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7-dehydrocholesterol reductase

Catalyzes the last step of the cholesterol synthesis pathway, which transforms cholesta-5,7-dien-3beta-ol (7-dehydrocholesterol,7-DHC) into cholesterol by reducing the C7-C8 double bond of its sterol core. Can also metabolize cholesta-5,7,24-trien-3beta-ol (7-dehydrodemosterol, 7-DHD) to desmosterol, which is then metabolized by the Delta(24)-sterol reductase (DHCR24) to cholesterol. Modulates ferroptosis (a form of regulated cell death driven by iron-dependent lipid peroxidation) through the metabolic breakdown of the anti-ferroptotic metabolites 7-DHC and 7-DHD which, when accumulated, divert the propagation of peroxyl radical-mediated damage from phospholipid components to its sterol core, protecting plasma and mitochondrial membranes from phospholipid autoxidation. Component of the microsomal antiestrogen binding site (AEBS), a multiproteic complex at the ER membrane that consists of an association between cholestenol Delta-isomerase/EBP and DHCR7. This complex is responsible for cholesterol-5,6-epoxide hydrolase (ChEH) activity, which consists in the hydration of cholesterol-5,6-epoxides (5,6-EC) into cholestane-3beta,5alpha,6beta-triol (CT). The precise role of each component of this complex has not been described yet. Oxidoreductase that catalyzes the last step of the cholesterol synthesis pathway, which transforms cholesta-5,7-dien-3beta-ol (7-dehydrocholesterol,7-DHC) into cholesterol by reducing the C7-C8 double bond of its sterol core. Can also metabolize cholesta-5,7,24-trien-3beta-ol (7-dehydrodemosterol, 7-DHD) to desmosterol, which is then metabolized by the Delta(24)-sterol reductase (DHCR24) to cholesterol. Modulates ferroptosis (a form of regulated cell death driven by iron-dependent lipid peroxidation) through the metabolic breakdown of the anti-ferroptotic metabolites 7-DHC and 7-DHD which, when accumulated, divert the propagation of peroxyl radical-mediated damage from phospholipid components to its sterol core, protecting plasma and mitochondrial membranes from phospholipid autoxidation.

AlphaFold DB , UniProt , Accession A0A096MM67, Species PAPAN (Papio anubis, Olive baboon), Gene DHCR7, Length 475 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.7	Very low	31.5	Very low	244 Å²	244	153.1 Å²	153.1	100%	1.202	86%	0.862	S	S	*	*				0	86.7	0	-64.8	-177.7	-122.9	0	0	106.7
2	A	29.6	Very low	31.2	Very low	104 Å²	104	148.5 Å²	148.5	86%	0.86	86%	0.858	S	S	*	*				58.6	99.3	72.3	0	0	0	0	0	113.7
3	A	29.6	Very low	31.2	Very low	98 Å²	98	152.1 Å²	152.1	81%	0.81	86%	0.857	S	S	*	*			trans	-175.5	87.9	142.1	0	0	0	0	0	107.9
4	K	29.2	Very low	30.9	Very low	210 Å²	210	146.9 Å²	146.9	91%	0.913	84%	0.835	S	S	*	*				72	105.1	93.9	-81.6	-172.2	176.9	179.3	0	114.5
5	S	34.4	Very low	30.8	Very low	116 Å²	116	146.8 Å²	146.8	81%	0.811	83%	0.83	S	S	*	*			trans	-64.9	142	159.3	52	0	0	0	0	112.6
6	Q	31.7	Very low	30.6	Very low	189 Å²	189	145.5 Å²	145.5	88%	0.883	82%	0.82	S	S	*	*			trans	-140.5	157.9	161.4	-93.3	-160.4	-5.9	0	0	111.2
7	P	32.2	Very low	30.5	Very low	109 Å²	109	141.5 Å²	141.5	71%	0.708	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-96.9	158.7	-137.4	35.7	-34.4	0	0	0	115.3	V9	P7-V9 PolarHBondContact O-N 2.76Å
8	N	31.7	Very low	30.5	Very low	168 Å²	168	139.7 Å²	139.7	90%	0.898	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-55.7	116.8	171.3	-84.3	-27.3	0	0	0	111.7
9	V	30.9	Very low	30.3	Very low	127 Å²	127	137.4 Å²	137.4	77%	0.77	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-75	126.3	166.8	178.1	0	0	0	0	108.4	P7 K11	P7-V9 PolarHBondContact O-N 2.76Å; V9-K11 PolarHBondContact O-N 2.76Å
10	P	30.8	Very low	30.1	Very low	114 Å²	114	136.5 Å²	136.5	74%	0.74	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-70.1	122.1	174.8	27.6	-30.5	0	0	0	109.3	A12	P10-A12 PolarHBondContact O-N 2.87Å; P10-A12 VanDerWaalsContact O-N 3.12Å
11	K	30.1	Very low	30.2	Very low	205 Å²	205	136.1 Å²	136.1	89%	0.891	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-57.1	117.2	170.2	-81.4	-178.2	175.6	179	0	108.8	V9 K13	V9-K11 PolarHBondContact O-N 2.76Å; K11-K13 PolarHBondContact O-N 3.43Å
12	A	27.8	Very low	29.8	Very low	98 Å²	98	134.4 Å²	134.4	81%	0.81	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-54.9	121.8	170.1	0	0	0	0	0	109.2	P10 S14	P10-A12 PolarHBondContact O-N 2.87Å; P10-A12 VanDerWaalsContact O-N 3.12Å; A12-S14 PolarHBondContact O-N 2.67Å
13	K	31.2	Very low	29.8	Very low	195 Å²	195	134.1 Å²	134.1	85%	0.848	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-60.5	125.6	167.1	-79.7	-179.7	174.5	179.9	0	107.6	K11 I15	K11-K13 PolarHBondContact O-N 3.43Å; K13-I15 PolarHBondContact O-N 3.38Å
14	S	26.9	Very low	29.9	Very low	79 Å²	79	131.8 Å²	131.8	55%	0.552	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-58.1	129.2	171.6	55.7	0	0	0	0	109.7	A12 D16 S17	A12-S14 PolarHBondContact O-N 2.67Å; S14-D16 PolarHBondContact O-N 2.87Å; S14-S17 PolarHBondContact O-OG 3.38Å
15	I	29.5	Very low	30.4	Very low	146 Å²	146	124.8 Å²	124.8	75%	0.749	70%	0.699	S	S	*	*	G	3₁₀ helix	trans	-70	-8	-179.9	-70	170.7	0	0	0	111.3	K13 S17	K13-I15 PolarHBondContact O-N 3.38Å; I15-S17 VanDerWaalsContact C-N 3.33Å; I15-S17 PolarHBondContact O-N 3.49Å
16	D	27.5	Very low	30.6	Very low	126 Å²	126	126.8 Å²	126.8	67%	0.674	70%	0.696	S	S	*	*	G	3₁₀ helix	trans	-81.2	-2.9	-178	-59.8	-38.2	0	0	0	115.1	S14	S14-D16 PolarHBondContact O-N 2.87Å
17	S	28.6	Very low	31.1	Very low	78 Å²	78	119.1 Å²	119.1	55%	0.545	67%	0.668	S	S	.	*	G	3₁₀ helix	trans	-88.1	-8.6	176.9	58.6	0	0	0	0	114.3	S14 I15	S14-S17 PolarHBondContact O-OG 3.38Å; I15-S17 VanDerWaalsContact C-N 3.33Å; I15-S17 PolarHBondContact O-N 3.49Å
18	V	30.3	Very low	32.2	Very low	108 Å²	108	121.6 Å²	121.6	66%	0.655	67%	0.67	S	S	*	*	S	Bend	trans	-97.4	-15.7	-174.5	-177.7	0	0	0	0	112.6
19	T	26.9	Very low	33.6	Very low	96 Å²	96	116.5 Å²	116.5	59%	0.589	64%	0.638	S	S	*	*	S	Bend	trans	-91.2	-19.8	-178.7	37.2	0	0	0	0	114.2
20	N	27.4	Very low	35	Very low	119 Å²	119	112.9 Å²	112.9	64%	0.636	63%	0.626	S	S	*	*	H	α-helix	trans	-82.6	-18.9	179.5	-90.4	-9.4	0	0	0	115	T23 A24	N20-T23 PolarHBondContact O-OG1 3.35Å; N20-A24 PolarHBondContact O-N 3.16Å
21	D	31.2	Very low	37	Very low	130 Å²	130	108.2 Å²	108.2	70%	0.695	59%	0.594	S	S	*	*	H	α-helix	trans	-77.5	-21.1	178.4	-99.1	-15.8	0	0	0	113.2
22	R	28.3	Very low	38.7	Very low	208 Å²	208	100.3 Å²	100.3	79%	0.785	57%	0.567	S	S	*	*	H	α-helix	trans	-81.5	-27.2	178.6	-79.1	-174	174.8	-177.7	-0.6	113.6	S25	R22-S25 PolarHBondContact O-OG 3.34Å
23	T	29.6	Very low	40.5	Very low	97 Å²	97	100.7 Å²	100.7	60%	0.595	55%	0.548	S	S	*	.	H	α-helix	trans	-81.6	-28.2	173.9	40.2	0	0	0	0	112	N20 S25	N20-T23 PolarHBondContact O-OG1 3.35Å; T23-S25 VanDerWaalsContact C-N 3.34Å; T23-S25 PolarHBondContact O-N 3.38Å
24	A	32.6	Very low	42.4	Very low	49 Å²	49	99.6 Å²	99.6	41%	0.405	55%	0.545	S	S	.	.	H	α-helix	trans	-68.9	-26.2	175.1	0	0	0	0	0	113.9	N20	N20-A24 PolarHBondContact O-N 3.16Å
25	S	38.4	Very low	44.9	Very low	64 Å²	64	97.4 Å²	97.4	45%	0.448	53%	0.529	S	S	.	.	G	3₁₀ helix	trans	-84.6	-21.2	-175.4	77.6	0	0	0	0	114.9	R22 T23 G27	R22-S25 PolarHBondContact O-OG 3.34Å; T23-S25 VanDerWaalsContact C-N 3.34Å; T23-S25 PolarHBondContact O-N 3.38Å; S25-G27 PolarHBondContact O-N 2.91Å; S25-G27 VanDerWaalsContact O-N 3.17Å
26	Q	39.7	Very low	47.6	Very low	157 Å²	157	94.1 Å²	94.1	73%	0.734	51%	0.513	S	S	*	.	G	3₁₀ helix	trans	-71.9	-6.5	178.1	-80.1	-176.8	-27.7	0	0	113.4
27	G	41.9	Very low	50.4	Low	29 Å²	29	98.9 Å²	98.9	30%	0.299	52%	0.521	S	S	.	.	G	3₁₀ helix	trans	-120.9	18.4	-165.3	0	0	0	0	0	117.3	S25 W33	S25-G27 PolarHBondContact O-N 2.91Å; S25-G27 VanDerWaalsContact O-N 3.17Å; G27-W33 VanDerWaalsContact CA-CH2 3.45Å; G27-W33 WeakPolarHBondContact O-CH2 3.29Å; G27-W33 WeakPolarHBondContact O-CZ2 3.48Å; G27-W33 WeakPolarHBondContact O-CZ3 3.28Å; G27-W33 PolarHBondContact O-NE1 3.4Å
28	Q	54.6	Low	53.1	Low	161 Å²	161	103 Å²	103	75%	0.752	53%	0.53	S	S	*	.			trans	-124.9	-0.1	-171.6	-66.1	-168.3	-9	0	0	119.1	W33	Q28-W33 VanDerWaalsContact N-CZ2 3.27Å
29	W	60.5	Low	55.7	Low	60 Å²	60	99.5 Å²	99.5	23%	0.227	51%	0.51	C	S	.	.	S	Bend	trans	-103.9	142.5	177.6	66	-90.8	0	0	0	115.4	W33 P136 K210 F225 H301	W29-W33 VanDerWaalsContact N-CH2 3.3Å; W29-W33 VanDerWaalsContact O-CH2 3.25Å; W29-W33 WeakPolarHBondContact O-CH2 3.32Å; W29-W33 WeakPolarHBondContact O-CZ2 3.36Å; W29-P136 HydrophobicContact CB-CB 4.37Å; W29-P136 HydrophobicContact CB-CG 4.48Å; W29-P136 HydrophobicContact CD2-CB 3.18Å; W29-P136 HydrophobicContact CD2-CG 3.53Å; W29-P136 HydrophobicContact CE3-CB 3.46Å; W29-P136 VanDerWaalsContact CE3-CB 3.46Å; W29-P136 HydrophobicContact CE3-CG 3.23Å; W29-P136 HydrophobicContact CG-CB 3.68Å; W29-P136 HydrophobicContact CG-CG 4.15Å; W29-P136 HydrophobicContact CH2-CB 3.76Å; W29-P136 HydrophobicContact CH2-CG 3.97Å; W29-P136 HydrophobicContact CZ2-CB 3.59Å; W29-P136 HydrophobicContact CZ2-CG 4.29Å; W29-P136 HydrophobicContact CZ3-CB 3.7Å; W29-P136 HydrophobicContact CZ3-CG 3.44Å; W29-P136 VanDerWaalsContact CZ3-CG 3.44Å; W29-K210 VanDerWaalsContact CZ3-CE 3.41Å; W29-K210 WeakPolarHBondContact O-CE 3.14Å; W29-K210 PolarHBondContact O-NZ 2.93Å; W29-F225 HydrophobicContact CZ3-CD2 4.36Å; W29-F225 HydrophobicContact CZ3-CG 4.32Å; W29-H301 AromaticContact CZ3-CE1 3.76Å; W29-H301 AromaticContact CZ3-NE2 3.95Å
30	G	61.4	Low	58.7	Low	51 Å²	51	96.1 Å²	96.1	53%	0.526	49%	0.488	S	S	.	.	S	Bend	trans	89.4	-135.3	169.4	0	0	0	0	0	115.4
31	R	71.9	Confident	61.7	Low	16 Å²	16	92.4 Å²	92.4	6%	0.06	48%	0.478	C	S	.	.	S	Bend	trans	-72.8	166.4	-177.4	53.3	177.5	-83.6	-174.9	-12.3	113	K210 T212 Y217 N218 G222	R31-K210 HydrophobicContact CG-CD 4.32Å; R31-T212 VanDerWaalsContact NH2-CG2 3.26Å; R31-T212 PolarHBondContact NH2-OG1 3.44Å; R31-Y217 VanDerWaalsContact CZ-CE1 3.46Å; R31-Y217 VanDerWaalsContact NE-CE1 3.31Å; R31-N218 PolarHBondContact NH2-OD1 2.92Å; R31-G222 PolarHBondContact NH1-O 2.9Å
32	A	66.9	Low	64.4	Low	39 Å²	39	88.2 Å²	88.2	32%	0.322	46%	0.459	S	S	.	.			trans	-63.1	149.8	-179.7	0	0	0	0	0	111.9	T212 Y217	A32-T212 WeakPolarHBondContact O-CG2 3.21Å; A32-Y217 HydrophobicContact CB-CE2 4.5Å; A32-Y217 VanDerWaalsContact CB-OH 3.27Å; A32-Y217 WeakPolarHBondContact CB-OH 3.27Å; A32-Y217 PolarHBondContact N-OH 3.25Å
33	W	65.2	Low	67.5	Low	106 Å²	106	78.9 Å²	78.9	40%	0.402	43%	0.425	S	S	.	.	S	Bend	trans	-99	-42.3	-173.6	-42.4	85.1	0	0	0	111.1	G27 Q28 W29 K210	G27-W33 VanDerWaalsContact CA-CH2 3.45Å; G27-W33 WeakPolarHBondContact O-CH2 3.29Å; G27-W33 WeakPolarHBondContact O-CZ2 3.48Å; G27-W33 WeakPolarHBondContact O-CZ3 3.28Å; G27-W33 PolarHBondContact O-NE1 3.4Å; Q28-W33 VanDerWaalsContact N-CZ2 3.27Å; W29-W33 VanDerWaalsContact N-CH2 3.3Å; W29-W33 VanDerWaalsContact O-CH2 3.25Å; W29-W33 WeakPolarHBondContact O-CH2 3.32Å; W29-W33 WeakPolarHBondContact O-CZ2 3.36Å; W33-K210 HydrophobicContact CH2-CD 4.36Å; W33-K210 HydrophobicContact CZ3-CD 4.27Å
34	E	71.1	Confident	70.4	Confident	172 Å²	172	77.1 Å²	77.1	80%	0.804	41%	0.411	S	S	*	.	S	Bend	trans	-104.9	134.8	171.9	-64.7	-176.6	175.3	0	0	108
35	V	80.1	Confident	73.3	Confident	33 Å²	33	80.9 Å²	80.9	20%	0.2	42%	0.418	C	S	.	.			trans	-104.6	102.5	178.9	-174.7	0	0	0	0	106.8	L40 N214 Y217	V35-L40 HydrophobicContact CG1-CB 3.99Å; V35-N214 HydrophobicContact CB-CB 4.31Å; V35-N214 HydrophobicContact CG2-CB 4Å; V35-Y217 HydrophobicContact CB-CD2 4.32Å; V35-Y217 HydrophobicContact CB-CG 4.37Å; V35-Y217 HydrophobicContact CG1-CD2 3.71Å; V35-Y217 HydrophobicContact CG1-CG 4.03Å; V35-Y217 HydrophobicContact CG2-CD1 3.55Å; V35-Y217 HydrophobicContact CG2-CD2 3.66Å; V35-Y217 HydrophobicContact CG2-CE1 4.19Å; V35-Y217 HydrophobicContact CG2-CE2 4.31Å; V35-Y217 HydrophobicContact CG2-CG 3.37Å
36	D	85.7	Confident	75.9	Confident	78 Å²	78	81.5 Å²	81.5	42%	0.417	42%	0.416	S	S	.	.			trans	-69.6	162.4	173	70.1	-86.9	0	0	0	111	F38 S39 L40	D36-F38 VanDerWaalsContact C-N 3.25Å; D36-F38 PolarHBondContact O-N 3.06Å; D36-F38 VanDerWaalsContact OD2-CA 3.32Å; D36-F38 WeakPolarHBondContact OD2-CA 3.43Å; D36-F38 WeakPolarHBondContact OD2-CB 3.49Å; D36-F38 PolarHBondContact OD2-N 2.82Å; D36-S39 PolarHBondContact O-N 3.37Å; D36-S39 VanDerWaalsContact OD1-CB 3.25Å; D36-S39 WeakPolarHBondContact OD1-CB 3.38Å; D36-S39 PolarHBondContact OD1-OG 2.92Å; D36-S39 PolarHBondContact OD2-N 3.49Å; D36-L40 PolarHBondContact O-N 2.94Å
37	W	85.8	Confident	78.4	Confident	225 Å²	225	75 Å²	75	85%	0.852	39%	0.386	S	S	*	.	H	α-helix	trans	-61	-32.2	-177.4	-72.8	105.4	0	0	0	113.6	L40 G41	W37-L40 HydrophobicContact CE3-CD2 4.33Å; W37-L40 HydrophobicContact CZ3-CD2 4.29Å; W37-G41 PolarHBondContact O-N 3.17Å
38	F	86.4	Confident	80.7	Confident	165 Å²	165	79.5 Å²	79.5	72%	0.724	40%	0.403	S	S	*	.	H	α-helix	trans	-72.3	-43	177.9	174.8	-92.1	0	0	0	111	D36 L40 G41 S42	D36-F38 VanDerWaalsContact C-N 3.25Å; D36-F38 PolarHBondContact O-N 3.06Å; D36-F38 VanDerWaalsContact OD2-CA 3.32Å; D36-F38 WeakPolarHBondContact OD2-CA 3.43Å; D36-F38 WeakPolarHBondContact OD2-CB 3.49Å; D36-F38 PolarHBondContact OD2-N 2.82Å; F38-L40 VanDerWaalsContact C-N 3.35Å; F38-L40 PolarHBondContact O-N 3.4Å; F38-G41 PolarHBondContact O-N 2.85Å; F38-S42 VanDerWaalsContact O-CB 3.32Å; F38-S42 WeakPolarHBondContact O-CB 3.27Å; F38-S42 PolarHBondContact O-N 2.65Å; F38-S42 PolarHBondContact O-OG 2.78Å
39	S	84.5	Confident	82.6	Confident	34 Å²	34	73.6 Å²	73.6	24%	0.238	38%	0.379	C	S	.	.	H	α-helix	trans	-58.9	-45.2	172.4	-71.3	0	0	0	0	111.7	D36 S42 I43	D36-S39 PolarHBondContact O-N 3.37Å; D36-S39 VanDerWaalsContact OD1-CB 3.25Å; D36-S39 WeakPolarHBondContact OD1-CB 3.38Å; D36-S39 PolarHBondContact OD1-OG 2.92Å; D36-S39 PolarHBondContact OD2-N 3.49Å; S39-S42 PolarHBondContact O-N 3.49Å; S39-I43 WeakPolarHBondContact O-CG1 3.15Å; S39-I43 PolarHBondContact O-N 3.02Å
40	L	88.8	Confident	84.3	Confident	26 Å²	26	71.1 Å²	71.1	14%	0.136	37%	0.371	C	S	.	.	H	α-helix	trans	-63.4	-48.3	177.4	-178.6	56.6	0	0	0	112	V35 D36 W37 F38 S42 I43 I44 N214 F216	V35-L40 HydrophobicContact CG1-CB 3.99Å; D36-L40 PolarHBondContact O-N 2.94Å; W37-L40 HydrophobicContact CE3-CD2 4.33Å; W37-L40 HydrophobicContact CZ3-CD2 4.29Å; F38-L40 VanDerWaalsContact C-N 3.35Å; F38-L40 PolarHBondContact O-N 3.4Å; L40-S42 VanDerWaalsContact C-N 3.3Å; L40-S42 PolarHBondContact O-N 3.06Å; L40-I43 PolarHBondContact O-N 3.48Å; L40-I44 HydrophobicContact CD1-CD1 3.89Å; L40-I44 HydrophobicContact CD1-CG1 4.21Å; L40-I44 HydrophobicContact CG-CD1 3.95Å; L40-I44 WeakPolarHBondContact O-CG1 3.36Å; L40-I44 PolarHBondContact O-N 3.22Å; L40-N214 VanDerWaalsContact CD1-ND2 3.34Å; L40-N214 WeakPolarHBondContact CD1-ND2 3.33Å; L40-F216 HydrophobicContact CD1-CB 4.03Å; L40-F216 HydrophobicContact CD1-CD2 4.28Å
41	G	90.4	Very high	85.9	Confident	40 Å²	40	69.8 Å²	69.8	41%	0.412	35%	0.353	S	S	.	.	H	α-helix	trans	-58.3	-43	177.2	0	0	0	0	0	112.1	W37 F38 I43 I44 F45	W37-G41 PolarHBondContact O-N 3.17Å; F38-G41 PolarHBondContact O-N 2.85Å; G41-I43 PolarHBondContact O-N 3.48Å; G41-I44 PolarHBondContact O-N 3.09Å; G41-F45 VanDerWaalsContact O-CB 3.3Å; G41-F45 WeakPolarHBondContact O-CB 3.38Å; G41-F45 PolarHBondContact O-N 2.97Å
42	S	89.1	Confident	87	Confident	43 Å²	43	74.3 Å²	74.3	30%	0.301	37%	0.374	S	S	.	.	H	α-helix	trans	-62.7	-41	176.7	-60.3	0	0	0	0	112.3	F38 S39 L40 F45 L46	F38-S42 VanDerWaalsContact O-CB 3.32Å; F38-S42 WeakPolarHBondContact O-CB 3.27Å; F38-S42 PolarHBondContact O-N 2.65Å; F38-S42 PolarHBondContact O-OG 2.78Å; S39-S42 PolarHBondContact O-N 3.49Å; L40-S42 VanDerWaalsContact C-N 3.3Å; L40-S42 PolarHBondContact O-N 3.06Å; S42-F45 PolarHBondContact O-N 3.02Å; S42-L46 VanDerWaalsContact O-CG 3.28Å; S42-L46 WeakPolarHBondContact O-CG 3.24Å; S42-L46 PolarHBondContact O-N 2.93Å
43	I	91.9	Very high	88.3	Confident	12 Å²	12	75.2 Å²	75.2	6%	0.062	37%	0.372	C	S	.	.	H	α-helix	trans	-67.5	-46.4	178.2	-74.1	-179.3	0	0	0	111.8	S39 L40 G41 F45 L46 L47 F216 Y217 M220	S39-I43 WeakPolarHBondContact O-CG1 3.15Å; S39-I43 PolarHBondContact O-N 3.02Å; L40-I43 PolarHBondContact O-N 3.48Å; G41-I43 PolarHBondContact O-N 3.48Å; I43-F45 VanDerWaalsContact C-N 3.27Å; I43-F45 PolarHBondContact O-N 3.45Å; I43-L46 PolarHBondContact O-N 3.27Å; I43-L47 HydrophobicContact CG2-CD1 3.75Å; I43-L47 HydrophobicContact CG2-CG 4.25Å; I43-L47 WeakPolarHBondContact O-CB 3.3Å; I43-L47 WeakPolarHBondContact O-CG 3.28Å; I43-L47 PolarHBondContact O-N 2.74Å; I43-F216 HydrophobicContact CG2-CB 4.27Å; I43-Y217 HydrophobicContact CD1-CD2 3.06Å; I43-Y217 HydrophobicContact CD1-CE2 3.7Å; I43-Y217 HydrophobicContact CD1-CG 3.75Å; I43-Y217 HydrophobicContact CG1-CD2 4.47Å; I43-M220 HydrophobicContact CD1-CB 4.13Å; I43-M220 HydrophobicContact CD1-CG 4.12Å; I43-M220 HydrophobicContact CG1-CB 4.4Å; I43-M220 HydrophobicContact CG1-CG 4.03Å; I43-M220 HydrophobicContact CG2-CB 3.57Å; I43-M220 HydrophobicContact CG2-CG 3.87Å
44	I	92.3	Very high	89.9	Confident	60 Å²	60	70.1 Å²	70.1	31%	0.308	35%	0.353	S	S	.	.	H	α-helix	trans	-61.2	-43.1	177.9	-68	170.6	0	0	0	109.7	L40 G41 L46 L47 L48 F216	L40-I44 HydrophobicContact CD1-CD1 3.89Å; L40-I44 HydrophobicContact CD1-CG1 4.21Å; L40-I44 HydrophobicContact CG-CD1 3.95Å; L40-I44 WeakPolarHBondContact O-CG1 3.36Å; L40-I44 PolarHBondContact O-N 3.22Å; G41-I44 PolarHBondContact O-N 3.09Å; I44-L46 PolarHBondContact O-N 3.31Å; I44-L47 PolarHBondContact O-N 3.01Å; I44-L48 HydrophobicContact CG2-CD1 3.88Å; I44-L48 WeakPolarHBondContact O-CG 3.22Å; I44-L48 PolarHBondContact O-N 3.44Å; I44-L48 VanDerWaalsContact O-N 3.13Å; I44-F216 HydrophobicContact CD1-CD2 4.32Å; I44-F216 HydrophobicContact CG1-CB 4.47Å; I44-F216 HydrophobicContact CG1-CD2 4.44Å; I44-F216 HydrophobicContact CG1-CG 4.23Å
45	F	92.8	Very high	91.1	Very high	128 Å²	128	63.2 Å²	63.2	56%	0.561	32%	0.32	S	S	*	.	H	α-helix	trans	-56.9	-48.8	174.3	177.2	-97.7	0	0	0	111.7	G41 S42 I43 L48 C49	G41-F45 VanDerWaalsContact O-CB 3.3Å; G41-F45 WeakPolarHBondContact O-CB 3.38Å; G41-F45 PolarHBondContact O-N 2.97Å; S42-F45 PolarHBondContact O-N 3.02Å; I43-F45 VanDerWaalsContact C-N 3.27Å; I43-F45 PolarHBondContact O-N 3.45Å; F45-L48 PolarHBondContact O-N 2.87Å; F45-C49 HydrophobicContact CE1-CB 4.26Å; F45-C49 HydrophobicContact CE2-CB 4.2Å; F45-C49 WeakPolarHBondContact CE2-SG 3.41Å; F45-C49 HydrophobicContact CZ-CB 4.07Å; F45-C49 WeakPolarHBondContact O-CB 3.46Å; F45-C49 PolarHBondContact O-N 3.42Å; F45-C49 PolarHBondContact O-SG 2.85Å
46	L	92.9	Very high	91.8	Very high	77 Å²	77	63.7 Å²	63.7	40%	0.403	32%	0.318	S	S	.	.	H	α-helix	trans	-64.9	-42.3	179.9	-71.9	172.1	0	0	0	113	S42 I43 I44 L48 A50 M220	S42-L46 VanDerWaalsContact O-CG 3.28Å; S42-L46 WeakPolarHBondContact O-CG 3.24Å; S42-L46 PolarHBondContact O-N 2.93Å; I43-L46 PolarHBondContact O-N 3.27Å; I44-L46 PolarHBondContact O-N 3.31Å; L46-L48 PolarHBondContact O-N 3.28Å; L46-A50 VanDerWaalsContact O-CB 3.28Å; L46-A50 WeakPolarHBondContact O-CB 3.32Å; L46-A50 PolarHBondContact O-N 3.08Å; L46-M220 HydrophobicContact CB-CE 4.08Å; L46-M220 HydrophobicContact CD1-CE 3.86Å
47	L	92.6	Very high	92.4	Very high	21 Å²	21	60.9 Å²	60.9	11%	0.11	30%	0.302	C	S	.	.	H	α-helix	trans	-61.1	-33.1	178.4	-74.1	171.2	0	0	0	112.4	I43 I44 F216 Y219 M220 W304	I43-L47 HydrophobicContact CG2-CD1 3.75Å; I43-L47 HydrophobicContact CG2-CG 4.25Å; I43-L47 WeakPolarHBondContact O-CB 3.3Å; I43-L47 WeakPolarHBondContact O-CG 3.28Å; I43-L47 PolarHBondContact O-N 2.74Å; I44-L47 PolarHBondContact O-N 3.01Å; L47-F216 HydrophobicContact CD1-CD1 4.2Å; L47-Y219 HydrophobicContact CD2-CD1 4.04Å; L47-Y219 HydrophobicContact CD2-CE1 4.22Å; L47-M220 HydrophobicContact CD2-SD 3.96Å; L47-M220 HydrophobicContact CG-SD 4.21Å; L47-W304 HydrophobicContact CD2-CB 4.28Å; L47-W304 HydrophobicContact CD2-CD2 3.49Å; L47-W304 VanDerWaalsContact CD2-CD2 3.49Å; L47-W304 HydrophobicContact CD2-CE3 3.64Å; L47-W304 HydrophobicContact CD2-CG 3.81Å; L47-W304 HydrophobicContact CD2-CH2 4.34Å; L47-W304 HydrophobicContact CD2-CZ2 4.27Å; L47-W304 HydrophobicContact CD2-CZ3 4.06Å
48	L	90.6	Very high	92.9	Very high	123 Å²	123	50.3 Å²	50.3	64%	0.644	26%	0.262	S	S	*	.	H	α-helix	trans	-86.9	-44.7	178.7	-66.4	173.1	0	0	0	112.4	I44 F45 L46	I44-L48 HydrophobicContact CG2-CD1 3.88Å; I44-L48 WeakPolarHBondContact O-CG 3.22Å; I44-L48 PolarHBondContact O-N 3.44Å; I44-L48 VanDerWaalsContact O-N 3.13Å; F45-L48 PolarHBondContact O-N 2.87Å; L46-L48 PolarHBondContact O-N 3.28Å
49	C	93.9	Very high	93.3	Very high	36 Å²	36	42.6 Å²	42.6	24%	0.243	23%	0.229	C	C	.	.	H	α-helix	trans	-88.1	-30.7	-168.7	-66.3	0	0	0	0	113.8	F45 F52 I53	F45-C49 HydrophobicContact CE1-CB 4.26Å; F45-C49 HydrophobicContact CE2-CB 4.2Å; F45-C49 WeakPolarHBondContact CE2-SG 3.41Å; F45-C49 HydrophobicContact CZ-CB 4.07Å; F45-C49 WeakPolarHBondContact O-CB 3.46Å; F45-C49 PolarHBondContact O-N 3.42Å; F45-C49 PolarHBondContact O-SG 2.85Å; C49-F52 WeakPolarHBondContact O-CB 3.3Å; C49-F52 PolarHBondContact O-N 3.06Å; C49-I53 VanDerWaalsContact O-CG1 3.27Å; C49-I53 WeakPolarHBondContact O-CG1 3.37Å; C49-I53 PolarHBondContact O-N 3.2Å
50	A	95.3	Very high	93.9	Very high	8 Å²	8	41 Å²	41	7%	0.066	22%	0.217	C	C	.	.	H	α-helix	trans	-64.8	-42.9	-176.2	0	0	0	0	0	113.6	L46 F52 I53 V54 W304 W308 W313	L46-A50 VanDerWaalsContact O-CB 3.28Å; L46-A50 WeakPolarHBondContact O-CB 3.32Å; L46-A50 PolarHBondContact O-N 3.08Å; A50-F52 VanDerWaalsContact C-N 3.29Å; A50-F52 PolarHBondContact O-N 3.32Å; A50-I53 PolarHBondContact O-N 3.47Å; A50-V54 PolarHBondContact O-N 3.31Å; A50-V54 VanDerWaalsContact O-N 3.09Å; A50-W304 HydrophobicContact CB-CH2 3.98Å; A50-W308 HydrophobicContact CB-CH2 3.81Å; A50-W308 HydrophobicContact CB-CZ3 3.78Å; A50-W313 HydrophobicContact CB-CZ3 4.2Å
51	P	95.8	Very high	94.2	Very high	23 Å²	23	39.7 Å²	39.7	15%	0.149	21%	0.211	C	C	.	.	H	α-helix	trans	-61.2	-39	172.7	-19.8	30.6	0	0	0	112.7	V54 Y55 Y189 W304 W308	P51-V54 PolarHBondContact O-N 3.22Å; P51-Y55 WeakPolarHBondContact O-CB 3.49Å; P51-Y55 PolarHBondContact O-N 2.78Å; P51-Y189 WeakPolarHBondContact CG-OH 3.42Å; P51-W304 HydrophobicContact CG-CZ2 4.06Å; P51-W308 HydrophobicContact CB-CZ2 4.07Å; P51-W308 HydrophobicContact CG-CZ2 4.01Å
52	F	94.5	Very high	94.4	Very high	112 Å²	112	40.8 Å²	40.8	49%	0.491	21%	0.207	S	C	.	.	H	α-helix	trans	-64.1	-40.7	175.8	179.9	-98.6	0	0	0	111.9	C49 A50 Y55 Y56	C49-F52 WeakPolarHBondContact O-CB 3.3Å; C49-F52 PolarHBondContact O-N 3.06Å; A50-F52 VanDerWaalsContact C-N 3.29Å; A50-F52 PolarHBondContact O-N 3.32Å; F52-Y55 PolarHBondContact O-N 2.99Å; F52-Y56 HydrophobicContact CE1-CD2 4.48Å; F52-Y56 HydrophobicContact CZ-CD2 4.43Å; F52-Y56 WeakPolarHBondContact O-CB 3.29Å; F52-Y56 PolarHBondContact O-N 2.92Å
53	I	95.5	Very high	94.7	Very high	57 Å²	57	40.9 Å²	40.9	29%	0.292	20%	0.203	S	C	.	.	H	α-helix	trans	-60.2	-48.3	175.6	-70.8	164.5	0	0	0	110.2	C49 A50 Y55 Y56 F57 W313	C49-I53 VanDerWaalsContact O-CG1 3.27Å; C49-I53 WeakPolarHBondContact O-CG1 3.37Å; C49-I53 PolarHBondContact O-N 3.2Å; A50-I53 PolarHBondContact O-N 3.47Å; I53-Y55 PolarHBondContact O-N 2.94Å; I53-Y56 WeakPolarHBondContact O-CB 3.39Å; I53-Y56 PolarHBondContact O-N 3.46Å; I53-F57 HydrophobicContact CG2-CD2 3.96Å; I53-F57 HydrophobicContact CG2-CE2 3.9Å; I53-F57 WeakPolarHBondContact O-CD2 3.19Å; I53-F57 PolarHBondContact O-N 2.87Å; I53-W313 HydrophobicContact CG2-CH2 4.5Å; I53-W313 HydrophobicContact CG2-CZ3 4.38Å
54	V	97.3	Very high	94.9	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-60.5	-50	178.4	179.2	0	0	0	0	110.5	A50 P51 Y56 F57 I58 L181 W308 V312 W313 Y316 L317	A50-V54 PolarHBondContact O-N 3.31Å; A50-V54 VanDerWaalsContact O-N 3.09Å; P51-V54 PolarHBondContact O-N 3.22Å; V54-Y56 VanDerWaalsContact C-N 3.32Å; V54-Y56 PolarHBondContact O-N 3.32Å; V54-F57 PolarHBondContact O-N 3.42Å; V54-I58 HydrophobicContact CG1-CG1 4.48Å; V54-I58 WeakPolarHBondContact O-CG1 3.49Å; V54-I58 PolarHBondContact O-N 3.07Å; V54-I58 VanDerWaalsContact O-N 3.1Å; V54-L181 HydrophobicContact CG1-CD1 3.7Å; V54-W308 HydrophobicContact CG2-CH2 3.66Å; V54-W308 HydrophobicContact CG2-CZ2 4.08Å; V54-V312 HydrophobicContact CB-CG1 4.45Å; V54-V312 HydrophobicContact CG1-CG1 4.01Å; V54-V312 HydrophobicContact CG2-CG1 4.32Å; V54-W313 HydrophobicContact CG2-CE3 3.99Å; V54-W313 HydrophobicContact CG2-CZ3 4.43Å; V54-Y316 HydrophobicContact CG1-CG 4.2Å; V54-L317 HydrophobicContact CG1-CD2 4.43Å; V54-L317 HydrophobicContact CG2-CD1 3.95Å; V54-L317 HydrophobicContact CG2-CD2 4.18Å; V54-L317 HydrophobicContact CG2-CG 4.04Å
55	Y	96.3	Very high	95	Very high	27 Å²	27	42.6 Å²	42.6	11%	0.106	22%	0.215	C	C	.	.	H	α-helix	trans	-55	-47.5	176.5	172.2	-98.9	0	0	0	112.1	P51 F52 I53 F57 I58 M59 W86 T89 W182	P51-Y55 WeakPolarHBondContact O-CB 3.49Å; P51-Y55 PolarHBondContact O-N 2.78Å; F52-Y55 PolarHBondContact O-N 2.99Å; I53-Y55 PolarHBondContact O-N 2.94Å; Y55-F57 PolarHBondContact O-N 2.98Å; Y55-I58 PolarHBondContact O-N 3.16Å; Y55-M59 HydrophobicContact CD1-CG 4.2Å; Y55-M59 HydrophobicContact CD2-CG 3.99Å; Y55-M59 HydrophobicContact CE1-CG 3.75Å; Y55-M59 HydrophobicContact CE2-CE 4.38Å; Y55-M59 HydrophobicContact CE2-CG 3.48Å; Y55-M59 VanDerWaalsContact CE2-CG 3.48Å; Y55-M59 HydrophobicContact CE2-SD 3.81Å; Y55-M59 HydrophobicContact CG-CG 4.32Å; Y55-M59 WeakPolarHBondContact O-CG 3.47Å; Y55-M59 PolarHBondContact O-N 2.87Å; Y55-W86 HydrophobicContact CE1-CE3 4.47Å; Y55-W86 HydrophobicContact CE2-CE3 4.4Å; Y55-W86 HydrophobicContact CE2-CZ3 4.16Å; Y55-W86 AromaticContact CZ-CE3 3.87Å; Y55-T89 HydrophobicContact CE2-CG2 3.72Å; Y55-T89 PolarHBondContact OH-OG1 2.92Å; Y55-W182 AromaticContact CD2-CH2 3.88Å; Y55-W182 HydrophobicContact CD2-CH2 3.88Å; Y55-W182 HydrophobicContact CD2-CZ2 4.1Å; Y55-W182 HydrophobicContact CE2-CH2 4.1Å; Y55-W182 HydrophobicContact CE2-CZ2 4.01Å
56	Y	96.1	Very high	95.2	Very high	43 Å²	43	36.5 Å²	36.5	17%	0.169	19%	0.189	C	C	.	.	H	α-helix	trans	-57.2	-47	179.2	-179.6	-93.2	0	0	0	112	F52 I53 V54 I58 M59 A60 L68 P71 V72	F52-Y56 HydrophobicContact CE1-CD2 4.48Å; F52-Y56 HydrophobicContact CZ-CD2 4.43Å; F52-Y56 WeakPolarHBondContact O-CB 3.29Å; F52-Y56 PolarHBondContact O-N 2.92Å; I53-Y56 WeakPolarHBondContact O-CB 3.39Å; I53-Y56 PolarHBondContact O-N 3.46Å; V54-Y56 VanDerWaalsContact C-N 3.32Å; V54-Y56 PolarHBondContact O-N 3.32Å; Y56-I58 PolarHBondContact O-N 2.87Å; Y56-M59 PolarHBondContact O-N 3.13Å; Y56-A60 VanDerWaalsContact O-CB 3.23Å; Y56-A60 WeakPolarHBondContact O-CB 3.14Å; Y56-A60 PolarHBondContact O-N 3.41Å; Y56-L68 HydrophobicContact CD1-CD2 4.34Å; Y56-L68 HydrophobicContact CE1-CD2 3.96Å; Y56-L68 PolarHBondContact OH-O 3.34Å; Y56-P71 HydrophobicContact CE2-CB 3.84Å; Y56-P71 HydrophobicContact CE2-CG 4.07Å; Y56-V72 HydrophobicContact CE2-CG2 4.42Å; Y56-V72 WeakPolarHBondContact OH-CG2 3.38Å
57	F	97.1	Very high	95.4	Very high	19 Å²	19	34 Å²	34	8%	0.083	18%	0.18	C	C	.	.	H	α-helix	trans	-63.4	-42.9	179.8	-88.3	-115.7	0	0	0	111.9	I53 V54 Y55 A60 C61 L68 L317 L320 L428 F431	I53-F57 HydrophobicContact CG2-CD2 3.96Å; I53-F57 HydrophobicContact CG2-CE2 3.9Å; I53-F57 WeakPolarHBondContact O-CD2 3.19Å; I53-F57 PolarHBondContact O-N 2.87Å; V54-F57 PolarHBondContact O-N 3.42Å; Y55-F57 PolarHBondContact O-N 2.98Å; F57-A60 PolarHBondContact O-N 3.19Å; F57-C61 PolarHBondContact O-N 3.31Å; F57-C61 VanDerWaalsContact O-N 3.08Å; F57-L68 HydrophobicContact CD1-CD2 4.06Å; F57-L68 HydrophobicContact CD2-CD2 4.21Å; F57-L68 HydrophobicContact CE1-CD1 4.07Å; F57-L68 HydrophobicContact CE1-CD2 3.98Å; F57-L68 HydrophobicContact CE2-CD2 4.15Å; F57-L68 HydrophobicContact CG-CD2 4.18Å; F57-L68 HydrophobicContact CZ-CD1 3.96Å; F57-L68 HydrophobicContact CZ-CD2 4.04Å; F57-L317 HydrophobicContact CB-CD2 4.23Å; F57-L317 HydrophobicContact CD1-CD2 4.49Å; F57-L317 HydrophobicContact CG-CD2 4.37Å; F57-L320 HydrophobicContact CB-CD2 4.34Å; F57-L320 HydrophobicContact CD1-CD1 3.59Å; F57-L320 HydrophobicContact CD1-CD2 4.26Å; F57-L320 HydrophobicContact CE1-CD1 4.06Å; F57-L428 HydrophobicContact CD1-CD1 4.24Å; F57-L428 HydrophobicContact CD1-CG 4.14Å; F57-F431 HydrophobicContact CD1-CG 4.46Å; F57-F431 HydrophobicContact CE1-CB 3.55Å; F57-F431 HydrophobicContact CE1-CD1 4.18Å; F57-F431 AromaticContact CE1-CD2 3.7Å; F57-F431 HydrophobicContact CE1-CD2 3.7Å; F57-F431 HydrophobicContact CE1-CE2 4.47Å; F57-F431 AromaticContact CE1-CG 3.51Å; F57-F431 HydrophobicContact CE1-CG 3.51Å; F57-F431 HydrophobicContact CE2-CD2 4.44Å; F57-F431 HydrophobicContact CZ-CB 4.1Å; F57-F431 AromaticContact CZ-CD2 3.44Å; F57-F431 HydrophobicContact CZ-CD2 3.44Å; F57-F431 VanDerWaalsContact CZ-CD2 3.44Å; F57-F431 HydrophobicContact CZ-CE2 4.01Å; F57-F431 AromaticContact CZ-CG 3.8Å; F57-F431 HydrophobicContact CZ-CG 3.8Å
58	I	96.9	Very high	95.5	Very high	2 Å²	2	34.5 Å²	34.5	1%	0.01	18%	0.182	C	C	.	.	H	α-helix	trans	-67.1	-43.7	178.3	-58.7	-46.9	0	0	0	111	V54 Y55 Y56 C61 D62 I178 L181 Y316 L320 L323	V54-I58 HydrophobicContact CG1-CG1 4.48Å; V54-I58 WeakPolarHBondContact O-CG1 3.49Å; V54-I58 PolarHBondContact O-N 3.07Å; V54-I58 VanDerWaalsContact O-N 3.1Å; Y55-I58 PolarHBondContact O-N 3.16Å; Y56-I58 PolarHBondContact O-N 2.87Å; I58-C61 PolarHBondContact O-N 2.71Å; I58-D62 WeakPolarHBondContact O-CB 3.39Å; I58-D62 PolarHBondContact O-N 2.92Å; I58-I178 HydrophobicContact CG2-CG1 3.78Å; I58-L181 HydrophobicContact CB-CD2 4.44Å; I58-L181 HydrophobicContact CG1-CD2 4.23Å; I58-Y316 HydrophobicContact CD1-CD1 4.08Å; I58-Y316 HydrophobicContact CG1-CD1 4.07Å; I58-L320 HydrophobicContact CD1-CD2 4.34Å; I58-L323 HydrophobicContact CD1-CD2 3.75Å
59	M	95.5	Very high	95.8	Very high	3 Å²	3	33.4 Å²	33.4	2%	0.015	18%	0.181	C	C	.	.	H	α-helix	trans	-67.9	-35.9	177.1	-66.2	-54.2	89	0	0	112.8	Y55 Y56 C61 D62 Q63 I85 T89 I178	Y55-M59 HydrophobicContact CD1-CG 4.2Å; Y55-M59 HydrophobicContact CD2-CG 3.99Å; Y55-M59 HydrophobicContact CE1-CG 3.75Å; Y55-M59 HydrophobicContact CE2-CE 4.38Å; Y55-M59 HydrophobicContact CE2-CG 3.48Å; Y55-M59 VanDerWaalsContact CE2-CG 3.48Å; Y55-M59 HydrophobicContact CE2-SD 3.81Å; Y55-M59 HydrophobicContact CG-CG 4.32Å; Y55-M59 WeakPolarHBondContact O-CG 3.47Å; Y55-M59 PolarHBondContact O-N 2.87Å; Y56-M59 PolarHBondContact O-N 3.13Å; M59-C61 VanDerWaalsContact C-N 3.26Å; M59-C61 PolarHBondContact O-N 2.93Å; M59-D62 PolarHBondContact O-N 3.44Å; M59-Q63 WeakPolarHBondContact O-CB 3.41Å; M59-Q63 PolarHBondContact O-N 2.93Å; M59-I85 HydrophobicContact CB-CG2 4.47Å; M59-T89 HydrophobicContact SD-CG2 4.14Å; M59-I178 HydrophobicContact CE-CB 4.45Å; M59-I178 HydrophobicContact CE-CD1 3.46Å; M59-I178 VanDerWaalsContact CE-CD1 3.46Å; M59-I178 HydrophobicContact CE-CG1 3.64Å; M59-I178 HydrophobicContact CE-CG2 3.97Å
60	A	96.5	Very high	95.8	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-61.2	-38.5	173.1	0	0	0	0	0	110.7	Y56 F57 Y64 S65 C66 L68 P71	Y56-A60 VanDerWaalsContact O-CB 3.23Å; Y56-A60 WeakPolarHBondContact O-CB 3.14Å; Y56-A60 PolarHBondContact O-N 3.41Å; F57-A60 PolarHBondContact O-N 3.19Å; A60-Y64 CarbonylContact O-C 3.41Å; A60-Y64 VanDerWaalsContact O-CA 3.3Å; A60-Y64 WeakPolarHBondContact O-CA 3.32Å; A60-Y64 VanDerWaalsContact O-CB 3.27Å; A60-Y64 WeakPolarHBondContact O-CB 3.2Å; A60-Y64 PolarHBondContact O-N 3.01Å; A60-Y64 VanDerWaalsContact O-N 3.16Å; A60-S65 PolarHBondContact O-N 3.28Å; A60-C66 VanDerWaalsContact O-CA 3.27Å; A60-C66 WeakPolarHBondContact O-CA 3.46Å; A60-C66 PolarHBondContact O-N 3.36Å; A60-L68 HydrophobicContact CB-CD2 4.13Å; A60-P71 HydrophobicContact CB-CG 4.2Å
61	C	95.1	Very high	95.7	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-66.2	-55.4	171.7	-91.1	0	0	0	0	113.4	F57 I58 M59 S65 C66 L323 Y327 L428	F57-C61 PolarHBondContact O-N 3.31Å; F57-C61 VanDerWaalsContact O-N 3.08Å; I58-C61 PolarHBondContact O-N 2.71Å; M59-C61 VanDerWaalsContact C-N 3.26Å; M59-C61 PolarHBondContact O-N 2.93Å; C61-S65 PolarHBondContact O-N 3.3Å; C61-C66 WeakPolarHBondContact CA-SG 3.4Å; C61-C66 HydrophobicContact CB-CB 4.17Å; C61-C66 WeakPolarHBondContact CB-SG 3.46Å; C61-C66 PolarHBondContact O-N 3.19Å; C61-C66 WeakPolarHBondContact SG-CB 3.37Å; C61-C66 CovalentContact SG-SG 2.06Å; C61-C66 PolarHBondContact SG-SG 3.31Å; C61-L323 HydrophobicContact CB-CD2 3.87Å; C61-L323 HydrophobicContact CB-CG 4.22Å; C61-Y327 HydrophobicContact CB-CE2 4.35Å; C61-L428 HydrophobicContact CB-CD1 4.49Å; C61-L428 WeakPolarHBondContact SG-CD1 2.98Å
62	D	94.4	Very high	95.6	Very high	63 Å²	63	35.1 Å²	35.1	34%	0.337	19%	0.191	S	C	.	.	H	α-helix	trans	-65.4	-44.4	-172.4	-174.3	67.1	0	0	0	113.3	I58 M59 I178 Y327	I58-D62 WeakPolarHBondContact O-CB 3.39Å; I58-D62 PolarHBondContact O-N 2.92Å; M59-D62 PolarHBondContact O-N 3.44Å; D62-I178 HydrophobicContact CB-CD1 3.99Å; D62-Y327 PolarHBondContact OD1-OH 2.91Å
63	Q	95.1	Very high	95.6	Very high	45 Å²	45	32.8 Å²	32.8	21%	0.21	19%	0.186	C	C	.	.	H	α-helix	trans	-100.9	-18.9	-172.3	-57.1	-175	24.2	0	0	113.7	M59 I85	M59-Q63 WeakPolarHBondContact O-CB 3.41Å; M59-Q63 PolarHBondContact O-N 2.93Å; Q63-I85 PolarHBondContact NE2-O 2.99Å; Q63-I85 VanDerWaalsContact NE2-O 3.15Å
64	Y	96.1	Very high	95.6	Very high	37 Å²	37	31.7 Å²	31.7	15%	0.145	18%	0.181	C	C	.	.	H	α-helix	trans	-128.9	22.7	-171.7	-66.8	-90.8	0	0	0	113.5	A60 C66 A67 P71 D74 I85	A60-Y64 CarbonylContact O-C 3.41Å; A60-Y64 VanDerWaalsContact O-CA 3.3Å; A60-Y64 WeakPolarHBondContact O-CA 3.32Å; A60-Y64 VanDerWaalsContact O-CB 3.27Å; A60-Y64 WeakPolarHBondContact O-CB 3.2Å; A60-Y64 PolarHBondContact O-N 3.01Å; A60-Y64 VanDerWaalsContact O-N 3.16Å; Y64-C66 PolarHBondContact O-N 2.86Å; Y64-C66 VanDerWaalsContact O-N 3.13Å; Y64-A67 WeakPolarHBondContact O-CB 3.45Å; Y64-A67 PolarHBondContact O-N 3.15Å; Y64-P71 HydrophobicContact CD2-CB 4.44Å; Y64-P71 HydrophobicContact CD2-CG 3.58Å; Y64-P71 HydrophobicContact CE2-CB 4.18Å; Y64-P71 HydrophobicContact CE2-CG 3.81Å; Y64-P71 HydrophobicContact CG-CG 4.01Å; Y64-D74 HydrophobicContact CE1-CB 4.35Å; Y64-D74 VanDerWaalsContact CE1-OD2 3.28Å; Y64-D74 WeakPolarHBondContact CE1-OD2 3.27Å; Y64-D74 PolarHBondContact OH-OD2 2.87Å; Y64-I85 HydrophobicContact CE2-CD1 4.4Å; Y64-I85 HydrophobicContact CE2-CG1 4.47Å
65	S	95.3	Very high	95.4	Very high	70 Å²	70	34.8 Å²	34.8	49%	0.49	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.4	39.7	179.9	-57.2	0	0	0	0	112.5	A60 C61 A67 H328 H426	A60-S65 PolarHBondContact O-N 3.28Å; C61-S65 PolarHBondContact O-N 3.3Å; S65-A67 PolarHBondContact O-N 3.04Å; S65-H328 PolarHBondContact O-NE2 3.4Å; S65-H426 PolarHBondContact O-NE2 2.98Å
66	C	96.8	Very high	95.3	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	65	15.4	179.7	-57.6	0	0	0	0	115.6	A60 C61 Y64 L68 Y324 H426 L428	A60-C66 VanDerWaalsContact O-CA 3.27Å; A60-C66 WeakPolarHBondContact O-CA 3.46Å; A60-C66 PolarHBondContact O-N 3.36Å; C61-C66 WeakPolarHBondContact CA-SG 3.4Å; C61-C66 HydrophobicContact CB-CB 4.17Å; C61-C66 WeakPolarHBondContact CB-SG 3.46Å; C61-C66 PolarHBondContact O-N 3.19Å; C61-C66 WeakPolarHBondContact SG-CB 3.37Å; C61-C66 CovalentContact SG-SG 2.06Å; C61-C66 PolarHBondContact SG-SG 3.31Å; Y64-C66 PolarHBondContact O-N 2.86Å; Y64-C66 VanDerWaalsContact O-N 3.13Å; C66-L68 PolarHBondContact O-N 3.17Å; C66-Y324 HydrophobicContact CB-CD2 3.62Å; C66-Y324 HydrophobicContact CB-CE2 4.15Å; C66-H426 PolarHBondContact O-CD2 3.28Å; C66-L428 HydrophobicContact CB-CB 4.49Å; C66-L428 HydrophobicContact CB-CD1 3.98Å; C66-L428 HydrophobicContact CB-CD2 4.35Å
67	A	96.6	Very high	95.2	Very high	26 Å²	26	39.2 Å²	39.2	22%	0.215	24%	0.24	C	C	.	.			trans	-76.4	101.8	171.6	0	0	0	0	0	111	Y64 S65 T69 G70 P71	Y64-A67 WeakPolarHBondContact O-CB 3.45Å; Y64-A67 PolarHBondContact O-N 3.15Å; S65-A67 PolarHBondContact O-N 3.04Å; A67-T69 PolarHBondContact O-N 2.06Å; A67-T69 VanDerWaalsContact O-N 3.09Å; A67-G70 PolarHBondContact O-N 3.2Å; A67-P71 WeakPolarHBondContact O-CD 3.18Å
68	L	95.5	Very high	94.9	Very high	31 Å²	31	41.4 Å²	41.4	16%	0.162	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-18.1	178.2	-70.4	-177.7	0	0	0	114	Y56 F57 A60 C66 L427 L428	Y56-L68 HydrophobicContact CD1-CD2 4.34Å; Y56-L68 HydrophobicContact CE1-CD2 3.96Å; Y56-L68 PolarHBondContact OH-O 3.34Å; F57-L68 HydrophobicContact CD1-CD2 4.06Å; F57-L68 HydrophobicContact CD2-CD2 4.21Å; F57-L68 HydrophobicContact CE1-CD1 4.07Å; F57-L68 HydrophobicContact CE1-CD2 3.98Å; F57-L68 HydrophobicContact CE2-CD2 4.15Å; F57-L68 HydrophobicContact CG-CD2 4.18Å; F57-L68 HydrophobicContact CZ-CD1 3.96Å; F57-L68 HydrophobicContact CZ-CD2 4.04Å; A60-L68 HydrophobicContact CB-CD2 4.13Å; C66-L68 PolarHBondContact O-N 3.17Å; L68-L427 HydrophobicContact CD1-CB 4.26Å; L68-L427 HydrophobicContact CD1-CD2 4.39Å; L68-L427 HydrophobicContact CD1-CG 4.29Å; L68-L428 HydrophobicContact CD1-CB 4.24Å; L68-L428 HydrophobicContact CD2-CB 4.21Å; L68-L428 HydrophobicContact CD2-CD1 3.85Å; L68-L428 HydrophobicContact CD2-CG 4.34Å; L68-L428 HydrophobicContact CG-CB 3.93Å; L68-L428 HydrophobicContact CG-CD1 4.43Å
69	T	95.4	Very high	94.7	Very high	100 Å²	100	49.3 Å²	49.3	61%	0.613	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.5	-17.6	175.7	50.4	0	0	0	0	112.5	A67 V72 V73	A67-T69 PolarHBondContact O-N 2.06Å; A67-T69 VanDerWaalsContact O-N 3.09Å; T69-V72 PolarHBondContact O-N 2.85Å; T69-V73 VanDerWaalsContact O-CG2 3.29Å; T69-V73 WeakPolarHBondContact O-CG2 3.1Å; T69-V73 PolarHBondContact O-N 3.28Å
70	G	94.3	Very high	94.5	Very high	13 Å²	13	49.8 Å²	49.8	13%	0.134	30%	0.302	C	S	.	.	H	α-helix	trans	-55	-59	-175	0	0	0	0	0	113.6	A67 V72 V73 D74	A67-G70 PolarHBondContact O-N 3.2Å; G70-V72 VanDerWaalsContact C-N 3.29Å; G70-V72 PolarHBondContact O-N 3.13Å; G70-V73 PolarHBondContact O-N 2.52Å; G70-D74 PolarHBondContact O-N 3.22Å
71	P	93.8	Very high	94.3	Very high	5 Å²	5	58.7 Å²	58.7	3%	0.032	34%	0.335	C	S	.	.	H	α-helix	trans	-55.5	-42.3	179	-24.6	31.5	0	0	0	113.2	Y56 A60 Y64 A67 I75 I85	Y56-P71 HydrophobicContact CE2-CB 3.84Å; Y56-P71 HydrophobicContact CE2-CG 4.07Å; A60-P71 HydrophobicContact CB-CG 4.2Å; Y64-P71 HydrophobicContact CD2-CB 4.44Å; Y64-P71 HydrophobicContact CD2-CG 3.58Å; Y64-P71 HydrophobicContact CE2-CB 4.18Å; Y64-P71 HydrophobicContact CE2-CG 3.81Å; Y64-P71 HydrophobicContact CG-CG 4.01Å; A67-P71 WeakPolarHBondContact O-CD 3.18Å; P71-I75 WeakPolarHBondContact O-CD1 3.07Å; P71-I75 VanDerWaalsContact O-CG1 3.24Å; P71-I75 WeakPolarHBondContact O-CG1 3.34Å; P71-I75 PolarHBondContact O-N 3.42Å; P71-I85 HydrophobicContact CB-CD1 4.15Å
72	V	94.3	Very high	94	Very high	84 Å²	84	64.2 Å²	64.2	51%	0.509	36%	0.364	S	S	.	.	H	α-helix	trans	-67.4	-45.1	-178.3	172.4	0	0	0	0	111.2	Y56 T69 G70 D74 I75 A76	Y56-V72 HydrophobicContact CE2-CG2 4.42Å; Y56-V72 WeakPolarHBondContact OH-CG2 3.38Å; T69-V72 PolarHBondContact O-N 2.85Å; G70-V72 VanDerWaalsContact C-N 3.29Å; G70-V72 PolarHBondContact O-N 3.13Å; V72-D74 VanDerWaalsContact C-N 3.35Å; V72-I75 PolarHBondContact O-N 3.42Å; V72-A76 WeakPolarHBondContact O-CB 3.42Å; V72-A76 PolarHBondContact O-N 2.9Å
73	V	94.7	Very high	93.8	Very high	64 Å²	64	64.3 Å²	64.3	39%	0.388	37%	0.37	S	S	.	.	H	α-helix	trans	-63.9	-42.6	178.9	173.4	0	0	0	0	110.4	T69 G70 I75 A76 T77	T69-V73 VanDerWaalsContact O-CG2 3.29Å; T69-V73 WeakPolarHBondContact O-CG2 3.1Å; T69-V73 PolarHBondContact O-N 3.28Å; G70-V73 PolarHBondContact O-N 2.52Å; V73-I75 PolarHBondContact O-N 3.08Å; V73-A76 PolarHBondContact O-N 3.22Å; V73-T77 HydrophobicContact CG1-CG2 4.13Å; V73-T77 WeakPolarHBondContact O-CB 3.35Å; V73-T77 VanDerWaalsContact O-CG2 3.28Å; V73-T77 WeakPolarHBondContact O-CG2 3.47Å; V73-T77 PolarHBondContact O-N 3.38Å; V73-T77 PolarHBondContact O-OG1 3.19Å
74	D	93.8	Very high	93.6	Very high	33 Å²	33	65.6 Å²	65.6	18%	0.176	38%	0.378	C	S	.	.	H	α-helix	trans	-66.5	-37.8	179.6	-84.7	8.4	0	0	0	113	Y64 G70 V72 T77 G78 R79 A80	Y64-D74 HydrophobicContact CE1-CB 4.35Å; Y64-D74 VanDerWaalsContact CE1-OD2 3.28Å; Y64-D74 WeakPolarHBondContact CE1-OD2 3.27Å; Y64-D74 PolarHBondContact OH-OD2 2.87Å; G70-D74 PolarHBondContact O-N 3.22Å; V72-D74 VanDerWaalsContact C-N 3.35Å; D74-T77 PolarHBondContact O-OG1 3.28Å; D74-G78 CarbonylContact O-C 3.32Å; D74-G78 PolarHBondContact O-N 3.42Å; D74-R79 HydrophobicContact CB-CB 4.25Å; D74-R79 PolarHBondContact O-N 3.16Å; D74-R79 IonicContact OD1-CZ 3.22Å; D74-R79 IonicContact OD1-NE 3.99Å; D74-R79 PolarHBondContact OD1-NE 2.81Å; D74-R79 IonicContact OD1-NH2 2.76Å; D74-R79 PolarHBondContact OD1-NH2 2.91Å; D74-A80 HydrophobicContact CB-CB 3.98Å; D74-A80 PolarHBondContact O-N 3.48Å; D74-A80 VanDerWaalsContact O-N 3.08Å
75	I	93.6	Very high	93.4	Very high	65 Å²	65	64.5 Å²	64.5	33%	0.333	38%	0.375	S	S	.	.	H	α-helix	trans	-67.2	-47.1	173	-66.7	164.3	0	0	0	110.8	P71 V72 V73 T77 G78 A80 L82 I85	P71-I75 WeakPolarHBondContact O-CD1 3.07Å; P71-I75 VanDerWaalsContact O-CG1 3.24Å; P71-I75 WeakPolarHBondContact O-CG1 3.34Å; P71-I75 PolarHBondContact O-N 3.42Å; V72-I75 PolarHBondContact O-N 3.42Å; V73-I75 PolarHBondContact O-N 3.08Å; I75-T77 VanDerWaalsContact C-N 3.3Å; I75-T77 PolarHBondContact O-N 3.47Å; I75-G78 PolarHBondContact O-N 2.87Å; I75-G78 VanDerWaalsContact O-N 3.16Å; I75-A80 WeakPolarHBondContact CA-O 3.23Å; I75-L82 HydrophobicContact CD1-CD2 3.51Å; I75-L82 HydrophobicContact CD1-CG 4.04Å; I75-I85 HydrophobicContact CD1-CD1 3.96Å; I75-I85 HydrophobicContact CG1-CD1 4.31Å
76	A	94.2	Very high	93.2	Very high	84 Å²	84	68.4 Å²	68.4	69%	0.694	38%	0.379	S	S	*	.	H	α-helix	trans	-65.5	-32.9	-177.7	0	0	0	0	0	112.9	V72 V73 G78	V72-A76 WeakPolarHBondContact O-CB 3.42Å; V72-A76 PolarHBondContact O-N 2.9Å; V73-A76 PolarHBondContact O-N 3.22Å; A76-G78 VanDerWaalsContact C-N 3.34Å
77	T	94.5	Very high	93.1	Very high	80 Å²	80	72.3 Å²	72.3	49%	0.491	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-2.8	177.5	56.4	0	0	0	0	113.3	V73 D74 I75 R79	V73-T77 HydrophobicContact CG1-CG2 4.13Å; V73-T77 WeakPolarHBondContact O-CB 3.35Å; V73-T77 VanDerWaalsContact O-CG2 3.28Å; V73-T77 WeakPolarHBondContact O-CG2 3.47Å; V73-T77 PolarHBondContact O-N 3.38Å; V73-T77 PolarHBondContact O-OG1 3.19Å; D74-T77 PolarHBondContact O-OG1 3.28Å; I75-T77 VanDerWaalsContact C-N 3.3Å; I75-T77 PolarHBondContact O-N 3.47Å; T77-R79 PolarHBondContact O-N 2.91Å; T77-R79 WeakPolarHBondContact OG1-CG 3.42Å; T77-R79 PolarHBondContact OG1-NE 3.44Å
78	G	91.8	Very high	92.9	Very high	65 Å²	65	77.9 Å²	77.9	67%	0.67	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.3	11.7	-177.8	0	0	0	0	0	114.7	D74 I75 A76 A80	D74-G78 CarbonylContact O-C 3.32Å; D74-G78 PolarHBondContact O-N 3.42Å; I75-G78 PolarHBondContact O-N 2.87Å; I75-G78 VanDerWaalsContact O-N 3.16Å; A76-G78 VanDerWaalsContact C-N 3.34Å; G78-A80 VanDerWaalsContact C-N 3.34Å
79	R	91.6	Very high	92.8	Very high	168 Å²	168	77.1 Å²	77.1	63%	0.634	43%	0.427	S	S	*	.	S	Bend	trans	-72.5	-26.6	176.2	-69.1	-167.2	-63.5	-145.1	2	113	D74 T77	D74-R79 HydrophobicContact CB-CB 4.25Å; D74-R79 PolarHBondContact O-N 3.16Å; D74-R79 IonicContact OD1-CZ 3.22Å; D74-R79 IonicContact OD1-NE 3.99Å; D74-R79 PolarHBondContact OD1-NE 2.81Å; D74-R79 IonicContact OD1-NH2 2.76Å; D74-R79 PolarHBondContact OD1-NH2 2.91Å; T77-R79 PolarHBondContact O-N 2.91Å; T77-R79 WeakPolarHBondContact OG1-CG 3.42Å; T77-R79 PolarHBondContact OG1-NE 3.44Å
80	A	91.1	Very high	92.8	Very high	13 Å²	13	74.4 Å²	74.4	11%	0.107	41%	0.412	C	S	.	.			trans	-140.7	151.7	172.6	0	0	0	0	0	110.5	D74 I75 G78	D74-A80 HydrophobicContact CB-CB 3.98Å; D74-A80 PolarHBondContact O-N 3.48Å; D74-A80 VanDerWaalsContact O-N 3.08Å; I75-A80 WeakPolarHBondContact CA-O 3.23Å; G78-A80 VanDerWaalsContact C-N 3.34Å
