A0A087Y5K0_POEFO Loading...

Mitogen-activated protein kinase kinase kinase 7

AlphaFold DB , UniProt , Accession A0A087Y5K0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 600 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.3	Very low	34.6	Very low	246 Å²	246	141.6 Å²	141.6	100%	1.212	79%	0.792	S	S	*	*				0	130.8	0	-71.5	165.7	171.2	0	0	107.2
2	S	28.9	Very low	34.6	Very low	112 Å²	112	146 Å²	146	78%	0.783	80%	0.802	S	S	*	*			trans	-83.6	140.7	174.4	-170.2	0	0	0	0	109.5
3	Q	30.2	Very low	35.2	Very low	194 Å²	194	141.7 Å²	141.7	91%	0.907	78%	0.782	S	S	*	*			trans	-104.4	102.2	167.9	-74.9	-172	-11.9	0	0	108.6
4	T	30.5	Very low	35.6	Very low	127 Å²	127	135.7 Å²	135.7	78%	0.779	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-72.5	126.1	171.8	44.4	0	0	0	0	110.2
5	L	29.9	Very low	35.8	Very low	160 Å²	160	136 Å²	136	84%	0.838	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-69.2	151.8	166	-72	166.8	0	0	0	110.4
6	P	30.9	Very low	36.4	Very low	101 Å²	101	131.8 Å²	131.8	66%	0.656	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-74.6	138.3	-173.7	29.4	-35.1	0	0	0	112.7	S8	P6-S8 PolarHBondContact O-N 3.4Å
7	P	38.8	Very low	37.4	Very low	125 Å²	125	130.8 Å²	130.8	81%	0.812	74%	0.742	S	S	*	*			trans	-89.1	80.5	176.4	34.9	-33.2	0	0	0	111.2
8	S	38.5	Very low	38.8	Very low	95 Å²	95	130.6 Å²	130.6	66%	0.664	75%	0.746	S	S	*	*			trans	-140.5	5.6	-175.9	61.5	0	0	0	0	117.5	P6 M10	P6-S8 PolarHBondContact O-N 3.4Å; S8-M10 PolarHBondContact O-N 3.47Å
9	D	33.3	Very low	40.6	Very low	171 Å²	171	126.2 Å²	126.2	91%	0.914	72%	0.718	S	S	*	*			trans	-90.9	26.7	168.1	-80.6	-24.7	0	0	0	112.3	L11	D9-L11 PolarHBondContact O-N 2.94Å; D9-L11 VanDerWaalsContact O-N 3.12Å
10	M	38.6	Very low	42.8	Very low	130 Å²	130	124.1 Å²	124.1	64%	0.64	70%	0.702	S	S	*	*			trans	-77.7	96.5	176.7	-80	-168.2	64.3	0	0	111.5	S8 E12	S8-M10 PolarHBondContact O-N 3.47Å; M10-E12 PolarHBondContact O-N 3.12Å; M10-E12 VanDerWaalsContact O-N 3.09Å
11	L	46.3	Very low	45.1	Very low	97 Å²	97	123.9 Å²	123.9	51%	0.508	70%	0.695	S	S	.	*			trans	35.3	65	146.7	-67.7	167.2	0	0	0	115.4	D9 T13 L69	D9-L11 PolarHBondContact O-N 2.94Å; D9-L11 VanDerWaalsContact O-N 3.12Å; L11-T13 PolarHBondContact O-N 2.61Å; L11-L69 HydrophobicContact CD2-CD2 4.4Å
12	E	34.9	Very low	48	Very low	194 Å²	194	112.4 Å²	112.4	91%	0.907	64%	0.639	S	S	*	*			trans	-63.5	102.5	162.8	-77.3	-160.2	143.7	0	0	108.8	M10 P14	M10-E12 PolarHBondContact O-N 3.12Å; M10-E12 VanDerWaalsContact O-N 3.09Å; E12-P14 WeakPolarHBondContact O-CD 3.46Å
13	T	43	Very low	51	Low	90 Å²	90	112 Å²	112	55%	0.552	63%	0.628	S	S	*	*			trans	-70	125	178.9	44.7	0	0	0	0	109.4	L11 P15 F19	L11-T13 PolarHBondContact O-N 2.61Å; T13-P15 WeakPolarHBondContact O-CD 3.36Å; T13-P15 VanDerWaalsContact O-N 3.16Å; T13-F19 HydrophobicContact CG2-CE1 4.21Å; T13-F19 HydrophobicContact CG2-CZ 3.8Å
14	P	40.7	Very low	54.1	Low	58 Å²	58	106.3 Å²	106.3	38%	0.377	60%	0.598	S	S	.	*			trans	-60	120.9	177	-24.3	34.5	0	0	0	110.1	E12 G16	E12-P14 WeakPolarHBondContact O-CD 3.46Å; P14-G16 PolarHBondContact O-N 2.64Å; P14-G16 VanDerWaalsContact O-N 3.09Å
15	P	37.7	Very low	57.1	Low	140 Å²	140	109.4 Å²	109.4	91%	0.909	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.7	113.9	-174.6	25.3	-33.6	0	0	0	110.4	T13	T13-P15 WeakPolarHBondContact O-CD 3.36Å; T13-P15 VanDerWaalsContact O-N 3.16Å
16	G	46.3	Very low	60.2	Low	68 Å²	68	105.7 Å²	105.7	70%	0.701	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	150.4	-12.6	172.1	0	0	0	0	0	117.4	P14	P14-G16 PolarHBondContact O-N 2.64Å; P14-G16 VanDerWaalsContact O-N 3.09Å
17	Y	52.6	Low	63.4	Low	115 Å²	115	101.5 Å²	101.5	45%	0.451	56%	0.557	S	S	.	*			trans	-125	130.9	-175.9	-76.5	-96.1	0	0	0	113.2	F19 S73 R74 N76	Y17-F19 PolarHBondContact O-N 2.9Å; Y17-S73 WeakPolarHBondContact CB-O 3.31Å; Y17-S73 VanDerWaalsContact CD1-O 3.29Å; Y17-S73 WeakPolarHBondContact CD1-O 3.49Å; Y17-R74 PolarHBondContact OH-O 2.77Å; Y17-N76 HydrophobicContact CE1-CB 4.49Å
18	P	62.5	Low	66.1	Low	127 Å²	127	101.9 Å²	101.9	83%	0.825	55%	0.548	S	S	*	.			trans	-87.1	95.3	-177.9	33.8	-33.1	0	0	0	111.5
19	F	73.1	Confident	68.9	Low	48 Å²	48	100.3 Å²	100.3	21%	0.211	53%	0.534	C	S	.	.			trans	-114.3	136.9	157.4	73.2	-86.6	0	0	0	109	T13 Y17 L69 S73 L83	T13-F19 HydrophobicContact CG2-CE1 4.21Å; T13-F19 HydrophobicContact CG2-CZ 3.8Å; Y17-F19 PolarHBondContact O-N 2.9Å; F19-L69 HydrophobicContact CD2-CD1 4.14Å; F19-L69 HydrophobicContact CE2-CD1 3.84Å; F19-L69 HydrophobicContact CE2-CG 4.46Å; F19-L69 HydrophobicContact CZ-CD1 4.32Å; F19-S73 VanDerWaalsContact CD1-CB 3.4Å; F19-S73 VanDerWaalsContact CE1-CB 3.47Å; F19-L83 HydrophobicContact CB-CD2 3.86Å; F19-L83 HydrophobicContact CB-CG 4.33Å; F19-L83 HydrophobicContact CD2-CD2 4.48Å; F19-L83 HydrophobicContact CG-CD2 4.16Å
20	E	86	Confident	71.9	Confident	84 Å²	84	96.1 Å²	96.1	39%	0.393	51%	0.509	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	142.1	-173.6	-161.9	173.3	157.3	0	0	110.9	I22 W46 K47 Y84 G85 S86	E20-I22 HydrophobicContact CB-CD1 4.39Å; E20-I22 HydrophobicContact CB-CG1 3.96Å; E20-I22 HydrophobicContact CG-CG1 4.18Å; E20-I22 PolarHBondContact O-N 3.19Å; E20-W46 VanDerWaalsContact OE2-CH2 3.23Å; E20-W46 WeakPolarHBondContact OE2-CH2 3.33Å; E20-W46 VanDerWaalsContact OE2-CZ2 3.29Å; E20-W46 WeakPolarHBondContact OE2-CZ2 3.47Å; E20-K47 IonicContact OE1-NZ 2.64Å; E20-K47 PolarHBondContact OE1-NZ 3.28Å; E20-K47 IonicContact OE2-NZ 2.77Å; E20-K47 PolarHBondContact OE2-NZ 3.2Å; E20-Y84 PolarHBondContact N-O 3.27Å; E20-G85 CarbonylContact O-C 3.42Å; E20-G85 WeakPolarHBondContact O-CA 3.43Å; E20-S86 PolarHBondContact O-N 2.82Å
21	E	90.6	Very high	74.4	Confident	119 Å²	119	95.6 Å²	95.6	56%	0.556	51%	0.505	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.8	114.1	161.8	-175.6	173.6	153.6	0	0	107.6	K88	E21-K88 VanDerWaalsContact OE1-CD 3.28Å; E21-K88 WeakPolarHBondContact OE1-CD 3.35Å; E21-K88 WeakPolarHBondContact OE1-CE 3.48Å; E21-K88 IonicContact OE1-NZ 2.82Å; E21-K88 PolarHBondContact OE1-NZ 3.02Å; E21-K88 WeakPolarHBondContact OE2-CE 3.31Å; E21-K88 IonicContact OE2-NZ 3.63Å; E21-K88 PolarHBondContact OE2-NZ 3.2Å
22	I	93.9	Very high	76.6	Confident	6 Å²	6	95.1 Å²	95.1	3%	0.031	51%	0.506	C	S	.	.			trans	-106	135.4	-169.2	-65	169.2	0	0	0	109.2	E20 I27 W46 S86 C87 V94	E20-I22 HydrophobicContact CB-CD1 4.39Å; E20-I22 HydrophobicContact CB-CG1 3.96Å; E20-I22 HydrophobicContact CG-CG1 4.18Å; E20-I22 PolarHBondContact O-N 3.19Å; I22-I27 HydrophobicContact CG2-CD1 3.89Å; I22-I27 HydrophobicContact CG2-CG1 4.06Å; I22-W46 HydrophobicContact CD1-CD2 4.22Å; I22-W46 HydrophobicContact CD1-CH2 3.9Å; I22-W46 HydrophobicContact CD1-CZ2 3.45Å; I22-W46 VanDerWaalsContact CD1-CZ2 3.45Å; I22-W46 HydrophobicContact CD1-CZ3 4.46Å; I22-W46 HydrophobicContact CG1-CH2 4.44Å; I22-W46 HydrophobicContact CG1-CZ2 3.64Å; I22-S86 PolarHBondContact N-O 3.37Å; I22-C87 WeakPolarHBondContact O-CA 3.49Å; I22-C87 PolarHBondContact O-SG 3.07Å; I22-V94 HydrophobicContact CD1-CB 3.77Å; I22-V94 HydrophobicContact CD1-CG1 4.03Å; I22-V94 HydrophobicContact CD1-CG2 3.75Å
23	N	93.4	Very high	79.1	Confident	103 Å²	103	89 Å²	89	55%	0.551	48%	0.482	S	S	*	.			trans	-73.8	130.5	168.5	-44.7	-68	0	0	0	108.1	E25 D26	N23-E25 PolarHBondContact O-N 3.5Å; N23-D26 WeakPolarHBondContact CB-OD2 3.23Å; N23-D26 PolarHBondContact ND2-OD2 2.66Å; N23-D26 WeakPolarHBondContact O-CB 3.47Å; N23-D26 PolarHBondContact O-N 2.82Å
24	Y	94.6	Very high	80.9	Confident	75 Å²	75	86.1 Å²	86.1	29%	0.294	47%	0.47	S	S	.	.	G	3₁₀ helix	trans	-64.3	-23.2	178.4	-171.1	-94	0	0	0	112.6	D26 I27 I53 C87 P90	Y24-D26 PolarHBondContact O-N 2.8Å; Y24-I27 HydrophobicContact CD2-CD1 4.43Å; Y24-I27 WeakPolarHBondContact O-CB 3.29Å; Y24-I27 PolarHBondContact O-N 2.89Å; Y24-I53 HydrophobicContact CE2-CD1 4.26Å; Y24-C87 HydrophobicContact CD2-CB 4.35Å; Y24-P90 HydrophobicContact CD1-CG 4.14Å; Y24-P90 HydrophobicContact CD2-CG 3.58Å; Y24-P90 HydrophobicContact CE1-CG 4.02Å; Y24-P90 HydrophobicContact CE2-CG 3.44Å; Y24-P90 VanDerWaalsContact CE2-CG 3.44Å; Y24-P90 HydrophobicContact CG-CG 3.92Å
25	E	94.4	Very high	82.6	Confident	191 Å²	191	91.1 Å²	91.1	89%	0.893	48%	0.481	S	S	*	.	G	3₁₀ helix	trans	-67.2	-20.2	173.9	-61.6	178.5	-176	0	0	113.2	N23 I27	N23-E25 PolarHBondContact O-N 3.5Å; E25-I27 PolarHBondContact O-N 2.93Å
26	D	95	Very high	83.8	Confident	83 Å²	83	86.7 Å²	86.7	44%	0.444	46%	0.461	S	S	.	.	G	3₁₀ helix	trans	-81.9	4.9	174	-61.5	-44.6	0	0	0	112.9	N23 Y24	N23-D26 WeakPolarHBondContact CB-OD2 3.23Å; N23-D26 PolarHBondContact ND2-OD2 2.66Å; N23-D26 WeakPolarHBondContact O-CB 3.47Å; N23-D26 PolarHBondContact O-N 2.82Å; Y24-D26 PolarHBondContact O-N 2.8Å
27	I	96.7	Very high	84.3	Confident	12 Å²	12	86.7 Å²	86.7	6%	0.062	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	112.6	-173	-54.4	-178.1	0	0	0	111.1	I22 Y24 E25 V29 A44 K45 I53 C87 V94	I22-I27 HydrophobicContact CG2-CD1 3.89Å; I22-I27 HydrophobicContact CG2-CG1 4.06Å; Y24-I27 HydrophobicContact CD2-CD1 4.43Å; Y24-I27 WeakPolarHBondContact O-CB 3.29Å; Y24-I27 PolarHBondContact O-N 2.89Å; E25-I27 PolarHBondContact O-N 2.93Å; I27-V29 HydrophobicContact CG2-CG2 4.19Å; I27-V29 PolarHBondContact O-N 2.81Å; I27-A44 HydrophobicContact CG2-CB 3.63Å; I27-K45 WeakPolarHBondContact CA-O 3.42Å; I27-I53 HydrophobicContact CD1-CG2 4.27Å; I27-I53 HydrophobicContact CG2-CD1 4.44Å; I27-I53 HydrophobicContact CG2-CG2 4.14Å; I27-C87 VanDerWaalsContact CD1-SG 3.55Å; I27-V94 HydrophobicContact CD1-CG2 3.72Å
28	E	96.9	Very high	84.9	Confident	134 Å²	134	83.4 Å²	83.4	63%	0.626	44%	0.442	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.6	97.4	171.9	-65.9	172.8	-174.4	0	0	109.3	A44 K45	E28-A44 CarbonylContact O-C 3.58Å; E28-A44 WeakPolarHBondContact O-CA 3.19Å; E28-A44 VanDerWaalsContact O-CB 3.3Å; E28-A44 WeakPolarHBondContact O-CB 3.13Å; E28-K45 HydrophobicContact CB-CB 4.24Å; E28-K45 PolarHBondContact N-O 2.81Å; E28-K45 PolarHBondContact O-N 3.44Å
29	V	96.3	Very high	85.5	Confident	62 Å²	62	77.6 Å²	77.6	38%	0.376	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	132.2	179.5	-171.5	0	0	0	0	111.1	I27 C42 I53	I27-V29 HydrophobicContact CG2-CG2 4.19Å; I27-V29 PolarHBondContact O-N 2.81Å; V29-C42 HydrophobicContact CG1-CB 3.96Å; V29-I53 HydrophobicContact CB-CD1 4.5Å; V29-I53 HydrophobicContact CG1-CD1 4.09Å; V29-I53 HydrophobicContact CG2-CD1 3.66Å
30	E	95.6	Very high	86.2	Confident	83 Å²	83	75.8 Å²	75.8	39%	0.388	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	-113.9	177.2	-59.9	-173.2	156	0	0	110.5	K43 K45	E30-K43 HydrophobicContact CB-CB 4.41Å; E30-K43 PolarHBondContact N-O 2.86Å; E30-K43 VanDerWaalsContact OE2-CD 3.29Å; E30-K43 WeakPolarHBondContact OE2-CD 3.3Å; E30-K43 WeakPolarHBondContact OE2-CG 3.29Å; E30-K43 IonicContact OE2-NZ 2.8Å; E30-K43 PolarHBondContact OE2-NZ 3.25Å; E30-K45 IonicContact OE1-NZ 2.61Å; E30-K45 PolarHBondContact OE1-NZ 2.83Å
31	E	92.9	Very high	86.4	Confident	118 Å²	118	73.3 Å²	73.3	55%	0.551	39%	0.389	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.9	156	-172.5	67.9	-169.9	156	0	0	113.8	V33 C42 K43	E31-V33 HydrophobicContact CG-CG1 3.95Å; E31-V33 PolarHBondContact O-N 2.89Å; E31-C42 CarbonylContact O-C 3.45Å; E31-C42 WeakPolarHBondContact O-CA 2.95Å; E31-C42 WeakPolarHBondContact O-CB 3.48Å; E31-K43 HydrophobicContact CG-CB 4.16Å; E31-K43 PolarHBondContact O-N 3.28Å
32	V	92.6	Very high	86.6	Confident	87 Å²	87	68.4 Å²	68.4	53%	0.527	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	114.4	170.8	176.4	0	0	0	0	109	V40	V32-V40 HydrophobicContact CG1-CG1 3.67Å; V32-V40 HydrophobicContact CG2-CG1 4.13Å
33	V	87.4	Confident	86.7	Confident	67 Å²	67	69.5 Å²	69.5	41%	0.406	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	-14	-179.1	-62.9	0	0	0	0	113.4	E31 V41 K43 Y97	E31-V33 HydrophobicContact CG-CG1 3.95Å; E31-V33 PolarHBondContact O-N 2.89Å; V33-V41 HydrophobicContact CG2-CB 4.19Å; V33-V41 HydrophobicContact CG2-CG1 3.76Å; V33-V41 WeakPolarHBondContact CG2-O 3.14Å; V33-V41 PolarHBondContact N-O 3.24Å; V33-K43 HydrophobicContact CG1-CB 3.89Å; V33-Y97 HydrophobicContact CG1-CE2 4.28Å
34	G	79.4	Confident	86.9	Confident	29 Å²	29	64.6 Å²	64.6	30%	0.299	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-171.4	161.5	175.2	0	0	0	0	0	114.6	V41	G34-V41 PolarHBondContact N-O 2.65Å; G34-V41 VanDerWaalsContact N-O 3.1Å; G34-V41 PolarHBondContact O-N 2.94Å
35	R	76.8	Confident	87.1	Confident	163 Å²	163	64.2 Å²	64.2	62%	0.615	35%	0.346	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.2	117.4	168.7	-73.6	177	159.7	-83.9	-10.1	107.2	V40 E57	R35-V40 HydrophobicContact CG-CG2 4.29Å; R35-E57 IonicContact CZ-OE1 2.78Å; R35-E57 VanDerWaalsContact CZ-OE1 3.27Å; R35-E57 IonicContact CZ-OE2 3.8Å; R35-E57 IonicContact NH1-OE1 2.61Å; R35-E57 PolarHBondContact NH1-OE1 2.97Å; R35-E57 IonicContact NH1-OE2 3.82Å; R35-E57 PolarHBondContact NH1-OE2 2.92Å; R35-E57 IonicContact NH2-OE1 2.86Å; R35-E57 PolarHBondContact NH2-OE1 2.94Å
36	G	62.4	Low	87.2	Confident	46 Å²	46	56.2 Å²	56.2	47%	0.474	31%	0.307	S	S	.	.			trans	-87.3	-171.5	-175.6	0	0	0	0	0	112.7	G39	G36-G39 PolarHBondContact N-O 3.48Å
37	A	57.8	Low	87.2	Confident	68 Å²	68	58.6 Å²	58.6	56%	0.562	31%	0.314	S	S	*	.	S	Bend	trans	-70.6	-21	162.4	0	0	0	0	0	112.1
38	F	65.1	Low	87	Confident	46 Å²	46	61.8 Å²	61.8	20%	0.202	35%	0.349	C	S	.	.	S	Bend	trans	-136.6	107.3	177.6	-46.1	-74.8	0	0	0	108.1	K54 E61 A64 T169	F38-K54 WeakPolarHBondContact O-CE 3.37Å; F38-E61 HydrophobicContact CB-CG 4.37Å; F38-E61 HydrophobicContact CD1-CG 4.4Å; F38-A64 HydrophobicContact CD1-CB 3.81Å; F38-A64 HydrophobicContact CD2-CB 4.41Å; F38-A64 HydrophobicContact CE1-CB 4.11Å; F38-A64 HydrophobicContact CG-CB 3.97Å; F38-T169 HydrophobicContact CE2-CG2 4.37Å
39	G	75.6	Confident	86.9	Confident	5 Å²	5	60.8 Å²	60.8	5%	0.052	34%	0.343	C	S	.	.	S	Bend	trans	77.3	178.3	174.1	0	0	0	0	0	117.9	G36 T55 E61	G36-G39 PolarHBondContact N-O 3.48Å; G39-T55 CarbonylContact C-O 3.54Å; G39-T55 WeakPolarHBondContact CA-O 3.28Å; G39-E61 VanDerWaalsContact CA-OE2 3.31Å; G39-E61 WeakPolarHBondContact CA-OE2 3.14Å; G39-E61 PolarHBondContact N-OE2 2.75Å
40	V	86.4	Confident	87	Confident	11 Å²	11	61 Å²	61	7%	0.067	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	142.5	176.2	-179.8	0	0	0	0	109.2	V32 R35 K54 T55 E57	V32-V40 HydrophobicContact CG1-CG1 3.67Å; V32-V40 HydrophobicContact CG2-CG1 4.13Å; R35-V40 HydrophobicContact CG-CG2 4.29Å; V40-K54 CarbonylContact O-C 3.54Å; V40-K54 VanDerWaalsContact O-CA 3.31Å; V40-K54 WeakPolarHBondContact O-CA 3.36Å; V40-T55 PolarHBondContact N-O 2.94Å; V40-T55 PolarHBondContact O-N 3Å; V40-T55 PolarHBondContact O-OG1 3.07Å; V40-E57 HydrophobicContact CG2-CG 3.65Å; V40-E57 WeakPolarHBondContact CG2-OE1 3.45Å
41	V	91.6	Very high	87	Confident	32 Å²	32	57 Å²	57	19%	0.194	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	122.1	169.4	-172.3	0	0	0	0	109.3	V33 G34 A52 I53 K54	V33-V41 HydrophobicContact CG2-CB 4.19Å; V33-V41 HydrophobicContact CG2-CG1 3.76Å; V33-V41 WeakPolarHBondContact CG2-O 3.14Å; V33-V41 PolarHBondContact N-O 3.24Å; G34-V41 PolarHBondContact N-O 2.65Å; G34-V41 VanDerWaalsContact N-O 3.1Å; G34-V41 PolarHBondContact O-N 2.94Å; V41-A52 HydrophobicContact CG1-CB 4.19Å; V41-I53 CarbonylContact C-O 3.58Å; V41-I53 VanDerWaalsContact CA-O 3.28Å; V41-I53 WeakPolarHBondContact CA-O 3.21Å; V41-K54 HydrophobicContact CG2-CB 4.39Å; V41-K54 HydrophobicContact CG2-CG 4.11Å
42	C	94.3	Very high	87.2	Confident	15 Å²	15	51.9 Å²	51.9	10%	0.101	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	149.2	172.9	-53.8	0	0	0	0	111	V29 E31 A52 I53	V29-C42 HydrophobicContact CG1-CB 3.96Å; E31-C42 CarbonylContact O-C 3.45Å; E31-C42 WeakPolarHBondContact O-CA 2.95Å; E31-C42 WeakPolarHBondContact O-CB 3.48Å; C42-A52 WeakPolarHBondContact O-CA 3.43Å; C42-I53 HydrophobicContact CB-CD1 4.28Å; C42-I53 HydrophobicContact CB-CG1 3.81Å; C42-I53 PolarHBondContact N-O 2.66Å; C42-I53 PolarHBondContact O-N 2.85Å
43	K	96.6	Very high	87.3	Confident	29 Å²	29	47.8 Å²	47.8	13%	0.126	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	143.4	158.5	-172.1	177	-171.2	-74.2	0	108.4	E30 E31 V33 D50 Y97	E30-K43 HydrophobicContact CB-CB 4.41Å; E30-K43 PolarHBondContact N-O 2.86Å; E30-K43 VanDerWaalsContact OE2-CD 3.29Å; E30-K43 WeakPolarHBondContact OE2-CD 3.3Å; E30-K43 WeakPolarHBondContact OE2-CG 3.29Å; E30-K43 IonicContact OE2-NZ 2.8Å; E30-K43 PolarHBondContact OE2-NZ 3.25Å; E31-K43 HydrophobicContact CG-CB 4.16Å; E31-K43 PolarHBondContact O-N 3.28Å; V33-K43 HydrophobicContact CG1-CB 3.89Å; K43-D50 IonicContact NZ-OD1 3.75Å; K43-D50 PolarHBondContact NZ-OD1 2.89Å; K43-Y97 HydrophobicContact CB-CD2 4.32Å; K43-Y97 HydrophobicContact CB-CE2 3.84Å; K43-Y97 HydrophobicContact CD-CE1 4.16Å; K43-Y97 HydrophobicContact CD-CE2 3.89Å; K43-Y97 HydrophobicContact CG-CD2 3.98Å; K43-Y97 HydrophobicContact CG-CE2 3.66Å
44	A	97.4	Very high	87.5	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	170.4	175.8	0	0	0	0	0	110.3	I27 E28 D50 V51 I53	I27-A44 HydrophobicContact CG2-CB 3.63Å; E28-A44 CarbonylContact O-C 3.58Å; E28-A44 WeakPolarHBondContact O-CA 3.19Å; E28-A44 VanDerWaalsContact O-CB 3.3Å; E28-A44 WeakPolarHBondContact O-CB 3.13Å; A44-D50 WeakPolarHBondContact O-CA 3.3Å; A44-V51 HydrophobicContact CB-CG2 4.02Å; A44-V51 PolarHBondContact N-O 3.42Å; A44-V51 WeakPolarHBondContact O-CG2 3.28Å; A44-V51 PolarHBondContact O-N 2.82Å; A44-V51 VanDerWaalsContact O-O 3.07Å; A44-I53 HydrophobicContact CB-CD1 4.36Å; A44-I53 HydrophobicContact CB-CG1 4.31Å; A44-I53 HydrophobicContact CB-CG2 4.24Å
45	K	97.8	Very high	88	Confident	68 Å²	68	44.9 Å²	44.9	30%	0.296	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	143.5	165.3	-65	-172.8	179.9	95.9	0	111.2	I27 E28 E30 K49	I27-K45 WeakPolarHBondContact CA-O 3.42Å; E28-K45 HydrophobicContact CB-CB 4.24Å; E28-K45 PolarHBondContact N-O 2.81Å; E28-K45 PolarHBondContact O-N 3.44Å; E30-K45 IonicContact OE1-NZ 2.61Å; E30-K45 PolarHBondContact OE1-NZ 2.83Å; K45-K49 VanDerWaalsContact CA-O 3.31Å; K45-K49 WeakPolarHBondContact CA-O 3.4Å
46	W	96.8	Very high	88.4	Confident	22 Å²	22	38.9 Å²	38.9	8%	0.083	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	130.3	174.1	173.5	72.4	0	0	0	109	E20 I22 G48 K49 V51 Y84	E20-W46 VanDerWaalsContact OE2-CH2 3.23Å; E20-W46 WeakPolarHBondContact OE2-CH2 3.33Å; E20-W46 VanDerWaalsContact OE2-CZ2 3.29Å; E20-W46 WeakPolarHBondContact OE2-CZ2 3.47Å; I22-W46 HydrophobicContact CD1-CD2 4.22Å; I22-W46 HydrophobicContact CD1-CH2 3.9Å; I22-W46 HydrophobicContact CD1-CZ2 3.45Å; I22-W46 VanDerWaalsContact CD1-CZ2 3.45Å; I22-W46 HydrophobicContact CD1-CZ3 4.46Å; I22-W46 HydrophobicContact CG1-CH2 4.44Å; I22-W46 HydrophobicContact CG1-CZ2 3.64Å; W46-G48 PolarHBondContact O-N 3.26Å; W46-G48 VanDerWaalsContact O-N 3.12Å; W46-K49 PolarHBondContact N-O 2.84Å; W46-K49 PolarHBondContact O-N 2.88Å; W46-V51 HydrophobicContact CB-CG1 4.17Å; W46-V51 HydrophobicContact CB-CG2 3.91Å; W46-V51 HydrophobicContact CE3-CG1 4.47Å; W46-Y84 HydrophobicContact CZ3-CG 4.35Å
47	K	94.7	Very high	89.3	Confident	133 Å²	133	42.1 Å²	42.1	58%	0.578	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.7	37.1	-175.1	-61.5	177.5	-178.3	174.8	0	113.4	E20 K49	E20-K47 IonicContact OE1-NZ 2.64Å; E20-K47 PolarHBondContact OE1-NZ 3.28Å; E20-K47 IonicContact OE2-NZ 2.77Å; E20-K47 PolarHBondContact OE2-NZ 3.2Å; K47-K49 VanDerWaalsContact C-N 3.33Å; K47-K49 PolarHBondContact O-N 2.91Å
48	G	93.2	Very high	90.4	Very high	79 Å²	79	40.8 Å²	40.8	81%	0.814	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	76.1	10.2	-179.2	0	0	0	0	0	115.9	W46	W46-G48 PolarHBondContact O-N 3.26Å; W46-G48 VanDerWaalsContact O-N 3.12Å
49	K	94.9	Very high	91.1	Very high	114 Å²	114	44.4 Å²	44.4	50%	0.496	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	140.2	179.2	-174.6	-179.7	-178.9	178.6	0	111.4	K45 W46 K47 V51 Y84	K45-K49 VanDerWaalsContact CA-O 3.31Å; K45-K49 WeakPolarHBondContact CA-O 3.4Å; W46-K49 PolarHBondContact N-O 2.84Å; W46-K49 PolarHBondContact O-N 2.88Å; K47-K49 VanDerWaalsContact C-N 3.33Å; K47-K49 PolarHBondContact O-N 2.91Å; K49-V51 PolarHBondContact O-N 2.91Å; K49-Y84 PolarHBondContact NZ-OH 2.83Å
50	D	97.1	Very high	91.2	Very high	65 Å²	65	48.9 Å²	48.9	35%	0.348	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	130.5	169.8	-66.9	-60.4	0	0	0	111.7	K43 A44 Y97	K43-D50 IonicContact NZ-OD1 3.75Å; K43-D50 PolarHBondContact NZ-OD1 2.89Å; A44-D50 WeakPolarHBondContact O-CA 3.3Å; D50-Y97 HydrophobicContact CB-CD1 4.34Å; D50-Y97 HydrophobicContact CB-CG 4.49Å
51	V	97.1	Very high	90.7	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	153.7	180	-63.2	0	0	0	0	110.4	A44 W46 K49 I53 Y84 V94 M95	A44-V51 HydrophobicContact CB-CG2 4.02Å; A44-V51 PolarHBondContact N-O 3.42Å; A44-V51 WeakPolarHBondContact O-CG2 3.28Å; A44-V51 PolarHBondContact O-N 2.82Å; A44-V51 VanDerWaalsContact O-O 3.07Å; W46-V51 HydrophobicContact CB-CG1 4.17Å; W46-V51 HydrophobicContact CB-CG2 3.91Å; W46-V51 HydrophobicContact CE3-CG1 4.47Å; K49-V51 PolarHBondContact O-N 2.91Å; V51-I53 HydrophobicContact CG2-CG2 4.42Å; V51-Y84 HydrophobicContact CG1-CD2 3.81Å; V51-Y84 HydrophobicContact CG1-CE2 3.85Å; V51-V94 HydrophobicContact CB-CG1 4Å; V51-V94 HydrophobicContact CG1-CG1 4.16Å; V51-V94 HydrophobicContact CG2-CG1 3.97Å; V51-M95 CarbonylContact C-O 3.44Å; V51-M95 VanDerWaalsContact CA-O 3.3Å; V51-M95 WeakPolarHBondContact CA-O 3.48Å; V51-M95 WeakPolarHBondContact CB-O 3.24Å
52	A	96.4	Very high	90.2	Very high	10 Å²	10	52.4 Å²	52.4	8%	0.083	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	129	166.1	0	0	0	0	0	108.7	V41 C42 M95 Y97	V41-A52 HydrophobicContact CG1-CB 4.19Å; C42-A52 WeakPolarHBondContact O-CA 3.43Å; A52-M95 PolarHBondContact N-O 3.17Å; A52-M95 PolarHBondContact O-N 3.4Å; A52-Y97 HydrophobicContact CB-CD2 4.32Å
53	I	95.1	Very high	89.5	Confident	1 Å²	1	60.1 Å²	60.1	1%	0.005	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	131.6	170.2	61.7	170.6	0	0	0	110.8	Y24 I27 V29 V41 C42 A44 V51 L93 V94	Y24-I53 HydrophobicContact CE2-CD1 4.26Å; I27-I53 HydrophobicContact CD1-CG2 4.27Å; I27-I53 HydrophobicContact CG2-CD1 4.44Å; I27-I53 HydrophobicContact CG2-CG2 4.14Å; V29-I53 HydrophobicContact CB-CD1 4.5Å; V29-I53 HydrophobicContact CG1-CD1 4.09Å; V29-I53 HydrophobicContact CG2-CD1 3.66Å; V41-I53 CarbonylContact C-O 3.58Å; V41-I53 VanDerWaalsContact CA-O 3.28Å; V41-I53 WeakPolarHBondContact CA-O 3.21Å; C42-I53 HydrophobicContact CB-CD1 4.28Å; C42-I53 HydrophobicContact CB-CG1 3.81Å; C42-I53 PolarHBondContact N-O 2.66Å; C42-I53 PolarHBondContact O-N 2.85Å; A44-I53 HydrophobicContact CB-CD1 4.36Å; A44-I53 HydrophobicContact CB-CG1 4.31Å; A44-I53 HydrophobicContact CB-CG2 4.24Å; V51-I53 HydrophobicContact CG2-CG2 4.42Å; I53-L93 CarbonylContact C-O 3.54Å; I53-L93 VanDerWaalsContact CA-O 3.24Å; I53-L93 WeakPolarHBondContact CA-O 3.43Å; I53-V94 HydrophobicContact CG2-CG1 4.39Å; I53-V94 HydrophobicContact CG2-CG2 4.21Å
54	K	92.1	Very high	88.5	Confident	11 Å²	11	59.4 Å²	59.4	5%	0.048	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	106	175	-170.7	-178.6	-166.6	-174	0	109.3	F38 V40 V41 E68 C92 L93 M95 D166	F38-K54 WeakPolarHBondContact O-CE 3.37Å; V40-K54 CarbonylContact O-C 3.54Å; V40-K54 VanDerWaalsContact O-CA 3.31Å; V40-K54 WeakPolarHBondContact O-CA 3.36Å; V41-K54 HydrophobicContact CG2-CB 4.39Å; V41-K54 HydrophobicContact CG2-CG 4.11Å; K54-E68 WeakPolarHBondContact CE-OE2 3.29Å; K54-E68 IonicContact NZ-OE1 2.7Å; K54-E68 PolarHBondContact NZ-OE1 3.09Å; K54-E68 IonicContact NZ-OE2 3.76Å; K54-E68 PolarHBondContact NZ-OE2 3.28Å; K54-C92 CarbonylContact O-C 3.6Å; K54-C92 WeakPolarHBondContact O-CA 3.2Å; K54-C92 WeakPolarHBondContact O-CB 3.35Å; K54-L93 HydrophobicContact CB-CB 4.33Å; K54-L93 HydrophobicContact CD-CD1 4.37Å; K54-L93 PolarHBondContact N-O 3.27Å; K54-L93 PolarHBondContact O-N 3.02Å; K54-M95 HydrophobicContact CB-CE 3.68Å; K54-M95 HydrophobicContact CD-CE 4.41Å; K54-D166 IonicContact NZ-OD1 3.22Å; K54-D166 PolarHBondContact NZ-OD1 3.15Å
