O-N 3.16Å; V413-N417 PolarHBondContact O-N 3.16Å; V413-S418 PolarHBondContact O-N 2.79Å; V413-L420 HydrophobicContact CG2-CD1 3.53Å; V413-L420 HydrophobicContact CG2-CD2 3.74Å; V413-L420 HydrophobicContact CG2-CG 3.47Å; V413-L420 VanDerWaalsContact CG2-CG 3.47Å
414	E	92	Very high	79.7	Confident	105 Å²	105	62.4 Å²	62.4	49%	0.491	32%	0.324	S	S	.	.	H	α-helix	trans	-69	-45.1	-178.7	-173.5	-164.8	148.8	0	0	111.1	N337 N411	N337-E414 VanDerWaalsContact CB-OE1 3.26Å; N337-E414 WeakPolarHBondContact CB-OE1 3.5Å; N337-E414 PolarHBondContact ND2-OE2 2.96Å; N411-E414 PolarHBondContact O-N 2.69Å
415	I	93.9	Very high	76.7	Confident	1 Å²	1	68.9 Å²	68.9	1%	0.005	36%	0.355	C	S	.	.	H	α-helix	trans	-67.9	-41.8	-174.9	-68.2	174.8	0	0	0	110.6	N337 A340 K341 V344 R407 L408 N411	N337-I415 HydrophobicContact CB-CG1 4.49Å; A340-I415 HydrophobicContact CB-CD1 3.89Å; K341-I415 HydrophobicContact CB-CG2 4.41Å; K341-I415 WeakPolarHBondContact CG-O 3.3Å; V344-I415 HydrophobicContact CG2-CG2 3.57Å; R407-I415 HydrophobicContact CG-CD1 4.48Å; L408-I415 HydrophobicContact CD2-CD1 3.94Å; L408-I415 HydrophobicContact CD2-CG2 4.09Å; N411-I415 HydrophobicContact CB-CD1 3.84Å; N411-I415 HydrophobicContact CB-CG1 4.18Å; N411-I415 WeakPolarHBondContact O-CB 3.19Å; N411-I415 WeakPolarHBondContact O-CG1 3.45Å; N411-I415 PolarHBondContact O-N 3.35Å
416	F	90.9	Very high	73.8	Confident	6 Å²	6	75.2 Å²	75.2	3%	0.026	39%	0.393	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.1	8.5	-177.7	-67.2	-87.3	0	0	0	114.7	V344 Y352 L355 K356 L359 A412 S418	V344-F416 HydrophobicContact CB-CE1 4.29Å; V344-F416 HydrophobicContact CB-CZ 4.25Å; V344-F416 HydrophobicContact CG1-CZ 4.1Å; V344-F416 HydrophobicContact CG2-CE1 4.25Å; V344-F416 HydrophobicContact CG2-CZ 4.29Å; Y352-F416 HydrophobicContact CD2-CD1 4.48Å; Y352-F416 HydrophobicContact CD2-CE1 4.15Å; Y352-F416 HydrophobicContact CE1-CD1 4.4Å; Y352-F416 AromaticContact CE2-CD1 3.71Å; Y352-F416 HydrophobicContact CE2-CD1 3.71Å; Y352-F416 AromaticContact CE2-CE1 3.76Å; Y352-F416 HydrophobicContact CE2-CE1 3.76Å; Y352-F416 AromaticContact CZ-CD1 3.66Å; L355-F416 HydrophobicContact CD2-CZ 4.05Å; L355-F416 HydrophobicContact CG-CZ 4.02Å; K356-F416 HydrophobicContact CB-CD1 3.58Å; K356-F416 HydrophobicContact CB-CE1 3.77Å; K356-F416 HydrophobicContact CB-CG 4.29Å; K356-F416 HydrophobicContact CD-CB 4.15Å; K356-F416 HydrophobicContact CD-CD1 3.96Å; K356-F416 HydrophobicContact CD-CG 4.39Å; K356-F416 HydrophobicContact CG-CB 4.11Å; K356-F416 HydrophobicContact CG-CD1 3.7Å; K356-F416 HydrophobicContact CG-CE1 4.38Å; K356-F416 HydrophobicContact CG-CG 4.01Å; K356-F416 PolarHBondContact NZ-O 3.13Å; L359-F416 HydrophobicContact CD1-CD2 4.49Å; L359-F416 HydrophobicContact CD1-CE2 3.42Å; L359-F416 VanDerWaalsContact CD1-CE2 3.42Å; L359-F416 HydrophobicContact CD1-CZ 3.72Å; A412-F416 WeakPolarHBondContact O-CB 3.13Å; A412-F416 WeakPolarHBondContact O-CD2 3.07Å; A412-F416 PolarHBondContact O-N 3.48Å; F416-S418 WeakPolarHBondContact O-CB 3.39Å; F416-S418 PolarHBondContact O-N 3.49Å; F416-S418 VanDerWaalsContact O-N 3.1Å