81	R	91.6	Very high	92.9	Very high	186 Å²	186	78.2 Å²	78.2	70%	0.702	43%	0.434	S	S	*	.			trans	-100.8	160	165.9	-62.4	177.8	177.1	-176.8	-0.5	109.5	S83 D84 I85	R81-S83 WeakPolarHBondContact CB-OG 3.38Å; R81-S83 PolarHBondContact O-N 3.39Å; R81-D84 WeakPolarHBondContact CB-OD2 3.32Å; R81-D84 PolarHBondContact N-OD2 3.49Å; R81-D84 WeakPolarHBondContact O-CB 3.21Å; R81-D84 PolarHBondContact O-N 3.43Å; R81-I85 PolarHBondContact O-N 3.36Å
82	L	89	Confident	93.1	Very high	116 Å²	116	82.1 Å²	82.1	61%	0.607	45%	0.453	S	S	*	.	H	α-helix	trans	-54.9	-34.9	171.4	-74.2	170.4	0	0	0	112	I75 D84 I85 W86	I75-L82 HydrophobicContact CD1-CD2 3.51Å; I75-L82 HydrophobicContact CD1-CG 4.04Å; L82-D84 PolarHBondContact O-N 2.88Å; L82-I85 PolarHBondContact O-N 3.09Å; L82-W86 WeakPolarHBondContact O-CB 3.3Å; L82-W86 PolarHBondContact O-N 3.39Å
83	S	91.2	Very high	93.2	Very high	66 Å²	66	80.5 Å²	80.5	46%	0.462	44%	0.444	S	S	.	.	H	α-helix	trans	-60.3	-32.8	174.5	54	0	0	0	0	113.1	R81 A87	R81-S83 WeakPolarHBondContact CB-OG 3.38Å; R81-S83 PolarHBondContact O-N 3.39Å; S83-A87 WeakPolarHBondContact O-CB 3.46Å; S83-A87 PolarHBondContact O-N 2.94Å
84	D	91.5	Very high	93.3	Very high	71 Å²	71	87.5 Å²	87.5	38%	0.38	46%	0.463	S	S	.	.	H	α-helix	trans	-77.9	-39.1	-174.7	-51.7	-25.7	0	0	0	110.4	R81 L82 W86 A87 K88	R81-D84 WeakPolarHBondContact CB-OD2 3.32Å; R81-D84 PolarHBondContact N-OD2 3.49Å; R81-D84 WeakPolarHBondContact O-CB 3.21Å; R81-D84 PolarHBondContact O-N 3.43Å; L82-D84 PolarHBondContact O-N 2.88Å; D84-W86 VanDerWaalsContact C-N 3.34Å; D84-A87 PolarHBondContact O-N 3.28Å; D84-K88 WeakPolarHBondContact O-CG 3.48Å; D84-K88 PolarHBondContact O-N 2.98Å
85	I	90.1	Very high	93.5	Very high	14 Å²	14	91.2 Å²	91.2	7%	0.072	48%	0.478	C	S	.	.	H	α-helix	trans	-64	-43.8	172.2	-60.3	175.4	0	0	0	109.8	M59 Q63 Y64 P71 I75 R81 L82 K88 T89	M59-I85 HydrophobicContact CB-CG2 4.47Å; Q63-I85 PolarHBondContact NE2-O 2.99Å; Q63-I85 VanDerWaalsContact NE2-O 3.15Å; Y64-I85 HydrophobicContact CE2-CD1 4.4Å; Y64-I85 HydrophobicContact CE2-CG1 4.47Å; P71-I85 HydrophobicContact CB-CD1 4.15Å; I75-I85 HydrophobicContact CD1-CD1 3.96Å; I75-I85 HydrophobicContact CG1-CD1 4.31Å; R81-I85 PolarHBondContact O-N 3.36Å; L82-I85 PolarHBondContact O-N 3.09Å; I85-K88 PolarHBondContact O-N 3.38Å; I85-T89 PolarHBondContact O-N 3.45Å; I85-T89 PolarHBondContact O-OG1 3.4Å
86	W	92.5	Very high	93.7	Very high	153 Å²	153	88.1 Å²	88.1	58%	0.58	46%	0.462	S	S	*	.	H	α-helix	trans	-64.2	-42.5	176.8	-174.1	-96.9	0	0	0	112.2	Y55 L82 D84 K88 T89 W182	Y55-W86 HydrophobicContact CE1-CE3 4.47Å; Y55-W86 HydrophobicContact CE2-CE3 4.4Å; Y55-W86 HydrophobicContact CE2-CZ3 4.16Å; Y55-W86 AromaticContact CZ-CE3 3.87Å; L82-W86 WeakPolarHBondContact O-CB 3.3Å; L82-W86 PolarHBondContact O-N 3.39Å; D84-W86 VanDerWaalsContact C-N 3.34Å; W86-K88 PolarHBondContact O-N 3.37Å; W86-T89 WeakPolarHBondContact O-CB 3.32Å; W86-T89 PolarHBondContact O-N 3.11Å; W86-T89 PolarHBondContact O-OG1 3.49Å; W86-W182 AromaticContact CH2-CH2 3.74Å; W86-W182 HydrophobicContact CH2-CH2 3.74Å; W86-W182 HydrophobicContact CH2-CZ2 4.09Å; W86-W182 AromaticContact CZ3-CH2 3.89Å; W86-W182 HydrophobicContact CZ3-CH2 3.89Å; W86-W182 HydrophobicContact CZ3-CZ2 4.27Å
87	A	93.4	Very high	93.9	Very high	82 Å²	82	85.7 Å²	85.7	68%	0.678	44%	0.442	S	S	*	.	H	α-helix	trans	-62.3	-28.9	179.4	0	0	0	0	0	113	S83 D84 T89	S83-A87 WeakPolarHBondContact O-CB 3.46Å; S83-A87 PolarHBondContact O-N 2.94Å; D84-A87 PolarHBondContact O-N 3.28Å; A87-T89 VanDerWaalsContact C-N 3.33Å
88	K	92.8	Very high	94	Very high	143 Å²	143	87.7 Å²	87.7	62%	0.622	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-9.3	174.9	-69.4	175.7	-176	176.5	0	113.7	D84 I85 W86 P90	D84-K88 WeakPolarHBondContact O-CG 3.48Å; D84-K88 PolarHBondContact O-N 2.98Å; I85-K88 PolarHBondContact O-N 3.38Å; W86-K88 PolarHBondContact O-N 3.37Å; K88-P90 VanDerWaalsContact O-CD 3.25Å; K88-P90 WeakPolarHBondContact O-CD 3.35Å
89	T	94.6	Very high	94.3	Very high	15 Å²	15	86.9 Å²	86.9	9%	0.092	43%	0.426	C	S	.	.	S	Bend	trans	-72.1	120.7	-177.5	-62.2	0	0	0	0	110.3	Y55 M59 I85 W86 A87 I178 W182	Y55-T89 HydrophobicContact CE2-CG2 3.72Å; Y55-T89 PolarHBondContact OH-OG1 2.92Å; M59-T89 HydrophobicContact SD-CG2 4.14Å; I85-T89 PolarHBondContact O-N 3.45Å; I85-T89 PolarHBondContact O-OG1 3.4Å; W86-T89 WeakPolarHBondContact O-CB 3.32Å; W86-T89 PolarHBondContact O-N 3.11Å; W86-T89 PolarHBondContact O-OG1 3.49Å; A87-T89 VanDerWaalsContact C-N 3.33Å; T89-I178 HydrophobicContact CG2-CG2 4.19Å; T89-W182 HydrophobicContact CG2-CZ2 3.79Å
90	P	95.5	Very high	94.6	Very high	43 Å²	43	80.2 Å²	80.2	28%	0.279	40%	0.401	S	S	.	.	P	Polyproline II helix	trans	-56	126.5	174.7	-28.4	36.6	0	0	0	111.8	K88 I178 P179 W182	K88-P90 VanDerWaalsContact O-CD 3.25Å; K88-P90 WeakPolarHBondContact O-CD 3.35Å; P90-I178 HydrophobicContact CB-CB 4.22Å; P90-I178 HydrophobicContact CB-CG2 4.15Å; P90-I178 HydrophobicContact CG-CB 4.16Å; P90-I178 HydrophobicContact CG-CD1 3.85Å; P90-I178 HydrophobicContact CG-CG2 4.26Å; P90-P179 HydrophobicContact CB-CG 4.15Å; P90-W182 PolarHBondContact O-NE1 3.49Å; P90-W182 VanDerWaalsContact O-NE1 3.11Å
91	P	96.2	Very high	94.9	Very high	93 Å²	93	83.7 Å²	83.7	60%	0.604	42%	0.421	S	S	*	.	P	Polyproline II helix	trans	-73.3	169.1	176.4	31.9	-35.6	0	0	0	110.7	T93	P91-T93 PolarHBondContact O-N 2.97Å
92	I	96.2	Very high	95.1	Very high	86 Å²	86	80.7 Å²	80.7	44%	0.441	42%	0.418	S	S	.	.	P	Polyproline II helix	trans	-58.2	131.1	169.2	-168.8	169	0	0	0	110.2	W182 I186	I92-W182 HydrophobicContact CB-CB 4.32Å; I92-I186 HydrophobicContact CD1-CD1 3.98Å
93	T	97.6	Very high	95.5	Very high	51 Å²	51	77.2 Å²	77.2	31%	0.313	40%	0.397	S	S	.	.			trans	-109.6	152.8	178.4	70.9	0	0	0	0	110.6	P91 K95 A96 A97 P179	P91-T93 PolarHBondContact O-N 2.97Å; T93-K95 PolarHBondContact O-N 3.31Å; T93-A96 PolarHBondContact O-N 3.04Å; T93-A96 WeakPolarHBondContact OG1-CB 3.41Å; T93-A96 PolarHBondContact OG1-N 3.22Å; T93-A96 VanDerWaalsContact OG1-N 3.1Å; T93-A97 PolarHBondContact O-N 3.32Å; T93-P179 HydrophobicContact CG2-CB 4.28Å; T93-P179 HydrophobicContact CG2-CG 4.02Å
94	R	97.4	Very high	95.8	Very high	210 Å²	210	75.2 Å²	75.2	79%	0.792	38%	0.382	S	S	*	.	H	α-helix	trans	-56.2	-41.2	174.1	-177.6	-176.7	-71.4	-167.1	-1.7	111.3	A97 Q98	R94-A97 PolarHBondContact O-N 2.92Å; R94-Q98 HydrophobicContact CG-CG 4.48Å; R94-Q98 WeakPolarHBondContact O-CB 3.26Å; R94-Q98 VanDerWaalsContact O-CG 3.3Å; R94-Q98 WeakPolarHBondContact O-CG 3.48Å; R94-Q98 PolarHBondContact O-N 2.87Å
95	K	96.9	Very high	96.1	Very high	112 Å²	112	75 Å²	75	49%	0.487	38%	0.384	S	S	.	.	H	α-helix	trans	-60.4	-49.4	178.3	-176.5	177.3	178.4	178.7	0	111.2	T93 A97 Q98 L99	T93-K95 PolarHBondContact O-N 3.31Å; K95-A97 PolarHBondContact O-N 3.43Å; K95-Q98 PolarHBondContact O-N 2.85Å; K95-L99 HydrophobicContact CG-CD1 3.99Å; K95-L99 HydrophobicContact CG-CG 4.44Å; K95-L99 WeakPolarHBondContact O-CB 3.33Å; K95-L99 VanDerWaalsContact O-CG 3.26Å; K95-L99 WeakPolarHBondContact O-CG 3.41Å; K95-L99 PolarHBondContact O-N 3.11Å
96	A	97.6	Very high	96.5	Very high	0 Å²	0	77.1 Å²	77.1	0%	0	39%	0.392	C	S	.	.	H	α-helix	trans	-63.1	-41.8	178.9	0	0	0	0	0	112.4	T93 Q98 L99 Y100 N176 P179 L180	T93-A96 PolarHBondContact O-N 3.04Å; T93-A96 WeakPolarHBondContact OG1-CB 3.41Å; T93-A96 PolarHBondContact OG1-N 3.22Å; T93-A96 VanDerWaalsContact OG1-N 3.1Å; A96-Q98 VanDerWaalsContact C-N 3.34Å; A96-Q98 PolarHBondContact O-N 2.84Å; A96-L99 PolarHBondContact O-N 2.98Å; A96-Y100 WeakPolarHBondContact O-CB 3.47Å; A96-Y100 PolarHBondContact O-N 3.26Å; A96-N176 HydrophobicContact CB-CB 4.41Å; A96-P179 HydrophobicContact CB-CB 3.34Å; A96-L180 HydrophobicContact CB-CD2 4.21Å; A96-L180 HydrophobicContact CB-CG 4.39Å
97	A	97.9	Very high	96.8	Very high	33 Å²	33	69.9 Å²	69.9	27%	0.273	37%	0.365	S	S	.	.	H	α-helix	trans	-60.8	-42.7	175.7	0	0	0	0	0	112.1	T93 R94 K95 T101	T93-A97 PolarHBondContact O-N 3.32Å; R94-A97 PolarHBondContact O-N 2.92Å; K95-A97 PolarHBondContact O-N 3.43Å; A97-T101 VanDerWaalsContact O-CB 3.27Å; A97-T101 WeakPolarHBondContact O-CB 3.35Å; A97-T101 PolarHBondContact O-N 2.86Å; A97-T101 PolarHBondContact O-OG1 3.47Å
98	Q	97.8	Very high	96.9	Very high	121 Å²	121	68.1 Å²	68.1	57%	0.565	35%	0.346	S	S	*	.	H	α-helix	trans	-64.4	-46.8	175.5	-74.1	172.4	-31.6	0	0	111.9	R94 K95 A96 T101 L102	R94-Q98 HydrophobicContact CG-CG 4.48Å; R94-Q98 WeakPolarHBondContact O-CB 3.26Å; R94-Q98 VanDerWaalsContact O-CG 3.3Å; R94-Q98 WeakPolarHBondContact O-CG 3.48Å; R94-Q98 PolarHBondContact O-N 2.87Å; K95-Q98 PolarHBondContact O-N 2.85Å; A96-Q98 VanDerWaalsContact C-N 3.34Å; A96-Q98 PolarHBondContact O-N 2.84Å; Q98-T101 PolarHBondContact O-N 3.35Å; Q98-L102 VanDerWaalsContact O-CB 3.31Å; Q98-L102 WeakPolarHBondContact O-CB 3.11Å; Q98-L102 PolarHBondContact O-N 3.03Å
99	L	97.3	Very high	97.2	Very high	48 Å²	48	65.9 Å²	65.9	25%	0.251	34%	0.34	S	S	.	.	H	α-helix	trans	-60.1	-47.8	178.5	-71.6	170.4	0	0	0	111.6	K95 A96 L102 W103 I172 L180	K95-L99 HydrophobicContact CG-CD1 3.99Å; K95-L99 HydrophobicContact CG-CG 4.44Å; K95-L99 WeakPolarHBondContact O-CB 3.33Å; K95-L99 VanDerWaalsContact O-CG 3.26Å; K95-L99 WeakPolarHBondContact O-CG 3.41Å; K95-L99 PolarHBondContact O-N 3.11Å; A96-L99 PolarHBondContact O-N 2.98Å; L99-L102 PolarHBondContact O-N 3.1Å; L99-W103 WeakPolarHBondContact O-CB 3.41Å; L99-W103 PolarHBondContact O-N 3.29Å; L99-I172 HydrophobicContact CD1-CD1 3.77Å; L99-I172 HydrophobicContact CD1-CG1 3.71Å; L99-I172 HydrophobicContact CD2-CD1 3.58Å; L99-I172 HydrophobicContact CD2-CG1 4.33Å; L99-I172 HydrophobicContact CG-CD1 4.32Å; L99-L180 HydrophobicContact CB-CD2 4.47Å
100	Y	97.4	Very high	97.3	Very high	29 Å²	29	65.9 Å²	65.9	11%	0.114	34%	0.339	C	S	.	.	H	α-helix	trans	-67	-40.4	-179.1	-160.5	-106.2	0	0	0	111.8	A96 W103 V104 L180 C183 A184 L187	A96-Y100 WeakPolarHBondContact O-CB 3.47Å; A96-Y100 PolarHBondContact O-N 3.26Å; Y100-W103 WeakPolarHBondContact O-CB 3.49Å; Y100-W103 PolarHBondContact O-N 3.05Å; Y100-V104 HydrophobicContact CD1-CG2 4.13Å; Y100-V104 HydrophobicContact CE1-CG2 3.91Å; Y100-V104 VanDerWaalsContact O-CG2 3.31Å; Y100-V104 WeakPolarHBondContact O-CG2 3.42Å; Y100-V104 PolarHBondContact O-N 3.46Å; Y100-L180 HydrophobicContact CD2-CD2 4Å; Y100-L180 HydrophobicContact CG-CD2 4.37Å; Y100-C183 HydrophobicContact CD1-CB 3.54Å; Y100-C183 HydrophobicContact CD2-CB 4.29Å; Y100-C183 HydrophobicContact CE1-CB 4.17Å; Y100-C183 HydrophobicContact CG-CB 3.6Å; Y100-A184 HydrophobicContact CE2-CB 4.22Å; Y100-A184 WeakPolarHBondContact OH-CA 3.47Å; Y100-L187 HydrophobicContact CE1-CB 3.92Å; Y100-L187 HydrophobicContact CE1-CD2 3.67Å; Y100-L187 HydrophobicContact CE1-CG 4.45Å
101	T	97.7	Very high	97.3	Very high	86 Å²	86	64.2 Å²	64.2	53%	0.528	33%	0.327	S	S	.	.	H	α-helix	trans	-63.4	-43.7	175.3	-57.9	0	0	0	0	111.3	A97 Q98 T105	A97-T101 VanDerWaalsContact O-CB 3.27Å; A97-T101 WeakPolarHBondContact O-CB 3.35Å; A97-T101 PolarHBondContact O-N 2.86Å; A97-T101 PolarHBondContact O-OG1 3.47Å; Q98-T101 PolarHBondContact O-N 3.35Å; T101-T105 VanDerWaalsContact O-CB 3.23Å; T101-T105 WeakPolarHBondContact O-CB 3.31Å; T101-T105 PolarHBondContact O-N 3.38Å; T101-T105 PolarHBondContact O-OG1 3.38Å
102	L	97.3	Very high	97.2	Very high	122 Å²	122	63.3 Å²	63.3	64%	0.639	32%	0.32	S	S	*	.	H	α-helix	trans	-62.8	-44.6	176.4	-178.4	64.8	0	0	0	111.1	Q98 L99 T105 F106	Q98-L102 VanDerWaalsContact O-CB 3.31Å; Q98-L102 WeakPolarHBondContact O-CB 3.11Å; Q98-L102 PolarHBondContact O-N 3.03Å; L99-L102 PolarHBondContact O-N 3.1Å; L102-T105 PolarHBondContact O-N 3.12Å; L102-F106 WeakPolarHBondContact O-CB 3.39Å; L102-F106 PolarHBondContact O-N 3.37Å
103	W	97.2	Very high	97.1	Very high	43 Å²	43	63.2 Å²	63.2	16%	0.163	33%	0.328	C	S	.	.	H	α-helix	trans	-56.6	-54.6	176	165.5	-116.8	0	0	0	112	L99 Y100 T105 F106 Q107 T154 V246 A247 L250	L99-W103 WeakPolarHBondContact O-CB 3.41Å; L99-W103 PolarHBondContact O-N 3.29Å; Y100-W103 WeakPolarHBondContact O-CB 3.49Å; Y100-W103 PolarHBondContact O-N 3.05Å; W103-T105 PolarHBondContact O-N 3.33Å; W103-F106 PolarHBondContact O-N 2.85Å; W103-Q107 HydrophobicContact CD2-CG 4Å; W103-Q107 HydrophobicContact CE3-CG 4.02Å; W103-Q107 VanDerWaalsContact CH2-CD 3.47Å; W103-Q107 HydrophobicContact CH2-CG 3.6Å; W103-Q107 HydrophobicContact CZ2-CG 3.55Å; W103-Q107 HydrophobicContact CZ3-CG 3.85Å; W103-Q107 WeakPolarHBondContact O-CG 3.3Å; W103-Q107 PolarHBondContact O-N 3.15Å; W103-T154 HydrophobicContact CH2-CG2 4.05Å; W103-T154 HydrophobicContact CZ3-CG2 3.67Å; W103-V246 HydrophobicContact CH2-CB 4.06Å; W103-V246 HydrophobicContact CH2-CG1 3.79Å; W103-V246 HydrophobicContact CZ2-CB 4.41Å; W103-A247 HydrophobicContact CZ2-CB 3.76Å; W103-L250 HydrophobicContact CE3-CD1 4.46Å; W103-L250 HydrophobicContact CH2-CD1 3.85Å; W103-L250 HydrophobicContact CZ3-CD1 3.65Å
104	V	97.7	Very high	96.9	Very high	24 Å²	24	62.1 Å²	62.1	15%	0.145	32%	0.32	C	S	.	.	H	α-helix	trans	-64.2	-43.5	-178.2	174.9	0	0	0	0	110.5	Y100 F106 Q107 V108 L187	Y100-V104 HydrophobicContact CD1-CG2 4.13Å; Y100-V104 HydrophobicContact CE1-CG2 3.91Å; Y100-V104 VanDerWaalsContact O-CG2 3.31Å; Y100-V104 WeakPolarHBondContact O-CG2 3.42Å; Y100-V104 PolarHBondContact O-N 3.46Å; V104-F106 PolarHBondContact O-N 2.87Å; V104-Q107 PolarHBondContact O-N 3.49Å; V104-V108 HydrophobicContact CG1-CG2 4.44Å; V104-V108 WeakPolarHBondContact O-CG2 3.16Å; V104-V108 PolarHBondContact O-N 3.33Å; V104-L187 HydrophobicContact CG1-CD2 4.37Å; V104-L187 HydrophobicContact CG2-CD2 3.78Å
105	T	97.9	Very high	96.6	Very high	68 Å²	68	54.8 Å²	54.8	42%	0.417	30%	0.299	S	S	.	.	H	α-helix	trans	-62	-44.2	177.8	-56.8	0	0	0	0	111.2	T101 L102 W103 Q107 V108 L109	T101-T105 VanDerWaalsContact O-CB 3.23Å; T101-T105 WeakPolarHBondContact O-CB 3.31Å; T101-T105 PolarHBondContact O-N 3.38Å; T101-T105 PolarHBondContact O-OG1 3.38Å; L102-T105 PolarHBondContact O-N 3.12Å; W103-T105 PolarHBondContact O-N 3.33Å; T105-Q107 PolarHBondContact O-N 3.47Å; T105-V108 PolarHBondContact O-N 3.16Å; T105-L109 HydrophobicContact CG2-CD1 4.35Å; T105-L109 WeakPolarHBondContact O-CG 3.37Å; T105-L109 PolarHBondContact O-N 3.21Å
106	F	97.6	Very high	96.4	Very high	58 Å²	58	49.6 Å²	49.6	25%	0.254	28%	0.277	S	S	.	.	H	α-helix	trans	-59.8	-45.4	175.8	177.7	-114.2	0	0	0	111.5	L102 W103 V104 V108 L109 L110 T154 L157	L102-F106 WeakPolarHBondContact O-CB 3.39Å; L102-F106 PolarHBondContact O-N 3.37Å; W103-F106 PolarHBondContact O-N 2.85Å; V104-F106 PolarHBondContact O-N 2.87Å; F106-V108 PolarHBondContact O-N 2.89Å; F106-L109 PolarHBondContact O-N 2.96Å; F106-L110 HydrophobicContact CD1-CD1 4.1Å; F106-L110 HydrophobicContact CD2-CG 4.49Å; F106-L110 HydrophobicContact CE1-CD1 3.51Å; F106-L110 HydrophobicContact CE1-CG 4.22Å; F106-L110 HydrophobicContact CE2-CD1 4.24Å; F106-L110 HydrophobicContact CE2-CD2 4.12Å; F106-L110 HydrophobicContact CE2-CG 4.12Å; F106-L110 HydrophobicContact CZ-CD1 3.59Å; F106-L110 HydrophobicContact CZ-CD2 4.09Å; F106-L110 HydrophobicContact CZ-CG 3.97Å; F106-L110 WeakPolarHBondContact O-CG 3.49Å; F106-L110 PolarHBondContact O-N 3.14Å; F106-T154 HydrophobicContact CE1-CG2 4.47Å; F106-L157 HydrophobicContact CE2-CD1 4.26Å; F106-L157 HydrophobicContact CZ-CD1 3.68Å
107	Q	97.8	Very high	96.1	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-64.4	-37.8	175.8	-72.1	-52.8	-47.6	0	0	112.8	W103 V104 T105 L110 Y111 T154 F238 R242	W103-Q107 HydrophobicContact CD2-CG 4Å; W103-Q107 HydrophobicContact CE3-CG 4.02Å; W103-Q107 VanDerWaalsContact CH2-CD 3.47Å; W103-Q107 HydrophobicContact CH2-CG 3.6Å; W103-Q107 HydrophobicContact CZ2-CG 3.55Å; W103-Q107 HydrophobicContact CZ3-CG 3.85Å; W103-Q107 WeakPolarHBondContact O-CG 3.3Å; W103-Q107 PolarHBondContact O-N 3.15Å; V104-Q107 PolarHBondContact O-N 3.49Å; T105-Q107 PolarHBondContact O-N 3.47Å; Q107-L110 PolarHBondContact O-N 3.39Å; Q107-Y111 VanDerWaalsContact O-CB 3.27Å; Q107-Y111 WeakPolarHBondContact O-CB 3.32Å; Q107-Y111 PolarHBondContact O-N 3.09Å; Q107-T154 PolarHBondContact NE2-OG1 2.9Å; Q107-T154 VanDerWaalsContact NE2-OG1 3.15Å; Q107-F238 HydrophobicContact CB-CE2 4.22Å; Q107-F238 HydrophobicContact CB-CZ 4.3Å; Q107-R242 HydrophobicContact CB-CB 4.08Å; Q107-R242 HydrophobicContact CG-CB 4.41Å
108	V	97.4	Very high	95.8	Very high	46 Å²	46	54 Å²	54	28%	0.279	29%	0.292	S	S	.	.	H	α-helix	trans	-61.3	-45.6	172.9	168.5	0	0	0	0	110.6	V104 T105 F106 Y111 T112 F233 F238	V104-V108 HydrophobicContact CG1-CG2 4.44Å; V104-V108 WeakPolarHBondContact O-CG2 3.16Å; V104-V108 PolarHBondContact O-N 3.33Å; T105-V108 PolarHBondContact O-N 3.16Å; F106-V108 PolarHBondContact O-N 2.89Å; V108-Y111 PolarHBondContact O-N 3.15Å; V108-T112 HydrophobicContact CG1-CG2 4.34Å; V108-T112 WeakPolarHBondContact O-CB 3.48Å; V108-T112 WeakPolarHBondContact O-CG2 3.45Å; V108-T112 PolarHBondContact O-N 3.49Å; V108-T112 PolarHBondContact O-OG1 2.81Å; V108-F233 HydrophobicContact CG1-CE2 4.19Å; V108-F233 HydrophobicContact CG2-CE2 4.2Å; V108-F233 HydrophobicContact CG2-CZ 4.46Å; V108-F238 HydrophobicContact CB-CE2 4.48Å; V108-F238 HydrophobicContact CB-CZ 4.39Å; V108-F238 HydrophobicContact CG2-CE1 4.1Å; V108-F238 HydrophobicContact CG2-CE2 3.92Å; V108-F238 HydrophobicContact CG2-CZ 3.42Å; V108-F238 VanDerWaalsContact CG2-CZ 3.42Å
109	L	97.1	Very high	95.4	Very high	95 Å²	95	51.6 Å²	51.6	50%	0.497	28%	0.281	S	S	.	.	H	α-helix	trans	-61.8	-46	177.7	-70	173.4	0	0	0	111.5	T105 F106 T112 S113	T105-L109 HydrophobicContact CG2-CD1 4.35Å; T105-L109 WeakPolarHBondContact O-CG 3.37Å; T105-L109 PolarHBondContact O-N 3.21Å; F106-L109 PolarHBondContact O-N 2.96Å; L109-T112 PolarHBondContact O-N 3.47Å; L109-T112 PolarHBondContact O-OG1 3.32Å; L109-S113 WeakPolarHBondContact O-CA 3.32Å; L109-S113 WeakPolarHBondContact O-CB 3.47Å; L109-S113 PolarHBondContact O-N 3.43Å; L109-S113 PolarHBondContact O-OG 3.19Å
110	L	96.8	Very high	95.1	Very high	16 Å²	16	55.7 Å²	55.7	8%	0.084	30%	0.296	C	S	.	.	H	α-helix	trans	-61.3	-46.9	174.9	-66.7	-177.4	0	0	0	111.2	F106 Q107 T112 L114 N146 A150 L153	F106-L110 HydrophobicContact CD1-CD1 4.1Å; F106-L110 HydrophobicContact CD2-CG 4.49Å; F106-L110 HydrophobicContact CE1-CD1 3.51Å; F106-L110 HydrophobicContact CE1-CG 4.22Å; F106-L110 HydrophobicContact CE2-CD1 4.24Å; F106-L110 HydrophobicContact CE2-CD2 4.12Å; F106-L110 HydrophobicContact CE2-CG 4.12Å; F106-L110 HydrophobicContact CZ-CD1 3.59Å; F106-L110 HydrophobicContact CZ-CD2 4.09Å; F106-L110 HydrophobicContact CZ-CG 3.97Å; F106-L110 WeakPolarHBondContact O-CG 3.49Å; F106-L110 PolarHBondContact O-N 3.14Å; Q107-L110 PolarHBondContact O-N 3.39Å; L110-T112 VanDerWaalsContact C-N 3.34Å; L110-T112 PolarHBondContact O-N 3.28Å; L110-L114 HydrophobicContact CD2-CD2 4.27Å; L110-L114 WeakPolarHBondContact O-CB 3.45Å; L110-L114 PolarHBondContact O-N 3.42Å; L110-L114 VanDerWaalsContact O-N 3.13Å; L110-N146 PolarHBondContact O-ND2 3.28Å; L110-N146 VanDerWaalsContact O-ND2 3.07Å; L110-A150 HydrophobicContact CB-CB 4.13Å; L110-A150 HydrophobicContact CD1-CB 4.05Å; L110-L153 HydrophobicContact CD2-CD1 4.23Å
111	Y	96.4	Very high	94.9	Very high	7 Å²	7	62.1 Å²	62.1	3%	0.027	33%	0.325	C	S	.	.	H	α-helix	trans	-61.8	-41.1	-178.6	-177.2	-113.9	0	0	0	113	Q107 V108 N146 F233 D234 L237 F238 R242	Q107-Y111 VanDerWaalsContact O-CB 3.27Å; Q107-Y111 WeakPolarHBondContact O-CB 3.32Å; Q107-Y111 PolarHBondContact O-N 3.09Å; V108-Y111 PolarHBondContact O-N 3.15Å; Y111-N146 PolarHBondContact O-ND2 2.87Å; Y111-F233 AromaticContact CD1-CD2 3.7Å; Y111-F233 HydrophobicContact CD1-CD2 3.7Å; Y111-F233 AromaticContact CD1-CE2 3.83Å; Y111-F233 HydrophobicContact CD1-CE2 3.83Å; Y111-F233 HydrophobicContact CD1-CG 4.49Å; Y111-F233 AromaticContact CE1-CD2 3.9Å; Y111-F233 HydrophobicContact CE1-CD2 3.9Å; Y111-F233 HydrophobicContact CE1-CE2 4.25Å; Y111-F233 HydrophobicContact CE1-CG 4.24Å; Y111-D234 PolarHBondContact OH-N 3.45Å; Y111-L237 HydrophobicContact CE2-CD2 4.17Å; Y111-L237 HydrophobicContact CE2-CG 4.3Å; Y111-F238 HydrophobicContact CD1-CB 4.15Å; Y111-F238 AromaticContact CD1-CD2 3.62Å; Y111-F238 HydrophobicContact CD1-CD2 3.62Å; Y111-F238 HydrophobicContact CD1-CE2 4.5Å; Y111-F238 HydrophobicContact CD1-CG 4.24Å; Y111-F238 HydrophobicContact CD2-CD2 4.24Å; Y111-F238 HydrophobicContact CE1-CB 3.89Å; Y111-F238 HydrophobicContact CE1-CD2 4.25Å; Y111-F238 HydrophobicContact CE1-CG 4.47Å; Y111-F238 AromaticContact CG-CD2 3.61Å; Y111-F238 HydrophobicContact CG-CD2 3.61Å; Y111-F238 HydrophobicContact CG-CE2 4.35Å; Y111-R242 HydrophobicContact CD2-CG 4.1Å; Y111-R242 HydrophobicContact CG-CG 4.43Å
112	T	94.4	Very high	94.6	Very high	74 Å²	74	60.8 Å²	60.8	45%	0.454	32%	0.315	S	S	.	.	H	α-helix	trans	-87.6	-36.4	-174.5	53.7	0	0	0	0	114	V108 L109 L110 F233	V108-T112 HydrophobicContact CG1-CG2 4.34Å; V108-T112 WeakPolarHBondContact O-CB 3.48Å; V108-T112 WeakPolarHBondContact O-CG2 3.45Å; V108-T112 PolarHBondContact O-N 3.49Å; V108-T112 PolarHBondContact O-OG1 2.81Å; L109-T112 PolarHBondContact O-N 3.47Å; L109-T112 PolarHBondContact O-OG1 3.32Å; L110-T112 VanDerWaalsContact C-N 3.34Å; L110-T112 PolarHBondContact O-N 3.28Å; T112-F233 HydrophobicContact CG2-CD2 3.69Å; T112-F233 HydrophobicContact CG2-CE2 4.33Å
113	S	93.6	Very high	94.3	Very high	85 Å²	85	60.7 Å²	60.7	59%	0.594	32%	0.321	S	S	*	.	H	α-helix	trans	-108.5	-18.4	-166.2	-49.7	0	0	0	0	113.1	L109 P115	L109-S113 WeakPolarHBondContact O-CA 3.32Å; L109-S113 WeakPolarHBondContact O-CB 3.47Å; L109-S113 PolarHBondContact O-N 3.43Å; L109-S113 PolarHBondContact O-OG 3.19Å; S113-P115 WeakPolarHBondContact O-CD 3.38Å
114	L	93.6	Very high	93.7	Very high	28 Å²	28	62 Å²	62	15%	0.147	35%	0.348	C	S	.	.			trans	-83.2	110.1	-179.2	-167.4	69.8	0	0	0	110.3	L110 N146 Q149 A150 L153	L110-L114 HydrophobicContact CD2-CD2 4.27Å; L110-L114 WeakPolarHBondContact O-CB 3.45Å; L110-L114 PolarHBondContact O-N 3.42Å; L110-L114 VanDerWaalsContact O-N 3.13Å; L114-N146 PolarHBondContact O-ND2 2.94Å; L114-Q149 VanDerWaalsContact CD1-NE2 3.32Å; L114-Q149 HydrophobicContact CD2-CB 4.04Å; L114-Q149 HydrophobicContact CD2-CG 3.9Å; L114-A150 HydrophobicContact CD2-CB 4.28Å; L114-L153 HydrophobicContact CD1-CD1 3.75Å; L114-L153 HydrophobicContact CD2-CD1 3.78Å; L114-L153 HydrophobicContact CG-CD1 4.42Å
115	P	91.3	Very high	93.5	Very high	56 Å²	56	61.3 Å²	61.3	36%	0.364	34%	0.343	S	S	.	.			trans	-66.6	145.1	165.1	31	-35.9	0	0	0	109.2	S113 F117 Q149	S113-P115 WeakPolarHBondContact O-CD 3.38Å; P115-F117 HydrophobicContact CB-CE2 4.35Å; P115-F117 HydrophobicContact CB-CZ 4.33Å; P115-F117 HydrophobicContact CG-CD2 4.1Å; P115-F117 HydrophobicContact CG-CE1 4.39Å; P115-F117 HydrophobicContact CG-CE2 3.39Å; P115-F117 HydrophobicContact CG-CZ 3.55Å; P115-F117 PolarHBondContact O-N 2.75Å; P115-Q149 PolarHBondContact O-NE2 3.21Å; P115-Q149 VanDerWaalsContact O-NE2 3.16Å; P115-Q149 PolarHBondContact O-OE1 3.37Å
116	D	91.6	Very high	93.2	Very high	3 Å²	3	60.4 Å²	60.4	2%	0.016	34%	0.337	C	S	.	.			trans	-78.7	112.5	171.2	-176.8	69.2	0	0	0	108.4	H119 Y125 G128 Q144 I145 N146	D116-H119 PolarHBondContact O-CE1 2.99Å; D116-H119 PolarHBondContact O-ND1 3.48Å; D116-H119 WeakPolarHBondContact OD2-CB 3.24Å; D116-H119 IonicContact OD2-CE1 3.37Å; D116-H119 IonicContact OD2-CG 2.83Å; D116-H119 VanDerWaalsContact OD2-CG 3.3Å; D116-H119 PolarHBondContact OD2-N 3.27Å; D116-H119 IonicContact OD2-ND1 2.81Å; D116-H119 PolarHBondContact OD2-ND1 3.29Å; D116-Y125 PolarHBondContact OD1-OH 3.02Å; D116-Y125 WeakPolarHBondContact OD2-CE1 3.45Å; D116-G128 PolarHBondContact OD2-N 2.69Å; D116-G128 VanDerWaalsContact OD2-N 3.17Å; D116-Q144 VanDerWaalsContact N-NE2 3.16Å; D116-I145 WeakPolarHBondContact CB-O 3.43Å; D116-N146 HydrophobicContact CB-CB 3.89Å
117	F	92.1	Very high	92.9	Very high	104 Å²	104	57.8 Å²	57.8	46%	0.456	33%	0.326	S	S	.	.			trans	-95.2	-23.5	171	-68.8	-68	0	0	0	111.3	P115 H119 K120 F121	P115-F117 HydrophobicContact CB-CE2 4.35Å; P115-F117 HydrophobicContact CB-CZ 4.33Å; P115-F117 HydrophobicContact CG-CD2 4.1Å; P115-F117 HydrophobicContact CG-CE1 4.39Å; P115-F117 HydrophobicContact CG-CE2 3.39Å; P115-F117 HydrophobicContact CG-CZ 3.55Å; P115-F117 PolarHBondContact O-N 2.75Å; F117-H119 VanDerWaalsContact C-N 3.28Å; F117-H119 PolarHBondContact O-N 2.81Å; F117-K120 WeakPolarHBondContact O-CB 3.29Å; F117-K120 PolarHBondContact O-N 3.41Å; F117-F121 WeakPolarHBondContact O-CD2 3.45Å
118	C	90.8	Very high	92.7	Very high	20 Å²	20	58 Å²	58	14%	0.135	33%	0.328	C	S	.	.	H	α-helix	trans	-54.8	-39.3	-179.2	-73.3	0	0	0	0	112.6	K120 F121 L122 Y125	C118-K120 PolarHBondContact O-N 3.11Å; C118-K120 VanDerWaalsContact O-N 3.13Å; C118-F121 PolarHBondContact O-N 3.23Å; C118-L122 HydrophobicContact CB-CD1 3.84Å; C118-L122 HydrophobicContact CB-CG 4.45Å; C118-L122 WeakPolarHBondContact O-CB 3.39Å; C118-L122 WeakPolarHBondContact O-CG 3.17Å; C118-L122 PolarHBondContact O-N 2.89Å; C118-Y125 HydrophobicContact CB-CD1 3.94Å; C118-Y125 HydrophobicContact CB-CE1 3.62Å
119	H	90.4	Very high	92.6	Very high	71 Å²	71	60.4 Å²	60.4	33%	0.329	34%	0.339	S	S	.	.	H	α-helix	trans	-62.3	-19.8	178.1	74.5	-88.7	0	0	0	114.9	D116 F117 Y125	D116-H119 PolarHBondContact O-CE1 2.99Å; D116-H119 PolarHBondContact O-ND1 3.48Å; D116-H119 WeakPolarHBondContact OD2-CB 3.24Å; D116-H119 IonicContact OD2-CE1 3.37Å; D116-H119 IonicContact OD2-CG 2.83Å; D116-H119 VanDerWaalsContact OD2-CG 3.3Å; D116-H119 PolarHBondContact OD2-N 3.27Å; D116-H119 IonicContact OD2-ND1 2.81Å; D116-H119 PolarHBondContact OD2-ND1 3.29Å; F117-H119 VanDerWaalsContact C-N 3.28Å; F117-H119 PolarHBondContact O-N 2.81Å; H119-Y125 HydrophobicContact CB-CD1 4.09Å; H119-Y125 HydrophobicContact CB-CE1 4.19Å
120	K	91.5	Very high	92.5	Very high	134 Å²	134	58.5 Å²	58.5	58%	0.583	33%	0.328	S	S	*	.	H	α-helix	trans	-80.2	-26.5	-179.8	-61.1	-174.6	179.7	-179.5	0	112.5	F117 C118	F117-K120 WeakPolarHBondContact O-CB 3.29Å; F117-K120 PolarHBondContact O-N 3.41Å; C118-K120 PolarHBondContact O-N 3.11Å; C118-K120 VanDerWaalsContact O-N 3.13Å
121	F	92.4	Very high	92.4	Very high	164 Å²	164	63.9 Å²	63.9	72%	0.719	35%	0.352	S	S	*	.	H	α-helix	trans	-118.5	-24.5	-170.4	-56.5	-74.8	0	0	0	113.7	F117 C118 P123	F117-F121 WeakPolarHBondContact O-CD2 3.45Å; C118-F121 PolarHBondContact O-N 3.23Å; F121-P123 VanDerWaalsContact O-CD 3.29Å; F121-P123 WeakPolarHBondContact O-CD 3.48Å
122	L	92.3	Very high	92.2	Very high	59 Å²	59	64.1 Å²	64.1	31%	0.309	36%	0.357	S	S	.	.	S	Bend	trans	-89.8	111.1	-178.8	-64.1	-178.8	0	0	0	110.7	C118 G124 Y125 L148 W286	C118-L122 HydrophobicContact CB-CD1 3.84Å; C118-L122 HydrophobicContact CB-CG 4.45Å; C118-L122 WeakPolarHBondContact O-CB 3.39Å; C118-L122 WeakPolarHBondContact O-CG 3.17Å; C118-L122 PolarHBondContact O-N 2.89Å; L122-G124 PolarHBondContact O-N 3.1Å; L122-Y125 HydrophobicContact CB-CD1 4.47Å; L122-Y125 HydrophobicContact CB-CG 4.5Å; L122-Y125 HydrophobicContact CD1-CD1 4.41Å; L122-Y125 PolarHBondContact O-N 3.26Å; L122-L148 HydrophobicContact CD1-CD2 3.91Å; L122-W286 HydrophobicContact CB-CH2 4.19Å; L122-W286 HydrophobicContact CD1-CH2 4.35Å; L122-W286 HydrophobicContact CD1-CZ3 3.95Å
123	P	89.9	Confident	91.9	Very high	119 Å²	119	62.8 Å²	62.8	77%	0.773	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	131.8	178.4	-20.4	33.7	0	0	0	111.1	F121 Y125	F121-P123 VanDerWaalsContact O-CD 3.29Å; F121-P123 WeakPolarHBondContact O-CD 3.48Å; P123-Y125 PolarHBondContact O-N 3.49Å
124	G	85.4	Confident	91.6	Very high	70 Å²	70	63.5 Å²	63.5	72%	0.722	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.7	-7.3	177	0	0	0	0	0	115.7	L122	L122-G124 PolarHBondContact O-N 3.1Å
125	Y	92.4	Very high	91.3	Very high	10 Å²	10	62.5 Å²	62.5	4%	0.039	35%	0.349	C	S	.	.			trans	-78.2	129.9	169.7	173.8	-115.4	0	0	0	110	D116 C118 H119 L122 P123 L148 W286	D116-Y125 PolarHBondContact OD1-OH 3.02Å; D116-Y125 WeakPolarHBondContact OD2-CE1 3.45Å; C118-Y125 HydrophobicContact CB-CD1 3.94Å; C118-Y125 HydrophobicContact CB-CE1 3.62Å; H119-Y125 HydrophobicContact CB-CD1 4.09Å; H119-Y125 HydrophobicContact CB-CE1 4.19Å; L122-Y125 HydrophobicContact CB-CD1 4.47Å; L122-Y125 HydrophobicContact CB-CG 4.5Å; L122-Y125 HydrophobicContact CD1-CD1 4.41Å; L122-Y125 PolarHBondContact O-N 3.26Å; P123-Y125 PolarHBondContact O-N 3.49Å; Y125-L148 HydrophobicContact CD2-CD2 4.05Å; Y125-L148 HydrophobicContact CE2-CB 4.04Å; Y125-L148 HydrophobicContact CE2-CD2 3.93Å; Y125-L148 HydrophobicContact CG-CD2 4.45Å; Y125-W286 HydrophobicContact CD2-CD2 4.31Å; Y125-W286 HydrophobicContact CD2-CG 4.41Å; Y125-W286 VanDerWaalsContact CD2-O 3.22Å; Y125-W286 WeakPolarHBondContact CD2-O 3.46Å
126	V	91.6	Very high	90.8	Very high	49 Å²	49	62.7 Å²	62.7	30%	0.297	35%	0.35	S	S	.	.			trans	-108.9	96.3	178.4	-175.2	0	0	0	0	108.1	T289	V126-T289 HydrophobicContact CG1-CG2 3.95Å; V126-T289 PolarHBondContact O-OG1 3.26Å
127	G	92.6	Very high	90.4	Very high	3 Å²	3	63.4 Å²	63.4	3%	0.031	36%	0.357	C	S	.	.			trans	-123.3	-162	176.7	0	0	0	0	0	112.5	Q130	G127-Q130 PolarHBondContact O-NE2 3.41Å
128	G	94.1	Very high	90	Very high	4 Å²	4	61 Å²	61	4%	0.041	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	75.3	-155.2	-179.3	0	0	0	0	0	113.2	D116 Q130 I145	D116-G128 PolarHBondContact OD2-N 2.69Å; D116-G128 VanDerWaalsContact OD2-N 3.17Å; G128-Q130 PolarHBondContact O-N 3.02Å; G128-I145 PolarHBondContact N-O 3.3Å; G128-I145 WeakPolarHBondContact O-CB 3.3Å; G128-I145 PolarHBondContact O-N 2.78Å
129	I	95	Very high	89.8	Confident	97 Å²	97	62 Å²	62	50%	0.497	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	117.2	-179.3	-60.4	172.7	0	0	0	109.2	K142 Y143 W232	I129-K142 HydrophobicContact CG2-CB 4.26Å; I129-K142 HydrophobicContact CG2-CD 4.28Å; I129-Y143 CarbonylContact C-O 3.58Å; I129-Y143 WeakPolarHBondContact CA-O 3.18Å; I129-W232 HydrophobicContact CD1-CH2 4.02Å; I129-W232 HydrophobicContact CG1-CH2 4.4Å; I129-W232 HydrophobicContact CG1-CZ3 4.46Å; I129-W232 HydrophobicContact CG2-CH2 4.36Å; I129-W232 HydrophobicContact CG2-CZ3 4.32Å
130	Q	95.2	Very high	89.8	Confident	56 Å²	56	61.6 Å²	61.6	26%	0.262	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	151.1	179	-60.5	-60.6	-38.2	0	0	111	G127 G128 K142 Y143 I145 T289 L292	G127-Q130 PolarHBondContact O-NE2 3.41Å; G128-Q130 PolarHBondContact O-N 3.02Å; Q130-K142 WeakPolarHBondContact O-CA 3.37Å; Q130-Y143 PolarHBondContact N-O 2.66Å; Q130-Y143 PolarHBondContact O-N 3.43Å; Q130-I145 HydrophobicContact CB-CG1 3.91Å; Q130-I145 HydrophobicContact CG-CB 4.38Å; Q130-I145 HydrophobicContact CG-CG1 3.73Å; Q130-T289 HydrophobicContact CB-CG2 4.17Å; Q130-T289 HydrophobicContact CG-CG2 3.9Å; Q130-L292 HydrophobicContact CB-CD1 4.1Å
131	E	94.3	Very high	89.9	Confident	128 Å²	128	56.3 Å²	56.3	60%	0.598	35%	0.347	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.2	133.9	174.6	-63.5	-172	158.1	0	0	110.3	V140	E131-V140 HydrophobicContact CB-CG1 3.93Å; E131-V140 HydrophobicContact CG-CG1 4.27Å
132	G	91.6	Very high	90	Very high	13 Å²	13	53.6 Å²	53.6	13%	0.134	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	-178.5	170.2	0	0	0	0	0	112.2	N141	G132-N141 PolarHBondContact N-O 3.29Å
133	A	88.3	Confident	90.1	Very high	45 Å²	45	51 Å²	51	37%	0.372	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	153	172.2	0	0	0	0	0	111.8	T135 C298	A133-T135 PolarHBondContact O-N 3.15Å; A133-C298 HydrophobicContact CB-CB 4.4Å; A133-C298 WeakPolarHBondContact CB-SG 3.32Å
134	V	87.8	Confident	90.3	Very high	101 Å²	101	47.1 Å²	47.1	61%	0.612	29%	0.292	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.7	120.4	170.5	-173.1	0	0	0	0	108	V139 V140	V134-V139 CarbonylContact C-O 3.57Å; V134-V139 WeakPolarHBondContact CA-O 3.25Å; V134-V140 HydrophobicContact CB-CG2 4.42Å; V134-V140 HydrophobicContact CG2-CG2 3.83Å
135	T	87.4	Confident	90.9	Very high	6 Å²	6	43.8 Å²	43.8	4%	0.037	26%	0.258	C	S	.	.	P	Polyproline II helix	trans	-67.6	161.4	173.6	75.5	0	0	0	0	109.8	A133 A137 G138 V139 D208 F225	A133-T135 PolarHBondContact O-N 3.15Å; T135-A137 PolarHBondContact O-N 3.37Å; T135-A137 VanDerWaalsContact O-N 3.17Å; T135-A137 PolarHBondContact OG1-N 3.01Å; T135-G138 WeakPolarHBondContact O-CA 3.22Å; T135-G138 PolarHBondContact O-N 3.34Å; T135-V139 HydrophobicContact CG2-CB 4.14Å; T135-V139 WeakPolarHBondContact CG2-O 3.35Å; T135-V139 PolarHBondContact N-O 2.96Å; T135-V139 WeakPolarHBondContact OG1-CB 3.48Å; T135-V139 PolarHBondContact OG1-N 2.81Å; T135-V139 VanDerWaalsContact OG1-N 3.09Å; T135-D208 VanDerWaalsContact CB-OD1 3.25Å; T135-D208 WeakPolarHBondContact CB-OD1 3.39Å; T135-D208 PolarHBondContact OG1-OD1 3.46Å; T135-D208 PolarHBondContact OG1-OD2 3.46Å; T135-F225 HydrophobicContact CG2-CD1 3.95Å; T135-F225 HydrophobicContact CG2-CE1 3.85Å
136	P	79.7	Confident	91	Very high	61 Å²	61	43.3 Å²	43.3	40%	0.396	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-19	177.7	-32.1	46.1	0	0	0	114.4	W29 G138	W29-P136 HydrophobicContact CB-CB 4.37Å; W29-P136 HydrophobicContact CB-CG 4.48Å; W29-P136 HydrophobicContact CD2-CB 3.18Å; W29-P136 HydrophobicContact CD2-CG 3.53Å; W29-P136 HydrophobicContact CE3-CB 3.46Å; W29-P136 VanDerWaalsContact CE3-CB 3.46Å; W29-P136 HydrophobicContact CE3-CG 3.23Å; W29-P136 HydrophobicContact CG-CB 3.68Å; W29-P136 HydrophobicContact CG-CG 4.15Å; W29-P136 HydrophobicContact CH2-CB 3.76Å; W29-P136 HydrophobicContact CH2-CG 3.97Å; W29-P136 HydrophobicContact CZ2-CB 3.59Å; W29-P136 HydrophobicContact CZ2-CG 4.29Å; W29-P136 HydrophobicContact CZ3-CB 3.7Å; W29-P136 HydrophobicContact CZ3-CG 3.44Å; W29-P136 VanDerWaalsContact CZ3-CG 3.44Å; P136-G138 PolarHBondContact O-N 3.23Å
137	A	83.1	Confident	91.2	Very high	18 Å²	18	41 Å²	41	15%	0.149	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.9	4.1	166.7	0	0	0	0	0	114.7	T135 V139 R207 D208	T135-A137 PolarHBondContact O-N 3.37Å; T135-A137 VanDerWaalsContact O-N 3.17Å; T135-A137 PolarHBondContact OG1-N 3.01Å; A137-V139 HydrophobicContact CB-CG2 4.41Å; A137-R207 HydrophobicContact CB-CB 3.47Å; A137-R207 VanDerWaalsContact CB-CB 3.47Å; A137-D208 WeakPolarHBondContact CB-OD1 3.27Å; A137-D208 WeakPolarHBondContact CB-OD2 3.14Å; A137-D208 PolarHBondContact N-OD1 3.37Å; A137-D208 VanDerWaalsContact N-OD1 3.13Å
138	G	83.9	Confident	91.4	Very high	53 Å²	53	41.1 Å²	41.1	55%	0.546	24%	0.242	S	C	.	.	S	Bend	trans	82.4	14.1	-179.2	0	0	0	0	0	114.7	T135 P136	T135-G138 WeakPolarHBondContact O-CA 3.22Å; T135-G138 PolarHBondContact O-N 3.34Å; P136-G138 PolarHBondContact O-N 3.23Å
139	V	86.9	Confident	91.5	Very high	42 Å²	42	42 Å²	42	26%	0.255	25%	0.245	S	C	.	.			trans	-86.2	135.7	-178	-177.6	0	0	0	0	110.1	V134 T135 A137	V134-V139 CarbonylContact C-O 3.57Å; V134-V139 WeakPolarHBondContact CA-O 3.25Å; T135-V139 HydrophobicContact CG2-CB 4.14Å; T135-V139 WeakPolarHBondContact CG2-O 3.35Å; T135-V139 PolarHBondContact N-O 2.96Å; T135-V139 WeakPolarHBondContact OG1-CB 3.48Å; T135-V139 PolarHBondContact OG1-N 2.81Å; T135-V139 VanDerWaalsContact OG1-N 3.09Å; A137-V139 HydrophobicContact CB-CG2 4.41Å
140	V	91.3	Very high	91.6	Very high	62 Å²	62	37.3 Å²	37.3	38%	0.376	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	108.2	170.6	-179.1	0	0	0	0	108.9	E131 V134	E131-V140 HydrophobicContact CB-CG1 3.93Å; E131-V140 HydrophobicContact CG-CG1 4.27Å; V134-V140 HydrophobicContact CB-CG2 4.42Å; V134-V140 HydrophobicContact CG2-CG2 3.83Å
141	N	92.5	Very high	91.7	Very high	23 Å²	23	36.1 Å²	36.1	12%	0.123	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	139.4	179.9	-77.6	-29.7	0	0	0	111.2	G132 Y143	G132-N141 PolarHBondContact N-O 3.29Å; N141-Y143 HydrophobicContact CB-CD2 4.37Å; N141-Y143 HydrophobicContact CB-CE2 3.53Å; N141-Y143 WeakPolarHBondContact O-CD2 3.39Å; N141-Y143 WeakPolarHBondContact O-CE2 3.35Å
142	K	94.7	Very high	91.8	Very high	107 Å²	107	33.1 Å²	33.1	47%	0.465	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	142.8	171.2	-63.9	-173.4	179.2	-173.9	0	110.6	I129 Q130 R228 W232	I129-K142 HydrophobicContact CG2-CB 4.26Å; I129-K142 HydrophobicContact CG2-CD 4.28Å; Q130-K142 WeakPolarHBondContact O-CA 3.37Å; K142-R228 PolarHBondContact O-NH1 2.87Å; K142-R228 PolarHBondContact O-NH2 2.97Å; K142-W232 HydrophobicContact CB-CH2 4.37Å; K142-W232 HydrophobicContact CB-CZ3 3.93Å
143	Y	95.1	Very high	92.1	Very high	3 Å²	3	35.6 Å²	35.6	1%	0.012	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	135.6	-177.2	-65.3	-96.3	0	0	0	109.8	I129 Q130 N141 R228 D234 L237 L292	I129-Y143 CarbonylContact C-O 3.58Å; I129-Y143 WeakPolarHBondContact CA-O 3.18Å; Q130-Y143 PolarHBondContact N-O 2.66Å; Q130-Y143 PolarHBondContact O-N 3.43Å; N141-Y143 HydrophobicContact CB-CD2 4.37Å; N141-Y143 HydrophobicContact CB-CE2 3.53Å; N141-Y143 WeakPolarHBondContact O-CD2 3.39Å; N141-Y143 WeakPolarHBondContact O-CE2 3.35Å; Y143-R228 PolarHBondContact OH-NH2 3.05Å; Y143-D234 HydrophobicContact CD1-CB 4.22Å; Y143-D234 HydrophobicContact CE1-CB 3.8Å; Y143-D234 VanDerWaalsContact CE1-CG 3.43Å; Y143-D234 WeakPolarHBondContact CE1-OD2 3.2Å; Y143-D234 PolarHBondContact OH-OD2 3.42Å; Y143-L237 HydrophobicContact CD1-CB 4.3Å; Y143-L237 HydrophobicContact CD1-CD2 3.63Å; Y143-L237 HydrophobicContact CE1-CB 4.36Å; Y143-L237 HydrophobicContact CE1-CD2 4.45Å; Y143-L237 HydrophobicContact CG-CD2 4.35Å; Y143-L292 HydrophobicContact CD1-CD2 3.68Å; Y143-L292 HydrophobicContact CD2-CD1 3.86Å; Y143-L292 HydrophobicContact CD2-CD2 3.82Å; Y143-L292 HydrophobicContact CD2-CG 4.46Å; Y143-L292 HydrophobicContact CE1-CD2 3.91Å; Y143-L292 HydrophobicContact CE2-CD2 4.12Å; Y143-L292 HydrophobicContact CG-CD1 4.03Å; Y143-L292 HydrophobicContact CG-CD2 3.61Å; Y143-L292 HydrophobicContact CG-CG 4.49Å
144	Q	94.5	Very high	92.5	Very high	38 Å²	38	33.8 Å²	33.8	18%	0.178	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	109	169.5	-178	70.5	7.3	0	0	108.5	D116 N146	D116-Q144 VanDerWaalsContact N-NE2 3.16Å; Q144-N146 HydrophobicContact CG-CB 4.49Å; Q144-N146 PolarHBondContact O-N 2.92Å
145	I	96.3	Very high	93	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	97.3	-179.2	-55.6	-54	0	0	0	108.8	D116 G128 Q130 L237 E288 L292	D116-I145 WeakPolarHBondContact CB-O 3.43Å; G128-I145 PolarHBondContact N-O 3.3Å; G128-I145 WeakPolarHBondContact O-CB 3.3Å; G128-I145 PolarHBondContact O-N 2.78Å; Q130-I145 HydrophobicContact CB-CG1 3.91Å; Q130-I145 HydrophobicContact CG-CB 4.38Å; Q130-I145 HydrophobicContact CG-CG1 3.73Å; I145-L237 HydrophobicContact CD1-CD2 3.87Å; I145-E288 HydrophobicContact CD1-CG 4.36Å; I145-E288 HydrophobicContact CG2-CB 3.8Å; I145-E288 HydrophobicContact CG2-CG 3.99Å; I145-E288 VanDerWaalsContact CG2-OE2 3.26Å; I145-E288 WeakPolarHBondContact CG2-OE2 3.24Å; I145-L292 HydrophobicContact CD1-CD1 4.1Å; I145-L292 HydrophobicContact CD1-CD2 4.32Å; I145-L292 HydrophobicContact CD1-CG 4.31Å
146	N	96.1	Very high	93.4	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	19%	0.194	C	C	.	.			trans	-131.3	13.3	-176.3	67.5	-0.6	0	0	0	113	L110 Y111 L114 D116 Q144 L148 Q149 A150 R242 E288	L110-N146 PolarHBondContact O-ND2 3.28Å; L110-N146 VanDerWaalsContact O-ND2 3.07Å; Y111-N146 PolarHBondContact O-ND2 2.87Å; L114-N146 PolarHBondContact O-ND2 2.94Å; D116-N146 HydrophobicContact CB-CB 3.89Å; Q144-N146 HydrophobicContact CG-CB 4.49Å; Q144-N146 PolarHBondContact O-N 2.92Å; N146-L148 PolarHBondContact O-N 2.87Å; N146-Q149 PolarHBondContact O-N 3.39Å; N146-A150 WeakPolarHBondContact O-CB 3.38Å; N146-A150 PolarHBondContact O-N 3.35Å; N146-R242 PolarHBondContact OD1-NH2 3.28Å; N146-E288 PolarHBondContact N-OE2 3.1Å
147	G	95.9	Very high	94.3	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-63.9	-38	-169.9	0	0	0	0	0	113.3	Q149 A150 W151 R242 E288	G147-Q149 PolarHBondContact O-N 3.47Å; G147-A150 PolarHBondContact O-N 3.49Å; G147-W151 VanDerWaalsContact O-CB 3.28Å; G147-W151 WeakPolarHBondContact O-CB 3.29Å; G147-W151 PolarHBondContact O-N 2.92Å; G147-R242 VanDerWaalsContact CA-CZ 3.48Å; G147-R242 VanDerWaalsContact CA-NH2 3.3Å; G147-E288 WeakPolarHBondContact CA-OE2 3.47Å; G147-E288 PolarHBondContact N-OE2 3.15Å
148	L	96.3	Very high	94.9	Very high	6 Å²	6	35.9 Å²	35.9	3%	0.031	20%	0.195	C	C	.	.	H	α-helix	trans	-61.7	-45.3	176.1	-176.6	62.3	0	0	0	111.5	L122 Y125 N146 W151 L152 F285 W286	L122-L148 HydrophobicContact CD1-CD2 3.91Å; Y125-L148 HydrophobicContact CD2-CD2 4.05Å; Y125-L148 HydrophobicContact CE2-CB 4.04Å; Y125-L148 HydrophobicContact CE2-CD2 3.93Å; Y125-L148 HydrophobicContact CG-CD2 4.45Å; N146-L148 PolarHBondContact O-N 2.87Å; L148-W151 PolarHBondContact O-N 3.37Å; L148-L152 HydrophobicContact CG-CD1 4.29Å; L148-L152 WeakPolarHBondContact O-CB 3.43Å; L148-L152 VanDerWaalsContact O-CG 3.28Å; L148-L152 WeakPolarHBondContact O-CG 3.48Å; L148-L152 PolarHBondContact O-N 3.29Å; L148-F285 HydrophobicContact CB-CB 4.11Å; L148-F285 HydrophobicContact CD1-CB 4.14Å; L148-W286 HydrophobicContact CD2-CE3 3.76Å; L148-W286 HydrophobicContact CD2-CZ3 4.22Å
149	Q	95.9	Very high	95.5	Very high	22 Å²	22	37.5 Å²	37.5	10%	0.103	19%	0.187	C	C	.	.	H	α-helix	trans	-67.4	-41.1	178	-164.4	179.3	-45.5	0	0	111.8	L114 P115 N146 G147 W151 L152 L153	L114-Q149 VanDerWaalsContact CD1-NE2 3.32Å; L114-Q149 HydrophobicContact CD2-CB 4.04Å; L114-Q149 HydrophobicContact CD2-CG 3.9Å; P115-Q149 PolarHBondContact O-NE2 3.21Å; P115-Q149 VanDerWaalsContact O-NE2 3.16Å; P115-Q149 PolarHBondContact O-OE1 3.37Å; N146-Q149 PolarHBondContact O-N 3.39Å; G147-Q149 PolarHBondContact O-N 3.47Å; Q149-W151 VanDerWaalsContact C-N 3.34Å; Q149-W151 PolarHBondContact O-N 3.37Å; Q149-L152 PolarHBondContact O-N 3.35Å; Q149-L153 HydrophobicContact CG-CD1 4.48Å; Q149-L153 WeakPolarHBondContact O-CG 3.18Å; Q149-L153 PolarHBondContact O-N 2.93Å
150	A	97.1	Very high	96	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-61.7	-42.3	175.3	0	0	0	0	0	111.7	L110 L114 N146 G147 T154	L110-A150 HydrophobicContact CB-CB 4.13Å; L110-A150 HydrophobicContact CD1-CB 4.05Å; L114-A150 HydrophobicContact CD2-CB 4.28Å; N146-A150 WeakPolarHBondContact O-CB 3.38Å; N146-A150 PolarHBondContact O-N 3.35Å; G147-A150 PolarHBondContact O-N 3.49Å; A150-T154 VanDerWaalsContact O-CB 3.25Å; A150-T154 WeakPolarHBondContact O-CB 3.38Å; A150-T154 PolarHBondContact O-N 2.98Å; A150-T154 PolarHBondContact O-OG1 3.24Å