55	T	90.1	Very high	87.9	Confident	24 Å²	24	60.1 Å²	60.1	15%	0.147	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	138.7	178.9	43.8	0	0	0	0	110.7	G39 V40 C92	G39-T55 CarbonylContact C-O 3.54Å; G39-T55 WeakPolarHBondContact CA-O 3.28Å; V40-T55 PolarHBondContact N-O 2.94Å; V40-T55 PolarHBondContact O-N 3Å; V40-T55 PolarHBondContact O-OG1 3.07Å; T55-C92 HydrophobicContact CG2-CB 3.59Å
56	I	84.9	Confident	87.2	Confident	37 Å²	37	60.7 Å²	60.7	19%	0.19	32%	0.319	C	S	.	.			trans	-73.8	141.6	170.5	58.9	176.5	0	0	0	111	E61 R62 F65 V91	I56-E61 WeakPolarHBondContact CA-OE2 3.38Å; I56-E61 HydrophobicContact CB-CB 4.01Å; I56-E61 HydrophobicContact CG2-CB 3.75Å; I56-R62 HydrophobicContact CD1-CB 4.4Å; I56-F65 HydrophobicContact CG2-CB 3.86Å; I56-F65 HydrophobicContact CG2-CD2 3.86Å; I56-F65 HydrophobicContact CG2-CG 4.15Å; I56-V91 HydrophobicContact CD1-CB 3.96Å; I56-V91 HydrophobicContact CD1-CG1 4.03Å; I56-V91 HydrophobicContact CG1-CB 4.14Å; I56-V91 HydrophobicContact CG1-CG1 4.39Å
57	E	81.1	Confident	86.5	Confident	115 Å²	115	61.8 Å²	61.8	54%	0.537	33%	0.328	S	S	.	.	S	Bend	trans	-93.7	-26.3	173.3	-70.9	-167.2	119.6	0	0	112.5	R35 V40 E61	R35-E57 IonicContact CZ-OE1 2.78Å; R35-E57 VanDerWaalsContact CZ-OE1 3.27Å; R35-E57 IonicContact CZ-OE2 3.8Å; R35-E57 IonicContact NH1-OE1 2.61Å; R35-E57 PolarHBondContact NH1-OE1 2.97Å; R35-E57 IonicContact NH1-OE2 3.82Å; R35-E57 PolarHBondContact NH1-OE2 2.92Å; R35-E57 IonicContact NH2-OE1 2.86Å; R35-E57 PolarHBondContact NH2-OE1 2.94Å; V40-E57 HydrophobicContact CG2-CG 3.65Å; V40-E57 WeakPolarHBondContact CG2-OE1 3.45Å; E57-E61 PolarHBondContact N-OE2 3.35Å
58	S	81.4	Confident	86	Confident	39 Å²	39	55.6 Å²	55.6	27%	0.273	30%	0.301	S	S	.	.	S	Bend	trans	-132.7	150.1	178.4	75	0	0	0	0	113.3	S60 E61	S58-S60 WeakPolarHBondContact CB-OG 3.49Å; S58-S60 PolarHBondContact O-N 3.09Å; S58-S60 PolarHBondContact OG-OG 3.44Å; S58-E61 VanDerWaalsContact CB-OE1 3.25Å; S58-E61 WeakPolarHBondContact CB-OE1 3.49Å; S58-E61 PolarHBondContact N-OE1 3.24Å; S58-E61 WeakPolarHBondContact O-CB 3.37Å; S58-E61 PolarHBondContact O-N 3.12Å; S58-E61 PolarHBondContact OG-OE1 3.27Å
59	E	79.7	Confident	85.8	Confident	122 Å²	122	52.3 Å²	52.3	57%	0.57	27%	0.265	S	S	*	.	G	3₁₀ helix	trans	-61.9	-23	175.3	-177.1	58	-153.2	0	0	112.2	E61 R62	E59-E61 PolarHBondContact O-N 2.77Å; E59-R62 VanDerWaalsContact CD-NE 3.26Å; E59-R62 WeakPolarHBondContact O-CB 3.25Å; E59-R62 PolarHBondContact O-N 3.28Å; E59-R62 VanDerWaalsContact O-N 3.16Å; E59-R62 WeakPolarHBondContact OE1-CD 3.46Å; E59-R62 IonicContact OE1-CZ 2.66Å; E59-R62 IonicContact OE1-NE 2.77Å; E59-R62 PolarHBondContact OE1-NE 2.71Å; E59-R62 IonicContact OE1-NH2 2.66Å; E59-R62 IonicContact OE2-CZ 2.65Å; E59-R62 IonicContact OE2-NE 2.93Å; E59-R62 PolarHBondContact OE2-NE 3.27Å; E59-R62 VanDerWaalsContact OE2-NE 3.08Å; E59-R62 IonicContact OE2-NH2 3.61Å; E59-R62 PolarHBondContact OE2-NH2 3.5Å
60	S	77.1	Confident	85.4	Confident	100 Å²	100	54.7 Å²	54.7	70%	0.699	27%	0.271	S	S	*	.	G	3₁₀ helix	trans	-57.5	-32.8	169.1	7.9	0	0	0	0	113.4	S58 R62	S58-S60 WeakPolarHBondContact CB-OG 3.49Å; S58-S60 PolarHBondContact O-N 3.09Å; S58-S60 PolarHBondContact OG-OG 3.44Å; S60-R62 VanDerWaalsContact C-N 3.32Å; S60-R62 PolarHBondContact O-N 3.18Å
61	E	76.5	Confident	84.9	Confident	26 Å²	26	52.1 Å²	52.1	12%	0.121	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-77	-15.1	179.3	-67.4	146.4	-121	0	0	113	F38 G39 I56 E57 S58 E59 K63 A64 F65	F38-E61 HydrophobicContact CB-CG 4.37Å; F38-E61 HydrophobicContact CD1-CG 4.4Å; G39-E61 VanDerWaalsContact CA-OE2 3.31Å; G39-E61 WeakPolarHBondContact CA-OE2 3.14Å; G39-E61 PolarHBondContact N-OE2 2.75Å; I56-E61 WeakPolarHBondContact CA-OE2 3.38Å; I56-E61 HydrophobicContact CB-CB 4.01Å; I56-E61 HydrophobicContact CG2-CB 3.75Å; E57-E61 PolarHBondContact N-OE2 3.35Å; S58-E61 VanDerWaalsContact CB-OE1 3.25Å; S58-E61 WeakPolarHBondContact CB-OE1 3.49Å; S58-E61 PolarHBondContact N-OE1 3.24Å; S58-E61 WeakPolarHBondContact O-CB 3.37Å; S58-E61 PolarHBondContact O-N 3.12Å; S58-E61 PolarHBondContact OG-OE1 3.27Å; E59-E61 PolarHBondContact O-N 2.77Å; E61-K63 PolarHBondContact O-N 2.93Å; E61-A64 PolarHBondContact O-N 2.96Å; E61-F65 PolarHBondContact O-N 2.71Å
62	R	81.2	Confident	84.5	Confident	90 Å²	90	52.3 Å²	52.3	34%	0.34	26%	0.257	S	S	.	.	H	α-helix	trans	-53.6	-34.9	-176.9	-176.5	-178	-63.4	-91.6	-4.1	112.5	I56 E59 S60 F65 I66	I56-R62 HydrophobicContact CD1-CB 4.4Å; E59-R62 VanDerWaalsContact CD-NE 3.26Å; E59-R62 WeakPolarHBondContact O-CB 3.25Å; E59-R62 PolarHBondContact O-N 3.28Å; E59-R62 VanDerWaalsContact O-N 3.16Å; E59-R62 WeakPolarHBondContact OE1-CD 3.46Å; E59-R62 IonicContact OE1-CZ 2.66Å; E59-R62 IonicContact OE1-NE 2.77Å; E59-R62 PolarHBondContact OE1-NE 2.71Å; E59-R62 IonicContact OE1-NH2 2.66Å; E59-R62 IonicContact OE2-CZ 2.65Å; E59-R62 IonicContact OE2-NE 2.93Å; E59-R62 PolarHBondContact OE2-NE 3.27Å; E59-R62 VanDerWaalsContact OE2-NE 3.08Å; E59-R62 IonicContact OE2-NH2 3.61Å; E59-R62 PolarHBondContact OE2-NH2 3.5Å; S60-R62 VanDerWaalsContact C-N 3.32Å; S60-R62 PolarHBondContact O-N 3.18Å; R62-F65 PolarHBondContact O-N 3.39Å; R62-I66 HydrophobicContact CG-CD1 3.74Å; R62-I66 HydrophobicContact CG-CG1 4.25Å; R62-I66 WeakPolarHBondContact O-CB 3.41Å; R62-I66 VanDerWaalsContact O-CG1 3.28Å; R62-I66 WeakPolarHBondContact O-CG1 3.21Å; R62-I66 PolarHBondContact O-N 3.13Å
63	K	77.9	Confident	84.1	Confident	177 Å²	177	52.3 Å²	52.3	77%	0.77	26%	0.257	S	S	*	.	H	α-helix	trans	-65.7	-45.6	177.1	-68.8	-175.4	179.6	179.6	0	112.3	E61 F65 I66 V67	E61-K63 PolarHBondContact O-N 2.93Å; K63-F65 VanDerWaalsContact C-N 3.35Å; K63-I66 PolarHBondContact O-N 2.91Å; K63-V67 WeakPolarHBondContact O-CG2 3.48Å; K63-V67 PolarHBondContact O-N 3.39Å; K63-V67 VanDerWaalsContact O-N 3.09Å
64	A	77	Confident	83.7	Confident	15 Å²	15	54.4 Å²	54.4	12%	0.124	27%	0.265	C	S	.	.	H	α-helix	trans	-64.7	-41.4	175.9	0	0	0	0	0	110.9	F38 E61 V67 E68	F38-A64 HydrophobicContact CD1-CB 3.81Å; F38-A64 HydrophobicContact CD2-CB 4.41Å; F38-A64 HydrophobicContact CE1-CB 4.11Å; F38-A64 HydrophobicContact CG-CB 3.97Å; E61-A64 PolarHBondContact O-N 2.96Å; A64-V67 PolarHBondContact O-N 3.31Å; A64-E68 WeakPolarHBondContact O-CB 3.38Å; A64-E68 PolarHBondContact O-N 3.1Å
65	F	84.1	Confident	83.6	Confident	15 Å²	15	54.7 Å²	54.7	7%	0.066	27%	0.267	C	S	.	.	H	α-helix	trans	-58.3	-47	174.3	180	-83.3	0	0	0	112.9	I56 E61 R62 K63 V67 E68 L69 V91 C92 L93	I56-F65 HydrophobicContact CG2-CB 3.86Å; I56-F65 HydrophobicContact CG2-CD2 3.86Å; I56-F65 HydrophobicContact CG2-CG 4.15Å; E61-F65 PolarHBondContact O-N 2.71Å; R62-F65 PolarHBondContact O-N 3.39Å; K63-F65 VanDerWaalsContact C-N 3.35Å; F65-V67 VanDerWaalsContact C-N 3.35Å; F65-V67 PolarHBondContact O-N 2.94Å; F65-E68 PolarHBondContact O-N 3.5Å; F65-L69 HydrophobicContact CE1-CD2 4.12Å; F65-L69 VanDerWaalsContact O-CB 3.31Å; F65-L69 WeakPolarHBondContact O-CB 2.95Å; F65-L69 PolarHBondContact O-N 2.66Å; F65-V91 HydrophobicContact CD1-CG1 3.62Å; F65-V91 HydrophobicContact CD2-CG1 3.98Å; F65-V91 HydrophobicContact CE1-CG1 3.35Å; F65-V91 HydrophobicContact CE2-CG1 3.69Å; F65-V91 HydrophobicContact CG-CG1 3.94Å; F65-V91 HydrophobicContact CZ-CG1 3.38Å; F65-C92 VanDerWaalsContact CE2-C 3.46Å; F65-L93 HydrophobicContact CD2-CD2 4.34Å; F65-L93 HydrophobicContact CD2-CG 4.14Å; F65-L93 HydrophobicContact CE1-CD2 4.23Å; F65-L93 HydrophobicContact CE2-CB 4.5Å; F65-L93 HydrophobicContact CE2-CD2 3.64Å; F65-L93 HydrophobicContact CE2-CG 3.55Å; F65-L93 HydrophobicContact CZ-CD2 3.56Å; F65-L93 HydrophobicContact CZ-CG 4.02Å
66	I	82.4	Confident	83.7	Confident	79 Å²	79	59.1 Å²	59.1	41%	0.405	29%	0.29	S	S	.	.	H	α-helix	trans	-66.4	-37.6	179.5	-70.8	169.4	0	0	0	111.1	R62 K63 R70	R62-I66 HydrophobicContact CG-CD1 3.74Å; R62-I66 HydrophobicContact CG-CG1 4.25Å; R62-I66 WeakPolarHBondContact O-CB 3.41Å; R62-I66 VanDerWaalsContact O-CG1 3.28Å; R62-I66 WeakPolarHBondContact O-CG1 3.21Å; R62-I66 PolarHBondContact O-N 3.13Å; K63-I66 PolarHBondContact O-N 2.91Å; I66-R70 VanDerWaalsContact O-CB 3.25Å; I66-R70 WeakPolarHBondContact O-CB 3.45Å; I66-R70 PolarHBondContact O-N 3.44Å
67	V	81.9	Confident	84.3	Confident	45 Å²	45	59.2 Å²	59.2	27%	0.273	29%	0.29	S	S	.	.	H	α-helix	trans	-62.1	-52.3	172.1	170.1	0	0	0	0	110.1	K63 A64 F65 L69 R70 Q71 A170	K63-V67 WeakPolarHBondContact O-CG2 3.48Å; K63-V67 PolarHBondContact O-N 3.39Å; K63-V67 VanDerWaalsContact O-N 3.09Å; A64-V67 PolarHBondContact O-N 3.31Å; F65-V67 VanDerWaalsContact C-N 3.35Å; F65-V67 PolarHBondContact O-N 2.94Å; V67-L69 PolarHBondContact O-N 3Å; V67-R70 CarbonylContact O-C 3.59Å; V67-R70 PolarHBondContact O-N 2.84Å; V67-R70 VanDerWaalsContact O-N 3.08Å; V67-Q71 HydrophobicContact CG1-CG 4.32Å; V67-Q71 WeakPolarHBondContact O-CG 3.42Å; V67-Q71 PolarHBondContact O-N 2.85Å; V67-A170 WeakPolarHBondContact CG1-O 3.39Å
68	E	85.6	Confident	85	Confident	4 Å²	4	58.1 Å²	58.1	2%	0.019	29%	0.293	C	S	.	.	H	α-helix	trans	-59.5	-46.1	-178.9	-175.1	166.8	-145.9	0	0	112.2	K54 A64 F65 R70 Q71 L72 L93 D166 F167	K54-E68 WeakPolarHBondContact CE-OE2 3.29Å; K54-E68 IonicContact NZ-OE1 2.7Å; K54-E68 PolarHBondContact NZ-OE1 3.09Å; K54-E68 IonicContact NZ-OE2 3.76Å; K54-E68 PolarHBondContact NZ-OE2 3.28Å; A64-E68 WeakPolarHBondContact O-CB 3.38Å; A64-E68 PolarHBondContact O-N 3.1Å; F65-E68 PolarHBondContact O-N 3.5Å; E68-R70 VanDerWaalsContact C-N 3.32Å; E68-R70 PolarHBondContact O-N 2.9Å; E68-Q71 PolarHBondContact O-N 3.47Å; E68-L72 HydrophobicContact CG-CD1 3.74Å; E68-L72 HydrophobicContact CG-CG 4.24Å; E68-L72 VanDerWaalsContact O-CB 3.28Å; E68-L72 WeakPolarHBondContact O-CB 3.38Å; E68-L72 PolarHBondContact O-N 3.42Å; E68-L93 HydrophobicContact CB-CD1 4.39Å; E68-L93 HydrophobicContact CG-CD1 3.71Å; E68-D166 WeakPolarHBondContact OE1-CA 3.45Å; E68-F167 HydrophobicContact CG-CB 4.14Å; E68-F167 PolarHBondContact OE1-N 3.27Å; E68-F167 VanDerWaalsContact OE1-N 3.1Å
69	L	88.1	Confident	85.9	Confident	9 Å²	9	56.8 Å²	56.8	5%	0.047	28%	0.283	C	S	.	.	H	α-helix	trans	-56.4	-45.2	172.8	179.8	58.3	0	0	0	111.5	L11 F19 F65 V67 Q71 S73 L83 L93	L11-L69 HydrophobicContact CD2-CD2 4.4Å; F19-L69 HydrophobicContact CD2-CD1 4.14Å; F19-L69 HydrophobicContact CE2-CD1 3.84Å; F19-L69 HydrophobicContact CE2-CG 4.46Å; F19-L69 HydrophobicContact CZ-CD1 4.32Å; F65-L69 HydrophobicContact CE1-CD2 4.12Å; F65-L69 VanDerWaalsContact O-CB 3.31Å; F65-L69 WeakPolarHBondContact O-CB 2.95Å; F65-L69 PolarHBondContact O-N 2.66Å; V67-L69 PolarHBondContact O-N 3Å; L69-Q71 PolarHBondContact O-N 3.49Å; L69-S73 VanDerWaalsContact O-CB 3.24Å; L69-S73 WeakPolarHBondContact O-CB 3.17Å; L69-S73 PolarHBondContact O-N 3.33Å; L69-S73 PolarHBondContact O-OG 3.5Å; L69-L83 HydrophobicContact CD1-CD2 3.98Å; L69-L93 HydrophobicContact CB-CD2 3.91Å; L69-L93 HydrophobicContact CD1-CD2 3.79Å; L69-L93 HydrophobicContact CG-CD2 4.37Å
70	R	86.3	Confident	86.7	Confident	164 Å²	164	51.2 Å²	51.2	62%	0.619	26%	0.257	S	S	*	.	H	α-helix	trans	-68.6	-30.5	-179.9	-170.5	178.9	-170.9	-179.1	7	113.1	I66 V67 E68 S73 R74	I66-R70 VanDerWaalsContact O-CB 3.25Å; I66-R70 WeakPolarHBondContact O-CB 3.45Å; I66-R70 PolarHBondContact O-N 3.44Å; V67-R70 CarbonylContact O-C 3.59Å; V67-R70 PolarHBondContact O-N 2.84Å; V67-R70 VanDerWaalsContact O-N 3.08Å; E68-R70 VanDerWaalsContact C-N 3.32Å; E68-R70 PolarHBondContact O-N 2.9Å; R70-S73 PolarHBondContact O-OG 2.93Å; R70-R74 WeakPolarHBondContact O-CD 3.31Å; R70-R74 WeakPolarHBondContact O-CG 3.41Å
71	Q	86.7	Confident	87.6	Confident	11 Å²	11	46.7 Å²	46.7	5%	0.051	23%	0.225	C	C	.	.	H	α-helix	trans	-82.6	-46.8	175.1	-55.9	-52.7	15	0	0	111.9	V67 E68 L69 S73 R74 V75 L143 F167 A170	V67-Q71 HydrophobicContact CG1-CG 4.32Å; V67-Q71 WeakPolarHBondContact O-CG 3.42Å; V67-Q71 PolarHBondContact O-N 2.85Å; E68-Q71 PolarHBondContact O-N 3.47Å; L69-Q71 PolarHBondContact O-N 3.49Å; Q71-S73 VanDerWaalsContact C-N 3.28Å; Q71-S73 PolarHBondContact O-N 2.95Å; Q71-R74 WeakPolarHBondContact O-CB 3.28Å; Q71-R74 PolarHBondContact O-N 2.88Å; Q71-V75 PolarHBondContact O-N 2.9Å; Q71-L143 HydrophobicContact CB-CD2 3.88Å; Q71-L143 HydrophobicContact CG-CD1 4.1Å; Q71-L143 HydrophobicContact CG-CD2 4.08Å; Q71-F167 HydrophobicContact CB-CB 4.34Å; Q71-A170 HydrophobicContact CG-CB 4.46Å; Q71-A170 WeakPolarHBondContact CG-O 3.47Å; Q71-A170 PolarHBondContact NE2-O 3.14Å
72	L	88.8	Confident	88.4	Confident	4 Å²	4	50.9 Å²	50.9	2%	0.021	24%	0.243	C	C	.	.	H	α-helix	trans	-61.9	-34.4	179.5	-79.1	177.9	0	0	0	112.6	E68 R74 V75 V81 L83 L93 M95 F167	E68-L72 HydrophobicContact CG-CD1 3.74Å; E68-L72 HydrophobicContact CG-CG 4.24Å; E68-L72 VanDerWaalsContact O-CB 3.28Å; E68-L72 WeakPolarHBondContact O-CB 3.38Å; E68-L72 PolarHBondContact O-N 3.42Å; L72-R74 PolarHBondContact O-N 2.92Å; L72-V75 HydrophobicContact CD2-CG2 4.24Å; L72-V75 WeakPolarHBondContact O-CG2 3.24Å; L72-V81 HydrophobicContact CD2-CG1 4.01Å; L72-L83 HydrophobicContact CB-CB 4.17Å; L72-L83 HydrophobicContact CB-CD2 4.04Å; L72-L83 HydrophobicContact CB-CG 4.49Å; L72-L93 HydrophobicContact CD1-CD1 4.03Å; L72-M95 HydrophobicContact CD1-SD 3.94Å; L72-F167 HydrophobicContact CD2-CD2 3.44Å; L72-F167 VanDerWaalsContact CD2-CD2 3.44Å; L72-F167 HydrophobicContact CD2-CE2 3.67Å; L72-F167 HydrophobicContact CD2-CG 4.28Å; L72-F167 HydrophobicContact CG-CD2 4Å
73	S	88.2	Confident	89	Confident	11 Å²	11	47.2 Å²	47.2	8%	0.077	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-13.4	172.4	54.5	0	0	0	0	114.3	Y17 F19 L69 R70 Q71	Y17-S73 WeakPolarHBondContact CB-O 3.31Å; Y17-S73 VanDerWaalsContact CD1-O 3.29Å; Y17-S73 WeakPolarHBondContact CD1-O 3.49Å; F19-S73 VanDerWaalsContact CD1-CB 3.4Å; F19-S73 VanDerWaalsContact CE1-CB 3.47Å; L69-S73 VanDerWaalsContact O-CB 3.24Å; L69-S73 WeakPolarHBondContact O-CB 3.17Å; L69-S73 PolarHBondContact O-N 3.33Å; L69-S73 PolarHBondContact O-OG 3.5Å; R70-S73 PolarHBondContact O-OG 2.93Å; Q71-S73 VanDerWaalsContact C-N 3.28Å; Q71-S73 PolarHBondContact O-N 2.95Å
74	R	87.4	Confident	89.7	Confident	45 Å²	45	40.2 Å²	40.2	17%	0.17	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101	-6.3	179.7	-67.3	167.9	63.6	-153.9	0.9	114.1	Y17 R70 Q71 L72 M138 D172	Y17-R74 PolarHBondContact OH-O 2.77Å; R70-R74 WeakPolarHBondContact O-CD 3.31Å; R70-R74 WeakPolarHBondContact O-CG 3.41Å; Q71-R74 WeakPolarHBondContact O-CB 3.28Å; Q71-R74 PolarHBondContact O-N 2.88Å; L72-R74 PolarHBondContact O-N 2.92Å; R74-M138 HydrophobicContact CB-CE 3.93Å; R74-M138 VanDerWaalsContact O-CE 3.31Å; R74-M138 WeakPolarHBondContact O-CE 3.31Å; R74-D172 IonicContact NH1-OD1 2.82Å
75	V	90.2	Very high	90.5	Very high	16 Å²	16	39.5 Å²	39.5	10%	0.097	19%	0.193	C	C	.	.			trans	-113	138.8	-172.6	-62.8	0	0	0	0	111.5	Q71 L72 I80 Y134 L135 M138 L143	Q71-V75 PolarHBondContact O-N 2.9Å; L72-V75 HydrophobicContact CD2-CG2 4.24Å; L72-V75 WeakPolarHBondContact O-CG2 3.24Å; V75-I80 HydrophobicContact CB-CD1 4.31Å; V75-I80 HydrophobicContact CG2-CG2 3.91Å; V75-Y134 HydrophobicContact CB-CE1 3.94Å; V75-Y134 HydrophobicContact CG1-CE1 4.04Å; V75-L135 HydrophobicContact CG1-CD2 3.77Å; V75-M138 HydrophobicContact CG1-CE 3.78Å; V75-M138 HydrophobicContact CG1-SD 3.84Å; V75-L143 HydrophobicContact CG1-CD2 4.37Å
76	N	91.5	Very high	91	Very high	118 Å²	118	39.4 Å²	39.4	63%	0.631	19%	0.194	S	C	*	.			trans	-148.9	97.8	174.4	-177.9	20.9	0	0	0	108.8	Y17 Y134	Y17-N76 HydrophobicContact CE1-CB 4.49Å; N76-Y134 PolarHBondContact N-OH 2.93Å; N76-Y134 PolarHBondContact O-OH 3.44Å
77	H	96.6	Very high	91.5	Very high	38 Å²	38	35.8 Å²	35.8	18%	0.176	18%	0.176	C	C	.	.			trans	-149.3	141.7	-177.8	-174.3	-96.6	0	0	0	109.3	N79 I80 Y134	H77-N79 PolarHBondContact CE1-OD1 3.17Å; H77-N79 PolarHBondContact ND1-N 2.95Å; H77-N79 PolarHBondContact O-N 2.78Å; H77-N79 VanDerWaalsContact O-N 3.16Å; H77-I80 HydrophobicContact CB-CB 4.39Å; H77-I80 HydrophobicContact CB-CD1 3.9Å; H77-I80 HydrophobicContact CB-CG1 4.05Å; H77-I80 PolarHBondContact O-N 2.73Å; H77-Y134 HydrophobicContact CB-CD1 3.88Å; H77-Y134 HydrophobicContact CB-CD2 4.15Å; H77-Y134 HydrophobicContact CB-CE1 4.11Å; H77-Y134 HydrophobicContact CB-CE2 4.35Å; H77-Y134 HydrophobicContact CB-CG 3.9Å; H77-Y134 AromaticContact CD2-CD2 3.82Å; H77-Y134 AromaticContact CD2-CG 3.84Å; H77-Y134 AromaticContact CG-CG 3.95Å
78	P	97.4	Very high	91.8	Very high	93 Å²	93	38.3 Å²	38.3	60%	0.604	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.7	-39.8	-176.6	-28.9	36.4	0	0	0	114	I80 K163	P78-I80 VanDerWaalsContact C-N 3.31Å; P78-I80 PolarHBondContact O-N 2.87Å; P78-K163 PolarHBondContact O-NZ 3.46Å
79	N	98.4	Very high	91.8	Very high	11 Å²	11	43 Å²	43	6%	0.059	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.9	24	-178.5	-51	105.9	0	0	0	114.4	H77 Q127 L162 K163 I164	H77-N79 PolarHBondContact CE1-OD1 3.17Å; H77-N79 PolarHBondContact ND1-N 2.95Å; H77-N79 PolarHBondContact O-N 2.78Å; H77-N79 VanDerWaalsContact O-N 3.16Å; N79-Q127 VanDerWaalsContact CB-O 3.3Å; N79-Q127 WeakPolarHBondContact CB-O 3.21Å; N79-Q127 WeakPolarHBondContact ND2-CB 3.36Å; N79-Q127 PolarHBondContact ND2-OE1 3.32Å; N79-L162 VanDerWaalsContact CA-O 3.27Å; N79-L162 WeakPolarHBondContact CA-O 3.49Å; N79-L162 WeakPolarHBondContact CB-O 3.38Å; N79-L162 PolarHBondContact ND2-O 3.14Å; N79-K163 WeakPolarHBondContact O-CA 3.46Å; N79-I164 WeakPolarHBondContact O-CG1 3.35Å; N79-I164 PolarHBondContact O-N 3.21Å
80	I	97.4	Very high	91.8	Very high	4 Å²	4	45.4 Å²	45.4	2%	0.021	23%	0.232	C	C	.	.	B	Isolated β-bridge	trans	-123.8	145.1	168.8	-61.3	178.6	0	0	0	107.3	V75 H77 P78 K82 Y134 L135 I164 F167	V75-I80 HydrophobicContact CB-CD1 4.31Å; V75-I80 HydrophobicContact CG2-CG2 3.91Å; H77-I80 HydrophobicContact CB-CB 4.39Å; H77-I80 HydrophobicContact CB-CD1 3.9Å; H77-I80 HydrophobicContact CB-CG1 4.05Å; H77-I80 PolarHBondContact O-N 2.73Å; P78-I80 VanDerWaalsContact C-N 3.31Å; P78-I80 PolarHBondContact O-N 2.87Å; I80-K82 PolarHBondContact O-N 2.89Å; I80-Y134 HydrophobicContact CD1-CD1 3.72Å; I80-Y134 HydrophobicContact CD1-CE1 4.12Å; I80-L135 HydrophobicContact CD1-CD1 4.36Å; I80-L135 HydrophobicContact CD1-CD2 3.89Å; I80-L135 HydrophobicContact CD1-CG 3.95Å; I80-I164 HydrophobicContact CG1-CB 4.44Å; I80-F167 HydrophobicContact CG2-CE2 3.83Å; I80-F167 HydrophobicContact CG2-CZ 3.71Å
81	V	95.3	Very high	92	Very high	6 Å²	6	38.5 Å²	38.5	4%	0.036	21%	0.209	C	C	.	.	P	Polyproline II helix	trans	-61.9	127.8	175.4	68.8	0	0	0	0	110.1	L72 M95 E96 I164 C165	L72-V81 HydrophobicContact CD2-CG1 4.01Å; V81-M95 HydrophobicContact CG2-CB 4.31Å; V81-E96 HydrophobicContact CG2-CB 3.99Å; V81-I164 WeakPolarHBondContact CG1-O 3.29Å; V81-I164 PolarHBondContact N-O 3.15Å; V81-C165 HydrophobicContact CB-CB 4.2Å; V81-C165 HydrophobicContact CG1-CB 3.79Å
82	K	93.2	Very high	92.3	Very high	113 Å²	113	38 Å²	38	49%	0.491	21%	0.206	S	C	.	.	P	Polyproline II helix	trans	-78.4	126.8	179.6	177.8	167.1	178.7	173.4	0	111.3	I80 Y84 M95 E96	I80-K82 PolarHBondContact O-N 2.89Å; K82-Y84 HydrophobicContact CD-CD1 4.36Å; K82-Y84 HydrophobicContact CD-CE1 3.86Å; K82-Y84 HydrophobicContact CG-CD1 4.27Å; K82-Y84 HydrophobicContact CG-CE1 3.98Å; K82-M95 CarbonylContact O-C 3.57Å; K82-M95 WeakPolarHBondContact O-CA 3.32Å; K82-E96 HydrophobicContact CB-CB 4.11Å; K82-E96 WeakPolarHBondContact CB-OE2 3.02Å; K82-E96 PolarHBondContact N-OE2 3.18Å; K82-E96 PolarHBondContact O-N 2.88Å
83	L	94.2	Very high	92.5	Very high	14 Å²	14	37.8 Å²	37.8	7%	0.073	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	135.8	163.3	-172.9	70.2	0	0	0	109.8	F19 L69 L72 G85 L93 M95	F19-L83 HydrophobicContact CB-CD2 3.86Å; F19-L83 HydrophobicContact CB-CG 4.33Å; F19-L83 HydrophobicContact CD2-CD2 4.48Å; F19-L83 HydrophobicContact CG-CD2 4.16Å; L69-L83 HydrophobicContact CD1-CD2 3.98Å; L72-L83 HydrophobicContact CB-CB 4.17Å; L72-L83 HydrophobicContact CB-CD2 4.04Å; L72-L83 HydrophobicContact CB-CG 4.49Å; L83-G85 WeakPolarHBondContact CD1-O 3.28Å; L83-L93 HydrophobicContact CD1-CB 4.24Å; L83-L93 HydrophobicContact CD1-CD2 4.35Å; L83-M95 HydrophobicContact CD1-CG 4.04Å
84	Y	94.1	Very high	92.8	Very high	30 Å²	30	37.3 Å²	37.3	12%	0.118	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	-38.2	168.5	-59.3	-55.1	0	0	0	111.7	E20 W46 K49 V51 K82 V94 M95 E96	E20-Y84 PolarHBondContact N-O 3.27Å; W46-Y84 HydrophobicContact CZ3-CG 4.35Å; K49-Y84 PolarHBondContact NZ-OH 2.83Å; V51-Y84 HydrophobicContact CG1-CD2 3.81Å; V51-Y84 HydrophobicContact CG1-CE2 3.85Å; K82-Y84 HydrophobicContact CD-CD1 4.36Å; K82-Y84 HydrophobicContact CD-CE1 3.86Å; K82-Y84 HydrophobicContact CG-CD1 4.27Å; K82-Y84 HydrophobicContact CG-CE1 3.98Å; Y84-V94 PolarHBondContact N-O 2.7Å; Y84-M95 VanDerWaalsContact CE2-C 3.4Å; Y84-M95 WeakPolarHBondContact CE2-O 3.48Å; Y84-E96 HydrophobicContact CE2-CB 4.23Å; Y84-E96 VanDerWaalsContact CE2-N 3.31Å
85	G	93.4	Very high	93.2	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	178.8	-167.3	-176.6	0	0	0	0	0	113.9	E20 L83 V94	E20-G85 CarbonylContact O-C 3.42Å; E20-G85 WeakPolarHBondContact O-CA 3.43Å; L83-G85 WeakPolarHBondContact CD1-O 3.28Å; G85-V94 PolarHBondContact N-O 3.08Å; G85-V94 PolarHBondContact O-N 3.21Å
86	S	94.4	Very high	93.4	Very high	13 Å²	13	37 Å²	37	9%	0.091	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	143.9	177.7	58.2	0	0	0	0	112.1	E20 I22 C92	E20-S86 PolarHBondContact O-N 2.82Å; I22-S86 PolarHBondContact N-O 3.37Å; S86-C92 CarbonylContact C-O 3.58Å; S86-C92 WeakPolarHBondContact CA-O 3.32Å; S86-C92 WeakPolarHBondContact CB-O 3.37Å
87	C	93.2	Very high	93.6	Very high	3 Å²	3	33.8 Å²	33.8	2%	0.02	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	144.7	172.1	-57.3	0	0	0	0	110.7	I22 Y24 I27 P90 V91 C92	I22-C87 WeakPolarHBondContact O-CA 3.49Å; I22-C87 PolarHBondContact O-SG 3.07Å; Y24-C87 HydrophobicContact CD2-CB 4.35Å; I27-C87 VanDerWaalsContact CD1-SG 3.55Å; C87-P90 WeakPolarHBondContact CB-O 3.32Å; C87-V91 WeakPolarHBondContact O-CA 3.39Å; C87-C92 VanDerWaalsContact CB-SG 3.59Å; C87-C92 PolarHBondContact N-O 3.31Å; C87-C92 PolarHBondContact O-N 3.45Å
88	K	87.5	Confident	93.6	Very high	98 Å²	98	32.5 Å²	32.5	43%	0.426	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	-28.6	175.9	-74.6	-178.1	-177.8	149.5	0	114.2	E21 V91	E21-K88 VanDerWaalsContact OE1-CD 3.28Å; E21-K88 WeakPolarHBondContact OE1-CD 3.35Å; E21-K88 WeakPolarHBondContact OE1-CE 3.48Å; E21-K88 IonicContact OE1-NZ 2.82Å; E21-K88 PolarHBondContact OE1-NZ 3.02Å; E21-K88 WeakPolarHBondContact OE2-CE 3.31Å; E21-K88 IonicContact OE2-NZ 3.63Å; E21-K88 PolarHBondContact OE2-NZ 3.2Å; K88-V91 WeakPolarHBondContact O-CG2 3.25Å
89	S	86.2	Confident	93.5	Very high	102 Å²	102	33 Å²	33	71%	0.713	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	-151.2	114.8	-178.5	-166.9	0	0	0	0	111.1
90	P	88.4	Confident	93.2	Very high	59 Å²	59	33.5 Å²	33.5	38%	0.383	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	cis	-54.9	158.7	-18.4	28.5	-37.3	0	0	0	111.8	Y24 C87 C92	Y24-P90 HydrophobicContact CD1-CG 4.14Å; Y24-P90 HydrophobicContact CD2-CG 3.58Å; Y24-P90 HydrophobicContact CE1-CG 4.02Å; Y24-P90 HydrophobicContact CE2-CG 3.44Å; Y24-P90 VanDerWaalsContact CE2-CG 3.44Å; Y24-P90 HydrophobicContact CG-CG 3.92Å; C87-P90 WeakPolarHBondContact CB-O 3.32Å; P90-C92 PolarHBondContact O-N 3.16Å