417	N	83	Confident	70.9	Confident	120 Å²	120	74.5 Å²	74.5	64%	0.642	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.4	38.9	174.5	-85.5	-20.5	0	0	0	113.9	K341 V413	K341-N417 WeakPolarHBondContact CE-ND2 3.44Å; K341-N417 PolarHBondContact NZ-ND2 3.02Å; K341-N417 PolarHBondContact NZ-OD1 2.81Å; V413-N417 PolarHBondContact O-N 3.16Å
418	S	68.3	Low	67.9	Low	29 Å²	29	77.3 Å²	77.3	20%	0.203	43%	0.428	C	S	.	.	S	Bend	trans	-149.2	124.6	-170	-172.2	0	0	0	0	109.4	K356 R360 V413 F416	K356-S418 VanDerWaalsContact NZ-CB 3.31Å; K356-S418 PolarHBondContact NZ-OG 3.04Å; R360-S418 PolarHBondContact NH1-OG 3.34Å; V413-S418 PolarHBondContact O-N 2.79Å; F416-S418 WeakPolarHBondContact O-CB 3.39Å; F416-S418 PolarHBondContact O-N 3.49Å; F416-S418 VanDerWaalsContact O-N 3.1Å
419	P	67.1	Low	64.9	Low	106 Å²	106	86.1 Å²	86.1	69%	0.688	47%	0.467	S	S	*	.			trans	-56.5	144.1	174.7	22	-30.3	0	0	0	109.7	R360	R360-P419 VanDerWaalsContact CZ-O 3.22Å; R360-P419 PolarHBondContact NH1-O 3.21Å; R360-P419 PolarHBondContact NH2-O 3.2Å
420	L	60	Low	61.9	Low	57 Å²	57	93.3 Å²	93.3	30%	0.298	50%	0.5	S	S	.	.			trans	-59.6	147.5	175.7	-61.8	167.3	0	0	0	108.6	Q362 V413 E422	Q362-L420 HydrophobicContact CG-CD1 4.42Å; Q362-L420 HydrophobicContact CG-CD2 4.15Å; V413-L420 HydrophobicContact CG2-CD1 3.53Å; V413-L420 HydrophobicContact CG2-CD2 3.74Å; V413-L420 HydrophobicContact CG2-CG 3.47Å; V413-L420 VanDerWaalsContact CG2-CG 3.47Å; L420-E422 PolarHBondContact O-N 3.44Å
421	D	56.8	Low	59	Low	62 Å²	62	93 Å²	93	33%	0.332	51%	0.51	S	S	.	.			trans	-63.3	104.3	177.1	-68.3	-49.9	0	0	0	108.2	R262 R360 T423	R262-D421 IonicContact NH2-OD2 3.81Å; R360-D421 IonicContact CZ-OD1 3.31Å; R360-D421 IonicContact CZ-OD2 3.71Å; R360-D421 IonicContact NE-OD1 3.29Å; R360-D421 IonicContact NE-OD2 2.68Å; R360-D421 PolarHBondContact NE-OD2 3.21Å; R360-D421 IonicContact NH2-OD1 3.13Å; R360-D421 PolarHBondContact NH2-OD1 3.42Å; R360-D421 IonicContact NH2-OD2 3.61Å; R360-D421 PolarHBondContact NH2-OD2 3.18Å; D421-T423 PolarHBondContact O-N 2.84Å
422	E	41.4	Very low	56.1	Low	200 Å²	200	97.4 Å²	97.4	94%	0.935	54%	0.539	S	S	*	.			trans	-69.1	70.2	165.4	-71	-172.9	-175.9	0	0	108.6	L420	L420-E422 PolarHBondContact O-N 3.44Å
423	T	40.2	Very low	53.3	Low	98 Å²	98	101.7 Å²	101.7	60%	0.601	57%	0.568	S	S	*	*			trans	-122.6	110.5	174.7	43.8	0	0	0	0	109.6	D421	D421-T423 PolarHBondContact O-N 2.84Å