151	W	97.4	Very high	96.2	Very high	30 Å²	30	34 Å²	34	11%	0.114	17%	0.169	C	C	.	.	H	α-helix	trans	-62.1	-48.6	174.8	-177.4	93.3	0	0	0	111.2	G147 L148 Q149 T154 H155 V246 T249 I282 F285	G147-W151 VanDerWaalsContact O-CB 3.28Å; G147-W151 WeakPolarHBondContact O-CB 3.29Å; G147-W151 PolarHBondContact O-N 2.92Å; L148-W151 PolarHBondContact O-N 3.37Å; Q149-W151 VanDerWaalsContact C-N 3.34Å; Q149-W151 PolarHBondContact O-N 3.37Å; W151-T154 PolarHBondContact O-N 3.25Å; W151-H155 AromaticContact CD1-CE1 3.36Å; W151-H155 AromaticContact CD1-ND1 3.65Å; W151-H155 AromaticContact CD2-CE1 3.95Å; W151-H155 AromaticContact CD2-ND1 3.6Å; W151-H155 AromaticContact CE2-CD2 3.99Å; W151-H155 AromaticContact CE2-CE1 3.38Å; W151-H155 AromaticContact CE2-CG 3.83Å; W151-H155 AromaticContact CE2-ND1 3.42Å; W151-H155 AromaticContact CE2-NE2 3.73Å; W151-H155 AromaticContact CG-CE1 3.92Å; W151-H155 AromaticContact CG-ND1 3.74Å; W151-H155 AromaticContact CZ2-CD2 3.77Å; W151-H155 AromaticContact CZ2-CE1 3.95Å; W151-H155 AromaticContact CZ2-CG 3.85Å; W151-H155 AromaticContact CZ2-ND1 3.94Å; W151-H155 AromaticContact CZ2-NE2 3.84Å; W151-H155 AromaticContact NE1-CE1 3.01Å; W151-H155 PolarHBondContact NE1-CE1 3.27Å; W151-H155 AromaticContact NE1-ND1 3.48Å; W151-H155 PolarHBondContact NE1-ND1 3.15Å; W151-H155 AromaticContact NE1-NE2 3.52Å; W151-H155 PolarHBondContact O-N 3.3Å; W151-H155 PolarHBondContact O-ND1 3.46Å; W151-V246 HydrophobicContact CB-CG2 4.44Å; W151-T249 PolarHBondContact NE1-OG1 3.24Å; W151-I282 HydrophobicContact CE3-CG1 4.45Å; W151-I282 HydrophobicContact CH2-CD1 3.58Å; W151-I282 HydrophobicContact CH2-CG1 3.67Å; W151-I282 HydrophobicContact CZ2-CD1 3.98Å; W151-I282 HydrophobicContact CZ2-CG1 3.73Å; W151-I282 HydrophobicContact CZ3-CD1 4.16Å; W151-I282 HydrophobicContact CZ3-CG1 4.04Å; W151-F285 HydrophobicContact CB-CD2 3.88Å; W151-F285 HydrophobicContact CB-CE2 4.04Å; W151-F285 HydrophobicContact CB-CG 4.39Å; W151-F285 AromaticContact CD1-CD2 3.69Å; W151-F285 AromaticContact CD1-CE2 3.43Å; W151-F285 VanDerWaalsContact CD1-CE2 3.43Å; W151-F285 AromaticContact CG-CD2 3.84Å; W151-F285 HydrophobicContact CG-CD2 3.84Å; W151-F285 AromaticContact CG-CE2 3.95Å; W151-F285 HydrophobicContact CG-CE2 3.95Å
152	L	96.6	Very high	96.3	Very high	65 Å²	65	34.1 Å²	34.1	34%	0.34	17%	0.173	S	C	.	.	H	α-helix	trans	-57.7	-51.6	178.4	-76.1	169.3	0	0	0	111.6	L148 Q149 T154 H155 L156	L148-L152 HydrophobicContact CG-CD1 4.29Å; L148-L152 WeakPolarHBondContact O-CB 3.43Å; L148-L152 VanDerWaalsContact O-CG 3.28Å; L148-L152 WeakPolarHBondContact O-CG 3.48Å; L148-L152 PolarHBondContact O-N 3.29Å; Q149-L152 PolarHBondContact O-N 3.35Å; L152-T154 VanDerWaalsContact C-N 3.32Å; L152-T154 PolarHBondContact O-N 3.45Å; L152-H155 PolarHBondContact O-N 3.49Å; L152-L156 VanDerWaalsContact O-CB 3.29Å; L152-L156 WeakPolarHBondContact O-CB 3.32Å; L152-L156 WeakPolarHBondContact O-CG 3.31Å; L152-L156 PolarHBondContact O-N 2.84Å
153	L	97.1	Very high	96.3	Very high	66 Å²	66	35.4 Å²	35.4	35%	0.346	18%	0.18	S	C	.	.	H	α-helix	trans	-60.1	-44.3	179.3	-70.8	176.3	0	0	0	111.6	L110 L114 Q149 H155 L157	L110-L153 HydrophobicContact CD2-CD1 4.23Å; L114-L153 HydrophobicContact CD1-CD1 3.75Å; L114-L153 HydrophobicContact CD2-CD1 3.78Å; L114-L153 HydrophobicContact CG-CD1 4.42Å; Q149-L153 HydrophobicContact CG-CD1 4.48Å; Q149-L153 WeakPolarHBondContact O-CG 3.18Å; Q149-L153 PolarHBondContact O-N 2.93Å; L153-H155 PolarHBondContact O-N 3.39Å; L153-L157 WeakPolarHBondContact O-CB 3.07Å; L153-L157 WeakPolarHBondContact O-CG 3.19Å; L153-L157 PolarHBondContact O-N 2.9Å
154	T	97.3	Very high	96.3	Very high	7 Å²	7	41.9 Å²	41.9	4%	0.043	21%	0.214	C	C	.	.	H	α-helix	trans	-59.3	-46.7	178.4	-61.7	0	0	0	0	111.6	W103 F106 Q107 A150 W151 L152 W158 V246 L250	W103-T154 HydrophobicContact CH2-CG2 4.05Å; W103-T154 HydrophobicContact CZ3-CG2 3.67Å; F106-T154 HydrophobicContact CE1-CG2 4.47Å; Q107-T154 PolarHBondContact NE2-OG1 2.9Å; Q107-T154 VanDerWaalsContact NE2-OG1 3.15Å; A150-T154 VanDerWaalsContact O-CB 3.25Å; A150-T154 WeakPolarHBondContact O-CB 3.38Å; A150-T154 PolarHBondContact O-N 2.98Å; A150-T154 PolarHBondContact O-OG1 3.24Å; W151-T154 PolarHBondContact O-N 3.25Å; L152-T154 VanDerWaalsContact C-N 3.32Å; L152-T154 PolarHBondContact O-N 3.45Å; T154-W158 PolarHBondContact O-N 2.81Å; T154-W158 VanDerWaalsContact O-N 3.14Å; T154-V246 HydrophobicContact CG2-CG1 3.82Å; T154-L250 HydrophobicContact CG2-CD1 3.55Å; T154-L250 HydrophobicContact CG2-CD2 4.39Å; T154-L250 HydrophobicContact CG2-CG 4.21Å
155	H	97.5	Very high	96.4	Very high	6 Å²	6	43.2 Å²	43.2	3%	0.028	22%	0.223	C	C	.	.	H	α-helix	trans	-74.6	-40.3	-177.6	-73.1	70.5	0	0	0	112.1	W151 L152 L153 L157 W158 F159 T249	W151-H155 AromaticContact CD1-CE1 3.36Å; W151-H155 AromaticContact CD1-ND1 3.65Å; W151-H155 AromaticContact CD2-CE1 3.95Å; W151-H155 AromaticContact CD2-ND1 3.6Å; W151-H155 AromaticContact CE2-CD2 3.99Å; W151-H155 AromaticContact CE2-CE1 3.38Å; W151-H155 AromaticContact CE2-CG 3.83Å; W151-H155 AromaticContact CE2-ND1 3.42Å; W151-H155 AromaticContact CE2-NE2 3.73Å; W151-H155 AromaticContact CG-CE1 3.92Å; W151-H155 AromaticContact CG-ND1 3.74Å; W151-H155 AromaticContact CZ2-CD2 3.77Å; W151-H155 AromaticContact CZ2-CE1 3.95Å; W151-H155 AromaticContact CZ2-CG 3.85Å; W151-H155 AromaticContact CZ2-ND1 3.94Å; W151-H155 AromaticContact CZ2-NE2 3.84Å; W151-H155 AromaticContact NE1-CE1 3.01Å; W151-H155 PolarHBondContact NE1-CE1 3.27Å; W151-H155 AromaticContact NE1-ND1 3.48Å; W151-H155 PolarHBondContact NE1-ND1 3.15Å; W151-H155 AromaticContact NE1-NE2 3.52Å; W151-H155 PolarHBondContact O-N 3.3Å; W151-H155 PolarHBondContact O-ND1 3.46Å; L152-H155 PolarHBondContact O-N 3.49Å; L153-H155 PolarHBondContact O-N 3.39Å; H155-L157 VanDerWaalsContact C-N 3.3Å; H155-L157 PolarHBondContact O-N 2.87Å; H155-W158 PolarHBondContact O-N 2.9Å; H155-W158 VanDerWaalsContact O-N 3.16Å; H155-F159 WeakPolarHBondContact O-CD2 3.45Å; H155-F159 PolarHBondContact O-N 3.18Å; H155-T249 PolarHBondContact CE1-OG1 3.43Å; H155-T249 WeakPolarHBondContact NE2-CB 3.31Å; H155-T249 PolarHBondContact NE2-OG1 2.77Å
156	L	97.3	Very high	96.3	Very high	110 Å²	110	47.8 Å²	47.8	58%	0.576	26%	0.255	S	S	*	.	H	α-helix	trans	-60.3	-40.7	174.9	-72.3	173.7	0	0	0	111.4	L152 F159 A160	L152-L156 VanDerWaalsContact O-CB 3.29Å; L152-L156 WeakPolarHBondContact O-CB 3.32Å; L152-L156 WeakPolarHBondContact O-CG 3.31Å; L152-L156 PolarHBondContact O-N 2.84Å; L156-F159 PolarHBondContact O-N 3.43Å; L156-A160 WeakPolarHBondContact O-CB 3.19Å; L156-A160 PolarHBondContact O-N 2.77Å
157	L	96.9	Very high	96.2	Very high	88 Å²	88	56.8 Å²	56.8	46%	0.461	29%	0.289	S	S	.	.	H	α-helix	trans	-64.2	-41.3	174.5	-74	170.4	0	0	0	111.9	F106 L153 H155 N161	F106-L157 HydrophobicContact CE2-CD1 4.26Å; F106-L157 HydrophobicContact CZ-CD1 3.68Å; L153-L157 WeakPolarHBondContact O-CB 3.07Å; L153-L157 WeakPolarHBondContact O-CG 3.19Å; L153-L157 PolarHBondContact O-N 2.9Å; H155-L157 VanDerWaalsContact C-N 3.3Å; H155-L157 PolarHBondContact O-N 2.87Å; L157-N161 VanDerWaalsContact O-CB 3.31Å; L157-N161 WeakPolarHBondContact O-CB 3.19Å; L157-N161 PolarHBondContact O-N 2.93Å
158	W	96.6	Very high	96.1	Very high	25 Å²	25	60.7 Å²	60.7	10%	0.095	31%	0.306	C	S	.	.	H	α-helix	trans	-63.7	-45.2	175.4	-174.7	94.2	0	0	0	112	T154 H155 N161 A162 P170 L250 L253	T154-W158 PolarHBondContact O-N 2.81Å; T154-W158 VanDerWaalsContact O-N 3.14Å; H155-W158 PolarHBondContact O-N 2.9Å; H155-W158 VanDerWaalsContact O-N 3.16Å; W158-N161 WeakPolarHBondContact O-CB 3.4Å; W158-N161 PolarHBondContact O-N 2.69Å; W158-A162 HydrophobicContact CE3-CB 4.45Å; W158-A162 HydrophobicContact CH2-CB 4.44Å; W158-A162 HydrophobicContact CZ3-CB 4.25Å; W158-A162 WeakPolarHBondContact O-CB 3.39Å; W158-A162 PolarHBondContact O-N 3.49Å; W158-P170 HydrophobicContact CH2-CB 4.21Å; W158-P170 HydrophobicContact CZ2-CB 3.74Å; W158-L250 HydrophobicContact CB-CD2 3.8Å; W158-L250 HydrophobicContact CG-CD2 3.83Å; W158-L253 HydrophobicContact CE3-CD1 4.06Å; W158-L253 HydrophobicContact CH2-CB 3.81Å; W158-L253 HydrophobicContact CZ2-CB 4Å; W158-L253 HydrophobicContact CZ3-CB 4.09Å; W158-L253 HydrophobicContact CZ3-CD1 4.1Å
159	F	96.6	Very high	96.1	Very high	88 Å²	88	62.8 Å²	62.8	39%	0.386	32%	0.321	S	S	.	.	H	α-helix	trans	-64.7	-44.3	176.7	-82.9	-67.6	0	0	0	112.2	H155 L156 N161 A162 H163 L253	H155-F159 WeakPolarHBondContact O-CD2 3.45Å; H155-F159 PolarHBondContact O-N 3.18Å; L156-F159 PolarHBondContact O-N 3.43Å; F159-N161 VanDerWaalsContact C-N 3.26Å; F159-N161 PolarHBondContact O-N 3.5Å; F159-A162 PolarHBondContact O-N 3.13Å; F159-H163 PolarHBondContact O-CD2 3.32Å; F159-H163 PolarHBondContact O-N 2.95Å; F159-L253 HydrophobicContact CE2-CD1 4.13Å; F159-L253 HydrophobicContact CZ-CD1 4.05Å; F159-L253 HydrophobicContact CZ-CD2 4.22Å
160	A	97.3	Very high	96.2	Very high	29 Å²	29	63.5 Å²	63.5	24%	0.24	33%	0.327	C	S	.	.	H	α-helix	trans	-59.8	-40.6	174.5	0	0	0	0	0	110.8	L156 L164 L165	L156-A160 WeakPolarHBondContact O-CB 3.19Å; L156-A160 PolarHBondContact O-N 2.77Å; A160-L164 WeakPolarHBondContact O-CA 3.47Å; A160-L164 VanDerWaalsContact O-CB 3.29Å; A160-L164 WeakPolarHBondContact O-CB 3.48Å; A160-L164 PolarHBondContact O-N 3.01Å; A160-L165 HydrophobicContact CB-CD1 4.21Å; A160-L165 PolarHBondContact O-N 2.88Å
161	N	96.3	Very high	96.3	Very high	1 Å²	1	63.6 Å²	63.6	1%	0.005	33%	0.328	C	S	.	.	I	π-helix	trans	-61.9	-47.9	172.7	174.4	75.7	0	0	0	112.3	L157 W158 F159 H163 S166 W167 F168	L157-N161 VanDerWaalsContact O-CB 3.31Å; L157-N161 WeakPolarHBondContact O-CB 3.19Å; L157-N161 PolarHBondContact O-N 2.93Å; W158-N161 WeakPolarHBondContact O-CB 3.4Å; W158-N161 PolarHBondContact O-N 2.69Å; F159-N161 VanDerWaalsContact C-N 3.26Å; F159-N161 PolarHBondContact O-N 3.5Å; N161-H163 VanDerWaalsContact C-N 3.3Å; N161-H163 PolarHBondContact O-N 3.41Å; N161-S166 WeakPolarHBondContact O-CA 3.34Å; N161-S166 PolarHBondContact O-N 3.36Å; N161-W167 WeakPolarHBondContact OD1-CA 3.48Å; N161-W167 VanDerWaalsContact OD1-CB 3.31Å; N161-W167 WeakPolarHBondContact OD1-CB 3.31Å; N161-W167 PolarHBondContact OD1-N 3.25Å; N161-F168 HydrophobicContact CB-CE1 3.97Å; N161-F168 HydrophobicContact CB-CE2 4.46Å; N161-F168 HydrophobicContact CB-CZ 3.88Å; N161-F168 VanDerWaalsContact CG-CE1 3.45Å; N161-F168 VanDerWaalsContact ND2-CD2 3.29Å; N161-F168 WeakPolarHBondContact ND2-CD2 3.45Å; N161-F168 WeakPolarHBondContact ND2-CE2 3.45Å; N161-F168 WeakPolarHBondContact ND2-CZ 3.46Å; N161-F168 PolarHBondContact ND2-O 3.39Å; N161-F168 WeakPolarHBondContact OD1-CD1 3.31Å; N161-F168 PolarHBondContact OD1-N 2.88Å; N161-F168 VanDerWaalsContact OD1-N 3.09Å
162	A	93.9	Very high	96.3	Very high	26 Å²	26	63.2 Å²	63.2	22%	0.215	33%	0.328	C	S	.	.	I	π-helix	trans	-65.5	-29.2	-175.9	0	0	0	0	0	114	W158 F159 P170	W158-A162 HydrophobicContact CE3-CB 4.45Å; W158-A162 HydrophobicContact CH2-CB 4.44Å; W158-A162 HydrophobicContact CZ3-CB 4.25Å; W158-A162 WeakPolarHBondContact O-CB 3.39Å; W158-A162 PolarHBondContact O-N 3.49Å; F159-A162 PolarHBondContact O-N 3.13Å; A162-P170 HydrophobicContact CB-CB 4.29Å; A162-P170 HydrophobicContact CB-CG 3.74Å
163	H	94.1	Very high	96.3	Very high	133 Å²	133	61.5 Å²	61.5	62%	0.616	32%	0.319	S	S	*	.	I	π-helix	trans	-113	-24.9	-173.8	-67.7	-66.9	0	0	0	115.2	F159 N161	F159-H163 PolarHBondContact O-CD2 3.32Å; F159-H163 PolarHBondContact O-N 2.95Å; N161-H163 VanDerWaalsContact C-N 3.3Å; N161-H163 PolarHBondContact O-N 3.41Å
164	L	95.7	Very high	96.4	Very high	139 Å²	139	59.6 Å²	59.6	73%	0.728	31%	0.308	S	S	*	.	I	π-helix	trans	-122.4	-52.2	-171.3	-53.1	174.7	0	0	0	112.1	A160	A160-L164 WeakPolarHBondContact O-CA 3.47Å; A160-L164 VanDerWaalsContact O-CB 3.29Å; A160-L164 WeakPolarHBondContact O-CB 3.48Å; A160-L164 PolarHBondContact O-N 3.01Å
165	L	95.4	Very high	96.4	Very high	67 Å²	67	62.6 Å²	62.6	35%	0.351	32%	0.323	S	S	.	.	I	π-helix	trans	-87.5	-33.4	-165.8	-51	168.2	0	0	0	113.3	A160 W167	A160-L165 HydrophobicContact CB-CD1 4.21Å; A160-L165 PolarHBondContact O-N 2.88Å; L165-W167 HydrophobicContact CB-CD2 3.86Å; L165-W167 HydrophobicContact CB-CG 3.95Å; L165-W167 HydrophobicContact CB-CZ2 4.34Å; L165-W167 HydrophobicContact CD1-CD2 4.04Å; L165-W167 HydrophobicContact CD1-CE3 3.92Å; L165-W167 HydrophobicContact CD1-CH2 3.71Å; L165-W167 HydrophobicContact CD1-CZ2 3.81Å; L165-W167 HydrophobicContact CD1-CZ3 3.76Å; L165-W167 HydrophobicContact CD2-CZ2 4Å; L165-W167 HydrophobicContact CG-CD2 4.49Å; L165-W167 HydrophobicContact CG-CZ2 4.27Å; L165-W167 PolarHBondContact O-N 3.42Å; L165-W167 VanDerWaalsContact O-N 3.13Å
166	S	94.6	Very high	96.5	Very high	96 Å²	96	62.9 Å²	62.9	67%	0.671	33%	0.325	S	S	*	.			trans	51.5	31.8	-177.9	-52.7	0	0	0	0	114.3	N161 F168	N161-S166 WeakPolarHBondContact O-CA 3.34Å; N161-S166 PolarHBondContact O-N 3.36Å; S166-F168 VanDerWaalsContact C-N 3.31Å; S166-F168 PolarHBondContact O-N 3.16Å
167	W	93.9	Very high	96.5	Very high	189 Å²	189	58.2 Å²	58.2	72%	0.716	30%	0.3	S	S	*	.	S	Bend	trans	-69.2	-29.9	179.5	-62.8	-20	0	0	0	112.5	N161 L165	N161-W167 WeakPolarHBondContact OD1-CA 3.48Å; N161-W167 VanDerWaalsContact OD1-CB 3.31Å; N161-W167 WeakPolarHBondContact OD1-CB 3.31Å; N161-W167 PolarHBondContact OD1-N 3.25Å; L165-W167 HydrophobicContact CB-CD2 3.86Å; L165-W167 HydrophobicContact CB-CG 3.95Å; L165-W167 HydrophobicContact CB-CZ2 4.34Å; L165-W167 HydrophobicContact CD1-CD2 4.04Å; L165-W167 HydrophobicContact CD1-CE3 3.92Å; L165-W167 HydrophobicContact CD1-CH2 3.71Å; L165-W167 HydrophobicContact CD1-CZ2 3.81Å; L165-W167 HydrophobicContact CD1-CZ3 3.76Å; L165-W167 HydrophobicContact CD2-CZ2 4Å; L165-W167 HydrophobicContact CG-CD2 4.49Å; L165-W167 HydrophobicContact CG-CZ2 4.27Å; L165-W167 PolarHBondContact O-N 3.42Å; L165-W167 VanDerWaalsContact O-N 3.13Å
168	F	94.6	Very high	96.5	Very high	82 Å²	82	54.5 Å²	54.5	36%	0.36	28%	0.28	S	S	.	.	S	Bend	trans	-149.8	158.7	174.8	57.6	-93.9	0	0	0	111.7	N161 S166 I172	N161-F168 HydrophobicContact CB-CE1 3.97Å; N161-F168 HydrophobicContact CB-CE2 4.46Å; N161-F168 HydrophobicContact CB-CZ 3.88Å; N161-F168 VanDerWaalsContact CG-CE1 3.45Å; N161-F168 VanDerWaalsContact ND2-CD2 3.29Å; N161-F168 WeakPolarHBondContact ND2-CD2 3.45Å; N161-F168 WeakPolarHBondContact ND2-CE2 3.45Å; N161-F168 WeakPolarHBondContact ND2-CZ 3.46Å; N161-F168 PolarHBondContact ND2-O 3.39Å; N161-F168 WeakPolarHBondContact OD1-CD1 3.31Å; N161-F168 PolarHBondContact OD1-N 2.88Å; N161-F168 VanDerWaalsContact OD1-N 3.09Å; S166-F168 VanDerWaalsContact C-N 3.31Å; S166-F168 PolarHBondContact O-N 3.16Å; F168-I172 HydrophobicContact CB-CD1 3.98Å; F168-I172 HydrophobicContact CD2-CB 4.46Å; F168-I172 HydrophobicContact CD2-CD1 4.45Å; F168-I172 HydrophobicContact CD2-CG2 3.78Å; F168-I172 HydrophobicContact CE2-CG2 4.18Å; F168-I172 HydrophobicContact CG-CD1 4.47Å
169	S	96.9	Very high	96.6	Very high	50 Å²	50	53.8 Å²	53.8	35%	0.35	28%	0.279	S	S	.	.			trans	-64.3	135.5	178.2	-174.9	0	0	0	0	111.8	T171 I172	S169-T171 PolarHBondContact O-N 3.22Å; S169-T171 VanDerWaalsContact O-N 3.11Å; S169-T171 PolarHBondContact OG-N 2.73Å; S169-T171 PolarHBondContact OG-OG1 3.26Å; S169-I172 WeakPolarHBondContact O-CB 3.44Å; S169-I172 VanDerWaalsContact O-CG2 3.31Å; S169-I172 WeakPolarHBondContact O-CG2 3.45Å; S169-I172 PolarHBondContact O-N 2.91Å
170	P	97.4	Very high	96.7	Very high	36 Å²	36	50.3 Å²	50.3	23%	0.234	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-23.3	170.3	-25.6	36.2	0	0	0	113.8	W158 A162 I172 S254 A257	W158-P170 HydrophobicContact CH2-CB 4.21Å; W158-P170 HydrophobicContact CZ2-CB 3.74Å; A162-P170 HydrophobicContact CB-CB 4.29Å; A162-P170 HydrophobicContact CB-CG 3.74Å; P170-I172 VanDerWaalsContact C-N 3.31Å; P170-I172 PolarHBondContact O-N 3.11Å; P170-S254 WeakPolarHBondContact O-CA 3.16Å; P170-S254 WeakPolarHBondContact O-CB 3.21Å; P170-S254 PolarHBondContact O-OG 2.69Å; P170-A257 HydrophobicContact CB-CB 3.77Å
171	T	98.1	Very high	96.7	Very high	3 Å²	3	49 Å²	49	2%	0.018	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-0.7	178	61.2	0	0	0	0	114.2	S169 I173 F174 D175 S254 A257 K258 E261	S169-T171 PolarHBondContact O-N 3.22Å; S169-T171 VanDerWaalsContact O-N 3.11Å; S169-T171 PolarHBondContact OG-N 2.73Å; S169-T171 PolarHBondContact OG-OG1 3.26Å; T171-I173 PolarHBondContact O-N 2.69Å; T171-F174 PolarHBondContact O-N 3.48Å; T171-D175 WeakPolarHBondContact CB-OD2 3.35Å; T171-D175 VanDerWaalsContact O-CG 3.32Å; T171-D175 PolarHBondContact O-N 3.02Å; T171-D175 PolarHBondContact OG1-OD2 3.42Å; T171-S254 VanDerWaalsContact C-OG 3.24Å; T171-S254 WeakPolarHBondContact CA-OG 3.32Å; T171-S254 PolarHBondContact O-OG 3.34Å; T171-A257 HydrophobicContact CG2-CB 4.09Å; T171-K258 HydrophobicContact CG2-CB 4.12Å; T171-K258 HydrophobicContact CG2-CD 3.93Å; T171-E261 HydrophobicContact CG2-CB 4.37Å; T171-E261 WeakPolarHBondContact CG2-OE2 3.34Å
172	I	97.8	Very high	96.8	Very high	21 Å²	21	51.9 Å²	51.9	11%	0.108	26%	0.264	C	S	.	.	H	α-helix	trans	-55.1	-31.7	-167.7	-168.1	162.5	0	0	0	114.5	L99 F168 S169 P170 N176	L99-I172 HydrophobicContact CD1-CD1 3.77Å; L99-I172 HydrophobicContact CD1-CG1 3.71Å; L99-I172 HydrophobicContact CD2-CD1 3.58Å; L99-I172 HydrophobicContact CD2-CG1 4.33Å; L99-I172 HydrophobicContact CG-CD1 4.32Å; F168-I172 HydrophobicContact CB-CD1 3.98Å; F168-I172 HydrophobicContact CD2-CB 4.46Å; F168-I172 HydrophobicContact CD2-CD1 4.45Å; F168-I172 HydrophobicContact CD2-CG2 3.78Å; F168-I172 HydrophobicContact CE2-CG2 4.18Å; F168-I172 HydrophobicContact CG-CD1 4.47Å; S169-I172 WeakPolarHBondContact O-CB 3.44Å; S169-I172 VanDerWaalsContact O-CG2 3.31Å; S169-I172 WeakPolarHBondContact O-CG2 3.45Å; S169-I172 PolarHBondContact O-N 2.91Å; P170-I172 VanDerWaalsContact C-N 3.31Å; P170-I172 PolarHBondContact O-N 3.11Å; I172-N176 PolarHBondContact O-N 3.39Å; I172-N176 PolarHBondContact O-ND2 2.87Å
173	I	98.1	Very high	97	Very high	30 Å²	30	51.1 Å²	51.1	15%	0.154	26%	0.257	C	S	.	.	H	α-helix	trans	-71.9	-49.2	178.7	-57.1	176.2	0	0	0	109.6	T171 D175 N176 W177 L180 L250 I251 S254	T171-I173 PolarHBondContact O-N 2.69Å; I173-D175 VanDerWaalsContact C-N 3.34Å; I173-D175 PolarHBondContact O-N 3.45Å; I173-N176 CarbonylContact O-C 3.15Å; I173-N176 PolarHBondContact O-N 3.37Å; I173-W177 HydrophobicContact CG2-CE3 3.96Å; I173-W177 HydrophobicContact CG2-CZ3 4.07Å; I173-W177 WeakPolarHBondContact O-CA 3.25Å; I173-W177 PolarHBondContact O-N 2.61Å; I173-L180 HydrophobicContact CG2-CD1 4.22Å; I173-L250 HydrophobicContact CD1-CB 4.06Å; I173-I251 HydrophobicContact CG2-CG1 3.95Å; I173-S254 WeakPolarHBondContact CB-OG 3.32Å; I173-S254 PolarHBondContact N-OG 3.13Å
174	F	98.3	Very high	97.2	Very high	25 Å²	25	44.8 Å²	44.8	11%	0.11	23%	0.228	C	C	.	.	H	α-helix	trans	-58.9	-46.4	175.3	-177.4	-84.8	0	0	0	111.4	T171 N176 W177 S254 F255 K258 L323 V326 Y327	T171-F174 PolarHBondContact O-N 3.48Å; F174-N176 PolarHBondContact O-N 2.83Å; F174-N176 VanDerWaalsContact O-N 3.08Å; F174-W177 WeakPolarHBondContact O-CB 3.23Å; F174-W177 PolarHBondContact O-N 3.48Å; F174-S254 PolarHBondContact N-OG 3.4Å; F174-F255 HydrophobicContact CB-CD1 4Å; F174-F255 HydrophobicContact CB-CE1 4.21Å; F174-F255 AromaticContact CD2-CD1 3.58Å; F174-F255 HydrophobicContact CD2-CD1 3.58Å; F174-F255 AromaticContact CD2-CE1 3.69Å; F174-F255 HydrophobicContact CD2-CE1 3.69Å; F174-F255 HydrophobicContact CG-CD1 4.28Å; F174-F255 HydrophobicContact CG-CE1 4.43Å; F174-K258 HydrophobicContact CB-CB 4.09Å; F174-K258 HydrophobicContact CB-CD 4.48Å; F174-K258 HydrophobicContact CB-CG 4.25Å; F174-K258 HydrophobicContact CD1-CB 4.15Å; F174-K258 HydrophobicContact CD1-CD 3.49Å; F174-K258 VanDerWaalsContact CD1-CD 3.49Å; F174-K258 HydrophobicContact CD1-CG 3.38Å; F174-K258 HydrophobicContact CD2-CB 4.35Å; F174-K258 HydrophobicContact CD2-CG 4.18Å; F174-K258 HydrophobicContact CE1-CD 3.94Å; F174-K258 HydrophobicContact CE1-CG 3.65Å; F174-K258 HydrophobicContact CE2-CG 4.41Å; F174-K258 HydrophobicContact CG-CB 3.92Å; F174-K258 HydrophobicContact CG-CD 4.11Å; F174-K258 HydrophobicContact CG-CG 3.66Å; F174-K258 HydrophobicContact CZ-CG 4.16Å; F174-L323 HydrophobicContact CD2-CD1 4.29Å; F174-L323 HydrophobicContact CE2-CD1 3.84Å; F174-V326 HydrophobicContact CD2-CG1 4.21Å; F174-V326 HydrophobicContact CD2-CG2 4.12Å; F174-V326 HydrophobicContact CE1-CG1 4.45Å; F174-V326 HydrophobicContact CE2-CB 3.86Å; F174-V326 HydrophobicContact CE2-CG1 3.55Å; F174-V326 HydrophobicContact CE2-CG2 3.96Å; F174-V326 HydrophobicContact CZ-CB 4.41Å; F174-V326 HydrophobicContact CZ-CG1 3.68Å; F174-Y327 HydrophobicContact CE2-CE2 4.1Å; F174-Y327 HydrophobicContact CZ-CE1 4.47Å; F174-Y327 HydrophobicContact CZ-CE2 4.09Å; F174-Y327 AromaticContact CZ-CZ 3.81Å
175	D	98.1	Very high	97.3	Very high	70 Å²	70	39 Å²	39	37%	0.374	20%	0.198	S	C	.	.	H	α-helix	trans	-64.4	-19.3	-176.5	-62	-28	0	0	0	113.1	T171 I173 K258	T171-D175 WeakPolarHBondContact CB-OD2 3.35Å; T171-D175 VanDerWaalsContact O-CG 3.32Å; T171-D175 PolarHBondContact O-N 3.02Å; T171-D175 PolarHBondContact OG1-OD2 3.42Å; I173-D175 VanDerWaalsContact C-N 3.34Å; I173-D175 PolarHBondContact O-N 3.45Å; D175-K258 WeakPolarHBondContact OD1-CE 3.26Å; D175-K258 IonicContact OD1-NZ 2.87Å; D175-K258 PolarHBondContact OD1-NZ 2.86Å
176	N	98.1	Very high	97.4	Very high	12 Å²	12	40.8 Å²	40.8	6%	0.064	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.5	18.6	177.6	-63.4	-93.9	0	0	0	111.9	A96 I172 I173 F174 I178 P179 L180	A96-N176 HydrophobicContact CB-CB 4.41Å; I172-N176 PolarHBondContact O-N 3.39Å; I172-N176 PolarHBondContact O-ND2 2.87Å; I173-N176 CarbonylContact O-C 3.15Å; I173-N176 PolarHBondContact O-N 3.37Å; F174-N176 PolarHBondContact O-N 2.83Å; F174-N176 VanDerWaalsContact O-N 3.08Å; N176-I178 PolarHBondContact O-N 3.39Å; N176-P179 VanDerWaalsContact O-CD 3.31Å; N176-P179 WeakPolarHBondContact O-CD 3.38Å; N176-L180 HydrophobicContact CB-CD1 4.03Å; N176-L180 HydrophobicContact CB-CG 4.07Å; N176-L180 WeakPolarHBondContact O-CB 3.24Å; N176-L180 WeakPolarHBondContact O-CG 3.32Å; N176-L180 PolarHBondContact O-N 3.05Å
177	W	97.9	Very high	97.6	Very high	13 Å²	13	38 Å²	38	5%	0.049	18%	0.184	C	C	.	.	H	α-helix	trans	-57.8	-46.9	-167.4	-173.4	-126.3	0	0	0	113.8	I173 F174 L180 L181 I251 F255 Y316	I173-W177 HydrophobicContact CG2-CE3 3.96Å; I173-W177 HydrophobicContact CG2-CZ3 4.07Å; I173-W177 WeakPolarHBondContact O-CA 3.25Å; I173-W177 PolarHBondContact O-N 2.61Å; F174-W177 WeakPolarHBondContact O-CB 3.23Å; F174-W177 PolarHBondContact O-N 3.48Å; W177-L180 PolarHBondContact O-N 3.41Å; W177-L181 PolarHBondContact O-N 2.83Å; W177-L181 VanDerWaalsContact O-N 3.1Å; W177-I251 HydrophobicContact CH2-CD1 3.9Å; W177-I251 HydrophobicContact CH2-CG1 4.24Å; W177-I251 HydrophobicContact CH2-CG2 3.69Å; W177-I251 HydrophobicContact CZ2-CG2 4.44Å; W177-I251 HydrophobicContact CZ3-CD1 3.89Å; W177-I251 HydrophobicContact CZ3-CG1 3.88Å; W177-I251 HydrophobicContact CZ3-CG2 3.77Å; W177-F255 HydrophobicContact CD2-CE1 4.3Å; W177-F255 HydrophobicContact CD2-CZ 4.1Å; W177-F255 AromaticContact CE2-CZ 3.84Å; W177-F255 HydrophobicContact CE3-CE1 4.45Å; W177-F255 HydrophobicContact CE3-CZ 4.36Å; W177-F255 HydrophobicContact CH2-CZ 4.2Å; W177-F255 AromaticContact CZ2-CZ 3.87Å; W177-F255 HydrophobicContact CZ2-CZ 3.87Å; W177-F255 HydrophobicContact CZ3-CZ 4.43Å; W177-Y316 HydrophobicContact CD2-CD1 4.27Å; W177-Y316 AromaticContact CD2-CE1 3.77Å; W177-Y316 HydrophobicContact CD2-CE1 3.77Å; W177-Y316 AromaticContact CE2-CD1 3.52Å; W177-Y316 AromaticContact CE2-CE1 3.51Å; W177-Y316 AromaticContact CE3-CE1 3.93Å; W177-Y316 HydrophobicContact CE3-CE1 3.93Å; W177-Y316 AromaticContact CH2-CD1 3.62Å; W177-Y316 HydrophobicContact CH2-CD1 3.62Å; W177-Y316 HydrophobicContact CH2-CD2 4.39Å; W177-Y316 AromaticContact CH2-CE1 3.61Å; W177-Y316 HydrophobicContact CH2-CE1 3.61Å; W177-Y316 HydrophobicContact CH2-CE2 4.4Å; W177-Y316 HydrophobicContact CH2-CG 4.01Å; W177-Y316 AromaticContact CH2-CZ 3.99Å; W177-Y316 AromaticContact CZ2-CD1 3.19Å; W177-Y316 HydrophobicContact CZ2-CD1 3.19Å; W177-Y316 AromaticContact CZ2-CE1 3.47Å; W177-Y316 HydrophobicContact CZ2-CE1 3.47Å; W177-Y316 VanDerWaalsContact CZ2-CE1 3.47Å; W177-Y316 AromaticContact CZ2-CG 3.84Å; W177-Y316 HydrophobicContact CZ2-CG 3.84Å; W177-Y316 HydrophobicContact CZ3-CD1 4.32Å; W177-Y316 AromaticContact CZ3-CE1 3.83Å; W177-Y316 HydrophobicContact CZ3-CE1 3.83Å; W177-Y316 AromaticContact CZ3-CZ 3.99Å
178	I	97.8	Very high	97.7	Very high	9 Å²	9	29 Å²	29	5%	0.046	15%	0.15	C	C	.	.	H	α-helix	trans	-72.9	-46	179.8	-60	159.2	0	0	0	111.9	I58 M59 D62 T89 P90 N176 L180 L181 W182	I58-I178 HydrophobicContact CG2-CG1 3.78Å; M59-I178 HydrophobicContact CE-CB 4.45Å; M59-I178 HydrophobicContact CE-CD1 3.46Å; M59-I178 VanDerWaalsContact CE-CD1 3.46Å; M59-I178 HydrophobicContact CE-CG1 3.64Å; M59-I178 HydrophobicContact CE-CG2 3.97Å; D62-I178 HydrophobicContact CB-CD1 3.99Å; T89-I178 HydrophobicContact CG2-CG2 4.19Å; P90-I178 HydrophobicContact CB-CB 4.22Å; P90-I178 HydrophobicContact CB-CG2 4.15Å; P90-I178 HydrophobicContact CG-CB 4.16Å; P90-I178 HydrophobicContact CG-CD1 3.85Å; P90-I178 HydrophobicContact CG-CG2 4.26Å; N176-I178 PolarHBondContact O-N 3.39Å; I178-L180 PolarHBondContact O-N 3.35Å; I178-L181 VanDerWaalsContact O-CB 3.25Å; I178-L181 WeakPolarHBondContact O-CB 3.11Å; I178-L181 PolarHBondContact O-N 2.92Å; I178-W182 PolarHBondContact O-N 3.02Å
179	P	98.3	Very high	97.9	Very high	11 Å²	11	29 Å²	29	7%	0.071	15%	0.148	C	C	.	.	H	α-helix	trans	-55.4	-36.9	170.8	-31.3	38.3	0	0	0	114.2	P90 T93 A96 N176 L181 W182 C183	P90-P179 HydrophobicContact CB-CG 4.15Å; T93-P179 HydrophobicContact CG2-CB 4.28Å; T93-P179 HydrophobicContact CG2-CG 4.02Å; A96-P179 HydrophobicContact CB-CB 3.34Å; N176-P179 VanDerWaalsContact O-CD 3.31Å; N176-P179 WeakPolarHBondContact O-CD 3.38Å; P179-L181 VanDerWaalsContact C-N 3.32Å; P179-W182 PolarHBondContact O-N 3.08Å; P179-C183 PolarHBondContact O-N 2.99Å; P179-C183 PolarHBondContact O-SG 3.01Å
180	L	98.4	Very high	97.9	Very high	15 Å²	15	29.1 Å²	29.1	8%	0.079	15%	0.152	C	C	.	.	H	α-helix	trans	-68	-29.8	175.4	-70.2	170.5	0	0	0	112.2	A96 L99 Y100 I173 N176 W177 I178 W182 C183 A184 Y316	A96-L180 HydrophobicContact CB-CD2 4.21Å; A96-L180 HydrophobicContact CB-CG 4.39Å; L99-L180 HydrophobicContact CB-CD2 4.47Å; Y100-L180 HydrophobicContact CD2-CD2 4Å; Y100-L180 HydrophobicContact CG-CD2 4.37Å; I173-L180 HydrophobicContact CG2-CD1 4.22Å; N176-L180 HydrophobicContact CB-CD1 4.03Å; N176-L180 HydrophobicContact CB-CG 4.07Å; N176-L180 WeakPolarHBondContact O-CB 3.24Å; N176-L180 WeakPolarHBondContact O-CG 3.32Å; N176-L180 PolarHBondContact O-N 3.05Å; W177-L180 PolarHBondContact O-N 3.41Å; I178-L180 PolarHBondContact O-N 3.35Å; L180-W182 VanDerWaalsContact C-N 3.28Å; L180-W182 PolarHBondContact O-N 3.26Å; L180-C183 PolarHBondContact O-N 2.94Å; L180-A184 WeakPolarHBondContact O-CB 3.27Å; L180-A184 PolarHBondContact O-N 2.61Å; L180-Y316 WeakPolarHBondContact CB-OH 3.47Å; L180-Y316 PolarHBondContact O-OH 3.45Å
181	L	98.1	Very high	97.9	Very high	1 Å²	1	27.8 Å²	27.8	1%	0.005	14%	0.144	C	C	.	.	H	α-helix	trans	-61.1	-40.2	175.8	176.4	61.9	0	0	0	110.8	V54 I58 W177 I178 P179 A184 N185 V312 Y316	V54-L181 HydrophobicContact CG1-CD1 3.7Å; I58-L181 HydrophobicContact CB-CD2 4.44Å; I58-L181 HydrophobicContact CG1-CD2 4.23Å; W177-L181 PolarHBondContact O-N 2.83Å; W177-L181 VanDerWaalsContact O-N 3.1Å; I178-L181 VanDerWaalsContact O-CB 3.25Å; I178-L181 WeakPolarHBondContact O-CB 3.11Å; I178-L181 PolarHBondContact O-N 2.92Å; P179-L181 VanDerWaalsContact C-N 3.32Å; L181-A184 PolarHBondContact O-N 3.22Å; L181-N185 WeakPolarHBondContact CD1-ND2 3.21Å; L181-N185 PolarHBondContact O-N 2.94Å; L181-N185 PolarHBondContact O-ND2 3.04Å; L181-V312 HydrophobicContact CD1-CG1 3.86Å; L181-Y316 VanDerWaalsContact CA-CZ 3.46Å; L181-Y316 WeakPolarHBondContact CA-OH 3.29Å; L181-Y316 HydrophobicContact CB-CD1 4.33Å; L181-Y316 HydrophobicContact CB-CE1 3.59Å; L181-Y316 HydrophobicContact CD1-CD1 3.72Å; L181-Y316 HydrophobicContact CD1-CD2 4.01Å; L181-Y316 HydrophobicContact CD1-CE1 3.74Å; L181-Y316 HydrophobicContact CD1-CE2 4.02Å; L181-Y316 HydrophobicContact CD1-CG 3.89Å; L181-Y316 HydrophobicContact CG-CD1 4.47Å; L181-Y316 HydrophobicContact CG-CE1 4.18Å; L181-Y316 PolarHBondContact N-OH 3.27Å
182	W	97.9	Very high	97.8	Very high	61 Å²	61	27.7 Å²	27.7	23%	0.231	14%	0.143	C	C	.	.	H	α-helix	trans	-65.1	-44.5	175.2	-60.3	124.8	0	0	0	111.8	Y55 W86 T89 P90 I92 I178 P179 L180 A184 N185 I186	Y55-W182 AromaticContact CD2-CH2 3.88Å; Y55-W182 HydrophobicContact CD2-CH2 3.88Å; Y55-W182 HydrophobicContact CD2-CZ2 4.1Å; Y55-W182 HydrophobicContact CE2-CH2 4.1Å; Y55-W182 HydrophobicContact CE2-CZ2 4.01Å; W86-W182 AromaticContact CH2-CH2 3.74Å; W86-W182 HydrophobicContact CH2-CH2 3.74Å; W86-W182 HydrophobicContact CH2-CZ2 4.09Å; W86-W182 AromaticContact CZ3-CH2 3.89Å; W86-W182 HydrophobicContact CZ3-CH2 3.89Å; W86-W182 HydrophobicContact CZ3-CZ2 4.27Å; T89-W182 HydrophobicContact CG2-CZ2 3.79Å; P90-W182 PolarHBondContact O-NE1 3.49Å; P90-W182 VanDerWaalsContact O-NE1 3.11Å; I92-W182 HydrophobicContact CB-CB 4.32Å; I178-W182 PolarHBondContact O-N 3.02Å; P179-W182 PolarHBondContact O-N 3.08Å; L180-W182 VanDerWaalsContact C-N 3.28Å; L180-W182 PolarHBondContact O-N 3.26Å; W182-A184 VanDerWaalsContact C-N 3.32Å; W182-A184 PolarHBondContact O-N 3.09Å; W182-N185 PolarHBondContact O-N 2.83Å; W182-I186 VanDerWaalsContact O-CG1 3.29Å; W182-I186 WeakPolarHBondContact O-CG1 3.46Å; W182-I186 PolarHBondContact O-N 3.42Å
183	C	98.3	Very high	97.8	Very high	10 Å²	10	29.6 Å²	29.6	7%	0.068	16%	0.156	C	C	.	.	H	α-helix	trans	-60.6	-41.8	175.7	-61.4	0	0	0	0	112.1	Y100 P179 L180 I186 L187	Y100-C183 HydrophobicContact CD1-CB 3.54Å; Y100-C183 HydrophobicContact CD2-CB 4.29Å; Y100-C183 HydrophobicContact CE1-CB 4.17Å; Y100-C183 HydrophobicContact CG-CB 3.6Å; P179-C183 PolarHBondContact O-N 2.99Å; P179-C183 PolarHBondContact O-SG 3.01Å; L180-C183 PolarHBondContact O-N 2.94Å; C183-I186 PolarHBondContact O-N 3.46Å; C183-L187 PolarHBondContact O-N 3.38Å
184	A	97.8	Very high	97.8	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-65.1	-42.2	177.5	0	0	0	0	0	112.2	Y100 L180 L181 W182 L187 G188 V312 Y316	Y100-A184 HydrophobicContact CE2-CB 4.22Å; Y100-A184 WeakPolarHBondContact OH-CA 3.47Å; L180-A184 WeakPolarHBondContact O-CB 3.27Å; L180-A184 PolarHBondContact O-N 2.61Å; L181-A184 PolarHBondContact O-N 3.22Å; W182-A184 VanDerWaalsContact C-N 3.32Å; W182-A184 PolarHBondContact O-N 3.09Å; A184-L187 PolarHBondContact O-N 3.37Å; A184-G188 PolarHBondContact O-N 2.99Å; A184-V312 VanDerWaalsContact C-CG2 3.47Å; A184-V312 HydrophobicContact CB-CG2 3.96Å; A184-V312 WeakPolarHBondContact O-CG2 3.28Å; A184-Y316 HydrophobicContact CB-CE2 3.88Å
185	N	97.8	Very high	97.7	Very high	17 Å²	17	30.6 Å²	30.6	9%	0.091	16%	0.159	C	C	.	.	H	α-helix	trans	-61	-48.9	173.3	-86.5	-79.9	0	0	0	111.5	L181 W182 L187 G188 Y189 W308	L181-N185 WeakPolarHBondContact CD1-ND2 3.21Å; L181-N185 PolarHBondContact O-N 2.94Å; L181-N185 PolarHBondContact O-ND2 3.04Å; W182-N185 PolarHBondContact O-N 2.83Å; N185-L187 VanDerWaalsContact C-N 3.29Å; N185-L187 PolarHBondContact O-N 3.21Å; N185-G188 PolarHBondContact O-N 2.8Å; N185-G188 VanDerWaalsContact O-N 3.16Å; N185-Y189 VanDerWaalsContact O-CD2 3.23Å; N185-Y189 WeakPolarHBondContact O-CD2 3.39Å; N185-Y189 PolarHBondContact O-N 3.23Å; N185-W308 PolarHBondContact OD1-NE1 3.39Å
186	I	97.9	Very high	97.6	Very high	106 Å²	106	28.3 Å²	28.3	54%	0.544	15%	0.147	S	C	.	.	H	α-helix	trans	-55.9	-46.6	177.8	-69.2	164.5	0	0	0	110.4	I92 W182 C183 A190	I92-I186 HydrophobicContact CD1-CD1 3.98Å; W182-I186 VanDerWaalsContact O-CG1 3.29Å; W182-I186 WeakPolarHBondContact O-CG1 3.46Å; W182-I186 PolarHBondContact O-N 3.42Å; C183-I186 PolarHBondContact O-N 3.46Å; I186-A190 WeakPolarHBondContact O-CB 3.34Å; I186-A190 PolarHBondContact O-N 3.39Å
187	L	97.7	Very high	97.5	Very high	38 Å²	38	30.4 Å²	30.4	20%	0.199	16%	0.159	C	C	.	.	H	α-helix	trans	-63.9	-44.9	177.5	-178.8	63.6	0	0	0	112.2	Y100 V104 C183 A184 N185 Y189 A190 V191 F239	Y100-L187 HydrophobicContact CE1-CB 3.92Å; Y100-L187 HydrophobicContact CE1-CD2 3.67Å; Y100-L187 HydrophobicContact CE1-CG 4.45Å; V104-L187 HydrophobicContact CG1-CD2 4.37Å; V104-L187 HydrophobicContact CG2-CD2 3.78Å; C183-L187 PolarHBondContact O-N 3.38Å; A184-L187 PolarHBondContact O-N 3.37Å; N185-L187 VanDerWaalsContact C-N 3.29Å; N185-L187 PolarHBondContact O-N 3.21Å; L187-Y189 PolarHBondContact O-N 2.97Å; L187-A190 PolarHBondContact O-N 3.11Å; L187-V191 WeakPolarHBondContact O-CB 3.49Å; L187-V191 WeakPolarHBondContact O-CG1 3.27Å; L187-V191 PolarHBondContact O-N 3.45Å; L187-F239 HydrophobicContact CD1-CE1 4.39Å; L187-F239 HydrophobicContact CD2-CE1 4Å; L187-F239 HydrophobicContact CG-CE1 4.11Å
188	G	97.3	Very high	97.4	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-59.1	-44.3	178.9	0	0	0	0	0	112.5	A184 N185 V191 S192	A184-G188 PolarHBondContact O-N 2.99Å; N185-G188 PolarHBondContact O-N 2.8Å; N185-G188 VanDerWaalsContact O-N 3.16Å; G188-V191 WeakPolarHBondContact O-CG1 3.36Å; G188-S192 WeakPolarHBondContact O-CB 3.21Å; G188-S192 PolarHBondContact O-N 3.31Å; G188-S192 PolarHBondContact O-OG 2.86Å
189	Y	97.7	Very high	97.3	Very high	81 Å²	81	29.7 Å²	29.7	32%	0.318	16%	0.157	S	C	.	.	H	α-helix	trans	-69.8	-41.9	173.6	-77.5	-75.6	0	0	0	112.1	P51 N185 L187 S192 T193 Y219 W304	P51-Y189 WeakPolarHBondContact CG-OH 3.42Å; N185-Y189 VanDerWaalsContact O-CD2 3.23Å; N185-Y189 WeakPolarHBondContact O-CD2 3.39Å; N185-Y189 PolarHBondContact O-N 3.23Å; L187-Y189 PolarHBondContact O-N 2.97Å; Y189-S192 PolarHBondContact O-N 3.35Å; Y189-T193 WeakPolarHBondContact O-CB 3.38Å; Y189-T193 PolarHBondContact O-N 3.34Å; Y189-T193 PolarHBondContact O-OG1 3.2Å; Y189-Y219 WeakPolarHBondContact CD1-OH 3.39Å; Y189-Y219 PolarHBondContact O-OH 3.05Å; Y189-W304 AromaticContact CD1-CD1 3.79Å; Y189-W304 AromaticContact CD1-NE1 3.53Å; Y189-W304 AromaticContact CE1-CD1 3.75Å; Y189-W304 AromaticContact CE1-NE1 3.11Å; Y189-W304 AromaticContact CZ-NE1 3.49Å
190	A	97.8	Very high	97	Very high	53 Å²	53	34.1 Å²	34.1	44%	0.438	17%	0.173	S	C	.	.	H	α-helix	trans	-62.4	-46.3	-179.6	0	0	0	0	0	112.2	I186 L187 S192 T193 F194	I186-A190 WeakPolarHBondContact O-CB 3.34Å; I186-A190 PolarHBondContact O-N 3.39Å; L187-A190 PolarHBondContact O-N 3.11Å; A190-S192 VanDerWaalsContact C-N 3.33Å; A190-S192 PolarHBondContact O-N 2.93Å; A190-T193 PolarHBondContact O-N 3.42Å; A190-F194 VanDerWaalsContact O-CB 3.27Å; A190-F194 WeakPolarHBondContact O-CB 3.38Å; A190-F194 PolarHBondContact O-N 2.87Å
191	V	97.1	Very high	96.8	Very high	8 Å²	8	41.2 Å²	41.2	5%	0.048	20%	0.203	C	C	.	.	H	α-helix	trans	-66.3	-37.3	179.3	73.9	0	0	0	0	111.7	L187 G188 F194 A195 F235 F239 F302	L187-V191 WeakPolarHBondContact O-CB 3.49Å; L187-V191 WeakPolarHBondContact O-CG1 3.27Å; L187-V191 PolarHBondContact O-N 3.45Å; G188-V191 WeakPolarHBondContact O-CG1 3.36Å; V191-F194 PolarHBondContact O-N 3.3Å; V191-A195 WeakPolarHBondContact O-CB 3.27Å; V191-A195 PolarHBondContact O-N 3.36Å; V191-F235 HydrophobicContact CG2-CD1 3.5Å; V191-F235 HydrophobicContact CG2-CE1 3.59Å; V191-F239 HydrophobicContact CB-CE1 4.28Å; V191-F239 HydrophobicContact CB-CE2 4.2Å; V191-F239 HydrophobicContact CB-CZ 3.82Å; V191-F239 HydrophobicContact CG1-CE1 4.25Å; V191-F239 HydrophobicContact CG1-CZ 4.24Å; V191-F239 HydrophobicContact CG2-CD2 3.94Å; V191-F239 HydrophobicContact CG2-CE1 4.15Å; V191-F239 HydrophobicContact CG2-CE2 3.22Å; V191-F239 HydrophobicContact CG2-CZ 3.33Å; V191-F302 HydrophobicContact CG2-CE1 3.96Å; V191-F302 HydrophobicContact CG2-CZ 4.21Å
192	S	97.1	Very high	96.7	Very high	1 Å²	1	46 Å²	46	1%	0.007	22%	0.224	C	C	.	.	H	α-helix	trans	-70.1	-42.8	-179.9	-55	0	0	0	0	111.4	G188 Y189 A190 A195 M196 W304	G188-S192 WeakPolarHBondContact O-CB 3.21Å; G188-S192 PolarHBondContact O-N 3.31Å; G188-S192 PolarHBondContact O-OG 2.86Å; Y189-S192 PolarHBondContact O-N 3.35Å; A190-S192 VanDerWaalsContact C-N 3.33Å; A190-S192 PolarHBondContact O-N 2.93Å; S192-A195 PolarHBondContact O-N 3.06Å; S192-M196 PolarHBondContact O-N 2.91Å; S192-W304 VanDerWaalsContact OG-CA 3.27Å; S192-W304 WeakPolarHBondContact OG-CA 3.33Å
193	T	97.4	Very high	96.4	Very high	61 Å²	61	45.1 Å²	45.1	37%	0.374	23%	0.227	S	C	.	.	H	α-helix	trans	-63.6	-44.1	172.5	-59.5	0	0	0	0	111.1	Y189 A190 A195 M196 V197 Y219	Y189-T193 WeakPolarHBondContact O-CB 3.38Å; Y189-T193 PolarHBondContact O-N 3.34Å; Y189-T193 PolarHBondContact O-OG1 3.2Å; A190-T193 PolarHBondContact O-N 3.42Å; T193-A195 PolarHBondContact O-N 3.19Å; T193-M196 PolarHBondContact O-N 3.17Å; T193-V197 HydrophobicContact CG2-CG2 4.41Å; T193-V197 WeakPolarHBondContact O-CG2 3.36Å; T193-V197 PolarHBondContact O-N 3.45Å; T193-Y219 WeakPolarHBondContact OG1-CE2 3.48Å; T193-Y219 PolarHBondContact OG1-OH 3.03Å
194	F	97.4	Very high	96.1	Very high	74 Å²	74	48 Å²	48	33%	0.325	24%	0.244	S	C	.	.	H	α-helix	trans	-58.7	-47	174.5	174.6	-94	0	0	0	111.6	A190 V191 M196 V197 K198 F202 I229 F235	A190-F194 VanDerWaalsContact O-CB 3.27Å; A190-F194 WeakPolarHBondContact O-CB 3.38Å; A190-F194 PolarHBondContact O-N 2.87Å; V191-F194 PolarHBondContact O-N 3.3Å; F194-M196 VanDerWaalsContact C-N 3.31Å; F194-M196 PolarHBondContact O-N 3.41Å; F194-V197 PolarHBondContact O-N 2.79Å; F194-K198 HydrophobicContact CE1-CB 4.39Å; F194-K198 HydrophobicContact CE1-CD 3.97Å; F194-K198 HydrophobicContact CZ-CD 4.34Å; F194-K198 WeakPolarHBondContact O-CB 3.4Å; F194-K198 PolarHBondContact O-N 2.92Å; F194-F202 HydrophobicContact CE2-CE2 4.02Å; F194-F202 HydrophobicContact CE2-CZ 4.13Å; F194-F202 AromaticContact CZ-CE2 3.95Å; F194-F202 HydrophobicContact CZ-CE2 3.95Å; F194-F202 HydrophobicContact CZ-CZ 4.5Å; F194-I229 HydrophobicContact CE1-CD1 4.4Å; F194-I229 HydrophobicContact CZ-CD1 4.3Å; F194-I229 HydrophobicContact CZ-CG1 4.48Å; F194-F235 AromaticContact CD1-CE1 3.71Å; F194-F235 HydrophobicContact CD1-CE1 3.71Å; F194-F235 AromaticContact CD1-CZ 3.69Å; F194-F235 HydrophobicContact CD1-CZ 3.69Å; F194-F235 AromaticContact CE1-CE1 3.86Å; F194-F235 HydrophobicContact CE1-CE1 3.86Å; F194-F235 HydrophobicContact CE1-CE2 4.08Å; F194-F235 AromaticContact CE1-CZ 3.31Å; F194-F235 HydrophobicContact CE1-CZ 3.31Å; F194-F235 HydrophobicContact CZ-CZ 4.35Å
195	A	96.7	Very high	95.6	Very high	1 Å²	1	49.1 Å²	49.1	1%	0.008	25%	0.252	C	S	.	.	H	α-helix	trans	-61.9	-38.4	178.6	0	0	0	0	0	112.2	V191 S192 T193 G199 P227 F302	V191-A195 WeakPolarHBondContact O-CB 3.27Å; V191-A195 PolarHBondContact O-N 3.36Å; S192-A195 PolarHBondContact O-N 3.06Å; T193-A195 PolarHBondContact O-N 3.19Å; A195-G199 PolarHBondContact O-N 3.42Å; A195-P227 HydrophobicContact CB-CG 4.44Å; A195-F302 HydrophobicContact CB-CD1 3.72Å; A195-F302 HydrophobicContact CB-CE1 4.1Å
196	M	95.9	Very high	95.1	Very high	23 Å²	23	52 Å²	52	11%	0.113	28%	0.278	C	S	.	.	H	α-helix	trans	-65.3	-54.5	174.1	-169.6	178.6	78.1	0	0	111.1	S192 T193 F194 K198 G199 Y200 F215 Y219	S192-M196 PolarHBondContact O-N 2.91Å; T193-M196 PolarHBondContact O-N 3.17Å; F194-M196 VanDerWaalsContact C-N 3.31Å; F194-M196 PolarHBondContact O-N 3.41Å; M196-K198 VanDerWaalsContact C-N 3.26Å; M196-K198 PolarHBondContact O-N 2.92Å; M196-G199 PolarHBondContact O-N 3.27Å; M196-Y200 HydrophobicContact CG-CD2 4.03Å; M196-Y200 HydrophobicContact CG-CE2 3.88Å; M196-Y200 VanDerWaalsContact O-CD2 3.32Å; M196-Y200 WeakPolarHBondContact O-CD2 3.3Å; M196-Y200 PolarHBondContact O-N 2.84Å; M196-Y200 VanDerWaalsContact O-N 3.16Å; M196-F215 HydrophobicContact CE-CD2 4.22Å; M196-F215 HydrophobicContact CE-CE2 3.29Å; M196-F215 HydrophobicContact CE-CZ 3.64Å; M196-F215 HydrophobicContact SD-CD2 4.38Å; M196-F215 HydrophobicContact SD-CE2 3.93Å; M196-F215 HydrophobicContact SD-CZ 4.28Å; M196-Y219 HydrophobicContact CB-CD2 4.42Å; M196-Y219 HydrophobicContact CE-CD2 4.22Å; M196-Y219 HydrophobicContact SD-CD2 3.72Å; M196-Y219 HydrophobicContact SD-CG 4.37Å
197	V	96.4	Very high	94.6	Very high	55 Å²	55	55.4 Å²	55.4	33%	0.333	28%	0.284	S	S	.	.	H	α-helix	trans	-54.4	-46.1	178.1	171.3	0	0	0	0	110.4	T193 F194 G199 Y200 F201 F202	T193-V197 HydrophobicContact CG2-CG2 4.41Å; T193-V197 WeakPolarHBondContact O-CG2 3.36Å; T193-V197 PolarHBondContact O-N 3.45Å; F194-V197 PolarHBondContact O-N 2.79Å; V197-G199 PolarHBondContact O-N 2.95Å; V197-Y200 PolarHBondContact O-N 3.34Å; V197-Y200 VanDerWaalsContact O-N 3.16Å; V197-F201 HydrophobicContact CG1-CD2 3.76Å; V197-F201 HydrophobicContact CG1-CE2 4.24Å; V197-F201 VanDerWaalsContact O-CD2 3.23Å; V197-F201 WeakPolarHBondContact O-CD2 3.47Å; V197-F201 PolarHBondContact O-N 3.08Å; V197-F202 HydrophobicContact CG1-CE1 3.95Å; V197-F202 HydrophobicContact CG1-CZ 4.17Å
198	K	95.6	Very high	94.1	Very high	6 Å²	6	54 Å²	54	3%	0.026	28%	0.277	C	S	.	.	H	α-helix	trans	-55.6	-48.9	174.7	176.5	173.8	-172.7	-39.8	0	112.5	F194 M196 Y200 F201 F202 P203 T204 E224 P227 R228	F194-K198 HydrophobicContact CE1-CB 4.39Å; F194-K198 HydrophobicContact CE1-CD 3.97Å; F194-K198 HydrophobicContact CZ-CD 4.34Å; F194-K198 WeakPolarHBondContact O-CB 3.4Å; F194-K198 PolarHBondContact O-N 2.92Å; M196-K198 VanDerWaalsContact C-N 3.26Å; M196-K198 PolarHBondContact O-N 2.92Å; K198-Y200 PolarHBondContact O-N 3.46Å; K198-F201 PolarHBondContact O-N 3.3Å; K198-F202 VanDerWaalsContact CA-CE2 3.41Å; K198-F202 VanDerWaalsContact CA-CZ 3.45Å; K198-F202 HydrophobicContact CB-CD2 3.78Å; K198-F202 HydrophobicContact CB-CE2 3.29Å; K198-F202 HydrophobicContact CB-CZ 3.76Å; K198-F202 HydrophobicContact CD-CD2 4.16Å; K198-F202 HydrophobicContact CD-CE2 4.05Å; K198-F202 HydrophobicContact CG-CD2 3.43Å; K198-F202 VanDerWaalsContact CG-CD2 3.43Å; K198-F202 HydrophobicContact CG-CE2 3.43Å; K198-F202 VanDerWaalsContact CG-CE2 3.43Å; K198-F202 HydrophobicContact CG-CG 4.32Å; K198-F202 HydrophobicContact CG-CZ 4.34Å; K198-F202 WeakPolarHBondContact CG-O 3.14Å; K198-F202 PolarHBondContact NZ-O 2.94Å; K198-F202 CarbonylContact O-C 3.03Å; K198-F202 WeakPolarHBondContact O-CA 3.2Å; K198-F202 PolarHBondContact O-N 3.02Å; K198-P203 VanDerWaalsContact O-N 3.08Å; K198-T204 PolarHBondContact NZ-OG1 3.17Å; K198-E224 WeakPolarHBondContact CD-OE2 3.49Å; K198-E224 WeakPolarHBondContact CG-OE2 3.33Å; K198-E224 VanDerWaalsContact NZ-CD 3.25Å; K198-E224 IonicContact NZ-OE1 2.92Å; K198-E224 PolarHBondContact NZ-OE1 3.48Å; K198-E224 IonicContact NZ-OE2 2.75Å; K198-E224 PolarHBondContact NZ-OE2 3.24Å; K198-P227 HydrophobicContact CD-CB 4.05Å; K198-R228 WeakPolarHBondContact CE-O 3.39Å
199	G	94.1	Very high	93.8	Very high	2 Å²	2	54.9 Å²	54.9	2%	0.021	28%	0.282	C	S	.	.	H	α-helix	trans	-59.7	-30.7	179.2	0	0	0	0	0	113.6	A195 M196 V197	A195-G199 PolarHBondContact O-N 3.42Å; M196-G199 PolarHBondContact O-N 3.27Å; V197-G199 PolarHBondContact O-N 2.95Å
200	Y	93.3	Very high	93.4	Very high	103 Å²	103	51.7 Å²	51.7	40%	0.404	27%	0.27	S	S	.	.	H	α-helix	trans	-83.2	-38.6	177.8	-83.1	-88	0	0	0	113.9	M196 V197 K198 F211 N218 V223	M196-Y200 HydrophobicContact CG-CD2 4.03Å; M196-Y200 HydrophobicContact CG-CE2 3.88Å; M196-Y200 VanDerWaalsContact O-CD2 3.32Å; M196-Y200 WeakPolarHBondContact O-CD2 3.3Å; M196-Y200 PolarHBondContact O-N 2.84Å; M196-Y200 VanDerWaalsContact O-N 3.16Å; V197-Y200 PolarHBondContact O-N 3.34Å; V197-Y200 VanDerWaalsContact O-N 3.16Å; K198-Y200 PolarHBondContact O-N 3.46Å; Y200-F211 HydrophobicContact CD1-CD1 4.3Å; Y200-F211 AromaticContact CD1-CE1 3.62Å; Y200-F211 HydrophobicContact CD1-CE1 3.62Å; Y200-F211 HydrophobicContact CD1-CZ 4.49Å; Y200-F211 HydrophobicContact CD2-CE1 4.15Å; Y200-F211 AromaticContact CE1-CD1 3.64Å; Y200-F211 HydrophobicContact CE1-CD1 3.64Å; Y200-F211 AromaticContact CE1-CE1 3.44Å; Y200-F211 HydrophobicContact CE1-CE1 3.44Å; Y200-F211 VanDerWaalsContact CE1-CE1 3.44Å; Y200-F211 HydrophobicContact CE2-CD1 4.27Å; Y200-F211 AromaticContact CE2-CE1 3.99Å; Y200-F211 HydrophobicContact CE2-CE1 3.99Å; Y200-F211 AromaticContact CG-CE1 3.98Å; Y200-F211 HydrophobicContact CG-CE1 3.98Å; Y200-F211 AromaticContact CZ-CD1 3.63Å; Y200-F211 AromaticContact CZ-CE1 3.64Å; Y200-N218 PolarHBondContact OH-ND2 3.4Å; Y200-V223 HydrophobicContact CD2-CG2 4.39Å; Y200-V223 HydrophobicContact CE2-CG2 3.79Å