91	V	89.5	Confident	93	Very high	20 Å²	20	34.6 Å²	34.6	12%	0.121	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	112.1	178.6	175.4	0	0	0	0	109	I56 F65 C87 K88	I56-V91 HydrophobicContact CD1-CB 3.96Å; I56-V91 HydrophobicContact CD1-CG1 4.03Å; I56-V91 HydrophobicContact CG1-CB 4.14Å; I56-V91 HydrophobicContact CG1-CG1 4.39Å; F65-V91 HydrophobicContact CD1-CG1 3.62Å; F65-V91 HydrophobicContact CD2-CG1 3.98Å; F65-V91 HydrophobicContact CE1-CG1 3.35Å; F65-V91 HydrophobicContact CE2-CG1 3.69Å; F65-V91 HydrophobicContact CG-CG1 3.94Å; F65-V91 HydrophobicContact CZ-CG1 3.38Å; C87-V91 WeakPolarHBondContact O-CA 3.39Å; K88-V91 WeakPolarHBondContact O-CG2 3.25Å
92	C	92.6	Very high	93.1	Very high	0 Å²	0	35 Å²	35	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	154.7	178.3	86.6	0	0	0	0	114.1	K54 T55 F65 S86 C87 P90	K54-C92 CarbonylContact O-C 3.6Å; K54-C92 WeakPolarHBondContact O-CA 3.2Å; K54-C92 WeakPolarHBondContact O-CB 3.35Å; T55-C92 HydrophobicContact CG2-CB 3.59Å; F65-C92 VanDerWaalsContact CE2-C 3.46Å; S86-C92 CarbonylContact C-O 3.58Å; S86-C92 WeakPolarHBondContact CA-O 3.32Å; S86-C92 WeakPolarHBondContact CB-O 3.37Å; C87-C92 VanDerWaalsContact CB-SG 3.59Å; C87-C92 PolarHBondContact N-O 3.31Å; C87-C92 PolarHBondContact O-N 3.45Å; P90-C92 PolarHBondContact O-N 3.16Å
93	L	93.4	Very high	93.3	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	138.2	166.3	-55.9	177.6	0	0	0	108.8	I53 K54 F65 E68 L69 L72 L83 M95	I53-L93 CarbonylContact C-O 3.54Å; I53-L93 VanDerWaalsContact CA-O 3.24Å; I53-L93 WeakPolarHBondContact CA-O 3.43Å; K54-L93 HydrophobicContact CB-CB 4.33Å; K54-L93 HydrophobicContact CD-CD1 4.37Å; K54-L93 PolarHBondContact N-O 3.27Å; K54-L93 PolarHBondContact O-N 3.02Å; F65-L93 HydrophobicContact CD2-CD2 4.34Å; F65-L93 HydrophobicContact CD2-CG 4.14Å; F65-L93 HydrophobicContact CE1-CD2 4.23Å; F65-L93 HydrophobicContact CE2-CB 4.5Å; F65-L93 HydrophobicContact CE2-CD2 3.64Å; F65-L93 HydrophobicContact CE2-CG 3.55Å; F65-L93 HydrophobicContact CZ-CD2 3.56Å; F65-L93 HydrophobicContact CZ-CG 4.02Å; E68-L93 HydrophobicContact CB-CD1 4.39Å; E68-L93 HydrophobicContact CG-CD1 3.71Å; L69-L93 HydrophobicContact CB-CD2 3.91Å; L69-L93 HydrophobicContact CD1-CD2 3.79Å; L69-L93 HydrophobicContact CG-CD2 4.37Å; L72-L93 HydrophobicContact CD1-CD1 4.03Å; L83-L93 HydrophobicContact CD1-CB 4.24Å; L83-L93 HydrophobicContact CD1-CD2 4.35Å; L93-M95 HydrophobicContact CB-CE 4.41Å; L93-M95 HydrophobicContact CB-CG 4.1Å; L93-M95 HydrophobicContact CB-SD 4.18Å; L93-M95 HydrophobicContact CD1-SD 4.25Å
94	V	95.3	Very high	93.4	Very high	0 Å²	0	32 Å²	32	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	116.3	173.4	-171.3	0	0	0	0	108.5	I22 I27 V51 I53 Y84 G85	I22-V94 HydrophobicContact CD1-CB 3.77Å; I22-V94 HydrophobicContact CD1-CG1 4.03Å; I22-V94 HydrophobicContact CD1-CG2 3.75Å; I27-V94 HydrophobicContact CD1-CG2 3.72Å; V51-V94 HydrophobicContact CB-CG1 4Å; V51-V94 HydrophobicContact CG1-CG1 4.16Å; V51-V94 HydrophobicContact CG2-CG1 3.97Å; I53-V94 HydrophobicContact CG2-CG1 4.39Å; I53-V94 HydrophobicContact CG2-CG2 4.21Å; Y84-V94 PolarHBondContact N-O 2.7Å; G85-V94 PolarHBondContact N-O 3.08Å; G85-V94 PolarHBondContact O-N 3.21Å
95	M	95.1	Very high	93.4	Very high	16 Å²	16	35 Å²	35	8%	0.079	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	167.3	-165.9	-60.3	179.6	-65.6	0	0	112.2	V51 A52 K54 L72 V81 K82 L83 Y84 L93 Y97	V51-M95 CarbonylContact C-O 3.44Å; V51-M95 VanDerWaalsContact CA-O 3.3Å; V51-M95 WeakPolarHBondContact CA-O 3.48Å; V51-M95 WeakPolarHBondContact CB-O 3.24Å; A52-M95 PolarHBondContact N-O 3.17Å; A52-M95 PolarHBondContact O-N 3.4Å; K54-M95 HydrophobicContact CB-CE 3.68Å; K54-M95 HydrophobicContact CD-CE 4.41Å; L72-M95 HydrophobicContact CD1-SD 3.94Å; V81-M95 HydrophobicContact CG2-CB 4.31Å; K82-M95 CarbonylContact O-C 3.57Å; K82-M95 WeakPolarHBondContact O-CA 3.32Å; L83-M95 HydrophobicContact CD1-CG 4.04Å; Y84-M95 VanDerWaalsContact CE2-C 3.4Å; Y84-M95 WeakPolarHBondContact CE2-O 3.48Å; L93-M95 HydrophobicContact CB-CE 4.41Å; L93-M95 HydrophobicContact CB-CG 4.1Å; L93-M95 HydrophobicContact CB-SD 4.18Å; L93-M95 HydrophobicContact CD1-SD 4.25Å; M95-Y97 PolarHBondContact O-N 3.49Å
96	E	94.6	Very high	93.6	Very high	38 Å²	38	35.1 Å²	35.1	18%	0.178	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56	117.3	167.2	-173.5	172.7	-146.8	0	0	111.2	V81 K82 Y84 K163	V81-E96 HydrophobicContact CG2-CB 3.99Å; K82-E96 HydrophobicContact CB-CB 4.11Å; K82-E96 WeakPolarHBondContact CB-OE2 3.02Å; K82-E96 PolarHBondContact N-OE2 3.18Å; K82-E96 PolarHBondContact O-N 2.88Å; Y84-E96 HydrophobicContact CE2-CB 4.23Å; Y84-E96 VanDerWaalsContact CE2-N 3.31Å; E96-K163 WeakPolarHBondContact OE1-CE 3.48Å; E96-K163 IonicContact OE1-NZ 3.36Å; E96-K163 PolarHBondContact OE1-NZ 3.1Å; E96-K163 WeakPolarHBondContact OE2-CD 3.42Å; E96-K163 VanDerWaalsContact OE2-CE 3.25Å; E96-K163 WeakPolarHBondContact OE2-CE 3.4Å; E96-K163 IonicContact OE2-NZ 3.69Å; E96-K163 PolarHBondContact OE2-NZ 3.42Å
97	Y	96.4	Very high	93.8	Very high	52 Å²	52	34.6 Å²	34.6	20%	0.204	19%	0.194	C	C	.	.			trans	-66.3	142.4	168.3	-174.2	-109.7	0	0	0	109.7	V33 K43 D50 A52 M95 E99	V33-Y97 HydrophobicContact CG1-CE2 4.28Å; K43-Y97 HydrophobicContact CB-CD2 4.32Å; K43-Y97 HydrophobicContact CB-CE2 3.84Å; K43-Y97 HydrophobicContact CD-CE1 4.16Å; K43-Y97 HydrophobicContact CD-CE2 3.89Å; K43-Y97 HydrophobicContact CG-CD2 3.98Å; K43-Y97 HydrophobicContact CG-CE2 3.66Å; D50-Y97 HydrophobicContact CB-CD1 4.34Å; D50-Y97 HydrophobicContact CB-CG 4.49Å; A52-Y97 HydrophobicContact CB-CD2 4.32Å; M95-Y97 PolarHBondContact O-N 3.49Å; Y97-E99 HydrophobicContact CD1-CB 4.31Å; Y97-E99 HydrophobicContact CE1-CB 3.94Å
98	A	95.8	Very high	93.9	Very high	11 Å²	11	35.9 Å²	35.9	9%	0.091	20%	0.199	C	C	.	.			trans	-121.9	103.9	178.8	0	0	0	0	0	110.4	G100 G101 L154 V156	A98-G100 VanDerWaalsContact C-N 3.33Å; A98-G100 PolarHBondContact O-N 3.41Å; A98-G101 PolarHBondContact O-N 3.22Å; A98-G101 VanDerWaalsContact O-N 3.13Å; A98-L154 HydrophobicContact CB-CB 3.73Å; A98-L154 HydrophobicContact CB-CD1 3.94Å; A98-L154 HydrophobicContact CB-CG 4.37Å; A98-V156 HydrophobicContact CB-CG1 3.56Å
99	E	94.2	Very high	94.2	Very high	104 Å²	104	32.5 Å²	32.5	49%	0.486	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74	-21	-167	79.4	-68.6	172	0	0	114.2	Y97 G101 V156 A157 G158	Y97-E99 HydrophobicContact CD1-CB 4.31Å; Y97-E99 HydrophobicContact CE1-CB 3.94Å; E99-G101 VanDerWaalsContact C-N 3.26Å; E99-G101 PolarHBondContact O-N 3.49Å; E99-V156 WeakPolarHBondContact OE1-CA 3.48Å; E99-V156 WeakPolarHBondContact OE2-CB 3.26Å; E99-A157 WeakPolarHBondContact OE1-CA 3.25Å; E99-A157 PolarHBondContact OE1-N 3.15Å; E99-G158 PolarHBondContact OE1-N 3.1Å
100	G	92.9	Very high	94.4	Very high	20 Å²	20	32 Å²	32	21%	0.206	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-0.6	171.6	0	0	0	0	0	114.3	A98 L155	A98-G100 VanDerWaalsContact C-N 3.33Å; A98-G100 PolarHBondContact O-N 3.41Å; G100-L155 WeakPolarHBondContact CA-O 3.48Å; G100-L155 PolarHBondContact N-O 3.01Å
101	G	94.3	Very high	94.6	Very high	27 Å²	27	37.5 Å²	37.5	28%	0.278	22%	0.215	S	C	.	.			trans	65.4	-149.9	-178	0	0	0	0	0	113	A98 E99 L154 L155	A98-G101 PolarHBondContact O-N 3.22Å; A98-G101 VanDerWaalsContact O-N 3.13Å; E99-G101 VanDerWaalsContact C-N 3.26Å; E99-G101 PolarHBondContact O-N 3.49Å; G101-L154 CarbonylContact O-C 3.58Å; G101-L154 VanDerWaalsContact O-CA 3.28Å; G101-L154 WeakPolarHBondContact O-CA 3.37Å; G101-L155 PolarHBondContact O-N 3.26Å
102	S	95.7	Very high	94.7	Very high	15 Å²	15	38.6 Å²	38.6	11%	0.105	22%	0.222	C	C	.	.	B	Isolated β-bridge	trans	-88.9	149.1	176.7	70.1	0	0	0	0	112.4	Y104 N105 V106 L153	S102-Y104 PolarHBondContact O-N 2.86Å; S102-N105 PolarHBondContact O-N 3.37Å; S102-N105 VanDerWaalsContact OG-CG 3.27Å; S102-N105 PolarHBondContact OG-N 3.36Å; S102-N105 PolarHBondContact OG-OD1 3.43Å; S102-V106 PolarHBondContact O-N 3.19Å; S102-V106 VanDerWaalsContact O-N 3.15Å; S102-L153 CarbonylContact C-O 3.3Å; S102-L153 WeakPolarHBondContact CA-O 3.42Å
103	L	98.1	Very high	94.7	Very high	1 Å²	1	40.9 Å²	40.9	1%	0.005	24%	0.235	C	C	.	.	H	α-helix	trans	-57.5	-33.4	171.2	179	63.2	0	0	0	111.1	N105 V106 L107 W124 P150 L153 L155 L162 V213	L103-N105 VanDerWaalsContact C-N 3.34Å; L103-N105 PolarHBondContact O-N 3.27Å; L103-V106 PolarHBondContact O-N 3.29Å; L103-L107 HydrophobicContact CD1-CD1 4.26Å; L103-L107 HydrophobicContact CD1-CG 4.11Å; L103-L107 HydrophobicContact CG-CD1 3.95Å; L103-L107 HydrophobicContact CG-CG 4.25Å; L103-L107 WeakPolarHBondContact O-CB 3.36Å; L103-L107 VanDerWaalsContact O-CG 3.25Å; L103-L107 WeakPolarHBondContact O-CG 3.33Å; L103-L107 PolarHBondContact O-N 2.85Å; L103-W124 HydrophobicContact CD1-CD2 3.85Å; L103-W124 HydrophobicContact CD1-CE3 3.54Å; L103-W124 HydrophobicContact CD1-CG 4.5Å; L103-W124 HydrophobicContact CD1-CH2 4.22Å; L103-W124 HydrophobicContact CD1-CZ2 4.49Å; L103-W124 HydrophobicContact CD1-CZ3 3.75Å; L103-P150 HydrophobicContact CB-CB 4.2Å; L103-P150 HydrophobicContact CD2-CB 4.3Å; L103-P150 HydrophobicContact CG-CB 4.17Å; L103-P150 PolarHBondContact N-O 3.39Å; L103-L153 HydrophobicContact CB-CB 4.16Å; L103-L153 WeakPolarHBondContact CB-O 3.28Å; L103-L153 HydrophobicContact CD2-CB 4.38Å; L103-L153 HydrophobicContact CD2-CD1 4.05Å; L103-L153 PolarHBondContact N-O 2.89Å; L103-L155 HydrophobicContact CB-CD1 4.4Å; L103-L155 HydrophobicContact CD1-CD1 4.02Å; L103-L162 HydrophobicContact CD2-CD1 4.19Å; L103-V213 HydrophobicContact CD2-CG1 4.02Å
104	Y	96.6	Very high	94.9	Very high	63 Å²	63	41.1 Å²	41.1	25%	0.247	24%	0.236	C	C	.	.	H	α-helix	trans	-58.5	-42.6	172.7	-175.1	-93.8	0	0	0	112.8	S102 L107 H108 P150 P151 K218	S102-Y104 PolarHBondContact O-N 2.86Å; Y104-L107 PolarHBondContact O-N 3.02Å; Y104-H108 AromaticContact CD2-CD2 3.69Å; Y104-H108 HydrophobicContact CE2-CB 4.39Å; Y104-H108 AromaticContact CE2-CD2 3.69Å; Y104-H108 PolarHBondContact O-N 2.87Å; Y104-P150 PolarHBondContact N-O 3.42Å; Y104-P150 VanDerWaalsContact N-O 3.14Å; Y104-P151 HydrophobicContact CD2-CG 4.04Å; Y104-P151 HydrophobicContact CG-CG 3.94Å; Y104-K218 WeakPolarHBondContact OH-CE 3.33Å; Y104-K218 PolarHBondContact OH-NZ 3.47Å
105	N	94.8	Very high	94.9	Very high	93 Å²	93	48.2 Å²	48.2	50%	0.497	26%	0.264	S	S	.	.	H	α-helix	trans	-69.6	-37.7	178.4	-68.6	2.5	0	0	0	111.4	S102 L103 G109	S102-N105 PolarHBondContact O-N 3.37Å; S102-N105 VanDerWaalsContact OG-CG 3.27Å; S102-N105 PolarHBondContact OG-N 3.36Å; S102-N105 PolarHBondContact OG-OD1 3.43Å; L103-N105 VanDerWaalsContact C-N 3.34Å; L103-N105 PolarHBondContact O-N 3.27Å; N105-G109 VanDerWaalsContact O-CA 3.26Å; N105-G109 WeakPolarHBondContact O-CA 3.42Å; N105-G109 PolarHBondContact O-N 3.08Å
106	V	97	Very high	95	Very high	3 Å²	3	48.5 Å²	48.5	2%	0.018	26%	0.264	C	S	.	.	H	α-helix	trans	-64.9	-36.8	174	161.3	0	0	0	0	112.2	S102 L103 P114 W124 L155 R216 L289	S102-V106 PolarHBondContact O-N 3.19Å; S102-V106 VanDerWaalsContact O-N 3.15Å; L103-V106 PolarHBondContact O-N 3.29Å; V106-P114 HydrophobicContact CB-CG 4.49Å; V106-P114 HydrophobicContact CG1-CG 3.96Å; V106-P114 HydrophobicContact CG2-CG 4.45Å; V106-W124 HydrophobicContact CG1-CH2 3.91Å; V106-W124 HydrophobicContact CG1-CZ2 4.37Å; V106-L155 HydrophobicContact CB-CD1 4.03Å; V106-L155 HydrophobicContact CG1-CD1 4.17Å; V106-L155 HydrophobicContact CG2-CD1 3.76Å; V106-R216 PolarHBondContact O-NH2 2.88Å; V106-L289 HydrophobicContact CG1-CD1 3.8Å; V106-L289 HydrophobicContact CG2-CD1 4.09Å
107	L	97.6	Very high	95.2	Very high	1 Å²	1	48.6 Å²	48.6	1%	0.005	27%	0.267	C	S	.	.	H	α-helix	trans	-78.4	-50	178.3	-67.1	172.7	0	0	0	112.8	L103 Y104 Y116 W124 P150 E212 V213 R216	L103-L107 HydrophobicContact CD1-CD1 4.26Å; L103-L107 HydrophobicContact CD1-CG 4.11Å; L103-L107 HydrophobicContact CG-CD1 3.95Å; L103-L107 HydrophobicContact CG-CG 4.25Å; L103-L107 WeakPolarHBondContact O-CB 3.36Å; L103-L107 VanDerWaalsContact O-CG 3.25Å; L103-L107 WeakPolarHBondContact O-CG 3.33Å; L103-L107 PolarHBondContact O-N 2.85Å; Y104-L107 PolarHBondContact O-N 3.02Å; L107-Y116 HydrophobicContact CD2-CE1 3.71Å; L107-Y116 WeakPolarHBondContact CD2-OH 3.48Å; L107-W124 HydrophobicContact CD2-CZ3 4.48Å; L107-P150 HydrophobicContact CD1-CB 4.38Å; L107-P150 HydrophobicContact CD1-CG 4.45Å; L107-E212 HydrophobicContact CD1-CG 3.96Å; L107-V213 HydrophobicContact CD1-CG1 4.14Å; L107-V213 HydrophobicContact CD2-CG1 4.43Å; L107-R216 HydrophobicContact CD2-CG 4.25Å; L107-R216 PolarHBondContact O-NE 3.26Å
108	H	96.4	Very high	95.3	Very high	30 Å²	30	47.4 Å²	47.4	14%	0.139	27%	0.269	C	S	.	.	H	α-helix	trans	-135.8	16.5	-161.5	-42.5	-70.7	0	0	0	114.6	Y104 E212	Y104-H108 AromaticContact CD2-CD2 3.69Å; Y104-H108 HydrophobicContact CE2-CB 4.39Å; Y104-H108 AromaticContact CE2-CD2 3.69Å; Y104-H108 PolarHBondContact O-N 2.87Å; H108-E212 IonicContact CD2-OE1 3.48Å; H108-E212 IonicContact CE1-OE1 2.7Å; H108-E212 IonicContact NE2-OE1 2.78Å; H108-E212 PolarHBondContact NE2-OE1 3.24Å
109	G	93.4	Very high	95.4	Very high	28 Å²	28	47.6 Å²	47.6	29%	0.289	27%	0.269	S	S	.	.	S	Bend	trans	-72.5	-162.9	178.7	0	0	0	0	0	114.1	N105	N105-G109 VanDerWaalsContact O-CA 3.26Å; N105-G109 WeakPolarHBondContact O-CA 3.42Å; N105-G109 PolarHBondContact O-N 3.08Å
110	A	91	Very high	95.6	Very high	91 Å²	91	43 Å²	43	75%	0.752	25%	0.248	S	C	*	.	S	Bend	trans	-68.7	152	171.9	0	0	0	0	0	111.4
111	E	91.2	Very high	95.9	Very high	174 Å²	174	42.2 Å²	42.2	81%	0.813	24%	0.239	S	C	*	.	S	Bend	trans	-72.1	146.9	169.8	-69.8	-174.5	174.9	0	0	110.8	L113	E111-L113 HydrophobicContact CG-CG 4.49Å
112	P	92	Very high	96.1	Very high	43 Å²	43	41.1 Å²	41.1	28%	0.279	23%	0.226	S	C	.	.	S	Bend	cis	-85	121.4	9.1	34	-33.6	0	0	0	112.7	P292 Q294	P112-P292 HydrophobicContact CB-CB 4.22Å; P112-P292 HydrophobicContact CB-CG 4.19Å; P112-Q294 HydrophobicContact CG-CG 4.1Å
113	L	93.9	Very high	96.2	Very high	49 Å²	49	40.8 Å²	40.8	26%	0.257	22%	0.224	S	C	.	.	P	Polyproline II helix	trans	-75	139.9	177.6	-72.1	176.5	0	0	0	111.2	E111 P292	E111-L113 HydrophobicContact CG-CG 4.49Å; L113-P292 VanDerWaalsContact O-CD 3.28Å; L113-P292 WeakPolarHBondContact O-CD 3.48Å
114	P	95.9	Very high	96.3	Very high	4 Å²	4	40.9 Å²	40.9	3%	0.026	23%	0.225	C	C	.	.	P	Polyproline II helix	trans	-71.2	152.7	-179.9	28.8	-34.8	0	0	0	112.2	V106 R216 L289 Q290 Y291	V106-P114 HydrophobicContact CB-CG 4.49Å; V106-P114 HydrophobicContact CG1-CG 3.96Å; V106-P114 HydrophobicContact CG2-CG 4.45Å; P114-R216 PolarHBondContact O-NH1 3.19Å; P114-R216 PolarHBondContact O-NH2 3.48Å; P114-L289 HydrophobicContact CB-CB 4.27Å; P114-L289 HydrophobicContact CG-CD1 4.37Å; P114-Q290 WeakPolarHBondContact CA-O 3.27Å; P114-Y291 HydrophobicContact CB-CD1 3.96Å; P114-Y291 HydrophobicContact CB-CD2 4.09Å; P114-Y291 HydrophobicContact CB-CE1 3.83Å; P114-Y291 HydrophobicContact CB-CE2 3.94Å; P114-Y291 HydrophobicContact CB-CG 4.09Å; P114-Y291 HydrophobicContact CG-CD1 4.41Å; P114-Y291 HydrophobicContact CG-CE1 3.85Å; P114-Y291 HydrophobicContact CG-CE2 4.44Å
115	Y	95.9	Very high	96.4	Very high	149 Å²	149	38 Å²	38	58%	0.584	21%	0.213	S	C	*	.	B	Isolated β-bridge	trans	-78.5	138.3	165.4	178.9	-101.8	0	0	0	110.3	T117 Q290	Y115-T117 HydrophobicContact CE1-CG2 3.96Å; Y115-Q290 PolarHBondContact N-O 3.29Å
116	Y	97.9	Very high	96.6	Very high	22 Å²	22	35.7 Å²	35.7	9%	0.086	20%	0.198	C	C	.	.			trans	-141.3	154.3	173.7	72.7	-99.2	0	0	0	111.2	L107 H120 A121 W124 V213 R216	L107-Y116 HydrophobicContact CD2-CE1 3.71Å; L107-Y116 WeakPolarHBondContact CD2-OH 3.48Å; Y116-H120 HydrophobicContact CD2-CB 4.43Å; Y116-A121 HydrophobicContact CE2-CB 4.18Å; Y116-W124 HydrophobicContact CD1-CH2 4.08Å; Y116-W124 HydrophobicContact CD1-CZ3 4.28Å; Y116-W124 HydrophobicContact CD2-CH2 4.01Å; Y116-W124 AromaticContact CD2-CZ3 3.79Å; Y116-W124 HydrophobicContact CD2-CZ3 3.79Å; Y116-W124 HydrophobicContact CE1-CZ3 4.48Å; Y116-W124 HydrophobicContact CE2-CZ3 4.04Å; Y116-W124 AromaticContact CG-CH2 3.71Å; Y116-W124 HydrophobicContact CG-CH2 3.71Å; Y116-W124 AromaticContact CG-CZ3 3.93Å; Y116-W124 HydrophobicContact CG-CZ3 3.93Å; Y116-V213 VanDerWaalsContact CE2-O 3.3Å; Y116-V213 WeakPolarHBondContact CE2-O 3.42Å; Y116-V213 PolarHBondContact OH-O 2.88Å; Y116-R216 HydrophobicContact CE1-CG 4.07Å; Y116-R216 WeakPolarHBondContact OH-CB 3.27Å
117	T	98	Very high	96.6	Very high	40 Å²	40	36.4 Å²	36.4	25%	0.245	20%	0.201	C	C	.	.			trans	-97.9	166.8	-176	65.3	0	0	0	0	111.6	Y115 S119 H120 A121	Y115-T117 HydrophobicContact CE1-CG2 3.96Å; T117-S119 PolarHBondContact O-N 2.84Å; T117-S119 WeakPolarHBondContact OG1-CB 3.37Å; T117-S119 PolarHBondContact OG1-N 3.46Å; T117-H120 PolarHBondContact N-ND1 3.4Å; T117-H120 PolarHBondContact O-N 2.92Å; T117-H120 VanDerWaalsContact O-N 3.09Å; T117-H120 PolarHBondContact OG1-CD2 3.26Å; T117-H120 PolarHBondContact OG1-N 3.16Å; T117-H120 VanDerWaalsContact OG1-N 3.09Å; T117-A121 PolarHBondContact O-N 2.89Å; T117-A121 VanDerWaalsContact O-N 3.11Å
118	A	97.8	Very high	96.7	Very high	28 Å²	28	36.4 Å²	36.4	23%	0.231	20%	0.201	C	C	.	.	H	α-helix	trans	-58.8	-27.7	166.9	0	0	0	0	0	112.4	A121 M122 F282 V426	A118-A121 PolarHBondContact O-N 3.06Å; A118-M122 WeakPolarHBondContact O-CB 3.28Å; A118-M122 VanDerWaalsContact O-CG 3.26Å; A118-M122 WeakPolarHBondContact O-CG 3.34Å; A118-M122 PolarHBondContact O-N 3.43Å; A118-F282 HydrophobicContact CB-CD1 4.11Å; A118-F282 HydrophobicContact CB-CE1 3.95Å; A118-V426 HydrophobicContact CB-CB 3.8Å; A118-V426 HydrophobicContact CB-CG1 4.21Å; A118-V426 HydrophobicContact CB-CG2 3.78Å
119	S	98.3	Very high	96.8	Very high	14 Å²	14	35 Å²	35	10%	0.098	20%	0.195	C	C	.	.	H	α-helix	trans	-66.9	-37.2	173.7	-48.8	0	0	0	0	112.5	T117 S123 F282 P283 G284 S285	T117-S119 PolarHBondContact O-N 2.84Å; T117-S119 WeakPolarHBondContact OG1-CB 3.37Å; T117-S119 PolarHBondContact OG1-N 3.46Å; S119-S123 WeakPolarHBondContact O-CB 3.43Å; S119-S123 PolarHBondContact O-N 2.91Å; S119-F282 PolarHBondContact OG-O 3.1Å; S119-P283 VanDerWaalsContact CB-O 3.31Å; S119-P283 WeakPolarHBondContact CB-O 3.37Å; S119-P283 PolarHBondContact OG-O 3.18Å; S119-G284 WeakPolarHBondContact CB-O 3.35Å; S119-S285 WeakPolarHBondContact O-CB 3.37Å
120	H	98.7	Very high	97.1	Very high	9 Å²	9	36.1 Å²	36.1	4%	0.042	19%	0.193	C	C	.	.	H	α-helix	trans	-65.1	-49.5	171.5	-58.6	168.9	0	0	0	110.7	Y116 T117 M122 S123 W124 E287 L289	Y116-H120 HydrophobicContact CD2-CB 4.43Å; T117-H120 PolarHBondContact N-ND1 3.4Å; T117-H120 PolarHBondContact O-N 2.92Å; T117-H120 VanDerWaalsContact O-N 3.09Å; T117-H120 PolarHBondContact OG1-CD2 3.26Å; T117-H120 PolarHBondContact OG1-N 3.16Å; T117-H120 VanDerWaalsContact OG1-N 3.09Å; H120-M122 PolarHBondContact O-N 2.95Å; H120-S123 PolarHBondContact O-N 2.78Å; H120-W124 HydrophobicContact CB-CD2 4.41Å; H120-W124 HydrophobicContact CB-CH2 4.03Å; H120-W124 HydrophobicContact CB-CZ2 3.86Å; H120-W124 HydrophobicContact CB-CZ3 4.36Å; H120-W124 WeakPolarHBondContact O-CB 3.31Å; H120-W124 VanDerWaalsContact O-CD2 3.28Å; H120-W124 PolarHBondContact O-N 2.93Å; H120-E287 PolarHBondContact CE1-O 3.19Å; H120-E287 PolarHBondContact NE2-O 2.72Å; H120-L289 WeakPolarHBondContact ND1-CD2 3.34Å
121	A	98.7	Very high	97.4	Very high	2 Å²	2	31.8 Å²	31.8	2%	0.017	16%	0.157	C	C	.	.	H	α-helix	trans	-55.9	-48.3	178.6	0	0	0	0	0	112.8	Y116 T117 A118 C125 V213	Y116-A121 HydrophobicContact CE2-CB 4.18Å; T117-A121 PolarHBondContact O-N 2.89Å; T117-A121 VanDerWaalsContact O-N 3.11Å; A118-A121 PolarHBondContact O-N 3.06Å; A121-C125 PolarHBondContact O-N 3.34Å; A121-V213 HydrophobicContact CB-CB 4.01Å; A121-V213 HydrophobicContact CB-CG2 3.85Å
122	M	98.7	Very high	97.8	Very high	4 Å²	4	23.5 Å²	23.5	2%	0.02	12%	0.118	C	C	.	.	H	α-helix	trans	-68.5	-37.5	178.2	-66.7	-63.2	-71.4	0	0	112.1	A118 H120 C125 Y126 L210 I250 M275 L278 M279 F282	A118-M122 WeakPolarHBondContact O-CB 3.28Å; A118-M122 VanDerWaalsContact O-CG 3.26Å; A118-M122 WeakPolarHBondContact O-CG 3.34Å; A118-M122 PolarHBondContact O-N 3.43Å; H120-M122 PolarHBondContact O-N 2.95Å; M122-C125 PolarHBondContact O-N 3.01Å; M122-Y126 VanDerWaalsContact O-CB 3.31Å; M122-Y126 WeakPolarHBondContact O-CB 3.47Å; M122-Y126 PolarHBondContact O-N 3.24Å; M122-L210 HydrophobicContact SD-CD1 4.13Å; M122-I250 HydrophobicContact CE-CD1 3.9Å; M122-I250 HydrophobicContact CE-CG1 4.2Å; M122-I250 HydrophobicContact SD-CD1 4.11Å; M122-M275 HydrophobicContact CB-CE 4.37Å; M122-M275 HydrophobicContact CE-CE 3.61Å; M122-M275 HydrophobicContact CE-SD 3.73Å; M122-M275 WeakPolarHBondContact O-CE 3.49Å; M122-M275 HydrophobicContact SD-CE 4.19Å; M122-L278 HydrophobicContact CE-CB 4.07Å; M122-L278 HydrophobicContact CE-CD1 3.87Å; M122-M279 HydrophobicContact CB-SD 3.67Å; M122-F282 HydrophobicContact CB-CD2 4.28Å; M122-F282 HydrophobicContact CB-CG 4.33Å; M122-F282 HydrophobicContact CE-CD2 4.36Å; M122-F282 HydrophobicContact CE-CE2 3.98Å; M122-F282 HydrophobicContact CG-CD1 4.22Å; M122-F282 HydrophobicContact CG-CD2 3.91Å; M122-F282 HydrophobicContact CG-CE1 4.22Å; M122-F282 HydrophobicContact CG-CE2 3.92Å; M122-F282 HydrophobicContact CG-CG 4.08Å; M122-F282 HydrophobicContact CG-CZ 4.08Å
123	S	98.8	Very high	98.1	Very high	9 Å²	9	22.7 Å²	22.7	6%	0.063	12%	0.115	C	C	.	.	H	α-helix	trans	-65.1	-45.1	176.4	-178.7	0	0	0	0	112.4	S119 H120 C125 Y126 Q127	S119-S123 WeakPolarHBondContact O-CB 3.43Å; S119-S123 PolarHBondContact O-N 2.91Å; H120-S123 PolarHBondContact O-N 2.78Å; S123-C125 PolarHBondContact O-N 3.44Å; S123-Y126 PolarHBondContact O-N 2.9Å; S123-Q127 WeakPolarHBondContact O-CB 3.08Å; S123-Q127 VanDerWaalsContact O-CG 3.31Å; S123-Q127 WeakPolarHBondContact O-CG 3.48Å; S123-Q127 PolarHBondContact O-N 3.08Å; S123-Q127 PolarHBondContact OG-NE2 3.45Å
124	W	98.9	Very high	98.3	Very high	3 Å²	3	23.5 Å²	23.5	1%	0.011	12%	0.115	C	C	.	.	H	α-helix	trans	-59.4	-46.6	175.7	-64.6	-28.7	0	0	0	111.6	L103 V106 L107 Y116 H120 Y126 Q127 C128 L155 G159 L162 V213 L289	L103-W124 HydrophobicContact CD1-CD2 3.85Å; L103-W124 HydrophobicContact CD1-CE3 3.54Å; L103-W124 HydrophobicContact CD1-CG 4.5Å; L103-W124 HydrophobicContact CD1-CH2 4.22Å; L103-W124 HydrophobicContact CD1-CZ2 4.49Å; L103-W124 HydrophobicContact CD1-CZ3 3.75Å; V106-W124 HydrophobicContact CG1-CH2 3.91Å; V106-W124 HydrophobicContact CG1-CZ2 4.37Å; L107-W124 HydrophobicContact CD2-CZ3 4.48Å; Y116-W124 HydrophobicContact CD1-CH2 4.08Å; Y116-W124 HydrophobicContact CD1-CZ3 4.28Å; Y116-W124 HydrophobicContact CD2-CH2 4.01Å; Y116-W124 AromaticContact CD2-CZ3 3.79Å; Y116-W124 HydrophobicContact CD2-CZ3 3.79Å; Y116-W124 HydrophobicContact CE1-CZ3 4.48Å; Y116-W124 HydrophobicContact CE2-CZ3 4.04Å; Y116-W124 AromaticContact CG-CH2 3.71Å; Y116-W124 HydrophobicContact CG-CH2 3.71Å; Y116-W124 AromaticContact CG-CZ3 3.93Å; Y116-W124 HydrophobicContact CG-CZ3 3.93Å; H120-W124 HydrophobicContact CB-CD2 4.41Å; H120-W124 HydrophobicContact CB-CH2 4.03Å; H120-W124 HydrophobicContact CB-CZ2 3.86Å; H120-W124 HydrophobicContact CB-CZ3 4.36Å; H120-W124 WeakPolarHBondContact O-CB 3.31Å; H120-W124 VanDerWaalsContact O-CD2 3.28Å; H120-W124 PolarHBondContact O-N 2.93Å; W124-Y126 PolarHBondContact O-N 3.4Å; W124-Q127 PolarHBondContact O-N 3.03Å; W124-C128 VanDerWaalsContact O-CB 3.26Å; W124-C128 WeakPolarHBondContact O-CB 3.35Å; W124-C128 PolarHBondContact O-N 2.85Å; W124-L155 HydrophobicContact CG-CD2 4.4Å; W124-L155 HydrophobicContact CZ2-CD1 4.24Å; W124-G159 PolarHBondContact NE1-O 2.94Å; W124-L162 HydrophobicContact CB-CD1 3.72Å; W124-L162 HydrophobicContact CG-CD1 4.21Å; W124-V213 HydrophobicContact CE3-CB 4.49Å; W124-V213 HydrophobicContact CE3-CG1 4.19Å; W124-L289 HydrophobicContact CH2-CD2 4.25Å; W124-L289 HydrophobicContact CZ2-CD1 4.11Å; W124-L289 HydrophobicContact CZ2-CD2 3.98Å; W124-L289 HydrophobicContact CZ2-CG 4.45Å