424	N	34.8	Very low	50.6	Low	134 Å²	134	106.5 Å²	106.5	72%	0.717	59%	0.59	S	S	*	*	S	Bend	trans	85.4	34.4	159.9	-59.8	-11.8	0	0	0	120	T426	N424-T426 VanDerWaalsContact C-N 3.26Å
425	Q	33.9	Very low	47.8	Very low	137 Å²	137	110.5 Å²	110.5	64%	0.64	61%	0.609	S	S	*	*	G	3₁₀ helix	trans	-74.1	-12.6	158.9	-75.1	-171.1	-1	0	0	113.8	G427	Q425-G427 PolarHBondContact O-N 3.5Å
426	T	33.9	Very low	45	Very low	133 Å²	133	121.5 Å²	121.5	82%	0.816	65%	0.651	S	S	*	*	G	3₁₀ helix	trans	-85.7	1.6	-177	48.5	0	0	0	0	115.5	N424	N424-T426 VanDerWaalsContact C-N 3.26Å
427	G	33.8	Very low	42.4	Very low	61 Å²	61	128.8 Å²	128.8	63%	0.629	69%	0.69	S	S	*	*	G	3₁₀ helix	trans	-100.4	-10.5	-175.6	0	0	0	0	0	117.1	Q425	Q425-G427 PolarHBondContact O-N 3.5Å
428	I	33.3	Very low	40.4	Very low	123 Å²	123	130.3 Å²	130.3	63%	0.631	70%	0.703	S	S	*	*	S	Bend	trans	-104.4	-14.3	-167.2	-61.1	178.6	0	0	0	113.3
429	F	32.5	Very low	39	Very low	184 Å²	184	134 Å²	134	81%	0.807	73%	0.729	S	S	*	*	S	Bend	trans	-96.2	1.3	-176.7	-82.4	-76.6	0	0	0	116.2
430	E	32.7	Very low	37.4	Very low	179 Å²	179	136.6 Å²	136.6	84%	0.836	74%	0.735	S	S	*	*	S	Bend	trans	-108.4	9.9	-172.4	-127.1	172.2	-159.7	0	0	116.4
431	S	33	Very low	36.8	Very low	105 Å²	105	142.1 Å²	142.1	73%	0.734	79%	0.789	S	S	*	*	S	Bend	trans	-110.3	11.7	-179.6	64.7	0	0	0	0	116.7
432	T	33.9	Very low	35.8	Very low	128 Å²	128	146.1 Å²	146.1	79%	0.785	81%	0.812	S	S	*	*	S	Bend	trans	-112.3	11.7	179.5	52.6	0	0	0	0	115.8
433	S	34.4	Very low	35.5	Very low	100 Å²	100	143.3 Å²	143.3	70%	0.699	81%	0.805	S	S	*	*	S	Bend	trans	-114.1	5	-172.5	-47	0	0	0	0	116.5
434	L	33.2	Very low	35.3	Very low	168 Å²	168	145.8 Å²	145.8	88%	0.88	82%	0.817	S	S	*	*			trans	-127.7	52.8	-174.1	-72.5	167.9	0	0	0	113.5
435	E	32.7	Very low	35.3	Very low	189 Å²	189	146.5 Å²	146.5	88%	0.883	82%	0.823	S	S	*	*			trans	-145.2	58.5	162.5	-77.2	-167.7	157.7	0	0	111.2
436	R	35.3	Very low	35.4	Very low	233 Å²	233	147.1 Å²	147.1	88%	0.879	83%	0.834	S	S	*	*			trans	-149.1	100.8	155.8	-66.8	-170.1	-165.1	136.7	6.8	106.9
437	D	35.6	Very low	35.5	Very low	159 Å²	159	148 Å²	148	85%	0.85	84%	0.835	S	S	*	*			trans	174.3	73.3	150	-84.3	-16.4	0	0	0	109
438	V	41.2	Very low	35.6	Very low	151 Å²	151	154.2 Å²	154.2	92%	0.915	85%	0.85	S	S	*	*			trans	-130.5	73.8	153.3	-172.3	0	0	0	0	106.4
439	S	38.5	Very low	35.8	Very low	107 Å²	107	156.6 Å²	156.6	75%	0.748	87%	0.867	S	S	*	*			trans	-93.9	104.4	168.5	177.6	0	0	0	0	108.7
440	I	34.6	Very low	36.1	Very low	160 Å²	160	154.3 Å²	154.3	82%	0.821	87%	0.872	S	S	*	*			trans	25.7	108.6	138.3	-51.7	172.5	0	0	0	115.7
441	A	47.9	Very low	36.4	Very low	173 Å²	173	152.1 Å²	152.1	100%	1.43	88%	0.875	S	S	*	*			trans	-132.2	0	145.1	0	0	0	0	0	108.2

Retrieved 441 of 441 residues in 88.2 ms (Link to these results)

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