201	F	94.6	Very high	93	Very high	164 Å²	164	54.2 Å²	54.2	72%	0.719	27%	0.271	S	S	*	.	H	α-helix	trans	-110.8	-31.5	-168.4	-64.3	-72.7	0	0	0	114.5	V197 K198	V197-F201 HydrophobicContact CG1-CD2 3.76Å; V197-F201 HydrophobicContact CG1-CE2 4.24Å; V197-F201 VanDerWaalsContact O-CD2 3.23Å; V197-F201 WeakPolarHBondContact O-CD2 3.47Å; V197-F201 PolarHBondContact O-N 3.08Å; K198-F201 PolarHBondContact O-N 3.3Å
202	F	94.8	Very high	92.5	Very high	101 Å²	101	54.9 Å²	54.9	44%	0.443	28%	0.276	S	S	.	.	S	Bend	trans	-145.6	57.5	-174.6	46.1	-85.1	0	0	0	112	F194 V197 K198	F194-F202 HydrophobicContact CE2-CE2 4.02Å; F194-F202 HydrophobicContact CE2-CZ 4.13Å; F194-F202 AromaticContact CZ-CE2 3.95Å; F194-F202 HydrophobicContact CZ-CE2 3.95Å; F194-F202 HydrophobicContact CZ-CZ 4.5Å; V197-F202 HydrophobicContact CG1-CE1 3.95Å; V197-F202 HydrophobicContact CG1-CZ 4.17Å; K198-F202 VanDerWaalsContact CA-CE2 3.41Å; K198-F202 VanDerWaalsContact CA-CZ 3.45Å; K198-F202 HydrophobicContact CB-CD2 3.78Å; K198-F202 HydrophobicContact CB-CE2 3.29Å; K198-F202 HydrophobicContact CB-CZ 3.76Å; K198-F202 HydrophobicContact CD-CD2 4.16Å; K198-F202 HydrophobicContact CD-CE2 4.05Å; K198-F202 HydrophobicContact CG-CD2 3.43Å; K198-F202 VanDerWaalsContact CG-CD2 3.43Å; K198-F202 HydrophobicContact CG-CE2 3.43Å; K198-F202 VanDerWaalsContact CG-CE2 3.43Å; K198-F202 HydrophobicContact CG-CG 4.32Å; K198-F202 HydrophobicContact CG-CZ 4.34Å; K198-F202 WeakPolarHBondContact CG-O 3.14Å; K198-F202 PolarHBondContact NZ-O 2.94Å; K198-F202 CarbonylContact O-C 3.03Å; K198-F202 WeakPolarHBondContact O-CA 3.2Å; K198-F202 PolarHBondContact O-N 3.02Å
203	P	93	Very high	91.8	Very high	44 Å²	44	59 Å²	59	29%	0.286	32%	0.318	S	S	.	.			trans	-66.1	142.7	179.3	29.2	-35.6	0	0	0	110.9	K198 S205 A206 C209	K198-P203 VanDerWaalsContact O-N 3.08Å; P203-S205 VanDerWaalsContact C-N 3.27Å; P203-S205 PolarHBondContact O-N 2.9Å; P203-A206 HydrophobicContact CG-CB 4.18Å; P203-C209 WeakPolarHBondContact CB-SG 3.18Å
204	T	90.6	Very high	91.5	Very high	69 Å²	69	57.6 Å²	57.6	42%	0.423	31%	0.308	S	S	.	.	S	Bend	trans	-65.4	-37.2	175	-61.7	0	0	0	0	110.1	K198 E224 R228	K198-T204 PolarHBondContact NZ-OG1 3.17Å; T204-E224 WeakPolarHBondContact CA-OE1 3.44Å; T204-E224 WeakPolarHBondContact CB-OE1 3.47Å; T204-E224 PolarHBondContact N-OE1 3.27Å; T204-E224 PolarHBondContact OG1-OE1 2.83Å; T204-E224 VanDerWaalsContact OG1-OE1 3.1Å; T204-R228 HydrophobicContact CG2-CB 4.13Å; T204-R228 PolarHBondContact OG1-N 3.16Å; T204-R228 PolarHBondContact OG1-O 2.87Å
205	S	87.4	Confident	91.3	Very high	24 Å²	24	59.5 Å²	59.5	17%	0.168	32%	0.317	C	S	.	.			trans	-143.2	109	173.1	173	0	0	0	0	108.7	P203 R207 D208 C209	P203-S205 VanDerWaalsContact C-N 3.27Å; P203-S205 PolarHBondContact O-N 2.9Å; S205-R207 PolarHBondContact O-N 2.93Å; S205-D208 VanDerWaalsContact CB-OD2 3.23Å; S205-D208 WeakPolarHBondContact CB-OD2 3.22Å; S205-D208 PolarHBondContact O-N 3.46Å; S205-D208 PolarHBondContact OG-OD2 2.65Å; S205-C209 PolarHBondContact O-SG 3.41Å; S205-C209 VanDerWaalsContact O-SG 3.41Å
206	A	87.4	Confident	91.2	Very high	77 Å²	77	64.2 Å²	64.2	64%	0.636	34%	0.337	S	S	*	.	G	3₁₀ helix	trans	-61	-28.7	178.6	0	0	0	0	0	112.5	P203 D208 C209	P203-A206 HydrophobicContact CG-CB 4.18Å; A206-D208 PolarHBondContact O-N 3.08Å; A206-C209 PolarHBondContact O-N 2.83Å
207	R	87.3	Confident	91.1	Very high	179 Å²	179	64 Å²	64	68%	0.675	34%	0.335	S	S	*	.	G	3₁₀ helix	trans	-71.3	-19.2	175.9	-65.1	-173.2	-65.7	166.8	2.5	113.2	A137 S205	A137-R207 HydrophobicContact CB-CB 3.47Å; A137-R207 VanDerWaalsContact CB-CB 3.47Å; S205-R207 PolarHBondContact O-N 2.93Å
208	D	88.4	Confident	90.9	Very high	8 Å²	8	61.3 Å²	61.3	4%	0.043	32%	0.319	C	S	.	.	G	3₁₀ helix	trans	-101.2	21.6	175.2	-66	-60.1	0	0	0	112.1	T135 A137 S205 A206 F225	T135-D208 VanDerWaalsContact CB-OD1 3.25Å; T135-D208 WeakPolarHBondContact CB-OD1 3.39Å; T135-D208 PolarHBondContact OG1-OD1 3.46Å; T135-D208 PolarHBondContact OG1-OD2 3.46Å; A137-D208 WeakPolarHBondContact CB-OD1 3.27Å; A137-D208 WeakPolarHBondContact CB-OD2 3.14Å; A137-D208 PolarHBondContact N-OD1 3.37Å; A137-D208 VanDerWaalsContact N-OD1 3.13Å; S205-D208 VanDerWaalsContact CB-OD2 3.23Å; S205-D208 WeakPolarHBondContact CB-OD2 3.22Å; S205-D208 PolarHBondContact O-N 3.46Å; S205-D208 PolarHBondContact OG-OD2 2.65Å; A206-D208 PolarHBondContact O-N 3.08Å; D208-F225 HydrophobicContact CB-CB 3.92Å; D208-F225 WeakPolarHBondContact O-CB 3.25Å; D208-F225 PolarHBondContact O-N 3.31Å
209	C	90.9	Very high	91	Very high	18 Å²	18	62.2 Å²	62.2	12%	0.122	32%	0.322	C	S	.	.	B	Isolated β-bridge	trans	-107.1	144.5	174.1	-67.5	0	0	0	0	111.3	P203 S205 A206 F211 V223	P203-C209 WeakPolarHBondContact CB-SG 3.18Å; S205-C209 PolarHBondContact O-SG 3.41Å; S205-C209 VanDerWaalsContact O-SG 3.41Å; A206-C209 PolarHBondContact O-N 2.83Å; C209-F211 HydrophobicContact CB-CE2 3.93Å; C209-F211 HydrophobicContact CB-CZ 4.26Å; C209-V223 CarbonylContact C-O 3.57Å; C209-V223 WeakPolarHBondContact CA-O 3.31Å; C209-V223 HydrophobicContact CB-CG1 4.17Å
210	K	88.7	Confident	91	Very high	15 Å²	15	62.5 Å²	62.5	7%	0.065	32%	0.323	C	S	.	.			trans	-134.1	137.1	177.4	-66	-166.1	-175.6	-123.8	0	112.8	W29 R31 W33 V223	W29-K210 VanDerWaalsContact CZ3-CE 3.41Å; W29-K210 WeakPolarHBondContact O-CE 3.14Å; W29-K210 PolarHBondContact O-NZ 2.93Å; R31-K210 HydrophobicContact CG-CD 4.32Å; W33-K210 HydrophobicContact CH2-CD 4.36Å; W33-K210 HydrophobicContact CZ3-CD 4.27Å; K210-V223 PolarHBondContact N-O 2.68Å
211	F	89.8	Confident	90.9	Very high	105 Å²	105	59.4 Å²	59.4	46%	0.461	31%	0.313	S	S	.	.			trans	-128.1	134.5	-178.3	-55.9	-88.1	0	0	0	109.4	Y200 C209 V223	Y200-F211 HydrophobicContact CD1-CD1 4.3Å; Y200-F211 AromaticContact CD1-CE1 3.62Å; Y200-F211 HydrophobicContact CD1-CE1 3.62Å; Y200-F211 HydrophobicContact CD1-CZ 4.49Å; Y200-F211 HydrophobicContact CD2-CE1 4.15Å; Y200-F211 AromaticContact CE1-CD1 3.64Å; Y200-F211 HydrophobicContact CE1-CD1 3.64Å; Y200-F211 AromaticContact CE1-CE1 3.44Å; Y200-F211 HydrophobicContact CE1-CE1 3.44Å; Y200-F211 VanDerWaalsContact CE1-CE1 3.44Å; Y200-F211 HydrophobicContact CE2-CD1 4.27Å; Y200-F211 AromaticContact CE2-CE1 3.99Å; Y200-F211 HydrophobicContact CE2-CE1 3.99Å; Y200-F211 AromaticContact CG-CE1 3.98Å; Y200-F211 HydrophobicContact CG-CE1 3.98Å; Y200-F211 AromaticContact CZ-CD1 3.63Å; Y200-F211 AromaticContact CZ-CE1 3.64Å; C209-F211 HydrophobicContact CB-CE2 3.93Å; C209-F211 HydrophobicContact CB-CZ 4.26Å; F211-V223 HydrophobicContact CD1-CG1 3.79Å; F211-V223 HydrophobicContact CD1-CG2 4.18Å; F211-V223 HydrophobicContact CE1-CB 4.36Å; F211-V223 HydrophobicContact CE1-CG1 3.25Å; F211-V223 HydrophobicContact CE1-CG2 4.18Å; F211-V223 HydrophobicContact CE2-CG1 4.11Å; F211-V223 HydrophobicContact CG-CG1 4.44Å; F211-V223 HydrophobicContact CZ-CG1 3.43Å; F211-V223 VanDerWaalsContact CZ-CG1 3.43Å
212	T	85	Confident	90.9	Very high	23 Å²	23	51.7 Å²	51.7	14%	0.141	28%	0.28	C	S	.	.			trans	-117.5	18.3	-177.1	63.6	0	0	0	0	113	R31 A32 N214 Y217 N218	R31-T212 VanDerWaalsContact NH2-CG2 3.26Å; R31-T212 PolarHBondContact NH2-OG1 3.44Å; A32-T212 WeakPolarHBondContact O-CG2 3.21Å; T212-N214 PolarHBondContact O-N 3.45Å; T212-Y217 HydrophobicContact CG2-CD1 3.91Å; T212-Y217 HydrophobicContact CG2-CE1 3.89Å; T212-Y217 WeakPolarHBondContact OG1-CD1 3.46Å; T212-N218 PolarHBondContact N-OD1 2.81Å; T212-N218 PolarHBondContact OG1-OD1 3.12Å; T212-N218 VanDerWaalsContact OG1-OD1 3.1Å
213	G	83.9	Confident	90.9	Very high	86 Å²	86	46.9 Å²	46.9	89%	0.887	26%	0.258	S	S	*	.	S	Bend	trans	65.5	-18.1	-174.8	0	0	0	0	0	115.8
214	N	91	Very high	90.9	Very high	32 Å²	32	44.9 Å²	44.9	17%	0.171	25%	0.246	C	C	.	.			trans	-99.1	118.5	-178.1	-173.5	-65.8	0	0	0	111.4	V35 L40 T212 F216 Y217 N218	V35-N214 HydrophobicContact CB-CB 4.31Å; V35-N214 HydrophobicContact CG2-CB 4Å; L40-N214 VanDerWaalsContact CD1-ND2 3.34Å; L40-N214 WeakPolarHBondContact CD1-ND2 3.33Å; T212-N214 PolarHBondContact O-N 3.45Å; N214-F216 PolarHBondContact OD1-N 3.33Å; N214-Y217 PolarHBondContact OD1-N 3.22Å; N214-N218 WeakPolarHBondContact O-CB 3.42Å; N214-N218 VanDerWaalsContact O-CG 3.27Å; N214-N218 PolarHBondContact O-N 3.43Å
215	F	93	Very high	91	Very high	115 Å²	115	41.8 Å²	41.8	50%	0.504	23%	0.226	S	C	.	.	H	α-helix	trans	-60	-49.6	-178.9	178	-91.7	0	0	0	113.2	M196 Y217 N218 Y219	M196-F215 HydrophobicContact CE-CD2 4.22Å; M196-F215 HydrophobicContact CE-CE2 3.29Å; M196-F215 HydrophobicContact CE-CZ 3.64Å; M196-F215 HydrophobicContact SD-CD2 4.38Å; M196-F215 HydrophobicContact SD-CE2 3.93Å; M196-F215 HydrophobicContact SD-CZ 4.28Å; F215-Y217 PolarHBondContact O-N 2.87Å; F215-N218 PolarHBondContact O-N 3.31Å; F215-Y219 WeakPolarHBondContact O-CB 3.5Å; F215-Y219 PolarHBondContact O-N 2.79Å
216	F	94.4	Very high	91.3	Very high	99 Å²	99	41.2 Å²	41.2	43%	0.434	22%	0.221	S	C	.	.	H	α-helix	trans	-64.7	-41.7	-176.3	-65.6	-72.7	0	0	0	112	L40 I43 I44 L47 N214 Y219 M220	L40-F216 HydrophobicContact CD1-CB 4.03Å; L40-F216 HydrophobicContact CD1-CD2 4.28Å; I43-F216 HydrophobicContact CG2-CB 4.27Å; I44-F216 HydrophobicContact CD1-CD2 4.32Å; I44-F216 HydrophobicContact CG1-CB 4.47Å; I44-F216 HydrophobicContact CG1-CD2 4.44Å; I44-F216 HydrophobicContact CG1-CG 4.23Å; L47-F216 HydrophobicContact CD1-CD1 4.2Å; N214-F216 PolarHBondContact OD1-N 3.33Å; F216-Y219 PolarHBondContact O-N 3.5Å; F216-M220 VanDerWaalsContact O-CB 3.32Å; F216-M220 WeakPolarHBondContact O-CB 3.49Å; F216-M220 PolarHBondContact O-N 2.82Å
217	Y	92.9	Very high	91.7	Very high	18 Å²	18	37.6 Å²	37.6	7%	0.071	19%	0.191	C	C	.	.	H	α-helix	trans	-67.2	-40.7	176.4	-171.4	-87	0	0	0	111.1	R31 A32 V35 I43 T212 N214 F215 Y219 M221	R31-Y217 VanDerWaalsContact CZ-CE1 3.46Å; R31-Y217 VanDerWaalsContact NE-CE1 3.31Å; A32-Y217 HydrophobicContact CB-CE2 4.5Å; A32-Y217 VanDerWaalsContact CB-OH 3.27Å; A32-Y217 WeakPolarHBondContact CB-OH 3.27Å; A32-Y217 PolarHBondContact N-OH 3.25Å; V35-Y217 HydrophobicContact CB-CD2 4.32Å; V35-Y217 HydrophobicContact CB-CG 4.37Å; V35-Y217 HydrophobicContact CG1-CD2 3.71Å; V35-Y217 HydrophobicContact CG1-CG 4.03Å; V35-Y217 HydrophobicContact CG2-CD1 3.55Å; V35-Y217 HydrophobicContact CG2-CD2 3.66Å; V35-Y217 HydrophobicContact CG2-CE1 4.19Å; V35-Y217 HydrophobicContact CG2-CE2 4.31Å; V35-Y217 HydrophobicContact CG2-CG 3.37Å; I43-Y217 HydrophobicContact CD1-CD2 3.06Å; I43-Y217 HydrophobicContact CD1-CE2 3.7Å; I43-Y217 HydrophobicContact CD1-CG 3.75Å; I43-Y217 HydrophobicContact CG1-CD2 4.47Å; T212-Y217 HydrophobicContact CG2-CD1 3.91Å; T212-Y217 HydrophobicContact CG2-CE1 3.89Å; T212-Y217 WeakPolarHBondContact OG1-CD1 3.46Å; N214-Y217 PolarHBondContact OD1-N 3.22Å; F215-Y217 PolarHBondContact O-N 2.87Å; Y217-Y219 PolarHBondContact O-N 3.39Å; Y217-M221 HydrophobicContact CE1-CB 4.36Å; Y217-M221 HydrophobicContact CE1-CG 4.13Å; Y217-M221 HydrophobicContact CE2-CG 4.08Å; Y217-M221 WeakPolarHBondContact O-CB 3.03Å; Y217-M221 PolarHBondContact O-N 3.07Å
218	N	93.9	Very high	92.1	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-59.7	-43.7	171.7	-77.2	-12.7	0	0	0	113	R31 Y200 T212 N214 F215 G222 V223	R31-N218 PolarHBondContact NH2-OD1 2.92Å; Y200-N218 PolarHBondContact OH-ND2 3.4Å; T212-N218 PolarHBondContact N-OD1 2.81Å; T212-N218 PolarHBondContact OG1-OD1 3.12Å; T212-N218 VanDerWaalsContact OG1-OD1 3.1Å; N214-N218 WeakPolarHBondContact O-CB 3.42Å; N214-N218 VanDerWaalsContact O-CG 3.27Å; N214-N218 PolarHBondContact O-N 3.43Å; F215-N218 PolarHBondContact O-N 3.31Å; N218-G222 CarbonylContact O-C 3.58Å; N218-G222 VanDerWaalsContact O-CA 3.25Å; N218-G222 WeakPolarHBondContact O-CA 3.32Å; N218-G222 PolarHBondContact O-N 3.27Å; N218-V223 HydrophobicContact CB-CG2 3.9Å
219	Y	95.8	Very high	92.4	Very high	24 Å²	24	33.7 Å²	33.7	9%	0.094	18%	0.182	C	C	.	.	H	α-helix	trans	-66	-47.6	178.9	-173.2	-104.8	0	0	0	112.1	L47 Y189 T193 M196 F215 F216 Y217 W304	L47-Y219 HydrophobicContact CD2-CD1 4.04Å; L47-Y219 HydrophobicContact CD2-CE1 4.22Å; Y189-Y219 WeakPolarHBondContact CD1-OH 3.39Å; Y189-Y219 PolarHBondContact O-OH 3.05Å; T193-Y219 WeakPolarHBondContact OG1-CE2 3.48Å; T193-Y219 PolarHBondContact OG1-OH 3.03Å; M196-Y219 HydrophobicContact CB-CD2 4.42Å; M196-Y219 HydrophobicContact CE-CD2 4.22Å; M196-Y219 HydrophobicContact SD-CD2 3.72Å; M196-Y219 HydrophobicContact SD-CG 4.37Å; F215-Y219 WeakPolarHBondContact O-CB 3.5Å; F215-Y219 PolarHBondContact O-N 2.79Å; F216-Y219 PolarHBondContact O-N 3.5Å; Y217-Y219 PolarHBondContact O-N 3.39Å; Y219-W304 HydrophobicContact CD1-CB 3.93Å; Y219-W304 HydrophobicContact CD1-CG 4.38Å; Y219-W304 HydrophobicContact CE1-CB 3.72Å; Y219-W304 AromaticContact CE1-CD1 3.58Å; Y219-W304 AromaticContact CE1-CG 3.82Å; Y219-W304 HydrophobicContact CE1-CG 3.82Å; Y219-W304 PolarHBondContact O-N 3.38Å
220	M	94.3	Very high	92.4	Very high	9 Å²	9	35.8 Å²	35.8	4%	0.044	21%	0.206	C	C	.	.	H	α-helix	trans	-62.9	-53.8	179.9	-179.4	71.1	177.3	0	0	112.1	I43 L46 L47 F216 G303 W304 Y305	I43-M220 HydrophobicContact CD1-CB 4.13Å; I43-M220 HydrophobicContact CD1-CG 4.12Å; I43-M220 HydrophobicContact CG1-CB 4.4Å; I43-M220 HydrophobicContact CG1-CG 4.03Å; I43-M220 HydrophobicContact CG2-CB 3.57Å; I43-M220 HydrophobicContact CG2-CG 3.87Å; L46-M220 HydrophobicContact CB-CE 4.08Å; L46-M220 HydrophobicContact CD1-CE 3.86Å; L47-M220 HydrophobicContact CD2-SD 3.96Å; L47-M220 HydrophobicContact CG-SD 4.21Å; F216-M220 VanDerWaalsContact O-CB 3.32Å; F216-M220 WeakPolarHBondContact O-CB 3.49Å; F216-M220 PolarHBondContact O-N 2.82Å; M220-G303 CarbonylContact O-C 3.59Å; M220-W304 HydrophobicContact CE-CE3 4.09Å; M220-W304 HydrophobicContact CE-CZ3 4.01Å; M220-W304 PolarHBondContact O-N 2.76Å; M220-W304 VanDerWaalsContact O-N 3.14Å; M220-W304 HydrophobicContact SD-CD2 4.4Å; M220-W304 HydrophobicContact SD-CE3 3.36Å; M220-W304 HydrophobicContact SD-CZ3 3.74Å; M220-Y305 HydrophobicContact CE-CD2 4.13Å; M220-Y305 WeakPolarHBondContact O-CB 3.34Å; M220-Y305 PolarHBondContact O-N 3.4Å
221	M	92.6	Very high	92.4	Very high	37 Å²	37	43.2 Å²	43.2	18%	0.182	24%	0.239	C	C	.	.	H	α-helix	trans	-90.4	-16.2	-170.3	-63.4	-56.1	-60.9	0	0	113.6	Y217 H301	Y217-M221 HydrophobicContact CE1-CB 4.36Å; Y217-M221 HydrophobicContact CE1-CG 4.13Å; Y217-M221 HydrophobicContact CE2-CG 4.08Å; Y217-M221 WeakPolarHBondContact O-CB 3.03Å; Y217-M221 PolarHBondContact O-N 3.07Å; M221-H301 CarbonylContact O-C 3.59Å; M221-H301 VanDerWaalsContact O-CB 3.25Å; M221-H301 WeakPolarHBondContact O-CB 3.4Å
222	G	94.2	Very high	92.5	Very high	2 Å²	2	44 Å²	44	2%	0.021	24%	0.239	C	C	.	.			trans	85.8	134.3	178.4	0	0	0	0	0	114.2	R31 N218 H301 F302 G303	R31-G222 PolarHBondContact NH1-O 2.9Å; N218-G222 CarbonylContact O-C 3.58Å; N218-G222 VanDerWaalsContact O-CA 3.25Å; N218-G222 WeakPolarHBondContact O-CA 3.32Å; N218-G222 PolarHBondContact O-N 3.27Å; G222-H301 WeakPolarHBondContact O-CB 3.25Å; G222-F302 VanDerWaalsContact CA-O 3.27Å; G222-F302 WeakPolarHBondContact CA-O 3.43Å; G222-G303 VanDerWaalsContact CA-CA 3.44Å
223	V	93.6	Very high	93	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	24%	0.237	C	C	.	.	S	Bend	trans	-81.6	-45.3	-179.8	167.6	0	0	0	0	111.8	Y200 C209 K210 F211 N218 H301	Y200-V223 HydrophobicContact CD2-CG2 4.39Å; Y200-V223 HydrophobicContact CE2-CG2 3.79Å; C209-V223 CarbonylContact C-O 3.57Å; C209-V223 WeakPolarHBondContact CA-O 3.31Å; C209-V223 HydrophobicContact CB-CG1 4.17Å; K210-V223 PolarHBondContact N-O 2.68Å; F211-V223 HydrophobicContact CD1-CG1 3.79Å; F211-V223 HydrophobicContact CD1-CG2 4.18Å; F211-V223 HydrophobicContact CE1-CB 4.36Å; F211-V223 HydrophobicContact CE1-CG1 3.25Å; F211-V223 HydrophobicContact CE1-CG2 4.18Å; F211-V223 HydrophobicContact CE2-CG1 4.11Å; F211-V223 HydrophobicContact CG-CG1 4.44Å; F211-V223 HydrophobicContact CZ-CG1 3.43Å; F211-V223 VanDerWaalsContact CZ-CG1 3.43Å; N218-V223 HydrophobicContact CB-CG2 3.9Å; V223-H301 PolarHBondContact O-CD2 3.31Å; V223-H301 VanDerWaalsContact O-CD2 3.32Å
224	E	93.7	Very high	93.6	Very high	3 Å²	3	40 Å²	40	1%	0.014	20%	0.195	C	C	.	.	B	Isolated β-bridge	trans	-89	133.8	-177.9	-174.9	170.6	-169.7	0	0	110.2	K198 T204 P227 F302	K198-E224 WeakPolarHBondContact CD-OE2 3.49Å; K198-E224 WeakPolarHBondContact CG-OE2 3.33Å; K198-E224 VanDerWaalsContact NZ-CD 3.25Å; K198-E224 IonicContact NZ-OE1 2.92Å; K198-E224 PolarHBondContact NZ-OE1 3.48Å; K198-E224 IonicContact NZ-OE2 2.75Å; K198-E224 PolarHBondContact NZ-OE2 3.24Å; T204-E224 WeakPolarHBondContact CA-OE1 3.44Å; T204-E224 WeakPolarHBondContact CB-OE1 3.47Å; T204-E224 PolarHBondContact N-OE1 3.27Å; T204-E224 PolarHBondContact OG1-OE1 2.83Å; T204-E224 VanDerWaalsContact OG1-OE1 3.1Å; E224-P227 HydrophobicContact CB-CB 4.43Å; E224-P227 VanDerWaalsContact CD-CA 3.44Å; E224-P227 HydrophobicContact CG-CB 4.21Å; E224-P227 WeakPolarHBondContact OE2-CB 3.34Å; E224-F302 PolarHBondContact O-N 2.87Å
225	F	92.8	Very high	93.9	Very high	3 Å²	3	39 Å²	39	1%	0.013	19%	0.189	C	C	.	.	S	Bend	trans	-65.5	-53.7	-176.2	-176.9	-129.4	0	0	0	112.3	W29 T135 D208 K236 I297 C298 D300 H301	W29-F225 HydrophobicContact CZ3-CD2 4.36Å; W29-F225 HydrophobicContact CZ3-CG 4.32Å; T135-F225 HydrophobicContact CG2-CD1 3.95Å; T135-F225 HydrophobicContact CG2-CE1 3.85Å; D208-F225 HydrophobicContact CB-CB 3.92Å; D208-F225 WeakPolarHBondContact O-CB 3.25Å; D208-F225 PolarHBondContact O-N 3.31Å; F225-K236 WeakPolarHBondContact O-CE 3.43Å; F225-K236 PolarHBondContact O-NZ 3.21Å; F225-I297 WeakPolarHBondContact CZ-O 3.42Å; F225-C298 WeakPolarHBondContact CZ-O 3.3Å; F225-D300 WeakPolarHBondContact CD2-O 3.41Å; F225-D300 VanDerWaalsContact CE2-O 3.25Å; F225-D300 WeakPolarHBondContact CE2-O 3.49Å; F225-H301 AromaticContact CD2-CE1 3.74Å; F225-H301 AromaticContact CD2-ND1 3.71Å
226	N	93.9	Very high	94	Very high	12 Å²	12	33.6 Å²	33.6	6%	0.064	17%	0.165	C	C	.	.	S	Bend	trans	-132.9	85.3	175.1	-68.7	-54.5	0	0	0	109.8	R228 K236 I297	N226-R228 PolarHBondContact O-N 3.31Å; N226-K236 VanDerWaalsContact OD1-CD 3.26Å; N226-K236 WeakPolarHBondContact OD1-CD 3.38Å; N226-K236 WeakPolarHBondContact OD1-CE 3.18Å; N226-K236 PolarHBondContact OD1-NZ 2.87Å; N226-I297 PolarHBondContact OD1-O 2.96Å
227	P	95.4	Very high	94	Very high	1 Å²	1	28.9 Å²	28.9	1%	0.006	15%	0.145	C	C	.	.			trans	-63.4	134	-179.6	17.3	-22.1	0	0	0	111.4	A195 K198 E224 F235 F302	A195-P227 HydrophobicContact CB-CG 4.44Å; K198-P227 HydrophobicContact CD-CB 4.05Å; E224-P227 HydrophobicContact CB-CB 4.43Å; E224-P227 VanDerWaalsContact CD-CA 3.44Å; E224-P227 HydrophobicContact CG-CB 4.21Å; E224-P227 WeakPolarHBondContact OE2-CB 3.34Å; P227-F235 HydrophobicContact CB-CD2 4.29Å; P227-F235 HydrophobicContact CB-CG 4.44Å; P227-F235 HydrophobicContact CG-CB 4.04Å; P227-F235 HydrophobicContact CG-CG 4.35Å; P227-F235 WeakPolarHBondContact O-CD2 3.31Å; P227-F235 PolarHBondContact O-N 3.18Å; P227-F302 HydrophobicContact CG-CB 3.58Å; P227-F302 HydrophobicContact CG-CD1 3.67Å; P227-F302 HydrophobicContact CG-CG 3.92Å
228	R	95.4	Very high	94.2	Very high	12 Å²	12	28.1 Å²	28.1	5%	0.045	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	146.2	179	-64.6	-174.5	164.8	-135.6	-8.6	114.3	K142 Y143 K198 T204 N226 K231 F233 D234	K142-R228 PolarHBondContact O-NH1 2.87Å; K142-R228 PolarHBondContact O-NH2 2.97Å; Y143-R228 PolarHBondContact OH-NH2 3.05Å; K198-R228 WeakPolarHBondContact CE-O 3.39Å; T204-R228 HydrophobicContact CG2-CB 4.13Å; T204-R228 PolarHBondContact OG1-N 3.16Å; T204-R228 PolarHBondContact OG1-O 2.87Å; N226-R228 PolarHBondContact O-N 3.31Å; R228-K231 PolarHBondContact NH1-O 2.99Å; R228-F233 CarbonylContact C-O 3.53Å; R228-F233 WeakPolarHBondContact CA-O 3.47Å; R228-F233 WeakPolarHBondContact CB-O 3.31Å; R228-D234 HydrophobicContact CG-CB 4.37Å; R228-D234 IonicContact CZ-OD2 3.33Å; R228-D234 IonicContact NE-OD2 2.96Å; R228-D234 PolarHBondContact NE-OD2 3.42Å; R228-D234 IonicContact NH2-OD2 2.87Å; R228-D234 PolarHBondContact NH2-OD2 2.93Å
229	I	94.6	Very high	94.3	Very high	94 Å²	94	28.6 Å²	28.6	48%	0.482	14%	0.144	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	118.5	161.3	-69.6	159.9	0	0	0	108.1	F194 F233 F235	F194-I229 HydrophobicContact CE1-CD1 4.4Å; F194-I229 HydrophobicContact CZ-CD1 4.3Å; F194-I229 HydrophobicContact CZ-CG1 4.48Å; I229-F233 HydrophobicContact CB-CB 4.13Å; I229-F233 HydrophobicContact CB-CD1 4.45Å; I229-F233 HydrophobicContact CD1-CD1 4.48Å; I229-F233 PolarHBondContact N-O 3.03Å; I229-F233 WeakPolarHBondContact O-CB 3.36Å; I229-F233 PolarHBondContact O-N 3.38Å; I229-F235 HydrophobicContact CD1-CE2 3.72Å; I229-F235 HydrophobicContact CD1-CZ 3.61Å; I229-F235 HydrophobicContact CG1-CE2 3.82Å; I229-F235 HydrophobicContact CG1-CZ 4.16Å
230	G	91.4	Very high	94.2	Very high	61 Å²	61	28 Å²	28	63%	0.629	14%	0.142	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.1	-152.7	-171.9	0	0	0	0	0	112.3
231	K	88.9	Confident	94.1	Very high	172 Å²	172	27.6 Å²	27.6	75%	0.748	14%	0.14	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-26.9	-177.4	-66.1	-177.5	-179.4	178	0	113.5	R228	R228-K231 PolarHBondContact NH1-O 2.99Å
232	W	91.9	Very high	94.1	Very high	121 Å²	121	25.9 Å²	25.9	46%	0.458	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	-113.1	-29.2	-161.8	-61.8	113.9	0	0	0	114.8	I129 K142 D234	I129-W232 HydrophobicContact CD1-CH2 4.02Å; I129-W232 HydrophobicContact CG1-CH2 4.4Å; I129-W232 HydrophobicContact CG1-CZ3 4.46Å; I129-W232 HydrophobicContact CG2-CH2 4.36Å; I129-W232 HydrophobicContact CG2-CZ3 4.32Å; K142-W232 HydrophobicContact CB-CH2 4.37Å; K142-W232 HydrophobicContact CB-CZ3 3.93Å; W232-D234 PolarHBondContact O-N 3.44Å
233	F	95.8	Very high	93.9	Very high	25 Å²	25	25.9 Å²	25.9	11%	0.11	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	101.3	-175.9	-167.8	-81.5	0	0	0	110.6	V108 Y111 T112 R228 I229 F235 F238	V108-F233 HydrophobicContact CG1-CE2 4.19Å; V108-F233 HydrophobicContact CG2-CE2 4.2Å; V108-F233 HydrophobicContact CG2-CZ 4.46Å; Y111-F233 AromaticContact CD1-CD2 3.7Å; Y111-F233 HydrophobicContact CD1-CD2 3.7Å; Y111-F233 AromaticContact CD1-CE2 3.83Å; Y111-F233 HydrophobicContact CD1-CE2 3.83Å; Y111-F233 HydrophobicContact CD1-CG 4.49Å; Y111-F233 AromaticContact CE1-CD2 3.9Å; Y111-F233 HydrophobicContact CE1-CD2 3.9Å; Y111-F233 HydrophobicContact CE1-CE2 4.25Å; Y111-F233 HydrophobicContact CE1-CG 4.24Å; T112-F233 HydrophobicContact CG2-CD2 3.69Å; T112-F233 HydrophobicContact CG2-CE2 4.33Å; R228-F233 CarbonylContact C-O 3.53Å; R228-F233 WeakPolarHBondContact CA-O 3.47Å; R228-F233 WeakPolarHBondContact CB-O 3.31Å; I229-F233 HydrophobicContact CB-CB 4.13Å; I229-F233 HydrophobicContact CB-CD1 4.45Å; I229-F233 HydrophobicContact CD1-CD1 4.48Å; I229-F233 PolarHBondContact N-O 3.03Å; I229-F233 WeakPolarHBondContact O-CB 3.36Å; I229-F233 PolarHBondContact O-N 3.38Å; F233-F235 AromaticContact CD1-CD2 3.9Å; F233-F235 HydrophobicContact CD1-CD2 3.9Å; F233-F235 AromaticContact CD1-CE2 3.75Å; F233-F235 HydrophobicContact CD1-CE2 3.75Å; F233-F235 HydrophobicContact CD1-CZ 4.43Å; F233-F235 AromaticContact CE1-CD2 3.98Å; F233-F235 HydrophobicContact CE1-CD2 3.98Å; F233-F235 AromaticContact CE1-CE2 3.86Å; F233-F235 HydrophobicContact CE1-CE2 3.86Å; F233-F235 HydrophobicContact CE1-CG 4.38Å; F233-F235 HydrophobicContact CE1-CZ 4.15Å; F233-F238 HydrophobicContact CE1-CB 4.31Å; F233-F238 HydrophobicContact CE1-CD1 4.18Å; F233-F238 HydrophobicContact CE1-CG 4.26Å; F233-F238 HydrophobicContact CE2-CD1 4.28Å; F233-F238 HydrophobicContact CE2-CD2 4Å; F233-F238 HydrophobicContact CE2-CE2 4.33Å; F233-F238 AromaticContact CE2-CG 3.98Å; F233-F238 HydrophobicContact CE2-CG 3.98Å; F233-F238 HydrophobicContact CZ-CB 4.04Å; F233-F238 AromaticContact CZ-CD1 3.48Å; F233-F238 HydrophobicContact CZ-CD1 3.48Å; F233-F238 VanDerWaalsContact CZ-CD1 3.48Å; F233-F238 HydrophobicContact CZ-CD2 4.02Å; F233-F238 AromaticContact CZ-CE1 3.92Å; F233-F238 HydrophobicContact CZ-CE1 3.92Å; F233-F238 HydrophobicContact CZ-CE2 4.41Å; F233-F238 AromaticContact CZ-CG 3.54Å; F233-F238 HydrophobicContact CZ-CG 3.54Å; F233-F238 HydrophobicContact CZ-CZ 4.38Å
234	D	96.4	Very high	93.7	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	122	177.8	-171.2	-80.1	0	0	0	111	Y111 Y143 R228 W232 K236 L237 F238	Y111-D234 PolarHBondContact OH-N 3.45Å; Y143-D234 HydrophobicContact CD1-CB 4.22Å; Y143-D234 HydrophobicContact CE1-CB 3.8Å; Y143-D234 VanDerWaalsContact CE1-CG 3.43Å; Y143-D234 WeakPolarHBondContact CE1-OD2 3.2Å; Y143-D234 PolarHBondContact OH-OD2 3.42Å; R228-D234 HydrophobicContact CG-CB 4.37Å; R228-D234 IonicContact CZ-OD2 3.33Å; R228-D234 IonicContact NE-OD2 2.96Å; R228-D234 PolarHBondContact NE-OD2 3.42Å; R228-D234 IonicContact NH2-OD2 2.87Å; R228-D234 PolarHBondContact NH2-OD2 2.93Å; W232-D234 PolarHBondContact O-N 3.44Å; D234-K236 PolarHBondContact O-N 2.83Å; D234-K236 PolarHBondContact OD1-N 3.41Å; D234-L237 HydrophobicContact CB-CB 4.48Å; D234-L237 PolarHBondContact OD1-N 3.32Å; D234-F238 WeakPolarHBondContact O-CB 3.18Å; D234-F238 PolarHBondContact O-N 3.41Å
235	F	96.6	Very high	93.7	Very high	10 Å²	10	26.4 Å²	26.4	4%	0.044	13%	0.134	C	C	.	.	H	α-helix	trans	-65.7	-38.8	-172.5	-82.8	-112.5	0	0	0	112.4	V191 F194 P227 I229 F233 F239 F302	V191-F235 HydrophobicContact CG2-CD1 3.5Å; V191-F235 HydrophobicContact CG2-CE1 3.59Å; F194-F235 AromaticContact CD1-CE1 3.71Å; F194-F235 HydrophobicContact CD1-CE1 3.71Å; F194-F235 AromaticContact CD1-CZ 3.69Å; F194-F235 HydrophobicContact CD1-CZ 3.69Å; F194-F235 AromaticContact CE1-CE1 3.86Å; F194-F235 HydrophobicContact CE1-CE1 3.86Å; F194-F235 HydrophobicContact CE1-CE2 4.08Å; F194-F235 AromaticContact CE1-CZ 3.31Å; F194-F235 HydrophobicContact CE1-CZ 3.31Å; F194-F235 HydrophobicContact CZ-CZ 4.35Å; P227-F235 HydrophobicContact CB-CD2 4.29Å; P227-F235 HydrophobicContact CB-CG 4.44Å; P227-F235 HydrophobicContact CG-CB 4.04Å; P227-F235 HydrophobicContact CG-CG 4.35Å; P227-F235 WeakPolarHBondContact O-CD2 3.31Å; P227-F235 PolarHBondContact O-N 3.18Å; I229-F235 HydrophobicContact CD1-CE2 3.72Å; I229-F235 HydrophobicContact CD1-CZ 3.61Å; I229-F235 HydrophobicContact CG1-CE2 3.82Å; I229-F235 HydrophobicContact CG1-CZ 4.16Å; F233-F235 AromaticContact CD1-CD2 3.9Å; F233-F235 HydrophobicContact CD1-CD2 3.9Å; F233-F235 AromaticContact CD1-CE2 3.75Å; F233-F235 HydrophobicContact CD1-CE2 3.75Å; F233-F235 HydrophobicContact CD1-CZ 4.43Å; F233-F235 AromaticContact CE1-CD2 3.98Å; F233-F235 HydrophobicContact CE1-CD2 3.98Å; F233-F235 AromaticContact CE1-CE2 3.86Å; F233-F235 HydrophobicContact CE1-CE2 3.86Å; F233-F235 HydrophobicContact CE1-CG 4.38Å; F233-F235 HydrophobicContact CE1-CZ 4.15Å; F235-F239 HydrophobicContact CB-CD2 4.4Å; F235-F239 HydrophobicContact CD1-CD2 4.09Å; F235-F239 AromaticContact CD1-CE2 3.69Å; F235-F239 HydrophobicContact CD1-CE2 3.69Å; F235-F239 HydrophobicContact CE1-CE2 4.12Å; F235-F239 WeakPolarHBondContact O-CB 3.17Å; F235-F239 WeakPolarHBondContact O-CD2 3.42Å; F235-F239 PolarHBondContact O-N 3.45Å; F235-F302 HydrophobicContact CB-CD1 4.02Å; F235-F302 HydrophobicContact CB-CE1 3.86Å; F235-F302 HydrophobicContact CB-CE2 4.43Å; F235-F302 HydrophobicContact CB-CG 4.38Å; F235-F302 HydrophobicContact CB-CZ 4.05Å; F235-F302 AromaticContact CD1-CE1 3.9Å; F235-F302 HydrophobicContact CD1-CE1 3.9Å; F235-F302 HydrophobicContact CD1-CZ 4.42Å; F235-F302 HydrophobicContact CG-CE1 4.31Å
236	K	95.4	Very high	93.9	Very high	3 Å²	3	26.2 Å²	26.2	1%	0.013	13%	0.133	C	C	.	.	H	α-helix	trans	-66.9	-49	-177.8	-63.8	-172	179.3	166.8	0	111.6	F225 N226 D234 F238 N240 D296 I297 D300 F302 L306	F225-K236 WeakPolarHBondContact O-CE 3.43Å; F225-K236 PolarHBondContact O-NZ 3.21Å; N226-K236 VanDerWaalsContact OD1-CD 3.26Å; N226-K236 WeakPolarHBondContact OD1-CD 3.38Å; N226-K236 WeakPolarHBondContact OD1-CE 3.18Å; N226-K236 PolarHBondContact OD1-NZ 2.87Å; D234-K236 PolarHBondContact O-N 2.83Å; D234-K236 PolarHBondContact OD1-N 3.41Å; K236-F238 VanDerWaalsContact C-N 3.34Å; K236-N240 WeakPolarHBondContact O-CB 3.42Å; K236-N240 PolarHBondContact O-N 2.9Å; K236-D296 WeakPolarHBondContact CD-O 3.41Å; K236-D296 WeakPolarHBondContact CE-O 3.49Å; K236-D296 PolarHBondContact NZ-O 3.47Å; K236-I297 HydrophobicContact CB-CD1 3.49Å; K236-I297 VanDerWaalsContact CB-CD1 3.49Å; K236-I297 HydrophobicContact CD-CD1 3.97Å; K236-I297 HydrophobicContact CG-CD1 4.45Å; K236-I297 PolarHBondContact NZ-O 3.46Å; K236-D300 WeakPolarHBondContact CE-O 3.29Å; K236-D300 PolarHBondContact NZ-O 2.88Å; K236-F302 HydrophobicContact CB-CD2 4.45Å; K236-F302 HydrophobicContact CG-CB 3.94Å; K236-F302 HydrophobicContact CG-CD2 3.68Å; K236-F302 HydrophobicContact CG-CG 4.12Å; K236-L306 HydrophobicContact CD-CD1 4.36Å; K236-L306 HydrophobicContact CG-CD1 4.43Å
237	L	95.6	Very high	94.1	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-66.9	-40.3	179.8	-175.2	65.2	0	0	0	110.9	Y111 Y143 I145 D234 G241 E288 Y291 L292	Y111-L237 HydrophobicContact CE2-CD2 4.17Å; Y111-L237 HydrophobicContact CE2-CG 4.3Å; Y143-L237 HydrophobicContact CD1-CB 4.3Å; Y143-L237 HydrophobicContact CD1-CD2 3.63Å; Y143-L237 HydrophobicContact CE1-CB 4.36Å; Y143-L237 HydrophobicContact CE1-CD2 4.45Å; Y143-L237 HydrophobicContact CG-CD2 4.35Å; I145-L237 HydrophobicContact CD1-CD2 3.87Å; D234-L237 HydrophobicContact CB-CB 4.48Å; D234-L237 PolarHBondContact OD1-N 3.32Å; L237-G241 PolarHBondContact O-N 3.02Å; L237-G241 VanDerWaalsContact O-N 3.12Å; L237-E288 HydrophobicContact CD1-CG 4.29Å; L237-Y291 HydrophobicContact CD1-CD1 4.02Å; L237-L292 HydrophobicContact CD1-CD2 4.42Å; L237-L292 HydrophobicContact CD2-CD2 4.28Å
238	F	96.8	Very high	94.2	Very high	2 Å²	2	26.2 Å²	26.2	1%	0.009	14%	0.135	C	C	.	.	H	α-helix	trans	-61.6	-59.8	178.8	176.8	-105	0	0	0	111.6	Q107 V108 Y111 F233 D234 K236 N240 G241 R242 P243	Q107-F238 HydrophobicContact CB-CE2 4.22Å; Q107-F238 HydrophobicContact CB-CZ 4.3Å; V108-F238 HydrophobicContact CB-CE2 4.48Å; V108-F238 HydrophobicContact CB-CZ 4.39Å; V108-F238 HydrophobicContact CG2-CE1 4.1Å; V108-F238 HydrophobicContact CG2-CE2 3.92Å; V108-F238 HydrophobicContact CG2-CZ 3.42Å; V108-F238 VanDerWaalsContact CG2-CZ 3.42Å; Y111-F238 HydrophobicContact CD1-CB 4.15Å; Y111-F238 AromaticContact CD1-CD2 3.62Å; Y111-F238 HydrophobicContact CD1-CD2 3.62Å; Y111-F238 HydrophobicContact CD1-CE2 4.5Å; Y111-F238 HydrophobicContact CD1-CG 4.24Å; Y111-F238 HydrophobicContact CD2-CD2 4.24Å; Y111-F238 HydrophobicContact CE1-CB 3.89Å; Y111-F238 HydrophobicContact CE1-CD2 4.25Å; Y111-F238 HydrophobicContact CE1-CG 4.47Å; Y111-F238 AromaticContact CG-CD2 3.61Å; Y111-F238 HydrophobicContact CG-CD2 3.61Å; Y111-F238 HydrophobicContact CG-CE2 4.35Å; F233-F238 HydrophobicContact CE1-CB 4.31Å; F233-F238 HydrophobicContact CE1-CD1 4.18Å; F233-F238 HydrophobicContact CE1-CG 4.26Å; F233-F238 HydrophobicContact CE2-CD1 4.28Å; F233-F238 HydrophobicContact CE2-CD2 4Å; F233-F238 HydrophobicContact CE2-CE2 4.33Å; F233-F238 AromaticContact CE2-CG 3.98Å; F233-F238 HydrophobicContact CE2-CG 3.98Å; F233-F238 HydrophobicContact CZ-CB 4.04Å; F233-F238 AromaticContact CZ-CD1 3.48Å; F233-F238 HydrophobicContact CZ-CD1 3.48Å; F233-F238 VanDerWaalsContact CZ-CD1 3.48Å; F233-F238 HydrophobicContact CZ-CD2 4.02Å; F233-F238 AromaticContact CZ-CE1 3.92Å; F233-F238 HydrophobicContact CZ-CE1 3.92Å; F233-F238 HydrophobicContact CZ-CE2 4.41Å; F233-F238 AromaticContact CZ-CG 3.54Å; F233-F238 HydrophobicContact CZ-CG 3.54Å; F233-F238 HydrophobicContact CZ-CZ 4.38Å; D234-F238 WeakPolarHBondContact O-CB 3.18Å; D234-F238 PolarHBondContact O-N 3.41Å; K236-F238 VanDerWaalsContact C-N 3.34Å; F238-N240 PolarHBondContact O-N 3.39Å; F238-G241 PolarHBondContact O-N 3.1Å; F238-R242 HydrophobicContact CD2-CB 3.89Å; F238-R242 HydrophobicContact CD2-CG 3.76Å; F238-R242 HydrophobicContact CE2-CB 3.75Å; F238-R242 HydrophobicContact CE2-CG 4Å; F238-R242 HydrophobicContact CZ-CB 4.44Å; F238-R242 WeakPolarHBondContact O-CB 3.49Å; F238-R242 PolarHBondContact O-N 3.21Å; F238-P243 HydrophobicContact CE1-CG 4.14Å; F238-P243 HydrophobicContact CZ-CG 4.43Å; F238-P243 WeakPolarHBondContact O-CD 3.36Å
239	F	95.9	Very high	94.3	Very high	9 Å²	9	26 Å²	26	4%	0.039	14%	0.135	C	C	.	.	H	α-helix	trans	-65.5	-42.4	-171.7	-83.9	-80.8	0	0	0	112.6	L187 V191 F235 P243 G244 F302 D310 C311	L187-F239 HydrophobicContact CD1-CE1 4.39Å; L187-F239 HydrophobicContact CD2-CE1 4Å; L187-F239 HydrophobicContact CG-CE1 4.11Å; V191-F239 HydrophobicContact CB-CE1 4.28Å; V191-F239 HydrophobicContact CB-CE2 4.2Å; V191-F239 HydrophobicContact CB-CZ 3.82Å; V191-F239 HydrophobicContact CG1-CE1 4.25Å; V191-F239 HydrophobicContact CG1-CZ 4.24Å; V191-F239 HydrophobicContact CG2-CD2 3.94Å; V191-F239 HydrophobicContact CG2-CE1 4.15Å; V191-F239 HydrophobicContact CG2-CE2 3.22Å; V191-F239 HydrophobicContact CG2-CZ 3.33Å; F235-F239 HydrophobicContact CB-CD2 4.4Å; F235-F239 HydrophobicContact CD1-CD2 4.09Å; F235-F239 AromaticContact CD1-CE2 3.69Å; F235-F239 HydrophobicContact CD1-CE2 3.69Å; F235-F239 HydrophobicContact CE1-CE2 4.12Å; F235-F239 WeakPolarHBondContact O-CB 3.17Å; F235-F239 WeakPolarHBondContact O-CD2 3.42Å; F235-F239 PolarHBondContact O-N 3.45Å; F239-P243 HydrophobicContact CD1-CG 3.88Å; F239-P243 HydrophobicContact CE1-CG 4.41Å; F239-G244 PolarHBondContact O-N 3.45Å; F239-F302 HydrophobicContact CB-CZ 4.46Å; F239-F302 AromaticContact CD2-CZ 4Å; F239-F302 HydrophobicContact CD2-CZ 4Å; F239-F302 HydrophobicContact CG-CZ 4.35Å; F239-D310 HydrophobicContact CB-CB 4.09Å; F239-C311 WeakPolarHBondContact CD1-SG 3.45Å
240	N	93.3	Very high	94.4	Very high	13 Å²	13	22.1 Å²	22.1	7%	0.07	12%	0.115	C	C	.	.	I	π-helix	trans	-61.9	-53.4	176.6	-177.7	-102.7	0	0	0	111.9	K236 F238 I245 Y291 D310	K236-N240 WeakPolarHBondContact O-CB 3.42Å; K236-N240 PolarHBondContact O-N 2.9Å; F238-N240 PolarHBondContact O-N 3.39Å; N240-I245 VanDerWaalsContact O-CG1 3.25Å; N240-I245 WeakPolarHBondContact O-CG1 3.22Å; N240-I245 PolarHBondContact O-N 3.38Å; N240-I245 VanDerWaalsContact O-N 3.1Å; N240-I245 WeakPolarHBondContact OD1-CD1 3.45Å; N240-Y291 HydrophobicContact CB-CE1 4.16Å; N240-Y291 PolarHBondContact ND2-OH 2.95Å; N240-Y291 WeakPolarHBondContact OD1-CE1 3.49Å; N240-Y291 PolarHBondContact OD1-OH 3.3Å; N240-D310 VanDerWaalsContact CA-CG 3.43Å; N240-D310 WeakPolarHBondContact CA-OD2 3.45Å; N240-D310 PolarHBondContact N-OD2 3.42Å; N240-D310 PolarHBondContact ND2-OD1 2.88Å
241	G	91.2	Very high	94.8	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	9%	0.087	C	C	.	.	I	π-helix	trans	-75.8	-49.5	-173	0	0	0	0	0	113.2	L237 F238 I245 V246 F285	L237-G241 PolarHBondContact O-N 3.02Å; L237-G241 VanDerWaalsContact O-N 3.12Å; F238-G241 PolarHBondContact O-N 3.1Å; G241-I245 PolarHBondContact O-N 2.86Å; G241-V246 WeakPolarHBondContact O-CG2 3.5Å; G241-V246 PolarHBondContact O-N 2.87Å; G241-V246 VanDerWaalsContact O-N 3.1Å; G241-F285 WeakPolarHBondContact O-CZ 3.4Å
242	R	93.2	Very high	95.2	Very high	0 Å²	0	11.4 Å²	11.4	0%	0	5%	0.051	C	C	.	.	I	π-helix	trans	-86	-79.5	-162.4	-54.2	-69.8	176.1	-78	-3.7	112.5	Q107 Y111 N146 G147 F238 G244 V246 E288	Q107-R242 HydrophobicContact CB-CB 4.08Å; Q107-R242 HydrophobicContact CG-CB 4.41Å; Y111-R242 HydrophobicContact CD2-CG 4.1Å; Y111-R242 HydrophobicContact CG-CG 4.43Å; N146-R242 PolarHBondContact OD1-NH2 3.28Å; G147-R242 VanDerWaalsContact CA-CZ 3.48Å; G147-R242 VanDerWaalsContact CA-NH2 3.3Å; F238-R242 HydrophobicContact CD2-CB 3.89Å; F238-R242 HydrophobicContact CD2-CG 3.76Å; F238-R242 HydrophobicContact CE2-CB 3.75Å; F238-R242 HydrophobicContact CE2-CG 4Å; F238-R242 HydrophobicContact CZ-CB 4.44Å; F238-R242 WeakPolarHBondContact O-CB 3.49Å; F238-R242 PolarHBondContact O-N 3.21Å; R242-G244 PolarHBondContact O-N 3.49Å; R242-V246 VanDerWaalsContact O-CB 3.29Å; R242-V246 WeakPolarHBondContact O-CB 3.17Å; R242-V246 PolarHBondContact O-N 3.33Å; R242-E288 IonicContact CZ-OE1 3.93Å; R242-E288 VanDerWaalsContact CZ-OE1 3.24Å; R242-E288 IonicContact NH1-OE1 3.3Å; R242-E288 PolarHBondContact NH1-OE1 3.21Å; R242-E288 IonicContact NH2-OE1 2.72Å; R242-E288 PolarHBondContact NH2-OE1 2.96Å; R242-E288 IonicContact NH2-OE2 2.7Å; R242-E288 PolarHBondContact NH2-OE2 3.22Å
243	P	89.6	Confident	95.5	Very high	3 Å²	3	7.4 Å²	7.4	2%	0.019	4%	0.038	C	C	.	.	I	π-helix	trans	-66.9	-20.9	-178.3	31.8	-36.3	0	0	0	113.2	F238 F239 A247	F238-P243 HydrophobicContact CE1-CG 4.14Å; F238-P243 HydrophobicContact CZ-CG 4.43Å; F238-P243 WeakPolarHBondContact O-CD 3.36Å; F239-P243 HydrophobicContact CD1-CG 3.88Å; F239-P243 HydrophobicContact CE1-CG 4.41Å; P243-A247 WeakPolarHBondContact O-CB 3.33Å
244	G	89.2	Confident	95.7	Very high	0 Å²	0	6.2 Å²	6.2	0%	0	3%	0.033	C	C	.	.	I	π-helix	trans	-84.3	-81.8	175.6	0	0	0	0	0	113.3	F239 R242 V246 A247 W248 D310	F239-G244 PolarHBondContact O-N 3.45Å; R242-G244 PolarHBondContact O-N 3.49Å; G244-V246 PolarHBondContact O-N 2.85Å; G244-A247 WeakPolarHBondContact O-CB 3.14Å; G244-A247 PolarHBondContact O-N 2.79Å; G244-A247 VanDerWaalsContact O-N 3.15Å; G244-W248 PolarHBondContact O-N 2.88Å; G244-W248 VanDerWaalsContact O-N 3.16Å; G244-D310 WeakPolarHBondContact CA-O 3.44Å
245	I	95.4	Very high	95.8	Very high	13 Å²	13	6.2 Å²	6.2	7%	0.067	3%	0.033	C	C	.	.	I	π-helix	trans	-67	-36.5	-169.8	-67.6	168.5	0	0	0	113.4	N240 G241 A247 W248 V281 F284 F285 L314	N240-I245 VanDerWaalsContact O-CG1 3.25Å; N240-I245 WeakPolarHBondContact O-CG1 3.22Å; N240-I245 PolarHBondContact O-N 3.38Å; N240-I245 VanDerWaalsContact O-N 3.1Å; N240-I245 WeakPolarHBondContact OD1-CD1 3.45Å; G241-I245 PolarHBondContact O-N 2.86Å; I245-A247 VanDerWaalsContact C-N 3.3Å; I245-A247 PolarHBondContact O-N 3.1Å; I245-W248 WeakPolarHBondContact O-CB 3.47Å; I245-W248 PolarHBondContact O-N 3.32Å; I245-V281 HydrophobicContact CG2-CB 4.41Å; I245-V281 HydrophobicContact CG2-CG1 3.74Å; I245-V281 HydrophobicContact CG2-CG2 4.11Å; I245-F284 HydrophobicContact CD1-CD1 3.94Å; I245-F284 HydrophobicContact CD1-CD2 4.16Å; I245-F284 HydrophobicContact CD1-CE1 3.57Å; I245-F284 HydrophobicContact CD1-CE2 3.78Å; I245-F284 HydrophobicContact CD1-CG 4.23Å; I245-F284 HydrophobicContact CD1-CZ 3.48Å; I245-F284 VanDerWaalsContact CD1-CZ 3.48Å; I245-F284 HydrophobicContact CG2-CD1 3.93Å; I245-F284 HydrophobicContact CG2-CE1 4.28Å; I245-F285 HydrophobicContact CB-CZ 4.09Å; I245-F285 HydrophobicContact CG2-CE2 3.67Å; I245-F285 HydrophobicContact CG2-CZ 3.68Å; I245-L314 HydrophobicContact CD1-CD1 4.49Å; I245-L314 HydrophobicContact CG1-CD1 3.77Å; I245-L314 HydrophobicContact CG1-CD2 4.44Å
246	V	96.9	Very high	95.9	Very high	0 Å²	0	6.4 Å²	6.4	0%	0	4%	0.037	C	C	.	.	I	π-helix	trans	-64.5	-38.2	173.7	-175.5	0	0	0	0	110.9	W103 W151 T154 G241 R242 G244 W248 T249 F285	W103-V246 HydrophobicContact CH2-CB 4.06Å; W103-V246 HydrophobicContact CH2-CG1 3.79Å; W103-V246 HydrophobicContact CZ2-CB 4.41Å; W151-V246 HydrophobicContact CB-CG2 4.44Å; T154-V246 HydrophobicContact CG2-CG1 3.82Å; G241-V246 WeakPolarHBondContact O-CG2 3.5Å; G241-V246 PolarHBondContact O-N 2.87Å; G241-V246 VanDerWaalsContact O-N 3.1Å; R242-V246 VanDerWaalsContact O-CB 3.29Å; R242-V246 WeakPolarHBondContact O-CB 3.17Å; R242-V246 PolarHBondContact O-N 3.33Å; G244-V246 PolarHBondContact O-N 2.85Å; V246-W248 VanDerWaalsContact C-N 3.29Å; V246-W248 PolarHBondContact O-N 3.23Å; V246-T249 PolarHBondContact O-OG1 3.4Å; V246-F285 HydrophobicContact CB-CZ 4.42Å; V246-F285 HydrophobicContact CG2-CE1 4.19Å; V246-F285 HydrophobicContact CG2-CE2 3.9Å; V246-F285 HydrophobicContact CG2-CZ 3.39Å
247	A	96.4	Very high	96	Very high	10 Å²	10	7.3 Å²	7.3	8%	0.083	5%	0.045	C	C	.	.	H	α-helix	trans	-65.1	-33.5	179.1	0	0	0	0	0	112	W103 P243 G244 I245 T249 L250 I251	W103-A247 HydrophobicContact CZ2-CB 3.76Å; P243-A247 WeakPolarHBondContact O-CB 3.33Å; G244-A247 WeakPolarHBondContact O-CB 3.14Å; G244-A247 PolarHBondContact O-N 2.79Å; G244-A247 VanDerWaalsContact O-N 3.15Å; I245-A247 VanDerWaalsContact C-N 3.3Å; I245-A247 PolarHBondContact O-N 3.1Å; A247-T249 PolarHBondContact O-N 3.48Å; A247-L250 PolarHBondContact O-N 3.2Å; A247-L250 VanDerWaalsContact O-N 3.12Å; A247-I251 HydrophobicContact CB-CD1 4.04Å; A247-I251 WeakPolarHBondContact O-CB 3.31Å; A247-I251 WeakPolarHBondContact O-CD1 3.28Å; A247-I251 WeakPolarHBondContact O-CG1 3.44Å; A247-I251 PolarHBondContact O-N 2.95Å
248	W	98.1	Very high	96.2	Very high	3 Å²	3	8.4 Å²	8.4	1%	0.011	5%	0.049	C	C	.	.	H	α-helix	trans	-49	-54.3	-179.4	-175.1	0.4	0	0	0	112.3	G244 I245 V246 I251 N252 Q277 Y280 V281 L314 Y318 T319	G244-W248 PolarHBondContact O-N 2.88Å; G244-W248 VanDerWaalsContact O-N 3.16Å; I245-W248 WeakPolarHBondContact O-CB 3.47Å; I245-W248 PolarHBondContact O-N 3.32Å; V246-W248 VanDerWaalsContact C-N 3.29Å; V246-W248 PolarHBondContact O-N 3.23Å; W248-I251 PolarHBondContact O-N 3.41Å; W248-N252 PolarHBondContact NE1-ND2 2.92Å; W248-N252 PolarHBondContact O-N 3.47Å; W248-N252 VanDerWaalsContact O-N 3.16Å; W248-N252 PolarHBondContact O-ND2 3.48Å; W248-Q277 HydrophobicContact CZ2-CB 4.02Å; W248-Q277 HydrophobicContact CZ2-CG 3.79Å; W248-Y280 AromaticContact CH2-CD1 3.97Å; W248-Y280 HydrophobicContact CH2-CD1 3.97Å; W248-Y280 HydrophobicContact CH2-CE1 4.34Å; W248-Y280 AromaticContact CZ3-CD1 3.76Å; W248-Y280 HydrophobicContact CZ3-CD1 3.76Å; W248-Y280 HydrophobicContact CZ3-CE1 4.01Å; W248-V281 HydrophobicContact CD2-CG2 3.85Å; W248-V281 HydrophobicContact CE3-CG2 3.35Å; W248-V281 HydrophobicContact CG-CG2 4.39Å; W248-V281 HydrophobicContact CZ3-CG2 3.76Å; W248-L314 HydrophobicContact CB-CD2 4.41Å; W248-Y318 HydrophobicContact CD2-CD2 4.5Å; W248-Y318 HydrophobicContact CE3-CD2 4.19Å; W248-Y318 AromaticContact CH2-CD2 3.79Å; W248-Y318 HydrophobicContact CH2-CD2 3.79Å; W248-Y318 HydrophobicContact CZ2-CD2 4.09Å; W248-Y318 AromaticContact CZ3-CD2 3.84Å; W248-Y318 HydrophobicContact CZ3-CD2 3.84Å; W248-Y318 HydrophobicContact CZ3-CE2 4.47Å; W248-Y318 PolarHBondContact NE1-O 3.43Å; W248-T319 HydrophobicContact CG-CG2 4.32Å
249	T	97.7	Very high	96.3	Very high	7 Å²	7	8.3 Å²	8.3	4%	0.043	5%	0.049	C	C	.	.	H	α-helix	trans	-71.4	-33.4	-179.1	46.1	0	0	0	0	112.8	W151 H155 V246 A247 N252 L253 A278 V281	W151-T249 PolarHBondContact NE1-OG1 3.24Å; H155-T249 PolarHBondContact CE1-OG1 3.43Å; H155-T249 WeakPolarHBondContact NE2-CB 3.31Å; H155-T249 PolarHBondContact NE2-OG1 2.77Å; V246-T249 PolarHBondContact O-OG1 3.4Å; A247-T249 PolarHBondContact O-N 3.48Å; T249-N252 PolarHBondContact O-N 3.43Å; T249-L253 VanDerWaalsContact O-CG 3.32Å; T249-L253 WeakPolarHBondContact O-CG 3.28Å; T249-L253 PolarHBondContact O-N 3.44Å; T249-A278 HydrophobicContact CG2-CB 4.21Å; T249-V281 HydrophobicContact CG2-CB 3.78Å; T249-V281 HydrophobicContact CG2-CG1 3.85Å; T249-V281 HydrophobicContact CG2-CG2 3.93Å
250	L	97.4	Very high	96.4	Very high	12 Å²	12	15.5 Å²	15.5	6%	0.063	8%	0.076	C	C	.	.	H	α-helix	trans	-64.2	-41.5	173.2	-77.1	-177.8	0	0	0	112.8	W103 T154 W158 I173 A247 N252 L253 S254	W103-L250 HydrophobicContact CE3-CD1 4.46Å; W103-L250 HydrophobicContact CH2-CD1 3.85Å; W103-L250 HydrophobicContact CZ3-CD1 3.65Å; T154-L250 HydrophobicContact CG2-CD1 3.55Å; T154-L250 HydrophobicContact CG2-CD2 4.39Å; T154-L250 HydrophobicContact CG2-CG 4.21Å; W158-L250 HydrophobicContact CB-CD2 3.8Å; W158-L250 HydrophobicContact CG-CD2 3.83Å; I173-L250 HydrophobicContact CD1-CB 4.06Å; A247-L250 PolarHBondContact O-N 3.2Å; A247-L250 VanDerWaalsContact O-N 3.12Å; L250-N252 VanDerWaalsContact C-N 3.33Å; L250-L253 PolarHBondContact O-N 2.98Å; L250-S254 PolarHBondContact O-N 3.47Å