125	C	98.9	Very high	98.3	Very high	1 Å²	1	23.3 Å²	23.3	1%	0.007	11%	0.114	C	C	.	.	H	α-helix	trans	-65.3	-36.6	175.9	-76.4	0	0	0	0	112.9	A121 M122 S123 S129 W206 L210 V213 M275	A121-C125 PolarHBondContact O-N 3.34Å; M122-C125 PolarHBondContact O-N 3.01Å; S123-C125 PolarHBondContact O-N 3.44Å; C125-S129 PolarHBondContact O-N 2.93Å; C125-S129 PolarHBondContact O-OG 3.05Å; C125-W206 HydrophobicContact CB-CZ2 3.84Å; C125-W206 PolarHBondContact O-NE1 2.81Å; C125-L210 HydrophobicContact CB-CD1 3.96Å; C125-V213 VanDerWaalsContact SG-CG2 3.55Å; C125-M275 HydrophobicContact CB-CE 3.91Å
126	Y	98.9	Very high	98.3	Very high	45 Å²	45	17.5 Å²	17.5	18%	0.176	9%	0.092	C	C	.	.	H	α-helix	trans	-65.2	-50.2	174.8	177	-133.4	0	0	0	112	M122 S123 W124 C128 S129 Q130 V272 M275 T276 M279	M122-Y126 VanDerWaalsContact O-CB 3.31Å; M122-Y126 WeakPolarHBondContact O-CB 3.47Å; M122-Y126 PolarHBondContact O-N 3.24Å; S123-Y126 PolarHBondContact O-N 2.9Å; W124-Y126 PolarHBondContact O-N 3.4Å; Y126-C128 VanDerWaalsContact C-N 3.29Å; Y126-C128 PolarHBondContact O-N 3.1Å; Y126-S129 PolarHBondContact O-N 2.67Å; Y126-S129 VanDerWaalsContact O-N 3.1Å; Y126-S129 PolarHBondContact O-OG 2.84Å; Y126-Q130 HydrophobicContact CD2-CG 4.18Å; Y126-Q130 HydrophobicContact CE2-CG 3.94Å; Y126-Q130 WeakPolarHBondContact O-CG 3.25Å; Y126-Q130 PolarHBondContact O-N 2.73Å; Y126-V272 HydrophobicContact CE2-CG1 4.17Å; Y126-M275 HydrophobicContact CD2-CB 3.46Å; Y126-M275 VanDerWaalsContact CD2-CB 3.46Å; Y126-M275 HydrophobicContact CE2-CB 4.22Å; Y126-M275 HydrophobicContact CG-CB 4.09Å; Y126-T276 VanDerWaalsContact CE2-OG1 3.23Å; Y126-T276 WeakPolarHBondContact CE2-OG1 3.37Å; Y126-T276 PolarHBondContact OH-OG1 3.32Å; Y126-M279 HydrophobicContact CD1-CG 4.02Å; Y126-M279 HydrophobicContact CG-CG 4.32Å
127	Q	98.9	Very high	98.2	Very high	19 Å²	19	18.5 Å²	18.5	9%	0.089	11%	0.108	C	C	.	.	H	α-helix	trans	-60.2	-38.9	177.2	-74.6	-177.4	72.5	0	0	112.4	N79 S123 W124 Q130 G131 T160 V161 L162	N79-Q127 VanDerWaalsContact CB-O 3.3Å; N79-Q127 WeakPolarHBondContact CB-O 3.21Å; N79-Q127 WeakPolarHBondContact ND2-CB 3.36Å; N79-Q127 PolarHBondContact ND2-OE1 3.32Å; S123-Q127 WeakPolarHBondContact O-CB 3.08Å; S123-Q127 VanDerWaalsContact O-CG 3.31Å; S123-Q127 WeakPolarHBondContact O-CG 3.48Å; S123-Q127 PolarHBondContact O-N 3.08Å; S123-Q127 PolarHBondContact OG-NE2 3.45Å; W124-Q127 PolarHBondContact O-N 3.03Å; Q127-Q130 PolarHBondContact O-N 3.09Å; Q127-G131 PolarHBondContact O-N 2.55Å; Q127-G131 VanDerWaalsContact O-N 3.09Å; Q127-T160 PolarHBondContact NE2-O 2.83Å; Q127-V161 VanDerWaalsContact OE1-CA 3.3Å; Q127-L162 HydrophobicContact CB-CB 4.07Å; Q127-L162 HydrophobicContact CB-CD2 4.47Å
128	C	98.9	Very high	98	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-61.4	-49.7	171.8	-175.7	0	0	0	0	111.1	W124 Y126 Q130 G131 V132 L162	W124-C128 VanDerWaalsContact O-CB 3.26Å; W124-C128 WeakPolarHBondContact O-CB 3.35Å; W124-C128 PolarHBondContact O-N 2.85Å; Y126-C128 VanDerWaalsContact C-N 3.29Å; Y126-C128 PolarHBondContact O-N 3.1Å; C128-Q130 VanDerWaalsContact C-N 3.29Å; C128-Q130 PolarHBondContact O-N 3.49Å; C128-G131 PolarHBondContact O-N 2.71Å; C128-V132 WeakPolarHBondContact O-CG2 3.18Å; C128-V132 PolarHBondContact O-N 3.47Å; C128-L162 HydrophobicContact CB-CD2 3.93Å
129	S	98.9	Very high	97.4	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-64.4	-31.3	179.2	67	0	0	0	0	113.1	C125 Y126 A133 V272	C125-S129 PolarHBondContact O-N 2.93Å; C125-S129 PolarHBondContact O-OG 3.05Å; Y126-S129 PolarHBondContact O-N 2.67Å; Y126-S129 VanDerWaalsContact O-N 3.1Å; Y126-S129 PolarHBondContact O-OG 2.84Å; S129-A133 WeakPolarHBondContact O-CB 3.49Å; S129-A133 PolarHBondContact O-N 2.97Å; S129-V272 VanDerWaalsContact C-CG2 3.44Å; S129-V272 WeakPolarHBondContact O-CG2 3.23Å; S129-V272 WeakPolarHBondContact OG-CG2 3.46Å
130	Q	98.9	Very high	96.8	Very high	53 Å²	53	28.9 Å²	28.9	25%	0.248	16%	0.157	C	C	.	.	H	α-helix	trans	-63.8	-47.9	171.9	-68.2	175	-82.1	0	0	111.8	Y126 Q127 C128 A133 Y134 V272	Y126-Q130 HydrophobicContact CD2-CG 4.18Å; Y126-Q130 HydrophobicContact CE2-CG 3.94Å; Y126-Q130 WeakPolarHBondContact O-CG 3.25Å; Y126-Q130 PolarHBondContact O-N 2.73Å; Q127-Q130 PolarHBondContact O-N 3.09Å; C128-Q130 VanDerWaalsContact C-N 3.29Å; C128-Q130 PolarHBondContact O-N 3.49Å; Q130-A133 PolarHBondContact O-N 3.16Å; Q130-Y134 PolarHBondContact O-N 3.33Å; Q130-V272 HydrophobicContact CG-CG1 4.27Å; Q130-V272 HydrophobicContact CG-CG2 4.09Å
131	G	98.6	Very high	96.1	Very high	0 Å²	0	33 Å²	33	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-61.9	-42.4	176.3	0	0	0	0	0	113.1	Q127 C128 Y134 L135	Q127-G131 PolarHBondContact O-N 2.55Å; Q127-G131 VanDerWaalsContact O-N 3.09Å; C128-G131 PolarHBondContact O-N 2.71Å; G131-Y134 WeakPolarHBondContact O-CB 3.38Å; G131-Y134 PolarHBondContact O-N 3.01Å; G131-L135 WeakPolarHBondContact O-CG 3.46Å; G131-L135 PolarHBondContact O-N 3.09Å
132	V	98.5	Very high	95.7	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-71.1	-38.9	177.5	-173.4	0	0	0	0	111.7	C128 Y134 L135 H136 L148 I164 D202 M268	C128-V132 WeakPolarHBondContact O-CG2 3.18Å; C128-V132 PolarHBondContact O-N 3.47Å; V132-Y134 VanDerWaalsContact C-N 3.27Å; V132-Y134 PolarHBondContact O-N 2.9Å; V132-L135 WeakPolarHBondContact O-CB 3.46Å; V132-L135 PolarHBondContact O-N 3.45Å; V132-L135 VanDerWaalsContact O-N 3.15Å; V132-H136 VanDerWaalsContact CG1-CE1 3.46Å; V132-H136 WeakPolarHBondContact CG1-CE1 3.44Å; V132-H136 VanDerWaalsContact CG1-NE2 3.32Å; V132-H136 WeakPolarHBondContact CG1-NE2 3.34Å; V132-H136 PolarHBondContact O-CD2 3.45Å; V132-H136 PolarHBondContact O-N 3.49Å; V132-L148 HydrophobicContact CG1-CD1 4.29Å; V132-L148 HydrophobicContact CG2-CD1 3.63Å; V132-L148 HydrophobicContact CG2-CD2 4.06Å; V132-L148 HydrophobicContact CG2-CG 4.47Å; V132-I164 HydrophobicContact CG2-CD1 3.73Å; V132-D202 HydrophobicContact CG1-CB 3.92Å; V132-M268 HydrophobicContact CB-CE 4.25Å; V132-M268 HydrophobicContact CB-CG 4.1Å; V132-M268 HydrophobicContact CB-SD 4.14Å; V132-M268 HydrophobicContact CG1-CE 3.95Å; V132-M268 HydrophobicContact CG1-CG 3.73Å; V132-M268 HydrophobicContact CG1-SD 4.2Å
133	A	98.6	Very high	95.2	Very high	26 Å²	26	33.7 Å²	33.7	22%	0.215	18%	0.181	C	C	.	.	H	α-helix	trans	-59.8	-37.4	173.9	0	0	0	0	0	112.3	S129 Q130 G137 M268 V272	S129-A133 WeakPolarHBondContact O-CB 3.49Å; S129-A133 PolarHBondContact O-N 2.97Å; Q130-A133 PolarHBondContact O-N 3.16Å; A133-G137 PolarHBondContact O-N 3.06Å; A133-M268 HydrophobicContact CB-CB 3.9Å; A133-V272 HydrophobicContact CB-CG2 3.91Å
134	Y	98.2	Very high	94.9	Very high	66 Å²	66	33.3 Å²	33.3	26%	0.259	18%	0.178	S	C	.	.	H	α-helix	trans	-61.9	-47.4	172.9	170.7	-89.2	0	0	0	111.8	V75 N76 H77 I80 Q130 G131 V132 G137 M138	V75-Y134 HydrophobicContact CB-CE1 3.94Å; V75-Y134 HydrophobicContact CG1-CE1 4.04Å; N76-Y134 PolarHBondContact N-OH 2.93Å; N76-Y134 PolarHBondContact O-OH 3.44Å; H77-Y134 HydrophobicContact CB-CD1 3.88Å; H77-Y134 HydrophobicContact CB-CD2 4.15Å; H77-Y134 HydrophobicContact CB-CE1 4.11Å; H77-Y134 HydrophobicContact CB-CE2 4.35Å; H77-Y134 HydrophobicContact CB-CG 3.9Å; H77-Y134 AromaticContact CD2-CD2 3.82Å; H77-Y134 AromaticContact CD2-CG 3.84Å; H77-Y134 AromaticContact CG-CG 3.95Å; I80-Y134 HydrophobicContact CD1-CD1 3.72Å; I80-Y134 HydrophobicContact CD1-CE1 4.12Å; Q130-Y134 PolarHBondContact O-N 3.33Å; G131-Y134 WeakPolarHBondContact O-CB 3.38Å; G131-Y134 PolarHBondContact O-N 3.01Å; V132-Y134 VanDerWaalsContact C-N 3.27Å; V132-Y134 PolarHBondContact O-N 2.9Å; Y134-G137 PolarHBondContact O-N 3.28Å; Y134-G137 VanDerWaalsContact O-N 3.15Å; Y134-M138 WeakPolarHBondContact O-CG 3.5Å; Y134-M138 PolarHBondContact O-N 3.01Å
135	L	96	Very high	94.6	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-60.5	-46.1	177.4	-66	168	0	0	0	112	V75 I80 G131 V132 G137 M138 L143 F167	V75-L135 HydrophobicContact CG1-CD2 3.77Å; I80-L135 HydrophobicContact CD1-CD1 4.36Å; I80-L135 HydrophobicContact CD1-CD2 3.89Å; I80-L135 HydrophobicContact CD1-CG 3.95Å; G131-L135 WeakPolarHBondContact O-CG 3.46Å; G131-L135 PolarHBondContact O-N 3.09Å; V132-L135 WeakPolarHBondContact O-CB 3.46Å; V132-L135 PolarHBondContact O-N 3.45Å; V132-L135 VanDerWaalsContact O-N 3.15Å; L135-G137 VanDerWaalsContact C-N 3.25Å; L135-G137 PolarHBondContact O-N 2.97Å; L135-M138 HydrophobicContact CD2-SD 4.16Å; L135-M138 WeakPolarHBondContact O-CB 3.47Å; L135-M138 WeakPolarHBondContact O-CG 3.35Å; L135-M138 PolarHBondContact O-N 2.74Å; L135-L143 CarbonylContact C-O 3.35Å; L135-L143 HydrophobicContact CB-CB 4.45Å; L135-L143 WeakPolarHBondContact CB-O 3.09Å; L135-L143 HydrophobicContact CD2-CB 4.36Å; L135-L143 HydrophobicContact CD2-CD2 3.8Å; L135-L143 HydrophobicContact CD2-CG 4.2Å; L135-L143 PolarHBondContact O-N 3.48Å; L135-F167 HydrophobicContact CD1-CE1 3.79Å; L135-F167 HydrophobicContact CD1-CZ 4.28Å; L135-F167 HydrophobicContact CD2-CE1 3.79Å; L135-F167 HydrophobicContact CD2-CZ 4.43Å; L135-F167 HydrophobicContact CG-CE1 4.47Å
136	H	96.2	Very high	94.1	Very high	27 Å²	27	33.8 Å²	33.8	13%	0.125	18%	0.18	C	C	.	.	H	α-helix	trans	-65.8	-29.2	176.2	-66.1	-174.8	0	0	0	112.1	V132 M138 A142 L143 E199 D202	V132-H136 VanDerWaalsContact CG1-CE1 3.46Å; V132-H136 WeakPolarHBondContact CG1-CE1 3.44Å; V132-H136 VanDerWaalsContact CG1-NE2 3.32Å; V132-H136 WeakPolarHBondContact CG1-NE2 3.34Å; V132-H136 PolarHBondContact O-CD2 3.45Å; V132-H136 PolarHBondContact O-N 3.49Å; H136-M138 VanDerWaalsContact C-N 3.34Å; H136-A142 WeakPolarHBondContact O-CB 3.42Å; H136-L143 PolarHBondContact CD2-O 2.83Å; H136-E199 PolarHBondContact CE1-O 2.87Å; H136-D202 IonicContact CD2-OD2 3.34Å; H136-D202 IonicContact CE1-OD2 2.67Å; H136-D202 IonicContact NE2-OD2 3.58Å; H136-D202 PolarHBondContact NE2-OD2 3.1Å
137	G	95.6	Very high	93.6	Very high	42 Å²	42	32 Å²	32	43%	0.433	17%	0.173	S	C	.	.	H	α-helix	trans	-72.9	-18.7	176.4	0	0	0	0	0	115	A133 Y134 L135 K139	A133-G137 PolarHBondContact O-N 3.06Å; Y134-G137 PolarHBondContact O-N 3.28Å; Y134-G137 VanDerWaalsContact O-N 3.15Å; L135-G137 VanDerWaalsContact C-N 3.25Å; L135-G137 PolarHBondContact O-N 2.97Å; G137-K139 PolarHBondContact O-NZ 2.85Å
138	M	92.6	Very high	93.4	Very high	21 Å²	21	31.1 Å²	31.1	10%	0.103	17%	0.169	C	C	.	.			trans	-55.2	156.4	-172.3	-66.5	-176	84.9	0	0	114.3	R74 V75 Y134 L135 H136 K141 A142 L143	R74-M138 HydrophobicContact CB-CE 3.93Å; R74-M138 VanDerWaalsContact O-CE 3.31Å; R74-M138 WeakPolarHBondContact O-CE 3.31Å; V75-M138 HydrophobicContact CG1-CE 3.78Å; V75-M138 HydrophobicContact CG1-SD 3.84Å; Y134-M138 WeakPolarHBondContact O-CG 3.5Å; Y134-M138 PolarHBondContact O-N 3.01Å; L135-M138 HydrophobicContact CD2-SD 4.16Å; L135-M138 WeakPolarHBondContact O-CB 3.47Å; L135-M138 WeakPolarHBondContact O-CG 3.35Å; L135-M138 PolarHBondContact O-N 2.74Å; H136-M138 VanDerWaalsContact C-N 3.34Å; M138-K141 CarbonylContact C-O 3.33Å; M138-K141 VanDerWaalsContact C-O 3.3Å; M138-K141 CarbonylContact O-C 3.57Å; M138-A142 PolarHBondContact O-N 2.87Å; M138-L143 HydrophobicContact SD-CB 3.74Å; M138-L143 HydrophobicContact SD-CD2 4.03Å
139	K	86.8	Confident	93.2	Very high	152 Å²	152	32.2 Å²	32.2	66%	0.661	17%	0.174	S	C	*	.	S	Bend	trans	-133.4	152.7	-178.4	-59.8	-68.8	163.5	-95.2	0	110	G137 K141	G137-K139 PolarHBondContact O-NZ 2.85Å; K139-K141 VanDerWaalsContact C-N 3.28Å
140	P	85.4	Confident	93.2	Very high	127 Å²	127	32.2 Å²	32.2	83%	0.825	17%	0.174	S	C	*	.	S	Bend	cis	-69.4	-19.7	-2.4	29.8	-36.1	0	0	0	113.7
141	K	83.7	Confident	92.9	Very high	97 Å²	97	32 Å²	32	42%	0.422	18%	0.177	S	C	.	.	S	Bend	trans	-117.5	146.5	175	-62.5	171.5	-177	178	0	110.8	M138 K139 D172	M138-K141 CarbonylContact C-O 3.33Å; M138-K141 VanDerWaalsContact C-O 3.3Å; M138-K141 CarbonylContact O-C 3.57Å; K139-K141 VanDerWaalsContact C-N 3.28Å; K141-D172 HydrophobicContact CD-CB 4.01Å; K141-D172 WeakPolarHBondContact CD-OD2 3.44Å; K141-D172 WeakPolarHBondContact CE-OD2 3.44Å; K141-D172 IonicContact NZ-OD2 3.04Å; K141-D172 PolarHBondContact NZ-OD2 2.91Å
142	A	89	Confident	92.7	Very high	20 Å²	20	32.5 Å²	32.5	17%	0.165	18%	0.18	C	C	.	.			trans	-67.2	145.5	167.7	0	0	0	0	0	110.7	H136 M138	H136-A142 WeakPolarHBondContact O-CB 3.42Å; M138-A142 PolarHBondContact O-N 2.87Å
143	L	90.2	Very high	92.7	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.18	C	C	.	.			trans	-102.1	130.1	173	-178.1	53.8	0	0	0	108.9	Q71 V75 L135 H136 M138 A170	Q71-L143 HydrophobicContact CB-CD2 3.88Å; Q71-L143 HydrophobicContact CG-CD1 4.1Å; Q71-L143 HydrophobicContact CG-CD2 4.08Å; V75-L143 HydrophobicContact CG1-CD2 4.37Å; L135-L143 CarbonylContact C-O 3.35Å; L135-L143 HydrophobicContact CB-CB 4.45Å; L135-L143 WeakPolarHBondContact CB-O 3.09Å; L135-L143 HydrophobicContact CD2-CB 4.36Å; L135-L143 HydrophobicContact CD2-CD2 3.8Å; L135-L143 HydrophobicContact CD2-CG 4.2Å; L135-L143 PolarHBondContact O-N 3.48Å; H136-L143 PolarHBondContact CD2-O 2.83Å; M138-L143 HydrophobicContact SD-CB 3.74Å; M138-L143 HydrophobicContact SD-CD2 4.03Å; L143-A170 HydrophobicContact CD1-CB 3.94Å; L143-A170 HydrophobicContact CG-CB 4.46Å
144	I	91.4	Very high	92.7	Very high	1 Å²	1	33 Å²	33	1%	0.005	18%	0.178	C	C	.	.	B	Isolated β-bridge	trans	-109	134.6	178.4	-54.5	173.5	0	0	0	107.7	R146 A170 I173 E199 D202	I144-R146 HydrophobicContact CB-CG 4.16Å; I144-R146 HydrophobicContact CG2-CG 3.61Å; I144-A170 WeakPolarHBondContact O-CA 3.43Å; I144-I173 HydrophobicContact CD1-CG1 3.82Å; I144-E199 HydrophobicContact CD1-CB 4.33Å; I144-E199 HydrophobicContact CG1-CB 4.14Å; I144-D202 WeakPolarHBondContact CG2-OD2 3.38Å
145	H	92	Very high	92.7	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	17%	0.166	C	C	.	.			trans	-80.4	-40.5	-175.8	-171.2	-17.6	0	0	0	112.7	D147 L148 I164 C165 D166 T169 D202	H145-D147 PolarHBondContact O-N 3.31Å; H145-L148 HydrophobicContact CB-CD1 4.47Å; H145-L148 HydrophobicContact CB-CG 4.08Å; H145-L148 WeakPolarHBondContact CD2-CD2 3.36Å; H145-I164 WeakPolarHBondContact CD2-CG2 3.46Å; H145-I164 VanDerWaalsContact NE2-CG2 3.29Å; H145-I164 WeakPolarHBondContact NE2-CG2 3.32Å; H145-C165 PolarHBondContact CE1-O 3.39Å; H145-C165 PolarHBondContact NE2-O 3.47Å; H145-D166 PolarHBondContact CE1-O 3.22Å; H145-T169 PolarHBondContact O-OG1 3.41Å; H145-D202 PolarHBondContact N-OD1 2.84Å; H145-D202 PolarHBondContact N-OD2 3.35Å
146	R	88.6	Confident	92.7	Very high	14 Å²	14	30.5 Å²	30.5	5%	0.053	17%	0.17	C	C	.	.	S	Bend	trans	65.2	-9	174.9	-47.1	179.2	-173.6	-177.4	1.2	117	I144 C171 D172 T175 M177 Y197 D202	I144-R146 HydrophobicContact CB-CG 4.16Å; I144-R146 HydrophobicContact CG2-CG 3.61Å; R146-C171 PolarHBondContact NH2-O 3.3Å; R146-D172 PolarHBondContact NH2-O 3.23Å; R146-T175 PolarHBondContact NH1-O 2.93Å; R146-T175 VanDerWaalsContact NH1-O 3.13Å; R146-T175 PolarHBondContact NH1-OG1 3.43Å; R146-M177 HydrophobicContact CB-CE 3.9Å; R146-M177 HydrophobicContact CB-SD 3.77Å; R146-M177 HydrophobicContact CG-SD 4.41Å; R146-M177 WeakPolarHBondContact O-CE 3.31Å; R146-Y197 HydrophobicContact CG-CE2 4.26Å; R146-Y197 PolarHBondContact NE-OH 3.34Å; R146-Y197 PolarHBondContact NH1-OH 3.21Å; R146-D202 PolarHBondContact N-OD1 3.48Å
147	D	88.7	Confident	92.7	Very high	7 Å²	7	31.8 Å²	31.8	4%	0.037	19%	0.186	C	C	.	.			trans	-140	43.1	-179.1	-153	-0.9	0	0	0	111.9	H145 K149 N152 N180 S183	H145-D147 PolarHBondContact O-N 3.31Å; D147-K149 PolarHBondContact O-N 3.17Å; D147-K149 WeakPolarHBondContact OD1-CD 3.33Å; D147-K149 VanDerWaalsContact OD1-CE 3.32Å; D147-K149 WeakPolarHBondContact OD1-CE 3.37Å; D147-K149 IonicContact OD1-NZ 3.25Å; D147-K149 PolarHBondContact OD1-NZ 3.04Å; D147-K149 IonicContact OD2-NZ 2.84Å; D147-K149 PolarHBondContact OD2-NZ 2.99Å; D147-N152 PolarHBondContact O-ND2 3.44Å; D147-N180 PolarHBondContact OD2-ND2 2.98Å; D147-S183 VanDerWaalsContact OD1-CB 3.25Å; D147-S183 WeakPolarHBondContact OD1-CB 3.36Å; D147-S183 PolarHBondContact OD1-OG 3.43Å; D147-S183 PolarHBondContact OD2-OG 3.21Å
148	L	95.4	Very high	92.7	Very high	1 Å²	1	31.6 Å²	31.6	1%	0.005	18%	0.184	C	C	.	.			trans	-70.9	117.7	173.2	-82	168.5	0	0	0	110.8	V132 H145 L153 I164 W186 D202 S205 I209	V132-L148 HydrophobicContact CG1-CD1 4.29Å; V132-L148 HydrophobicContact CG2-CD1 3.63Å; V132-L148 HydrophobicContact CG2-CD2 4.06Å; V132-L148 HydrophobicContact CG2-CG 4.47Å; H145-L148 HydrophobicContact CB-CD1 4.47Å; H145-L148 HydrophobicContact CB-CG 4.08Å; H145-L148 WeakPolarHBondContact CD2-CD2 3.36Å; L148-L153 HydrophobicContact CD2-CD2 4.07Å; L148-I164 HydrophobicContact CD2-CG2 4.5Å; L148-W186 WeakPolarHBondContact O-CB 3.42Å; L148-D202 HydrophobicContact CD1-CB 3.59Å; L148-S205 WeakPolarHBondContact O-CB 3.38Å; L148-I209 HydrophobicContact CB-CD1 4.22Å
149	K	95.1	Very high	93	Very high	22 Å²	22	30.8 Å²	30.8	10%	0.096	18%	0.18	C	C	.	.	S	Bend	trans	-161.6	153.6	-178.3	57	-169.1	175.3	-157.7	0	108.8	D147 P151 N152 S183 W186	D147-K149 PolarHBondContact O-N 3.17Å; D147-K149 WeakPolarHBondContact OD1-CD 3.33Å; D147-K149 VanDerWaalsContact OD1-CE 3.32Å; D147-K149 WeakPolarHBondContact OD1-CE 3.37Å; D147-K149 IonicContact OD1-NZ 3.25Å; D147-K149 PolarHBondContact OD1-NZ 3.04Å; D147-K149 IonicContact OD2-NZ 2.84Å; D147-K149 PolarHBondContact OD2-NZ 2.99Å; K149-P151 VanDerWaalsContact C-N 3.27Å; K149-P151 HydrophobicContact CG-CB 4.36Å; K149-P151 HydrophobicContact CG-CG 4.32Å; K149-P151 VanDerWaalsContact O-N 3.11Å; K149-N152 WeakPolarHBondContact CE-ND2 3.42Å; K149-N152 WeakPolarHBondContact CE-OD1 3.3Å; K149-N152 HydrophobicContact CG-CB 4.18Å; K149-N152 PolarHBondContact O-N 3.09Å; K149-S183 PolarHBondContact NZ-OG 3.42Å; K149-W186 HydrophobicContact CB-CB 4.45Å; K149-W186 HydrophobicContact CB-CD2 3.73Å; K149-W186 HydrophobicContact CB-CE3 3.8Å; K149-W186 HydrophobicContact CB-CG 4.01Å; K149-W186 HydrophobicContact CB-CZ3 4.37Å
150	P	97.1	Very high	93.5	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	15%	0.154	C	C	.	.	G	3₁₀ helix	trans	-55.9	-26.2	-178.4	-24.7	34.4	0	0	0	116.5	L103 Y104 L107 N152 L153 W186 I209 E212	L103-P150 HydrophobicContact CB-CB 4.2Å; L103-P150 HydrophobicContact CD2-CB 4.3Å; L103-P150 HydrophobicContact CG-CB 4.17Å; L103-P150 PolarHBondContact N-O 3.39Å; Y104-P150 PolarHBondContact N-O 3.42Å; Y104-P150 VanDerWaalsContact N-O 3.14Å; L107-P150 HydrophobicContact CD1-CB 4.38Å; L107-P150 HydrophobicContact CD1-CG 4.45Å; P150-N152 VanDerWaalsContact C-N 3.27Å; P150-N152 PolarHBondContact O-N 3.05Å; P150-L153 PolarHBondContact O-N 3.46Å; P150-W186 HydrophobicContact CG-CZ2 4.43Å; P150-I209 HydrophobicContact CG-CG1 4.48Å; P150-E212 HydrophobicContact CG-CG 4.5Å; P150-E212 VanDerWaalsContact CG-OE2 3.24Å; P150-E212 WeakPolarHBondContact CG-OE2 3.47Å
151	P	93.6	Very high	94.1	Very high	48 Å²	48	20.6 Å²	20.6	31%	0.312	13%	0.129	S	C	.	.	G	3₁₀ helix	trans	-60.3	-31.1	168.5	-30.1	36.5	0	0	0	114.9	Y104 K149	Y104-P151 HydrophobicContact CD2-CG 4.04Å; Y104-P151 HydrophobicContact CG-CG 3.94Å; K149-P151 VanDerWaalsContact C-N 3.27Å; K149-P151 HydrophobicContact CG-CB 4.36Å; K149-P151 HydrophobicContact CG-CG 4.32Å; K149-P151 VanDerWaalsContact O-N 3.11Å
152	N	94.9	Very high	94.9	Very high	12 Å²	12	16 Å²	16	6%	0.064	11%	0.109	C	C	.	.	G	3₁₀ helix	trans	-98.4	12.7	-176.9	-66.2	25.9	0	0	0	112.2	D147 K149 P150 C165 D166	D147-N152 PolarHBondContact O-ND2 3.44Å; K149-N152 WeakPolarHBondContact CE-ND2 3.42Å; K149-N152 WeakPolarHBondContact CE-OD1 3.3Å; K149-N152 HydrophobicContact CG-CB 4.18Å; K149-N152 PolarHBondContact O-N 3.09Å; P150-N152 VanDerWaalsContact C-N 3.27Å; P150-N152 PolarHBondContact O-N 3.05Å; N152-C165 PolarHBondContact O-N 3.22Å; N152-C165 PolarHBondContact O-SG 3.35Å; N152-D166 HydrophobicContact CB-CB 4.46Å; N152-D166 WeakPolarHBondContact ND2-CB 3.5Å; N152-D166 PolarHBondContact ND2-OD2 2.8Å
153	L	97.8	Very high	95.3	Very high	0 Å²	0	16 Å²	16	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	112.5	174.3	-57.4	179.6	0	0	0	108	S102 L103 L148 P150 L162 I164 I209	S102-L153 CarbonylContact C-O 3.3Å; S102-L153 WeakPolarHBondContact CA-O 3.42Å; L103-L153 HydrophobicContact CB-CB 4.16Å; L103-L153 WeakPolarHBondContact CB-O 3.28Å; L103-L153 HydrophobicContact CD2-CB 4.38Å; L103-L153 HydrophobicContact CD2-CD1 4.05Å; L103-L153 PolarHBondContact N-O 2.89Å; L148-L153 HydrophobicContact CD2-CD2 4.07Å; P150-L153 PolarHBondContact O-N 3.46Å; L153-L162 HydrophobicContact CB-CD1 4.16Å; L153-L162 HydrophobicContact CB-CG 4.42Å; L153-L162 HydrophobicContact CD1-CD1 4.36Å; L153-L162 HydrophobicContact CD2-CD2 4.31Å; L153-I164 HydrophobicContact CD2-CB 4.46Å; L153-I164 HydrophobicContact CD2-CG1 3.84Å; L153-I209 HydrophobicContact CD1-CD1 4.09Å; L153-I209 HydrophobicContact CD1-CG2 4.21Å
154	L	97.6	Very high	95.7	Very high	35 Å²	35	16 Å²	16	18%	0.183	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	156.5	-178.6	-55.1	179.5	0	0	0	111.4	A98 G101 L162 K163 C165	A98-L154 HydrophobicContact CB-CB 3.73Å; A98-L154 HydrophobicContact CB-CD1 3.94Å; A98-L154 HydrophobicContact CB-CG 4.37Å; G101-L154 CarbonylContact O-C 3.58Å; G101-L154 VanDerWaalsContact O-CA 3.28Å; G101-L154 WeakPolarHBondContact O-CA 3.37Å; L154-L162 CarbonylContact O-C 3.59Å; L154-L162 WeakPolarHBondContact O-CA 3.37Å; L154-K163 PolarHBondContact N-O 2.86Å; L154-K163 PolarHBondContact O-N 3.24Å; L154-C165 HydrophobicContact CD1-CB 3.81Å; L154-C165 HydrophobicContact CG-CB 4.13Å
155	L	98.3	Very high	95.7	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	138.1	-179	-68.3	176.1	0	0	0	111.8	G100 G101 L103 V106 W124 V161 L162	G100-L155 WeakPolarHBondContact CA-O 3.48Å; G100-L155 PolarHBondContact N-O 3.01Å; G101-L155 PolarHBondContact O-N 3.26Å; L103-L155 HydrophobicContact CB-CD1 4.4Å; L103-L155 HydrophobicContact CD1-CD1 4.02Å; V106-L155 HydrophobicContact CB-CD1 4.03Å; V106-L155 HydrophobicContact CG1-CD1 4.17Å; V106-L155 HydrophobicContact CG2-CD1 3.76Å; W124-L155 HydrophobicContact CG-CD2 4.4Å; W124-L155 HydrophobicContact CZ2-CD1 4.24Å; L155-V161 CarbonylContact C-O 3.56Å; L155-V161 WeakPolarHBondContact CA-O 3.49Å; L155-L162 HydrophobicContact CD2-CB 3.96Å; L155-L162 HydrophobicContact CD2-CD1 4.27Å; L155-L162 HydrophobicContact CD2-CG 4.32Å
156	V	96.9	Very high	95.2	Very high	15 Å²	15	17.7 Å²	17.7	9%	0.091	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	176.7	178.3	-52.8	0	0	0	0	111	A98 E99 G158 G159 T160 V161 K163	A98-V156 HydrophobicContact CB-CG1 3.56Å; E99-V156 WeakPolarHBondContact OE1-CA 3.48Å; E99-V156 WeakPolarHBondContact OE2-CB 3.26Å; V156-G158 PolarHBondContact O-N 3.29Å; V156-G159 PolarHBondContact O-N 3.01Å; V156-T160 PolarHBondContact O-N 3.44Å; V156-V161 HydrophobicContact CG2-CB 3.7Å; V156-V161 HydrophobicContact CG2-CG1 3.71Å; V156-V161 PolarHBondContact N-O 3.45Å; V156-V161 PolarHBondContact O-N 3.33Å; V156-K163 HydrophobicContact CG1-CD 4.08Å; V156-K163 HydrophobicContact CG2-CD 4.02Å
157	A	96.6	Very high	94.5	Very high	54 Å²	54	17 Å²	17	45%	0.446	11%	0.113	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.7	51.8	-175.3	0	0	0	0	0	111.5	E99 G159 T160 V161	E99-A157 WeakPolarHBondContact OE1-CA 3.25Å; E99-A157 PolarHBondContact OE1-N 3.15Å; A157-G159 PolarHBondContact O-N 2.82Å; A157-T160 WeakPolarHBondContact CB-OG1 3.39Å; A157-T160 PolarHBondContact O-N 2.9Å; A157-T160 PolarHBondContact O-OG1 3.4Å; A157-V161 HydrophobicContact CB-CB 4.25Å; A157-V161 HydrophobicContact CB-CG2 3.98Å
158	G	95.8	Very high	93.4	Very high	38 Å²	38	17.1 Å²	17.1	39%	0.392	12%	0.116	S	C	.	.	T	Hydrogen-bonded Turn	trans	66.5	22.9	-179.4	0	0	0	0	0	114.2	E99 V156 L289	E99-G158 PolarHBondContact OE1-N 3.1Å; V156-G158 PolarHBondContact O-N 3.29Å; G158-L289 PolarHBondContact O-N 3.25Å
159	G	97.4	Very high	91.9	Very high	3 Å²	3	17.9 Å²	17.9	3%	0.031	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	94.3	-0.6	179.6	0	0	0	0	0	115.4	W124 V156 A157	W124-G159 PolarHBondContact NE1-O 2.94Å; V156-G159 PolarHBondContact O-N 3.01Å; A157-G159 PolarHBondContact O-N 2.82Å