251	I	98.6	Very high	96.6	Very high	8 Å²	8	20 Å²	20	4%	0.041	10%	0.096	C	C	.	.	H	α-helix	trans	-59.7	-48.5	177.1	-69.1	158.4	0	0	0	109.1	I173 W177 A247 W248 L253 S254 F255 P315 T319	I173-I251 HydrophobicContact CG2-CG1 3.95Å; W177-I251 HydrophobicContact CH2-CD1 3.9Å; W177-I251 HydrophobicContact CH2-CG1 4.24Å; W177-I251 HydrophobicContact CH2-CG2 3.69Å; W177-I251 HydrophobicContact CZ2-CG2 4.44Å; W177-I251 HydrophobicContact CZ3-CD1 3.89Å; W177-I251 HydrophobicContact CZ3-CG1 3.88Å; W177-I251 HydrophobicContact CZ3-CG2 3.77Å; A247-I251 HydrophobicContact CB-CD1 4.04Å; A247-I251 WeakPolarHBondContact O-CB 3.31Å; A247-I251 WeakPolarHBondContact O-CD1 3.28Å; A247-I251 WeakPolarHBondContact O-CG1 3.44Å; A247-I251 PolarHBondContact O-N 2.95Å; W248-I251 PolarHBondContact O-N 3.41Å; I251-L253 VanDerWaalsContact C-N 3.34Å; I251-L253 PolarHBondContact O-N 2.9Å; I251-S254 WeakPolarHBondContact O-CB 3.25Å; I251-S254 PolarHBondContact O-N 3.21Å; I251-S254 VanDerWaalsContact O-N 3.13Å; I251-F255 HydrophobicContact CG2-CD1 4.33Å; I251-F255 HydrophobicContact CG2-CD2 3.98Å; I251-F255 HydrophobicContact CG2-CE1 3.82Å; I251-F255 HydrophobicContact CG2-CE2 3.43Å; I251-F255 VanDerWaalsContact CG2-CE2 3.43Å; I251-F255 HydrophobicContact CG2-CG 4.44Å; I251-F255 HydrophobicContact CG2-CZ 3.35Å; I251-F255 WeakPolarHBondContact O-CD1 3.33Å; I251-F255 VanDerWaalsContact O-CG 3.31Å; I251-F255 WeakPolarHBondContact O-CG 3.42Å; I251-F255 PolarHBondContact O-N 2.92Å; I251-P315 HydrophobicContact CD1-CB 3.72Å; I251-T319 HydrophobicContact CB-CG2 4.02Å; I251-T319 HydrophobicContact CD1-CG2 4.39Å; I251-T319 HydrophobicContact CG2-CG2 3.7Å
252	N	98.4	Very high	96.9	Very high	1 Å²	1	24.3 Å²	24.3	1%	0.005	12%	0.119	C	C	.	.	H	α-helix	trans	-61.2	-40.3	177.9	-72.4	-28.4	0	0	0	113.2	W248 T249 L250 S254 F255 A256 N274 Q277	W248-N252 PolarHBondContact NE1-ND2 2.92Å; W248-N252 PolarHBondContact O-N 3.47Å; W248-N252 VanDerWaalsContact O-N 3.16Å; W248-N252 PolarHBondContact O-ND2 3.48Å; T249-N252 PolarHBondContact O-N 3.43Å; L250-N252 VanDerWaalsContact C-N 3.33Å; N252-S254 VanDerWaalsContact C-N 3.32Å; N252-S254 PolarHBondContact O-N 3Å; N252-F255 WeakPolarHBondContact O-CB 3.47Å; N252-F255 PolarHBondContact O-N 2.87Å; N252-A256 PolarHBondContact O-N 3.1Å; N252-N274 WeakPolarHBondContact CB-OD1 3.45Å; N252-N274 PolarHBondContact O-OD1 2.82Å; N252-Q277 PolarHBondContact ND2-OE1 3.46Å
253	L	98.4	Very high	97.2	Very high	36 Å²	36	27.6 Å²	27.6	19%	0.188	13%	0.134	C	C	.	.	H	α-helix	trans	-63.5	-39.5	174.8	-72.3	174.8	0	0	0	111.6	W158 F159 T249 L250 I251 F255 A256 A257 N274	W158-L253 HydrophobicContact CE3-CD1 4.06Å; W158-L253 HydrophobicContact CH2-CB 3.81Å; W158-L253 HydrophobicContact CZ2-CB 4Å; W158-L253 HydrophobicContact CZ3-CB 4.09Å; W158-L253 HydrophobicContact CZ3-CD1 4.1Å; F159-L253 HydrophobicContact CE2-CD1 4.13Å; F159-L253 HydrophobicContact CZ-CD1 4.05Å; F159-L253 HydrophobicContact CZ-CD2 4.22Å; T249-L253 VanDerWaalsContact O-CG 3.32Å; T249-L253 WeakPolarHBondContact O-CG 3.28Å; T249-L253 PolarHBondContact O-N 3.44Å; L250-L253 PolarHBondContact O-N 2.98Å; I251-L253 VanDerWaalsContact C-N 3.34Å; I251-L253 PolarHBondContact O-N 2.9Å; L253-F255 VanDerWaalsContact C-N 3.35Å; L253-A256 PolarHBondContact O-N 2.96Å; L253-A257 WeakPolarHBondContact O-CB 3.4Å; L253-A257 PolarHBondContact O-N 3.23Å; L253-N274 PolarHBondContact N-OD1 3.42Å
254	S	98.7	Very high	97.5	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-66.5	-36.9	175	-160.3	0	0	0	0	112.1	P170 T171 I173 F174 L250 I251 N252 A257 K258	P170-S254 WeakPolarHBondContact O-CA 3.16Å; P170-S254 WeakPolarHBondContact O-CB 3.21Å; P170-S254 PolarHBondContact O-OG 2.69Å; T171-S254 VanDerWaalsContact C-OG 3.24Å; T171-S254 WeakPolarHBondContact CA-OG 3.32Å; T171-S254 PolarHBondContact O-OG 3.34Å; I173-S254 WeakPolarHBondContact CB-OG 3.32Å; I173-S254 PolarHBondContact N-OG 3.13Å; F174-S254 PolarHBondContact N-OG 3.4Å; L250-S254 PolarHBondContact O-N 3.47Å; I251-S254 WeakPolarHBondContact O-CB 3.25Å; I251-S254 PolarHBondContact O-N 3.21Å; I251-S254 VanDerWaalsContact O-N 3.13Å; N252-S254 VanDerWaalsContact C-N 3.32Å; N252-S254 PolarHBondContact O-N 3Å; S254-A257 PolarHBondContact O-N 3.37Å; S254-K258 WeakPolarHBondContact O-CB 3.32Å; S254-K258 PolarHBondContact O-N 3.39Å
255	F	98.7	Very high	97.9	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-64.8	-43.3	172.7	-66.7	-10.2	0	0	0	111.9	F174 W177 I251 N252 L253 A257 K258 Q259 M270 L323 V326	F174-F255 HydrophobicContact CB-CD1 4Å; F174-F255 HydrophobicContact CB-CE1 4.21Å; F174-F255 AromaticContact CD2-CD1 3.58Å; F174-F255 HydrophobicContact CD2-CD1 3.58Å; F174-F255 AromaticContact CD2-CE1 3.69Å; F174-F255 HydrophobicContact CD2-CE1 3.69Å; F174-F255 HydrophobicContact CG-CD1 4.28Å; F174-F255 HydrophobicContact CG-CE1 4.43Å; W177-F255 HydrophobicContact CD2-CE1 4.3Å; W177-F255 HydrophobicContact CD2-CZ 4.1Å; W177-F255 AromaticContact CE2-CZ 3.84Å; W177-F255 HydrophobicContact CE3-CE1 4.45Å; W177-F255 HydrophobicContact CE3-CZ 4.36Å; W177-F255 HydrophobicContact CH2-CZ 4.2Å; W177-F255 AromaticContact CZ2-CZ 3.87Å; W177-F255 HydrophobicContact CZ2-CZ 3.87Å; W177-F255 HydrophobicContact CZ3-CZ 4.43Å; I251-F255 HydrophobicContact CG2-CD1 4.33Å; I251-F255 HydrophobicContact CG2-CD2 3.98Å; I251-F255 HydrophobicContact CG2-CE1 3.82Å; I251-F255 HydrophobicContact CG2-CE2 3.43Å; I251-F255 VanDerWaalsContact CG2-CE2 3.43Å; I251-F255 HydrophobicContact CG2-CG 4.44Å; I251-F255 HydrophobicContact CG2-CZ 3.35Å; I251-F255 WeakPolarHBondContact O-CD1 3.33Å; I251-F255 VanDerWaalsContact O-CG 3.31Å; I251-F255 WeakPolarHBondContact O-CG 3.42Å; I251-F255 PolarHBondContact O-N 2.92Å; N252-F255 WeakPolarHBondContact O-CB 3.47Å; N252-F255 PolarHBondContact O-N 2.87Å; L253-F255 VanDerWaalsContact C-N 3.35Å; F255-A257 PolarHBondContact O-N 3.2Å; F255-K258 PolarHBondContact O-N 2.83Å; F255-Q259 PolarHBondContact O-N 2.97Å; F255-M270 HydrophobicContact CB-CE 4.22Å; F255-L323 HydrophobicContact CD2-CB 4.31Å; F255-L323 HydrophobicContact CE1-CD1 4.25Å; F255-L323 HydrophobicContact CE2-CB 3.68Å; F255-L323 HydrophobicContact CE2-CD1 4.39Å; F255-L323 HydrophobicContact CZ-CB 4.04Å; F255-L323 HydrophobicContact CZ-CD1 3.93Å; F255-V326 HydrophobicContact CB-CG2 3.67Å; F255-V326 HydrophobicContact CD1-CG2 4.45Å; F255-V326 HydrophobicContact CG-CG2 4.13Å; F255-V326 WeakPolarHBondContact O-CG2 3.33Å
256	A	98.7	Very high	98	Very high	15 Å²	15	37.1 Å²	37.1	12%	0.124	20%	0.198	C	C	.	.	H	α-helix	trans	-62.5	-42.4	174.3	0	0	0	0	0	111.8	N252 L253 K258 Q259 R260 V266 M270	N252-A256 PolarHBondContact O-N 3.1Å; L253-A256 PolarHBondContact O-N 2.96Å; A256-K258 VanDerWaalsContact C-N 3.32Å; A256-K258 PolarHBondContact O-N 2.75Å; A256-Q259 PolarHBondContact O-N 3.47Å; A256-R260 PolarHBondContact O-N 2.87Å; A256-V266 HydrophobicContact CB-CG1 4.35Å; A256-M270 HydrophobicContact CB-CG 3.77Å; A256-M270 HydrophobicContact CB-SD 4.24Å
257	A	98.6	Very high	98.1	Very high	21 Å²	21	37.1 Å²	37.1	17%	0.174	20%	0.198	C	C	.	.	H	α-helix	trans	-60.8	-41.6	173.9	0	0	0	0	0	111.7	P170 T171 L253 S254 F255 R260 E261	P170-A257 HydrophobicContact CB-CB 3.77Å; T171-A257 HydrophobicContact CG2-CB 4.09Å; L253-A257 WeakPolarHBondContact O-CB 3.4Å; L253-A257 PolarHBondContact O-N 3.23Å; S254-A257 PolarHBondContact O-N 3.37Å; F255-A257 PolarHBondContact O-N 3.2Å; A257-R260 WeakPolarHBondContact O-CB 3.27Å; A257-R260 PolarHBondContact O-N 3.03Å; A257-E261 PolarHBondContact O-N 3.3Å
258	K	98.7	Very high	98.2	Very high	23 Å²	23	38.6 Å²	38.6	10%	0.1	21%	0.205	C	C	.	.	H	α-helix	trans	-66.7	-40.8	177.2	-170.3	73.2	179.7	-179.1	0	112.2	T171 F174 D175 S254 F255 A256 R260 E261 L262 V326	T171-K258 HydrophobicContact CG2-CB 4.12Å; T171-K258 HydrophobicContact CG2-CD 3.93Å; F174-K258 HydrophobicContact CB-CB 4.09Å; F174-K258 HydrophobicContact CB-CD 4.48Å; F174-K258 HydrophobicContact CB-CG 4.25Å; F174-K258 HydrophobicContact CD1-CB 4.15Å; F174-K258 HydrophobicContact CD1-CD 3.49Å; F174-K258 VanDerWaalsContact CD1-CD 3.49Å; F174-K258 HydrophobicContact CD1-CG 3.38Å; F174-K258 HydrophobicContact CD2-CB 4.35Å; F174-K258 HydrophobicContact CD2-CG 4.18Å; F174-K258 HydrophobicContact CE1-CD 3.94Å; F174-K258 HydrophobicContact CE1-CG 3.65Å; F174-K258 HydrophobicContact CE2-CG 4.41Å; F174-K258 HydrophobicContact CG-CB 3.92Å; F174-K258 HydrophobicContact CG-CD 4.11Å; F174-K258 HydrophobicContact CG-CG 3.66Å; F174-K258 HydrophobicContact CZ-CG 4.16Å; D175-K258 WeakPolarHBondContact OD1-CE 3.26Å; D175-K258 IonicContact OD1-NZ 2.87Å; D175-K258 PolarHBondContact OD1-NZ 2.86Å; S254-K258 WeakPolarHBondContact O-CB 3.32Å; S254-K258 PolarHBondContact O-N 3.39Å; F255-K258 PolarHBondContact O-N 2.83Å; A256-K258 VanDerWaalsContact C-N 3.32Å; A256-K258 PolarHBondContact O-N 2.75Å; K258-R260 VanDerWaalsContact C-N 3.26Å; K258-R260 PolarHBondContact O-N 3.18Å; K258-E261 WeakPolarHBondContact CE-OE1 3.47Å; K258-E261 IonicContact NZ-OE1 3.7Å; K258-E261 PolarHBondContact NZ-OE1 2.77Å; K258-E261 WeakPolarHBondContact O-CB 3.35Å; K258-E261 PolarHBondContact O-N 3.29Å; K258-E261 VanDerWaalsContact O-N 3.15Å; K258-L262 HydrophobicContact CD-CG 4.47Å; K258-L262 HydrophobicContact CG-CD1 3.98Å; K258-L262 HydrophobicContact CG-CG 4.25Å; K258-L262 WeakPolarHBondContact O-CG 3.25Å; K258-L262 PolarHBondContact O-N 2.77Å; K258-V326 HydrophobicContact CB-CG1 4.13Å; K258-V326 HydrophobicContact CG-CG1 3.73Å
259	Q	98.6	Very high	98.2	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-58.6	-42.4	175	-169.7	-175.9	66.5	0	0	110.6	F255 A256 L262 H263 T267 M270 L325	F255-Q259 PolarHBondContact O-N 2.97Å; A256-Q259 PolarHBondContact O-N 3.47Å; Q259-L262 PolarHBondContact O-N 3.39Å; Q259-H263 WeakPolarHBondContact O-CB 3.21Å; Q259-H263 PolarHBondContact O-CD2 3.03Å; Q259-H263 VanDerWaalsContact O-CD2 3.3Å; Q259-H263 PolarHBondContact O-N 3.16Å; Q259-T267 PolarHBondContact NE2-OG1 3.27Å; Q259-T267 PolarHBondContact OE1-OG1 3.21Å; Q259-M270 HydrophobicContact CB-CE 4.04Å; Q259-M270 VanDerWaalsContact OE1-CB 3.22Å; Q259-L325 PolarHBondContact NE2-O 2.92Å
260	R	98.3	Very high	98.3	Very high	161 Å²	161	38.1 Å²	38.1	61%	0.608	20%	0.202	S	C	*	.	H	α-helix	trans	-63.6	-41.8	174.8	-170.6	178.1	178.1	-177.6	-1.5	112.8	A256 A257 K258 G264 V266	A256-R260 PolarHBondContact O-N 2.87Å; A257-R260 WeakPolarHBondContact O-CB 3.27Å; A257-R260 PolarHBondContact O-N 3.03Å; K258-R260 VanDerWaalsContact C-N 3.26Å; K258-R260 PolarHBondContact O-N 3.18Å; R260-G264 CarbonylContact O-C 3.31Å; R260-G264 WeakPolarHBondContact O-CA 3.32Å; R260-G264 PolarHBondContact O-N 3.2Å; R260-V266 HydrophobicContact CB-CG2 3.78Å; R260-V266 HydrophobicContact CG-CG2 4.4Å
261	E	98.3	Very high	98.4	Very high	106 Å²	106	41 Å²	41	50%	0.495	22%	0.22	S	C	.	.	H	α-helix	trans	-61.8	-45	177.3	-175.9	-173.6	102.2	0	0	111.6	T171 A257 K258	T171-E261 HydrophobicContact CG2-CB 4.37Å; T171-E261 WeakPolarHBondContact CG2-OE2 3.34Å; A257-E261 PolarHBondContact O-N 3.3Å; K258-E261 WeakPolarHBondContact CE-OE1 3.47Å; K258-E261 IonicContact NZ-OE1 3.7Å; K258-E261 PolarHBondContact NZ-OE1 2.77Å; K258-E261 WeakPolarHBondContact O-CB 3.35Å; K258-E261 PolarHBondContact O-N 3.29Å; K258-E261 VanDerWaalsContact O-N 3.15Å
262	L	98.1	Very high	98.3	Very high	91 Å²	91	41.6 Å²	41.6	48%	0.476	22%	0.223	S	C	.	.	H	α-helix	trans	-76.7	-38	-176.4	-66.7	176.5	0	0	0	113.4	K258 Q259 V326	K258-L262 HydrophobicContact CD-CG 4.47Å; K258-L262 HydrophobicContact CG-CD1 3.98Å; K258-L262 HydrophobicContact CG-CG 4.25Å; K258-L262 WeakPolarHBondContact O-CG 3.25Å; K258-L262 PolarHBondContact O-N 2.77Å; Q259-L262 PolarHBondContact O-N 3.39Å; L262-V326 HydrophobicContact CD1-CG1 3.78Å
263	H	97.8	Very high	98.4	Very high	69 Å²	69	41.6 Å²	41.6	32%	0.319	22%	0.223	S	C	.	.	H	α-helix	trans	-116.2	0.8	-168.9	-53.2	-71.1	0	0	0	113.8	Q259 H265 V326	Q259-H263 WeakPolarHBondContact O-CB 3.21Å; Q259-H263 PolarHBondContact O-CD2 3.03Å; Q259-H263 VanDerWaalsContact O-CD2 3.3Å; Q259-H263 PolarHBondContact O-N 3.16Å; H263-H265 PolarHBondContact O-N 3.04Å; H263-H265 VanDerWaalsContact O-N 3.17Å; H263-H265 PolarHBondContact O-ND1 2.59Å; H263-V326 PolarHBondContact NE2-O 2.86Å
264	G	97.4	Very high	98.4	Very high	62 Å²	62	40.8 Å²	40.8	64%	0.639	22%	0.219	S	C	*	.	S	Bend	trans	75.4	-8.8	-178.8	0	0	0	0	0	115.3	R260	R260-G264 CarbonylContact O-C 3.31Å; R260-G264 WeakPolarHBondContact O-CA 3.32Å; R260-G264 PolarHBondContact O-N 3.2Å
265	H	97	Very high	98.3	Very high	100 Å²	100	44 Å²	44	46%	0.463	24%	0.238	S	C	.	.	S	Bend	trans	-150.5	164.1	-178.7	65.9	-79.6	0	0	0	111.9	H263	H263-H265 PolarHBondContact O-N 3.04Å; H263-H265 VanDerWaalsContact O-N 3.17Å; H263-H265 PolarHBondContact O-ND1 2.59Å
266	V	98.4	Very high	98.3	Very high	54 Å²	54	44.3 Å²	44.3	33%	0.327	24%	0.24	S	C	.	.			trans	-104.3	126.1	172	-174.7	0	0	0	0	108.5	A256 R260 M270 V271	A256-V266 HydrophobicContact CB-CG1 4.35Å; R260-V266 HydrophobicContact CB-CG2 3.78Å; R260-V266 HydrophobicContact CG-CG2 4.4Å; V266-M270 HydrophobicContact CG1-CB 3.78Å; V266-M270 HydrophobicContact CG1-CG 3.68Å; V266-V271 HydrophobicContact CG1-CG2 3.92Å
267	T	98.6	Very high	98.3	Very high	1 Å²	1	43.6 Å²	43.6	1%	0.006	23%	0.234	C	C	.	.			trans	-70.1	155.4	180	57.2	0	0	0	0	112.4	Q259 A269 M270 V271 P329 V330	Q259-T267 PolarHBondContact NE2-OG1 3.27Å; Q259-T267 PolarHBondContact OE1-OG1 3.21Å; T267-A269 PolarHBondContact O-N 3.06Å; T267-M270 PolarHBondContact O-N 3.01Å; T267-M270 WeakPolarHBondContact OG1-CB 3.48Å; T267-M270 PolarHBondContact OG1-N 3.13Å; T267-V271 PolarHBondContact O-N 3.47Å; T267-V271 VanDerWaalsContact O-N 3.16Å; T267-P329 HydrophobicContact CG2-CB 3.72Å; T267-V330 VanDerWaalsContact CB-O 3.27Å; T267-V330 WeakPolarHBondContact CB-O 3.34Å
268	N	98.3	Very high	98.3	Very high	40 Å²	40	43.7 Å²	43.7	21%	0.214	24%	0.235	C	C	.	.	H	α-helix	trans	-63.4	-30.7	176.1	66.5	0.5	0	0	0	112.7	V271 L272 Q331 L332	N268-V271 PolarHBondContact O-N 3.49Å; N268-L272 WeakPolarHBondContact O-CB 3.21Å; N268-L272 WeakPolarHBondContact O-CG 3.37Å; N268-L272 PolarHBondContact O-N 3.19Å; N268-Q331 VanDerWaalsContact N-OE1 3.1Å; N268-Q331 PolarHBondContact ND2-NE2 2.8Å; N268-Q331 PolarHBondContact OD1-OE1 3.34Å; N268-L332 PolarHBondContact ND2-O 3.41Å; N268-L332 PolarHBondContact OD1-N 3.48Å
269	A	98.6	Very high	98.3	Very high	0 Å²	0	45 Å²	45	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-61.7	-47.1	173.8	0	0	0	0	0	111.7	T267 V271 L272 V273 L325 V330 L332 A421	T267-A269 PolarHBondContact O-N 3.06Å; A269-V271 VanDerWaalsContact C-N 3.32Å; A269-V271 PolarHBondContact O-N 2.84Å; A269-L272 PolarHBondContact O-N 3.29Å; A269-V273 WeakPolarHBondContact O-CG2 3.38Å; A269-V273 PolarHBondContact O-N 2.85Å; A269-L325 HydrophobicContact CB-CD1 4.06Å; A269-L325 HydrophobicContact CB-CD2 3.81Å; A269-V330 HydrophobicContact CB-CB 4.19Å; A269-V330 HydrophobicContact CB-CG1 4.4Å; A269-V330 WeakPolarHBondContact CB-O 3.47Å; A269-L332 HydrophobicContact CB-CD1 4.3Å; A269-L332 HydrophobicContact CB-CG 4.32Å; A269-A421 WeakPolarHBondContact CB-O 3.29Å
270	M	98.8	Very high	98.2	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-61.7	-42.2	178.4	179.9	65.5	84.2	0	0	111.1	F255 A256 Q259 V266 T267 N274 G322 L325 V326	F255-M270 HydrophobicContact CB-CE 4.22Å; A256-M270 HydrophobicContact CB-CG 3.77Å; A256-M270 HydrophobicContact CB-SD 4.24Å; Q259-M270 HydrophobicContact CB-CE 4.04Å; Q259-M270 VanDerWaalsContact OE1-CB 3.22Å; V266-M270 HydrophobicContact CG1-CB 3.78Å; V266-M270 HydrophobicContact CG1-CG 3.68Å; T267-M270 PolarHBondContact O-N 3.01Å; T267-M270 WeakPolarHBondContact OG1-CB 3.48Å; T267-M270 PolarHBondContact OG1-N 3.13Å; M270-N274 WeakPolarHBondContact O-CB 3.41Å; M270-N274 PolarHBondContact O-N 2.98Å; M270-N274 PolarHBondContact O-ND2 3.48Å; M270-N274 PolarHBondContact SD-ND2 2.88Å; M270-N274 VanDerWaalsContact SD-ND2 3.39Å; M270-G322 WeakPolarHBondContact CE-O 3.38Å; M270-L325 HydrophobicContact CB-CD1 4.33Å; M270-L325 HydrophobicContact CE-CB 3.57Å; M270-L325 HydrophobicContact SD-CB 4.3Å; M270-L325 HydrophobicContact SD-CD1 4.49Å; M270-V326 HydrophobicContact CE-CG2 4Å
271	V	98.6	Very high	98.1	Very high	74 Å²	74	40 Å²	40	45%	0.448	22%	0.224	S	C	.	.	H	α-helix	trans	-61.6	-47	174.9	176.3	0	0	0	0	111	V266 T267 N268 A269 V273 N274 V275	V266-V271 HydrophobicContact CG1-CG2 3.92Å; T267-V271 PolarHBondContact O-N 3.47Å; T267-V271 VanDerWaalsContact O-N 3.16Å; N268-V271 PolarHBondContact O-N 3.49Å; A269-V271 VanDerWaalsContact C-N 3.32Å; A269-V271 PolarHBondContact O-N 2.84Å; V271-V273 PolarHBondContact O-N 3.27Å; V271-N274 PolarHBondContact O-N 2.73Å; V271-V275 HydrophobicContact CG1-CG2 4.12Å; V271-V275 WeakPolarHBondContact O-CB 3.31Å; V271-V275 VanDerWaalsContact O-CG2 3.3Å; V271-V275 WeakPolarHBondContact O-CG2 3.44Å; V271-V275 PolarHBondContact O-N 2.83Å
272	L	98.4	Very high	98.1	Very high	20 Å²	20	37.9 Å²	37.9	11%	0.105	22%	0.216	C	C	.	.	H	α-helix	trans	-59.9	-47	179.2	-77.9	172.9	0	0	0	112.4	N268 A269 N274 V275 L276 L332 A337 V340 L341	N268-L272 WeakPolarHBondContact O-CB 3.21Å; N268-L272 WeakPolarHBondContact O-CG 3.37Å; N268-L272 PolarHBondContact O-N 3.19Å; A269-L272 PolarHBondContact O-N 3.29Å; L272-N274 PolarHBondContact O-N 2.94Å; L272-V275 PolarHBondContact O-N 3.46Å; L272-L276 WeakPolarHBondContact O-CB 3.02Å; L272-L276 VanDerWaalsContact O-CG 3.26Å; L272-L276 WeakPolarHBondContact O-CG 3.43Å; L272-L276 PolarHBondContact O-N 3.43Å; L272-L332 HydrophobicContact CD1-CD1 3.98Å; L272-A337 HydrophobicContact CD1-CB 3.98Å; L272-V340 HydrophobicContact CD1-CG1 4.42Å; L272-L341 HydrophobicContact CD2-CB 3.9Å; L272-L341 HydrophobicContact CD2-CD1 4.01Å; L272-L341 HydrophobicContact CD2-CG 4.39Å
273	V	98.6	Very high	98	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-58.9	-48.8	176.6	171.3	0	0	0	0	110.5	A269 V271 V275 Q277 Q321 L325 A421	A269-V273 WeakPolarHBondContact O-CG2 3.38Å; A269-V273 PolarHBondContact O-N 2.85Å; V271-V273 PolarHBondContact O-N 3.27Å; V273-V275 PolarHBondContact O-N 3.16Å; V273-Q277 HydrophobicContact CG1-CG 4.4Å; V273-Q277 VanDerWaalsContact O-CB 3.31Å; V273-Q277 WeakPolarHBondContact O-CB 3.45Å; V273-Q277 VanDerWaalsContact O-CG 3.32Å; V273-Q277 WeakPolarHBondContact O-CG 3.27Å; V273-Q277 PolarHBondContact O-N 3.39Å; V273-Q321 HydrophobicContact CG1-CB 3.87Å; V273-Q321 HydrophobicContact CG2-CB 4.09Å; V273-L325 HydrophobicContact CB-CD1 4.43Å; V273-L325 HydrophobicContact CG2-CD1 3.81Å; V273-A421 HydrophobicContact CG2-CB 3.57Å
274	N	98.5	Very high	97.9	Very high	20 Å²	20	32.3 Å²	32.3	11%	0.107	19%	0.188	C	C	.	.	H	α-helix	trans	-60.3	-47.3	179.6	-87.6	-99	0	0	0	111.9	N252 L253 M270 V271 L272 A278	N252-N274 WeakPolarHBondContact CB-OD1 3.45Å; N252-N274 PolarHBondContact O-OD1 2.82Å; L253-N274 PolarHBondContact N-OD1 3.42Å; M270-N274 WeakPolarHBondContact O-CB 3.41Å; M270-N274 PolarHBondContact O-N 2.98Å; M270-N274 PolarHBondContact O-ND2 3.48Å; M270-N274 PolarHBondContact SD-ND2 2.88Å; M270-N274 VanDerWaalsContact SD-ND2 3.39Å; V271-N274 PolarHBondContact O-N 2.73Å; L272-N274 PolarHBondContact O-N 2.94Å; N274-A278 WeakPolarHBondContact O-CB 3.44Å; N274-A278 PolarHBondContact O-N 3.14Å
275	V	98.4	Very high	97.8	Very high	66 Å²	66	29.4 Å²	29.4	40%	0.4	16%	0.157	S	C	.	.	H	α-helix	trans	-65.1	-49.4	-178.8	168.5	0	0	0	0	111.1	V271 L272 V273 A278 I279	V271-V275 HydrophobicContact CG1-CG2 4.12Å; V271-V275 WeakPolarHBondContact O-CB 3.31Å; V271-V275 VanDerWaalsContact O-CG2 3.3Å; V271-V275 WeakPolarHBondContact O-CG2 3.44Å; V271-V275 PolarHBondContact O-N 2.83Å; L272-V275 PolarHBondContact O-N 3.46Å; V273-V275 PolarHBondContact O-N 3.16Å; V275-A278 PolarHBondContact O-N 2.95Å; V275-I279 HydrophobicContact CG1-CD1 3.99Å; V275-I279 VanDerWaalsContact O-CG1 3.31Å; V275-I279 WeakPolarHBondContact O-CG1 3.48Å; V275-I279 PolarHBondContact O-N 3.13Å
276	L	98.4	Very high	97.7	Very high	7 Å²	7	28.9 Å²	28.9	4%	0.037	15%	0.151	C	C	.	.	H	α-helix	trans	-66	-42.3	-176.9	-68.4	174.3	0	0	0	111.7	L272 I279 Y280 V340 L341 A417 Y418	L272-L276 WeakPolarHBondContact O-CB 3.02Å; L272-L276 VanDerWaalsContact O-CG 3.26Å; L272-L276 WeakPolarHBondContact O-CG 3.43Å; L272-L276 PolarHBondContact O-N 3.43Å; L276-I279 PolarHBondContact O-N 3.02Å; L276-Y280 PolarHBondContact O-N 3.09Å; L276-V340 HydrophobicContact CD1-CG1 4.37Å; L276-L341 HydrophobicContact CD2-CD1 4.12Å; L276-A417 HydrophobicContact CD1-CB 4.1Å; L276-Y418 HydrophobicContact CB-CD1 3.88Å; L276-Y418 HydrophobicContact CB-CE1 3.61Å; L276-Y418 HydrophobicContact CD1-CD1 4.4Å
277	Q	98.4	Very high	97.5	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-68.9	-36.2	175.1	-67.4	-174.4	-10	0	0	111.8	W248 N252 V273 Y280 V281 Y318 Y418	W248-Q277 HydrophobicContact CZ2-CB 4.02Å; W248-Q277 HydrophobicContact CZ2-CG 3.79Å; N252-Q277 PolarHBondContact ND2-OE1 3.46Å; V273-Q277 HydrophobicContact CG1-CG 4.4Å; V273-Q277 VanDerWaalsContact O-CB 3.31Å; V273-Q277 WeakPolarHBondContact O-CB 3.45Å; V273-Q277 VanDerWaalsContact O-CG 3.32Å; V273-Q277 WeakPolarHBondContact O-CG 3.27Å; V273-Q277 PolarHBondContact O-N 3.39Å; Q277-Y280 WeakPolarHBondContact O-CB 3.45Å; Q277-Y280 PolarHBondContact O-N 3.41Å; Q277-V281 WeakPolarHBondContact O-CG2 3.34Å; Q277-V281 PolarHBondContact O-N 3.46Å; Q277-Y318 PolarHBondContact NE2-O 3.08Å; Q277-Y418 HydrophobicContact CG-CD1 4Å; Q277-Y418 HydrophobicContact CG-CD2 3.9Å; Q277-Y418 HydrophobicContact CG-CE1 3.97Å; Q277-Y418 HydrophobicContact CG-CE2 3.85Å; Q277-Y418 HydrophobicContact CG-CG 3.99Å
278	A	98	Very high	97.3	Very high	24 Å²	24	28.4 Å²	28.4	20%	0.198	15%	0.147	C	C	.	.	H	α-helix	trans	-65	-39.9	174.6	0	0	0	0	0	112.4	T249 N274 V275 Y280 V281 I282	T249-A278 HydrophobicContact CG2-CB 4.21Å; N274-A278 WeakPolarHBondContact O-CB 3.44Å; N274-A278 PolarHBondContact O-N 3.14Å; V275-A278 PolarHBondContact O-N 2.95Å; A278-Y280 VanDerWaalsContact C-N 3.29Å; A278-Y280 PolarHBondContact O-N 3.41Å; A278-V281 PolarHBondContact O-N 3.34Å; A278-I282 HydrophobicContact CB-CD1 4.47Å; A278-I282 WeakPolarHBondContact O-CB 3.29Å; A278-I282 WeakPolarHBondContact O-CD1 3.2Å; A278-I282 WeakPolarHBondContact O-CG1 3.4Å; A278-I282 PolarHBondContact O-N 2.95Å
279	I	97.9	Very high	97	Very high	49 Å²	49	27.4 Å²	27.4	25%	0.251	14%	0.142	S	C	.	.	H	α-helix	trans	-55.6	-48.7	172.7	-71.4	165.1	0	0	0	109.6	V275 L276 D283 L345 Y348	V275-I279 HydrophobicContact CG1-CD1 3.99Å; V275-I279 VanDerWaalsContact O-CG1 3.31Å; V275-I279 WeakPolarHBondContact O-CG1 3.48Å; V275-I279 PolarHBondContact O-N 3.13Å; L276-I279 PolarHBondContact O-N 3.02Å; I279-D283 WeakPolarHBondContact O-CB 3.45Å; I279-D283 PolarHBondContact O-N 3.26Å; I279-L345 HydrophobicContact CD1-CD2 3.89Å; I279-Y348 HydrophobicContact CG2-CD1 4.03Å; I279-Y348 HydrophobicContact CG2-CD2 3.72Å; I279-Y348 HydrophobicContact CG2-CE1 4.08Å; I279-Y348 HydrophobicContact CG2-CE2 3.77Å; I279-Y348 HydrophobicContact CG2-CG 3.86Å
280	Y	96.8	Very high	96.5	Very high	56 Å²	56	31.3 Å²	31.3	22%	0.22	16%	0.157	C	C	.	.	H	α-helix	trans	-61.1	-45.8	178.7	-174.6	-84.9	0	0	0	112.7	W248 L276 Q277 A278 D283 F284 D411 Y418	W248-Y280 AromaticContact CH2-CD1 3.97Å; W248-Y280 HydrophobicContact CH2-CD1 3.97Å; W248-Y280 HydrophobicContact CH2-CE1 4.34Å; W248-Y280 AromaticContact CZ3-CD1 3.76Å; W248-Y280 HydrophobicContact CZ3-CD1 3.76Å; W248-Y280 HydrophobicContact CZ3-CE1 4.01Å; L276-Y280 PolarHBondContact O-N 3.09Å; Q277-Y280 WeakPolarHBondContact O-CB 3.45Å; Q277-Y280 PolarHBondContact O-N 3.41Å; A278-Y280 VanDerWaalsContact C-N 3.29Å; A278-Y280 PolarHBondContact O-N 3.41Å; Y280-D283 PolarHBondContact O-N 3.46Å; Y280-F284 PolarHBondContact O-N 3.1Å; Y280-D411 WeakPolarHBondContact CE2-OD1 3.34Å; Y280-Y418 WeakPolarHBondContact CB-OH 3.33Å
281	V	97.5	Very high	96.1	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-69	-43.2	-178.7	168.2	0	0	0	0	112.4	I245 W248 T249 Q277 A278 D283 F284 F285	I245-V281 HydrophobicContact CG2-CB 4.41Å; I245-V281 HydrophobicContact CG2-CG1 3.74Å; I245-V281 HydrophobicContact CG2-CG2 4.11Å; W248-V281 HydrophobicContact CD2-CG2 3.85Å; W248-V281 HydrophobicContact CE3-CG2 3.35Å; W248-V281 HydrophobicContact CG-CG2 4.39Å; W248-V281 HydrophobicContact CZ3-CG2 3.76Å; T249-V281 HydrophobicContact CG2-CB 3.78Å; T249-V281 HydrophobicContact CG2-CG1 3.85Å; T249-V281 HydrophobicContact CG2-CG2 3.93Å; Q277-V281 WeakPolarHBondContact O-CG2 3.34Å; Q277-V281 PolarHBondContact O-N 3.46Å; A278-V281 PolarHBondContact O-N 3.34Å; V281-D283 VanDerWaalsContact C-N 3.3Å; V281-D283 PolarHBondContact O-N 3.25Å; V281-F284 WeakPolarHBondContact O-CB 3.45Å; V281-F284 PolarHBondContact O-N 3.21Å; V281-F285 HydrophobicContact CG1-CD2 3.89Å; V281-F285 HydrophobicContact CG1-CE2 3.65Å; V281-F285 VanDerWaalsContact O-CD2 3.27Å; V281-F285 WeakPolarHBondContact O-CD2 3.31Å; V281-F285 PolarHBondContact O-N 3.09Å
282	I	97.1	Very high	95.8	Very high	62 Å²	62	28.8 Å²	28.8	32%	0.318	14%	0.139	S	C	.	.	H	α-helix	trans	-64.9	-41	176.7	-66.9	166.1	0	0	0	109.8	W151 A278 F284 F285 W286	W151-I282 HydrophobicContact CE3-CG1 4.45Å; W151-I282 HydrophobicContact CH2-CD1 3.58Å; W151-I282 HydrophobicContact CH2-CG1 3.67Å; W151-I282 HydrophobicContact CZ2-CD1 3.98Å; W151-I282 HydrophobicContact CZ2-CG1 3.73Å; W151-I282 HydrophobicContact CZ3-CD1 4.16Å; W151-I282 HydrophobicContact CZ3-CG1 4.04Å; A278-I282 HydrophobicContact CB-CD1 4.47Å; A278-I282 WeakPolarHBondContact O-CB 3.29Å; A278-I282 WeakPolarHBondContact O-CD1 3.2Å; A278-I282 WeakPolarHBondContact O-CG1 3.4Å; A278-I282 PolarHBondContact O-N 2.95Å; I282-F284 VanDerWaalsContact C-N 3.32Å; I282-F284 PolarHBondContact O-N 3.33Å; I282-F285 PolarHBondContact O-N 2.85Å; I282-W286 WeakPolarHBondContact O-CB 3.22Å; I282-W286 PolarHBondContact O-N 3.48Å
283	D	95.8	Very high	95.2	Very high	12 Å²	12	33.4 Å²	33.4	6%	0.064	16%	0.159	C	C	.	.	H	α-helix	trans	-63.1	-37.3	175.7	-178.7	71.9	0	0	0	112.5	I279 Y280 V281 N287 Y348 R352	I279-D283 WeakPolarHBondContact O-CB 3.45Å; I279-D283 PolarHBondContact O-N 3.26Å; Y280-D283 PolarHBondContact O-N 3.46Å; V281-D283 VanDerWaalsContact C-N 3.3Å; V281-D283 PolarHBondContact O-N 3.25Å; D283-N287 WeakPolarHBondContact O-CB 3.29Å; D283-N287 PolarHBondContact O-N 3.39Å; D283-N287 PolarHBondContact O-ND2 3Å; D283-Y348 HydrophobicContact CB-CE2 3.75Å; D283-Y348 PolarHBondContact OD1-OH 2.89Å; D283-R352 VanDerWaalsContact CG-CZ 3.47Å; D283-R352 IonicContact OD1-CZ 2.76Å; D283-R352 IonicContact OD1-NE 3.03Å; D283-R352 PolarHBondContact OD1-NE 2.94Å; D283-R352 IonicContact OD1-NH2 3.3Å; D283-R352 PolarHBondContact OD1-NH2 2.81Å; D283-R352 IonicContact OD2-CZ 3.66Å; D283-R352 VanDerWaalsContact OD2-CZ 3.24Å; D283-R352 IonicContact OD2-NE 3.24Å; D283-R352 PolarHBondContact OD2-NE 3.32Å; D283-R352 IonicContact OD2-NH2 3.18Å; D283-R352 PolarHBondContact OD2-NH2 3.36Å
284	F	95.3	Very high	94.7	Very high	32 Å²	32	34.2 Å²	34.2	14%	0.14	16%	0.164	C	C	.	.	H	α-helix	trans	-58.5	-52	169.2	171	-91.2	0	0	0	111.2	I245 Y280 V281 I282 N287 E288 Y291	I245-F284 HydrophobicContact CD1-CD1 3.94Å; I245-F284 HydrophobicContact CD1-CD2 4.16Å; I245-F284 HydrophobicContact CD1-CE1 3.57Å; I245-F284 HydrophobicContact CD1-CE2 3.78Å; I245-F284 HydrophobicContact CD1-CG 4.23Å; I245-F284 HydrophobicContact CD1-CZ 3.48Å; I245-F284 VanDerWaalsContact CD1-CZ 3.48Å; I245-F284 HydrophobicContact CG2-CD1 3.93Å; I245-F284 HydrophobicContact CG2-CE1 4.28Å; Y280-F284 PolarHBondContact O-N 3.1Å; V281-F284 WeakPolarHBondContact O-CB 3.45Å; V281-F284 PolarHBondContact O-N 3.21Å; I282-F284 VanDerWaalsContact C-N 3.32Å; I282-F284 PolarHBondContact O-N 3.33Å; F284-N287 CarbonylContact O-C 3.49Å; F284-N287 WeakPolarHBondContact O-CA 3.36Å; F284-N287 PolarHBondContact O-N 3.46Å; F284-E288 WeakPolarHBondContact O-CA 3.43Å; F284-E288 PolarHBondContact O-N 2.92Å; F284-Y291 AromaticContact CE2-CD2 3.57Å; F284-Y291 HydrophobicContact CE2-CD2 3.57Å; F284-Y291 HydrophobicContact CE2-CE2 4.09Å; F284-Y291 AromaticContact CE2-CG 3.9Å; F284-Y291 HydrophobicContact CE2-CG 3.9Å; F284-Y291 HydrophobicContact CZ-CD2 4.19Å; F284-Y291 HydrophobicContact CZ-CG 4.13Å
285	F	96.5	Very high	94	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-69.4	-34.8	-177.8	-74.3	-58	0	0	0	113.9	L148 W151 G241 I245 V246 V281 I282 N287 E288	L148-F285 HydrophobicContact CB-CB 4.11Å; L148-F285 HydrophobicContact CD1-CB 4.14Å; W151-F285 HydrophobicContact CB-CD2 3.88Å; W151-F285 HydrophobicContact CB-CE2 4.04Å; W151-F285 HydrophobicContact CB-CG 4.39Å; W151-F285 AromaticContact CD1-CD2 3.69Å; W151-F285 AromaticContact CD1-CE2 3.43Å; W151-F285 VanDerWaalsContact CD1-CE2 3.43Å; W151-F285 AromaticContact CG-CD2 3.84Å; W151-F285 HydrophobicContact CG-CD2 3.84Å; W151-F285 AromaticContact CG-CE2 3.95Å; W151-F285 HydrophobicContact CG-CE2 3.95Å; G241-F285 WeakPolarHBondContact O-CZ 3.4Å; I245-F285 HydrophobicContact CB-CZ 4.09Å; I245-F285 HydrophobicContact CG2-CE2 3.67Å; I245-F285 HydrophobicContact CG2-CZ 3.68Å; V246-F285 HydrophobicContact CB-CZ 4.42Å; V246-F285 HydrophobicContact CG2-CE1 4.19Å; V246-F285 HydrophobicContact CG2-CE2 3.9Å; V246-F285 HydrophobicContact CG2-CZ 3.39Å; V281-F285 HydrophobicContact CG1-CD2 3.89Å; V281-F285 HydrophobicContact CG1-CE2 3.65Å; V281-F285 VanDerWaalsContact O-CD2 3.27Å; V281-F285 WeakPolarHBondContact O-CD2 3.31Å; V281-F285 PolarHBondContact O-N 3.09Å; I282-F285 PolarHBondContact O-N 2.85Å; F285-N287 PolarHBondContact O-N 3.46Å; F285-E288 WeakPolarHBondContact O-CB 3.25Å; F285-E288 PolarHBondContact O-N 3.43Å
286	W	95.3	Very high	93.5	Very high	90 Å²	90	31.9 Å²	31.9	34%	0.341	15%	0.149	S	C	.	.	H	α-helix	trans	-59.3	-29	171	-173.4	-81.1	0	0	0	111.6	L122 Y125 L148 I282	L122-W286 HydrophobicContact CB-CH2 4.19Å; L122-W286 HydrophobicContact CD1-CH2 4.35Å; L122-W286 HydrophobicContact CD1-CZ3 3.95Å; Y125-W286 HydrophobicContact CD2-CD2 4.31Å; Y125-W286 HydrophobicContact CD2-CG 4.41Å; Y125-W286 VanDerWaalsContact CD2-O 3.22Å; Y125-W286 WeakPolarHBondContact CD2-O 3.46Å; L148-W286 HydrophobicContact CD2-CE3 3.76Å; L148-W286 HydrophobicContact CD2-CZ3 4.22Å; I282-W286 WeakPolarHBondContact O-CB 3.22Å; I282-W286 PolarHBondContact O-N 3.48Å
287	N	93.2	Very high	93.1	Very high	45 Å²	45	31.7 Å²	31.7	24%	0.241	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.2	26.2	-177.4	-61.5	-93.6	0	0	0	112.5	D283 F284 F285 T289 W290 R352	D283-N287 WeakPolarHBondContact O-CB 3.29Å; D283-N287 PolarHBondContact O-N 3.39Å; D283-N287 PolarHBondContact O-ND2 3Å; F284-N287 CarbonylContact O-C 3.49Å; F284-N287 WeakPolarHBondContact O-CA 3.36Å; F284-N287 PolarHBondContact O-N 3.46Å; F285-N287 PolarHBondContact O-N 3.46Å; N287-T289 PolarHBondContact O-N 2.88Å; N287-T289 VanDerWaalsContact O-N 3.13Å; N287-W290 VanDerWaalsContact O-CB 3.24Å; N287-W290 WeakPolarHBondContact O-CB 3.12Å; N287-W290 PolarHBondContact O-N 3.27Å; N287-R352 PolarHBondContact ND2-NH1 3.47Å; N287-R352 PolarHBondContact ND2-NH2 2.84Å; N287-R352 PolarHBondContact OD1-NH1 2.87Å
288	E	94.8	Very high	92.5	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-57.3	-34.9	-173.7	-177.8	-179	-146.5	0	0	111.7	I145 N146 G147 L237 R242 F284 F285 W290 Y291	I145-E288 HydrophobicContact CD1-CG 4.36Å; I145-E288 HydrophobicContact CG2-CB 3.8Å; I145-E288 HydrophobicContact CG2-CG 3.99Å; I145-E288 VanDerWaalsContact CG2-OE2 3.26Å; I145-E288 WeakPolarHBondContact CG2-OE2 3.24Å; N146-E288 PolarHBondContact N-OE2 3.1Å; G147-E288 WeakPolarHBondContact CA-OE2 3.47Å; G147-E288 PolarHBondContact N-OE2 3.15Å; L237-E288 HydrophobicContact CD1-CG 4.29Å; R242-E288 IonicContact CZ-OE1 3.93Å; R242-E288 VanDerWaalsContact CZ-OE1 3.24Å; R242-E288 IonicContact NH1-OE1 3.3Å; R242-E288 PolarHBondContact NH1-OE1 3.21Å; R242-E288 IonicContact NH2-OE1 2.72Å; R242-E288 PolarHBondContact NH2-OE1 2.96Å; R242-E288 IonicContact NH2-OE2 2.7Å; R242-E288 PolarHBondContact NH2-OE2 3.22Å; F284-E288 WeakPolarHBondContact O-CA 3.43Å; F284-E288 PolarHBondContact O-N 2.92Å; F285-E288 WeakPolarHBondContact O-CB 3.25Å; F285-E288 PolarHBondContact O-N 3.43Å; E288-W290 PolarHBondContact O-N 2.95Å; E288-W290 VanDerWaalsContact O-N 3.17Å; E288-Y291 WeakPolarHBondContact O-CA 3.29Å; E288-Y291 WeakPolarHBondContact O-CB 3.35Å; E288-Y291 PolarHBondContact O-N 3.18Å
289	T	92.3	Very high	91.9	Very high	18 Å²	18	34.6 Å²	34.6	11%	0.11	16%	0.159	C	C	.	.	H	α-helix	trans	-56.7	-31.9	174.2	-62.7	0	0	0	0	113.2	V126 Q130 N287 Y291 L292	V126-T289 HydrophobicContact CG1-CG2 3.95Å; V126-T289 PolarHBondContact O-OG1 3.26Å; Q130-T289 HydrophobicContact CB-CG2 4.17Å; Q130-T289 HydrophobicContact CG-CG2 3.9Å; N287-T289 PolarHBondContact O-N 2.88Å; N287-T289 VanDerWaalsContact O-N 3.13Å; T289-Y291 VanDerWaalsContact C-N 3.26Å; T289-Y291 PolarHBondContact O-N 3.38Å; T289-L292 WeakPolarHBondContact O-CB 3.44Å; T289-L292 PolarHBondContact O-N 3.03Å
290	W	87.6	Confident	91.5	Very high	82 Å²	82	33 Å²	33	31%	0.311	15%	0.15	S	C	.	.	H	α-helix	trans	-68.4	-28.7	175.7	-175.7	86	0	0	0	112	N287 E288 L292 K293 T294	N287-W290 VanDerWaalsContact O-CB 3.24Å; N287-W290 WeakPolarHBondContact O-CB 3.12Å; N287-W290 PolarHBondContact O-N 3.27Å; E288-W290 PolarHBondContact O-N 2.95Å; E288-W290 VanDerWaalsContact O-N 3.17Å; W290-L292 PolarHBondContact O-N 3.26Å; W290-K293 WeakPolarHBondContact O-CB 3.24Å; W290-K293 PolarHBondContact O-N 2.89Å; W290-T294 HydrophobicContact CE3-CG2 3.98Å; W290-T294 HydrophobicContact CH2-CG2 4.21Å; W290-T294 HydrophobicContact CZ3-CG2 3.68Å
291	Y	90.1	Very high	91.3	Very high	19 Å²	19	30.5 Å²	30.5	8%	0.075	14%	0.141	C	C	.	.	H	α-helix	trans	-59.2	-31	176.9	-167.4	-108.7	0	0	0	112.2	L237 N240 F284 E288 T289 K293 T294 D296 I297	L237-Y291 HydrophobicContact CD1-CD1 4.02Å; N240-Y291 HydrophobicContact CB-CE1 4.16Å; N240-Y291 PolarHBondContact ND2-OH 2.95Å; N240-Y291 WeakPolarHBondContact OD1-CE1 3.49Å; N240-Y291 PolarHBondContact OD1-OH 3.3Å; F284-Y291 AromaticContact CE2-CD2 3.57Å; F284-Y291 HydrophobicContact CE2-CD2 3.57Å; F284-Y291 HydrophobicContact CE2-CE2 4.09Å; F284-Y291 AromaticContact CE2-CG 3.9Å; F284-Y291 HydrophobicContact CE2-CG 3.9Å; F284-Y291 HydrophobicContact CZ-CD2 4.19Å; F284-Y291 HydrophobicContact CZ-CG 4.13Å; E288-Y291 WeakPolarHBondContact O-CA 3.29Å; E288-Y291 WeakPolarHBondContact O-CB 3.35Å; E288-Y291 PolarHBondContact O-N 3.18Å; T289-Y291 VanDerWaalsContact C-N 3.26Å; T289-Y291 PolarHBondContact O-N 3.38Å; Y291-K293 PolarHBondContact O-N 2.9Å; Y291-T294 HydrophobicContact CD2-CG2 3.73Å; Y291-T294 HydrophobicContact CE2-CG2 4.21Å; Y291-T294 HydrophobicContact CG-CG2 4.37Å; Y291-T294 WeakPolarHBondContact O-CB 3.41Å; Y291-T294 WeakPolarHBondContact O-CG2 3.47Å; Y291-T294 PolarHBondContact O-N 2.88Å; Y291-T294 PolarHBondContact O-OG1 3.4Å; Y291-D296 PolarHBondContact OH-OD2 3.33Å; Y291-I297 HydrophobicContact CD1-CD1 4.25Å; Y291-I297 HydrophobicContact CD1-CG1 3.86Å; Y291-I297 HydrophobicContact CE1-CD1 3.95Å; Y291-I297 HydrophobicContact CE1-CG1 3.81Å; Y291-I297 WeakPolarHBondContact O-CG1 3.36Å
292	L	92.1	Very high	91.2	Very high	2 Å²	2	30.5 Å²	30.5	1%	0.01	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-17.9	174.6	-58.1	-175.7	0	0	0	113.8	Q130 Y143 I145 L237 T289 W290 I297 C298	Q130-L292 HydrophobicContact CB-CD1 4.1Å; Y143-L292 HydrophobicContact CD1-CD2 3.68Å; Y143-L292 HydrophobicContact CD2-CD1 3.86Å; Y143-L292 HydrophobicContact CD2-CD2 3.82Å; Y143-L292 HydrophobicContact CD2-CG 4.46Å; Y143-L292 HydrophobicContact CE1-CD2 3.91Å; Y143-L292 HydrophobicContact CE2-CD2 4.12Å; Y143-L292 HydrophobicContact CG-CD1 4.03Å; Y143-L292 HydrophobicContact CG-CD2 3.61Å; Y143-L292 HydrophobicContact CG-CG 4.49Å; I145-L292 HydrophobicContact CD1-CD1 4.1Å; I145-L292 HydrophobicContact CD1-CD2 4.32Å; I145-L292 HydrophobicContact CD1-CG 4.31Å; L237-L292 HydrophobicContact CD1-CD2 4.42Å; L237-L292 HydrophobicContact CD2-CD2 4.28Å; T289-L292 WeakPolarHBondContact O-CB 3.44Å; T289-L292 PolarHBondContact O-N 3.03Å; W290-L292 PolarHBondContact O-N 3.26Å; L292-I297 WeakPolarHBondContact O-CG2 3.26Å; L292-C298 PolarHBondContact O-SG 3.46Å
293	K	87.3	Confident	91.2	Very high	117 Å²	117	27.7 Å²	27.7	51%	0.509	13%	0.127	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.6	3.6	179.8	-55.4	178.2	-176	176.7	0	112.8	W290 Y291	W290-K293 WeakPolarHBondContact O-CB 3.24Å; W290-K293 PolarHBondContact O-N 2.89Å; Y291-K293 PolarHBondContact O-N 2.9Å
294	T	86.9	Confident	91.2	Very high	17 Å²	17	27.4 Å²	27.4	10%	0.104	13%	0.125	C	C	.	.	S	Bend	trans	-81.1	166.2	-179	65.2	0	0	0	0	111.6	W290 Y291 D296 I297 C298	W290-T294 HydrophobicContact CE3-CG2 3.98Å; W290-T294 HydrophobicContact CH2-CG2 4.21Å; W290-T294 HydrophobicContact CZ3-CG2 3.68Å; Y291-T294 HydrophobicContact CD2-CG2 3.73Å; Y291-T294 HydrophobicContact CE2-CG2 4.21Å; Y291-T294 HydrophobicContact CG-CG2 4.37Å; Y291-T294 WeakPolarHBondContact O-CB 3.41Å; Y291-T294 WeakPolarHBondContact O-CG2 3.47Å; Y291-T294 PolarHBondContact O-N 2.88Å; Y291-T294 PolarHBondContact O-OG1 3.4Å; T294-D296 PolarHBondContact O-N 3.12Å; T294-I297 PolarHBondContact O-N 2.88Å; T294-C298 WeakPolarHBondContact O-CB 3.38Å; T294-C298 PolarHBondContact O-N 2.91Å; T294-C298 PolarHBondContact O-SG 3.32Å
295	I	84.4	Confident	91.1	Very high	20 Å²	20	29.9 Å²	29.9	10%	0.103	13%	0.134	C	C	.	.	H	α-helix	trans	-62	-33	179.8	-162.1	157.5	0	0	0	112.8	I297 H299 D300 R446	I295-I297 PolarHBondContact O-N 3.23Å; I295-H299 HydrophobicContact CG1-CB 3.91Å; I295-H299 WeakPolarHBondContact O-CA 3.26Å; I295-H299 WeakPolarHBondContact O-CB 3.23Å; I295-H299 PolarHBondContact O-N 3.28Å; I295-D300 PolarHBondContact O-N 3.32Å; I295-R446 HydrophobicContact CD1-CG 4.46Å; I295-R446 VanDerWaalsContact CD1-CZ 3.43Å
296	D	87.8	Confident	91	Very high	18 Å²	18	30.4 Å²	30.4	10%	0.096	14%	0.137	C	C	.	.	H	α-helix	trans	-67.6	-40.4	-176.1	-51.3	-28.7	0	0	0	110.3	K236 Y291 T294 L306 R443	K236-D296 WeakPolarHBondContact CD-O 3.41Å; K236-D296 WeakPolarHBondContact CE-O 3.49Å; K236-D296 PolarHBondContact NZ-O 3.47Å; Y291-D296 PolarHBondContact OH-OD2 3.33Å; T294-D296 PolarHBondContact O-N 3.12Å; D296-L306 HydrophobicContact CB-CD2 4.46Å; D296-R443 VanDerWaalsContact CG-NH2 3.29Å; D296-R443 IonicContact OD1-NH2 3.03Å; D296-R443 PolarHBondContact OD1-NH2 3.31Å; D296-R443 IonicContact OD2-NH2 2.77Å; D296-R443 PolarHBondContact OD2-NH2 3.43Å
297	I	89.4	Confident	91.1	Very high	3 Å²	3	26.1 Å²	26.1	2%	0.015	12%	0.12	C	C	.	.	H	α-helix	trans	-80.4	-47	174.8	-59.9	-63.5	0	0	0	112.1	F225 N226 K236 Y291 L292 T294 I295	F225-I297 WeakPolarHBondContact CZ-O 3.42Å; N226-I297 PolarHBondContact OD1-O 2.96Å; K236-I297 HydrophobicContact CB-CD1 3.49Å; K236-I297 VanDerWaalsContact CB-CD1 3.49Å; K236-I297 HydrophobicContact CD-CD1 3.97Å; K236-I297 HydrophobicContact CG-CD1 4.45Å; K236-I297 PolarHBondContact NZ-O 3.46Å; Y291-I297 HydrophobicContact CD1-CD1 4.25Å; Y291-I297 HydrophobicContact CD1-CG1 3.86Å; Y291-I297 HydrophobicContact CE1-CD1 3.95Å; Y291-I297 HydrophobicContact CE1-CG1 3.81Å; Y291-I297 WeakPolarHBondContact O-CG1 3.36Å; L292-I297 WeakPolarHBondContact O-CG2 3.26Å; T294-I297 PolarHBondContact O-N 2.88Å; I295-I297 PolarHBondContact O-N 3.23Å
298	C	87.4	Confident	91.3	Very high	15 Å²	15	24.2 Å²	24.2	10%	0.101	11%	0.11	C	C	.	.	H	α-helix	trans	-85.7	-15.4	-167.8	-68.6	0	0	0	0	115.3	A133 F225 L292 T294	A133-C298 HydrophobicContact CB-CB 4.4Å; A133-C298 WeakPolarHBondContact CB-SG 3.32Å; F225-C298 WeakPolarHBondContact CZ-O 3.3Å; L292-C298 PolarHBondContact O-SG 3.46Å; T294-C298 WeakPolarHBondContact O-CB 3.38Å; T294-C298 PolarHBondContact O-N 2.91Å; T294-C298 PolarHBondContact O-SG 3.32Å
299	H	84.1	Confident	91.3	Very high	69 Å²	69	24.9 Å²	24.9	32%	0.319	12%	0.116	S	C	.	.	T	Hydrogen-bonded Turn	trans	-142.7	-37.7	-170.1	-58.2	-53.8	0	0	0	115.1	I295 R450	I295-H299 HydrophobicContact CG1-CB 3.91Å; I295-H299 WeakPolarHBondContact O-CA 3.26Å; I295-H299 WeakPolarHBondContact O-CB 3.23Å; I295-H299 PolarHBondContact O-N 3.28Å; H299-R450 VanDerWaalsContact CD2-CZ 3.41Å; H299-R450 PolarHBondContact CD2-NH1 3.46Å; H299-R450 PolarHBondContact CD2-NH2 2.95Å; H299-R450 PolarHBondContact CE1-NH2 3.04Å; H299-R450 VanDerWaalsContact CG-NH2 3.33Å; H299-R450 PolarHBondContact ND1-NH2 3.43Å; H299-R450 VanDerWaalsContact ND1-NH2 3.16Å; H299-R450 PolarHBondContact NE2-NH1 2.87Å; H299-R450 PolarHBondContact NE2-NH2 3.3Å
300	D	89.6	Confident	91.5	Very high	15 Å²	15	24.6 Å²	24.6	8%	0.08	11%	0.114	C	C	.	.			trans	-78.2	150.9	177.8	-67.7	-31.6	0	0	0	110.3	F225 K236 I295 R446	F225-D300 WeakPolarHBondContact CD2-O 3.41Å; F225-D300 VanDerWaalsContact CE2-O 3.25Å; F225-D300 WeakPolarHBondContact CE2-O 3.49Å; K236-D300 WeakPolarHBondContact CE-O 3.29Å; K236-D300 PolarHBondContact NZ-O 2.88Å; I295-D300 PolarHBondContact O-N 3.32Å; D300-R446 IonicContact OD1-CZ 2.84Å; D300-R446 IonicContact OD1-NH1 2.89Å; D300-R446 PolarHBondContact OD1-NH1 3.19Å; D300-R446 IonicContact OD1-NH2 3.52Å; D300-R446 IonicContact OD2-CZ 2.59Å; D300-R446 IonicContact OD2-NH1 3.76Å; D300-R446 PolarHBondContact OD2-NH1 3.43Å; D300-R446 IonicContact OD2-NH2 2.92Å; D300-R446 PolarHBondContact OD2-NH2 2.93Å
301	H	93.6	Very high	91.9	Very high	4 Å²	4	20.8 Å²	20.8	2%	0.019	10%	0.1	C	C	.	.			trans	-93.1	162.3	173.4	-67.2	53	0	0	0	109	W29 M221 G222 V223 F225 G303	W29-H301 AromaticContact CZ3-CE1 3.76Å; W29-H301 AromaticContact CZ3-NE2 3.95Å; M221-H301 CarbonylContact O-C 3.59Å; M221-H301 VanDerWaalsContact O-CB 3.25Å; M221-H301 WeakPolarHBondContact O-CB 3.4Å; G222-H301 WeakPolarHBondContact O-CB 3.25Å; V223-H301 PolarHBondContact O-CD2 3.31Å; V223-H301 VanDerWaalsContact O-CD2 3.32Å; F225-H301 AromaticContact CD2-CE1 3.74Å; F225-H301 AromaticContact CD2-ND1 3.71Å; H301-G303 PolarHBondContact O-N 2.86Å
302	F	95.3	Very high	92.3	Very high	1 Å²	1	19.9 Å²	19.9	0%	0.004	10%	0.096	C	C	.	.			trans	-93.2	105	-179.9	-171	-99.7	0	0	0	110.9	V191 A195 G222 E224 P227 F235 K236 F239 L306	V191-F302 HydrophobicContact CG2-CE1 3.96Å; V191-F302 HydrophobicContact CG2-CZ 4.21Å; A195-F302 HydrophobicContact CB-CD1 3.72Å; A195-F302 HydrophobicContact CB-CE1 4.1Å; G222-F302 VanDerWaalsContact CA-O 3.27Å; G222-F302 WeakPolarHBondContact CA-O 3.43Å; E224-F302 PolarHBondContact O-N 2.87Å; P227-F302 HydrophobicContact CG-CB 3.58Å; P227-F302 HydrophobicContact CG-CD1 3.67Å; P227-F302 HydrophobicContact CG-CG 3.92Å; F235-F302 HydrophobicContact CB-CD1 4.02Å; F235-F302 HydrophobicContact CB-CE1 3.86Å; F235-F302 HydrophobicContact CB-CE2 4.43Å; F235-F302 HydrophobicContact CB-CG 4.38Å; F235-F302 HydrophobicContact CB-CZ 4.05Å; F235-F302 AromaticContact CD1-CE1 3.9Å; F235-F302 HydrophobicContact CD1-CE1 3.9Å; F235-F302 HydrophobicContact CD1-CZ 4.42Å; F235-F302 HydrophobicContact CG-CE1 4.31Å; K236-F302 HydrophobicContact CB-CD2 4.45Å; K236-F302 HydrophobicContact CG-CB 3.94Å; K236-F302 HydrophobicContact CG-CD2 3.68Å; K236-F302 HydrophobicContact CG-CG 4.12Å; F239-F302 HydrophobicContact CB-CZ 4.46Å; F239-F302 AromaticContact CD2-CZ 4Å; F239-F302 HydrophobicContact CD2-CZ 4Å; F239-F302 HydrophobicContact CG-CZ 4.35Å; F302-L306 HydrophobicContact CD2-CB 3.63Å; F302-L306 HydrophobicContact CD2-CD1 4.07Å; F302-L306 HydrophobicContact CE2-CB 3.82Å
303	G	95.9	Very high	92.5	Very high	2 Å²	2	21.4 Å²	21.4	2%	0.021	10%	0.102	C	C	.	.	S	Bend	trans	-132.4	-160.7	173.3	0	0	0	0	0	111.1	M220 G222 H301 Y305 L306 G307	M220-G303 CarbonylContact O-C 3.59Å; G222-G303 VanDerWaalsContact CA-CA 3.44Å; H301-G303 PolarHBondContact O-N 2.86Å; G303-Y305 PolarHBondContact O-N 3.02Å; G303-L306 PolarHBondContact O-N 3.25Å; G303-G307 PolarHBondContact O-N 2.97Å
304	W	97.1	Very high	92.9	Very high	6 Å²	6	16.4 Å²	16.4	2%	0.023	8%	0.081	C	C	.	.	H	α-helix	trans	-56.3	-36.3	-179.5	-176.2	96.1	0	0	0	113.8	L47 A50 P51 Y189 S192 Y219 M220 L306 G307 W308	L47-W304 HydrophobicContact CD2-CB 4.28Å; L47-W304 HydrophobicContact CD2-CD2 3.49Å; L47-W304 VanDerWaalsContact CD2-CD2 3.49Å; L47-W304 HydrophobicContact CD2-CE3 3.64Å; L47-W304 HydrophobicContact CD2-CG 3.81Å; L47-W304 HydrophobicContact CD2-CH2 4.34Å; L47-W304 HydrophobicContact CD2-CZ2 4.27Å; L47-W304 HydrophobicContact CD2-CZ3 4.06Å; A50-W304 HydrophobicContact CB-CH2 3.98Å; P51-W304 HydrophobicContact CG-CZ2 4.06Å; Y189-W304 AromaticContact CD1-CD1 3.79Å; Y189-W304 AromaticContact CD1-NE1 3.53Å; Y189-W304 AromaticContact CE1-CD1 3.75Å; Y189-W304 AromaticContact CE1-NE1 3.11Å; Y189-W304 AromaticContact CZ-NE1 3.49Å; S192-W304 VanDerWaalsContact OG-CA 3.27Å; S192-W304 WeakPolarHBondContact OG-CA 3.33Å; Y219-W304 HydrophobicContact CD1-CB 3.93Å; Y219-W304 HydrophobicContact CD1-CG 4.38Å; Y219-W304 HydrophobicContact CE1-CB 3.72Å; Y219-W304 AromaticContact CE1-CD1 3.58Å; Y219-W304 AromaticContact CE1-CG 3.82Å; Y219-W304 HydrophobicContact CE1-CG 3.82Å; Y219-W304 PolarHBondContact O-N 3.38Å; M220-W304 HydrophobicContact CE-CE3 4.09Å; M220-W304 HydrophobicContact CE-CZ3 4.01Å; M220-W304 PolarHBondContact O-N 2.76Å; M220-W304 VanDerWaalsContact O-N 3.14Å; M220-W304 HydrophobicContact SD-CD2 4.4Å; M220-W304 HydrophobicContact SD-CE3 3.36Å; M220-W304 HydrophobicContact SD-CZ3 3.74Å; W304-L306 VanDerWaalsContact C-N 3.34Å; W304-L306 PolarHBondContact O-N 3.43Å; W304-G307 PolarHBondContact O-N 2.98Å; W304-W308 HydrophobicContact CD2-CB 3.82Å; W304-W308 HydrophobicContact CD2-CG 4.3Å; W304-W308 AromaticContact CE2-CD2 3.93Å; W304-W308 AromaticContact CE2-CG 3.55Å; W304-W308 HydrophobicContact CE3-CB 4.5Å; W304-W308 HydrophobicContact CG-CB 4.03Å; W304-W308 AromaticContact CH2-CD2 3.95Å; W304-W308 HydrophobicContact CH2-CD2 3.95Å; W304-W308 AromaticContact CH2-CE3 3.67Å; W304-W308 HydrophobicContact CH2-CE3 3.67Å; W304-W308 HydrophobicContact CH2-CG 4.44Å; W304-W308 HydrophobicContact CH2-CZ3 4.08Å; W304-W308 HydrophobicContact CZ2-CB 4.09Å; W304-W308 AromaticContact CZ2-CD2 3.5Å; W304-W308 HydrophobicContact CZ2-CD2 3.5Å; W304-W308 AromaticContact CZ2-CE3 3.74Å; W304-W308 HydrophobicContact CZ2-CE3 3.74Å; W304-W308 AromaticContact CZ2-CG 3.65Å; W304-W308 HydrophobicContact CZ2-CG 3.65Å; W304-W308 HydrophobicContact CZ2-CZ3 4.41Å; W304-W308 HydrophobicContact CZ3-CE3 4.17Å; W304-W308 AromaticContact NE1-CD1 3.78Å; W304-W308 AromaticContact NE1-CG 3.6Å; W304-W308 VanDerWaalsContact O-CB 3.26Å; W304-W308 WeakPolarHBondContact O-CB 3.48Å; W304-W308 PolarHBondContact O-N 3.4Å
305	Y	93.7	Very high	93.4	Very high	84 Å²	84	16 Å²	16	33%	0.329	8%	0.078	S	C	.	.	H	α-helix	trans	-53.1	-47.7	177	171.2	-108	0	0	0	113	M220 G303 G309	M220-Y305 HydrophobicContact CE-CD2 4.13Å; M220-Y305 WeakPolarHBondContact O-CB 3.34Å; M220-Y305 PolarHBondContact O-N 3.4Å; G303-Y305 PolarHBondContact O-N 3.02Å; Y305-G309 WeakPolarHBondContact O-CA 2.99Å; Y305-G309 PolarHBondContact O-N 3.44Å
306	L	94.1	Very high	94	Very high	11 Å²	11	15.3 Å²	15.3	6%	0.058	8%	0.075	C	C	.	.	H	α-helix	trans	-82.9	-47.3	177.5	-67.7	-179.8	0	0	0	111.4	K236 D296 F302 G303 W304 G309 D310	K236-L306 HydrophobicContact CD-CD1 4.36Å; K236-L306 HydrophobicContact CG-CD1 4.43Å; D296-L306 HydrophobicContact CB-CD2 4.46Å; F302-L306 HydrophobicContact CD2-CB 3.63Å; F302-L306 HydrophobicContact CD2-CD1 4.07Å; F302-L306 HydrophobicContact CE2-CB 3.82Å; G303-L306 PolarHBondContact O-N 3.25Å; W304-L306 VanDerWaalsContact C-N 3.34Å; W304-L306 PolarHBondContact O-N 3.43Å; L306-G309 PolarHBondContact O-N 3.32Å; L306-D310 VanDerWaalsContact O-CB 3.29Å; L306-D310 WeakPolarHBondContact O-CB 3.42Å; L306-D310 VanDerWaalsContact O-CG 3.27Å; L306-D310 PolarHBondContact O-N 3.34Å
307	G	95.7	Very high	94.5	Very high	0 Å²	0	14.5 Å²	14.5	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-61.1	-50.2	-175.4	0	0	0	0	0	113.6	G303 W304 C311	G303-G307 PolarHBondContact O-N 2.97Å; W304-G307 PolarHBondContact O-N 2.98Å; G307-C311 WeakPolarHBondContact O-CB 3.37Å; G307-C311 PolarHBondContact O-N 2.88Å; G307-C311 PolarHBondContact O-SG 2.93Å
308	W	97.5	Very high	94.9	Very high	6 Å²	6	15.7 Å²	15.7	2%	0.023	8%	0.075	C	C	.	.	H	α-helix	trans	-75.7	-37.5	176.4	-178.1	91.7	0	0	0	111.9	A50 P51 V54 N185 W304 D310 C311 V312 W313	A50-W308 HydrophobicContact CB-CH2 3.81Å; A50-W308 HydrophobicContact CB-CZ3 3.78Å; P51-W308 HydrophobicContact CB-CZ2 4.07Å; P51-W308 HydrophobicContact CG-CZ2 4.01Å; V54-W308 HydrophobicContact CG2-CH2 3.66Å; V54-W308 HydrophobicContact CG2-CZ2 4.08Å; N185-W308 PolarHBondContact OD1-NE1 3.39Å; W304-W308 HydrophobicContact CD2-CB 3.82Å; W304-W308 HydrophobicContact CD2-CG 4.3Å; W304-W308 AromaticContact CE2-CD2 3.93Å; W304-W308 AromaticContact CE2-CG 3.55Å; W304-W308 HydrophobicContact CE3-CB 4.5Å; W304-W308 HydrophobicContact CG-CB 4.03Å; W304-W308 AromaticContact CH2-CD2 3.95Å; W304-W308 HydrophobicContact CH2-CD2 3.95Å; W304-W308 AromaticContact CH2-CE3 3.67Å; W304-W308 HydrophobicContact CH2-CE3 3.67Å; W304-W308 HydrophobicContact CH2-CG 4.44Å; W304-W308 HydrophobicContact CH2-CZ3 4.08Å; W304-W308 HydrophobicContact CZ2-CB 4.09Å; W304-W308 AromaticContact CZ2-CD2 3.5Å; W304-W308 HydrophobicContact CZ2-CD2 3.5Å; W304-W308 AromaticContact CZ2-CE3 3.74Å; W304-W308 HydrophobicContact CZ2-CE3 3.74Å; W304-W308 AromaticContact CZ2-CG 3.65Å; W304-W308 HydrophobicContact CZ2-CG 3.65Å; W304-W308 HydrophobicContact CZ2-CZ3 4.41Å; W304-W308 HydrophobicContact CZ3-CE3 4.17Å; W304-W308 AromaticContact NE1-CD1 3.78Å; W304-W308 AromaticContact NE1-CG 3.6Å; W304-W308 VanDerWaalsContact O-CB 3.26Å; W304-W308 WeakPolarHBondContact O-CB 3.48Å; W304-W308 PolarHBondContact O-N 3.4Å; W308-D310 PolarHBondContact O-N 2.6Å; W308-C311 PolarHBondContact O-N 3.28Å; W308-V312 HydrophobicContact CD2-CB 4.12Å; W308-V312 HydrophobicContact CD2-CG2 4.42Å; W308-V312 HydrophobicContact CG-CB 4.48Å; W308-V312 HydrophobicContact CG-CG2 4.3Å; W308-V312 HydrophobicContact CH2-CG1 4.3Å; W308-V312 HydrophobicContact CZ2-CB 3.84Å; W308-V312 HydrophobicContact CZ2-CG1 3.56Å; W308-V312 WeakPolarHBondContact O-CB 3.42Å; W308-V312 PolarHBondContact O-N 2.95Å; W308-W313 HydrophobicContact CE3-CB 4.47Å; W308-W313 HydrophobicContact CH2-CB 4.47Å; W308-W313 AromaticContact CH2-CE3 3.88Å; W308-W313 HydrophobicContact CH2-CE3 3.88Å; W308-W313 HydrophobicContact CZ3-CB 3.94Å; W308-W313 HydrophobicContact CZ3-CD2 4.45Å; W308-W313 AromaticContact CZ3-CE3 3.75Å; W308-W313 HydrophobicContact CZ3-CE3 3.75Å
309	G	96.1	Very high	95.4	Very high	13 Å²	13	15 Å²	15	13%	0.134	7%	0.07	C	C	.	.	I	π-helix	trans	-57.4	-47.6	177.2	0	0	0	0	0	112.9	Y305 L306 W313 L314	Y305-G309 WeakPolarHBondContact O-CA 2.99Å; Y305-G309 PolarHBondContact O-N 3.44Å; L306-G309 PolarHBondContact O-N 3.32Å; G309-W313 WeakPolarHBondContact O-CB 3.4Å; G309-W313 PolarHBondContact O-N 2.92Å; G309-W313 VanDerWaalsContact O-N 3.12Å; G309-L314 PolarHBondContact O-N 2.72Å
310	D	95.8	Very high	96.1	Very high	12 Å²	12	11.7 Å²	11.7	6%	0.064	6%	0.055	C	C	.	.	I	π-helix	trans	-70.3	-33.3	179.5	-71	-35.6	0	0	0	112.6	F239 N240 G244 L306 W308 P315	F239-D310 HydrophobicContact CB-CB 4.09Å; N240-D310 VanDerWaalsContact CA-CG 3.43Å; N240-D310 WeakPolarHBondContact CA-OD2 3.45Å; N240-D310 PolarHBondContact N-OD2 3.42Å; N240-D310 PolarHBondContact ND2-OD1 2.88Å; G244-D310 WeakPolarHBondContact CA-O 3.44Å; L306-D310 VanDerWaalsContact O-CB 3.29Å; L306-D310 WeakPolarHBondContact O-CB 3.42Å; L306-D310 VanDerWaalsContact O-CG 3.27Å; L306-D310 PolarHBondContact O-N 3.34Å; W308-D310 PolarHBondContact O-N 2.6Å; D310-P315 WeakPolarHBondContact O-CD 3.49Å
311	C	96.6	Very high	96.5	Very high	2 Å²	2	11 Å²	11	1%	0.014	5%	0.051	C	C	.	.	I	π-helix	trans	-80	-36	-179.7	-68.4	0	0	0	0	113.8	F239 G307 W308	F239-C311 WeakPolarHBondContact CD1-SG 3.45Å; G307-C311 WeakPolarHBondContact O-CB 3.37Å; G307-C311 PolarHBondContact O-N 2.88Å; G307-C311 PolarHBondContact O-SG 2.93Å; W308-C311 PolarHBondContact O-N 3.28Å
312	V	97.5	Very high	96.7	Very high	0 Å²	0	10.8 Å²	10.8	0%	0	5%	0.05	C	C	.	.	I	π-helix	trans	-122.1	-57.2	-166.6	-173.8	0	0	0	0	111.4	V54 L181 A184 W308 L314 P315 Y316	V54-V312 HydrophobicContact CB-CG1 4.45Å; V54-V312 HydrophobicContact CG1-CG1 4.01Å; V54-V312 HydrophobicContact CG2-CG1 4.32Å; L181-V312 HydrophobicContact CD1-CG1 3.86Å; A184-V312 VanDerWaalsContact C-CG2 3.47Å; A184-V312 HydrophobicContact CB-CG2 3.96Å; A184-V312 WeakPolarHBondContact O-CG2 3.28Å; W308-V312 HydrophobicContact CD2-CB 4.12Å; W308-V312 HydrophobicContact CD2-CG2 4.42Å; W308-V312 HydrophobicContact CG-CB 4.48Å; W308-V312 HydrophobicContact CG-CG2 4.3Å; W308-V312 HydrophobicContact CH2-CG1 4.3Å; W308-V312 HydrophobicContact CZ2-CB 3.84Å; W308-V312 HydrophobicContact CZ2-CG1 3.56Å; W308-V312 WeakPolarHBondContact O-CB 3.42Å; W308-V312 PolarHBondContact O-N 2.95Å; V312-L314 PolarHBondContact O-N 3.03Å; V312-P315 WeakPolarHBondContact O-CD 3.08Å; V312-Y316 HydrophobicContact CG1-CD2 4.34Å; V312-Y316 WeakPolarHBondContact O-CB 3.38Å; V312-Y316 VanDerWaalsContact O-CD2 3.22Å; V312-Y316 WeakPolarHBondContact O-CD2 3.27Å; V312-Y316 PolarHBondContact O-N 3.1Å
313	W	97.4	Very high	96.9	Very high	34 Å²	34	10.8 Å²	10.8	13%	0.129	5%	0.05	C	C	.	.	I	π-helix	trans	-60	-50.2	-174.1	-173.6	-86.7	0	0	0	111.9	A50 I53 V54 W308 G309 L317 F431 Y435	A50-W313 HydrophobicContact CB-CZ3 4.2Å; I53-W313 HydrophobicContact CG2-CH2 4.5Å; I53-W313 HydrophobicContact CG2-CZ3 4.38Å; V54-W313 HydrophobicContact CG2-CE3 3.99Å; V54-W313 HydrophobicContact CG2-CZ3 4.43Å; W308-W313 HydrophobicContact CE3-CB 4.47Å; W308-W313 HydrophobicContact CH2-CB 4.47Å; W308-W313 AromaticContact CH2-CE3 3.88Å; W308-W313 HydrophobicContact CH2-CE3 3.88Å; W308-W313 HydrophobicContact CZ3-CB 3.94Å; W308-W313 HydrophobicContact CZ3-CD2 4.45Å; W308-W313 AromaticContact CZ3-CE3 3.75Å; W308-W313 HydrophobicContact CZ3-CE3 3.75Å; G309-W313 WeakPolarHBondContact O-CB 3.4Å; G309-W313 PolarHBondContact O-N 2.92Å; G309-W313 VanDerWaalsContact O-N 3.12Å; W313-L317 HydrophobicContact CD2-CD1 3.4Å; W313-L317 VanDerWaalsContact CD2-CD1 3.4Å; W313-L317 HydrophobicContact CD2-CG 4.38Å; W313-L317 VanDerWaalsContact CE2-CD1 3.45Å; W313-L317 HydrophobicContact CE3-CD1 3.42Å; W313-L317 VanDerWaalsContact CE3-CD1 3.42Å; W313-L317 HydrophobicContact CG-CD1 4.11Å; W313-L317 HydrophobicContact CH2-CD1 3.6Å; W313-L317 HydrophobicContact CZ2-CD1 3.57Å; W313-L317 HydrophobicContact CZ3-CD1 3.52Å; W313-L317 VanDerWaalsContact O-CB 3.27Å; W313-L317 WeakPolarHBondContact O-CB 3.22Å; W313-L317 PolarHBondContact O-N 3.19Å; W313-F431 AromaticContact CH2-CZ 3.79Å; W313-F431 HydrophobicContact CH2-CZ 3.79Å; W313-F431 HydrophobicContact CZ2-CE1 4.09Å; W313-F431 AromaticContact CZ2-CZ 3.61Å; W313-F431 HydrophobicContact CZ2-CZ 3.61Å; W313-Y435 AromaticContact CE2-CE2 3.73Å; W313-Y435 AromaticContact CE2-CZ 3.97Å; W313-Y435 AromaticContact CZ2-CD2 3.6Å; W313-Y435 HydrophobicContact CZ2-CD2 3.6Å; W313-Y435 AromaticContact CZ2-CE2 3.58Å; W313-Y435 HydrophobicContact CZ2-CE2 3.58Å; W313-Y435 HydrophobicContact CZ2-CG 4.28Å; W313-Y435 AromaticContact NE1-CE1 3.57Å; W313-Y435 AromaticContact NE1-CE2 3.45Å; W313-Y435 AromaticContact NE1-CZ 3.2Å; W313-Y435 PolarHBondContact NE1-OH 3.17Å
314	L	96	Very high	97	Very high	13 Å²	13	11.1 Å²	11.1	7%	0.068	5%	0.051	C	C	.	.	H	α-helix	trans	-62.9	-58.2	-178.1	-176.9	166.4	0	0	0	111.4	I245 W248 G309 V312 Y316 Y318	I245-L314 HydrophobicContact CD1-CD1 4.49Å; I245-L314 HydrophobicContact CG1-CD1 3.77Å; I245-L314 HydrophobicContact CG1-CD2 4.44Å; W248-L314 HydrophobicContact CB-CD2 4.41Å; G309-L314 PolarHBondContact O-N 2.72Å; V312-L314 PolarHBondContact O-N 3.03Å; L314-Y316 VanDerWaalsContact C-N 3.3Å; L314-Y316 PolarHBondContact O-N 3.41Å; L314-Y318 HydrophobicContact CD2-CD2 4.48Å; L314-Y318 HydrophobicContact CG-CD2 3.92Å; L314-Y318 HydrophobicContact CG-CE2 4.11Å; L314-Y318 HydrophobicContact CG-CG 4.18Å; L314-Y318 WeakPolarHBondContact O-CB 3.38Å; L314-Y318 PolarHBondContact O-N 3.04Å
315	P	96.4	Very high	97.1	Very high	7 Å²	7	10.9 Å²	10.9	5%	0.045	5%	0.05	C	C	.	.	H	α-helix	trans	-64.7	-31.4	-174.1	-24.3	37.1	0	0	0	113.9	I251 D310 V312 T319	I251-P315 HydrophobicContact CD1-CB 3.72Å; D310-P315 WeakPolarHBondContact O-CD 3.49Å; V312-P315 WeakPolarHBondContact O-CD 3.08Å; P315-T319 WeakPolarHBondContact O-CB 3.46Å; P315-T319 WeakPolarHBondContact O-CG2 3.19Å; P315-T319 PolarHBondContact O-OG1 3.4Å
316	Y	97.8	Very high	97.3	Very high	7 Å²	7	6.9 Å²	6.9	3%	0.027	3%	0.034	C	C	.	.	H	α-helix	trans	-92	-35.4	-174.6	-72	-95.9	0	0	0	113.8	V54 I58 W177 L180 L181 A184 V312 L314	V54-Y316 HydrophobicContact CG1-CG 4.2Å; I58-Y316 HydrophobicContact CD1-CD1 4.08Å; I58-Y316 HydrophobicContact CG1-CD1 4.07Å; W177-Y316 HydrophobicContact CD2-CD1 4.27Å; W177-Y316 AromaticContact CD2-CE1 3.77Å; W177-Y316 HydrophobicContact CD2-CE1 3.77Å; W177-Y316 AromaticContact CE2-CD1 3.52Å; W177-Y316 AromaticContact CE2-CE1 3.51Å; W177-Y316 AromaticContact CE3-CE1 3.93Å; W177-Y316 HydrophobicContact CE3-CE1 3.93Å; W177-Y316 AromaticContact CH2-CD1 3.62Å; W177-Y316 HydrophobicContact CH2-CD1 3.62Å; W177-Y316 HydrophobicContact CH2-CD2 4.39Å; W177-Y316 AromaticContact CH2-CE1 3.61Å; W177-Y316 HydrophobicContact CH2-CE1 3.61Å; W177-Y316 HydrophobicContact CH2-CE2 4.4Å; W177-Y316 HydrophobicContact CH2-CG 4.01Å; W177-Y316 AromaticContact CH2-CZ 3.99Å; W177-Y316 AromaticContact CZ2-CD1 3.19Å; W177-Y316 HydrophobicContact CZ2-CD1 3.19Å; W177-Y316 AromaticContact CZ2-CE1 3.47Å; W177-Y316 HydrophobicContact CZ2-CE1 3.47Å; W177-Y316 VanDerWaalsContact CZ2-CE1 3.47Å; W177-Y316 AromaticContact CZ2-CG 3.84Å; W177-Y316 HydrophobicContact CZ2-CG 3.84Å; W177-Y316 HydrophobicContact CZ3-CD1 4.32Å; W177-Y316 AromaticContact CZ3-CE1 3.83Å; W177-Y316 HydrophobicContact CZ3-CE1 3.83Å; W177-Y316 AromaticContact CZ3-CZ 3.99Å; L180-Y316 WeakPolarHBondContact CB-OH 3.47Å; L180-Y316 PolarHBondContact O-OH 3.45Å; L181-Y316 VanDerWaalsContact CA-CZ 3.46Å; L181-Y316 WeakPolarHBondContact CA-OH 3.29Å; L181-Y316 HydrophobicContact CB-CD1 4.33Å; L181-Y316 HydrophobicContact CB-CE1 3.59Å; L181-Y316 HydrophobicContact CD1-CD1 3.72Å; L181-Y316 HydrophobicContact CD1-CD2 4.01Å; L181-Y316 HydrophobicContact CD1-CE1 3.74Å; L181-Y316 HydrophobicContact CD1-CE2 4.02Å; L181-Y316 HydrophobicContact CD1-CG 3.89Å; L181-Y316 HydrophobicContact CG-CD1 4.47Å; L181-Y316 HydrophobicContact CG-CE1 4.18Å; L181-Y316 PolarHBondContact N-OH 3.27Å; A184-Y316 HydrophobicContact CB-CE2 3.88Å; V312-Y316 HydrophobicContact CG1-CD2 4.34Å; V312-Y316 WeakPolarHBondContact O-CB 3.38Å; V312-Y316 VanDerWaalsContact O-CD2 3.22Å; V312-Y316 WeakPolarHBondContact O-CD2 3.27Å; V312-Y316 PolarHBondContact O-N 3.1Å; L314-Y316 VanDerWaalsContact C-N 3.3Å; L314-Y316 PolarHBondContact O-N 3.41Å
317	L	97.6	Very high	97.5	Very high	0 Å²	0	9.7 Å²	9.7	0%	0	4%	0.044	C	C	.	.	H	α-helix	trans	-93	-24.8	-178.2	-56.7	-172.8	0	0	0	113.3	V54 F57 W313 T319 L320 F431	V54-L317 HydrophobicContact CG1-CD2 4.43Å; V54-L317 HydrophobicContact CG2-CD1 3.95Å; V54-L317 HydrophobicContact CG2-CD2 4.18Å; V54-L317 HydrophobicContact CG2-CG 4.04Å; F57-L317 HydrophobicContact CB-CD2 4.23Å; F57-L317 HydrophobicContact CD1-CD2 4.49Å; F57-L317 HydrophobicContact CG-CD2 4.37Å; W313-L317 HydrophobicContact CD2-CD1 3.4Å; W313-L317 VanDerWaalsContact CD2-CD1 3.4Å; W313-L317 HydrophobicContact CD2-CG 4.38Å; W313-L317 VanDerWaalsContact CE2-CD1 3.45Å; W313-L317 HydrophobicContact CE3-CD1 3.42Å; W313-L317 VanDerWaalsContact CE3-CD1 3.42Å; W313-L317 HydrophobicContact CG-CD1 4.11Å; W313-L317 HydrophobicContact CH2-CD1 3.6Å; W313-L317 HydrophobicContact CZ2-CD1 3.57Å; W313-L317 HydrophobicContact CZ3-CD1 3.52Å; W313-L317 VanDerWaalsContact O-CB 3.27Å; W313-L317 WeakPolarHBondContact O-CB 3.22Å; W313-L317 PolarHBondContact O-N 3.19Å; L317-T319 VanDerWaalsContact C-N 3.29Å; L317-L320 HydrophobicContact CB-CD1 4.33Å; L317-L320 HydrophobicContact CD2-CD1 4.02Å; L317-L320 HydrophobicContact CD2-CD2 4.47Å; L317-L320 HydrophobicContact CD2-CG 4.44Å; L317-L320 WeakPolarHBondContact O-CD1 3.46Å; L317-L320 WeakPolarHBondContact O-CG 3.29Å; L317-F431 HydrophobicContact CB-CD1 4.38Å; L317-F431 HydrophobicContact CB-CE1 3.91Å; L317-F431 HydrophobicContact CD1-CD1 4.49Å; L317-F431 HydrophobicContact CD1-CE1 3.5Å; L317-F431 VanDerWaalsContact CD1-CE1 3.5Å; L317-F431 HydrophobicContact CD1-CZ 3.79Å; L317-F431 HydrophobicContact CG-CE1 4.19Å
318	Y	97.6	Very high	97.6	Very high	29 Å²	29	11.8 Å²	11.8	11%	0.114	5%	0.054	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-15.1	178.5	-70.1	28.4	0	0	0	112.3	W248 Q277 L314 Q321 Y432 Y435	W248-Y318 HydrophobicContact CD2-CD2 4.5Å; W248-Y318 HydrophobicContact CE3-CD2 4.19Å; W248-Y318 AromaticContact CH2-CD2 3.79Å; W248-Y318 HydrophobicContact CH2-CD2 3.79Å; W248-Y318 HydrophobicContact CZ2-CD2 4.09Å; W248-Y318 AromaticContact CZ3-CD2 3.84Å; W248-Y318 HydrophobicContact CZ3-CD2 3.84Å; W248-Y318 HydrophobicContact CZ3-CE2 4.47Å; W248-Y318 PolarHBondContact NE1-O 3.43Å; Q277-Y318 PolarHBondContact NE2-O 3.08Å; L314-Y318 HydrophobicContact CD2-CD2 4.48Å; L314-Y318 HydrophobicContact CG-CD2 3.92Å; L314-Y318 HydrophobicContact CG-CE2 4.11Å; L314-Y318 HydrophobicContact CG-CG 4.18Å; L314-Y318 WeakPolarHBondContact O-CB 3.38Å; L314-Y318 PolarHBondContact O-N 3.04Å; Y318-Q321 PolarHBondContact O-OE1 2.82Å; Y318-Q321 VanDerWaalsContact O-OE1 3.09Å; Y318-Y432 HydrophobicContact CD1-CD2 4.07Å; Y318-Y432 AromaticContact CD1-CE2 3.65Å; Y318-Y432 HydrophobicContact CD1-CE2 3.65Å; Y318-Y432 AromaticContact CD2-CE2 3.6Å; Y318-Y432 HydrophobicContact CD2-CE2 3.6Å; Y318-Y432 HydrophobicContact CE1-CD2 4.49Å; Y318-Y432 AromaticContact CE1-CE2 3.93Å; Y318-Y432 HydrophobicContact CE1-CE2 3.93Å; Y318-Y432 AromaticContact CE2-CE2 3.89Å; Y318-Y432 HydrophobicContact CE2-CE2 3.89Å; Y318-Y432 HydrophobicContact CG-CD2 4.16Å; Y318-Y432 AromaticContact CG-CE2 3.46Å; Y318-Y432 HydrophobicContact CG-CE2 3.46Å; Y318-Y432 VanDerWaalsContact CG-CE2 3.46Å; Y318-Y435 HydrophobicContact CE1-CD1 4.27Å; Y318-Y435 AromaticContact CE1-CE1 3.76Å; Y318-Y435 HydrophobicContact CE1-CE1 3.76Å; Y318-Y435 WeakPolarHBondContact OH-CE1 3.28Å
319	T	98.3	Very high	97.5	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	7%	0.07	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.6	5.8	180	59.1	0	0	0	0	113	W248 I251 P315 L317 Q321 G322 L323	W248-T319 HydrophobicContact CG-CG2 4.32Å; I251-T319 HydrophobicContact CB-CG2 4.02Å; I251-T319 HydrophobicContact CD1-CG2 4.39Å; I251-T319 HydrophobicContact CG2-CG2 3.7Å; P315-T319 WeakPolarHBondContact O-CB 3.46Å; P315-T319 WeakPolarHBondContact O-CG2 3.19Å; P315-T319 PolarHBondContact O-OG1 3.4Å; L317-T319 VanDerWaalsContact C-N 3.29Å; T319-Q321 PolarHBondContact O-N 2.97Å; T319-Q321 VanDerWaalsContact O-N 3.15Å; T319-G322 PolarHBondContact O-N 2.9Å; T319-L323 PolarHBondContact O-N 3.2Å
320	L	98.4	Very high	97.6	Very high	0 Å²	0	15 Å²	15	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-57.2	-32.6	-177.2	-73.9	172.7	0	0	0	113.3	F57 I58 L317 L323 Y324 L428 F431	F57-L320 HydrophobicContact CB-CD2 4.34Å; F57-L320 HydrophobicContact CD1-CD1 3.59Å; F57-L320 HydrophobicContact CD1-CD2 4.26Å; F57-L320 HydrophobicContact CE1-CD1 4.06Å; I58-L320 HydrophobicContact CD1-CD2 4.34Å; L317-L320 HydrophobicContact CB-CD1 4.33Å; L317-L320 HydrophobicContact CD2-CD1 4.02Å; L317-L320 HydrophobicContact CD2-CD2 4.47Å; L317-L320 HydrophobicContact CD2-CG 4.44Å; L317-L320 WeakPolarHBondContact O-CD1 3.46Å; L317-L320 WeakPolarHBondContact O-CG 3.29Å; L320-L323 HydrophobicContact CD2-CD2 4.41Å; L320-L323 PolarHBondContact O-N 2.87Å; L320-Y324 WeakPolarHBondContact O-CB 3.49Å; L320-Y324 PolarHBondContact O-N 2.77Å; L320-L428 HydrophobicContact CB-CD2 3.93Å; L320-L428 HydrophobicContact CD2-CD2 4.05Å; L320-L428 HydrophobicContact CD2-CG 4.44Å; L320-L428 HydrophobicContact CG-CD2 4.39Å; L320-F431 HydrophobicContact CD1-CB 4.31Å; L320-F431 HydrophobicContact CD1-CD1 3.9Å; L320-F431 HydrophobicContact CD1-CG 4.4Å
321	Q	98.6	Very high	97.7	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-64.1	-46.5	176.7	-61	83	-0.7	0	0	110.7	V273 Y318 T319 Y324 L325 C422 P429	V273-Q321 HydrophobicContact CG1-CB 3.87Å; V273-Q321 HydrophobicContact CG2-CB 4.09Å; Y318-Q321 PolarHBondContact O-OE1 2.82Å; Y318-Q321 VanDerWaalsContact O-OE1 3.09Å; T319-Q321 PolarHBondContact O-N 2.97Å; T319-Q321 VanDerWaalsContact O-N 3.15Å; Q321-Y324 PolarHBondContact O-N 3.37Å; Q321-L325 WeakPolarHBondContact O-CB 3.49Å; Q321-L325 WeakPolarHBondContact O-CG 3.28Å; Q321-L325 PolarHBondContact O-N 3.41Å; Q321-C422 VanDerWaalsContact CB-SG 3.54Å; Q321-P429 HydrophobicContact CG-CB 4.25Å; Q321-P429 PolarHBondContact NE2-O 3.37Å
322	G	98.4	Very high	97.7	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-63	-46.3	174.7	0	0	0	0	0	111.1	M270 T319 Y324 L325 V326	M270-G322 WeakPolarHBondContact CE-O 3.38Å; T319-G322 PolarHBondContact O-N 2.9Å; G322-Y324 PolarHBondContact O-N 2.91Å; G322-L325 PolarHBondContact O-N 2.85Å; G322-V326 WeakPolarHBondContact O-CG2 3.21Å; G322-V326 PolarHBondContact O-N 3.32Å
323	L	98.5	Very high	97.8	Very high	1 Å²	1	23.9 Å²	23.9	1%	0.005	12%	0.121	C	C	.	.	H	α-helix	trans	-57.8	-49.1	177.7	-177.5	63.1	0	0	0	111.3	I58 C61 F174 F255 T319 L320 L325 V326 Y327	I58-L323 HydrophobicContact CD1-CD2 3.75Å; C61-L323 HydrophobicContact CB-CD2 3.87Å; C61-L323 HydrophobicContact CB-CG 4.22Å; F174-L323 HydrophobicContact CD2-CD1 4.29Å; F174-L323 HydrophobicContact CE2-CD1 3.84Å; F255-L323 HydrophobicContact CD2-CB 4.31Å; F255-L323 HydrophobicContact CE1-CD1 4.25Å; F255-L323 HydrophobicContact CE2-CB 3.68Å; F255-L323 HydrophobicContact CE2-CD1 4.39Å; F255-L323 HydrophobicContact CZ-CB 4.04Å; F255-L323 HydrophobicContact CZ-CD1 3.93Å; T319-L323 PolarHBondContact O-N 3.2Å; L320-L323 HydrophobicContact CD2-CD2 4.41Å; L320-L323 PolarHBondContact O-N 2.87Å; L323-L325 VanDerWaalsContact C-N 3.3Å; L323-L325 PolarHBondContact O-N 3.13Å; L323-V326 WeakPolarHBondContact O-CB 3.25Å; L323-V326 PolarHBondContact O-N 3.05Å; L323-V326 VanDerWaalsContact O-N 3.15Å; L323-Y327 HydrophobicContact CD1-CE2 3.85Å; L323-Y327 HydrophobicContact CG-CE2 4.28Å; L323-Y327 WeakPolarHBondContact O-CD2 3.24Å
324	Y	98.6	Very high	97.8	Very high	9 Å²	9	27.4 Å²	27.4	4%	0.035	15%	0.146	C	C	.	.	H	α-helix	trans	-54.5	-46.1	176.7	173.7	-101.4	0	0	0	111.8	C66 L320 Q321 G322 V326 Y327 H328 V330 C422 H426 P429	C66-Y324 HydrophobicContact CB-CD2 3.62Å; C66-Y324 HydrophobicContact CB-CE2 4.15Å; L320-Y324 WeakPolarHBondContact O-CB 3.49Å; L320-Y324 PolarHBondContact O-N 2.77Å; Q321-Y324 PolarHBondContact O-N 3.37Å; G322-Y324 PolarHBondContact O-N 2.91Å; Y324-V326 VanDerWaalsContact C-N 3.26Å; Y324-V326 PolarHBondContact O-N 3.22Å; Y324-Y327 PolarHBondContact O-N 3.39Å; Y324-Y327 VanDerWaalsContact O-N 3.17Å; Y324-H328 HydrophobicContact CD1-CB 4.34Å; Y324-H328 AromaticContact CD2-CD2 3.6Å; Y324-H328 HydrophobicContact CE1-CB 3.8Å; Y324-H328 HydrophobicContact CE2-CB 3.99Å; Y324-H328 AromaticContact CE2-CD2 3.15Å; Y324-H328 WeakPolarHBondContact CE2-CD2 3.32Å; Y324-H328 AromaticContact CE2-CG 3.56Å; Y324-H328 AromaticContact CE2-NE2 3.7Å; Y324-H328 AromaticContact CZ-CD2 3.67Å; Y324-H328 AromaticContact CZ-CG 3.55Å; Y324-H328 PolarHBondContact O-N 3.35Å; Y324-V330 HydrophobicContact CE1-CG2 4.2Å; Y324-C422 HydrophobicContact CD1-CB 3.65Å; Y324-C422 HydrophobicContact CE1-CB 3.8Å; Y324-C422 WeakPolarHBondContact CE1-O 3.25Å; Y324-H426 HydrophobicContact CD2-CB 4.42Å; Y324-H426 HydrophobicContact CE2-CB 3.7Å; Y324-H426 AromaticContact CE2-CG 3.53Å; Y324-H426 AromaticContact CE2-ND1 3.45Å; Y324-H426 WeakPolarHBondContact CE2-ND1 3.43Å; Y324-H426 AromaticContact CZ-ND1 3.64Å; Y324-H426 PolarHBondContact OH-ND1 2.86Å; Y324-P429 HydrophobicContact CD1-CG 3.67Å; Y324-P429 HydrophobicContact CD2-CG 3.93Å; Y324-P429 HydrophobicContact CE1-CG 4.2Å; Y324-P429 HydrophobicContact CE2-CG 4.45Å; Y324-P429 HydrophobicContact CG-CG 3.53Å
325	L	98.6	Very high	97.9	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-68	-22.5	-177.7	-70.9	170.7	0	0	0	113.3	Q259 A269 M270 V273 Q321 G322 L323 H328 V330	Q259-L325 PolarHBondContact NE2-O 2.92Å; A269-L325 HydrophobicContact CB-CD1 4.06Å; A269-L325 HydrophobicContact CB-CD2 3.81Å; M270-L325 HydrophobicContact CB-CD1 4.33Å; M270-L325 HydrophobicContact CE-CB 3.57Å; M270-L325 HydrophobicContact SD-CB 4.3Å; M270-L325 HydrophobicContact SD-CD1 4.49Å; V273-L325 HydrophobicContact CB-CD1 4.43Å; V273-L325 HydrophobicContact CG2-CD1 3.81Å; Q321-L325 WeakPolarHBondContact O-CB 3.49Å; Q321-L325 WeakPolarHBondContact O-CG 3.28Å; Q321-L325 PolarHBondContact O-N 3.41Å; G322-L325 PolarHBondContact O-N 2.85Å; L323-L325 VanDerWaalsContact C-N 3.3Å; L323-L325 PolarHBondContact O-N 3.13Å; L325-H328 WeakPolarHBondContact CA-O 3.36Å; L325-H328 CarbonylContact O-C 3.35Å; L325-H328 VanDerWaalsContact O-C 3.32Å; L325-V330 HydrophobicContact CD2-CB 3.78Å; L325-V330 HydrophobicContact CD2-CG2 3.94Å
326	V	98.3	Very high	97.9	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-62.7	-45.3	171.5	-178	0	0	0	0	110.9	F174 F255 K258 L262 H263 M270 G322 L323 Y324	F174-V326 HydrophobicContact CD2-CG1 4.21Å; F174-V326 HydrophobicContact CD2-CG2 4.12Å; F174-V326 HydrophobicContact CE1-CG1 4.45Å; F174-V326 HydrophobicContact CE2-CB 3.86Å; F174-V326 HydrophobicContact CE2-CG1 3.55Å; F174-V326 HydrophobicContact CE2-CG2 3.96Å; F174-V326 HydrophobicContact CZ-CB 4.41Å; F174-V326 HydrophobicContact CZ-CG1 3.68Å; F255-V326 HydrophobicContact CB-CG2 3.67Å; F255-V326 HydrophobicContact CD1-CG2 4.45Å; F255-V326 HydrophobicContact CG-CG2 4.13Å; F255-V326 WeakPolarHBondContact O-CG2 3.33Å; K258-V326 HydrophobicContact CB-CG1 4.13Å; K258-V326 HydrophobicContact CG-CG1 3.73Å; L262-V326 HydrophobicContact CD1-CG1 3.78Å; H263-V326 PolarHBondContact NE2-O 2.86Å; M270-V326 HydrophobicContact CE-CG2 4Å; G322-V326 WeakPolarHBondContact O-CG2 3.21Å; G322-V326 PolarHBondContact O-N 3.32Å; L323-V326 WeakPolarHBondContact O-CB 3.25Å; L323-V326 PolarHBondContact O-N 3.05Å; L323-V326 VanDerWaalsContact O-N 3.15Å; Y324-V326 VanDerWaalsContact C-N 3.26Å; Y324-V326 PolarHBondContact O-N 3.22Å
327	Y	97.4	Very high	97.9	Very high	70 Å²	70	37.5 Å²	37.5	28%	0.275	20%	0.203	S	C	.	.	H	α-helix	trans	-80.9	-27.7	179.6	-62.2	-82.9	0	0	0	112.7	C61 D62 F174 L323 Y324	C61-Y327 HydrophobicContact CB-CE2 4.35Å; D62-Y327 PolarHBondContact OD1-OH 2.91Å; F174-Y327 HydrophobicContact CE2-CE2 4.1Å; F174-Y327 HydrophobicContact CZ-CE1 4.47Å; F174-Y327 HydrophobicContact CZ-CE2 4.09Å; F174-Y327 AromaticContact CZ-CZ 3.81Å; L323-Y327 HydrophobicContact CD1-CE2 3.85Å; L323-Y327 HydrophobicContact CG-CE2 4.28Å; L323-Y327 WeakPolarHBondContact O-CD2 3.24Å; Y324-Y327 PolarHBondContact O-N 3.39Å; Y324-Y327 VanDerWaalsContact O-N 3.17Å
328	H	97.7	Very high	98	Very high	45 Å²	45	41 Å²	41	21%	0.208	22%	0.224	C	C	.	.	S	Bend	trans	-123.4	90.9	-179.3	-65.8	-88.7	0	0	0	110.5	S65 Y324 L325 V330 H426	S65-H328 PolarHBondContact O-NE2 3.4Å; Y324-H328 HydrophobicContact CD1-CB 4.34Å; Y324-H328 AromaticContact CD2-CD2 3.6Å; Y324-H328 HydrophobicContact CE1-CB 3.8Å; Y324-H328 HydrophobicContact CE2-CB 3.99Å; Y324-H328 AromaticContact CE2-CD2 3.15Å; Y324-H328 WeakPolarHBondContact CE2-CD2 3.32Å; Y324-H328 AromaticContact CE2-CG 3.56Å; Y324-H328 AromaticContact CE2-NE2 3.7Å; Y324-H328 AromaticContact CZ-CD2 3.67Å; Y324-H328 AromaticContact CZ-CG 3.55Å; Y324-H328 PolarHBondContact O-N 3.35Å; L325-H328 WeakPolarHBondContact CA-O 3.36Å; L325-H328 CarbonylContact O-C 3.35Å; L325-H328 VanDerWaalsContact O-C 3.32Å; H328-V330 VanDerWaalsContact C-N 3.25Å; H328-V330 HydrophobicContact CB-CG2 4.42Å; H328-V330 PolarHBondContact O-N 2.83Å; H328-H426 AromaticContact CE1-CE1 3.51Å; H328-H426 AromaticContact CE1-NE2 3.96Å; H328-H426 AromaticContact NE2-CE1 3.83Å; H328-H426 AromaticContact NE2-NE2 4Å
329	P	96.5	Very high	98	Very high	55 Å²	55	41.4 Å²	41.4	36%	0.357	24%	0.238	S	C	.	.			trans	-71.8	79.2	179.7	30.7	-35.9	0	0	0	111.2	T267 Q331	T267-P329 HydrophobicContact CG2-CB 3.72Å; P329-Q331 PolarHBondContact O-N 3.49Å
330	V	97.8	Very high	98	Very high	32 Å²	32	42 Å²	42	19%	0.194	24%	0.242	C	C	.	.			trans	-73.4	118.4	179.7	177.7	0	0	0	0	110.4	T267 A269 Y324 L325 H328 L332	T267-V330 VanDerWaalsContact CB-O 3.27Å; T267-V330 WeakPolarHBondContact CB-O 3.34Å; A269-V330 HydrophobicContact CB-CB 4.19Å; A269-V330 HydrophobicContact CB-CG1 4.4Å; A269-V330 WeakPolarHBondContact CB-O 3.47Å; Y324-V330 HydrophobicContact CE1-CG2 4.2Å; L325-V330 HydrophobicContact CD2-CB 3.78Å; L325-V330 HydrophobicContact CD2-CG2 3.94Å; H328-V330 VanDerWaalsContact C-N 3.25Å; H328-V330 HydrophobicContact CB-CG2 4.42Å; H328-V330 PolarHBondContact O-N 2.83Å; V330-L332 HydrophobicContact CG1-CD2 3.91Å; V330-L332 HydrophobicContact CG1-CG 4.32Å
331	Q	97.7	Very high	98	Very high	121 Å²	121	44.8 Å²	44.8	57%	0.565	26%	0.256	S	S	*	.			trans	-102.7	109.8	169.9	-171.2	66.7	12.2	0	0	109.8	N268 P329	N268-Q331 VanDerWaalsContact N-OE1 3.1Å; N268-Q331 PolarHBondContact ND2-NE2 2.8Å; N268-Q331 PolarHBondContact OD1-OE1 3.34Å; P329-Q331 PolarHBondContact O-N 3.49Å
332	L	97.5	Very high	98	Very high	21 Å²	21	49.4 Å²	49.4	11%	0.11	28%	0.28	C	S	.	.			trans	-76.8	143.8	178.9	-61.4	171.7	0	0	0	110.6	N268 A269 L272 V330 H336 A337	N268-L332 PolarHBondContact ND2-O 3.41Å; N268-L332 PolarHBondContact OD1-N 3.48Å; A269-L332 HydrophobicContact CB-CD1 4.3Å; A269-L332 HydrophobicContact CB-CG 4.32Å; L272-L332 HydrophobicContact CD1-CD1 3.98Å; V330-L332 HydrophobicContact CG1-CD2 3.91Å; V330-L332 HydrophobicContact CG1-CG 4.32Å; L332-H336 HydrophobicContact CB-CB 4.42Å; L332-A337 HydrophobicContact CB-CB 4.16Å
333	S	97.8	Very high	98	Very high	58 Å²	58	51.5 Å²	51.5	41%	0.406	29%	0.291	S	S	.	.			trans	-62.6	151.5	164.6	66.8	0	0	0	0	110.7	P335 H336 A337	S333-P335 VanDerWaalsContact C-CD 3.49Å; S333-H336 PolarHBondContact O-N 2.95Å; S333-H336 PolarHBondContact OG-ND1 3.06Å; S333-A337 PolarHBondContact O-N 2.99Å
334	T	97.6	Very high	98	Very high	107 Å²	107	51.7 Å²	51.7	66%	0.656	29%	0.293	S	S	*	.	H	α-helix	trans	-51.8	-45.2	-178.5	-50.9	0	0	0	0	113.5	H336 A337 V338	T334-H336 VanDerWaalsContact C-N 3.34Å; T334-H336 PolarHBondContact O-N 2.7Å; T334-A337 PolarHBondContact O-N 3.04Å; T334-V338 HydrophobicContact CG2-CG2 4.35Å; T334-V338 WeakPolarHBondContact O-CB 3.34Å; T334-V338 VanDerWaalsContact O-CG2 3.32Å; T334-V338 WeakPolarHBondContact O-CG2 3.12Å; T334-V338 PolarHBondContact O-N 3.3Å
335	P	97.9	Very high	98	Very high	98 Å²	98	54.6 Å²	54.6	64%	0.636	31%	0.309	S	S	*	.	H	α-helix	trans	-62.1	-39.6	178.2	-23.5	35.4	0	0	0	113.1	S333 G339	S333-P335 VanDerWaalsContact C-CD 3.49Å; P335-G339 PolarHBondContact O-N 3.01Å
336	H	97.3	Very high	98	Very high	126 Å²	126	57.8 Å²	57.8	58%	0.583	33%	0.329	S	S	*	.	H	α-helix	trans	-68.4	-44.2	177.8	-73.7	80.6	0	0	0	111.3	L332 S333 T334 V338 G339 V340	L332-H336 HydrophobicContact CB-CB 4.42Å; S333-H336 PolarHBondContact O-N 2.95Å; S333-H336 PolarHBondContact OG-ND1 3.06Å; T334-H336 VanDerWaalsContact C-N 3.34Å; T334-H336 PolarHBondContact O-N 2.7Å; H336-V338 VanDerWaalsContact C-N 3.34Å; H336-V338 PolarHBondContact O-N 2.98Å; H336-G339 PolarHBondContact O-N 3.31Å; H336-V340 WeakPolarHBondContact O-CG2 3.38Å; H336-V340 PolarHBondContact O-N 3.22Å
337	A	98.2	Very high	98	Very high	15 Å²	15	57.8 Å²	57.8	12%	0.124	33%	0.329	C	S	.	.	H	α-helix	trans	-59.2	-44.5	176.4	0	0	0	0	0	111.8	L272 L332 S333 T334 L341	L272-A337 HydrophobicContact CD1-CB 3.98Å; L332-A337 HydrophobicContact CB-CB 4.16Å; S333-A337 PolarHBondContact O-N 2.99Å; T334-A337 PolarHBondContact O-N 3.04Å; A337-L341 WeakPolarHBondContact O-CB 3.47Å; A337-L341 PolarHBondContact O-N 3.42Å
338	V	98.3	Very high	98	Very high	73 Å²	73	58 Å²	58	44%	0.442	33%	0.329	S	S	.	.	H	α-helix	trans	-64.7	-44.2	175.6	171.3	0	0	0	0	111.2	T334 H336 V340 L341 L342	T334-V338 HydrophobicContact CG2-CG2 4.35Å; T334-V338 WeakPolarHBondContact O-CB 3.34Å; T334-V338 VanDerWaalsContact O-CG2 3.32Å; T334-V338 WeakPolarHBondContact O-CG2 3.12Å; T334-V338 PolarHBondContact O-N 3.3Å; H336-V338 VanDerWaalsContact C-N 3.34Å; H336-V338 PolarHBondContact O-N 2.98Å; V338-V340 PolarHBondContact O-N 3.21Å; V338-L341 PolarHBondContact O-N 3.15Å; V338-L342 HydrophobicContact CG1-CD1 3.84Å; V338-L342 HydrophobicContact CG1-CG 4.23Å; V338-L342 WeakPolarHBondContact O-CB 3.33Å; V338-L342 VanDerWaalsContact O-CG 3.3Å; V338-L342 WeakPolarHBondContact O-CG 3.23Å; V338-L342 PolarHBondContact O-N 2.69Å
339	G	98.4	Very high	98	Very high	39 Å²	39	61.9 Å²	61.9	40%	0.402	34%	0.343	S	S	.	.	H	α-helix	trans	-59.7	-44.9	177.6	0	0	0	0	0	112.9	P335 H336 L342 L343	P335-G339 PolarHBondContact O-N 3.01Å; H336-G339 PolarHBondContact O-N 3.31Å; G339-L342 PolarHBondContact O-N 2.89Å; G339-L343 WeakPolarHBondContact O-CB 3.47Å; G339-L343 PolarHBondContact O-N 2.94Å
340	V	98.4	Very high	98	Very high	12 Å²	12	60 Å²	60	7%	0.073	33%	0.33	C	S	.	.	H	α-helix	trans	-64.1	-45	176.1	170.5	0	0	0	0	111.4	L272 L276 H336 V338 L343 G344 A417 L420 A421	L272-V340 HydrophobicContact CD1-CG1 4.42Å; L276-V340 HydrophobicContact CD1-CG1 4.37Å; H336-V340 WeakPolarHBondContact O-CG2 3.38Å; H336-V340 PolarHBondContact O-N 3.22Å; V338-V340 PolarHBondContact O-N 3.21Å; V340-L343 PolarHBondContact O-N 2.87Å; V340-G344 PolarHBondContact O-N 2.91Å; V340-A417 HydrophobicContact CG1-CB 4.28Å; V340-A417 VanDerWaalsContact CG1-O 3.29Å; V340-A417 WeakPolarHBondContact CG1-O 3.42Å; V340-L420 HydrophobicContact CG2-CB 3.89Å; V340-A421 HydrophobicContact CG1-CB 4.08Å
341	L	98.4	Very high	98	Very high	58 Å²	58	59.7 Å²	59.7	30%	0.304	33%	0.326	S	S	.	.	H	α-helix	trans	-59.9	-48	176.9	179.8	62	0	0	0	111.3	L272 L276 A337 V338 L343 G344 L345	L272-L341 HydrophobicContact CD2-CB 3.9Å; L272-L341 HydrophobicContact CD2-CD1 4.01Å; L272-L341 HydrophobicContact CD2-CG 4.39Å; L276-L341 HydrophobicContact CD2-CD1 4.12Å; A337-L341 WeakPolarHBondContact O-CB 3.47Å; A337-L341 PolarHBondContact O-N 3.42Å; V338-L341 PolarHBondContact O-N 3.15Å; L341-L343 PolarHBondContact O-N 3.33Å; L341-G344 PolarHBondContact O-N 3.41Å; L341-L345 HydrophobicContact CD1-CD1 3.9Å; L341-L345 HydrophobicContact CD1-CG 4.01Å; L341-L345 HydrophobicContact CG-CD1 3.91Å; L341-L345 HydrophobicContact CG-CG 4.34Å; L341-L345 WeakPolarHBondContact O-CB 3.36Å; L341-L345 VanDerWaalsContact O-CG 3.3Å; L341-L345 WeakPolarHBondContact O-CG 3.47Å; L341-L345 PolarHBondContact O-N 3.18Å
342	L	98.5	Very high	97.9	Very high	98 Å²	98	56.4 Å²	56.4	51%	0.513	31%	0.308	S	S	.	.	H	α-helix	trans	-62.1	-43.5	178.3	-72.3	175.5	0	0	0	111.6	V338 G339 G344 L345 V346	V338-L342 HydrophobicContact CG1-CD1 3.84Å; V338-L342 HydrophobicContact CG1-CG 4.23Å; V338-L342 WeakPolarHBondContact O-CB 3.33Å; V338-L342 VanDerWaalsContact O-CG 3.3Å; V338-L342 WeakPolarHBondContact O-CG 3.23Å; V338-L342 PolarHBondContact O-N 2.69Å; G339-L342 PolarHBondContact O-N 2.89Å; L342-G344 VanDerWaalsContact C-N 3.33Å; L342-G344 PolarHBondContact O-N 3.21Å; L342-L345 PolarHBondContact O-N 2.9Å; L342-V346 VanDerWaalsContact O-CB 3.32Å; L342-V346 WeakPolarHBondContact O-CB 3.22Å; L342-V346 WeakPolarHBondContact O-CG2 3.39Å; L342-V346 PolarHBondContact O-N 2.87Å
343	L	98.6	Very high	97.8	Very high	44 Å²	44	57 Å²	57	23%	0.23	31%	0.313	C	S	.	.	H	α-helix	trans	-57.6	-47.2	175.7	179.1	65.9	0	0	0	111.3	G339 V340 L341 G347 M413 L416 A417 L420	G339-L343 WeakPolarHBondContact O-CB 3.47Å; G339-L343 PolarHBondContact O-N 2.94Å; V340-L343 PolarHBondContact O-N 2.87Å; L341-L343 PolarHBondContact O-N 3.33Å; L343-G347 PolarHBondContact O-N 3.38Å; L343-M413 HydrophobicContact CD1-CB 4.17Å; L343-M413 HydrophobicContact CD1-CE 3.73Å; L343-M413 HydrophobicContact CD1-CG 4.3Å; L343-L416 HydrophobicContact CD2-CB 4.42Å; L343-L416 HydrophobicContact CD2-CD2 4.16Å; L343-L416 HydrophobicContact CD2-CG 4.12Å; L343-A417 HydrophobicContact CB-CB 4.32Å; L343-A417 HydrophobicContact CD2-CB 4.09Å; L343-A417 HydrophobicContact CG-CB 4.13Å; L343-L420 HydrophobicContact CD2-CD1 3.77Å
344	G	98.2	Very high	97.7	Very high	4 Å²	4	54.2 Å²	54.2	4%	0.041	29%	0.293	C	S	.	.	H	α-helix	trans	-64.2	-45.5	178.7	0	0	0	0	0	113	V340 L341 L342 G347 Y348	V340-G344 PolarHBondContact O-N 2.91Å; L341-G344 PolarHBondContact O-N 3.41Å; L342-G344 VanDerWaalsContact C-N 3.33Å; L342-G344 PolarHBondContact O-N 3.21Å; G344-G347 PolarHBondContact O-N 2.94Å; G344-Y348 WeakPolarHBondContact O-CB 3.47Å; G344-Y348 PolarHBondContact O-N 2.98Å
345	L	98.4	Very high	97.5	Very high	70 Å²	70	49.5 Å²	49.5	37%	0.366	26%	0.264	S	S	.	.	H	α-helix	trans	-68.9	-38.6	179.8	-68.3	179.3	0	0	0	112.8	I279 L341 L342 Y348 Y349	I279-L345 HydrophobicContact CD1-CD2 3.89Å; L341-L345 HydrophobicContact CD1-CD1 3.9Å; L341-L345 HydrophobicContact CD1-CG 4.01Å; L341-L345 HydrophobicContact CG-CD1 3.91Å; L341-L345 HydrophobicContact CG-CG 4.34Å; L341-L345 WeakPolarHBondContact O-CB 3.36Å; L341-L345 VanDerWaalsContact O-CG 3.3Å; L341-L345 WeakPolarHBondContact O-CG 3.47Å; L341-L345 PolarHBondContact O-N 3.18Å; L342-L345 PolarHBondContact O-N 2.9Å; L345-Y348 PolarHBondContact O-N 3.41Å; L345-Y349 WeakPolarHBondContact O-CB 3.19Å; L345-Y349 PolarHBondContact O-N 3.41Å
346	V	98.5	Very high	97.2	Very high	68 Å²	68	49.8 Å²	49.8	41%	0.412	26%	0.257	S	S	.	.	H	α-helix	trans	-67.3	-42.2	173.9	173.5	0	0	0	0	110.3	L342 Y349 I350 M413	L342-V346 VanDerWaalsContact O-CB 3.32Å; L342-V346 WeakPolarHBondContact O-CB 3.22Å; L342-V346 WeakPolarHBondContact O-CG2 3.39Å; L342-V346 PolarHBondContact O-N 2.87Å; V346-Y349 PolarHBondContact O-N 3.34Å; V346-I350 HydrophobicContact CG1-CD1 3.88Å; V346-I350 HydrophobicContact CG1-CG1 4.45Å; V346-I350 WeakPolarHBondContact O-CG1 3.43Å; V346-I350 PolarHBondContact O-N 3.24Å; V346-M413 HydrophobicContact CB-CE 4.17Å; V346-M413 HydrophobicContact CG1-CE 3.71Å
347	G	98.1	Very high	97.1	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-57.1	-49.6	173.6	0	0	0	0	0	112	L343 G344 Y349 I350 F351 G410	L343-G347 PolarHBondContact O-N 3.38Å; G344-G347 PolarHBondContact O-N 2.94Å; G347-Y349 PolarHBondContact O-N 3.49Å; G347-I350 PolarHBondContact O-N 2.82Å; G347-F351 WeakPolarHBondContact O-CB 3.21Å; G347-F351 PolarHBondContact O-N 3.16Å; G347-G410 CarbonylContact C-O 3.21Å; G347-G410 VanDerWaalsContact CA-O 3.29Å; G347-G410 WeakPolarHBondContact CA-O 3.14Å; G347-G410 CarbonylContact O-C 3.57Å; G347-G410 WeakPolarHBondContact O-CA 3.42Å
348	Y	97.7	Very high	96.9	Very high	73 Å²	73	44.8 Å²	44.8	29%	0.286	23%	0.231	S	C	.	.	H	α-helix	trans	-56.6	-48.9	174	172.4	-108	0	0	0	112.3	I279 D283 G344 L345 I350 F351 R352	I279-Y348 HydrophobicContact CG2-CD1 4.03Å; I279-Y348 HydrophobicContact CG2-CD2 3.72Å; I279-Y348 HydrophobicContact CG2-CE1 4.08Å; I279-Y348 HydrophobicContact CG2-CE2 3.77Å; I279-Y348 HydrophobicContact CG2-CG 3.86Å; D283-Y348 HydrophobicContact CB-CE2 3.75Å; D283-Y348 PolarHBondContact OD1-OH 2.89Å; G344-Y348 WeakPolarHBondContact O-CB 3.47Å; G344-Y348 PolarHBondContact O-N 2.98Å; L345-Y348 PolarHBondContact O-N 3.41Å; Y348-I350 PolarHBondContact O-N 3.45Å; Y348-F351 PolarHBondContact O-N 3.5Å; Y348-R352 HydrophobicContact CE2-CB 4.26Å; Y348-R352 WeakPolarHBondContact O-CB 3.34Å; Y348-R352 PolarHBondContact O-N 3.31Å
349	Y	97.8	Very high	96.4	Very high	127 Å²	127	42.6 Å²	42.6	50%	0.498	22%	0.216	S	C	.	.	H	α-helix	trans	-56.4	-48.5	177.8	171.6	-94.2	0	0	0	111.6	L345 V346 G347 R352 V353 F399	L345-Y349 WeakPolarHBondContact O-CB 3.19Å; L345-Y349 PolarHBondContact O-N 3.41Å; V346-Y349 PolarHBondContact O-N 3.34Å; G347-Y349 PolarHBondContact O-N 3.49Å; Y349-R352 PolarHBondContact O-N 3.24Å; Y349-V353 HydrophobicContact CD2-CG2 3.8Å; Y349-V353 HydrophobicContact CE1-CG2 4.32Å; Y349-V353 HydrophobicContact CE2-CG2 3.56Å; Y349-V353 HydrophobicContact CG-CG2 4.3Å; Y349-V353 VanDerWaalsContact O-CB 3.27Å; Y349-V353 WeakPolarHBondContact O-CB 3.18Å; Y349-V353 VanDerWaalsContact O-CG2 3.25Å; Y349-V353 WeakPolarHBondContact O-CG2 3.48Å; Y349-V353 PolarHBondContact O-N 2.83Å; Y349-F399 HydrophobicContact CE1-CZ 4.29Å
350	I	97.9	Very high	96.1	Very high	17 Å²	17	43.3 Å²	43.3	9%	0.087	21%	0.211	C	C	.	.	H	α-helix	trans	-60.9	-50.3	178.4	-70.5	167.8	0	0	0	110.5	V346 G347 Y348 R352 A354 F399 F406 M413	V346-I350 HydrophobicContact CG1-CD1 3.88Å; V346-I350 HydrophobicContact CG1-CG1 4.45Å; V346-I350 WeakPolarHBondContact O-CG1 3.43Å; V346-I350 PolarHBondContact O-N 3.24Å; G347-I350 PolarHBondContact O-N 2.82Å; Y348-I350 PolarHBondContact O-N 3.45Å; I350-R352 VanDerWaalsContact C-N 3.35Å; I350-R352 PolarHBondContact O-N 3.12Å; I350-A354 WeakPolarHBondContact O-CB 3.33Å; I350-A354 PolarHBondContact O-N 3.46Å; I350-F399 HydrophobicContact CG1-CE1 4.2Å; I350-F399 HydrophobicContact CG1-CZ 4.05Å; I350-F399 HydrophobicContact CG2-CE1 4.31Å; I350-F406 HydrophobicContact CD1-CE1 4.18Å; I350-F406 HydrophobicContact CG1-CE1 4.41Å; I350-F406 HydrophobicContact CG2-CD1 3.47Å; I350-F406 VanDerWaalsContact CG2-CD1 3.47Å; I350-F406 HydrophobicContact CG2-CE1 3.54Å; I350-M413 HydrophobicContact CD1-CE 4.33Å; I350-M413 HydrophobicContact CD1-SD 3.76Å
351	F	96.6	Very high	95.9	Very high	24 Å²	24	43.2 Å²	43.2	11%	0.105	21%	0.209	C	C	.	.	H	α-helix	trans	-55.9	-50	179.3	170	-97.2	0	0	0	111.5	G347 Y348 N355 N407 D411	G347-F351 WeakPolarHBondContact O-CB 3.21Å; G347-F351 PolarHBondContact O-N 3.16Å; Y348-F351 PolarHBondContact O-N 3.5Å; F351-N355 WeakPolarHBondContact CE2-ND2 3.49Å; F351-N355 PolarHBondContact O-N 2.91Å; F351-N355 VanDerWaalsContact O-N 3.16Å; F351-N355 PolarHBondContact O-ND2 3.48Å; F351-N407 WeakPolarHBondContact CD2-O 3.36Å; F351-D411 HydrophobicContact CD2-CB 4.09Å
352	R	94.8	Very high	95.5	Very high	53 Å²	53	48.1 Å²	48.1	20%	0.2	22%	0.224	C	C	.	.	H	α-helix	trans	-69.4	-48.3	-175.6	178.6	45.7	52.8	-179.3	0.5	111.7	D283 N287 Y348 Y349 I350 N355 H356	D283-R352 VanDerWaalsContact CG-CZ 3.47Å; D283-R352 IonicContact OD1-CZ 2.76Å; D283-R352 IonicContact OD1-NE 3.03Å; D283-R352 PolarHBondContact OD1-NE 2.94Å; D283-R352 IonicContact OD1-NH2 3.3Å; D283-R352 PolarHBondContact OD1-NH2 2.81Å; D283-R352 IonicContact OD2-CZ 3.66Å; D283-R352 VanDerWaalsContact OD2-CZ 3.24Å; D283-R352 IonicContact OD2-NE 3.24Å; D283-R352 PolarHBondContact OD2-NE 3.32Å; D283-R352 IonicContact OD2-NH2 3.18Å; D283-R352 PolarHBondContact OD2-NH2 3.36Å; N287-R352 PolarHBondContact ND2-NH1 3.47Å; N287-R352 PolarHBondContact ND2-NH2 2.84Å; N287-R352 PolarHBondContact OD1-NH1 2.87Å; Y348-R352 HydrophobicContact CE2-CB 4.26Å; Y348-R352 WeakPolarHBondContact O-CB 3.34Å; Y348-R352 PolarHBondContact O-N 3.31Å; Y349-R352 PolarHBondContact O-N 3.24Å; I350-R352 VanDerWaalsContact C-N 3.35Å; I350-R352 PolarHBondContact O-N 3.12Å; R352-N355 PolarHBondContact O-N 2.94Å; R352-H356 WeakPolarHBondContact O-CB 3.46Å; R352-H356 PolarHBondContact O-N 2.94Å