160	T	98.3	Very high	90.4	Very high	19 Å²	19	16.8 Å²	16.8	12%	0.117	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-30.9	-176.7	60.9	0	0	0	0	113.3	Q127 V156 A157 E287	Q127-T160 PolarHBondContact NE2-O 2.83Å; V156-T160 PolarHBondContact O-N 3.44Å; A157-T160 WeakPolarHBondContact CB-OG1 3.39Å; A157-T160 PolarHBondContact O-N 2.9Å; A157-T160 PolarHBondContact O-OG1 3.4Å; T160-E287 WeakPolarHBondContact CG2-O 3.45Å
161	V	98.6	Very high	88.6	Confident	47 Å²	47	18.1 Å²	18.1	29%	0.285	12%	0.124	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	129.5	-176	174.3	0	0	0	0	110.6	Q127 L155 V156 A157	Q127-V161 VanDerWaalsContact OE1-CA 3.3Å; L155-V161 CarbonylContact C-O 3.56Å; L155-V161 WeakPolarHBondContact CA-O 3.49Å; V156-V161 HydrophobicContact CG2-CB 3.7Å; V156-V161 HydrophobicContact CG2-CG1 3.71Å; V156-V161 PolarHBondContact N-O 3.45Å; V156-V161 PolarHBondContact O-N 3.33Å; A157-V161 HydrophobicContact CB-CB 4.25Å; A157-V161 HydrophobicContact CB-CG2 3.98Å
162	L	98.8	Very high	86.8	Confident	1 Å²	1	18.1 Å²	18.1	1%	0.005	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	139.1	-179	180	149.8	0	0	0	111.8	N79 L103 W124 Q127 C128 L153 L154 L155	N79-L162 VanDerWaalsContact CA-O 3.27Å; N79-L162 WeakPolarHBondContact CA-O 3.49Å; N79-L162 WeakPolarHBondContact CB-O 3.38Å; N79-L162 PolarHBondContact ND2-O 3.14Å; L103-L162 HydrophobicContact CD2-CD1 4.19Å; W124-L162 HydrophobicContact CB-CD1 3.72Å; W124-L162 HydrophobicContact CG-CD1 4.21Å; Q127-L162 HydrophobicContact CB-CB 4.07Å; Q127-L162 HydrophobicContact CB-CD2 4.47Å; C128-L162 HydrophobicContact CB-CD2 3.93Å; L153-L162 HydrophobicContact CB-CD1 4.16Å; L153-L162 HydrophobicContact CB-CG 4.42Å; L153-L162 HydrophobicContact CD1-CD1 4.36Å; L153-L162 HydrophobicContact CD2-CD2 4.31Å; L154-L162 CarbonylContact O-C 3.59Å; L154-L162 WeakPolarHBondContact O-CA 3.37Å; L155-L162 HydrophobicContact CD2-CB 3.96Å; L155-L162 HydrophobicContact CD2-CD1 4.27Å; L155-L162 HydrophobicContact CD2-CG 4.32Å
163	K	98.4	Very high	84.7	Confident	18 Å²	18	22.2 Å²	22.2	8%	0.078	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	128.3	-179.9	-74.5	169.6	174.8	-74.4	0	112.1	P78 N79 E96 L154 V156	P78-K163 PolarHBondContact O-NZ 3.46Å; N79-K163 WeakPolarHBondContact O-CA 3.46Å; E96-K163 WeakPolarHBondContact OE1-CE 3.48Å; E96-K163 IonicContact OE1-NZ 3.36Å; E96-K163 PolarHBondContact OE1-NZ 3.1Å; E96-K163 WeakPolarHBondContact OE2-CD 3.42Å; E96-K163 VanDerWaalsContact OE2-CE 3.25Å; E96-K163 WeakPolarHBondContact OE2-CE 3.4Å; E96-K163 IonicContact OE2-NZ 3.69Å; E96-K163 PolarHBondContact OE2-NZ 3.42Å; L154-K163 PolarHBondContact N-O 2.86Å; L154-K163 PolarHBondContact O-N 3.24Å; V156-K163 HydrophobicContact CG1-CD 4.08Å; V156-K163 HydrophobicContact CG2-CD 4.02Å
164	I	97.8	Very high	81.9	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	137.6	175.2	-60.2	170.4	0	0	0	110.2	N79 I80 V81 V132 H145 L148 L153 F167	N79-I164 WeakPolarHBondContact O-CG1 3.35Å; N79-I164 PolarHBondContact O-N 3.21Å; I80-I164 HydrophobicContact CG1-CB 4.44Å; V81-I164 WeakPolarHBondContact CG1-O 3.29Å; V81-I164 PolarHBondContact N-O 3.15Å; V132-I164 HydrophobicContact CG2-CD1 3.73Å; H145-I164 WeakPolarHBondContact CD2-CG2 3.46Å; H145-I164 VanDerWaalsContact NE2-CG2 3.29Å; H145-I164 WeakPolarHBondContact NE2-CG2 3.32Å; L148-I164 HydrophobicContact CD2-CG2 4.5Å; L153-I164 HydrophobicContact CD2-CB 4.46Å; L153-I164 HydrophobicContact CD2-CG1 3.84Å; I164-F167 HydrophobicContact CG2-CE2 4.31Å; I164-F167 HydrophobicContact CG2-CZ 3.86Å
165	C	91.6	Very high	79.1	Confident	18 Å²	18	32.1 Å²	32.1	12%	0.122	19%	0.193	C	C	.	.			trans	-138.1	-177.7	177.8	76	0	0	0	0	113.3	V81 H145 N152 L154	V81-C165 HydrophobicContact CB-CB 4.2Å; V81-C165 HydrophobicContact CG1-CB 3.79Å; H145-C165 PolarHBondContact CE1-O 3.39Å; H145-C165 PolarHBondContact NE2-O 3.47Å; N152-C165 PolarHBondContact O-N 3.22Å; N152-C165 PolarHBondContact O-SG 3.35Å; L154-C165 HydrophobicContact CD1-CB 3.81Å; L154-C165 HydrophobicContact CG-CB 4.13Å
166	D	81.6	Confident	76.3	Confident	20 Å²	20	39.2 Å²	39.2	11%	0.107	23%	0.226	C	C	.	.			trans	60.3	73.7	176.2	-168.7	43.1	0	0	0	114	K54 E68 H145 N152 G168	K54-D166 IonicContact NZ-OD1 3.22Å; K54-D166 PolarHBondContact NZ-OD1 3.15Å; E68-D166 WeakPolarHBondContact OE1-CA 3.45Å; H145-D166 PolarHBondContact CE1-O 3.22Å; N152-D166 HydrophobicContact CB-CB 4.46Å; N152-D166 WeakPolarHBondContact ND2-CB 3.5Å; N152-D166 PolarHBondContact ND2-OD2 2.8Å; D166-G168 VanDerWaalsContact C-N 3.3Å; D166-G168 PolarHBondContact O-N 3.42Å
167	F	75.4	Confident	73.6	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	23%	0.232	C	C	.	.			trans	-90.4	15.1	-178	-68.8	-97.5	0	0	0	113.1	E68 Q71 L72 I80 L135 I164 T169 A170	E68-F167 HydrophobicContact CG-CB 4.14Å; E68-F167 PolarHBondContact OE1-N 3.27Å; E68-F167 VanDerWaalsContact OE1-N 3.1Å; Q71-F167 HydrophobicContact CB-CB 4.34Å; L72-F167 HydrophobicContact CD2-CD2 3.44Å; L72-F167 VanDerWaalsContact CD2-CD2 3.44Å; L72-F167 HydrophobicContact CD2-CE2 3.67Å; L72-F167 HydrophobicContact CD2-CG 4.28Å; L72-F167 HydrophobicContact CG-CD2 4Å; I80-F167 HydrophobicContact CG2-CE2 3.83Å; I80-F167 HydrophobicContact CG2-CZ 3.71Å; L135-F167 HydrophobicContact CD1-CE1 3.79Å; L135-F167 HydrophobicContact CD1-CZ 4.28Å; L135-F167 HydrophobicContact CD2-CE1 3.79Å; L135-F167 HydrophobicContact CD2-CZ 4.43Å; L135-F167 HydrophobicContact CG-CE1 4.47Å; I164-F167 HydrophobicContact CG2-CE2 4.31Å; I164-F167 HydrophobicContact CG2-CZ 3.86Å; F167-T169 PolarHBondContact O-N 2.9Å; F167-T169 VanDerWaalsContact O-N 3.15Å; F167-A170 HydrophobicContact CB-CB 3.95Å; F167-A170 HydrophobicContact CD1-CB 3.78Å; F167-A170 HydrophobicContact CG-CB 4.35Å; F167-A170 WeakPolarHBondContact O-CB 3.33Å; F167-A170 PolarHBondContact O-N 3.42Å
168	G	64.3	Low	70.9	Confident	9 Å²	9	43.4 Å²	43.4	9%	0.093	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-23	-177.7	0	0	0	0	0	115.2	D166	D166-G168 VanDerWaalsContact C-N 3.3Å; D166-G168 PolarHBondContact O-N 3.42Å
169	T	64.8	Low	68.3	Low	16 Å²	16	45.6 Å²	45.6	10%	0.098	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.3	-7.5	173.4	52.5	0	0	0	0	113.7	F38 H145 F167 C171 N180	F38-T169 HydrophobicContact CE2-CG2 4.37Å; H145-T169 PolarHBondContact O-OG1 3.41Å; F167-T169 PolarHBondContact O-N 2.9Å; F167-T169 VanDerWaalsContact O-N 3.15Å; T169-C171 PolarHBondContact O-N 3.42Å; T169-N180 WeakPolarHBondContact CG2-ND2 3.37Å
170	A	63	Low	65.9	Low	0 Å²	0	46.6 Å²	46.6	0%	0	25%	0.25	C	S	.	.			trans	-77.4	110.5	-170.1	0	0	0	0	0	111.4	V67 Q71 L143 I144 F167	V67-A170 WeakPolarHBondContact CG1-O 3.39Å; Q71-A170 HydrophobicContact CG-CB 4.46Å; Q71-A170 WeakPolarHBondContact CG-O 3.47Å; Q71-A170 PolarHBondContact NE2-O 3.14Å; L143-A170 HydrophobicContact CD1-CB 3.94Å; L143-A170 HydrophobicContact CG-CB 4.46Å; I144-A170 WeakPolarHBondContact O-CA 3.43Å; F167-A170 HydrophobicContact CB-CB 3.95Å; F167-A170 HydrophobicContact CD1-CB 3.78Å; F167-A170 HydrophobicContact CG-CB 4.35Å; F167-A170 WeakPolarHBondContact O-CB 3.33Å; F167-A170 PolarHBondContact O-N 3.42Å
171	C	59.1	Low	63.6	Low	27 Å²	27	55.7 Å²	55.7	18%	0.182	29%	0.288	C	S	.	.	B	Isolated β-bridge	trans	-130.8	154.1	-173.1	-72.8	0	0	0	0	112.6	R146 T169 T175	R146-C171 PolarHBondContact NH2-O 3.3Å; T169-C171 PolarHBondContact O-N 3.42Å; C171-T175 VanDerWaalsContact CB-OG1 3.31Å; C171-T175 WeakPolarHBondContact CB-OG1 3Å
172	D	55.9	Low	61.7	Low	49 Å²	49	56.1 Å²	56.1	26%	0.262	30%	0.303	S	S	.	.			trans	-52.9	158.1	159.6	-70	6.1	0	0	0	110.8	R74 K141 R146 Q174	R74-D172 IonicContact NH1-OD1 2.82Å; K141-D172 HydrophobicContact CD-CB 4.01Å; K141-D172 WeakPolarHBondContact CD-OD2 3.44Å; K141-D172 WeakPolarHBondContact CE-OD2 3.44Å; K141-D172 IonicContact NZ-OD2 3.04Å; K141-D172 PolarHBondContact NZ-OD2 2.91Å; R146-D172 PolarHBondContact NH2-O 3.23Å; D172-Q174 PolarHBondContact O-N 2.62Å
173	I	49.8	Very low	60.7	Low	98 Å²	98	56.2 Å²	56.2	50%	0.503	30%	0.303	S	S	.	.	S	Bend	trans	-66.4	18.7	-160.9	-63	165.4	0	0	0	116.1	I144	I144-I173 HydrophobicContact CD1-CG1 3.82Å
174	Q	40.1	Very low	60.1	Low	175 Å²	175	55.6 Å²	55.6	82%	0.818	30%	0.301	S	S	*	.			trans	-136.3	47.7	-173.8	-65.7	-176.9	-60.5	0	0	114.6	D172	D172-Q174 PolarHBondContact O-N 2.62Å
175	T	39.5	Very low	59.9	Low	68 Å²	68	56 Å²	56	42%	0.417	31%	0.305	S	S	.	.			trans	-139.5	131.7	170.9	49.7	0	0	0	0	111.9	R146 C171 Y197	R146-T175 PolarHBondContact NH1-O 2.93Å; R146-T175 VanDerWaalsContact NH1-O 3.13Å; R146-T175 PolarHBondContact NH1-OG1 3.43Å; C171-T175 VanDerWaalsContact CB-OG1 3.31Å; C171-T175 WeakPolarHBondContact CB-OG1 3Å; T175-Y197 PolarHBondContact O-OH 3.19Å
176	H	38.5	Very low	60.1	Low	149 Å²	149	56.3 Å²	56.3	69%	0.69	30%	0.304	S	S	*	.	P	Polyproline II helix	trans	-70.2	146.6	170.8	-67.6	-88.2	0	0	0	110.5
177	M	41.4	Very low	60.6	Low	45 Å²	45	55.9 Å²	55.9	22%	0.222	30%	0.301	C	S	.	.	P	Polyproline II helix	trans	-82	137.8	178.4	-74.3	-93.6	-78.9	0	0	111	R146 M187 V191 Y197	R146-M177 HydrophobicContact CB-CE 3.9Å; R146-M177 HydrophobicContact CB-SD 3.77Å; R146-M177 HydrophobicContact CG-SD 4.41Å; R146-M177 WeakPolarHBondContact O-CE 3.31Å; M177-M187 HydrophobicContact CE-CE 4.38Å; M177-V191 HydrophobicContact CB-CG1 4.37Å; M177-V191 HydrophobicContact CE-CG1 4.02Å; M177-V191 HydrophobicContact CG-CG1 3.98Å; M177-Y197 HydrophobicContact CG-CE1 4.46Å; M177-Y197 WeakPolarHBondContact CG-OH 3.39Å
178	T	38.9	Very low	61.4	Low	112 Å²	112	56 Å²	56	69%	0.687	30%	0.301	S	S	*	.	P	Polyproline II helix	trans	-81.8	146.7	160.7	45.2	0	0	0	0	110.1	N180	T178-N180 PolarHBondContact O-N 2.98Å
179	N	41.3	Very low	62.7	Low	84 Å²	84	55.6 Å²	55.6	45%	0.449	30%	0.297	S	S	.	.			trans	-65.1	92.6	-176	-91.7	-40.7	0	0	0	113.3	K181	N179-K181 PolarHBondContact O-N 3.45Å; N179-K181 VanDerWaalsContact O-N 3.11Å
180	N	47.9	Very low	63.7	Low	23 Å²	23	55.3 Å²	55.3	12%	0.123	30%	0.295	C	S	.	.			trans	-67.7	105.6	171.4	-84.7	14.5	0	0	0	110.8	D147 T169 T178 G182 S183	D147-N180 PolarHBondContact OD2-ND2 2.98Å; T169-N180 WeakPolarHBondContact CG2-ND2 3.37Å; T178-N180 PolarHBondContact O-N 2.98Å; N180-G182 PolarHBondContact O-N 3.33Å; N180-S183 PolarHBondContact O-N 3.4Å
181	K	49.2	Very low	64.7	Low	210 Å²	210	55.9 Å²	55.9	91%	0.913	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	124.4	172.6	-64.7	176.9	-177.8	174.7	0	109.3	N179	N179-K181 PolarHBondContact O-N 3.45Å; N179-K181 VanDerWaalsContact O-N 3.11Å
182	G	59.4	Low	65.6	Low	57 Å²	57	56 Å²	56	59%	0.588	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	104.7	-20.4	177.6	0	0	0	0	0	116	N180	N180-G182 PolarHBondContact O-N 3.33Å
183	S	77.9	Confident	66.4	Low	3 Å²	3	55.6 Å²	55.6	2%	0.021	29%	0.292	C	S	.	.			trans	-86.9	-6.4	-175.7	-59.9	0	0	0	0	115.4	D147 K149 N180 A185 W186 M187	D147-S183 VanDerWaalsContact OD1-CB 3.25Å; D147-S183 WeakPolarHBondContact OD1-CB 3.36Å; D147-S183 PolarHBondContact OD1-OG 3.43Å; D147-S183 PolarHBondContact OD2-OG 3.21Å; K149-S183 PolarHBondContact NZ-OG 3.42Å; N180-S183 PolarHBondContact O-N 3.4Å; S183-A185 PolarHBondContact O-N 3.4Å; S183-W186 PolarHBondContact O-N 2.95Å; S183-M187 PolarHBondContact O-N 2.96Å
184	A	85.4	Confident	67.1	Low	4 Å²	4	52.4 Å²	52.4	3%	0.033	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-28.5	-169.4	0	0	0	0	0	115.3	W186 A227 I230 M231	A184-W186 VanDerWaalsContact C-N 3.33Å; A184-W186 PolarHBondContact O-N 2.91Å; A184-A227 HydrophobicContact CB-CB 3.95Å; A184-I230 HydrophobicContact CB-CB 4.41Å; A184-I230 HydrophobicContact CB-CG2 4.45Å; A184-M231 HydrophobicContact CB-CE 4.17Å; A184-M231 HydrophobicContact CB-CG 4.1Å
185	A	93	Very high	68.5	Low	9 Å²	9	46.5 Å²	46.5	7%	0.074	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-21.7	-179.5	0	0	0	0	0	114.2	S183 P219 F220	S183-A185 PolarHBondContact O-N 3.4Å; A185-P219 HydrophobicContact CB-CB 4.35Å; A185-P219 HydrophobicContact CB-CG 3.94Å; A185-F220 HydrophobicContact CB-CD2 4.05Å; A185-F220 WeakPolarHBondContact O-CE2 3.24Å
186	W	95.8	Very high	70	Confident	25 Å²	25	51.3 Å²	51.3	10%	0.095	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.4	-2.2	177	-56.1	-89.8	0	0	0	112.9	L148 K149 P150 S183 A184 S205 I208 E212 P219	L148-W186 WeakPolarHBondContact O-CB 3.42Å; K149-W186 HydrophobicContact CB-CB 4.45Å; K149-W186 HydrophobicContact CB-CD2 3.73Å; K149-W186 HydrophobicContact CB-CE3 3.8Å; K149-W186 HydrophobicContact CB-CG 4.01Å; K149-W186 HydrophobicContact CB-CZ3 4.37Å; P150-W186 HydrophobicContact CG-CZ2 4.43Å; S183-W186 PolarHBondContact O-N 2.95Å; A184-W186 VanDerWaalsContact C-N 3.33Å; A184-W186 PolarHBondContact O-N 2.91Å; W186-S205 WeakPolarHBondContact O-CA 3.15Å; W186-S205 WeakPolarHBondContact O-CB 3.5Å; W186-S205 PolarHBondContact O-OG 3.5Å; W186-I208 VanDerWaalsContact CD1-CG2 3.48Å; W186-I208 HydrophobicContact CG-CG2 4.25Å; W186-E212 PolarHBondContact NE1-OE2 2.91Å; W186-P219 HydrophobicContact CD2-CG 4.48Å; W186-P219 HydrophobicContact CZ2-CG 3.82Å
187	M	91.9	Very high	71.8	Confident	11 Å²	11	45.9 Å²	45.9	5%	0.054	26%	0.259	C	S	.	.			trans	-82.1	131.9	-172.7	-167.6	175.1	-69.4	0	0	111.9	M177 S183 V191 F192 F204 M231	M177-M187 HydrophobicContact CE-CE 4.38Å; S183-M187 PolarHBondContact O-N 2.96Å; M187-V191 HydrophobicContact CG-CB 4.06Å; M187-V191 HydrophobicContact CG-CG1 4.08Å; M187-V191 HydrophobicContact SD-CB 4.5Å; M187-V191 HydrophobicContact SD-CG1 4.1Å; M187-F192 HydrophobicContact CB-CD1 4.28Å; M187-F192 HydrophobicContact CG-CD1 3.98Å; M187-F192 HydrophobicContact SD-CB 3.95Å; M187-F192 HydrophobicContact SD-CD1 3.99Å; M187-F192 HydrophobicContact SD-CG 4.49Å; M187-F204 VanDerWaalsContact O-CE1 3.29Å; M187-F204 WeakPolarHBondContact O-CE1 3.31Å; M187-M231 HydrophobicContact SD-CE 4.26Å
188	A	93	Very high	74.1	Confident	1 Å²	1	45.5 Å²	45.5	1%	0.008	26%	0.261	C	S	.	.			trans	-69.2	144.9	177.1	0	0	0	0	0	111.8	E190 V191 C201 F204	A188-E190 VanDerWaalsContact CB-OE1 3.27Å; A188-E190 WeakPolarHBondContact CB-OE1 3.46Å; A188-E190 WeakPolarHBondContact CB-OE2 3.37Å; A188-E190 PolarHBondContact O-N 3.15Å; A188-V191 HydrophobicContact CB-CG2 4.12Å; A188-V191 WeakPolarHBondContact O-CB 3.5Å; A188-V191 PolarHBondContact O-N 3Å; A188-V191 VanDerWaalsContact O-N 3.11Å; A188-C201 HydrophobicContact CB-CB 3.85Å; A188-F204 HydrophobicContact CB-CB 3.64Å; A188-F204 HydrophobicContact CB-CD1 4.06Å; A188-F204 HydrophobicContact CB-CD2 4.32Å; A188-F204 HydrophobicContact CB-CG 3.77Å
189	P	89.9	Confident	76.7	Confident	1 Å²	1	43 Å²	43	1%	0.006	24%	0.241	C	C	.	.	H	α-helix	trans	-57.4	-44.4	-174.3	20	-31.4	0	0	0	113.5	V191 F192 E193 V234 K260	P189-V191 PolarHBondContact O-N 2.99Å; P189-F192 HydrophobicContact CB-CE2 4.48Å; P189-F192 HydrophobicContact CB-CZ 4.12Å; P189-F192 PolarHBondContact O-N 3.45Å; P189-E193 WeakPolarHBondContact CB-OE1 3.44Å; P189-E193 WeakPolarHBondContact O-CB 3.37Å; P189-E193 WeakPolarHBondContact O-CG 3.39Å; P189-E193 PolarHBondContact O-N 2.81Å; P189-V234 HydrophobicContact CB-CG1 4.43Å; P189-K260 HydrophobicContact CG-CG 4.47Å
190	E	86.8	Confident	79.3	Confident	11 Å²	11	40.4 Å²	40.4	5%	0.051	23%	0.226	C	C	.	.	H	α-helix	trans	-62	-20.1	-178.4	70.4	-79.5	-175.3	0	0	113.9	A188 S195 P262 R265	A188-E190 VanDerWaalsContact CB-OE1 3.27Å; A188-E190 WeakPolarHBondContact CB-OE1 3.46Å; A188-E190 WeakPolarHBondContact CB-OE2 3.37Å; A188-E190 PolarHBondContact O-N 3.15Å; E190-S195 PolarHBondContact O-N 3.09Å; E190-S195 VanDerWaalsContact O-N 3.1Å; E190-P262 HydrophobicContact CG-CG 4.08Å; E190-R265 IonicContact OE1-CZ 2.73Å; E190-R265 IonicContact OE1-NH1 3.76Å; E190-R265 PolarHBondContact OE1-NH1 2.96Å; E190-R265 IonicContact OE1-NH2 3.99Å; E190-R265 IonicContact OE2-CZ 2.84Å; E190-R265 IonicContact OE2-NH1 3.97Å; E190-R265 PolarHBondContact OE2-NH1 3.47Å; E190-R265 IonicContact OE2-NH2 2.62Å; E190-R265 PolarHBondContact OE2-NH2 3.3Å
191	V	84.1	Confident	81.6	Confident	12 Å²	12	39.5 Å²	39.5	7%	0.073	22%	0.221	C	C	.	.	H	α-helix	trans	-78.5	-45.5	-179	178.7	0	0	0	0	111.2	M177 M187 A188 P189 G194 Y197 C201	M177-V191 HydrophobicContact CB-CG1 4.37Å; M177-V191 HydrophobicContact CE-CG1 4.02Å; M177-V191 HydrophobicContact CG-CG1 3.98Å; M187-V191 HydrophobicContact CG-CB 4.06Å; M187-V191 HydrophobicContact CG-CG1 4.08Å; M187-V191 HydrophobicContact SD-CB 4.5Å; M187-V191 HydrophobicContact SD-CG1 4.1Å; A188-V191 HydrophobicContact CB-CG2 4.12Å; A188-V191 WeakPolarHBondContact O-CB 3.5Å; A188-V191 PolarHBondContact O-N 3Å; A188-V191 VanDerWaalsContact O-N 3.11Å; P189-V191 PolarHBondContact O-N 2.99Å; V191-G194 PolarHBondContact O-N 3.43Å; V191-Y197 HydrophobicContact CG2-CD1 4.34Å; V191-Y197 HydrophobicContact CG2-CD2 4.14Å; V191-Y197 HydrophobicContact CG2-CG 3.92Å; V191-C201 HydrophobicContact CG2-CB 3.53Å
192	F	77.4	Confident	83.9	Confident	29 Å²	29	29.5 Å²	29.5	13%	0.127	18%	0.178	C	C	.	.	H	α-helix	trans	-83.7	-16.9	175.7	59.7	-113.8	0	0	0	113.1	M187 P189 G194 M231 V234 H235	M187-F192 HydrophobicContact CB-CD1 4.28Å; M187-F192 HydrophobicContact CG-CD1 3.98Å; M187-F192 HydrophobicContact SD-CB 3.95Å; M187-F192 HydrophobicContact SD-CD1 3.99Å; M187-F192 HydrophobicContact SD-CG 4.49Å; P189-F192 HydrophobicContact CB-CE2 4.48Å; P189-F192 HydrophobicContact CB-CZ 4.12Å; P189-F192 PolarHBondContact O-N 3.45Å; F192-G194 PolarHBondContact O-N 3.37Å; F192-M231 HydrophobicContact CB-CE 4.06Å; F192-M231 HydrophobicContact CB-CG 4.4Å; F192-M231 HydrophobicContact CB-SD 4.32Å; F192-M231 HydrophobicContact CD1-CB 4.26Å; F192-M231 HydrophobicContact CD1-CG 3.85Å; F192-M231 HydrophobicContact CD2-CB 4.03Å; F192-M231 HydrophobicContact CD2-CG 4.31Å; F192-M231 HydrophobicContact CE1-CB 4.16Å; F192-M231 HydrophobicContact CE1-CG 4.1Å; F192-M231 HydrophobicContact CE2-CB 3.95Å; F192-M231 WeakPolarHBondContact CE2-O 3.04Å; F192-M231 HydrophobicContact CG-CB 4.19Å; F192-M231 HydrophobicContact CG-CG 3.96Å; F192-M231 HydrophobicContact CG-SD 4.48Å; F192-M231 HydrophobicContact CZ-CB 3.99Å; F192-M231 HydrophobicContact CZ-CG 4.43Å; F192-M231 WeakPolarHBondContact CZ-O 3.4Å; F192-V234 HydrophobicContact CE1-CB 4.39Å; F192-V234 HydrophobicContact CE1-CG1 4.11Å; F192-V234 HydrophobicContact CZ-CB 4.03Å; F192-V234 HydrophobicContact CZ-CG1 3.92Å; F192-H235 HydrophobicContact CE2-CB 4.15Å
193	E	72.6	Confident	85.8	Confident	40 Å²	40	26.8 Å²	26.8	19%	0.187	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-1.1	165	-70	165.3	-160.8	0	0	112.9	P189 S195 H235 L495	P189-E193 WeakPolarHBondContact CB-OE1 3.44Å; P189-E193 WeakPolarHBondContact O-CB 3.37Å; P189-E193 WeakPolarHBondContact O-CG 3.39Å; P189-E193 PolarHBondContact O-N 2.81Å; E193-S195 PolarHBondContact O-N 3.25Å; E193-S195 VanDerWaalsContact O-N 3.08Å; E193-H235 IonicContact OE1-CE1 2.67Å; E193-H235 PolarHBondContact OE1-CE1 2.69Å; E193-H235 IonicContact OE1-CG 3.87Å; E193-H235 IonicContact OE1-ND1 2.79Å; E193-H235 PolarHBondContact OE1-ND1 3.15Å; E193-L495 VanDerWaalsContact O-CD1 3.25Å; E193-L495 WeakPolarHBondContact O-CD1 3.31Å
194	G	65.1	Low	86.8	Confident	31 Å²	31	26.6 Å²	26.6	32%	0.32	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.2	13.3	178.7	0	0	0	0	0	115.2	V191 F192	V191-G194 PolarHBondContact O-N 3.43Å; F192-G194 PolarHBondContact O-N 3.37Å
195	S	69	Low	87.4	Confident	51 Å²	51	26.7 Å²	26.7	36%	0.357	15%	0.149	S	C	.	.			trans	-75.1	170.4	-176.6	-72.6	0	0	0	0	112	E190 E193 Y197	E190-S195 PolarHBondContact O-N 3.09Å; E190-S195 VanDerWaalsContact O-N 3.1Å; E193-S195 PolarHBondContact O-N 3.25Å; E193-S195 VanDerWaalsContact O-N 3.08Å; S195-Y197 WeakPolarHBondContact O-CD1 3.23Å; S195-Y197 PolarHBondContact O-N 2.78Å
196	N	72.3	Confident	87.7	Confident	170 Å²	170	26.3 Å²	26.3	91%	0.909	15%	0.146	S	C	*	.			trans	-67	97.3	169.2	-75.4	-22.5	0	0	0	109.8
197	Y	76.4	Confident	87.8	Confident	34 Å²	34	25.1 Å²	25.1	13%	0.133	14%	0.141	C	C	.	.			trans	-93.7	163.2	175.7	65.3	-89.7	0	0	0	111.7	R146 T175 M177 V191 S195	R146-Y197 HydrophobicContact CG-CE2 4.26Å; R146-Y197 PolarHBondContact NE-OH 3.34Å; R146-Y197 PolarHBondContact NH1-OH 3.21Å; T175-Y197 PolarHBondContact O-OH 3.19Å; M177-Y197 HydrophobicContact CG-CE1 4.46Å; M177-Y197 WeakPolarHBondContact CG-OH 3.39Å; V191-Y197 HydrophobicContact CG2-CD1 4.34Å; V191-Y197 HydrophobicContact CG2-CD2 4.14Å; V191-Y197 HydrophobicContact CG2-CG 3.92Å; S195-Y197 WeakPolarHBondContact O-CD1 3.23Å; S195-Y197 PolarHBondContact O-N 2.78Å
198	S	88.6	Confident	88.1	Confident	38 Å²	38	24.6 Å²	24.6	27%	0.266	14%	0.138	S	C	.	.			trans	-133	-168.9	179.7	88.8	0	0	0	0	111.4	K200 C201	S198-K200 PolarHBondContact O-N 2.93Å; S198-K200 WeakPolarHBondContact OG-CG 3.42Å; S198-K200 PolarHBondContact OG-N 2.89Å; S198-C201 PolarHBondContact O-N 3.43Å; S198-C201 PolarHBondContact O-SG 2.87Å
199	E	93.6	Very high	88.4	Confident	60 Å²	60	24.6 Å²	24.6	28%	0.28	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.4	-17.9	173.7	88	-60.4	160.3	0	0	113.6	H136 I144 C201 D202	H136-E199 PolarHBondContact CE1-O 2.87Å; I144-E199 HydrophobicContact CD1-CB 4.33Å; I144-E199 HydrophobicContact CG1-CB 4.14Å; E199-C201 PolarHBondContact O-N 2.95Å; E199-D202 PolarHBondContact O-N 3.18Å
200	K	97.1	Very high	88.8	Confident	28 Å²	28	24.5 Å²	24.5	12%	0.122	14%	0.138	C	C	.	.	H	α-helix	trans	-66.4	-11.8	174	-61.2	-56.1	-165.3	75.2	0	114.7	S198 V203 F204 P262 S263 R265	S198-K200 PolarHBondContact O-N 2.93Å; S198-K200 WeakPolarHBondContact OG-CG 3.42Å; S198-K200 PolarHBondContact OG-N 2.89Å; K200-V203 HydrophobicContact CD-CG2 4.22Å; K200-V203 PolarHBondContact O-N 2.92Å; K200-F204 PolarHBondContact O-N 3.22Å; K200-P262 HydrophobicContact CB-CB 3.74Å; K200-P262 HydrophobicContact CG-CB 4.27Å; K200-P262 WeakPolarHBondContact CG-O 3.26Å; K200-P262 PolarHBondContact NZ-O 3.38Å; K200-S263 PolarHBondContact NZ-O 3.09Å; K200-R265 HydrophobicContact CD-CB 4.36Å; K200-R265 PolarHBondContact NZ-O 3.23Å; K200-R265 WeakPolarHBondContact O-CD 3.4Å; K200-R265 PolarHBondContact O-NH1 2.86Å
201	C	95.1	Very high	89.4	Confident	4 Å²	4	24.4 Å²	24.4	3%	0.027	14%	0.137	C	C	.	.	H	α-helix	trans	-69.5	-42	171.3	66.3	0	0	0	0	111.4	A188 V191 S198 E199 V203 F204 S205	A188-C201 HydrophobicContact CB-CB 3.85Å; V191-C201 HydrophobicContact CG2-CB 3.53Å; S198-C201 PolarHBondContact O-N 3.43Å; S198-C201 PolarHBondContact O-SG 2.87Å; E199-C201 PolarHBondContact O-N 2.95Å; C201-V203 PolarHBondContact O-N 2.91Å; C201-F204 WeakPolarHBondContact O-CB 3.47Å; C201-F204 PolarHBondContact O-N 2.9Å; C201-S205 PolarHBondContact O-N 3.48Å; C201-S205 PolarHBondContact O-OG 3.11Å
202	D	97.6	Very high	90.1	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-59.7	-31.7	174.3	-68.9	-20.6	0	0	0	111.7	V132 H136 I144 H145 R146 L148 E199 S205 W206	V132-D202 HydrophobicContact CG1-CB 3.92Å; H136-D202 IonicContact CD2-OD2 3.34Å; H136-D202 IonicContact CE1-OD2 2.67Å; H136-D202 IonicContact NE2-OD2 3.58Å; H136-D202 PolarHBondContact NE2-OD2 3.1Å; I144-D202 WeakPolarHBondContact CG2-OD2 3.38Å; H145-D202 PolarHBondContact N-OD1 2.84Å; H145-D202 PolarHBondContact N-OD2 3.35Å; R146-D202 PolarHBondContact N-OD1 3.48Å; L148-D202 HydrophobicContact CD1-CB 3.59Å; E199-D202 PolarHBondContact O-N 3.18Å; D202-S205 PolarHBondContact O-N 2.84Å; D202-W206 WeakPolarHBondContact O-CB 3.3Å; D202-W206 PolarHBondContact O-N 3.2Å
203	V	98.8	Very high	91.1	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-66.7	-39.1	175.1	178.1	0	0	0	0	112.3	K200 C201 G207 C257 R265 P266 M268 I271	K200-V203 HydrophobicContact CD-CG2 4.22Å; K200-V203 PolarHBondContact O-N 2.92Å; C201-V203 PolarHBondContact O-N 2.91Å; V203-G207 PolarHBondContact O-N 3.31Å; V203-G207 VanDerWaalsContact O-N 3.1Å; V203-C257 HydrophobicContact CG1-CB 4.08Å; V203-R265 HydrophobicContact CB-CB 4.45Å; V203-R265 HydrophobicContact CG1-CB 3.83Å; V203-P266 HydrophobicContact CG1-CG 4.17Å; V203-M268 HydrophobicContact CB-CE 4.35Å; V203-M268 HydrophobicContact CG2-CE 3.95Å; V203-M268 HydrophobicContact CG2-CG 4.15Å; V203-I271 HydrophobicContact CG1-CD1 3.92Å; V203-I271 HydrophobicContact CG2-CD1 4.49Å
204	F	98.6	Very high	92.4	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-63.1	-48.8	174.7	-177.7	-80.1	0	0	0	110.5	M187 A188 K200 C201 W206 G207 I208 V234 C257 W258	M187-F204 VanDerWaalsContact O-CE1 3.29Å; M187-F204 WeakPolarHBondContact O-CE1 3.31Å; A188-F204 HydrophobicContact CB-CB 3.64Å; A188-F204 HydrophobicContact CB-CD1 4.06Å; A188-F204 HydrophobicContact CB-CD2 4.32Å; A188-F204 HydrophobicContact CB-CG 3.77Å; K200-F204 PolarHBondContact O-N 3.22Å; C201-F204 WeakPolarHBondContact O-CB 3.47Å; C201-F204 PolarHBondContact O-N 2.9Å; F204-W206 VanDerWaalsContact C-N 3.33Å; F204-W206 PolarHBondContact O-N 2.86Å; F204-G207 PolarHBondContact O-N 3.45Å; F204-I208 HydrophobicContact CD1-CG1 4.11Å; F204-I208 HydrophobicContact CE1-CD1 4.12Å; F204-I208 HydrophobicContact CE1-CG1 3.8Å; F204-I208 HydrophobicContact CZ-CD1 4.37Å; F204-I208 PolarHBondContact O-N 2.98Å; F204-I208 VanDerWaalsContact O-N 3.13Å; F204-V234 HydrophobicContact CZ-CG1 3.81Å; F204-C257 WeakPolarHBondContact CA-O 3.46Å; F204-W258 HydrophobicContact CD2-CB 4.01Å; F204-W258 HydrophobicContact CE2-CB 3.86Å; F204-W258 HydrophobicContact CZ-CB 4.45Å
205	S	98.5	Very high	94	Very high	6 Å²	6	22.5 Å²	22.5	4%	0.042	12%	0.123	C	C	.	.	H	α-helix	trans	-58	-44.4	178.6	-53	0	0	0	0	112	L148 W186 C201 D202 G207 I208 I209	L148-S205 WeakPolarHBondContact O-CB 3.38Å; W186-S205 WeakPolarHBondContact O-CA 3.15Å; W186-S205 WeakPolarHBondContact O-CB 3.5Å; W186-S205 PolarHBondContact O-OG 3.5Å; C201-S205 PolarHBondContact O-N 3.48Å; C201-S205 PolarHBondContact O-OG 3.11Å; D202-S205 PolarHBondContact O-N 2.84Å; S205-G207 VanDerWaalsContact C-N 3.32Å; S205-G207 PolarHBondContact O-N 2.83Å; S205-I208 PolarHBondContact O-N 3.47Å; S205-I209 WeakPolarHBondContact O-CD1 3.14Å; S205-I209 VanDerWaalsContact O-CG1 3.31Å; S205-I209 WeakPolarHBondContact O-CG1 3.32Å; S205-I209 PolarHBondContact O-N 2.94Å
206	W	98.9	Very high	95.3	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-59.8	-39.2	174.3	-175.2	93.6	0	0	0	113	C125 D202 F204 I208 I209 L210 L253 C257 M268 I271 M275	C125-W206 HydrophobicContact CB-CZ2 3.84Å; C125-W206 PolarHBondContact O-NE1 2.81Å; D202-W206 WeakPolarHBondContact O-CB 3.3Å; D202-W206 PolarHBondContact O-N 3.2Å; F204-W206 VanDerWaalsContact C-N 3.33Å; F204-W206 PolarHBondContact O-N 2.86Å; W206-I208 VanDerWaalsContact C-N 3.33Å; W206-I208 PolarHBondContact O-N 2.95Å; W206-I209 PolarHBondContact O-N 2.69Å; W206-L210 HydrophobicContact CH2-CD2 3.74Å; W206-L210 HydrophobicContact CZ3-CB 4.41Å; W206-L210 HydrophobicContact CZ3-CD2 3.76Å; W206-L210 PolarHBondContact O-N 2.92Å; W206-L253 HydrophobicContact CH2-CD2 3.74Å; W206-L253 HydrophobicContact CH2-CG 4.26Å; W206-L253 HydrophobicContact CZ3-CD2 4.1Å; W206-L253 HydrophobicContact CZ3-CG 4.09Å; W206-C257 HydrophobicContact CE3-CB 4.49Å; W206-M268 HydrophobicContact CB-CE 3.55Å; W206-M268 HydrophobicContact CG-CE 3.87Å; W206-I271 HydrophobicContact CD2-CD1 4.35Å; W206-I271 HydrophobicContact CD2-CG2 4.14Å; W206-I271 HydrophobicContact CE3-CD1 4.01Å; W206-I271 HydrophobicContact CE3-CG2 4.16Å; W206-I271 HydrophobicContact CH2-CG2 3.47Å; W206-I271 VanDerWaalsContact CH2-CG2 3.47Å; W206-I271 HydrophobicContact CZ2-CG2 3.39Å; W206-I271 HydrophobicContact CZ3-CD1 4.35Å; W206-I271 HydrophobicContact CZ3-CG1 4.5Å; W206-I271 HydrophobicContact CZ3-CG2 3.85Å; W206-M275 HydrophobicContact CH2-CG 4.19Å; W206-M275 HydrophobicContact CH2-SD 3.98Å; W206-M275 HydrophobicContact CZ2-CE 4.24Å; W206-M275 HydrophobicContact CZ2-CG 4.03Å; W206-M275 HydrophobicContact CZ2-SD 4.08Å
207	G	98.8	Very high	96.5	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-62.8	-36.6	175.2	0	0	0	0	0	113.5	V203 F204 S205 W211	V203-G207 PolarHBondContact O-N 3.31Å; V203-G207 VanDerWaalsContact O-N 3.1Å; F204-G207 PolarHBondContact O-N 3.45Å; S205-G207 VanDerWaalsContact C-N 3.32Å; S205-G207 PolarHBondContact O-N 2.83Å; G207-W211 PolarHBondContact O-N 2.75Å
208	I	98.8	Very high	97.5	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-70.3	-43.8	172.8	-57.6	-64.9	0	0	0	110.9	W186 F204 S205 W206 L210 W211 E212 P219 F220 P240 W258	W186-I208 VanDerWaalsContact CD1-CG2 3.48Å; W186-I208 HydrophobicContact CG-CG2 4.25Å; F204-I208 HydrophobicContact CD1-CG1 4.11Å; F204-I208 HydrophobicContact CE1-CD1 4.12Å; F204-I208 HydrophobicContact CE1-CG1 3.8Å; F204-I208 HydrophobicContact CZ-CD1 4.37Å; F204-I208 PolarHBondContact O-N 2.98Å; F204-I208 VanDerWaalsContact O-N 3.13Å; S205-I208 PolarHBondContact O-N 3.47Å; W206-I208 VanDerWaalsContact C-N 3.33Å; W206-I208 PolarHBondContact O-N 2.95Å; I208-L210 VanDerWaalsContact C-N 3.3Å; I208-L210 PolarHBondContact O-N 2.8Å; I208-W211 WeakPolarHBondContact O-CB 3.39Å; I208-W211 PolarHBondContact O-N 3.4Å; I208-E212 WeakPolarHBondContact O-CB 3.5Å; I208-E212 PolarHBondContact O-N 2.89Å; I208-P219 HydrophobicContact CG2-CB 3.56Å; I208-P219 HydrophobicContact CG2-CG 3.65Å; I208-F220 HydrophobicContact CD1-CE2 4.31Å; I208-F220 HydrophobicContact CD1-CZ 4.48Å; I208-P240 HydrophobicContact CD1-CG 3.73Å; I208-W258 HydrophobicContact CD1-CE3 3.99Å
209	I	98.9	Very high	97.9	Very high	1 Å²	1	22.3 Å²	22.3	1%	0.005	10%	0.098	C	C	.	.	H	α-helix	trans	-59.4	-41.2	177.6	-67.6	157.4	0	0	0	111	L148 P150 L153 S205 W206 W211 E212 V213	L148-I209 HydrophobicContact CB-CD1 4.22Å; P150-I209 HydrophobicContact CG-CG1 4.48Å; L153-I209 HydrophobicContact CD1-CD1 4.09Å; L153-I209 HydrophobicContact CD1-CG2 4.21Å; S205-I209 WeakPolarHBondContact O-CD1 3.14Å; S205-I209 VanDerWaalsContact O-CG1 3.31Å; S205-I209 WeakPolarHBondContact O-CG1 3.32Å; S205-I209 PolarHBondContact O-N 2.94Å; W206-I209 PolarHBondContact O-N 2.69Å; I209-W211 PolarHBondContact O-N 2.85Å; I209-E212 PolarHBondContact O-N 3.38Å; I209-V213 HydrophobicContact CG2-CG1 4.45Å; I209-V213 WeakPolarHBondContact O-CG2 3.33Å; I209-V213 PolarHBondContact O-N 3.35Å
210	L	98.9	Very high	97.9	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-60.2	-43.6	176	-179.3	65.3	0	0	0	112.3	M122 C125 W206 I208 E212 V213 I214 I250 M254	M122-L210 HydrophobicContact SD-CD1 4.13Å; C125-L210 HydrophobicContact CB-CD1 3.96Å; W206-L210 HydrophobicContact CH2-CD2 3.74Å; W206-L210 HydrophobicContact CZ3-CB 4.41Å; W206-L210 HydrophobicContact CZ3-CD2 3.76Å; W206-L210 PolarHBondContact O-N 2.92Å; I208-L210 VanDerWaalsContact C-N 3.3Å; I208-L210 PolarHBondContact O-N 2.8Å; L210-E212 VanDerWaalsContact C-N 3.34Å; L210-V213 WeakPolarHBondContact O-CG2 3.26Å; L210-I214 HydrophobicContact CD1-CD1 3.83Å; L210-I214 HydrophobicContact CD1-CG1 4.48Å; L210-I214 HydrophobicContact CG-CD1 4.02Å; L210-I214 WeakPolarHBondContact O-CD1 3.17Å; L210-I214 VanDerWaalsContact O-CG1 3.23Å; L210-I214 WeakPolarHBondContact O-CG1 3.29Å; L210-I214 PolarHBondContact O-N 3.45Å; L210-I250 HydrophobicContact CD2-CG2 4.21Å; L210-M254 HydrophobicContact CD2-CB 3.96Å; L210-M254 HydrophobicContact CD2-CG 4.35Å
211	W	98.8	Very high	97.7	Very high	9 Å²	9	24.2 Å²	24.2	3%	0.034	11%	0.111	C	C	.	.	H	α-helix	trans	-62.9	-42.3	174.9	178.7	91.8	0	0	0	111.8	G207 I208 I209 I214 T215 R217 P219 P240 P241 I243 M254 W258	G207-W211 PolarHBondContact O-N 2.75Å; I208-W211 WeakPolarHBondContact O-CB 3.39Å; I208-W211 PolarHBondContact O-N 3.4Å; I209-W211 PolarHBondContact O-N 2.85Å; W211-I214 PolarHBondContact O-N 2.87Å; W211-T215 HydrophobicContact CD2-CG2 4.14Å; W211-T215 HydrophobicContact CZ2-CG2 3.92Å; W211-T215 WeakPolarHBondContact O-CB 3.27Å; W211-T215 WeakPolarHBondContact O-CG2 3.46Å; W211-T215 PolarHBondContact O-N 3.3Å; W211-T215 PolarHBondContact O-OG1 3.12Å; W211-R217 HydrophobicContact CH2-CB 3.72Å; W211-R217 HydrophobicContact CZ3-CB 4.04Å; W211-R217 WeakPolarHBondContact CZ3-O 3.49Å; W211-P219 HydrophobicContact CE3-CB 4.42Å; W211-P219 HydrophobicContact CZ3-CB 4.23Å; W211-P240 HydrophobicContact CD2-CB 3.37Å; W211-P240 HydrophobicContact CD2-CG 4.14Å; W211-P240 HydrophobicContact CE3-CB 3.83Å; W211-P240 HydrophobicContact CE3-CG 4.29Å; W211-P240 HydrophobicContact CG-CB 3.74Å; W211-P240 HydrophobicContact CG-CG 4.37Å; W211-P240 HydrophobicContact CH2-CB 4.19Å; W211-P240 HydrophobicContact CZ2-CB 3.77Å; W211-P240 HydrophobicContact CZ3-CB 4.21Å; W211-P241 HydrophobicContact CZ2-CG 3.97Å; W211-P241 PolarHBondContact NE1-O 2.83Å; W211-I243 HydrophobicContact CG-CD1 4.36Å; W211-M254 HydrophobicContact CB-CG 4.48Å; W211-M254 HydrophobicContact CB-SD 3.69Å; W211-M254 HydrophobicContact CG-SD 4.23Å; W211-W258 HydrophobicContact CB-CZ3 4.01Å; W211-W258 HydrophobicContact CG-CZ3 4.22Å
212	E	98.8	Very high	97.4	Very high	0 Å²	0	32 Å²	32	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-67.1	-45	-177.5	170.5	165.6	-150.9	0	0	112.7	L107 H108 P150 W186 I208 I209 L210 I214 T215 R216 R217 P219	L107-E212 HydrophobicContact CD1-CG 3.96Å; H108-E212 IonicContact CD2-OE1 3.48Å; H108-E212 IonicContact CE1-OE1 2.7Å; H108-E212 IonicContact NE2-OE1 2.78Å; H108-E212 PolarHBondContact NE2-OE1 3.24Å; P150-E212 HydrophobicContact CG-CG 4.5Å; P150-E212 VanDerWaalsContact CG-OE2 3.24Å; P150-E212 WeakPolarHBondContact CG-OE2 3.47Å; W186-E212 PolarHBondContact NE1-OE2 2.91Å; I208-E212 WeakPolarHBondContact O-CB 3.5Å; I208-E212 PolarHBondContact O-N 2.89Å; I209-E212 PolarHBondContact O-N 3.38Å; L210-E212 VanDerWaalsContact C-N 3.34Å; E212-I214 VanDerWaalsContact C-N 3.32Å; E212-I214 PolarHBondContact O-N 3.18Å; E212-T215 PolarHBondContact O-N 3.04Å; E212-T215 PolarHBondContact O-OG1 3.09Å; E212-R216 WeakPolarHBondContact O-CA 3.32Å; E212-R216 PolarHBondContact O-N 3.01Å; E212-R217 WeakPolarHBondContact CG-O 3.35Å; E212-P219 WeakPolarHBondContact OE1-CD 3.29Å
213	V	98.8	Very high	96.9	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-68.3	-29.5	176.7	-62.3	0	0	0	0	112.9	L103 L107 Y116 A121 W124 C125 I209 L210	L103-V213 HydrophobicContact CD2-CG1 4.02Å; L107-V213 HydrophobicContact CD1-CG1 4.14Å; L107-V213 HydrophobicContact CD2-CG1 4.43Å; Y116-V213 VanDerWaalsContact CE2-O 3.3Å; Y116-V213 WeakPolarHBondContact CE2-O 3.42Å; Y116-V213 PolarHBondContact OH-O 2.88Å; A121-V213 HydrophobicContact CB-CB 4.01Å; A121-V213 HydrophobicContact CB-CG2 3.85Å; W124-V213 HydrophobicContact CE3-CB 4.49Å; W124-V213 HydrophobicContact CE3-CG1 4.19Å; C125-V213 VanDerWaalsContact SG-CG2 3.55Å; I209-V213 HydrophobicContact CG2-CG1 4.45Å; I209-V213 WeakPolarHBondContact O-CG2 3.33Å; I209-V213 PolarHBondContact O-N 3.35Å; L210-V213 WeakPolarHBondContact O-CG2 3.26Å
214	I	98.6	Very high	96	Very high	34 Å²	34	35.3 Å²	35.3	17%	0.174	17%	0.17	C	C	.	.	H	α-helix	trans	-77.1	-36.1	177.1	-64.6	170.2	0	0	0	111.3	L210 W211 E212 I243 L246 I250	L210-I214 HydrophobicContact CD1-CD1 3.83Å; L210-I214 HydrophobicContact CD1-CG1 4.48Å; L210-I214 HydrophobicContact CG-CD1 4.02Å; L210-I214 WeakPolarHBondContact O-CD1 3.17Å; L210-I214 VanDerWaalsContact O-CG1 3.23Å; L210-I214 WeakPolarHBondContact O-CG1 3.29Å; L210-I214 PolarHBondContact O-N 3.45Å; W211-I214 PolarHBondContact O-N 2.87Å; E212-I214 VanDerWaalsContact C-N 3.32Å; E212-I214 PolarHBondContact O-N 3.18Å; I214-I243 HydrophobicContact CB-CD1 3.98Å; I214-I243 HydrophobicContact CG2-CD1 3.68Å; I214-I243 HydrophobicContact CG2-CG2 4.37Å; I214-L246 HydrophobicContact CD1-CD1 4.08Å; I214-L246 HydrophobicContact CG2-CD1 4.2Å; I214-I250 HydrophobicContact CD1-CG2 3.99Å
215	T	98.4	Very high	94.9	Very high	37 Å²	37	38.4 Å²	38.4	23%	0.227	20%	0.202	C	C	.	.	H	α-helix	trans	-90.8	-21	-177.4	55.7	0	0	0	0	114.8	W211 E212 R217 I243	W211-T215 HydrophobicContact CD2-CG2 4.14Å; W211-T215 HydrophobicContact CZ2-CG2 3.92Å; W211-T215 WeakPolarHBondContact O-CB 3.27Å; W211-T215 WeakPolarHBondContact O-CG2 3.46Å; W211-T215 PolarHBondContact O-N 3.3Å; W211-T215 PolarHBondContact O-OG1 3.12Å; E212-T215 PolarHBondContact O-N 3.04Å; E212-T215 PolarHBondContact O-OG1 3.09Å; T215-R217 PolarHBondContact O-N 2.91Å; T215-R217 PolarHBondContact OG1-N 3.05Å; T215-I243 HydrophobicContact CG2-CD1 3.57Å; T215-I243 HydrophobicContact CG2-CG1 3.71Å
216	R	98.1	Very high	93.8	Very high	65 Å²	65	41.1 Å²	41.1	25%	0.245	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.7	37	-164	-151.2	-179.2	-168.1	147.7	12	112.6	V106 L107 P114 Y116 E212	V106-R216 PolarHBondContact O-NH2 2.88Å; L107-R216 HydrophobicContact CD2-CG 4.25Å; L107-R216 PolarHBondContact O-NE 3.26Å; P114-R216 PolarHBondContact O-NH1 3.19Å; P114-R216 PolarHBondContact O-NH2 3.48Å; Y116-R216 HydrophobicContact CE1-CG 4.07Å; Y116-R216 WeakPolarHBondContact OH-CB 3.27Å; E212-R216 WeakPolarHBondContact O-CA 3.32Å; E212-R216 PolarHBondContact O-N 3.01Å
217	R	97.7	Very high	92.7	Very high	143 Å²	143	43 Å²	43	54%	0.54	24%	0.235	S	C	.	.			trans	-120.9	144.1	178.2	-69.2	-179.6	177.3	-132	-4.7	110.7	W211 E212 T215	W211-R217 HydrophobicContact CH2-CB 3.72Å; W211-R217 HydrophobicContact CZ3-CB 4.04Å; W211-R217 WeakPolarHBondContact CZ3-O 3.49Å; E212-R217 WeakPolarHBondContact CG-O 3.35Å; T215-R217 PolarHBondContact O-N 2.91Å; T215-R217 PolarHBondContact OG1-N 3.05Å
218	K	96.8	Very high	91.7	Very high	75 Å²	75	47.1 Å²	47.1	33%	0.326	25%	0.253	S	S	.	.			trans	-69.3	131.6	172.8	-65.2	177.3	-172.7	177.5	0	109.5	Y104 F220 D221	Y104-K218 WeakPolarHBondContact OH-CE 3.33Å; Y104-K218 PolarHBondContact OH-NZ 3.47Å; K218-F220 PolarHBondContact O-N 2.75Å; K218-D221 HydrophobicContact CB-CB 4.01Å
219	P	96.3	Very high	90.9	Very high	6 Å²	6	52.3 Å²	52.3	4%	0.039	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	132	178.1	23.3	-30.9	0	0	0	111	A185 W186 I208 W211 E212 D221	A185-P219 HydrophobicContact CB-CB 4.35Å; A185-P219 HydrophobicContact CB-CG 3.94Å; W186-P219 HydrophobicContact CD2-CG 4.48Å; W186-P219 HydrophobicContact CZ2-CG 3.82Å; I208-P219 HydrophobicContact CG2-CB 3.56Å; I208-P219 HydrophobicContact CG2-CG 3.65Å; W211-P219 HydrophobicContact CE3-CB 4.42Å; W211-P219 HydrophobicContact CZ3-CB 4.23Å; E212-P219 WeakPolarHBondContact OE1-CD 3.29Å; P219-D221 VanDerWaalsContact C-N 3.26Å; P219-D221 PolarHBondContact O-N 3.25Å
220	F	94.8	Very high	90.3	Very high	17 Å²	17	53.3 Å²	53.3	8%	0.075	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	62.1	18.4	178.8	-48	-77.5	0	0	0	116.7	A185 I208 K218 E222 I223 G224 I230 V234 T238 P240	A185-F220 HydrophobicContact CB-CD2 4.05Å; A185-F220 WeakPolarHBondContact O-CE2 3.24Å; I208-F220 HydrophobicContact CD1-CE2 4.31Å; I208-F220 HydrophobicContact CD1-CZ 4.48Å; K218-F220 PolarHBondContact O-N 2.75Å; F220-E222 PolarHBondContact O-N 2.96Å; F220-I223 HydrophobicContact CB-CD1 4.08Å; F220-I223 HydrophobicContact CB-CG1 4.28Å; F220-I223 HydrophobicContact CD1-CD1 3.85Å; F220-I223 HydrophobicContact CG-CD1 4.37Å; F220-I223 WeakPolarHBondContact O-CB 3.44Å; F220-I223 PolarHBondContact O-N 2.96Å; F220-G224 PolarHBondContact O-N 2.8Å; F220-I230 HydrophobicContact CB-CD1 4.25Å; F220-I230 HydrophobicContact CB-CG1 4.21Å; F220-I230 HydrophobicContact CB-CG2 4.08Å; F220-I230 HydrophobicContact CD2-CG2 3.86Å; F220-I230 HydrophobicContact CG-CG2 4Å; F220-V234 HydrophobicContact CE1-CG2 4Å; F220-V234 HydrophobicContact CE2-CG2 3.9Å; F220-V234 HydrophobicContact CZ-CG2 3.54Å; F220-T238 HydrophobicContact CE1-CG2 4.26Å; F220-P240 HydrophobicContact CE1-CG 4.46Å; F220-P240 HydrophobicContact CE2-CG 4.3Å; F220-P240 HydrophobicContact CZ-CG 4.02Å
221	D	91.6	Very high	89.6	Confident	111 Å²	111	54.2 Å²	54.2	59%	0.594	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	-39.6	179.3	-152.5	58.1	0	0	0	112.7	K218 P219 I223 G224	K218-D221 HydrophobicContact CB-CB 4.01Å; P219-D221 VanDerWaalsContact C-N 3.26Å; P219-D221 PolarHBondContact O-N 3.25Å; D221-I223 PolarHBondContact O-N 2.82Å; D221-G224 PolarHBondContact O-N 3.41Å
222	E	88.6	Confident	88.7	Confident	169 Å²	169	60.4 Å²	60.4	79%	0.79	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-20.6	176.8	-64.5	174.5	-162.1	0	0	114	F220	F220-E222 PolarHBondContact O-N 2.96Å
223	I	88.3	Confident	88.1	Confident	43 Å²	43	61 Å²	61	22%	0.221	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-54.9	173.2	-56.8	-173.1	0	0	0	108.8	F220 D221 R229 I230 A233	F220-I223 HydrophobicContact CB-CD1 4.08Å; F220-I223 HydrophobicContact CB-CG1 4.28Å; F220-I223 HydrophobicContact CD1-CD1 3.85Å; F220-I223 HydrophobicContact CG-CD1 4.37Å; F220-I223 WeakPolarHBondContact O-CB 3.44Å; F220-I223 PolarHBondContact O-N 2.96Å; D221-I223 PolarHBondContact O-N 2.82Å; I223-R229 HydrophobicContact CG2-CB 4.1Å; I223-R229 PolarHBondContact O-NH1 3.42Å; I223-R229 PolarHBondContact O-NH2 3.48Å; I223-I230 HydrophobicContact CB-CG1 4.48Å; I223-I230 HydrophobicContact CG2-CG1 4.38Å; I223-A233 HydrophobicContact CD1-CB 3.58Å
224	G	78.7	Confident	87.7	Confident	26 Å²	26	61 Å²	61	27%	0.268	31%	0.311	S	S	.	.			trans	60.8	-170.2	178	0	0	0	0	0	115.8	F220 D221 R229	F220-G224 PolarHBondContact O-N 2.8Å; D221-G224 PolarHBondContact O-N 3.41Å; G224-R229 PolarHBondContact O-NH1 3.27Å
225	G	75.1	Confident	87.2	Confident	65 Å²	65	62.2 Å²	62.2	67%	0.67	32%	0.316	S	S	*	.	S	Bend	trans	68.9	-156.4	-179.3	0	0	0	0	0	113.7
226	P	76.4	Confident	86.6	Confident	62 Å²	62	64.9 Å²	64.9	40%	0.403	33%	0.329	S	S	.	.	S	Bend	trans	-66.5	149.1	-176.2	-23.2	34.9	0	0	0	113.9	F228 R229	P226-F228 HydrophobicContact CB-CD1 3.63Å; P226-F228 HydrophobicContact CB-CE1 3.46Å; P226-F228 VanDerWaalsContact CB-CE1 3.46Å; P226-F228 HydrophobicContact CB-CZ 4.24Å; P226-F228 HydrophobicContact CG-CE1 3.86Å; P226-F228 HydrophobicContact CG-CZ 4.33Å; P226-F228 PolarHBondContact O-N 3.39Å; P226-R229 WeakPolarHBondContact O-CB 3.48Å; P226-R229 PolarHBondContact O-N 3.24Å
227	A	76.7	Confident	86.2	Confident	39 Å²	39	63.9 Å²	63.9	32%	0.322	34%	0.338	S	S	.	.	H	α-helix	trans	-51.1	-33.5	-176.1	0	0	0	0	0	115	A184 R229 I230 M231	A184-A227 HydrophobicContact CB-CB 3.95Å; A227-R229 PolarHBondContact O-N 2.98Å; A227-I230 PolarHBondContact O-N 2.91Å; A227-I230 VanDerWaalsContact O-N 3.14Å; A227-M231 PolarHBondContact O-N 3.35Å; A227-M231 VanDerWaalsContact O-N 3.11Å
228	F	76.3	Confident	86.1	Confident	87 Å²	87	60.1 Å²	60.1	38%	0.382	33%	0.331	S	S	.	.	H	α-helix	trans	-61	-26.9	178.9	70.7	-106.2	0	0	0	113.2	P226 M231 W232 T532	P226-F228 HydrophobicContact CB-CD1 3.63Å; P226-F228 HydrophobicContact CB-CE1 3.46Å; P226-F228 VanDerWaalsContact CB-CE1 3.46Å; P226-F228 HydrophobicContact CB-CZ 4.24Å; P226-F228 HydrophobicContact CG-CE1 3.86Å; P226-F228 HydrophobicContact CG-CZ 4.33Å; P226-F228 PolarHBondContact O-N 3.39Å; F228-M231 PolarHBondContact O-N 3.41Å; F228-W232 VanDerWaalsContact O-CB 3.28Å; F228-W232 WeakPolarHBondContact O-CB 3.33Å; F228-W232 PolarHBondContact O-N 3.13Å; F228-T532 HydrophobicContact CZ-CG2 4.41Å
229	R	83.1	Confident	86.2	Confident	110 Å²	110	58.5 Å²	58.5	42%	0.415	32%	0.323	S	S	.	.	H	α-helix	trans	-68.6	-37.6	177.2	-65.1	-176.6	65.2	-131.1	1	111.8	I223 G224 P226 A227 A233	I223-R229 HydrophobicContact CG2-CB 4.1Å; I223-R229 PolarHBondContact O-NH1 3.42Å; I223-R229 PolarHBondContact O-NH2 3.48Å; G224-R229 PolarHBondContact O-NH1 3.27Å; P226-R229 WeakPolarHBondContact O-CB 3.48Å; P226-R229 PolarHBondContact O-N 3.24Å; A227-R229 PolarHBondContact O-N 2.98Å; R229-A233 WeakPolarHBondContact O-CB 3.46Å; R229-A233 PolarHBondContact O-N 3.07Å; R229-A233 VanDerWaalsContact O-N 3.09Å
230	I	85.9	Confident	86.2	Confident	22 Å²	22	58.4 Å²	58.4	11%	0.113	32%	0.323	C	S	.	.	H	α-helix	trans	-70.4	-45.3	174.8	-60.9	175.2	0	0	0	109.8	A184 F220 I223 A227 W232 A233 V234	A184-I230 HydrophobicContact CB-CB 4.41Å; A184-I230 HydrophobicContact CB-CG2 4.45Å; F220-I230 HydrophobicContact CB-CD1 4.25Å; F220-I230 HydrophobicContact CB-CG1 4.21Å; F220-I230 HydrophobicContact CB-CG2 4.08Å; F220-I230 HydrophobicContact CD2-CG2 3.86Å; F220-I230 HydrophobicContact CG-CG2 4Å; I223-I230 HydrophobicContact CB-CG1 4.48Å; I223-I230 HydrophobicContact CG2-CG1 4.38Å; A227-I230 PolarHBondContact O-N 2.91Å; A227-I230 VanDerWaalsContact O-N 3.14Å; I230-W232 PolarHBondContact O-N 3.44Å; I230-A233 PolarHBondContact O-N 3.46Å; I230-V234 HydrophobicContact CG2-CG2 4.3Å; I230-V234 WeakPolarHBondContact O-CB 3.42Å; I230-V234 WeakPolarHBondContact O-CG2 3.43Å; I230-V234 PolarHBondContact O-N 3.24Å
231	M	84	Confident	86.3	Confident	19 Å²	19	61.7 Å²	61.7	9%	0.094	35%	0.345	C	S	.	.	H	α-helix	trans	-56.1	-48.2	175.1	-66.4	166.6	162.6	0	0	111.7	A184 M187 F192 A227 F228 A233 V234 H235	A184-M231 HydrophobicContact CB-CE 4.17Å; A184-M231 HydrophobicContact CB-CG 4.1Å; M187-M231 HydrophobicContact SD-CE 4.26Å; F192-M231 HydrophobicContact CB-CE 4.06Å; F192-M231 HydrophobicContact CB-CG 4.4Å; F192-M231 HydrophobicContact CB-SD 4.32Å; F192-M231 HydrophobicContact CD1-CB 4.26Å; F192-M231 HydrophobicContact CD1-CG 3.85Å; F192-M231 HydrophobicContact CD2-CB 4.03Å; F192-M231 HydrophobicContact CD2-CG 4.31Å; F192-M231 HydrophobicContact CE1-CB 4.16Å; F192-M231 HydrophobicContact CE1-CG 4.1Å; F192-M231 HydrophobicContact CE2-CB 3.95Å; F192-M231 WeakPolarHBondContact CE2-O 3.04Å; F192-M231 HydrophobicContact CG-CB 4.19Å; F192-M231 HydrophobicContact CG-CG 3.96Å; F192-M231 HydrophobicContact CG-SD 4.48Å; F192-M231 HydrophobicContact CZ-CB 3.99Å; F192-M231 HydrophobicContact CZ-CG 4.43Å; F192-M231 WeakPolarHBondContact CZ-O 3.4Å; A227-M231 PolarHBondContact O-N 3.35Å; A227-M231 VanDerWaalsContact O-N 3.11Å; F228-M231 PolarHBondContact O-N 3.41Å; M231-A233 PolarHBondContact O-N 2.88Å; M231-V234 PolarHBondContact O-N 3.49Å; M231-H235 WeakPolarHBondContact O-CB 3.34Å; M231-H235 PolarHBondContact O-N 2.97Å
232	W	80.7	Confident	86.5	Confident	138 Å²	138	61.6 Å²	61.6	52%	0.523	34%	0.344	S	S	.	.	H	α-helix	trans	-60.9	-42.5	177.4	-179.2	-102.6	0	0	0	112.9	F228 I230 N236	F228-W232 VanDerWaalsContact O-CB 3.28Å; F228-W232 WeakPolarHBondContact O-CB 3.33Å; F228-W232 PolarHBondContact O-N 3.13Å; I230-W232 PolarHBondContact O-N 3.44Å; W232-N236 PolarHBondContact NE1-ND2 2.78Å; W232-N236 WeakPolarHBondContact O-CB 3.21Å; W232-N236 PolarHBondContact O-N 2.91Å; W232-N236 VanDerWaalsContact O-N 3.13Å; W232-N236 PolarHBondContact O-ND2 3.42Å
233	A	85.1	Confident	86.9	Confident	13 Å²	13	55 Å²	55	11%	0.107	31%	0.314	C	S	.	.	H	α-helix	trans	-63.8	-47.9	175.2	0	0	0	0	0	111.6	I223 R229 I230 M231 H235 N236 G237 T238	I223-A233 HydrophobicContact CD1-CB 3.58Å; R229-A233 WeakPolarHBondContact O-CB 3.46Å; R229-A233 PolarHBondContact O-N 3.07Å; R229-A233 VanDerWaalsContact O-N 3.09Å; I230-A233 PolarHBondContact O-N 3.46Å; M231-A233 PolarHBondContact O-N 2.88Å; A233-H235 VanDerWaalsContact C-N 3.34Å; A233-H235 PolarHBondContact O-N 3.08Å; A233-N236 CarbonylContact O-C 3.49Å; A233-N236 PolarHBondContact O-N 3.11Å; A233-G237 PolarHBondContact O-N 2.55Å; A233-T238 HydrophobicContact CB-CG2 4.3Å; A233-T238 WeakPolarHBondContact O-CB 3.34Å; A233-T238 PolarHBondContact O-N 3.03Å; A233-T238 PolarHBondContact O-OG1 2.83Å; A233-T238 VanDerWaalsContact O-OG1 3.06Å
234	V	91.6	Very high	87.3	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-63.7	-37.8	179.6	171.2	0	0	0	0	112	P189 F192 F204 F220 I230 M231 G237 R239	P189-V234 HydrophobicContact CB-CG1 4.43Å; F192-V234 HydrophobicContact CE1-CB 4.39Å; F192-V234 HydrophobicContact CE1-CG1 4.11Å; F192-V234 HydrophobicContact CZ-CB 4.03Å; F192-V234 HydrophobicContact CZ-CG1 3.92Å; F204-V234 HydrophobicContact CZ-CG1 3.81Å; F220-V234 HydrophobicContact CE1-CG2 4Å; F220-V234 HydrophobicContact CE2-CG2 3.9Å; F220-V234 HydrophobicContact CZ-CG2 3.54Å; I230-V234 HydrophobicContact CG2-CG2 4.3Å; I230-V234 WeakPolarHBondContact O-CB 3.42Å; I230-V234 WeakPolarHBondContact O-CG2 3.43Å; I230-V234 PolarHBondContact O-N 3.24Å; M231-V234 PolarHBondContact O-N 3.49Å; V234-G237 PolarHBondContact O-N 3.32Å; V234-G237 VanDerWaalsContact O-N 3.15Å; V234-R239 PolarHBondContact O-NH1 3.29Å