353	V	95.9	Very high	95	Very high	33 Å²	33	51 Å²	51	20%	0.2	23%	0.228	C	C	.	.	H	α-helix	trans	-68.5	-40.1	-178.8	175.8	0	0	0	0	111.3	Y349 N355 H356 Q357 F399	Y349-V353 HydrophobicContact CD2-CG2 3.8Å; Y349-V353 HydrophobicContact CE1-CG2 4.32Å; Y349-V353 HydrophobicContact CE2-CG2 3.56Å; Y349-V353 HydrophobicContact CG-CG2 4.3Å; Y349-V353 VanDerWaalsContact O-CB 3.27Å; Y349-V353 WeakPolarHBondContact O-CB 3.18Å; Y349-V353 VanDerWaalsContact O-CG2 3.25Å; Y349-V353 WeakPolarHBondContact O-CG2 3.48Å; Y349-V353 PolarHBondContact O-N 2.83Å; V353-N355 PolarHBondContact O-N 3.4Å; V353-H356 PolarHBondContact O-N 3.37Å; V353-Q357 HydrophobicContact CG1-CG 4.29Å; V353-Q357 WeakPolarHBondContact O-CB 3.39Å; V353-Q357 VanDerWaalsContact O-CG 3.27Å; V353-Q357 WeakPolarHBondContact O-CG 3.33Å; V353-Q357 PolarHBondContact O-N 2.89Å; V353-F399 HydrophobicContact CB-CD2 4.4Å; V353-F399 HydrophobicContact CB-CE2 3.93Å; V353-F399 HydrophobicContact CG1-CD2 4.04Å; V353-F399 HydrophobicContact CG1-CE2 3.7Å
354	A	96	Very high	94.7	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-60.5	-46	175.2	0	0	0	0	0	111.2	I350 Q357 K358 F399 W400 N407	I350-A354 WeakPolarHBondContact O-CB 3.33Å; I350-A354 PolarHBondContact O-N 3.46Å; A354-Q357 PolarHBondContact O-N 2.71Å; A354-K358 PolarHBondContact O-N 2.91Å; A354-F399 HydrophobicContact CB-CB 3.78Å; A354-F399 HydrophobicContact CB-CD2 3.99Å; A354-F399 HydrophobicContact CB-CG 4.11Å; A354-W400 PolarHBondContact O-NE1 2.95Å; A354-N407 HydrophobicContact CB-CB 3.75Å
355	N	93.6	Very high	94.4	Very high	8 Å²	8	54.6 Å²	54.6	4%	0.043	25%	0.247	C	C	.	.	H	α-helix	trans	-65.5	-39.8	176.1	-79.1	-58.6	0	0	0	112.7	F351 R352 V353 K358 D359	F351-N355 WeakPolarHBondContact CE2-ND2 3.49Å; F351-N355 PolarHBondContact O-N 2.91Å; F351-N355 VanDerWaalsContact O-N 3.16Å; F351-N355 PolarHBondContact O-ND2 3.48Å; R352-N355 PolarHBondContact O-N 2.94Å; V353-N355 PolarHBondContact O-N 3.4Å; N355-K358 PolarHBondContact O-N 3.41Å; N355-K358 PolarHBondContact OD1-NZ 3.48Å; N355-D359 PolarHBondContact O-N 2.94Å
356	H	92.1	Very high	94.1	Very high	103 Å²	103	51.8 Å²	51.8	48%	0.477	24%	0.236	S	C	.	.	H	α-helix	trans	-62.4	-42.5	175.4	-179.2	72.4	0	0	0	112.1	R352 V353 K358 D359 L360	R352-H356 WeakPolarHBondContact O-CB 3.46Å; R352-H356 PolarHBondContact O-N 2.94Å; V353-H356 PolarHBondContact O-N 3.37Å; H356-K358 VanDerWaalsContact C-N 3.31Å; H356-K358 PolarHBondContact O-N 2.97Å; H356-D359 PolarHBondContact O-N 2.88Å; H356-L360 VanDerWaalsContact O-CB 3.27Å; H356-L360 WeakPolarHBondContact O-CB 3.31Å; H356-L360 PolarHBondContact O-N 2.83Å
357	Q	95.4	Very high	93.8	Very high	8 Å²	8	58.5 Å²	58.5	4%	0.037	25%	0.254	C	S	.	.	H	α-helix	trans	-56.2	-45.3	175.1	-76	177.3	-10.1	0	0	111.5	V353 A354 F361 I370 W371 L395	V353-Q357 HydrophobicContact CG1-CG 4.29Å; V353-Q357 WeakPolarHBondContact O-CB 3.39Å; V353-Q357 VanDerWaalsContact O-CG 3.27Å; V353-Q357 WeakPolarHBondContact O-CG 3.33Å; V353-Q357 PolarHBondContact O-N 2.89Å; A354-Q357 PolarHBondContact O-N 2.71Å; Q357-F361 WeakPolarHBondContact O-CB 3.25Å; Q357-F361 PolarHBondContact O-N 2.89Å; Q357-I370 HydrophobicContact CB-CD1 4.06Å; Q357-I370 HydrophobicContact CG-CD1 4.03Å; Q357-I370 HydrophobicContact CG-CG2 4.2Å; Q357-W371 VanDerWaalsContact NE2-NE1 3.13Å; Q357-L395 HydrophobicContact CB-CD2 4.46Å
358	K	92.5	Very high	93.7	Very high	29 Å²	29	59.3 Å²	59.3	13%	0.126	26%	0.259	C	S	.	.	H	α-helix	trans	-64.4	-44.3	176.6	176.5	177.8	64	-164.1	0	112.1	A354 N355 H356 R362 W400	A354-K358 PolarHBondContact O-N 2.91Å; N355-K358 PolarHBondContact O-N 3.41Å; N355-K358 PolarHBondContact OD1-NZ 3.48Å; H356-K358 VanDerWaalsContact C-N 3.31Å; H356-K358 PolarHBondContact O-N 2.97Å; K358-R362 WeakPolarHBondContact O-CB 3.42Å; K358-R362 VanDerWaalsContact O-CG 3.29Å; K358-R362 WeakPolarHBondContact O-CG 3.42Å; K358-R362 PolarHBondContact O-N 3.14Å; K358-W400 HydrophobicContact CB-CZ2 3.78Å; K358-W400 HydrophobicContact CD-CH2 3.78Å; K358-W400 HydrophobicContact CD-CZ2 3.6Å; K358-W400 HydrophobicContact CD-CZ3 4.48Å; K358-W400 HydrophobicContact CG-CZ2 4.25Å
359	D	89.5	Confident	93.6	Very high	27 Å²	27	61.3 Å²	61.3	14%	0.144	27%	0.274	C	S	.	.	H	α-helix	trans	-67.3	-48.6	-179.2	-171.2	56.9	0	0	0	111.6	N355 H356 F361 R362 R363	N355-D359 PolarHBondContact O-N 2.94Å; H356-D359 PolarHBondContact O-N 2.88Å; D359-F361 VanDerWaalsContact C-N 3.32Å; D359-F361 PolarHBondContact O-N 2.97Å; D359-R362 PolarHBondContact O-N 2.91Å; D359-R363 WeakPolarHBondContact O-CG 3.31Å; D359-R363 PolarHBondContact O-N 3.19Å; D359-R363 IonicContact OD1-CZ 3.17Å; D359-R363 IonicContact OD1-NE 2.77Å; D359-R363 PolarHBondContact OD1-NE 3.49Å; D359-R363 IonicContact OD1-NH2 2.87Å; D359-R363 IonicContact OD2-CZ 3.5Å; D359-R363 IonicContact OD2-NE 2.84Å; D359-R363 PolarHBondContact OD2-NE 3.13Å; D359-R363 IonicContact OD2-NH2 3.24Å; D359-R363 PolarHBondContact OD2-NH2 3.16Å
360	L	91.6	Very high	93.5	Very high	54 Å²	54	55.7 Å²	55.7	28%	0.283	25%	0.253	S	S	.	.	H	α-helix	trans	-57.4	-45.8	175.7	178.9	63	0	0	0	111.4	H356 R362 R363 T364 C368	H356-L360 VanDerWaalsContact O-CB 3.27Å; H356-L360 WeakPolarHBondContact O-CB 3.31Å; H356-L360 PolarHBondContact O-N 2.83Å; L360-R362 PolarHBondContact O-N 3.23Å; L360-R363 PolarHBondContact O-N 3.46Å; L360-T364 HydrophobicContact CD1-CG2 3.87Å; L360-T364 WeakPolarHBondContact O-CB 3.23Å; L360-T364 WeakPolarHBondContact O-CG2 3.49Å; L360-T364 PolarHBondContact O-N 2.72Å; L360-T364 PolarHBondContact O-OG1 3.06Å; L360-C368 HydrophobicContact CD1-CB 4.37Å; L360-C368 HydrophobicContact CD2-CB 4.04Å; L360-C368 HydrophobicContact CG-CB 3.86Å
361	F	94.6	Very high	93.4	Very high	9 Å²	9	61.9 Å²	61.9	4%	0.039	28%	0.275	C	S	.	.	H	α-helix	trans	-58.3	-45.8	176.8	176.6	-103.5	0	0	0	112.2	Q357 D359 T364 D365 G366 P375 V377 K393 L395	Q357-F361 WeakPolarHBondContact O-CB 3.25Å; Q357-F361 PolarHBondContact O-N 2.89Å; D359-F361 VanDerWaalsContact C-N 3.32Å; D359-F361 PolarHBondContact O-N 2.97Å; F361-T364 PolarHBondContact O-OG1 3.29Å; F361-D365 PolarHBondContact O-N 3.47Å; F361-G366 VanDerWaalsContact CE2-CA 3.46Å; F361-G366 PolarHBondContact O-N 3.44Å; F361-P375 HydrophobicContact CD2-CB 4.24Å; F361-P375 HydrophobicContact CD2-CG 4.15Å; F361-P375 HydrophobicContact CE2-CB 4.21Å; F361-P375 HydrophobicContact CE2-CG 4.12Å; F361-V377 HydrophobicContact CE2-CG1 3.34Å; F361-V377 HydrophobicContact CZ-CB 4.31Å; F361-V377 HydrophobicContact CZ-CG1 3.47Å; F361-V377 VanDerWaalsContact CZ-CG1 3.47Å; F361-K393 HydrophobicContact CE1-CB 3.88Å; F361-K393 WeakPolarHBondContact CE1-O 3.39Å; F361-K393 HydrophobicContact CZ-CB 3.64Å; F361-L395 HydrophobicContact CB-CD2 4.19Å; F361-L395 HydrophobicContact CD1-CB 3.95Å; F361-L395 HydrophobicContact CD2-CD1 3.86Å; F361-L395 HydrophobicContact CE1-CB 3.99Å; F361-L395 HydrophobicContact CE2-CD1 4.05Å; F361-L395 HydrophobicContact CG-CB 4.21Å; F361-L395 HydrophobicContact CG-CD1 4.22Å; F361-L395 HydrophobicContact CG-CD2 4.24Å; F361-L395 HydrophobicContact CG-CG 4.47Å; F361-L395 HydrophobicContact CZ-CB 4.28Å
362	R	89.6	Confident	93.3	Very high	161 Å²	161	63.8 Å²	63.8	61%	0.608	30%	0.301	S	S	*	.	H	α-helix	trans	-67.4	-43.9	178.8	-74.6	175	176.3	178.6	-1.4	112.5	K358 D359 L360 T364 D365	K358-R362 WeakPolarHBondContact O-CB 3.42Å; K358-R362 VanDerWaalsContact O-CG 3.29Å; K358-R362 WeakPolarHBondContact O-CG 3.42Å; K358-R362 PolarHBondContact O-N 3.14Å; D359-R362 PolarHBondContact O-N 2.91Å; L360-R362 PolarHBondContact O-N 3.23Å; R362-T364 VanDerWaalsContact C-N 3.33Å; R362-T364 PolarHBondContact O-N 2.89Å; R362-D365 PolarHBondContact O-N 2.92Å
363	R	87.8	Confident	93.3	Very high	159 Å²	159	68.9 Å²	68.9	60%	0.6	33%	0.325	S	S	*	.	H	α-helix	trans	-67.4	-33	-178.9	-70.4	-175	-166.3	-147.7	11.8	113.2	D359 L360	D359-R363 WeakPolarHBondContact O-CG 3.31Å; D359-R363 PolarHBondContact O-N 3.19Å; D359-R363 IonicContact OD1-CZ 3.17Å; D359-R363 IonicContact OD1-NE 2.77Å; D359-R363 PolarHBondContact OD1-NE 3.49Å; D359-R363 IonicContact OD1-NH2 2.87Å; D359-R363 IonicContact OD2-CZ 3.5Å; D359-R363 IonicContact OD2-NE 2.84Å; D359-R363 PolarHBondContact OD2-NE 3.13Å; D359-R363 IonicContact OD2-NH2 3.24Å; D359-R363 PolarHBondContact OD2-NH2 3.16Å; L360-R363 PolarHBondContact O-N 3.46Å
364	T	92.1	Very high	93.3	Very high	33 Å²	33	75.7 Å²	75.7	20%	0.202	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	-0.6	-179.1	59.5	0	0	0	0	113.3	L360 F361 R362 G366 R367 C368	L360-T364 HydrophobicContact CD1-CG2 3.87Å; L360-T364 WeakPolarHBondContact O-CB 3.23Å; L360-T364 WeakPolarHBondContact O-CG2 3.49Å; L360-T364 PolarHBondContact O-N 2.72Å; L360-T364 PolarHBondContact O-OG1 3.06Å; F361-T364 PolarHBondContact O-OG1 3.29Å; R362-T364 VanDerWaalsContact C-N 3.33Å; R362-T364 PolarHBondContact O-N 2.89Å; T364-G366 PolarHBondContact O-N 2.62Å; T364-R367 VanDerWaalsContact O-CB 3.28Å; T364-R367 WeakPolarHBondContact O-CB 3.38Å; T364-R367 PolarHBondContact O-N 2.96Å; T364-R367 PolarHBondContact O-NE 3.37Å; T364-C368 HydrophobicContact CG2-CB 4.18Å; T364-C368 WeakPolarHBondContact OG1-CB 3.48Å
365	D	91.6	Very high	93.3	Very high	90 Å²	90	76.2 Å²	76.2	48%	0.481	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.4	39.9	-171.8	-172.6	36.4	0	0	0	112.5	F361 R362 R367 K393	F361-D365 PolarHBondContact O-N 3.47Å; R362-D365 PolarHBondContact O-N 2.92Å; D365-R367 VanDerWaalsContact C-N 3.31Å; D365-R367 PolarHBondContact O-N 2.85Å; D365-K393 PolarHBondContact O-NZ 2.81Å; D365-K393 IonicContact OD1-NZ 2.9Å; D365-K393 PolarHBondContact OD1-NZ 2.83Å; D365-K393 IonicContact OD2-NZ 3.18Å; D365-K393 PolarHBondContact OD2-NZ 2.86Å
366	G	91.5	Very high	93.4	Very high	12 Å²	12	83 Å²	83	12%	0.124	38%	0.384	C	S	.	.	T	Hydrogen-bonded Turn	trans	79.6	2.7	-177.5	0	0	0	0	0	115.6	F361 T364 C368 P375	F361-G366 VanDerWaalsContact CE2-CA 3.46Å; F361-G366 PolarHBondContact O-N 3.44Å; T364-G366 PolarHBondContact O-N 2.62Å; G366-C368 PolarHBondContact O-N 3.36Å; G366-C368 VanDerWaalsContact O-N 3.1Å; G366-P375 WeakPolarHBondContact O-CG 3.42Å
367	R	93.6	Very high	93.7	Very high	208 Å²	208	80.9 Å²	80.9	79%	0.785	38%	0.378	S	S	*	.			trans	-86	59	174.8	-58.8	177.6	-67.9	174.6	-1.6	111.2	T364 D365	T364-R367 VanDerWaalsContact O-CB 3.28Å; T364-R367 WeakPolarHBondContact O-CB 3.38Å; T364-R367 PolarHBondContact O-N 2.96Å; T364-R367 PolarHBondContact O-NE 3.37Å; D365-R367 VanDerWaalsContact C-N 3.31Å; D365-R367 PolarHBondContact O-N 2.85Å
368	C	94.8	Very high	93.7	Very high	17 Å²	17	81.3 Å²	81.3	12%	0.115	38%	0.381	C	S	.	.	S	Bend	trans	-138.7	176.9	177.2	65.2	0	0	0	0	110.9	L360 T364 G366 P375	L360-C368 HydrophobicContact CD1-CB 4.37Å; L360-C368 HydrophobicContact CD2-CB 4.04Å; L360-C368 HydrophobicContact CG-CB 3.86Å; T364-C368 HydrophobicContact CG2-CB 4.18Å; T364-C368 WeakPolarHBondContact OG1-CB 3.48Å; G366-C368 PolarHBondContact O-N 3.36Å; G366-C368 VanDerWaalsContact O-N 3.1Å; C368-P375 WeakPolarHBondContact O-CD 3.27Å
369	L	96.1	Very high	93.8	Very high	116 Å²	116	86.3 Å²	86.3	61%	0.607	41%	0.405	S	S	*	.			trans	-108.2	134.8	169.1	-61.2	177.2	0	0	0	109.3	K373	L369-K373 WeakPolarHBondContact CA-O 3.07Å
370	I	95.6	Very high	93.9	Very high	9 Å²	9	85.2 Å²	85.2	5%	0.046	40%	0.399	C	S	.	.	B	Isolated β-bridge	trans	-117.3	116.3	173	-57.2	-63.7	0	0	0	106.8	Q357 G372 K373 P375 L395	Q357-I370 HydrophobicContact CB-CD1 4.06Å; Q357-I370 HydrophobicContact CG-CD1 4.03Å; Q357-I370 HydrophobicContact CG-CG2 4.2Å; I370-G372 VanDerWaalsContact C-N 3.27Å; I370-G372 PolarHBondContact O-N 3.26Å; I370-K373 PolarHBondContact N-O 3.46Å; I370-K373 PolarHBondContact O-N 2.97Å; I370-P375 HydrophobicContact CG1-CB 3.96Å; I370-L395 HydrophobicContact CG1-CD1 4.38Å
371	W	95.4	Very high	93.9	Very high	147 Å²	147	84.5 Å²	84.5	56%	0.557	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.2	46.5	-170.5	-62.3	-22	0	0	0	113	Q357 K373 F399 V402	Q357-W371 VanDerWaalsContact NE2-NE1 3.13Å; W371-K373 PolarHBondContact O-N 2.84Å; W371-F399 HydrophobicContact CH2-CD1 4.35Å; W371-F399 HydrophobicContact CZ2-CD1 4.04Å; W371-F399 HydrophobicContact CZ2-CD2 4.06Å; W371-F399 HydrophobicContact CZ2-CE1 4.03Å; W371-F399 HydrophobicContact CZ2-CE2 4.03Å; W371-F399 HydrophobicContact CZ2-CG 4.08Å; W371-F399 HydrophobicContact CZ2-CZ 4.03Å; W371-V402 HydrophobicContact CH2-CG2 4.35Å
372	G	94.1	Very high	93.5	Very high	63 Å²	63	86.7 Å²	86.7	65%	0.649	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.7	1.6	176.7	0	0	0	0	0	115.6	I370	I370-G372 VanDerWaalsContact C-N 3.27Å; I370-G372 PolarHBondContact O-N 3.26Å
373	K	95.3	Very high	93.1	Very high	161 Å²	161	83.2 Å²	83.2	70%	0.7	40%	0.404	S	S	*	.	B	Isolated β-bridge	trans	-121.2	154.9	-179	-63.5	-178.7	-177.6	178.6	0	111.5	L369 I370 W371	L369-K373 WeakPolarHBondContact CA-O 3.07Å; I370-K373 PolarHBondContact N-O 3.46Å; I370-K373 PolarHBondContact O-N 2.97Å; W371-K373 PolarHBondContact O-N 2.84Å
374	K	96	Very high	92.4	Very high	176 Å²	176	77.7 Å²	77.7	77%	0.765	39%	0.39	S	S	*	.	P	Polyproline II helix	trans	-59.1	130.6	171.1	-173.1	178.3	179.8	-179.9	0	108.9
375	P	96.5	Very high	91.3	Very high	10 Å²	10	80.8 Å²	80.8	7%	0.065	42%	0.418	C	S	.	.	P	Polyproline II helix	trans	-63	139.9	-176.6	23.6	-33.8	0	0	0	111	F361 G366 C368 I370 V377 L395 S397	F361-P375 HydrophobicContact CD2-CB 4.24Å; F361-P375 HydrophobicContact CD2-CG 4.15Å; F361-P375 HydrophobicContact CE2-CB 4.21Å; F361-P375 HydrophobicContact CE2-CG 4.12Å; G366-P375 WeakPolarHBondContact O-CG 3.42Å; C368-P375 WeakPolarHBondContact O-CD 3.27Å; I370-P375 HydrophobicContact CG1-CB 3.96Å; P375-V377 HydrophobicContact CB-CG1 4.26Å; P375-V377 HydrophobicContact CG-CG1 4.46Å; P375-L395 HydrophobicContact CB-CD1 3.59Å; P375-S397 WeakPolarHBondContact CA-OG 3.27Å
376	K	96.5	Very high	90.3	Very high	152 Å²	152	81.6 Å²	81.6	66%	0.661	42%	0.422	S	S	*	.	P	Polyproline II helix	trans	-79.2	133.1	165	-63.8	-178	-179.7	-179.3	0	108.1	V396 S397	K376-V396 VanDerWaalsContact C-CG2 3.42Å; K376-V396 HydrophobicContact CB-CG2 3.62Å; K376-V396 VanDerWaalsContact O-CG2 3.25Å; K376-V396 WeakPolarHBondContact O-CG2 3.46Å; K376-V396 PolarHBondContact O-N 3.38Å; K376-S397 PolarHBondContact N-OG 2.93Å; K376-S397 VanDerWaalsContact N-OG 3.1Å
377	V	96.6	Very high	89.6	Confident	58 Å²	58	83.5 Å²	83.5	35%	0.352	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	152.8	-172.3	-56.4	0	0	0	0	111.8	F361 P375 L394	F361-V377 HydrophobicContact CE2-CG1 3.34Å; F361-V377 HydrophobicContact CZ-CB 4.31Å; F361-V377 HydrophobicContact CZ-CG1 3.47Å; F361-V377 VanDerWaalsContact CZ-CG1 3.47Å; P375-V377 HydrophobicContact CB-CG1 4.26Å; P375-V377 HydrophobicContact CG-CG1 4.46Å; V377-L394 CarbonylContact C-O 3.36Å; V377-L394 VanDerWaalsContact CA-O 3.28Å; V377-L394 WeakPolarHBondContact CA-O 3.27Å
378	I	95.8	Very high	89.1	Confident	16 Å²	16	79.1 Å²	79.1	8%	0.082	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	117.4	165.4	-62.7	175.3	0	0	0	107.2	C380 K393 L394 V396 R461 Y462 A465	I378-C380 PolarHBondContact O-SG 3.16Å; I378-C380 VanDerWaalsContact O-SG 3.41Å; I378-K393 WeakPolarHBondContact O-CA 3.29Å; I378-L394 HydrophobicContact CB-CB 4.43Å; I378-L394 PolarHBondContact N-O 3.22Å; I378-L394 PolarHBondContact O-N 2.93Å; I378-V396 HydrophobicContact CD1-CG1 3.83Å; I378-V396 HydrophobicContact CG1-CG1 4.1Å; I378-V396 HydrophobicContact CG1-CG2 4.45Å; I378-R461 HydrophobicContact CD1-CB 4.22Å; I378-Y462 HydrophobicContact CD1-CD2 4.3Å; I378-A465 HydrophobicContact CD1-CB 4.3Å
379	E	94.7	Very high	88.7	Confident	135 Å²	135	86.4 Å²	86.4	63%	0.631	46%	0.456	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.7	132.9	172.9	-61	-166.4	158.1	0	0	109.5
380	C	92.9	Very high	88.2	Confident	4 Å²	4	84.1 Å²	84.1	3%	0.027	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	147.3	-175.4	-53.2	0	0	0	0	109.7	I378 H391 S392 L394 Y455 D458	I378-C380 PolarHBondContact O-SG 3.16Å; I378-C380 VanDerWaalsContact O-SG 3.41Å; C380-H391 WeakPolarHBondContact O-CA 3.33Å; C380-S392 PolarHBondContact N-O 3.07Å; C380-S392 PolarHBondContact O-N 3.04Å; C380-L394 WeakPolarHBondContact SG-CD1 3.28Å; C380-L394 VanDerWaalsContact SG-CG 3.51Å; C380-Y455 HydrophobicContact CB-CD1 3.73Å; C380-Y455 HydrophobicContact CB-CE1 4.23Å; C380-Y455 HydrophobicContact CB-CG 4.4Å; C380-D458 VanDerWaalsContact CA-OD2 3.32Å; C380-D458 WeakPolarHBondContact CA-OD2 3.33Å; C380-D458 HydrophobicContact CB-CB 3.94Å; C380-D458 VanDerWaalsContact SG-CB 3.6Å
381	S	90.4	Very high	88	Confident	39 Å²	39	91.3 Å²	91.3	27%	0.273	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	138.7	167.1	70.7	0	0	0	0	110.4	R389 H390 D458	S381-R389 PolarHBondContact OG-NH2 3.44Å; S381-H390 WeakPolarHBondContact CA-O 3.37Å; S381-D458 PolarHBondContact N-OD2 3.17Å
382	Y	85.9	Confident	87.8	Confident	54 Å²	54	86 Å²	86	21%	0.212	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	150.4	175	69.9	-86.9	0	0	0	110.6	H390 K454 Y455	Y382-H390 HydrophobicContact CD1-CB 4.09Å; Y382-H390 HydrophobicContact CD2-CB 4.34Å; Y382-H390 HydrophobicContact CE1-CB 3.59Å; Y382-H390 HydrophobicContact CE2-CB 3.85Å; Y382-H390 AromaticContact CE2-CD2 3.89Å; Y382-H390 HydrophobicContact CG-CB 4.45Å; Y382-H390 VanDerWaalsContact CZ-CB 3.46Å; Y382-H390 AromaticContact CZ-CG 3.96Å; Y382-H390 PolarHBondContact N-O 3.21Å; Y382-H390 PolarHBondContact O-N 3.2Å; Y382-K454 WeakPolarHBondContact CB-O 3.14Å; Y382-K454 VanDerWaalsContact CD1-CE 3.48Å; Y382-K454 HydrophobicContact CD1-CG 4.47Å; Y382-K454 HydrophobicContact CD2-CD 4.43Å; Y382-K454 VanDerWaalsContact CD2-CE 3.42Å; Y382-K454 HydrophobicContact CD2-CG 4.08Å; Y382-K454 HydrophobicContact CG-CD 4.43Å; Y382-K454 HydrophobicContact CG-CG 3.95Å; Y382-K454 VanDerWaalsContact CZ-NZ 3.34Å; Y382-K454 PolarHBondContact OH-NZ 3.27Å; Y382-Y455 HydrophobicContact CD1-CD1 4.16Å; Y382-Y455 AromaticContact CD1-CE1 3.7Å; Y382-Y455 HydrophobicContact CD1-CE1 3.7Å; Y382-Y455 HydrophobicContact CE1-CE1 4.18Å; Y382-Y455 HydrophobicContact CG-CE1 4.43Å
383	T	81.4	Confident	87.8	Confident	89 Å²	89	85.7 Å²	85.7	55%	0.546	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	126.2	174.2	-52.9	0	0	0	0	108.4	Q388	T383-Q388 CarbonylContact C-O 3.59Å; T383-Q388 WeakPolarHBondContact CA-O 3.13Å
384	S	74.1	Confident	87.8	Confident	43 Å²	43	79 Å²	79	30%	0.301	41%	0.413	S	S	.	.			trans	-78.1	167.3	175.8	166.9	0	0	0	0	110.8	D386 G387 Q388 H390	S384-D386 WeakPolarHBondContact CB-OD1 3.33Å; S384-D386 PolarHBondContact O-N 3.46Å; S384-D386 VanDerWaalsContact O-N 3.16Å; S384-D386 PolarHBondContact OG-OD1 3.34Å; S384-G387 PolarHBondContact O-N 3.46Å; S384-Q388 PolarHBondContact N-O 3.32Å; S384-H390 VanDerWaalsContact CB-CD2 3.46Å; S384-H390 WeakPolarHBondContact CB-CD2 3.35Å; S384-H390 WeakPolarHBondContact CB-NE2 3.5Å
385	A	68.8	Low	87.8	Confident	97 Å²	97	71.2 Å²	71.2	80%	0.802	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-19.4	-177.9	0	0	0	0	0	113.5	G387	A385-G387 VanDerWaalsContact C-N 3.26Å
386	D	71.4	Confident	87.8	Confident	107 Å²	107	71.9 Å²	71.9	57%	0.572	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	3.5	172.4	61.9	-12.3	0	0	0	113.5	S384 Q388	S384-D386 WeakPolarHBondContact CB-OD1 3.33Å; S384-D386 PolarHBondContact O-N 3.46Å; S384-D386 VanDerWaalsContact O-N 3.16Å; S384-D386 PolarHBondContact OG-OD1 3.34Å; D386-Q388 VanDerWaalsContact C-N 3.26Å; D386-Q388 PolarHBondContact O-N 3.37Å; D386-Q388 PolarHBondContact OD1-N 2.93Å; D386-Q388 WeakPolarHBondContact OD2-CG 3.42Å
387	G	76.4	Confident	87.8	Confident	53 Å²	53	65.6 Å²	65.6	55%	0.546	36%	0.359	S	S	.	.	S	Bend	trans	80.1	0.8	-180	0	0	0	0	0	114.3	S384 A385	S384-G387 PolarHBondContact O-N 3.46Å; A385-G387 VanDerWaalsContact C-N 3.26Å
388	Q	82.3	Confident	87.8	Confident	116 Å²	116	63.2 Å²	63.2	54%	0.542	35%	0.346	S	S	.	.			trans	-78.6	135.7	180	-64.6	-64.6	-16.8	0	0	111.1	T383 S384 D386 H390	T383-Q388 CarbonylContact C-O 3.59Å; T383-Q388 WeakPolarHBondContact CA-O 3.13Å; S384-Q388 PolarHBondContact N-O 3.32Å; D386-Q388 VanDerWaalsContact C-N 3.26Å; D386-Q388 PolarHBondContact O-N 3.37Å; D386-Q388 PolarHBondContact OD1-N 2.93Å; D386-Q388 WeakPolarHBondContact OD2-CG 3.42Å; Q388-H390 PolarHBondContact O-CD2 3.13Å; Q388-H390 VanDerWaalsContact O-CD2 3.25Å
389	R	86.1	Confident	87.9	Confident	170 Å²	170	63.4 Å²	63.4	64%	0.642	35%	0.346	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.8	127	172.5	-71.2	-173.1	87.5	-176.7	4.2	109.7	S381	S381-R389 PolarHBondContact OG-NH2 3.44Å
390	H	86.8	Confident	88	Confident	67 Å²	67	58.1 Å²	58.1	31%	0.31	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	143.8	176.9	-62.6	-85.8	0	0	0	110.5	S381 Y382 S384 Q388	S381-H390 WeakPolarHBondContact CA-O 3.37Å; Y382-H390 HydrophobicContact CD1-CB 4.09Å; Y382-H390 HydrophobicContact CD2-CB 4.34Å; Y382-H390 HydrophobicContact CE1-CB 3.59Å; Y382-H390 HydrophobicContact CE2-CB 3.85Å; Y382-H390 AromaticContact CE2-CD2 3.89Å; Y382-H390 HydrophobicContact CG-CB 4.45Å; Y382-H390 VanDerWaalsContact CZ-CB 3.46Å; Y382-H390 AromaticContact CZ-CG 3.96Å; Y382-H390 PolarHBondContact N-O 3.21Å; Y382-H390 PolarHBondContact O-N 3.2Å; S384-H390 VanDerWaalsContact CB-CD2 3.46Å; S384-H390 WeakPolarHBondContact CB-CD2 3.35Å; S384-H390 WeakPolarHBondContact CB-NE2 3.5Å; Q388-H390 PolarHBondContact O-CD2 3.13Å; Q388-H390 VanDerWaalsContact O-CD2 3.25Å
391	H	90.1	Very high	88.1	Confident	161 Å²	161	59.2 Å²	59.2	75%	0.745	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.5	137.6	172	-64.8	-82.4	0	0	0	109.8	C380	C380-H391 WeakPolarHBondContact O-CA 3.33Å
392	S	91.7	Very high	88.4	Confident	35 Å²	35	59.9 Å²	59.9	25%	0.245	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	166.8	176.3	-157.2	0	0	0	0	110.3	C380	C380-S392 PolarHBondContact N-O 3.07Å; C380-S392 PolarHBondContact O-N 3.04Å
393	K	94	Very high	89	Confident	56 Å²	56	57.3 Å²	57.3	24%	0.243	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	133.5	178.3	-62.2	171.9	177.4	153	0	109	F361 D365 I378	F361-K393 HydrophobicContact CE1-CB 3.88Å; F361-K393 WeakPolarHBondContact CE1-O 3.39Å; F361-K393 HydrophobicContact CZ-CB 3.64Å; D365-K393 PolarHBondContact O-NZ 2.81Å; D365-K393 IonicContact OD1-NZ 2.9Å; D365-K393 PolarHBondContact OD1-NZ 2.83Å; D365-K393 IonicContact OD2-NZ 3.18Å; D365-K393 PolarHBondContact OD2-NZ 2.86Å; I378-K393 WeakPolarHBondContact O-CA 3.29Å
394	L	95	Very high	89.7	Confident	21 Å²	21	53.7 Å²	53.7	11%	0.11	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	130.6	172.9	-63.1	176.7	0	0	0	109.6	V377 I378 C380 Y455 W459 Y462	V377-L394 CarbonylContact C-O 3.36Å; V377-L394 VanDerWaalsContact CA-O 3.28Å; V377-L394 WeakPolarHBondContact CA-O 3.27Å; I378-L394 HydrophobicContact CB-CB 4.43Å; I378-L394 PolarHBondContact N-O 3.22Å; I378-L394 PolarHBondContact O-N 2.93Å; C380-L394 WeakPolarHBondContact SG-CD1 3.28Å; C380-L394 VanDerWaalsContact SG-CG 3.51Å; L394-Y455 HydrophobicContact CD1-CD2 4.3Å; L394-Y455 HydrophobicContact CD2-CD2 4.42Å; L394-Y455 HydrophobicContact CD2-CE2 3.97Å; L394-W459 HydrophobicContact CD1-CE3 3.86Å; L394-W459 HydrophobicContact CD1-CZ3 4.19Å; L394-Y462 HydrophobicContact CB-CD2 3.7Å; L394-Y462 HydrophobicContact CB-CE2 4.02Å; L394-Y462 HydrophobicContact CB-CG 4.37Å; L394-Y462 HydrophobicContact CD1-CD1 4.48Å; L394-Y462 HydrophobicContact CD1-CD2 4.08Å; L394-Y462 HydrophobicContact CD1-CG 3.88Å; L394-Y462 HydrophobicContact CG-CD2 4.49Å
395	L	96.2	Very high	90.7	Very high	12 Å²	12	51.9 Å²	51.9	6%	0.063	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	117.7	-176.5	176.8	64	0	0	0	110.4	Q357 F361 I370 P375 S397 W400 Y462	Q357-L395 HydrophobicContact CB-CD2 4.46Å; F361-L395 HydrophobicContact CB-CD2 4.19Å; F361-L395 HydrophobicContact CD1-CB 3.95Å; F361-L395 HydrophobicContact CD2-CD1 3.86Å; F361-L395 HydrophobicContact CE1-CB 3.99Å; F361-L395 HydrophobicContact CE2-CD1 4.05Å; F361-L395 HydrophobicContact CG-CB 4.21Å; F361-L395 HydrophobicContact CG-CD1 4.22Å; F361-L395 HydrophobicContact CG-CD2 4.24Å; F361-L395 HydrophobicContact CG-CG 4.47Å; F361-L395 HydrophobicContact CZ-CB 4.28Å; I370-L395 HydrophobicContact CG1-CD1 4.38Å; P375-L395 HydrophobicContact CB-CD1 3.59Å; L395-S397 VanDerWaalsContact CD1-OG 3.26Å; L395-S397 WeakPolarHBondContact CD1-OG 3.34Å; L395-W400 HydrophobicContact CB-CB 4.42Å; L395-W400 HydrophobicContact CD2-CB 4.16Å; L395-W400 HydrophobicContact CD2-CG 4.06Å; L395-W400 HydrophobicContact CG-CB 4.12Å; L395-W400 WeakPolarHBondContact O-CB 3.49Å; L395-Y462 WeakPolarHBondContact O-CE2 3.39Å
396	V	96.6	Very high	92.1	Very high	24 Å²	24	48.6 Å²	48.6	15%	0.145	26%	0.256	C	S	.	.			trans	-113.2	34.9	179.2	-65.2	0	0	0	0	112	K376 I378 Y462 A465 V466	K376-V396 VanDerWaalsContact C-CG2 3.42Å; K376-V396 HydrophobicContact CB-CG2 3.62Å; K376-V396 VanDerWaalsContact O-CG2 3.25Å; K376-V396 WeakPolarHBondContact O-CG2 3.46Å; K376-V396 PolarHBondContact O-N 3.38Å; I378-V396 HydrophobicContact CD1-CG1 3.83Å; I378-V396 HydrophobicContact CG1-CG1 4.1Å; I378-V396 HydrophobicContact CG1-CG2 4.45Å; V396-Y462 HydrophobicContact CG1-CD2 3.31Å; V396-Y462 HydrophobicContact CG1-CE2 3.42Å; V396-Y462 VanDerWaalsContact CG1-CE2 3.42Å; V396-A465 HydrophobicContact CG1-CB 4.22Å; V396-V466 HydrophobicContact CB-CG2 4.11Å; V396-V466 HydrophobicContact CG1-CG2 3.99Å
397	S	96.4	Very high	93.2	Very high	21 Å²	21	43.7 Å²	43.7	15%	0.147	23%	0.229	C	C	.	.	S	Bend	trans	-145.6	167.6	179.2	55.4	0	0	0	0	111.4	P375 K376 L395 G401	P375-S397 WeakPolarHBondContact CA-OG 3.27Å; K376-S397 PolarHBondContact N-OG 2.93Å; K376-S397 VanDerWaalsContact N-OG 3.1Å; L395-S397 VanDerWaalsContact CD1-OG 3.26Å; L395-S397 WeakPolarHBondContact CD1-OG 3.34Å; S397-G401 PolarHBondContact O-N 2.63Å
398	G	96.8	Very high	94.2	Very high	8 Å²	8	42.6 Å²	42.6	8%	0.082	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.6	-146	-168.5	0	0	0	0	0	110.9	W400 G401 V402	G398-W400 VanDerWaalsContact C-N 3.26Å; G398-W400 PolarHBondContact O-N 3.3Å; G398-G401 PolarHBondContact O-N 3.25Å; G398-V402 PolarHBondContact O-N 2.86Å
399	F	97.5	Very high	94.9	Very high	20 Å²	20	37.7 Å²	37.7	9%	0.088	19%	0.187	C	C	.	.	H	α-helix	trans	-63.5	-32.7	177.6	-75.4	-61.1	0	0	0	112.8	Y349 I350 V353 A354 W371 G401 V402 A403 F406	Y349-F399 HydrophobicContact CE1-CZ 4.29Å; I350-F399 HydrophobicContact CG1-CE1 4.2Å; I350-F399 HydrophobicContact CG1-CZ 4.05Å; I350-F399 HydrophobicContact CG2-CE1 4.31Å; V353-F399 HydrophobicContact CB-CD2 4.4Å; V353-F399 HydrophobicContact CB-CE2 3.93Å; V353-F399 HydrophobicContact CG1-CD2 4.04Å; V353-F399 HydrophobicContact CG1-CE2 3.7Å; A354-F399 HydrophobicContact CB-CB 3.78Å; A354-F399 HydrophobicContact CB-CD2 3.99Å; A354-F399 HydrophobicContact CB-CG 4.11Å; W371-F399 HydrophobicContact CH2-CD1 4.35Å; W371-F399 HydrophobicContact CZ2-CD1 4.04Å; W371-F399 HydrophobicContact CZ2-CD2 4.06Å; W371-F399 HydrophobicContact CZ2-CE1 4.03Å; W371-F399 HydrophobicContact CZ2-CE2 4.03Å; W371-F399 HydrophobicContact CZ2-CG 4.08Å; W371-F399 HydrophobicContact CZ2-CZ 4.03Å; F399-G401 PolarHBondContact O-N 3.27Å; F399-V402 WeakPolarHBondContact O-CB 3.41Å; F399-V402 PolarHBondContact O-N 2.8Å; F399-A403 PolarHBondContact O-N 3.17Å; F399-F406 HydrophobicContact CB-CB 4.2Å; F399-F406 HydrophobicContact CB-CD1 4.18Å; F399-F406 AromaticContact CD1-CD1 3.19Å; F399-F406 HydrophobicContact CD1-CD1 3.19Å; F399-F406 AromaticContact CD1-CE1 3.44Å; F399-F406 HydrophobicContact CD1-CE1 3.44Å; F399-F406 VanDerWaalsContact CD1-CE1 3.44Å; F399-F406 HydrophobicContact CD1-CG 4.12Å; F399-F406 AromaticContact CE1-CD1 3.76Å; F399-F406 HydrophobicContact CE1-CD1 3.76Å; F399-F406 AromaticContact CE1-CE1 3.54Å; F399-F406 HydrophobicContact CE1-CE1 3.54Å; F399-F406 AromaticContact CG-CD1 3.96Å; F399-F406 HydrophobicContact CG-CD1 3.96Å
400	W	96.9	Very high	95.4	Very high	23 Å²	23	29.6 Å²	29.6	9%	0.087	16%	0.157	C	C	.	.	H	α-helix	trans	-71.1	-14.2	175.6	-59.5	89.1	0	0	0	113.3	A354 K358 L395 G398 R404 V466	A354-W400 PolarHBondContact O-NE1 2.95Å; K358-W400 HydrophobicContact CB-CZ2 3.78Å; K358-W400 HydrophobicContact CD-CH2 3.78Å; K358-W400 HydrophobicContact CD-CZ2 3.6Å; K358-W400 HydrophobicContact CD-CZ3 4.48Å; K358-W400 HydrophobicContact CG-CZ2 4.25Å; L395-W400 HydrophobicContact CB-CB 4.42Å; L395-W400 HydrophobicContact CD2-CB 4.16Å; L395-W400 HydrophobicContact CD2-CG 4.06Å; L395-W400 HydrophobicContact CG-CB 4.12Å; L395-W400 WeakPolarHBondContact O-CB 3.49Å; G398-W400 VanDerWaalsContact C-N 3.26Å; G398-W400 PolarHBondContact O-N 3.3Å; W400-R404 WeakPolarHBondContact CZ3-O 3.47Å; W400-V466 WeakPolarHBondContact O-CG2 3.23Å
401	G	96.2	Very high	95.9	Very high	28 Å²	28	27 Å²	27	29%	0.289	15%	0.145	S	C	.	.	H	α-helix	trans	-88.7	-14.7	168.8	0	0	0	0	0	113.9	S397 G398 F399	S397-G401 PolarHBondContact O-N 2.63Å; G398-G401 PolarHBondContact O-N 3.25Å; F399-G401 PolarHBondContact O-N 3.27Å
402	V	96.7	Very high	96.3	Very high	53 Å²	53	20.9 Å²	20.9	32%	0.321	12%	0.118	S	C	.	.	H	α-helix	trans	-85.3	-50.9	177.9	176.4	0	0	0	0	110.2	W371 G398 F399 F406 P472	W371-V402 HydrophobicContact CH2-CG2 4.35Å; G398-V402 PolarHBondContact O-N 2.86Å; F399-V402 WeakPolarHBondContact O-CB 3.41Å; F399-V402 PolarHBondContact O-N 2.8Å; V402-F406 HydrophobicContact CB-CD2 4.27Å; V402-F406 HydrophobicContact CG1-CD2 3.77Å; V402-F406 HydrophobicContact CG1-CE2 3.65Å; V402-F406 HydrophobicContact CG1-CZ 4.31Å; V402-P472 HydrophobicContact CG1-CG 3.59Å
403	A	97.2	Very high	96.6	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	12%	0.117	C	C	.	.			trans	-149.3	152.6	171.8	0	0	0	0	0	110	F399 H405 F406 Y468 L470	F399-A403 PolarHBondContact O-N 3.17Å; A403-H405 PolarHBondContact O-N 3.36Å; A403-H405 VanDerWaalsContact O-N 3.17Å; A403-F406 HydrophobicContact CB-CB 4.18Å; A403-F406 HydrophobicContact CB-CD2 3.85Å; A403-F406 PolarHBondContact O-N 3.45Å; A403-Y468 WeakPolarHBondContact CA-O 3.26Å; A403-L470 VanDerWaalsContact CB-O 3.24Å; A403-L470 WeakPolarHBondContact CB-O 3.47Å
404	R	96.4	Very high	96.8	Very high	13 Å²	13	19 Å²	19	5%	0.049	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-23.9	-174.8	-63.2	-171.9	-64.9	-93.1	1	113.2	W400 E448 Y462 V466 P467 Y468	W400-R404 WeakPolarHBondContact CZ3-O 3.47Å; R404-E448 IonicContact CZ-OE1 2.73Å; R404-E448 IonicContact NE-OE1 3.67Å; R404-E448 PolarHBondContact NE-OE1 2.77Å; R404-E448 IonicContact NH2-OE1 3.33Å; R404-E448 PolarHBondContact NH2-OE1 3.47Å; R404-E448 IonicContact NH2-OE2 2.68Å; R404-Y462 HydrophobicContact CB-CE1 4.14Å; R404-Y462 VanDerWaalsContact CD-CE1 3.49Å; R404-Y462 HydrophobicContact CG-CD1 4.28Å; R404-Y462 HydrophobicContact CG-CE1 3.54Å; R404-V466 WeakPolarHBondContact CD-O 3.41Å; R404-V466 HydrophobicContact CG-CB 4.03Å; R404-V466 HydrophobicContact CG-CG1 3.79Å; R404-V466 WeakPolarHBondContact CG-O 3.39Å; R404-V466 PolarHBondContact NH1-O 3.23Å; R404-P467 PolarHBondContact NH1-O 3.45Å; R404-Y468 PolarHBondContact N-O 3.36Å
405	H	95.9	Very high	97	Very high	4 Å²	4	18 Å²	18	2%	0.019	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	-133.3	43.2	177.6	-59.8	-83.9	0	0	0	112.5	A403 N407 Y408 C444 D447 R469 L470	A403-H405 PolarHBondContact O-N 3.36Å; A403-H405 VanDerWaalsContact O-N 3.17Å; H405-N407 VanDerWaalsContact C-OD1 3.3Å; H405-N407 WeakPolarHBondContact CA-OD1 3.49Å; H405-N407 PolarHBondContact O-N 2.95Å; H405-N407 VanDerWaalsContact O-N 3.08Å; H405-N407 PolarHBondContact O-OD1 3.44Å; H405-Y408 HydrophobicContact CB-CD2 3.49Å; H405-Y408 VanDerWaalsContact CB-CD2 3.49Å; H405-Y408 HydrophobicContact CB-CE2 3.83Å; H405-Y408 HydrophobicContact CB-CG 4.06Å; H405-Y408 AromaticContact CG-CD2 3.98Å; H405-Y408 AromaticContact CG-CE2 3.8Å; H405-Y408 AromaticContact ND1-CE2 3.52Å; H405-Y408 AromaticContact ND1-CZ 3.97Å; H405-Y408 WeakPolarHBondContact O-CB 3.21Å; H405-Y408 PolarHBondContact O-N 3.5Å; H405-C444 PolarHBondContact CD2-SG 3.46Å; H405-D447 IonicContact CE1-OD2 3.13Å; H405-D447 PolarHBondContact CE1-OD2 2.93Å; H405-R469 WeakPolarHBondContact CA-O 3.37Å; H405-R469 WeakPolarHBondContact CB-O 3.05Å; H405-R469 PolarHBondContact N-O 3.24Å; H405-L470 HydrophobicContact CB-CD2 3.94Å
406	F	96.9	Very high	97.1	Very high	28 Å²	28	20.4 Å²	20.4	12%	0.123	12%	0.116	C	C	.	.	H	α-helix	trans	-62.3	-19.9	-178.5	-155	-96	0	0	0	113.7	I350 F399 V402 A403 Y408 V409 G410 P472	I350-F406 HydrophobicContact CD1-CE1 4.18Å; I350-F406 HydrophobicContact CG1-CE1 4.41Å; I350-F406 HydrophobicContact CG2-CD1 3.47Å; I350-F406 VanDerWaalsContact CG2-CD1 3.47Å; I350-F406 HydrophobicContact CG2-CE1 3.54Å; F399-F406 HydrophobicContact CB-CB 4.2Å; F399-F406 HydrophobicContact CB-CD1 4.18Å; F399-F406 AromaticContact CD1-CD1 3.19Å; F399-F406 HydrophobicContact CD1-CD1 3.19Å; F399-F406 AromaticContact CD1-CE1 3.44Å; F399-F406 HydrophobicContact CD1-CE1 3.44Å; F399-F406 VanDerWaalsContact CD1-CE1 3.44Å; F399-F406 HydrophobicContact CD1-CG 4.12Å; F399-F406 AromaticContact CE1-CD1 3.76Å; F399-F406 HydrophobicContact CE1-CD1 3.76Å; F399-F406 AromaticContact CE1-CE1 3.54Å; F399-F406 HydrophobicContact CE1-CE1 3.54Å; F399-F406 AromaticContact CG-CD1 3.96Å; F399-F406 HydrophobicContact CG-CD1 3.96Å; V402-F406 HydrophobicContact CB-CD2 4.27Å; V402-F406 HydrophobicContact CG1-CD2 3.77Å; V402-F406 HydrophobicContact CG1-CE2 3.65Å; V402-F406 HydrophobicContact CG1-CZ 4.31Å; A403-F406 HydrophobicContact CB-CB 4.18Å; A403-F406 HydrophobicContact CB-CD2 3.85Å; A403-F406 PolarHBondContact O-N 3.45Å; F406-Y408 PolarHBondContact O-N 3.23Å; F406-V409 HydrophobicContact CD2-CB 4.48Å; F406-V409 HydrophobicContact CD2-CG2 4.1Å; F406-V409 HydrophobicContact CE2-CG2 4.37Å; F406-V409 WeakPolarHBondContact O-CB 3.5Å; F406-V409 PolarHBondContact O-N 3.49Å; F406-V409 VanDerWaalsContact O-N 3.15Å; F406-G410 PolarHBondContact O-N 2.86Å; F406-P472 HydrophobicContact CE2-CG 4.41Å
407	N	95.8	Very high	97.2	Very high	4 Å²	4	19.3 Å²	19.3	2%	0.021	11%	0.109	C	C	.	.	H	α-helix	trans	-59	-35	168.7	62.1	-56.2	0	0	0	112.5	F351 A354 H405 V409 G410 D411	F351-N407 WeakPolarHBondContact CD2-O 3.36Å; A354-N407 HydrophobicContact CB-CB 3.75Å; H405-N407 VanDerWaalsContact C-OD1 3.3Å; H405-N407 WeakPolarHBondContact CA-OD1 3.49Å; H405-N407 PolarHBondContact O-N 2.95Å; H405-N407 VanDerWaalsContact O-N 3.08Å; H405-N407 PolarHBondContact O-OD1 3.44Å; N407-V409 VanDerWaalsContact C-N 3.33Å; N407-G410 PolarHBondContact O-N 3.33Å; N407-D411 PolarHBondContact O-N 3.45Å
408	Y	96.7	Very high	97.3	Very high	31 Å²	31	18.7 Å²	18.7	12%	0.122	10%	0.103	C	C	.	.	H	α-helix	trans	-71.4	-27.7	176.5	-62.9	-15.3	0	0	0	112.2	H405 F406 G410 D411 L412 L440 C444 L470	H405-Y408 HydrophobicContact CB-CD2 3.49Å; H405-Y408 VanDerWaalsContact CB-CD2 3.49Å; H405-Y408 HydrophobicContact CB-CE2 3.83Å; H405-Y408 HydrophobicContact CB-CG 4.06Å; H405-Y408 AromaticContact CG-CD2 3.98Å; H405-Y408 AromaticContact CG-CE2 3.8Å; H405-Y408 AromaticContact ND1-CE2 3.52Å; H405-Y408 AromaticContact ND1-CZ 3.97Å; H405-Y408 WeakPolarHBondContact O-CB 3.21Å; H405-Y408 PolarHBondContact O-N 3.5Å; F406-Y408 PolarHBondContact O-N 3.23Å; Y408-G410 VanDerWaalsContact C-N 3.35Å; Y408-D411 WeakPolarHBondContact O-CB 3.35Å; Y408-D411 PolarHBondContact O-N 3.2Å; Y408-L412 WeakPolarHBondContact O-CG 3.32Å; Y408-L412 PolarHBondContact O-N 3.06Å; Y408-L440 HydrophobicContact CD1-CD2 3.82Å; Y408-L440 HydrophobicContact CD2-CB 4.33Å; Y408-L440 HydrophobicContact CD2-CD2 4.32Å; Y408-L440 HydrophobicContact CE1-CD2 4.16Å; Y408-L440 HydrophobicContact CG-CB 4.37Å; Y408-L440 HydrophobicContact CG-CD2 3.93Å; Y408-C444 HydrophobicContact CD2-CB 4.32Å; Y408-C444 HydrophobicContact CE2-CB 4.14Å; Y408-L470 HydrophobicContact CD2-CD2 4Å; Y408-L470 HydrophobicContact CG-CD2 4.27Å
409	V	97.1	Very high	97.3	Very high	12 Å²	12	18.3 Å²	18.3	7%	0.073	10%	0.099	C	C	.	.	H	α-helix	trans	-62.7	-45	171.6	178.9	0	0	0	0	110.3	F406 N407 D411 L412 M413 L470 L471	F406-V409 HydrophobicContact CD2-CB 4.48Å; F406-V409 HydrophobicContact CD2-CG2 4.1Å; F406-V409 HydrophobicContact CE2-CG2 4.37Å; F406-V409 WeakPolarHBondContact O-CB 3.5Å; F406-V409 PolarHBondContact O-N 3.49Å; F406-V409 VanDerWaalsContact O-N 3.15Å; N407-V409 VanDerWaalsContact C-N 3.33Å; V409-D411 VanDerWaalsContact C-N 3.28Å; V409-D411 PolarHBondContact O-N 2.84Å; V409-L412 PolarHBondContact O-N 2.7Å; V409-M413 HydrophobicContact CG1-SD 4.26Å; V409-M413 VanDerWaalsContact O-CG 3.32Å; V409-M413 WeakPolarHBondContact O-CG 3.35Å; V409-M413 PolarHBondContact O-N 2.79Å; V409-L470 HydrophobicContact CG2-CB 4.26Å; V409-L470 HydrophobicContact CG2-CD2 4.47Å; V409-L470 WeakPolarHBondContact CG2-O 2.97Å; V409-L471 HydrophobicContact CG1-CD2 3.83Å; V409-L471 HydrophobicContact CG2-CD2 3.95Å
410	G	97.3	Very high	97.4	Very high	1 Å²	1	20.3 Å²	20.3	1%	0.01	11%	0.111	C	C	.	.	H	α-helix	trans	-58.4	-40.2	174.8	0	0	0	0	0	113	G347 F406 N407 Y408 M413 G414	G347-G410 CarbonylContact C-O 3.21Å; G347-G410 VanDerWaalsContact CA-O 3.29Å; G347-G410 WeakPolarHBondContact CA-O 3.14Å; G347-G410 CarbonylContact O-C 3.57Å; G347-G410 WeakPolarHBondContact O-CA 3.42Å; F406-G410 PolarHBondContact O-N 2.86Å; N407-G410 PolarHBondContact O-N 3.33Å; Y408-G410 VanDerWaalsContact C-N 3.35Å; G410-M413 PolarHBondContact O-N 2.92Å; G410-G414 PolarHBondContact O-N 3.23Å; G410-G414 VanDerWaalsContact O-N 3.09Å
411	D	96.9	Very high	97.4	Very high	12 Å²	12	19.2 Å²	19.2	6%	0.064	11%	0.107	C	C	.	.	H	α-helix	trans	-65.7	-41.4	176.9	-159.1	11.4	0	0	0	112.3	Y280 F351 N407 Y408 V409 G414 S415 M436 L440	Y280-D411 WeakPolarHBondContact CE2-OD1 3.34Å; F351-D411 HydrophobicContact CD2-CB 4.09Å; N407-D411 PolarHBondContact O-N 3.45Å; Y408-D411 WeakPolarHBondContact O-CB 3.35Å; Y408-D411 PolarHBondContact O-N 3.2Å; V409-D411 VanDerWaalsContact C-N 3.28Å; V409-D411 PolarHBondContact O-N 2.84Å; D411-G414 PolarHBondContact O-N 2.86Å; D411-S415 WeakPolarHBondContact O-CB 3.39Å; D411-S415 PolarHBondContact O-N 3.19Å; D411-S415 PolarHBondContact O-OG 3.26Å; D411-M436 VanDerWaalsContact OD2-CE 3.31Å; D411-M436 WeakPolarHBondContact OD2-CE 3.19Å; D411-L440 HydrophobicContact CB-CD1 4.01Å
412	L	98.1	Very high	97.5	Very high	33 Å²	33	18 Å²	18	17%	0.173	9%	0.093	C	C	.	.	H	α-helix	trans	-66.4	-36.5	174.1	-69.6	172.7	0	0	0	112.7	Y408 V409 S415 L416 I433 M436 A437 L440	Y408-L412 WeakPolarHBondContact O-CG 3.32Å; Y408-L412 PolarHBondContact O-N 3.06Å; V409-L412 PolarHBondContact O-N 2.7Å; L412-S415 PolarHBondContact O-N 2.96Å; L412-L416 WeakPolarHBondContact O-CB 3.22Å; L412-L416 PolarHBondContact O-N 3.24Å; L412-I433 HydrophobicContact CB-CD1 4.22Å; L412-I433 HydrophobicContact CD2-CD1 3.79Å; L412-I433 VanDerWaalsContact O-CD1 3.31Å; L412-I433 WeakPolarHBondContact O-CD1 3.27Å; L412-M436 HydrophobicContact CD2-CB 4.12Å; L412-A437 HydrophobicContact CD2-CB 4.06Å; L412-L440 HydrophobicContact CD2-CD1 3.85Å; L412-L440 HydrophobicContact CG-CD1 3.82Å
413	M	98.4	Very high	97.5	Very high	45 Å²	45	16.6 Å²	16.6	22%	0.222	9%	0.09	C	C	.	.	H	α-helix	trans	-63.2	-44.7	174.4	-71.1	173.7	70.7	0	0	111.4	L343 V346 I350 V409 G410 L416 A417	L343-M413 HydrophobicContact CD1-CB 4.17Å; L343-M413 HydrophobicContact CD1-CE 3.73Å; L343-M413 HydrophobicContact CD1-CG 4.3Å; V346-M413 HydrophobicContact CB-CE 4.17Å; V346-M413 HydrophobicContact CG1-CE 3.71Å; I350-M413 HydrophobicContact CD1-CE 4.33Å; I350-M413 HydrophobicContact CD1-SD 3.76Å; V409-M413 HydrophobicContact CG1-SD 4.26Å; V409-M413 VanDerWaalsContact O-CG 3.32Å; V409-M413 WeakPolarHBondContact O-CG 3.35Å; V409-M413 PolarHBondContact O-N 2.79Å; G410-M413 PolarHBondContact O-N 2.92Å; M413-L416 PolarHBondContact O-N 3.43Å; M413-A417 WeakPolarHBondContact O-CB 3.17Å; M413-A417 PolarHBondContact O-N 3.47Å
414	G	97.9	Very high	97.4	Very high	6 Å²	6	20.2 Å²	20.2	6%	0.062	13%	0.127	C	C	.	.	H	α-helix	trans	-61	-46.8	173.5	0	0	0	0	0	112	G410 D411 L416 A417 Y418	G410-G414 PolarHBondContact O-N 3.23Å; G410-G414 VanDerWaalsContact O-N 3.09Å; D411-G414 PolarHBondContact O-N 2.86Å; G414-L416 VanDerWaalsContact C-N 3.31Å; G414-L416 PolarHBondContact O-N 3.47Å; G414-A417 WeakPolarHBondContact O-CB 2.84Å; G414-A417 PolarHBondContact O-N 3.21Å; G414-A417 VanDerWaalsContact O-N 3.1Å; G414-Y418 WeakPolarHBondContact O-CD1 3.25Å; G414-Y418 VanDerWaalsContact O-CE1 3.31Å; G414-Y418 WeakPolarHBondContact O-CE1 3.26Å; G414-Y418 VanDerWaalsContact O-CG 3.31Å; G414-Y418 PolarHBondContact O-N 3.17Å
415	S	98.3	Very high	97.2	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-57.2	-42.9	176.8	-60.1	0	0	0	0	112.4	D411 L412 Y418 C419 Y432	D411-S415 WeakPolarHBondContact O-CB 3.39Å; D411-S415 PolarHBondContact O-N 3.19Å; D411-S415 PolarHBondContact O-OG 3.26Å; L412-S415 PolarHBondContact O-N 2.96Å; S415-Y418 PolarHBondContact O-N 2.63Å; S415-C419 PolarHBondContact O-N 3.32Å; S415-C419 PolarHBondContact O-SG 3.46Å; S415-Y432 VanDerWaalsContact OG-CE1 3.31Å; S415-Y432 WeakPolarHBondContact OG-CE1 3.4Å
416	L	98.6	Very high	97.2	Very high	63 Å²	63	24.7 Å²	24.7	33%	0.33	17%	0.165	S	C	.	.	H	α-helix	trans	-67.4	-40.5	176.3	179.7	60.8	0	0	0	111.3	L343 L412 M413 G414 Y418 C419 L420 I433	L343-L416 HydrophobicContact CD2-CB 4.42Å; L343-L416 HydrophobicContact CD2-CD2 4.16Å; L343-L416 HydrophobicContact CD2-CG 4.12Å; L412-L416 WeakPolarHBondContact O-CB 3.22Å; L412-L416 PolarHBondContact O-N 3.24Å; M413-L416 PolarHBondContact O-N 3.43Å; G414-L416 VanDerWaalsContact C-N 3.31Å; G414-L416 PolarHBondContact O-N 3.47Å; L416-Y418 VanDerWaalsContact C-N 3.32Å; L416-Y418 PolarHBondContact O-N 2.9Å; L416-C419 PolarHBondContact O-N 2.59Å; L416-C419 VanDerWaalsContact O-N 3.13Å; L416-L420 HydrophobicContact CD1-CD1 4.1Å; L416-L420 HydrophobicContact CD1-CD2 4.46Å; L416-L420 HydrophobicContact CD1-CG 3.95Å; L416-L420 HydrophobicContact CD2-CD1 4.28Å; L416-L420 HydrophobicContact CG-CD1 3.77Å; L416-L420 HydrophobicContact CG-CG 4.1Å; L416-L420 WeakPolarHBondContact O-CG 3.33Å; L416-L420 PolarHBondContact O-N 3.23Å; L416-I433 HydrophobicContact CB-CD1 4.12Å; L416-I433 HydrophobicContact CB-CG1 4.24Å; L416-I433 HydrophobicContact CD1-CG1 4.43Å
417	A	98.6	Very high	97.2	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-59.4	-41.3	176.5	0	0	0	0	0	112	L276 V340 L343 M413 G414 C419 L420 A421	L276-A417 HydrophobicContact CD1-CB 4.1Å; V340-A417 HydrophobicContact CG1-CB 4.28Å; V340-A417 VanDerWaalsContact CG1-O 3.29Å; V340-A417 WeakPolarHBondContact CG1-O 3.42Å; L343-A417 HydrophobicContact CB-CB 4.32Å; L343-A417 HydrophobicContact CD2-CB 4.09Å; L343-A417 HydrophobicContact CG-CB 4.13Å; M413-A417 WeakPolarHBondContact O-CB 3.17Å; M413-A417 PolarHBondContact O-N 3.47Å; G414-A417 WeakPolarHBondContact O-CB 2.84Å; G414-A417 PolarHBondContact O-N 3.21Å; G414-A417 VanDerWaalsContact O-N 3.1Å; A417-C419 VanDerWaalsContact C-N 3.28Å; A417-C419 PolarHBondContact O-N 3.43Å; A417-L420 PolarHBondContact O-N 2.81Å; A417-A421 PolarHBondContact O-N 2.8Å; A417-A421 VanDerWaalsContact O-N 3.11Å
418	Y	98.3	Very high	97.3	Very high	8 Å²	8	28.4 Å²	28.4	3%	0.031	19%	0.186	C	C	.	.	H	α-helix	trans	-58.4	-43.4	175.3	-51.5	-19.1	0	0	0	111.2	L276 Q277 Y280 G414 S415 L416 A421 Y432	L276-Y418 HydrophobicContact CB-CD1 3.88Å; L276-Y418 HydrophobicContact CB-CE1 3.61Å; L276-Y418 HydrophobicContact CD1-CD1 4.4Å; Q277-Y418 HydrophobicContact CG-CD1 4Å; Q277-Y418 HydrophobicContact CG-CD2 3.9Å; Q277-Y418 HydrophobicContact CG-CE1 3.97Å; Q277-Y418 HydrophobicContact CG-CE2 3.85Å; Q277-Y418 HydrophobicContact CG-CG 3.99Å; Y280-Y418 WeakPolarHBondContact CB-OH 3.33Å; G414-Y418 WeakPolarHBondContact O-CD1 3.25Å; G414-Y418 VanDerWaalsContact O-CE1 3.31Å; G414-Y418 WeakPolarHBondContact O-CE1 3.26Å; G414-Y418 VanDerWaalsContact O-CG 3.31Å; G414-Y418 PolarHBondContact O-N 3.17Å; S415-Y418 PolarHBondContact O-N 2.63Å; L416-Y418 VanDerWaalsContact C-N 3.32Å; L416-Y418 PolarHBondContact O-N 2.9Å; Y418-A421 WeakPolarHBondContact O-CB 3.2Å; Y418-Y432 AromaticContact CD2-CD1 3.92Å; Y418-Y432 HydrophobicContact CD2-CD1 3.92Å; Y418-Y432 AromaticContact CD2-CE1 3.5Å; Y418-Y432 HydrophobicContact CD2-CE1 3.5Å; Y418-Y432 VanDerWaalsContact CD2-CE1 3.5Å; Y418-Y432 AromaticContact CE2-CE1 3.7Å; Y418-Y432 HydrophobicContact CE2-CE1 3.7Å
419	C	98.6	Very high	97.3	Very high	0 Å²	0	27 Å²	27	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-71.7	-43.8	-177.7	-55.2	0	0	0	0	111.9	S415 L416 A417 A421 C422 P429 Y430 I433	S415-C419 PolarHBondContact O-N 3.32Å; S415-C419 PolarHBondContact O-SG 3.46Å; L416-C419 PolarHBondContact O-N 2.59Å; L416-C419 VanDerWaalsContact O-N 3.13Å; A417-C419 VanDerWaalsContact C-N 3.28Å; A417-C419 PolarHBondContact O-N 3.43Å; C419-A421 PolarHBondContact O-N 3.41Å; C419-C422 WeakPolarHBondContact O-CB 3.12Å; C419-C422 PolarHBondContact O-N 2.7Å; C419-P429 PolarHBondContact SG-O 2.83Å; C419-Y430 HydrophobicContact CB-CD1 3.73Å; C419-Y430 HydrophobicContact CB-CE1 3.89Å; C419-Y430 HydrophobicContact CB-CG 4.08Å; C419-I433 HydrophobicContact CB-CG2 4.33Å
420	L	98.4	Very high	97.4	Very high	63 Å²	63	28.6 Å²	28.6	33%	0.33	19%	0.185	S	C	.	.	H	α-helix	trans	-64.7	-27.1	179.3	-72.5	174.9	0	0	0	112.6	V340 L343 L416 A417 C422 G423 Y430	V340-L420 HydrophobicContact CG2-CB 3.89Å; L343-L420 HydrophobicContact CD2-CD1 3.77Å; L416-L420 HydrophobicContact CD1-CD1 4.1Å; L416-L420 HydrophobicContact CD1-CD2 4.46Å; L416-L420 HydrophobicContact CD1-CG 3.95Å; L416-L420 HydrophobicContact CD2-CD1 4.28Å; L416-L420 HydrophobicContact CG-CD1 3.77Å; L416-L420 HydrophobicContact CG-CG 4.1Å; L416-L420 WeakPolarHBondContact O-CG 3.33Å; L416-L420 PolarHBondContact O-N 3.23Å; A417-L420 PolarHBondContact O-N 2.81Å; L420-C422 PolarHBondContact O-N 3.24Å; L420-G423 PolarHBondContact O-N 2.65Å; L420-Y430 HydrophobicContact CD2-CE1 4.25Å
421	A	98.1	Very high	97.4	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-27.7	172.3	0	0	0	0	0	112.3	A269 V273 V340 A417 Y418 C419 G423	A269-A421 WeakPolarHBondContact CB-O 3.29Å; V273-A421 HydrophobicContact CG2-CB 3.57Å; V340-A421 HydrophobicContact CG1-CB 4.08Å; A417-A421 PolarHBondContact O-N 2.8Å; A417-A421 VanDerWaalsContact O-N 3.11Å; Y418-A421 WeakPolarHBondContact O-CB 3.2Å; C419-A421 PolarHBondContact O-N 3.41Å; A421-G423 VanDerWaalsContact C-N 3.32Å; A421-G423 PolarHBondContact O-N 3.41Å
422	C	97.9	Very high	97.4	Very high	2 Å²	2	29.7 Å²	29.7	1%	0.014	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.5	0.5	178.3	-59.3	0	0	0	0	114.4	Q321 Y324 C419 L420 P429	Q321-C422 VanDerWaalsContact CB-SG 3.54Å; Y324-C422 HydrophobicContact CD1-CB 3.65Å; Y324-C422 HydrophobicContact CE1-CB 3.8Å; Y324-C422 WeakPolarHBondContact CE1-O 3.25Å; C419-C422 WeakPolarHBondContact O-CB 3.12Å; C419-C422 PolarHBondContact O-N 2.7Å; L420-C422 PolarHBondContact O-N 3.24Å; C422-P429 HydrophobicContact CB-CB 3.74Å; C422-P429 HydrophobicContact CB-CG 3.76Å
423	G	95.8	Very high	97.4	Very high	24 Å²	24	29.5 Å²	29.5	25%	0.247	19%	0.188	C	C	.	.			trans	72	-165.7	-173.8	0	0	0	0	0	113.1	L420 A421 Y430	L420-G423 PolarHBondContact O-N 2.65Å; A421-G423 VanDerWaalsContact C-N 3.32Å; A421-G423 PolarHBondContact O-N 3.41Å; G423-Y430 WeakPolarHBondContact O-CE2 3.12Å; G423-Y430 PolarHBondContact O-OH 3.49Å
424	G	94.8	Very high	97.4	Very high	75 Å²	75	31.3 Å²	31.3	77%	0.773	20%	0.198	S	C	*	.	S	Bend	trans	-111	8.2	-171.9	0	0	0	0	0	115.8
425	G	92.9	Very high	97.3	Very high	63 Å²	63	33.2 Å²	33.2	65%	0.649	20%	0.204	S	C	*	.	S	Bend	trans	-76.7	-22.2	-169.8	0	0	0	0	0	115.3
426	H	95.9	Very high	97.2	Very high	48 Å²	48	33.5 Å²	33.5	22%	0.222	21%	0.205	C	C	.	.			trans	-139.3	145.7	-174.3	-68.2	76.9	0	0	0	111.4	S65 C66 Y324 H328 P429 Y430	S65-H426 PolarHBondContact O-NE2 2.98Å; C66-H426 PolarHBondContact O-CD2 3.28Å; Y324-H426 HydrophobicContact CD2-CB 4.42Å; Y324-H426 HydrophobicContact CE2-CB 3.7Å; Y324-H426 AromaticContact CE2-CG 3.53Å; Y324-H426 AromaticContact CE2-ND1 3.45Å; Y324-H426 WeakPolarHBondContact CE2-ND1 3.43Å; Y324-H426 AromaticContact CZ-ND1 3.64Å; Y324-H426 PolarHBondContact OH-ND1 2.86Å; H328-H426 AromaticContact CE1-CE1 3.51Å; H328-H426 AromaticContact CE1-NE2 3.96Å; H328-H426 AromaticContact NE2-CE1 3.83Å; H328-H426 AromaticContact NE2-NE2 4Å; H426-P429 WeakPolarHBondContact O-CD 3.27Å; H426-Y430 WeakPolarHBondContact O-CD2 3.4Å
427	L	97.1	Very high	97.2	Very high	110 Å²	110	32.2 Å²	32.2	58%	0.576	20%	0.203	S	C	*	.	S	Bend	trans	-77.3	-24.5	176.2	-175.3	63.4	0	0	0	112.8	L68 Y430 F431 I434	L68-L427 HydrophobicContact CD1-CB 4.26Å; L68-L427 HydrophobicContact CD1-CD2 4.39Å; L68-L427 HydrophobicContact CD1-CG 4.29Å; L427-Y430 WeakPolarHBondContact O-CB 3.12Å; L427-Y430 PolarHBondContact O-N 2.84Å; L427-F431 PolarHBondContact O-N 3.48Å; L427-I434 HydrophobicContact CD1-CD1 4.17Å
428	L	97.4	Very high	97	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-52.4	-49.1	-174.2	-179.8	145.6	0	0	0	113.8	F57 C61 C66 L68 L320 Y430 F431	F57-L428 HydrophobicContact CD1-CD1 4.24Å; F57-L428 HydrophobicContact CD1-CG 4.14Å; C61-L428 HydrophobicContact CB-CD1 4.49Å; C61-L428 WeakPolarHBondContact SG-CD1 2.98Å; C66-L428 HydrophobicContact CB-CB 4.49Å; C66-L428 HydrophobicContact CB-CD1 3.98Å; C66-L428 HydrophobicContact CB-CD2 4.35Å; L68-L428 HydrophobicContact CD1-CB 4.24Å; L68-L428 HydrophobicContact CD2-CB 4.21Å; L68-L428 HydrophobicContact CD2-CD1 3.85Å; L68-L428 HydrophobicContact CD2-CG 4.34Å; L68-L428 HydrophobicContact CG-CB 3.93Å; L68-L428 HydrophobicContact CG-CD1 4.43Å; L320-L428 HydrophobicContact CB-CD2 3.93Å; L320-L428 HydrophobicContact CD2-CD2 4.05Å; L320-L428 HydrophobicContact CD2-CG 4.44Å; L320-L428 HydrophobicContact CG-CD2 4.39Å; L428-Y430 PolarHBondContact O-N 2.91Å; L428-F431 VanDerWaalsContact O-CB 3.29Å; L428-F431 WeakPolarHBondContact O-CB 3.27Å; L428-F431 PolarHBondContact O-N 3.1Å
429	P	97.8	Very high	96.7	Very high	1 Å²	1	38.7 Å²	38.7	1%	0.006	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-62.3	-31.4	178	-24.8	36.4	0	0	0	113.5	Q321 Y324 C419 C422 H426 F431	Q321-P429 HydrophobicContact CG-CB 4.25Å; Q321-P429 PolarHBondContact NE2-O 3.37Å; Y324-P429 HydrophobicContact CD1-CG 3.67Å; Y324-P429 HydrophobicContact CD2-CG 3.93Å; Y324-P429 HydrophobicContact CE1-CG 4.2Å; Y324-P429 HydrophobicContact CE2-CG 4.45Å; Y324-P429 HydrophobicContact CG-CG 3.53Å; C419-P429 PolarHBondContact SG-O 2.83Å; C422-P429 HydrophobicContact CB-CB 3.74Å; C422-P429 HydrophobicContact CB-CG 3.76Å; H426-P429 WeakPolarHBondContact O-CD 3.27Å; P429-F431 VanDerWaalsContact C-N 3.25Å; P429-F431 PolarHBondContact O-N 3.41Å
430	Y	98.2	Very high	96.5	Very high	47 Å²	47	38.8 Å²	38.8	18%	0.184	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-77.7	-8.7	-177.9	-68.7	-96	0	0	0	113.6	C419 L420 G423 H426 L427 L428 Y432 I433 I434	C419-Y430 HydrophobicContact CB-CD1 3.73Å; C419-Y430 HydrophobicContact CB-CE1 3.89Å; C419-Y430 HydrophobicContact CB-CG 4.08Å; L420-Y430 HydrophobicContact CD2-CE1 4.25Å; G423-Y430 WeakPolarHBondContact O-CE2 3.12Å; G423-Y430 PolarHBondContact O-OH 3.49Å; H426-Y430 WeakPolarHBondContact O-CD2 3.4Å; L427-Y430 WeakPolarHBondContact O-CB 3.12Å; L427-Y430 PolarHBondContact O-N 2.84Å; L428-Y430 PolarHBondContact O-N 2.91Å; Y430-Y432 PolarHBondContact O-N 3.23Å; Y430-I433 HydrophobicContact CD1-CG2 4.15Å; Y430-I433 WeakPolarHBondContact O-CG2 3.44Å; Y430-I433 PolarHBondContact O-N 2.8Å; Y430-I434 WeakPolarHBondContact O-CD1 3.33Å; Y430-I434 WeakPolarHBondContact O-CG1 3.25Å; Y430-I434 PolarHBondContact O-N 2.8Å; Y430-I434 VanDerWaalsContact O-N 3.16Å
431	F	97.4	Very high	96.3	Very high	35 Å²	35	38.1 Å²	38.1	15%	0.154	24%	0.236	C	C	.	.	H	α-helix	trans	-52.5	-37.8	170.2	172.8	-95	0	0	0	111.9	F57 W313 L317 L320 L427 L428 P429 I434 Y435	F57-F431 HydrophobicContact CD1-CG 4.46Å; F57-F431 HydrophobicContact CE1-CB 3.55Å; F57-F431 HydrophobicContact CE1-CD1 4.18Å; F57-F431 AromaticContact CE1-CD2 3.7Å; F57-F431 HydrophobicContact CE1-CD2 3.7Å; F57-F431 HydrophobicContact CE1-CE2 4.47Å; F57-F431 AromaticContact CE1-CG 3.51Å; F57-F431 HydrophobicContact CE1-CG 3.51Å; F57-F431 HydrophobicContact CE2-CD2 4.44Å; F57-F431 HydrophobicContact CZ-CB 4.1Å; F57-F431 AromaticContact CZ-CD2 3.44Å; F57-F431 HydrophobicContact CZ-CD2 3.44Å; F57-F431 VanDerWaalsContact CZ-CD2 3.44Å; F57-F431 HydrophobicContact CZ-CE2 4.01Å; F57-F431 AromaticContact CZ-CG 3.8Å; F57-F431 HydrophobicContact CZ-CG 3.8Å; W313-F431 AromaticContact CH2-CZ 3.79Å; W313-F431 HydrophobicContact CH2-CZ 3.79Å; W313-F431 HydrophobicContact CZ2-CE1 4.09Å; W313-F431 AromaticContact CZ2-CZ 3.61Å; W313-F431 HydrophobicContact CZ2-CZ 3.61Å; L317-F431 HydrophobicContact CB-CD1 4.38Å; L317-F431 HydrophobicContact CB-CE1 3.91Å; L317-F431 HydrophobicContact CD1-CD1 4.49Å; L317-F431 HydrophobicContact CD1-CE1 3.5Å; L317-F431 VanDerWaalsContact CD1-CE1 3.5Å; L317-F431 HydrophobicContact CD1-CZ 3.79Å; L317-F431 HydrophobicContact CG-CE1 4.19Å; L320-F431 HydrophobicContact CD1-CB 4.31Å; L320-F431 HydrophobicContact CD1-CD1 3.9Å; L320-F431 HydrophobicContact CD1-CG 4.4Å; L427-F431 PolarHBondContact O-N 3.48Å; L428-F431 VanDerWaalsContact O-CB 3.29Å; L428-F431 WeakPolarHBondContact O-CB 3.27Å; L428-F431 PolarHBondContact O-N 3.1Å; P429-F431 VanDerWaalsContact C-N 3.25Å; P429-F431 PolarHBondContact O-N 3.41Å; F431-I434 PolarHBondContact O-N 2.84Å; F431-Y435 HydrophobicContact CE1-CG 4.41Å; F431-Y435 VanDerWaalsContact O-CB 3.24Å; F431-Y435 WeakPolarHBondContact O-CB 3.32Å; F431-Y435 PolarHBondContact O-N 3.04Å
432	Y	97.1	Very high	96	Very high	1 Å²	1	43.7 Å²	43.7	0%	0.004	26%	0.262	C	S	.	.	H	α-helix	trans	-61.8	-49.4	-178.4	-173.5	-101.2	0	0	0	112.9	Y318 S415 Y418 Y430 I434 Y435 M436	Y318-Y432 HydrophobicContact CD1-CD2 4.07Å; Y318-Y432 AromaticContact CD1-CE2 3.65Å; Y318-Y432 HydrophobicContact CD1-CE2 3.65Å; Y318-Y432 AromaticContact CD2-CE2 3.6Å; Y318-Y432 HydrophobicContact CD2-CE2 3.6Å; Y318-Y432 HydrophobicContact CE1-CD2 4.49Å; Y318-Y432 AromaticContact CE1-CE2 3.93Å; Y318-Y432 HydrophobicContact CE1-CE2 3.93Å; Y318-Y432 AromaticContact CE2-CE2 3.89Å; Y318-Y432 HydrophobicContact CE2-CE2 3.89Å; Y318-Y432 HydrophobicContact CG-CD2 4.16Å; Y318-Y432 AromaticContact CG-CE2 3.46Å; Y318-Y432 HydrophobicContact CG-CE2 3.46Å; Y318-Y432 VanDerWaalsContact CG-CE2 3.46Å; S415-Y432 VanDerWaalsContact OG-CE1 3.31Å; S415-Y432 WeakPolarHBondContact OG-CE1 3.4Å; Y418-Y432 AromaticContact CD2-CD1 3.92Å; Y418-Y432 HydrophobicContact CD2-CD1 3.92Å; Y418-Y432 AromaticContact CD2-CE1 3.5Å; Y418-Y432 HydrophobicContact CD2-CE1 3.5Å; Y418-Y432 VanDerWaalsContact CD2-CE1 3.5Å; Y418-Y432 AromaticContact CE2-CE1 3.7Å; Y418-Y432 HydrophobicContact CE2-CE1 3.7Å; Y430-Y432 PolarHBondContact O-N 3.23Å; Y432-I434 VanDerWaalsContact C-N 3.34Å; Y432-I434 PolarHBondContact O-N 2.72Å; Y432-Y435 PolarHBondContact O-N 2.94Å; Y432-M436 HydrophobicContact CD1-CG 4.17Å; Y432-M436 HydrophobicContact CE1-CG 3.83Å; Y432-M436 HydrophobicContact CE2-CG 4.18Å; Y432-M436 WeakPolarHBondContact O-CB 3.18Å; Y432-M436 VanDerWaalsContact O-CG 3.27Å; Y432-M436 WeakPolarHBondContact O-CG 3.1Å; Y432-M436 PolarHBondContact O-N 3.16Å
433	I	98	Very high	95.6	Very high	29 Å²	29	46.3 Å²	46.3	15%	0.149	27%	0.271	C	S	.	.	H	α-helix	trans	-66	-37.4	177.8	-179.9	60.6	0	0	0	111.6	L412 L416 C419 Y430 M436 A437	L412-I433 HydrophobicContact CB-CD1 4.22Å; L412-I433 HydrophobicContact CD2-CD1 3.79Å; L412-I433 VanDerWaalsContact O-CD1 3.31Å; L412-I433 WeakPolarHBondContact O-CD1 3.27Å; L416-I433 HydrophobicContact CB-CD1 4.12Å; L416-I433 HydrophobicContact CB-CG1 4.24Å; L416-I433 HydrophobicContact CD1-CG1 4.43Å; C419-I433 HydrophobicContact CB-CG2 4.33Å; Y430-I433 HydrophobicContact CD1-CG2 4.15Å; Y430-I433 WeakPolarHBondContact O-CG2 3.44Å; Y430-I433 PolarHBondContact O-N 2.8Å; I433-M436 PolarHBondContact O-N 3.02Å; I433-A437 VanDerWaalsContact O-CB 3.3Å; I433-A437 WeakPolarHBondContact O-CB 2.96Å; I433-A437 PolarHBondContact O-N 3.25Å
434	I	98	Very high	95.4	Very high	83 Å²	83	45.1 Å²	45.1	43%	0.426	26%	0.26	S	S	.	.	H	α-helix	trans	-62.4	-49.7	176.2	-66	165.5	0	0	0	110	L427 Y430 F431 Y432 A437 I438	L427-I434 HydrophobicContact CD1-CD1 4.17Å; Y430-I434 WeakPolarHBondContact O-CD1 3.33Å; Y430-I434 WeakPolarHBondContact O-CG1 3.25Å; Y430-I434 PolarHBondContact O-N 2.8Å; Y430-I434 VanDerWaalsContact O-N 3.16Å; F431-I434 PolarHBondContact O-N 2.84Å; Y432-I434 VanDerWaalsContact C-N 3.34Å; Y432-I434 PolarHBondContact O-N 2.72Å; I434-A437 PolarHBondContact O-N 3.32Å; I434-I438 HydrophobicContact CG2-CD1 4.13Å; I434-I438 WeakPolarHBondContact O-CG1 3.47Å; I434-I438 PolarHBondContact O-N 2.87Å; I434-I438 VanDerWaalsContact O-N 3.11Å
435	Y	96.3	Very high	95.2	Very high	46 Å²	46	45.1 Å²	45.1	18%	0.18	24%	0.241	C	C	.	.	H	α-helix	trans	-60.6	-47.8	177.1	167.2	-104	0	0	0	111.7	W313 Y318 F431 Y432 A437 I438 L439	W313-Y435 AromaticContact CE2-CE2 3.73Å; W313-Y435 AromaticContact CE2-CZ 3.97Å; W313-Y435 AromaticContact CZ2-CD2 3.6Å; W313-Y435 HydrophobicContact CZ2-CD2 3.6Å; W313-Y435 AromaticContact CZ2-CE2 3.58Å; W313-Y435 HydrophobicContact CZ2-CE2 3.58Å; W313-Y435 HydrophobicContact CZ2-CG 4.28Å; W313-Y435 AromaticContact NE1-CE1 3.57Å; W313-Y435 AromaticContact NE1-CE2 3.45Å; W313-Y435 AromaticContact NE1-CZ 3.2Å; W313-Y435 PolarHBondContact NE1-OH 3.17Å; Y318-Y435 HydrophobicContact CE1-CD1 4.27Å; Y318-Y435 AromaticContact CE1-CE1 3.76Å; Y318-Y435 HydrophobicContact CE1-CE1 3.76Å; Y318-Y435 WeakPolarHBondContact OH-CE1 3.28Å; F431-Y435 HydrophobicContact CE1-CG 4.41Å; F431-Y435 VanDerWaalsContact O-CB 3.24Å; F431-Y435 WeakPolarHBondContact O-CB 3.32Å; F431-Y435 PolarHBondContact O-N 3.04Å; Y432-Y435 PolarHBondContact O-N 2.94Å; Y435-A437 VanDerWaalsContact C-N 3.33Å; Y435-A437 PolarHBondContact O-N 2.84Å; Y435-I438 PolarHBondContact O-N 2.81Å; Y435-L439 HydrophobicContact CE1-CD2 4Å; Y435-L439 WeakPolarHBondContact O-CB 3.37Å; Y435-L439 PolarHBondContact O-N 2.78Å
436	M	96.9	Very high	95	Very high	6 Å²	6	45.2 Å²	45.2	3%	0.03	22%	0.222	C	C	.	.	H	α-helix	trans	-62.9	-38.1	179.1	-74.9	-63.1	-70.1	0	0	112	D411 L412 Y432 I433 L439 L440	D411-M436 VanDerWaalsContact OD2-CE 3.31Å; D411-M436 WeakPolarHBondContact OD2-CE 3.19Å; L412-M436 HydrophobicContact CD2-CB 4.12Å; Y432-M436 HydrophobicContact CD1-CG 4.17Å; Y432-M436 HydrophobicContact CE1-CG 3.83Å; Y432-M436 HydrophobicContact CE2-CG 4.18Å; Y432-M436 WeakPolarHBondContact O-CB 3.18Å; Y432-M436 VanDerWaalsContact O-CG 3.27Å; Y432-M436 WeakPolarHBondContact O-CG 3.1Å; Y432-M436 PolarHBondContact O-N 3.16Å; I433-M436 PolarHBondContact O-N 3.02Å; M436-L439 PolarHBondContact O-N 3.33Å; M436-L439 HydrophobicContact SD-CD2 4.06Å; M436-L440 HydrophobicContact CE-CD1 4.02Å; M436-L440 HydrophobicContact CE-CG 4.31Å; M436-L440 VanDerWaalsContact O-CB 3.25Å; M436-L440 WeakPolarHBondContact O-CB 3.16Å; M436-L440 VanDerWaalsContact O-CG 3.24Å; M436-L440 WeakPolarHBondContact O-CG 3.14Å; M436-L440 PolarHBondContact O-N 3.25Å
437	A	97.1	Very high	94.6	Very high	35 Å²	35	45.3 Å²	45.3	29%	0.289	22%	0.224	S	C	.	.	H	α-helix	trans	-61.4	-45.7	174.2	0	0	0	0	0	112	L412 I433 I434 Y435 T441	L412-A437 HydrophobicContact CD2-CB 4.06Å; I433-A437 VanDerWaalsContact O-CB 3.3Å; I433-A437 WeakPolarHBondContact O-CB 2.96Å; I433-A437 PolarHBondContact O-N 3.25Å; I434-A437 PolarHBondContact O-N 3.32Å; Y435-A437 VanDerWaalsContact C-N 3.33Å; Y435-A437 PolarHBondContact O-N 2.84Å; A437-T441 VanDerWaalsContact O-CB 3.23Å; A437-T441 WeakPolarHBondContact O-CB 3.46Å; A437-T441 PolarHBondContact O-N 2.82Å; A437-T441 PolarHBondContact O-OG1 3.07Å
438	I	95.7	Very high	94.4	Very high	116 Å²	116	40.7 Å²	40.7	60%	0.595	20%	0.2	S	C	*	.	H	α-helix	trans	-64.2	-49.5	176.7	-65	166.2	0	0	0	110.4	I434 Y435 L440 T441 H442	I434-I438 HydrophobicContact CG2-CD1 4.13Å; I434-I438 WeakPolarHBondContact O-CG1 3.47Å; I434-I438 PolarHBondContact O-N 2.87Å; I434-I438 VanDerWaalsContact O-N 3.11Å; Y435-I438 PolarHBondContact O-N 2.81Å; I438-L440 PolarHBondContact O-N 2.8Å; I438-T441 PolarHBondContact O-N 2.84Å; I438-H442 WeakPolarHBondContact O-CB 3.44Å; I438-H442 PolarHBondContact O-N 2.91Å
439	L	92.4	Very high	94	Very high	29 Å²	29	47 Å²	47	15%	0.152	23%	0.229	C	C	.	.	H	α-helix	trans	-58.3	-50	-179	178.3	68.9	0	0	0	111.6	Y435 M436 H442 R443	Y435-L439 HydrophobicContact CE1-CD2 4Å; Y435-L439 WeakPolarHBondContact O-CB 3.37Å; Y435-L439 PolarHBondContact O-N 2.78Å; M436-L439 PolarHBondContact O-N 3.33Å; M436-L439 HydrophobicContact SD-CD2 4.06Å; L439-H442 PolarHBondContact O-N 3.13Å; L439-R443 WeakPolarHBondContact O-CB 3.36Å; L439-R443 PolarHBondContact O-N 2.84Å
440	L	94.1	Very high	93.4	Very high	2 Å²	2	51 Å²	51	1%	0.01	24%	0.244	C	C	.	.	H	α-helix	trans	-71.6	-33.4	-176.8	-67.7	175.8	0	0	0	112.1	Y408 D411 L412 M436 I438 C444	Y408-L440 HydrophobicContact CD1-CD2 3.82Å; Y408-L440 HydrophobicContact CD2-CB 4.33Å; Y408-L440 HydrophobicContact CD2-CD2 4.32Å; Y408-L440 HydrophobicContact CE1-CD2 4.16Å; Y408-L440 HydrophobicContact CG-CB 4.37Å; Y408-L440 HydrophobicContact CG-CD2 3.93Å; D411-L440 HydrophobicContact CB-CD1 4.01Å; L412-L440 HydrophobicContact CD2-CD1 3.85Å; L412-L440 HydrophobicContact CG-CD1 3.82Å; M436-L440 HydrophobicContact CE-CD1 4.02Å; M436-L440 HydrophobicContact CE-CG 4.31Å; M436-L440 VanDerWaalsContact O-CB 3.25Å; M436-L440 WeakPolarHBondContact O-CB 3.16Å; M436-L440 VanDerWaalsContact O-CG 3.24Å; M436-L440 WeakPolarHBondContact O-CG 3.14Å; M436-L440 PolarHBondContact O-N 3.25Å; I438-L440 PolarHBondContact O-N 2.8Å; L440-C444 WeakPolarHBondContact O-CB 2.98Å; L440-C444 PolarHBondContact O-N 3.47Å
441	T	94	Very high	93	Very high	48 Å²	48	49.8 Å²	49.8	29%	0.294	24%	0.242	S	C	.	.	H	α-helix	trans	-64.9	-49.5	172.5	-58.8	0	0	0	0	110.7	A437 I438 R443 C444 L445 F475	A437-T441 VanDerWaalsContact O-CB 3.23Å; A437-T441 WeakPolarHBondContact O-CB 3.46Å; A437-T441 PolarHBondContact O-N 2.82Å; A437-T441 PolarHBondContact O-OG1 3.07Å; I438-T441 PolarHBondContact O-N 2.84Å; T441-R443 VanDerWaalsContact C-N 3.34Å; T441-R443 PolarHBondContact O-N 3.41Å; T441-C444 WeakPolarHBondContact O-CB 3.48Å; T441-C444 PolarHBondContact O-N 2.86Å; T441-L445 HydrophobicContact CG2-CD1 4.39Å; T441-L445 WeakPolarHBondContact O-CG 3.38Å; T441-L445 PolarHBondContact O-N 3.26Å; T441-F475 HydrophobicContact CG2-CE1 4.14Å; T441-F475 HydrophobicContact CG2-CZ 4.21Å
442	H	90.8	Very high	92.7	Very high	118 Å²	118	50 Å²	50	55%	0.546	25%	0.25	S	S	.	.	H	α-helix	trans	-61.2	-43.4	176.6	179.2	-102.5	0	0	0	111.7	I438 L439 C444 L445 R446	I438-H442 WeakPolarHBondContact O-CB 3.44Å; I438-H442 PolarHBondContact O-N 2.91Å; L439-H442 PolarHBondContact O-N 3.13Å; H442-C444 PolarHBondContact O-N 2.75Å; H442-L445 PolarHBondContact O-N 2.87Å; H442-R446 WeakPolarHBondContact O-CB 3.44Å; H442-R446 PolarHBondContact O-N 3.4Å
443	R	89.4	Confident	92.3	Very high	56 Å²	56	54.2 Å²	54.2	21%	0.211	28%	0.28	C	S	.	.	H	α-helix	trans	-63.7	-39.4	177.1	-178.1	173.7	-94.8	-176.4	-9.6	112	D296 L439 T441 D447	D296-R443 VanDerWaalsContact CG-NH2 3.29Å; D296-R443 IonicContact OD1-NH2 3.03Å; D296-R443 PolarHBondContact OD1-NH2 3.31Å; D296-R443 IonicContact OD2-NH2 2.77Å; D296-R443 PolarHBondContact OD2-NH2 3.43Å; L439-R443 WeakPolarHBondContact O-CB 3.36Å; L439-R443 PolarHBondContact O-N 2.84Å; T441-R443 VanDerWaalsContact C-N 3.34Å; T441-R443 PolarHBondContact O-N 3.41Å; R443-D447 WeakPolarHBondContact O-CB 3.25Å; R443-D447 PolarHBondContact O-N 3.38Å
444	C	91.8	Very high	91.9	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-59	-55.6	173.2	170.8	0	0	0	0	110.8	H405 Y408 L440 T441 H442 R446 D447 E448	H405-C444 PolarHBondContact CD2-SG 3.46Å; Y408-C444 HydrophobicContact CD2-CB 4.32Å; Y408-C444 HydrophobicContact CE2-CB 4.14Å; L440-C444 WeakPolarHBondContact O-CB 2.98Å; L440-C444 PolarHBondContact O-N 3.47Å; T441-C444 WeakPolarHBondContact O-CB 3.48Å; T441-C444 PolarHBondContact O-N 2.86Å; H442-C444 PolarHBondContact O-N 2.75Å; C444-R446 VanDerWaalsContact C-N 3.28Å; C444-R446 PolarHBondContact O-N 3.26Å; C444-D447 PolarHBondContact O-N 2.8Å; C444-D447 VanDerWaalsContact O-N 3.07Å; C444-E448 WeakPolarHBondContact O-CG 3.21Å; C444-E448 PolarHBondContact O-N 3.19Å
445	L	91.7	Very high	91.5	Very high	74 Å²	74	54 Å²	54	39%	0.387	27%	0.274	S	S	.	.	H	α-helix	trans	-58.5	-40.5	-178.9	-66.8	173.2	0	0	0	112.3	T441 H442 E448 H449 F475	T441-L445 HydrophobicContact CG2-CD1 4.39Å; T441-L445 WeakPolarHBondContact O-CG 3.38Å; T441-L445 PolarHBondContact O-N 3.26Å; H442-L445 PolarHBondContact O-N 2.87Å; L445-E448 PolarHBondContact O-N 3.45Å; L445-H449 WeakPolarHBondContact O-CB 3.35Å; L445-H449 PolarHBondContact O-N 2.96Å; L445-F475 HydrophobicContact CD2-CZ 4.25Å
446	R	87.8	Confident	91.4	Very high	66 Å²	66	53.3 Å²	53.3	25%	0.249	28%	0.282	C	S	.	.	H	α-helix	trans	-64.2	-42.2	176.1	-172.8	169.5	71.6	154.7	3.3	112.2	I295 D300 H442 C444 R450	I295-R446 HydrophobicContact CD1-CG 4.46Å; I295-R446 VanDerWaalsContact CD1-CZ 3.43Å; D300-R446 IonicContact OD1-CZ 2.84Å; D300-R446 IonicContact OD1-NH1 2.89Å; D300-R446 PolarHBondContact OD1-NH1 3.19Å; D300-R446 IonicContact OD1-NH2 3.52Å; D300-R446 IonicContact OD2-CZ 2.59Å; D300-R446 IonicContact OD2-NH1 3.76Å; D300-R446 PolarHBondContact OD2-NH1 3.43Å; D300-R446 IonicContact OD2-NH2 2.92Å; D300-R446 PolarHBondContact OD2-NH2 2.93Å; H442-R446 WeakPolarHBondContact O-CB 3.44Å; H442-R446 PolarHBondContact O-N 3.4Å; C444-R446 VanDerWaalsContact C-N 3.28Å; C444-R446 PolarHBondContact O-N 3.26Å; R446-R450 VanDerWaalsContact O-CG 3.24Å; R446-R450 WeakPolarHBondContact O-CG 3.42Å; R446-R450 PolarHBondContact O-N 2.95Å
447	D	87.6	Confident	91.2	Very high	50 Å²	50	62.8 Å²	62.8	27%	0.267	32%	0.317	S	S	.	.	H	α-helix	trans	-68.1	-40.8	177.9	-164.8	50.5	0	0	0	111.8	H405 R443 C444 R450 C451	H405-D447 IonicContact CE1-OD2 3.13Å; H405-D447 PolarHBondContact CE1-OD2 2.93Å; R443-D447 WeakPolarHBondContact O-CB 3.25Å; R443-D447 PolarHBondContact O-N 3.38Å; C444-D447 PolarHBondContact O-N 2.8Å; C444-D447 VanDerWaalsContact O-N 3.07Å; D447-R450 PolarHBondContact O-N 2.73Å; D447-C451 WeakPolarHBondContact O-CB 3.4Å; D447-C451 PolarHBondContact O-N 2.9Å; D447-C451 PolarHBondContact O-SG 3.16Å
448	E	92.1	Very high	91.1	Very high	13 Å²	13	62.5 Å²	62.5	6%	0.061	31%	0.311	C	S	.	.	H	α-helix	trans	-64	-44.6	176.6	-67.4	-159.6	152.1	0	0	112.6	R404 C444 L445 R450 C451 A452 W459 R469	R404-E448 IonicContact CZ-OE1 2.73Å; R404-E448 IonicContact NE-OE1 3.67Å; R404-E448 PolarHBondContact NE-OE1 2.77Å; R404-E448 IonicContact NH2-OE1 3.33Å; R404-E448 PolarHBondContact NH2-OE1 3.47Å; R404-E448 IonicContact NH2-OE2 2.68Å; C444-E448 WeakPolarHBondContact O-CG 3.21Å; C444-E448 PolarHBondContact O-N 3.19Å; L445-E448 PolarHBondContact O-N 3.45Å; E448-R450 PolarHBondContact O-N 3.26Å; E448-C451 PolarHBondContact O-N 3.02Å; E448-A452 WeakPolarHBondContact O-CB 3.13Å; E448-A452 PolarHBondContact O-N 2.79Å; E448-W459 HydrophobicContact CB-CZ2 4.17Å; E448-W459 HydrophobicContact CG-CZ2 4.02Å; E448-R469 WeakPolarHBondContact OE1-CG 3.43Å; E448-R469 IonicContact OE1-NE 3.42Å; E448-R469 IonicContact OE2-CZ 2.75Å; E448-R469 IonicContact OE2-NE 3.22Å; E448-R469 PolarHBondContact OE2-NE 3.22Å; E448-R469 IonicContact OE2-NH2 2.69Å; E448-R469 PolarHBondContact OE2-NH2 3.34Å
449	H	90.1	Very high	91.2	Very high	133 Å²	133	58 Å²	58	62%	0.616	29%	0.286	S	S	*	.	H	α-helix	trans	-57	-42.4	176	-179.4	-113.1	0	0	0	110.7	L445 A452 S453	L445-H449 WeakPolarHBondContact O-CB 3.35Å; L445-H449 PolarHBondContact O-N 2.96Å; H449-A452 PolarHBondContact O-N 3.35Å; H449-S453 PolarHBondContact O-N 3.17Å; H449-S453 PolarHBondContact O-OG 3.28Å
450	R	85.1	Confident	91.3	Very high	85 Å²	85	62.5 Å²	62.5	32%	0.321	31%	0.307	S	S	.	.	H	α-helix	trans	-68.2	-40.9	178	-68.9	176.6	66.4	-143.3	-8.5	112.7	H299 R446 D447 E448 A452 S453 K454	H299-R450 VanDerWaalsContact CD2-CZ 3.41Å; H299-R450 PolarHBondContact CD2-NH1 3.46Å; H299-R450 PolarHBondContact CD2-NH2 2.95Å; H299-R450 PolarHBondContact CE1-NH2 3.04Å; H299-R450 VanDerWaalsContact CG-NH2 3.33Å; H299-R450 PolarHBondContact ND1-NH2 3.43Å; H299-R450 VanDerWaalsContact ND1-NH2 3.16Å; H299-R450 PolarHBondContact NE2-NH1 2.87Å; H299-R450 PolarHBondContact NE2-NH2 3.3Å; R446-R450 VanDerWaalsContact O-CG 3.24Å; R446-R450 WeakPolarHBondContact O-CG 3.42Å; R446-R450 PolarHBondContact O-N 2.95Å; D447-R450 PolarHBondContact O-N 2.73Å; E448-R450 PolarHBondContact O-N 3.26Å; R450-A452 VanDerWaalsContact C-N 3.33Å; R450-S453 PolarHBondContact O-N 2.75Å; R450-K454 VanDerWaalsContact O-CB 3.23Å; R450-K454 WeakPolarHBondContact O-CB 3.33Å; R450-K454 PolarHBondContact O-N 3.16Å
451	C	90	Very high	91.5	Very high	21 Å²	21	69.4 Å²	69.4	14%	0.142	33%	0.333	C	S	.	.	H	α-helix	trans	-67.4	-35.5	176.5	-76.3	0	0	0	0	111.7	D447 E448 K454 Y455 W459	D447-C451 WeakPolarHBondContact O-CB 3.4Å; D447-C451 PolarHBondContact O-N 2.9Å; D447-C451 PolarHBondContact O-SG 3.16Å; E448-C451 PolarHBondContact O-N 3.02Å; C451-K454 PolarHBondContact O-N 3.16Å; C451-Y455 HydrophobicContact CB-CD2 4.17Å; C451-Y455 HydrophobicContact CB-CE2 4.38Å; C451-Y455 WeakPolarHBondContact O-CD2 3.37Å; C451-Y455 PolarHBondContact O-N 3.41Å; C451-W459 HydrophobicContact CB-CD2 3.71Å; C451-W459 HydrophobicContact CB-CE3 3.62Å; C451-W459 HydrophobicContact CB-CH2 3.64Å; C451-W459 HydrophobicContact CB-CZ2 3.75Å; C451-W459 HydrophobicContact CB-CZ3 3.58Å
452	A	91.6	Very high	91.6	Very high	39 Å²	39	67.6 Å²	67.6	32%	0.322	32%	0.32	S	S	.	.	H	α-helix	trans	-62.8	-49.3	171.1	0	0	0	0	0	111.5	E448 H449 R450 K454 G456 W459	E448-A452 WeakPolarHBondContact O-CB 3.13Å; E448-A452 PolarHBondContact O-N 2.79Å; H449-A452 PolarHBondContact O-N 3.35Å; R450-A452 VanDerWaalsContact C-N 3.33Å; A452-K454 VanDerWaalsContact C-N 3.26Å; A452-K454 PolarHBondContact O-N 2.98Å; A452-G456 WeakPolarHBondContact O-CA 3.38Å; A452-G456 PolarHBondContact O-N 2.82Å; A452-W459 VanDerWaalsContact CA-CD1 3.45Å; A452-W459 HydrophobicContact CB-CG 4.29Å
453	S	88.9	Confident	91.9	Very high	90 Å²	90	63.9 Å²	63.9	63%	0.629	31%	0.306	S	S	*	.	H	α-helix	trans	-62	-34.4	176.3	-53.1	0	0	0	0	112.7	H449 R450	H449-S453 PolarHBondContact O-N 3.17Å; H449-S453 PolarHBondContact O-OG 3.28Å; R450-S453 PolarHBondContact O-N 2.75Å
454	K	88.1	Confident	92.2	Very high	83 Å²	83	65 Å²	65	36%	0.361	33%	0.327	S	S	.	.	H	α-helix	trans	-78.7	-47.6	-177.3	-174.9	-179.9	179.3	-167.7	0	113.2	Y382 R450 C451 A452	Y382-K454 WeakPolarHBondContact CB-O 3.14Å; Y382-K454 VanDerWaalsContact CD1-CE 3.48Å; Y382-K454 HydrophobicContact CD1-CG 4.47Å; Y382-K454 HydrophobicContact CD2-CD 4.43Å; Y382-K454 VanDerWaalsContact CD2-CE 3.42Å; Y382-K454 HydrophobicContact CD2-CG 4.08Å; Y382-K454 HydrophobicContact CG-CD 4.43Å; Y382-K454 HydrophobicContact CG-CG 3.95Å; Y382-K454 VanDerWaalsContact CZ-NZ 3.34Å; Y382-K454 PolarHBondContact OH-NZ 3.27Å; R450-K454 VanDerWaalsContact O-CB 3.23Å; R450-K454 WeakPolarHBondContact O-CB 3.33Å; R450-K454 PolarHBondContact O-N 3.16Å; C451-K454 PolarHBondContact O-N 3.16Å; A452-K454 VanDerWaalsContact C-N 3.26Å; A452-K454 PolarHBondContact O-N 2.98Å
455	Y	91.1	Very high	92.5	Very high	23 Å²	23	67.8 Å²	67.8	9%	0.09	35%	0.35	C	S	.	.	H	α-helix	trans	-105.1	-9.9	-170.7	-55.5	-63.7	0	0	0	113.7	C380 Y382 L394 C451 R457 D458 W459	C380-Y455 HydrophobicContact CB-CD1 3.73Å; C380-Y455 HydrophobicContact CB-CE1 4.23Å; C380-Y455 HydrophobicContact CB-CG 4.4Å; Y382-Y455 HydrophobicContact CD1-CD1 4.16Å; Y382-Y455 AromaticContact CD1-CE1 3.7Å; Y382-Y455 HydrophobicContact CD1-CE1 3.7Å; Y382-Y455 HydrophobicContact CE1-CE1 4.18Å; Y382-Y455 HydrophobicContact CG-CE1 4.43Å; L394-Y455 HydrophobicContact CD1-CD2 4.3Å; L394-Y455 HydrophobicContact CD2-CD2 4.42Å; L394-Y455 HydrophobicContact CD2-CE2 3.97Å; C451-Y455 HydrophobicContact CB-CD2 4.17Å; C451-Y455 HydrophobicContact CB-CE2 4.38Å; C451-Y455 WeakPolarHBondContact O-CD2 3.37Å; C451-Y455 PolarHBondContact O-N 3.41Å; Y455-R457 PolarHBondContact O-N 2.84Å; Y455-D458 PolarHBondContact O-N 3.48Å; Y455-W459 HydrophobicContact CD2-CE3 4.3Å
456	G	92.2	Very high	92.7	Very high	33 Å²	33	64.3 Å²	64.3	34%	0.34	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.9	-121.9	175.6	0	0	0	0	0	112.8	A452 D458 W459 E460	A452-G456 WeakPolarHBondContact O-CA 3.38Å; A452-G456 PolarHBondContact O-N 2.82Å; G456-D458 PolarHBondContact O-N 2.79Å; G456-W459 WeakPolarHBondContact O-CA 3.4Å; G456-W459 VanDerWaalsContact O-CB 3.22Å; G456-W459 WeakPolarHBondContact O-CB 3.13Å; G456-W459 PolarHBondContact O-N 3.13Å; G456-E460 PolarHBondContact O-N 3.21Å
457	R	94.3	Very high	93.1	Very high	204 Å²	204	64.7 Å²	64.7	77%	0.77	34%	0.343	S	S	*	.	H	α-helix	trans	-59	-30.8	-179.6	-67.7	-174.2	-178.7	179.6	0.5	114	Y455 W459 E460 R461	Y455-R457 PolarHBondContact O-N 2.84Å; R457-W459 VanDerWaalsContact C-N 3.26Å; R457-W459 PolarHBondContact O-N 3.41Å; R457-E460 WeakPolarHBondContact O-CB 3.47Å; R457-E460 PolarHBondContact O-N 3.29Å; R457-R461 WeakPolarHBondContact O-CG 3.23Å; R457-R461 PolarHBondContact O-N 3.09Å; R457-R461 VanDerWaalsContact O-N 3.08Å
458	D	95.3	Very high	93.6	Very high	30 Å²	30	66.7 Å²	66.7	16%	0.16	35%	0.348	C	S	.	.	H	α-helix	trans	-70.7	-27.8	177	-65.9	-39.8	0	0	0	111.3	C380 S381 Y455 G456 R461 Y462	C380-D458 VanDerWaalsContact CA-OD2 3.32Å; C380-D458 WeakPolarHBondContact CA-OD2 3.33Å; C380-D458 HydrophobicContact CB-CB 3.94Å; C380-D458 VanDerWaalsContact SG-CB 3.6Å; S381-D458 PolarHBondContact N-OD2 3.17Å; Y455-D458 PolarHBondContact O-N 3.48Å; G456-D458 PolarHBondContact O-N 2.79Å; D458-R461 IonicContact OD1-NH1 3.85Å; D458-R461 PolarHBondContact OD1-NH1 3.41Å; D458-Y462 PolarHBondContact O-N 3Å; D458-Y462 VanDerWaalsContact O-N 3.09Å
459	W	96	Very high	93.7	Very high	20 Å²	20	69.7 Å²	69.7	8%	0.076	36%	0.358	C	S	.	.	H	α-helix	trans	-68.8	-41	169.6	-171.2	-115.1	0	0	0	112.1	L394 E448 C451 A452 Y455 G456 R457 R461 Y462 T463	L394-W459 HydrophobicContact CD1-CE3 3.86Å; L394-W459 HydrophobicContact CD1-CZ3 4.19Å; E448-W459 HydrophobicContact CB-CZ2 4.17Å; E448-W459 HydrophobicContact CG-CZ2 4.02Å; C451-W459 HydrophobicContact CB-CD2 3.71Å; C451-W459 HydrophobicContact CB-CE3 3.62Å; C451-W459 HydrophobicContact CB-CH2 3.64Å; C451-W459 HydrophobicContact CB-CZ2 3.75Å; C451-W459 HydrophobicContact CB-CZ3 3.58Å; A452-W459 VanDerWaalsContact CA-CD1 3.45Å; A452-W459 HydrophobicContact CB-CG 4.29Å; Y455-W459 HydrophobicContact CD2-CE3 4.3Å; G456-W459 WeakPolarHBondContact O-CA 3.4Å; G456-W459 VanDerWaalsContact O-CB 3.22Å; G456-W459 WeakPolarHBondContact O-CB 3.13Å; G456-W459 PolarHBondContact O-N 3.13Å; R457-W459 VanDerWaalsContact C-N 3.26Å; R457-W459 PolarHBondContact O-N 3.41Å; W459-R461 VanDerWaalsContact C-N 3.27Å; W459-R461 PolarHBondContact O-N 3.45Å; W459-Y462 HydrophobicContact CD2-CD1 4.32Å; W459-Y462 AromaticContact CE3-CD1 3.62Å; W459-Y462 HydrophobicContact CE3-CD1 3.62Å; W459-Y462 HydrophobicContact CE3-CE1 4.38Å; W459-Y462 HydrophobicContact CE3-CG 4.18Å; W459-Y462 AromaticContact CH2-CD1 3.6Å; W459-Y462 HydrophobicContact CH2-CD1 3.6Å; W459-Y462 AromaticContact CH2-CE1 3.63Å; W459-Y462 HydrophobicContact CH2-CE1 3.63Å; W459-Y462 HydrophobicContact CZ2-CD1 4.27Å; W459-Y462 AromaticContact CZ3-CD1 3.22Å; W459-Y462 HydrophobicContact CZ3-CD1 3.22Å; W459-Y462 AromaticContact CZ3-CE1 3.53Å; W459-Y462 HydrophobicContact CZ3-CE1 3.53Å; W459-Y462 HydrophobicContact CZ3-CG 4.09Å; W459-Y462 CarbonylContact O-C 3.57Å; W459-Y462 WeakPolarHBondContact O-CA 3.36Å; W459-Y462 WeakPolarHBondContact O-CB 3.32Å; W459-Y462 PolarHBondContact O-N 3.24Å; W459-T463 HydrophobicContact CD2-CG2 4.29Å; W459-T463 HydrophobicContact CG-CG2 4.41Å; W459-T463 HydrophobicContact CZ2-CG2 4.19Å; W459-T463 WeakPolarHBondContact O-CG2 3.5Å; W459-T463 PolarHBondContact O-N 3.41Å; W459-T463 PolarHBondContact O-OG1 3.48Å
460	E	96.3	Very high	93.9	Very high	125 Å²	125	63.8 Å²	63.8	58%	0.584	33%	0.331	S	S	*	.	H	α-helix	trans	-60	-40	175.5	-64.2	171.1	178.5	0	0	111.4	G456 R457 Y462 T463 A464	G456-E460 PolarHBondContact O-N 3.21Å; R457-E460 WeakPolarHBondContact O-CB 3.47Å; R457-E460 PolarHBondContact O-N 3.29Å; E460-Y462 VanDerWaalsContact C-N 3.31Å; E460-Y462 PolarHBondContact O-N 2.75Å; E460-T463 PolarHBondContact O-N 2.88Å; E460-T463 PolarHBondContact O-OG1 3.1Å; E460-T463 VanDerWaalsContact O-OG1 3.08Å; E460-A464 WeakPolarHBondContact O-CB 3.48Å; E460-A464 PolarHBondContact O-N 2.72Å
461	R	96.7	Very high	94.2	Very high	147 Å²	147	63.5 Å²	63.5	56%	0.555	34%	0.336	S	S	*	.	H	α-helix	trans	-63.3	-38.3	172.8	-67.9	172	66.2	-160.4	3.4	111.8	I378 R457 D458 W459 A465	I378-R461 HydrophobicContact CD1-CB 4.22Å; R457-R461 WeakPolarHBondContact O-CG 3.23Å; R457-R461 PolarHBondContact O-N 3.09Å; R457-R461 VanDerWaalsContact O-N 3.08Å; D458-R461 IonicContact OD1-NH1 3.85Å; D458-R461 PolarHBondContact OD1-NH1 3.41Å; W459-R461 VanDerWaalsContact C-N 3.27Å; W459-R461 PolarHBondContact O-N 3.45Å; R461-A465 WeakPolarHBondContact O-CB 3.43Å; R461-A465 PolarHBondContact O-N 2.86Å
462	Y	96.9	Very high	94.3	Very high	9 Å²	9	65.3 Å²	65.3	4%	0.035	35%	0.347	C	S	.	.	H	α-helix	trans	-67	-46.1	176.8	-178.8	-103.5	0	0	0	112.5	I378 L394 L395 V396 R404 D458 W459 E460 A464 A465 V466	I378-Y462 HydrophobicContact CD1-CD2 4.3Å; L394-Y462 HydrophobicContact CB-CD2 3.7Å; L394-Y462 HydrophobicContact CB-CE2 4.02Å; L394-Y462 HydrophobicContact CB-CG 4.37Å; L394-Y462 HydrophobicContact CD1-CD1 4.48Å; L394-Y462 HydrophobicContact CD1-CD2 4.08Å; L394-Y462 HydrophobicContact CD1-CG 3.88Å; L394-Y462 HydrophobicContact CG-CD2 4.49Å; L395-Y462 WeakPolarHBondContact O-CE2 3.39Å; V396-Y462 HydrophobicContact CG1-CD2 3.31Å; V396-Y462 HydrophobicContact CG1-CE2 3.42Å; V396-Y462 VanDerWaalsContact CG1-CE2 3.42Å; R404-Y462 HydrophobicContact CB-CE1 4.14Å; R404-Y462 VanDerWaalsContact CD-CE1 3.49Å; R404-Y462 HydrophobicContact CG-CD1 4.28Å; R404-Y462 HydrophobicContact CG-CE1 3.54Å; D458-Y462 PolarHBondContact O-N 3Å; D458-Y462 VanDerWaalsContact O-N 3.09Å; W459-Y462 HydrophobicContact CD2-CD1 4.32Å; W459-Y462 AromaticContact CE3-CD1 3.62Å; W459-Y462 HydrophobicContact CE3-CD1 3.62Å; W459-Y462 HydrophobicContact CE3-CE1 4.38Å; W459-Y462 HydrophobicContact CE3-CG 4.18Å; W459-Y462 AromaticContact CH2-CD1 3.6Å; W459-Y462 HydrophobicContact CH2-CD1 3.6Å; W459-Y462 AromaticContact CH2-CE1 3.63Å; W459-Y462 HydrophobicContact CH2-CE1 3.63Å; W459-Y462 HydrophobicContact CZ2-CD1 4.27Å; W459-Y462 AromaticContact CZ3-CD1 3.22Å; W459-Y462 HydrophobicContact CZ3-CD1 3.22Å; W459-Y462 AromaticContact CZ3-CE1 3.53Å; W459-Y462 HydrophobicContact CZ3-CE1 3.53Å; W459-Y462 HydrophobicContact CZ3-CG 4.09Å; W459-Y462 CarbonylContact O-C 3.57Å; W459-Y462 WeakPolarHBondContact O-CA 3.36Å; W459-Y462 WeakPolarHBondContact O-CB 3.32Å; W459-Y462 PolarHBondContact O-N 3.24Å; E460-Y462 VanDerWaalsContact C-N 3.31Å; E460-Y462 PolarHBondContact O-N 2.75Å; Y462-A464 VanDerWaalsContact C-N 3.31Å; Y462-A464 PolarHBondContact O-N 2.92Å; Y462-A465 PolarHBondContact O-N 3.26Å; Y462-V466 HydrophobicContact CE2-CG2 4.48Å; Y462-V466 PolarHBondContact O-N 2.99Å
463	T	96.7	Very high	94.3	Very high	40 Å²	40	66.3 Å²	66.3	25%	0.245	36%	0.362	C	S	.	.	H	α-helix	trans	-69	-29.8	177.9	58.1	0	0	0	0	112.2	W459 E460 V466 P467	W459-T463 HydrophobicContact CD2-CG2 4.29Å; W459-T463 HydrophobicContact CG-CG2 4.41Å; W459-T463 HydrophobicContact CZ2-CG2 4.19Å; W459-T463 WeakPolarHBondContact O-CG2 3.5Å; W459-T463 PolarHBondContact O-N 3.41Å; W459-T463 PolarHBondContact O-OG1 3.48Å; E460-T463 PolarHBondContact O-N 2.88Å; E460-T463 PolarHBondContact O-OG1 3.1Å; E460-T463 VanDerWaalsContact O-OG1 3.08Å; T463-V466 CarbonylContact O-C 3.45Å; T463-V466 VanDerWaalsContact O-C 3.31Å; T463-P467 WeakPolarHBondContact O-CA 3.07Å
464	A	96.8	Very high	94.5	Very high	80 Å²	80	68.7 Å²	68.7	66%	0.661	37%	0.365	S	S	*	.	H	α-helix	trans	-67.8	-38.5	170.3	0	0	0	0	0	112.5	E460 Y462	E460-A464 WeakPolarHBondContact O-CB 3.48Å; E460-A464 PolarHBondContact O-N 2.72Å; Y462-A464 VanDerWaalsContact C-N 3.31Å; Y462-A464 PolarHBondContact O-N 2.92Å
465	A	96.8	Very high	94.6	Very high	58 Å²	58	68.2 Å²	68.2	48%	0.479	36%	0.364	S	S	.	.	H	α-helix	trans	-73.6	-34.1	178.9	0	0	0	0	0	113.1	I378 V396 R461 Y462	I378-A465 HydrophobicContact CD1-CB 4.3Å; V396-A465 HydrophobicContact CG1-CB 4.22Å; R461-A465 WeakPolarHBondContact O-CB 3.43Å; R461-A465 PolarHBondContact O-N 2.86Å; Y462-A465 PolarHBondContact O-N 3.26Å
466	V	97.3	Very high	94.8	Very high	2 Å²	2	70.5 Å²	70.5	1%	0.012	38%	0.377	C	S	.	.	S	Bend	trans	-129.5	84.3	-179.4	-173.1	0	0	0	0	107.5	V396 W400 R404 Y462 T463 Y468	V396-V466 HydrophobicContact CB-CG2 4.11Å; V396-V466 HydrophobicContact CG1-CG2 3.99Å; W400-V466 WeakPolarHBondContact O-CG2 3.23Å; R404-V466 WeakPolarHBondContact CD-O 3.41Å; R404-V466 HydrophobicContact CG-CB 4.03Å; R404-V466 HydrophobicContact CG-CG1 3.79Å; R404-V466 WeakPolarHBondContact CG-O 3.39Å; R404-V466 PolarHBondContact NH1-O 3.23Å; Y462-V466 HydrophobicContact CE2-CG2 4.48Å; Y462-V466 PolarHBondContact O-N 2.99Å; T463-V466 CarbonylContact O-C 3.45Å; T463-V466 VanDerWaalsContact O-C 3.31Å; V466-Y468 PolarHBondContact O-N 2.85Å
467	P	96.1	Very high	94.9	Very high	74 Å²	74	72.5 Å²	72.5	48%	0.481	38%	0.379	S	S	.	.			trans	-72	-25.8	-167.5	26.3	-34.5	0	0	0	114.6	R404 T463	R404-P467 PolarHBondContact NH1-O 3.45Å; T463-P467 WeakPolarHBondContact O-CA 3.07Å
468	Y	97.3	Very high	95	Very high	92 Å²	92	65.2 Å²	65.2	36%	0.361	36%	0.358	S	S	.	.			trans	-89.1	139.8	-175.7	-49.3	-67.3	0	0	0	112.4	A403 R404 V466 P472 G473	A403-Y468 WeakPolarHBondContact CA-O 3.26Å; R404-Y468 PolarHBondContact N-O 3.36Å; V466-Y468 PolarHBondContact O-N 2.85Å; Y468-P472 HydrophobicContact CD2-CB 3.81Å; Y468-P472 HydrophobicContact CD2-CG 4.41Å; Y468-P472 HydrophobicContact CE2-CB 4.1Å; Y468-P472 HydrophobicContact CG-CB 4.22Å; Y468-G473 VanDerWaalsContact CD1-N 3.27Å
469	R	95.1	Very high	95	Very high	75 Å²	75	67.2 Å²	67.2	28%	0.283	37%	0.369	S	S	.	.	S	Bend	trans	-78	-53.7	175.7	-68.3	-177.9	169.1	122.8	0.1	111.4	H405 E448 F475	H405-R469 WeakPolarHBondContact CA-O 3.37Å; H405-R469 WeakPolarHBondContact CB-O 3.05Å; H405-R469 PolarHBondContact N-O 3.24Å; E448-R469 WeakPolarHBondContact OE1-CG 3.43Å; E448-R469 IonicContact OE1-NE 3.42Å; E448-R469 IonicContact OE2-CZ 2.75Å; E448-R469 IonicContact OE2-NE 3.22Å; E448-R469 PolarHBondContact OE2-NE 3.22Å; E448-R469 IonicContact OE2-NH2 2.69Å; E448-R469 PolarHBondContact OE2-NH2 3.34Å; R469-F475 HydrophobicContact CB-CD1 3.77Å; R469-F475 HydrophobicContact CB-CE1 3.84Å; R469-F475 HydrophobicContact CB-CG 4.45Å; R469-F475 WeakPolarHBondContact CB-O 3.44Å; R469-F475 HydrophobicContact CG-CD1 4.41Å; R469-F475 HydrophobicContact CG-CE1 4.2Å; R469-F475 HydrophobicContact CG-CZ 4.45Å; R469-F475 PolarHBondContact N-O 3.25Å; R469-F475 PolarHBondContact N-OXT 3.32Å; R469-F475 VanDerWaalsContact NH1-CE2 3.34Å
470	L	93.1	Very high	94.9	Very high	10 Å²	10	70.2 Å²	70.2	5%	0.052	39%	0.388	C	S	.	.	S	Bend	trans	-126.4	-73.1	-171.9	-70.8	175.5	0	0	0	110.8	A403 H405 Y408 V409 P472 F475	A403-L470 VanDerWaalsContact CB-O 3.24Å; A403-L470 WeakPolarHBondContact CB-O 3.47Å; H405-L470 HydrophobicContact CB-CD2 3.94Å; Y408-L470 HydrophobicContact CD2-CD2 4Å; Y408-L470 HydrophobicContact CG-CD2 4.27Å; V409-L470 HydrophobicContact CG2-CB 4.26Å; V409-L470 HydrophobicContact CG2-CD2 4.47Å; V409-L470 WeakPolarHBondContact CG2-O 2.97Å; L470-P472 WeakPolarHBondContact O-CD 3.39Å; L470-F475 HydrophobicContact CB-CD1 4.31Å; L470-F475 HydrophobicContact CD1-CD1 4.01Å; L470-F475 HydrophobicContact CD1-CE1 4.24Å; L470-F475 HydrophobicContact CG-CD1 4.23Å; L470-F475 PolarHBondContact N-OXT 3.12Å
471	L	92.9	Very high	94.8	Very high	78 Å²	78	66.5 Å²	66.5	41%	0.408	38%	0.375	S	S	.	.	S	Bend	trans	-104.1	112.8	-172.2	-71.4	178	0	0	0	109.2	V409 G473 I474 F475	V409-L471 HydrophobicContact CG1-CD2 3.83Å; V409-L471 HydrophobicContact CG2-CD2 3.95Å; L471-G473 PolarHBondContact O-N 3.34Å; L471-I474 HydrophobicContact CB-CB 4.09Å; L471-I474 HydrophobicContact CB-CD1 4.2Å; L471-I474 HydrophobicContact CB-CG1 4.47Å; L471-I474 HydrophobicContact CD1-CD1 4.13Å; L471-I474 PolarHBondContact O-N 3.38Å; L471-F475 PolarHBondContact N-OXT 3.35Å; L471-F475 PolarHBondContact O-N 3.24Å; L471-F475 VanDerWaalsContact O-N 3.11Å
472	P	92.1	Very high	94.7	Very high	60 Å²	60	60.8 Å²	60.8	39%	0.39	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.7	128.8	178	-27.2	35.4	0	0	0	112.3	V402 F406 Y468 L470 I474	V402-P472 HydrophobicContact CG1-CG 3.59Å; F406-P472 HydrophobicContact CE2-CG 4.41Å; Y468-P472 HydrophobicContact CD2-CB 3.81Å; Y468-P472 HydrophobicContact CD2-CG 4.41Å; Y468-P472 HydrophobicContact CE2-CB 4.1Å; Y468-P472 HydrophobicContact CG-CB 4.22Å; L470-P472 WeakPolarHBondContact O-CD 3.39Å; P472-I474 VanDerWaalsContact C-N 3.33Å
473	G	91.4	Very high	94.5	Very high	60 Å²	60	64.8 Å²	64.8	62%	0.619	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.6	-5.6	-178.4	0	0	0	0	0	115.7	Y468 L471	Y468-G473 VanDerWaalsContact CD1-N 3.27Å; L471-G473 PolarHBondContact O-N 3.34Å
474	I	92.6	Very high	94.3	Very high	139 Å²	139	66.8 Å²	66.8	71%	0.713	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119	-58.7	-178.9	-57.6	175.2	0	0	0	111	L471 P472	L471-I474 HydrophobicContact CB-CB 4.09Å; L471-I474 HydrophobicContact CB-CD1 4.2Å; L471-I474 HydrophobicContact CB-CG1 4.47Å; L471-I474 HydrophobicContact CD1-CD1 4.13Å; L471-I474 PolarHBondContact O-N 3.38Å; P472-I474 VanDerWaalsContact C-N 3.33Å
475	F	90.4	Very high	94.1	Very high	74 Å²	74	65.6 Å²	65.6	33%	0.325	38%	0.375	S	S	.	.			trans	-151.8	0	-174.7	-176.6	-110.3	0	0	0	110.2	T441 L445 R469 L470 L471	T441-F475 HydrophobicContact CG2-CE1 4.14Å; T441-F475 HydrophobicContact CG2-CZ 4.21Å; L445-F475 HydrophobicContact CD2-CZ 4.25Å; R469-F475 HydrophobicContact CB-CD1 3.77Å; R469-F475 HydrophobicContact CB-CE1 3.84Å; R469-F475 HydrophobicContact CB-CG 4.45Å; R469-F475 WeakPolarHBondContact CB-O 3.44Å; R469-F475 HydrophobicContact CG-CD1 4.41Å; R469-F475 HydrophobicContact CG-CE1 4.2Å; R469-F475 HydrophobicContact CG-CZ 4.45Å; R469-F475 PolarHBondContact N-O 3.25Å; R469-F475 PolarHBondContact N-OXT 3.32Å; R469-F475 VanDerWaalsContact NH1-CE2 3.34Å; L470-F475 HydrophobicContact CB-CD1 4.31Å; L470-F475 HydrophobicContact CD1-CD1 4.01Å; L470-F475 HydrophobicContact CD1-CE1 4.24Å; L470-F475 HydrophobicContact CG-CD1 4.23Å; L470-F475 PolarHBondContact N-OXT 3.12Å; L471-F475 PolarHBondContact N-OXT 3.35Å; L471-F475 PolarHBondContact O-N 3.24Å; L471-F475 VanDerWaalsContact O-N 3.11Å

Retrieved 475 of 475 residues in 92.3 ms (Link to these results)

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