235	H	86.3	Confident	88	Confident	60 Å²	60	69 Å²	69	28%	0.278	37%	0.374	S	S	.	.	H	α-helix	trans	-58	-47.8	172.2	-178.6	76.2	0	0	0	111.7	F192 E193 M231 A233 G237 K260	F192-H235 HydrophobicContact CE2-CB 4.15Å; E193-H235 IonicContact OE1-CE1 2.67Å; E193-H235 PolarHBondContact OE1-CE1 2.69Å; E193-H235 IonicContact OE1-CG 3.87Å; E193-H235 IonicContact OE1-ND1 2.79Å; E193-H235 PolarHBondContact OE1-ND1 3.15Å; M231-H235 WeakPolarHBondContact O-CB 3.34Å; M231-H235 PolarHBondContact O-N 2.97Å; A233-H235 VanDerWaalsContact C-N 3.34Å; A233-H235 PolarHBondContact O-N 3.08Å; H235-G237 PolarHBondContact O-N 2.86Å; H235-G237 VanDerWaalsContact O-N 3.13Å; H235-K260 PolarHBondContact O-NZ 2.91Å
236	N	87.3	Confident	89	Confident	93 Å²	93	66.8 Å²	66.8	50%	0.497	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	9.2	177.9	-70.6	-48.1	0	0	0	113.8	W232 A233	W232-N236 PolarHBondContact NE1-ND2 2.78Å; W232-N236 WeakPolarHBondContact O-CB 3.21Å; W232-N236 PolarHBondContact O-N 2.91Å; W232-N236 VanDerWaalsContact O-N 3.13Å; W232-N236 PolarHBondContact O-ND2 3.42Å; A233-N236 CarbonylContact O-C 3.49Å; A233-N236 PolarHBondContact O-N 3.11Å
237	G	89.9	Confident	90	Very high	43 Å²	43	65.6 Å²	65.6	44%	0.443	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	90	3.3	173.1	0	0	0	0	0	115.2	A233 V234 H235 R239	A233-G237 PolarHBondContact O-N 2.55Å; V234-G237 PolarHBondContact O-N 3.32Å; V234-G237 VanDerWaalsContact O-N 3.15Å; H235-G237 PolarHBondContact O-N 2.86Å; H235-G237 VanDerWaalsContact O-N 3.13Å; G237-R239 PolarHBondContact O-N 3.38Å
238	T	95.4	Very high	90.9	Very high	65 Å²	65	70.1 Å²	70.1	40%	0.399	35%	0.352	S	S	.	.			trans	-60.4	137.3	172.2	-49.4	0	0	0	0	110.2	F220 A233	F220-T238 HydrophobicContact CE1-CG2 4.26Å; A233-T238 HydrophobicContact CB-CG2 4.3Å; A233-T238 WeakPolarHBondContact O-CB 3.34Å; A233-T238 PolarHBondContact O-N 3.03Å; A233-T238 PolarHBondContact O-OG1 2.83Å; A233-T238 VanDerWaalsContact O-OG1 3.06Å
239	R	97.9	Very high	91.9	Very high	41 Å²	41	70 Å²	70	16%	0.155	36%	0.359	C	S	.	.			trans	-137.3	163.4	178	-65	-62	-179.5	-91.4	4.1	109.3	V234 G237 W258	V234-R239 PolarHBondContact O-NH1 3.29Å; G237-R239 PolarHBondContact O-N 3.38Å; R239-W258 HydrophobicContact CB-CD2 4.31Å; R239-W258 HydrophobicContact CB-CZ2 4.11Å; R239-W258 HydrophobicContact CG-CD2 4.32Å; R239-W258 HydrophobicContact CG-CG 4.13Å; R239-W258 PolarHBondContact NE-O 3.15Å; R239-W258 PolarHBondContact NH2-O 2.83Å
240	P	97.5	Very high	92.7	Very high	4 Å²	4	65 Å²	65	3%	0.026	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-57.8	144.8	172.9	-21.6	34.1	0	0	0	111.4	I208 W211 F220 W258	I208-P240 HydrophobicContact CD1-CG 3.73Å; W211-P240 HydrophobicContact CD2-CB 3.37Å; W211-P240 HydrophobicContact CD2-CG 4.14Å; W211-P240 HydrophobicContact CE3-CB 3.83Å; W211-P240 HydrophobicContact CE3-CG 4.29Å; W211-P240 HydrophobicContact CG-CB 3.74Å; W211-P240 HydrophobicContact CG-CG 4.37Å; W211-P240 HydrophobicContact CH2-CB 4.19Å; W211-P240 HydrophobicContact CZ2-CB 3.77Å; W211-P240 HydrophobicContact CZ3-CB 4.21Å; F220-P240 HydrophobicContact CE1-CG 4.46Å; F220-P240 HydrophobicContact CE2-CG 4.3Å; F220-P240 HydrophobicContact CZ-CG 4.02Å; P240-W258 HydrophobicContact CB-CH2 4.28Å; P240-W258 HydrophobicContact CB-CZ3 4.17Å; P240-W258 HydrophobicContact CG-CE3 4.48Å; P240-W258 HydrophobicContact CG-CH2 4.46Å; P240-W258 HydrophobicContact CG-CZ3 3.95Å
241	P	96.9	Very high	93.3	Very high	85 Å²	85	65.7 Å²	65.7	55%	0.552	34%	0.344	S	S	*	.	P	Polyproline II helix	trans	-65.6	146	-173.6	25.7	-35	0	0	0	112.5	W211 I243	W211-P241 HydrophobicContact CZ2-CG 3.97Å; W211-P241 PolarHBondContact NE1-O 2.83Å; P241-I243 PolarHBondContact O-N 2.73Å
242	L	96.1	Very high	93.9	Very high	110 Å²	110	67.7 Å²	67.7	58%	0.576	36%	0.359	S	S	*	.	P	Polyproline II helix	trans	-62.1	137.1	179.6	-64.8	179.8	0	0	0	111.8	T255	L242-T255 HydrophobicContact CD2-CG2 4.01Å
243	I	96.9	Very high	94.8	Very high	31 Å²	31	61.3 Å²	61.3	16%	0.159	34%	0.336	C	S	.	.	P	Polyproline II helix	trans	-83.5	122.4	-174.9	-53.6	176.1	0	0	0	109.1	W211 I214 T215 P241 L246 M254	W211-I243 HydrophobicContact CG-CD1 4.36Å; I214-I243 HydrophobicContact CB-CD1 3.98Å; I214-I243 HydrophobicContact CG2-CD1 3.68Å; I214-I243 HydrophobicContact CG2-CG2 4.37Å; T215-I243 HydrophobicContact CG2-CD1 3.57Å; T215-I243 HydrophobicContact CG2-CG1 3.71Å; P241-I243 PolarHBondContact O-N 2.73Å; I243-L246 HydrophobicContact CB-CB 4.04Å; I243-L246 HydrophobicContact CB-CD2 4.22Å; I243-L246 HydrophobicContact CD1-CD2 4.31Å; I243-L246 HydrophobicContact CG2-CB 4.3Å; I243-L246 WeakPolarHBondContact O-CB 3.44Å; I243-L246 PolarHBondContact O-N 2.86Å; I243-M254 HydrophobicContact CD1-CE 4.41Å; I243-M254 HydrophobicContact CD1-SD 4.28Å
244	K	94.7	Very high	95.4	Very high	192 Å²	192	60.7 Å²	60.7	84%	0.835	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	138.4	176.9	-66.3	-178.7	-179.1	177.1	0	110.3	L246	K244-L246 PolarHBondContact O-N 3.33Å
245	N	94	Very high	95.8	Very high	170 Å²	170	62.7 Å²	62.7	91%	0.909	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.5	17.4	179	-55	-15.3	0	0	0	115.8
246	L	95.8	Very high	96.4	Very high	18 Å²	18	63.7 Å²	63.7	9%	0.094	34%	0.344	C	S	.	.			trans	-66.1	133	174.6	-172.7	69.4	0	0	0	111.2	I214 I243 K244 K248 I250 E251 M254	I214-L246 HydrophobicContact CD1-CD1 4.08Å; I214-L246 HydrophobicContact CG2-CD1 4.2Å; I243-L246 HydrophobicContact CB-CB 4.04Å; I243-L246 HydrophobicContact CB-CD2 4.22Å; I243-L246 HydrophobicContact CD1-CD2 4.31Å; I243-L246 HydrophobicContact CG2-CB 4.3Å; I243-L246 WeakPolarHBondContact O-CB 3.44Å; I243-L246 PolarHBondContact O-N 2.86Å; K244-L246 PolarHBondContact O-N 3.33Å; L246-K248 PolarHBondContact O-N 2.92Å; L246-I250 HydrophobicContact CD1-CB 4.29Å; L246-I250 HydrophobicContact CD1-CG2 4.07Å; L246-I250 HydrophobicContact CD2-CG2 4.43Å; L246-I250 HydrophobicContact CG-CB 4.34Å; L246-I250 HydrophobicContact CG-CG2 4.45Å; L246-E251 HydrophobicContact CD2-CB 3.79Å; L246-E251 HydrophobicContact CD2-CG 4.27Å; L246-E251 HydrophobicContact CG-CB 4.32Å; L246-M254 HydrophobicContact CD2-CE 3.7Å; L246-M254 HydrophobicContact CD2-SD 4.39Å
247	P	97.1	Very high	96.9	Very high	38 Å²	38	59.2 Å²	59.2	25%	0.247	32%	0.32	C	S	.	.			trans	-58.1	128.1	174.4	-26.7	35.9	0	0	0	111.9	P249 I250 E251	P247-P249 VanDerWaalsContact C-CD 3.4Å; P247-P249 VanDerWaalsContact C-N 3.33Å; P247-P249 VanDerWaalsContact O-N 3.16Å; P247-I250 HydrophobicContact CB-CD1 4.19Å; P247-I250 HydrophobicContact CB-CG1 4.36Å; P247-I250 HydrophobicContact CG-CD1 4.16Å; P247-I250 WeakPolarHBondContact O-CA 3.36Å; P247-I250 WeakPolarHBondContact O-CB 3.42Å; P247-I250 PolarHBondContact O-N 2.81Å; P247-E251 PolarHBondContact O-N 3.45Å
248	K	97.4	Very high	97.3	Very high	134 Å²	134	58 Å²	58	58%	0.583	30%	0.303	S	S	*	.	H	α-helix	trans	-55.6	-31.5	-173.8	-66.9	-55.6	-169.3	-176.8	0	116.2	L246 I250 E251 S252	L246-K248 PolarHBondContact O-N 2.92Å; K248-I250 VanDerWaalsContact C-N 3.31Å; K248-I250 PolarHBondContact O-N 3.13Å; K248-E251 HydrophobicContact CD-CB 4.37Å; K248-E251 VanDerWaalsContact CD-OE1 3.31Å; K248-E251 WeakPolarHBondContact CD-OE1 3.32Å; K248-E251 IonicContact NZ-OE1 2.81Å; K248-E251 PolarHBondContact NZ-OE1 3.01Å; K248-E251 IonicContact NZ-OE2 3.76Å; K248-E251 PolarHBondContact NZ-OE2 2.76Å; K248-E251 PolarHBondContact O-N 2.75Å; K248-S252 VanDerWaalsContact O-CB 3.27Å; K248-S252 WeakPolarHBondContact O-CB 3.44Å; K248-S252 PolarHBondContact O-N 3.26Å
249	P	97.4	Very high	97.4	Very high	84 Å²	84	56.2 Å²	56.2	55%	0.545	29%	0.293	S	S	.	.	H	α-helix	trans	-60.4	-37.5	170.6	-26.4	36.6	0	0	0	113.6	P247 L253 L278	P247-P249 VanDerWaalsContact C-CD 3.4Å; P247-P249 VanDerWaalsContact C-N 3.33Å; P247-P249 VanDerWaalsContact O-N 3.16Å; P249-L253 WeakPolarHBondContact O-CB 3.45Å; P249-L253 PolarHBondContact O-N 2.79Å; P249-L253 VanDerWaalsContact O-N 3.1Å; P249-L278 HydrophobicContact CB-CD2 4.24Å
250	I	98.3	Very high	97.2	Very high	5 Å²	5	59 Å²	59	3%	0.026	31%	0.306	C	S	.	.	H	α-helix	trans	-75.7	-43.7	178.7	-53	176.4	0	0	0	109.8	M122 L210 I214 L246 P247 K248 S252 L253 M254 L278 F282	M122-I250 HydrophobicContact CE-CD1 3.9Å; M122-I250 HydrophobicContact CE-CG1 4.2Å; M122-I250 HydrophobicContact SD-CD1 4.11Å; L210-I250 HydrophobicContact CD2-CG2 4.21Å; I214-I250 HydrophobicContact CD1-CG2 3.99Å; L246-I250 HydrophobicContact CD1-CB 4.29Å; L246-I250 HydrophobicContact CD1-CG2 4.07Å; L246-I250 HydrophobicContact CD2-CG2 4.43Å; L246-I250 HydrophobicContact CG-CB 4.34Å; L246-I250 HydrophobicContact CG-CG2 4.45Å; P247-I250 HydrophobicContact CB-CD1 4.19Å; P247-I250 HydrophobicContact CB-CG1 4.36Å; P247-I250 HydrophobicContact CG-CD1 4.16Å; P247-I250 WeakPolarHBondContact O-CA 3.36Å; P247-I250 WeakPolarHBondContact O-CB 3.42Å; P247-I250 PolarHBondContact O-N 2.81Å; K248-I250 VanDerWaalsContact C-N 3.31Å; K248-I250 PolarHBondContact O-N 3.13Å; I250-S252 VanDerWaalsContact C-N 3.32Å; I250-S252 PolarHBondContact O-N 2.82Å; I250-L253 PolarHBondContact O-N 2.89Å; I250-M254 VanDerWaalsContact O-CB 3.26Å; I250-M254 WeakPolarHBondContact O-CB 3.44Å; I250-M254 PolarHBondContact O-N 3.41Å; I250-L278 HydrophobicContact CG1-CD1 4.17Å; I250-L278 HydrophobicContact CG1-CD2 4.43Å; I250-F282 HydrophobicContact CD1-CE2 4.08Å; I250-F282 HydrophobicContact CD1-CZ 3.86Å
251	E	98.4	Very high	97.1	Very high	36 Å²	36	62.4 Å²	62.4	17%	0.168	32%	0.324	C	S	.	.	H	α-helix	trans	-57.3	-44.6	174.5	-168.1	-172.5	94.3	0	0	111.8	L246 P247 K248 T255	L246-E251 HydrophobicContact CD2-CB 3.79Å; L246-E251 HydrophobicContact CD2-CG 4.27Å; L246-E251 HydrophobicContact CG-CB 4.32Å; P247-E251 PolarHBondContact O-N 3.45Å; K248-E251 HydrophobicContact CD-CB 4.37Å; K248-E251 VanDerWaalsContact CD-OE1 3.31Å; K248-E251 WeakPolarHBondContact CD-OE1 3.32Å; K248-E251 IonicContact NZ-OE1 2.81Å; K248-E251 PolarHBondContact NZ-OE1 3.01Å; K248-E251 IonicContact NZ-OE2 3.76Å; K248-E251 PolarHBondContact NZ-OE2 2.76Å; K248-E251 PolarHBondContact O-N 2.75Å; E251-T255 WeakPolarHBondContact O-CB 3.32Å; E251-T255 VanDerWaalsContact O-CG2 3.32Å; E251-T255 WeakPolarHBondContact O-CG2 2.95Å; E251-T255 PolarHBondContact O-N 3.11Å; E251-T255 PolarHBondContact O-OG1 3.02Å
252	S	98.3	Very high	97	Very high	61 Å²	61	60.1 Å²	60.1	43%	0.427	31%	0.309	S	S	.	.	H	α-helix	trans	-65.8	-42.2	177.6	-175.8	0	0	0	0	112.3	K248 I250 T255 R256	K248-S252 VanDerWaalsContact O-CB 3.27Å; K248-S252 WeakPolarHBondContact O-CB 3.44Å; K248-S252 PolarHBondContact O-N 3.26Å; I250-S252 VanDerWaalsContact C-N 3.32Å; I250-S252 PolarHBondContact O-N 2.82Å; S252-T255 PolarHBondContact O-OG1 3.07Å; S252-R256 WeakPolarHBondContact O-CB 3.25Å; S252-R256 WeakPolarHBondContact O-CG 3.43Å; S252-R256 PolarHBondContact O-N 2.92Å
253	L	98.6	Very high	97	Very high	4 Å²	4	58.5 Å²	58.5	2%	0.021	31%	0.307	C	S	.	.	H	α-helix	trans	-63.1	-50.2	176.3	-174.6	62.9	0	0	0	111.4	W206 P249 I250 T255 R256 C257 P266 I271 I274 M275	W206-L253 HydrophobicContact CH2-CD2 3.74Å; W206-L253 HydrophobicContact CH2-CG 4.26Å; W206-L253 HydrophobicContact CZ3-CD2 4.1Å; W206-L253 HydrophobicContact CZ3-CG 4.09Å; P249-L253 WeakPolarHBondContact O-CB 3.45Å; P249-L253 PolarHBondContact O-N 2.79Å; P249-L253 VanDerWaalsContact O-N 3.1Å; I250-L253 PolarHBondContact O-N 2.89Å; L253-T255 PolarHBondContact O-N 3.03Å; L253-R256 PolarHBondContact O-N 3.1Å; L253-C257 PolarHBondContact O-N 3.06Å; L253-C257 PolarHBondContact O-SG 2.91Å; L253-P266 HydrophobicContact CD1-CG 4.39Å; L253-I271 HydrophobicContact CD1-CG1 4.22Å; L253-I274 HydrophobicContact CD1-CD1 3.87Å; L253-I274 HydrophobicContact CD2-CB 4.45Å; L253-I274 HydrophobicContact CD2-CG2 3.9Å; L253-M275 HydrophobicContact CD2-CG 4.35Å; L253-M275 HydrophobicContact CD2-SD 3.99Å
254	M	98.7	Very high	97.1	Very high	0 Å²	0	62.6 Å²	62.6	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-57.3	-49.2	179	-173.4	177.4	69.8	0	0	111.8	L210 W211 I243 L246 I250 C257 W258	L210-M254 HydrophobicContact CD2-CB 3.96Å; L210-M254 HydrophobicContact CD2-CG 4.35Å; W211-M254 HydrophobicContact CB-CG 4.48Å; W211-M254 HydrophobicContact CB-SD 3.69Å; W211-M254 HydrophobicContact CG-SD 4.23Å; I243-M254 HydrophobicContact CD1-CE 4.41Å; I243-M254 HydrophobicContact CD1-SD 4.28Å; L246-M254 HydrophobicContact CD2-CE 3.7Å; L246-M254 HydrophobicContact CD2-SD 4.39Å; I250-M254 VanDerWaalsContact O-CB 3.26Å; I250-M254 WeakPolarHBondContact O-CB 3.44Å; I250-M254 PolarHBondContact O-N 3.41Å; M254-C257 WeakPolarHBondContact O-CB 3.31Å; M254-C257 PolarHBondContact O-N 3.23Å; M254-W258 HydrophobicContact CE-CH2 3.84Å; M254-W258 HydrophobicContact CE-CZ2 4.43Å; M254-W258 HydrophobicContact CE-CZ3 4.4Å; M254-W258 HydrophobicContact CG-CE3 4.18Å; M254-W258 HydrophobicContact CG-CH2 4.09Å; M254-W258 HydrophobicContact CG-CZ3 3.78Å; M254-W258 PolarHBondContact O-N 3.09Å; M254-W258 HydrophobicContact SD-CH2 4.19Å; M254-W258 HydrophobicContact SD-CZ3 4.15Å
255	T	98.4	Very high	97.3	Very high	43 Å²	43	53.6 Å²	53.6	26%	0.264	29%	0.286	S	S	.	.	H	α-helix	trans	-70.2	-34.7	-178.2	51.4	0	0	0	0	113.4	L242 E251 S252 L253 C257 W258	L242-T255 HydrophobicContact CD2-CG2 4.01Å; E251-T255 WeakPolarHBondContact O-CB 3.32Å; E251-T255 VanDerWaalsContact O-CG2 3.32Å; E251-T255 WeakPolarHBondContact O-CG2 2.95Å; E251-T255 PolarHBondContact O-N 3.11Å; E251-T255 PolarHBondContact O-OG1 3.02Å; S252-T255 PolarHBondContact O-OG1 3.07Å; L253-T255 PolarHBondContact O-N 3.03Å; T255-C257 VanDerWaalsContact C-N 3.34Å; T255-W258 HydrophobicContact CG2-CZ2 3.89Å
256	R	98.6	Very high	97.5	Very high	80 Å²	80	45.6 Å²	45.6	30%	0.302	24%	0.243	S	C	.	.	H	α-helix	trans	-63	-39	170.5	-75.4	173.7	64.1	-149.2	-2.4	111.9	S252 L253 W258 S259 E270	S252-R256 WeakPolarHBondContact O-CB 3.25Å; S252-R256 WeakPolarHBondContact O-CG 3.43Å; S252-R256 PolarHBondContact O-N 2.92Å; L253-R256 PolarHBondContact O-N 3.1Å; R256-W258 VanDerWaalsContact C-N 3.33Å; R256-W258 PolarHBondContact O-N 3.23Å; R256-S259 WeakPolarHBondContact O-CB 3.48Å; R256-S259 PolarHBondContact O-N 2.88Å; R256-S259 PolarHBondContact O-OG 3.06Å; R256-E270 IonicContact CZ-OE1 2.93Å; R256-E270 IonicContact NH1-OE1 2.75Å; R256-E270 PolarHBondContact NH1-OE1 2.98Å; R256-E270 VanDerWaalsContact NH2-CD 3.33Å; R256-E270 IonicContact NH2-OE1 3.96Å; R256-E270 PolarHBondContact NH2-OE1 2.86Å; R256-E270 IonicContact NH2-OE2 2.72Å; R256-E270 PolarHBondContact NH2-OE2 3.13Å
257	C	98.8	Very high	97.6	Very high	0 Å²	0	47 Å²	47	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-63.1	-36.8	-178.6	-69.2	0	0	0	0	112.5	V203 F204 W206 L253 M254 T255 R265	V203-C257 HydrophobicContact CG1-CB 4.08Å; F204-C257 WeakPolarHBondContact CA-O 3.46Å; W206-C257 HydrophobicContact CE3-CB 4.49Å; L253-C257 PolarHBondContact O-N 3.06Å; L253-C257 PolarHBondContact O-SG 2.91Å; M254-C257 WeakPolarHBondContact O-CB 3.31Å; M254-C257 PolarHBondContact O-N 3.23Å; T255-C257 VanDerWaalsContact C-N 3.34Å; C257-R265 WeakPolarHBondContact O-CD 3.26Å; C257-R265 WeakPolarHBondContact O-CG 3.29Å
258	W	98.2	Very high	97.7	Very high	18 Å²	18	45.3 Å²	45.3	7%	0.068	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.3	16.2	-179.7	67.5	38.4	0	0	0	116	F204 I208 W211 R239 P240 M254 T255 R256	F204-W258 HydrophobicContact CD2-CB 4.01Å; F204-W258 HydrophobicContact CE2-CB 3.86Å; F204-W258 HydrophobicContact CZ-CB 4.45Å; I208-W258 HydrophobicContact CD1-CE3 3.99Å; W211-W258 HydrophobicContact CB-CZ3 4.01Å; W211-W258 HydrophobicContact CG-CZ3 4.22Å; R239-W258 HydrophobicContact CB-CD2 4.31Å; R239-W258 HydrophobicContact CB-CZ2 4.11Å; R239-W258 HydrophobicContact CG-CD2 4.32Å; R239-W258 HydrophobicContact CG-CG 4.13Å; R239-W258 PolarHBondContact NE-O 3.15Å; R239-W258 PolarHBondContact NH2-O 2.83Å; P240-W258 HydrophobicContact CB-CH2 4.28Å; P240-W258 HydrophobicContact CB-CZ3 4.17Å; P240-W258 HydrophobicContact CG-CE3 4.48Å; P240-W258 HydrophobicContact CG-CH2 4.46Å; P240-W258 HydrophobicContact CG-CZ3 3.95Å; M254-W258 HydrophobicContact CE-CH2 3.84Å; M254-W258 HydrophobicContact CE-CZ2 4.43Å; M254-W258 HydrophobicContact CE-CZ3 4.4Å; M254-W258 HydrophobicContact CG-CE3 4.18Å; M254-W258 HydrophobicContact CG-CH2 4.09Å; M254-W258 HydrophobicContact CG-CZ3 3.78Å; M254-W258 PolarHBondContact O-N 3.09Å; M254-W258 HydrophobicContact SD-CH2 4.19Å; M254-W258 HydrophobicContact SD-CZ3 4.15Å; T255-W258 HydrophobicContact CG2-CZ2 3.89Å; R256-W258 VanDerWaalsContact C-N 3.33Å; R256-W258 PolarHBondContact O-N 3.23Å
259	S	98.1	Very high	97.7	Very high	27 Å²	27	44.5 Å²	44.5	19%	0.189	24%	0.241	C	C	.	.			trans	-50.1	139.8	175	-58.8	0	0	0	0	112	R256 D261 R265	R256-S259 WeakPolarHBondContact O-CB 3.48Å; R256-S259 PolarHBondContact O-N 2.88Å; R256-S259 PolarHBondContact O-OG 3.06Å; S259-D261 WeakPolarHBondContact CB-O 3.39Å; S259-R265 PolarHBondContact O-NE 3.27Å; S259-R265 PolarHBondContact O-NH2 3.44Å
260	K	92.9	Very high	97.8	Very high	100 Å²	100	43.4 Å²	43.4	44%	0.435	23%	0.229	S	C	.	.	S	Bend	trans	-61.5	-52.1	175.7	-175	165.5	-176.9	167.2	0	110.4	P189 H235 P262 R265	P189-K260 HydrophobicContact CG-CG 4.47Å; H235-K260 PolarHBondContact O-NZ 2.91Å; K260-P262 WeakPolarHBondContact O-CD 3.31Å; K260-R265 PolarHBondContact O-NH2 3.43Å; K260-R265 VanDerWaalsContact O-NH2 3.09Å
261	D	94.8	Very high	97.8	Very high	75 Å²	75	43.1 Å²	43.1	40%	0.401	23%	0.228	S	C	.	.	S	Bend	trans	-65.4	118.5	169.8	173.7	7.7	0	0	0	111	S259 S263 Q264	S259-D261 WeakPolarHBondContact CB-O 3.39Å; D261-S263 PolarHBondContact O-N 3.45Å; D261-S263 VanDerWaalsContact OD1-CB 3.25Å; D261-S263 WeakPolarHBondContact OD1-CB 3.46Å; D261-S263 PolarHBondContact OD1-N 2.61Å; D261-S263 PolarHBondContact OD1-OG 3.41Å; D261-S263 PolarHBondContact OD2-OG 3.26Å; D261-Q264 HydrophobicContact CB-CG 4.02Å; D261-Q264 PolarHBondContact O-N 3.26Å; D261-Q264 WeakPolarHBondContact OD2-CG 3.48Å; D261-Q264 PolarHBondContact OD2-NE2 2.85Å
262	P	96.1	Very high	97.9	Very high	37 Å²	37	42.7 Å²	42.7	24%	0.24	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-20.9	177.3	-19	32.2	0	0	0	114.2	E190 K200 K260 R265	E190-P262 HydrophobicContact CG-CG 4.08Å; K200-P262 HydrophobicContact CB-CB 3.74Å; K200-P262 HydrophobicContact CG-CB 4.27Å; K200-P262 WeakPolarHBondContact CG-O 3.26Å; K200-P262 PolarHBondContact NZ-O 3.38Å; K260-P262 WeakPolarHBondContact O-CD 3.31Å; P262-R265 WeakPolarHBondContact O-CB 3.33Å; P262-R265 PolarHBondContact O-N 3.41Å
263	S	96.1	Very high	97.9	Very high	75 Å²	75	45 Å²	45	52%	0.524	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-35.5	179.9	83.2	0	0	0	0	112.3	K200 D261 R265	K200-S263 PolarHBondContact NZ-O 3.09Å; D261-S263 PolarHBondContact O-N 3.45Å; D261-S263 VanDerWaalsContact OD1-CB 3.25Å; D261-S263 WeakPolarHBondContact OD1-CB 3.46Å; D261-S263 PolarHBondContact OD1-N 2.61Å; D261-S263 PolarHBondContact OD1-OG 3.41Å; D261-S263 PolarHBondContact OD2-OG 3.26Å; S263-R265 VanDerWaalsContact C-N 3.27Å; S263-R265 PolarHBondContact O-N 3.21Å
264	Q	97.6	Very high	97.9	Very high	117 Å²	117	47 Å²	47	55%	0.547	24%	0.24	S	C	.	.	S	Bend	trans	-71.8	-18.7	178.1	-51.6	-50.7	-46.4	0	0	113.8	D261	D261-Q264 HydrophobicContact CB-CG 4.02Å; D261-Q264 PolarHBondContact O-N 3.26Å; D261-Q264 WeakPolarHBondContact OD2-CG 3.48Å; D261-Q264 PolarHBondContact OD2-NE2 2.85Å
265	R	98.6	Very high	97.9	Very high	4 Å²	4	47 Å²	47	2%	0.015	24%	0.24	C	C	.	.	S	Bend	trans	-67.9	138.5	177.4	-55.1	-180	-166.7	151.8	12.5	109.4	E190 K200 V203 C257 S259 K260 P262 S263	E190-R265 IonicContact OE1-CZ 2.73Å; E190-R265 IonicContact OE1-NH1 3.76Å; E190-R265 PolarHBondContact OE1-NH1 2.96Å; E190-R265 IonicContact OE1-NH2 3.99Å; E190-R265 IonicContact OE2-CZ 2.84Å; E190-R265 IonicContact OE2-NH1 3.97Å; E190-R265 PolarHBondContact OE2-NH1 3.47Å; E190-R265 IonicContact OE2-NH2 2.62Å; E190-R265 PolarHBondContact OE2-NH2 3.3Å; K200-R265 HydrophobicContact CD-CB 4.36Å; K200-R265 PolarHBondContact NZ-O 3.23Å; K200-R265 WeakPolarHBondContact O-CD 3.4Å; K200-R265 PolarHBondContact O-NH1 2.86Å; V203-R265 HydrophobicContact CB-CB 4.45Å; V203-R265 HydrophobicContact CG1-CB 3.83Å; C257-R265 WeakPolarHBondContact O-CD 3.26Å; C257-R265 WeakPolarHBondContact O-CG 3.29Å; S259-R265 PolarHBondContact O-NE 3.27Å; S259-R265 PolarHBondContact O-NH2 3.44Å; K260-R265 PolarHBondContact O-NH2 3.43Å; K260-R265 VanDerWaalsContact O-NH2 3.09Å; P262-R265 WeakPolarHBondContact O-CB 3.33Å; P262-R265 PolarHBondContact O-N 3.41Å; S263-R265 VanDerWaalsContact C-N 3.27Å; S263-R265 PolarHBondContact O-N 3.21Å
266	P	98.7	Very high	97.9	Very high	2 Å²	2	47.6 Å²	47.6	1%	0.013	24%	0.244	C	C	.	.	P	Polyproline II helix	trans	-59.2	164.9	174.2	27.1	-36.1	0	0	0	111.7	V203 L253 E270 I271	V203-P266 HydrophobicContact CG1-CG 4.17Å; L253-P266 HydrophobicContact CD1-CG 4.39Å; P266-E270 WeakPolarHBondContact CA-OE2 3.34Å; P266-E270 HydrophobicContact CB-CB 4.13Å; P266-E270 HydrophobicContact CB-CG 4.37Å; P266-E270 VanDerWaalsContact CB-OE2 3.22Å; P266-E270 WeakPolarHBondContact CB-OE2 3.23Å; P266-I271 HydrophobicContact CB-CG1 4.09Å; P266-I271 HydrophobicContact CG-CD1 3.93Å; P266-I271 HydrophobicContact CG-CG1 3.74Å
267	S	98.7	Very high	97.8	Very high	46 Å²	46	49.5 Å²	49.5	32%	0.322	26%	0.256	S	S	.	.	P	Polyproline II helix	trans	-79.8	158.3	163.6	72.1	0	0	0	0	110.3	E269 E270 I271	S267-E269 PolarHBondContact O-N 2.85Å; S267-E270 WeakPolarHBondContact O-CB 3.41Å; S267-E270 PolarHBondContact O-N 3.34Å; S267-E270 PolarHBondContact OG-N 3.41Å; S267-E270 VanDerWaalsContact OG-N 3.13Å; S267-I271 PolarHBondContact O-N 3.49Å
268	M	98.7	Very high	97.8	Very high	3 Å²	3	50.5 Å²	50.5	2%	0.015	26%	0.261	C	S	.	.	H	α-helix	trans	-61	-30.6	172.7	-80.1	-66.8	174.6	0	0	112.7	V132 A133 V203 W206 E270 I271 V272	V132-M268 HydrophobicContact CB-CE 4.25Å; V132-M268 HydrophobicContact CB-CG 4.1Å; V132-M268 HydrophobicContact CB-SD 4.14Å; V132-M268 HydrophobicContact CG1-CE 3.95Å; V132-M268 HydrophobicContact CG1-CG 3.73Å; V132-M268 HydrophobicContact CG1-SD 4.2Å; A133-M268 HydrophobicContact CB-CB 3.9Å; V203-M268 HydrophobicContact CB-CE 4.35Å; V203-M268 HydrophobicContact CG2-CE 3.95Å; V203-M268 HydrophobicContact CG2-CG 4.15Å; W206-M268 HydrophobicContact CB-CE 3.55Å; W206-M268 HydrophobicContact CG-CE 3.87Å; M268-E270 VanDerWaalsContact C-N 3.34Å; M268-E270 PolarHBondContact O-N 2.99Å; M268-I271 HydrophobicContact CE-CD1 4.09Å; M268-I271 PolarHBondContact O-N 3.05Å; M268-I271 HydrophobicContact SD-CB 4.44Å; M268-I271 HydrophobicContact SD-CD1 3.67Å; M268-V272 WeakPolarHBondContact O-CB 3.4Å; M268-V272 VanDerWaalsContact O-CG2 3.29Å; M268-V272 WeakPolarHBondContact O-CG2 3.47Å; M268-V272 PolarHBondContact O-N 3.29Å
269	E	98.6	Very high	97.7	Very high	117 Å²	117	51.1 Å²	51.1	55%	0.547	27%	0.265	S	S	.	.	H	α-helix	trans	-65.6	-35.2	173.1	-158.3	-158.4	155.8	0	0	112.5	S267 K273	S267-E269 PolarHBondContact O-N 2.85Å; E269-K273 VanDerWaalsContact CD-NZ 3.31Å; E269-K273 WeakPolarHBondContact O-CD 3.41Å; E269-K273 VanDerWaalsContact O-CG 3.28Å; E269-K273 WeakPolarHBondContact O-CG 3.35Å; E269-K273 PolarHBondContact O-N 2.99Å; E269-K273 VanDerWaalsContact OE1-CE 3.26Å; E269-K273 WeakPolarHBondContact OE1-CE 3.49Å; E269-K273 IonicContact OE1-NZ 3.08Å; E269-K273 PolarHBondContact OE1-NZ 3.27Å
270	E	98.8	Very high	97.7	Very high	61 Å²	61	57.5 Å²	57.5	29%	0.285	29%	0.289	S	S	.	.	H	α-helix	trans	-69.2	-44.7	172.6	-165.9	-161.4	146.9	0	0	110.9	R256 P266 S267 M268 V272 K273 I274	R256-E270 IonicContact CZ-OE1 2.93Å; R256-E270 IonicContact NH1-OE1 2.75Å; R256-E270 PolarHBondContact NH1-OE1 2.98Å; R256-E270 VanDerWaalsContact NH2-CD 3.33Å; R256-E270 IonicContact NH2-OE1 3.96Å; R256-E270 PolarHBondContact NH2-OE1 2.86Å; R256-E270 IonicContact NH2-OE2 2.72Å; R256-E270 PolarHBondContact NH2-OE2 3.13Å; P266-E270 WeakPolarHBondContact CA-OE2 3.34Å; P266-E270 HydrophobicContact CB-CB 4.13Å; P266-E270 HydrophobicContact CB-CG 4.37Å; P266-E270 VanDerWaalsContact CB-OE2 3.22Å; P266-E270 WeakPolarHBondContact CB-OE2 3.23Å; S267-E270 WeakPolarHBondContact O-CB 3.41Å; S267-E270 PolarHBondContact O-N 3.34Å; S267-E270 PolarHBondContact OG-N 3.41Å; S267-E270 VanDerWaalsContact OG-N 3.13Å; M268-E270 VanDerWaalsContact C-N 3.34Å; M268-E270 PolarHBondContact O-N 2.99Å; E270-V272 PolarHBondContact O-N 3.34Å; E270-K273 PolarHBondContact O-N 2.91Å; E270-I274 HydrophobicContact CG-CD1 3.96Å; E270-I274 WeakPolarHBondContact O-CG1 3.28Å; E270-I274 PolarHBondContact O-N 2.94Å
271	I	98.9	Very high	97.9	Very high	0 Å²	0	59 Å²	59	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-57.9	-49	176	-66.7	166.6	0	0	0	110.5	V203 W206 L253 P266 S267 M268 K273 I274 M275	V203-I271 HydrophobicContact CG1-CD1 3.92Å; V203-I271 HydrophobicContact CG2-CD1 4.49Å; W206-I271 HydrophobicContact CD2-CD1 4.35Å; W206-I271 HydrophobicContact CD2-CG2 4.14Å; W206-I271 HydrophobicContact CE3-CD1 4.01Å; W206-I271 HydrophobicContact CE3-CG2 4.16Å; W206-I271 HydrophobicContact CH2-CG2 3.47Å; W206-I271 VanDerWaalsContact CH2-CG2 3.47Å; W206-I271 HydrophobicContact CZ2-CG2 3.39Å; W206-I271 HydrophobicContact CZ3-CD1 4.35Å; W206-I271 HydrophobicContact CZ3-CG1 4.5Å; W206-I271 HydrophobicContact CZ3-CG2 3.85Å; L253-I271 HydrophobicContact CD1-CG1 4.22Å; P266-I271 HydrophobicContact CB-CG1 4.09Å; P266-I271 HydrophobicContact CG-CD1 3.93Å; P266-I271 HydrophobicContact CG-CG1 3.74Å; S267-I271 PolarHBondContact O-N 3.49Å; M268-I271 HydrophobicContact CE-CD1 4.09Å; M268-I271 PolarHBondContact O-N 3.05Å; M268-I271 HydrophobicContact SD-CB 4.44Å; M268-I271 HydrophobicContact SD-CD1 3.67Å; I271-K273 PolarHBondContact O-N 3.38Å; I271-I274 PolarHBondContact O-N 3.22Å; I271-M275 HydrophobicContact CG2-CG 4.01Å; I271-M275 WeakPolarHBondContact O-CB 3.46Å; I271-M275 VanDerWaalsContact O-CG 3.23Å; I271-M275 WeakPolarHBondContact O-CG 3.36Å; I271-M275 PolarHBondContact O-N 2.77Å
272	V	98.9	Very high	98	Very high	27 Å²	27	56 Å²	56	16%	0.164	28%	0.276	C	S	.	.	H	α-helix	trans	-53.9	-51.5	176.7	166.7	0	0	0	0	110.2	Y126 S129 Q130 A133 M268 E270 I274 M275 T276	Y126-V272 HydrophobicContact CE2-CG1 4.17Å; S129-V272 VanDerWaalsContact C-CG2 3.44Å; S129-V272 WeakPolarHBondContact O-CG2 3.23Å; S129-V272 WeakPolarHBondContact OG-CG2 3.46Å; Q130-V272 HydrophobicContact CG-CG1 4.27Å; Q130-V272 HydrophobicContact CG-CG2 4.09Å; A133-V272 HydrophobicContact CB-CG2 3.91Å; M268-V272 WeakPolarHBondContact O-CB 3.4Å; M268-V272 VanDerWaalsContact O-CG2 3.29Å; M268-V272 WeakPolarHBondContact O-CG2 3.47Å; M268-V272 PolarHBondContact O-N 3.29Å; E270-V272 PolarHBondContact O-N 3.34Å; V272-I274 PolarHBondContact O-N 2.98Å; V272-M275 PolarHBondContact O-N 3.48Å; V272-T276 PolarHBondContact O-N 3.37Å; V272-T276 PolarHBondContact O-OG1 3.46Å
273	K	98.6	Very high	98	Very high	109 Å²	109	59.1 Å²	59.1	47%	0.474	30%	0.297	S	S	.	.	H	α-helix	trans	-59.6	-44.3	179.8	-71	165.2	-172.4	170	0	112.9	E269 E270 I271 H277	E269-K273 VanDerWaalsContact CD-NZ 3.31Å; E269-K273 WeakPolarHBondContact O-CD 3.41Å; E269-K273 VanDerWaalsContact O-CG 3.28Å; E269-K273 WeakPolarHBondContact O-CG 3.35Å; E269-K273 PolarHBondContact O-N 2.99Å; E269-K273 VanDerWaalsContact OE1-CE 3.26Å; E269-K273 WeakPolarHBondContact OE1-CE 3.49Å; E269-K273 IonicContact OE1-NZ 3.08Å; E269-K273 PolarHBondContact OE1-NZ 3.27Å; E270-K273 PolarHBondContact O-N 2.91Å; I271-K273 PolarHBondContact O-N 3.38Å; K273-H277 PolarHBondContact O-CD2 3.4Å; K273-H277 PolarHBondContact O-N 3.46Å
274	I	98.7	Very high	97.9	Very high	46 Å²	46	56.9 Å²	56.9	24%	0.236	29%	0.286	C	S	.	.	H	α-helix	trans	-65.2	-45	178.3	-65.9	168.5	0	0	0	110.2	L253 E270 I271 V272 H277 L278	L253-I274 HydrophobicContact CD1-CD1 3.87Å; L253-I274 HydrophobicContact CD2-CB 4.45Å; L253-I274 HydrophobicContact CD2-CG2 3.9Å; E270-I274 HydrophobicContact CG-CD1 3.96Å; E270-I274 WeakPolarHBondContact O-CG1 3.28Å; E270-I274 PolarHBondContact O-N 2.94Å; I271-I274 PolarHBondContact O-N 3.22Å; V272-I274 PolarHBondContact O-N 2.98Å; I274-H277 PolarHBondContact O-N 3.17Å; I274-H277 VanDerWaalsContact O-N 3.15Å; I274-L278 HydrophobicContact CG2-CD1 3.85Å; I274-L278 HydrophobicContact CG2-CG 4.31Å; I274-L278 WeakPolarHBondContact O-CG 3.45Å; I274-L278 PolarHBondContact O-N 3.47Å
275	M	98.6	Very high	97.8	Very high	1 Å²	1	52.7 Å²	52.7	1%	0.005	27%	0.269	C	S	.	.	H	α-helix	trans	-65.3	-40.8	178.4	-68.1	-65	-71.7	0	0	112.1	M122 C125 Y126 W206 L253 I271 V272 H277 L278 M279	M122-M275 HydrophobicContact CB-CE 4.37Å; M122-M275 HydrophobicContact CE-CE 3.61Å; M122-M275 HydrophobicContact CE-SD 3.73Å; M122-M275 WeakPolarHBondContact O-CE 3.49Å; M122-M275 HydrophobicContact SD-CE 4.19Å; C125-M275 HydrophobicContact CB-CE 3.91Å; Y126-M275 HydrophobicContact CD2-CB 3.46Å; Y126-M275 VanDerWaalsContact CD2-CB 3.46Å; Y126-M275 HydrophobicContact CE2-CB 4.22Å; Y126-M275 HydrophobicContact CG-CB 4.09Å; W206-M275 HydrophobicContact CH2-CG 4.19Å; W206-M275 HydrophobicContact CH2-SD 3.98Å; W206-M275 HydrophobicContact CZ2-CE 4.24Å; W206-M275 HydrophobicContact CZ2-CG 4.03Å; W206-M275 HydrophobicContact CZ2-SD 4.08Å; L253-M275 HydrophobicContact CD2-CG 4.35Å; L253-M275 HydrophobicContact CD2-SD 3.99Å; I271-M275 HydrophobicContact CG2-CG 4.01Å; I271-M275 WeakPolarHBondContact O-CB 3.46Å; I271-M275 VanDerWaalsContact O-CG 3.23Å; I271-M275 WeakPolarHBondContact O-CG 3.36Å; I271-M275 PolarHBondContact O-N 2.77Å; V272-M275 PolarHBondContact O-N 3.48Å; M275-H277 PolarHBondContact O-N 2.98Å; M275-L278 PolarHBondContact O-N 3.23Å; M275-L278 VanDerWaalsContact O-N 3.09Å; M275-L278 HydrophobicContact SD-CD1 4.05Å; M275-M279 WeakPolarHBondContact O-CG 3.31Å; M275-M279 PolarHBondContact O-N 3.18Å
276	T	98.3	Very high	97.7	Very high	55 Å²	55	58.2 Å²	58.2	34%	0.337	30%	0.299	S	S	.	.	H	α-helix	trans	-56	-35.1	171.8	-53.3	0	0	0	0	112.1	Y126 V272	Y126-T276 VanDerWaalsContact CE2-OG1 3.23Å; Y126-T276 WeakPolarHBondContact CE2-OG1 3.37Å; Y126-T276 PolarHBondContact OH-OG1 3.32Å; V272-T276 PolarHBondContact O-N 3.37Å; V272-T276 PolarHBondContact O-OG1 3.46Å
277	H	97.6	Very high	97.6	Very high	119 Å²	119	63.4 Å²	63.4	55%	0.551	32%	0.323	S	S	*	.	H	α-helix	trans	-78.1	-36.6	175.2	-66.8	-24.8	0	0	0	113	K273 I274 M275	K273-H277 PolarHBondContact O-CD2 3.4Å; K273-H277 PolarHBondContact O-N 3.46Å; I274-H277 PolarHBondContact O-N 3.17Å; I274-H277 VanDerWaalsContact O-N 3.15Å; M275-H277 PolarHBondContact O-N 2.98Å
278	L	97.6	Very high	97.5	Very high	22 Å²	22	64.6 Å²	64.6	12%	0.115	33%	0.33	C	S	.	.	H	α-helix	trans	-68.3	-39	177.3	-71.4	170.9	0	0	0	112.7	M122 P249 I250 I274 M275 K280 Y281 F282	M122-L278 HydrophobicContact CE-CB 4.07Å; M122-L278 HydrophobicContact CE-CD1 3.87Å; P249-L278 HydrophobicContact CB-CD2 4.24Å; I250-L278 HydrophobicContact CG1-CD1 4.17Å; I250-L278 HydrophobicContact CG1-CD2 4.43Å; I274-L278 HydrophobicContact CG2-CD1 3.85Å; I274-L278 HydrophobicContact CG2-CG 4.31Å; I274-L278 WeakPolarHBondContact O-CG 3.45Å; I274-L278 PolarHBondContact O-N 3.47Å; M275-L278 PolarHBondContact O-N 3.23Å; M275-L278 VanDerWaalsContact O-N 3.09Å; M275-L278 HydrophobicContact SD-CD1 4.05Å; L278-K280 PolarHBondContact O-N 2.94Å; L278-Y281 WeakPolarHBondContact O-CD2 3.35Å; L278-Y281 PolarHBondContact O-N 3.4Å; L278-F282 WeakPolarHBondContact O-CD2 3.46Å
279	M	97.8	Very high	97.3	Very high	30 Å²	30	65.3 Å²	65.3	15%	0.148	33%	0.333	C	S	.	.	G	3₁₀ helix	trans	-56.8	-21.4	-179.3	-73.6	-53.5	-60.1	0	0	113.8	M122 Y126 M275 Y281 F282	M122-M279 HydrophobicContact CB-SD 3.67Å; Y126-M279 HydrophobicContact CD1-CG 4.02Å; Y126-M279 HydrophobicContact CG-CG 4.32Å; M275-M279 WeakPolarHBondContact O-CG 3.31Å; M275-M279 PolarHBondContact O-N 3.18Å; M279-Y281 PolarHBondContact O-N 3.47Å; M279-Y281 VanDerWaalsContact O-N 3.15Å; M279-F282 HydrophobicContact CE-CB 4.26Å; M279-F282 CarbonylContact O-C 3.49Å; M279-F282 PolarHBondContact O-N 3.07Å; M279-F282 HydrophobicContact SD-CB 4.42Å
280	K	97.1	Very high	96.9	Very high	162 Å²	162	66 Å²	66	70%	0.704	34%	0.337	S	S	*	.	G	3₁₀ helix	trans	-59.5	-21.6	172.2	-62.7	-174.5	176	-173.5	0	114	L278	L278-K280 PolarHBondContact O-N 2.94Å
281	Y	97.1	Very high	96.3	Very high	130 Å²	130	69 Å²	69	51%	0.51	35%	0.346	S	S	.	.	G	3₁₀ helix	trans	-101.1	1.1	177.7	-54.8	-81.4	0	0	0	112.9	L278 M279 P283	L278-Y281 WeakPolarHBondContact O-CD2 3.35Å; L278-Y281 PolarHBondContact O-N 3.4Å; M279-Y281 PolarHBondContact O-N 3.47Å; M279-Y281 VanDerWaalsContact O-N 3.15Å; Y281-P283 VanDerWaalsContact C-CD 3.45Å
282	F	96.8	Very high	95.7	Very high	12 Å²	12	72.5 Å²	72.5	5%	0.053	37%	0.369	C	S	.	.			trans	-128.1	64.3	-176.4	-66.2	-73.9	0	0	0	111.9	A118 S119 M122 I250 L278 M279	A118-F282 HydrophobicContact CB-CD1 4.11Å; A118-F282 HydrophobicContact CB-CE1 3.95Å; S119-F282 PolarHBondContact OG-O 3.1Å; M122-F282 HydrophobicContact CB-CD2 4.28Å; M122-F282 HydrophobicContact CB-CG 4.33Å; M122-F282 HydrophobicContact CE-CD2 4.36Å; M122-F282 HydrophobicContact CE-CE2 3.98Å; M122-F282 HydrophobicContact CG-CD1 4.22Å; M122-F282 HydrophobicContact CG-CD2 3.91Å; M122-F282 HydrophobicContact CG-CE1 4.22Å; M122-F282 HydrophobicContact CG-CE2 3.92Å; M122-F282 HydrophobicContact CG-CG 4.08Å; M122-F282 HydrophobicContact CG-CZ 4.08Å; I250-F282 HydrophobicContact CD1-CE2 4.08Å; I250-F282 HydrophobicContact CD1-CZ 3.86Å; L278-F282 WeakPolarHBondContact O-CD2 3.46Å; M279-F282 HydrophobicContact CE-CB 4.26Å; M279-F282 CarbonylContact O-C 3.49Å; M279-F282 PolarHBondContact O-N 3.07Å; M279-F282 HydrophobicContact SD-CB 4.42Å
283	P	96.3	Very high	94	Very high	104 Å²	104	81.8 Å²	81.8	68%	0.675	40%	0.403	S	S	*	.			trans	-70.5	165	175.2	33.1	-37.2	0	0	0	112	S119 Y281	S119-P283 VanDerWaalsContact CB-O 3.31Å; S119-P283 WeakPolarHBondContact CB-O 3.37Å; S119-P283 PolarHBondContact OG-O 3.18Å; Y281-P283 VanDerWaalsContact C-CD 3.45Å
284	G	94.8	Very high	91.9	Very high	28 Å²	28	83.1 Å²	83.1	29%	0.289	41%	0.411	S	S	.	.			trans	69.8	47.6	-177.7	0	0	0	0	0	111.6	S119 D286	S119-G284 WeakPolarHBondContact CB-O 3.35Å; G284-D286 WeakPolarHBondContact CA-OD1 3.47Å
285	S	94.3	Very high	89.1	Confident	28 Å²	28	91.2 Å²	91.2	20%	0.196	44%	0.44	C	S	.	.			trans	-97.3	-4.8	173	57.2	0	0	0	0	113.4	S119	S119-S285 WeakPolarHBondContact O-CB 3.37Å
286	D	96.3	Very high	86.4	Confident	120 Å²	120	95.9 Å²	95.9	64%	0.642	47%	0.473	S	S	*	.	S	Bend	trans	-105.8	-1.2	-174.2	46.7	-45	0	0	0	112.2	G284	G284-D286 WeakPolarHBondContact CA-OD1 3.47Å
287	E	96.7	Very high	83.6	Confident	112 Å²	112	100.7 Å²	100.7	52%	0.523	50%	0.496	S	S	.	.	S	Bend	trans	-75.8	127.7	171	-68.3	-67.8	166.3	0	0	110.6	H120 T160	H120-E287 PolarHBondContact CE1-O 3.19Å; H120-E287 PolarHBondContact NE2-O 2.72Å; T160-E287 WeakPolarHBondContact CG2-O 3.45Å
288	P	97.2	Very high	81.1	Confident	71 Å²	71	103.7 Å²	103.7	46%	0.461	51%	0.51	S	S	.	.	P	Polyproline II helix	trans	-58.8	149.7	176.2	-26.4	35.8	0	0	0	113.8	Q290	P288-Q290 PolarHBondContact O-N 3.44Å
289	L	95.4	Very high	78.3	Confident	17 Å²	17	106.7 Å²	106.7	9%	0.089	54%	0.539	C	S	.	.	P	Polyproline II helix	trans	-62.9	128	175.6	-71.6	-178.2	0	0	0	111.5	V106 P114 H120 W124 G158 Y291	V106-L289 HydrophobicContact CG1-CD1 3.8Å; V106-L289 HydrophobicContact CG2-CD1 4.09Å; P114-L289 HydrophobicContact CB-CB 4.27Å; P114-L289 HydrophobicContact CG-CD1 4.37Å; H120-L289 WeakPolarHBondContact ND1-CD2 3.34Å; W124-L289 HydrophobicContact CH2-CD2 4.25Å; W124-L289 HydrophobicContact CZ2-CD1 4.11Å; W124-L289 HydrophobicContact CZ2-CD2 3.98Å; W124-L289 HydrophobicContact CZ2-CG 4.45Å; G158-L289 PolarHBondContact O-N 3.25Å; L289-Y291 HydrophobicContact CB-CE2 4.2Å
290	Q	88.7	Confident	75.2	Confident	132 Å²	132	115 Å²	115	62%	0.617	58%	0.577	S	S	*	*	B	Isolated β-bridge	trans	-96.9	119.1	-180	-62.9	-177.9	6.7	0	0	109.8	P114 Y115 P288	P114-Q290 WeakPolarHBondContact CA-O 3.27Å; Y115-Q290 PolarHBondContact N-O 3.29Å; P288-Q290 PolarHBondContact O-N 3.44Å
291	Y	86.4	Confident	72.2	Confident	123 Å²	123	112.7 Å²	112.7	48%	0.482	58%	0.581	S	S	.	*	P	Polyproline II helix	trans	-91.4	139.3	174.8	-71.8	-101.7	0	0	0	110	P114 L289 Y293	P114-Y291 HydrophobicContact CB-CD1 3.96Å; P114-Y291 HydrophobicContact CB-CD2 4.09Å; P114-Y291 HydrophobicContact CB-CE1 3.83Å; P114-Y291 HydrophobicContact CB-CE2 3.94Å; P114-Y291 HydrophobicContact CB-CG 4.09Å; P114-Y291 HydrophobicContact CG-CD1 4.41Å; P114-Y291 HydrophobicContact CG-CE1 3.85Å; P114-Y291 HydrophobicContact CG-CE2 4.44Å; L289-Y291 HydrophobicContact CB-CE2 4.2Å; Y291-Y293 PolarHBondContact O-N 3.33Å
292	P	85.9	Confident	69.2	Low	74 Å²	74	114.4 Å²	114.4	48%	0.481	60%	0.599	S	S	.	*	P	Polyproline II helix	trans	-56.2	124.9	171.9	-24.6	33.3	0	0	0	111.3	P112 L113 Q294	P112-P292 HydrophobicContact CB-CB 4.22Å; P112-P292 HydrophobicContact CB-CG 4.19Å; L113-P292 VanDerWaalsContact O-CD 3.28Å; L113-P292 WeakPolarHBondContact O-CD 3.48Å; P292-Q294 PolarHBondContact O-N 2.69Å
293	Y	64.5	Low	66.2	Low	222 Å²	222	119.3 Å²	119.3	87%	0.871	64%	0.635	S	S	*	*			trans	-68.5	113.5	-177.4	-152.7	-79.6	0	0	0	110.2	Y291	Y291-Y293 PolarHBondContact O-N 3.33Å
294	Q	54.2	Low	63	Low	137 Å²	137	118.9 Å²	118.9	64%	0.64	64%	0.641	S	S	*	*			trans	-78.6	123.8	174	-72	-175.6	-42.7	0	0	109.9	P112 P292 S296	P112-Q294 HydrophobicContact CG-CG 4.1Å; P292-Q294 PolarHBondContact O-N 2.69Å; Q294-S296 PolarHBondContact O-N 3.29Å
295	Y	39.4	Very low	59.9	Low	216 Å²	216	125.6 Å²	125.6	85%	0.847	67%	0.67	S	S	*	*			trans	-73.1	106	163.1	-110.3	-96.6	0	0	0	108.4	D297	Y295-D297 PolarHBondContact O-N 3.47Å
296	S	41.3	Very low	56.8	Low	99 Å²	99	129.7 Å²	129.7	69%	0.692	70%	0.698	S	S	*	*			trans	-81.4	103.1	167.4	54.1	0	0	0	0	109.3	Q294 E298	Q294-S296 PolarHBondContact O-N 3.29Å; S296-E298 PolarHBondContact O-N 3.06Å
297	D	41.2	Very low	53.5	Low	156 Å²	156	130.2 Å²	130.2	83%	0.834	71%	0.706	S	S	*	*			trans	-73.7	65.8	177.6	-101.8	-25.6	0	0	0	112	Y295	Y295-D297 PolarHBondContact O-N 3.47Å
298	E	44.9	Very low	50.2	Low	182 Å²	182	131.2 Å²	131.2	85%	0.85	72%	0.719	S	S	*	*			trans	-120.1	50.7	176.9	-68.5	-154.8	146.7	0	0	112.7	S296	S296-E298 PolarHBondContact O-N 3.06Å
299	A	37.2	Very low	46.9	Very low	86 Å²	86	132.8 Å²	132.8	71%	0.711	73%	0.732	S	S	*	*			trans	-151.8	50.5	175.7	0	0	0	0	0	115.5
300	Q	34.6	Very low	43.6	Very low	205 Å²	205	142 Å²	142	96%	0.958	77%	0.767	S	S	*	*			trans	-152.3	60.9	165.5	-129.8	147.1	105.9	0	0	116.4
301	S	33.5	Very low	40.8	Very low	113 Å²	113	143.1 Å²	143.1	79%	0.79	77%	0.774	S	S	*	*			trans	-117.5	97.7	155.3	-173.1	0	0	0	0	110.2
302	N	33.2	Very low	37.9	Very low	165 Å²	165	143.8 Å²	143.8	88%	0.882	79%	0.787	S	S	*	*			trans	-169.2	144.7	144.8	-98.1	-36.6	0	0	0	109.5
303	S	33.6	Very low	35.1	Very low	115 Å²	115	149.4 Å²	149.4	80%	0.804	80%	0.799	S	S	*	*			trans	-91.3	146.9	-174.4	52.2	0	0	0	0	113
304	A	30.1	Very low	33.3	Very low	96 Å²	96	145.4 Å²	145.4	79%	0.793	80%	0.799	S	S	*	*			trans	-145.8	124.4	160.2	0	0	0	0	0	108.9
305	N	29.2	Very low	32.1	Very low	168 Å²	168	142 Å²	142	90%	0.898	80%	0.8	S	S	*	*			trans	-83.2	149.5	175.2	-74.6	-18.8	0	0	0	110.8
306	S	29.9	Very low	31.5	Very low	114 Å²	114	137.9 Å²	137.9	80%	0.797	80%	0.798	S	S	*	*			trans	-82	138.2	-169.5	-42.9	0	0	0	0	115.3
307	T	27.4	Very low	30.9	Very low	132 Å²	132	138.3 Å²	138.3	81%	0.81	80%	0.8	S	S	*	*			trans	-167.4	123.4	135.8	22.9	0	0	0	0	107.9
308	V	27.2	Very low	30.3	Very low	132 Å²	132	136.5 Å²	136.5	80%	0.8	80%	0.795	S	S	*	*				64.6	122.7	73.9	175.2	0	0	0	0	111.4
309	S	28.2	Very low	29.7	Very low	105 Å²	105	132.8 Å²	132.8	73%	0.734	79%	0.789	S	S	*	*			cis	-167.4	157.5	-3.6	48.5	0	0	0	0	112.2
310	Y	24.6	Very low	29.4	Very low	209 Å²	209	135.6 Å²	135.6	82%	0.82	79%	0.793	S	S	*	*			trans	-162.1	151	137.5	-150.8	-106.4	0	0	0	111.2	D312	Y310-D312 HydrophobicContact CE1-CB 4.46Å
311	M	30.8	Very low	29.4	Very low	156 Å²	156	136.6 Å²	136.6	77%	0.768	79%	0.787	S	S	*	*			trans	-152.2	145.8	170.2	-123.6	-170	-178.7	0	0	108.7
312	D	24.3	Very low	29.5	Very low	138 Å²	138	135.6 Å²	135.6	74%	0.738	78%	0.781	S	S	*	*			trans	-146.9	161.5	163.3	-151.3	-12.2	0	0	0	110.4	Y310	Y310-D312 HydrophobicContact CE1-CB 4.46Å
313	Y	27.6	Very low	29.4	Very low	191 Å²	191	134.6 Å²	134.6	75%	0.749	78%	0.775	S	S	*	*			trans	-125.7	156	-154.9	-98.8	-93.6	0	0	0	114.8
314	T	28.1	Very low	29.4	Very low	139 Å²	139	134.7 Å²	134.7	85%	0.853	77%	0.771	S	S	*	*			trans	-143.2	107.9	156.4	57	0	0	0	0	113.5
315	G	27	Very low	29.3	Very low	65 Å²	65	136.7 Å²	136.7	67%	0.67	77%	0.768	S	S	*	*			trans	74.9	148.3	159	0	0	0	0	0	118.3
316	T	27.4	Very low	29.5	Very low	130 Å²	130	135.6 Å²	135.6	80%	0.798	76%	0.759	S	S	*	*			cis	-162.3	139.4	-3.8	-22.7	0	0	0	0	111.1
317	S	28.3	Very low	29.6	Very low	107 Å²	107	136.7 Å²	136.7	75%	0.748	75%	0.752	S	S	*	*			trans	60.3	144.3	152.5	-70.1	0	0	0	0	120.6
318	T	28.6	Very low	29.8	Very low	119 Å²	119	137.5 Å²	137.5	73%	0.73	75%	0.746	S	S	*	*			cis	-157.7	145.9	1.2	36.7	0	0	0	0	111.2
319	S	32.5	Very low	29.9	Very low	103 Å²	103	136.1 Å²	136.1	72%	0.72	74%	0.742	S	S	*	*			trans	59	143.7	154.1	60	0	0	0	0	119.7
320	N	31.4	Very low	29.9	Very low	146 Å²	146	138.1 Å²	138.1	78%	0.781	74%	0.744	S	S	*	*			cis	-151.3	161.6	13.2	-116.6	-23	0	0	0	112.7
321	R	33.7	Very low	30.1	Very low	226 Å²	226	132.4 Å²	132.4	85%	0.853	74%	0.735	S	S	*	*			trans	-17.8	155.9	163.2	-81.2	172.4	174.7	140.9	-0.9	119.7
322	S	35.7	Very low	30.1	Very low	92 Å²	92	134.6 Å²	134.6	64%	0.643	74%	0.744	S	S	*	*			cis	-166.7	147.2	19.1	30.8	0	0	0	0	114.5
323	D	31.6	Very low	30.2	Very low	144 Å²	144	131.4 Å²	131.4	77%	0.77	74%	0.744	S	S	*	*			trans	59.8	147	134.3	-50.6	-15.4	0	0	0	120.5
324	V	33	Very low	30.2	Very low	117 Å²	117	127.7 Å²	127.7	71%	0.709	75%	0.746	S	S	*	*			cis	-160	153.7	4.9	-116.2	0	0	0	0	111.4
325	N	29.3	Very low	30.2	Very low	138 Å²	138	127.3 Å²	127.3	74%	0.738	74%	0.738	S	S	*	*			trans	62.6	163	147.2	-72.3	21.6	0	0	0	120.1
326	M	33	Very low	30.2	Very low	144 Å²	144	130.5 Å²	130.5	71%	0.709	74%	0.74	S	S	*	*			cis	-171.9	170.7	-26.2	-124.8	69.2	178.1	0	0	106.8
327	E	31.2	Very low	30.2	Very low	137 Å²	137	129.5 Å²	129.5	64%	0.64	73%	0.734	S	S	*	*			cis	-163.8	175.8	-10.5	-145.4	168	-111.3	0	0	111.4
328	H	32.1	Very low	30.1	Very low	150 Å²	150	132 Å²	132	69%	0.694	74%	0.737	S	S	*	*			trans	22.9	122.1	150.3	-82.4	-45.3	0	0	0	123.6
329	S	29.5	Very low	30.1	Very low	103 Å²	103	135.7 Å²	135.7	72%	0.72	74%	0.743	S	S	*	*				111.2	159.8	95.3	70.5	0	0	0	0	112.6
330	D	28.1	Very low	29.7	Very low	146 Å²	146	138.2 Å²	138.2	78%	0.781	75%	0.747	S	S	*	*			cis	-160.8	177.5	-8.7	-138.3	-44.7	0	0	0	113
331	S	29.9	Very low	29.4	Very low	90 Å²	90	137.5 Å²	137.5	63%	0.629	75%	0.748	S	S	*	*			trans	83.5	125.9	147.3	73.8	0	0	0	0	124.5
332	Q	29.5	Very low	29.4	Very low	201 Å²	201	132.4 Å²	132.4	94%	0.939	74%	0.744	S	S	*	*			trans	51.1	147	133.2	-59.2	176.2	-4.6	0	0	122.1
333	G	27.1	Very low	28.9	Very low	72 Å²	72	135.6 Å²	135.6	74%	0.742	75%	0.749	S	S	*	*			cis	172.4	170.8	-2.4	0	0	0	0	0	112.7
334	S	27.6	Very low	28.6	Very low	113 Å²	113	138.1 Å²	138.1	79%	0.79	75%	0.753	S	S	*	*			trans	7.3	149.5	166.3	-72.7	0	0	0	0	122.6
335	N	28	Very low	28.2	Very low	131 Å²	131	136.7 Å²	136.7	70%	0.701	75%	0.754	S	S	*	*			cis	-164.7	-164.8	2.4	-112.9	40.7	0	0	0	107.1
336	D	27.5	Very low	29.2	Very low	131 Å²	131	135.1 Å²	135.1	70%	0.701	75%	0.751	S	S	*	*			cis	-152.9	-142.9	7	-146.2	-64.7	0	0	0	112.7
337	T	26	Very low	28.9	Very low	110 Å²	110	136.2 Å²	136.2	68%	0.675	75%	0.754	S	S	*	*			trans	-133.7	150.6	-158.7	-43.2	0	0	0	0	114.4
338	I	27.6	Very low	28.6	Very low	158 Å²	158	139 Å²	139	81%	0.81	77%	0.765	S	S	*	*			trans	173.5	148.7	133.2	-90.8	158.1	0	0	0	112.1
339	K	27.6	Very low	28.4	Very low	197 Å²	197	140.3 Å²	140.3	86%	0.857	77%	0.768	S	S	*	*			trans	-116.9	146.7	175.6	-60.4	177.9	-178.9	178	0	111.8
340	I	24.3	Very low	28.6	Very low	157 Å²	157	141.7 Å²	141.7	81%	0.805	78%	0.775	S	S	*	*			trans	-143.4	151	158.1	-60.9	-175	0	0	0	110.2
341	T	25.6	Very low	28.6	Very low	130 Å²	130	144.6 Å²	144.6	80%	0.798	78%	0.78	S	S	*	*			trans	-151.4	144.7	169.2	-42.4	0	0	0	0	109.6
342	P	33.4	Very low	28.5	Very low	119 Å²	119	144 Å²	144	77%	0.773	79%	0.789	S	S	*	*			trans	-145.6	-172.9	136.3	35.6	-17.5	0	0	0	115
343	Q	26	Very low	28.4	Very low	159 Å²	159	142.1 Å²	142.1	74%	0.743	79%	0.785	S	S	*	*			trans	-108.1	172.4	-168.3	-58.3	163.5	-25.6	0	0	113.8
344	F	25.2	Very low	29.4	Very low	198 Å²	198	143.3 Å²	143.3	87%	0.868	78%	0.78	S	S	*	*				151.9	168.2	129.7	-86.3	-71.9	0	0	0	114.9
345	A	24.7	Very low	29.4	Very low	87 Å²	87	145 Å²	145	72%	0.719	78%	0.779	S	S	*	*			trans	-154.6	-166	-175.7	0	0	0	0	0	109.7
346	P	49.7	Very low	29.5	Very low	104 Å²	104	149.3 Å²	149.3	68%	0.675	79%	0.785	S	S	*	*			cis	-136.2	-157.1	-16.7	40.2	-18.9	0	0	0	114.5
347	H	26.7	Very low	29.4	Very low	167 Å²	167	149.9 Å²	149.9	77%	0.773	79%	0.794	S	S	*	*			trans	80.5	160.5	170.7	-59.5	-49.4	0	0	0	118.2
348	F	25.1	Very low	29.5	Very low	197 Å²	197	152.5 Å²	152.5	86%	0.864	80%	0.803	S	S	*	*			cis	-142.8	-179.6	19	-132	-84.8	0	0	0	114.1
349	K	27.2	Very low	30.4	Very low	176 Å²	176	150.1 Å²	150.1	77%	0.765	80%	0.798	S	S	*	*			trans	-105.7	172.4	176.2	-69.8	-173.2	177	-177.6	0	114.1
350	P	33.7	Very low	30.4	Very low	132 Å²	132	148.9 Å²	148.9	86%	0.857	80%	0.8	S	S	*	*				-136.5	-169.8	114.5	38.3	-26.9	0	0	0	115.8
351	K	29	Very low	30.6	Very low	207 Å²	207	146.6 Å²	146.6	90%	0.9	80%	0.798	S	S	*	*			trans	-131.5	164.2	-176.9	-65.2	178.4	174.1	-177.9	0	111.5
352	G	26.3	Very low	30.8	Very low	79 Å²	79	152.7 Å²	152.7	81%	0.814	81%	0.806	S	S	*	*			trans	177.3	137.1	160.4	0	0	0	0	0	115.9
353	D	27.6	Very low	30.5	Very low	160 Å²	160	150.7 Å²	150.7	86%	0.856	81%	0.807	S	S	*	*			trans	-162	171.3	-179.7	-138.8	-10.5	0	0	0	106.5
354	P	49.6	Very low	30.6	Very low	97 Å²	97	146.6 Å²	146.6	63%	0.63	81%	0.808	S	S	*	*			cis	-139.1	-162.4	-9.3	34.1	-9.4	0	0	0	115.1
355	L	27.2	Very low	30.7	Very low	148 Å²	148	142.6 Å²	142.6	78%	0.775	80%	0.804	S	S	*	*			trans	97.2	127.5	151.9	-70.5	164.7	0	0	0	123.9
356	R	28.8	Very low	31	Very low	222 Å²	222	144.3 Å²	144.3	84%	0.838	81%	0.805	S	S	*	*			trans	37.1	124.9	146.4	-72.4	-178.9	169.3	179.5	-3	121.6
357	T	26.3	Very low	29.9	Very low	143 Å²	143	147.6 Å²	147.6	88%	0.877	81%	0.812	S	S	*	*				-177.3	157.5	101.6	26.6	0	0	0	0	113.9
358	L	27.7	Very low	30	Very low	165 Å²	165	145 Å²	145	86%	0.864	81%	0.812	S	S	*	*			trans	-114.4	178.6	164.2	-77.2	172.7	0	0	0	107.9
359	P	46.3	Very low	30	Very low	108 Å²	108	143 Å²	143	70%	0.701	81%	0.81	S	S	*	*			cis	-127.6	-171.4	-17.7	36.3	-19	0	0	0	112.3
360	L	27.4	Very low	30.5	Very low	172 Å²	172	140.6 Å²	140.6	90%	0.901	81%	0.812	S	S	*	*			trans	-166.8	152.9	136.7	-111.1	165.9	0	0	0	112.7
361	S	29	Very low	30.2	Very low	109 Å²	109	138.9 Å²	138.9	76%	0.762	81%	0.809	S	S	*	*			trans	-132.5	149.2	-172.8	-52.4	0	0	0	0	112.7
362	R	29.4	Very low	30.1	Very low	258 Å²	258	140.3 Å²	140.3	97%	0.974	81%	0.809	S	S	*	*			trans	-163.8	134.7	161.2	-114.2	179.8	176.1	-169.1	-1.9	110
363	G	27	Very low	30.1	Very low	77 Å²	77	142 Å²	142	79%	0.794	80%	0.803	S	S	*	*			cis	165.6	141.3	-12.1	0	0	0	0	0	113.5
364	G	28.2	Very low	30.1	Very low	73 Å²	73	143.2 Å²	143.2	75%	0.753	80%	0.804	S	S	*	*			trans	82.2	152	175.5	0	0	0	0	0	115.3
365	S	27.7	Very low	28.9	Very low	114 Å²	114	143.5 Å²	143.5	80%	0.797	81%	0.807	S	S	*	*			cis	-164.1	172.2	-7.8	-76.4	0	0	0	0	108.1
366	V	30.2	Very low	28.8	Very low	123 Å²	123	146.1 Å²	146.1	75%	0.745	81%	0.813	S	S	*	*			cis	-143.8	178	10	-135.4	0	0	0	0	111.9
367	E	27.5	Very low	28.6	Very low	173 Å²	173	139.1 Å²	139.1	81%	0.808	80%	0.802	S	S	*	*			trans	-30	162.8	152.7	-70.4	158	166.3	0	0	119.1
368	S	28.5	Very low	28.6	Very low	111 Å²	111	138.3 Å²	138.3	78%	0.776	80%	0.802	S	S	*	*			cis	-167.9	164.2	-16.6	57.2	0	0	0	0	113.8
369	L	26.4	Very low	28.7	Very low	157 Å²	157	135.3 Å²	135.3	82%	0.822	80%	0.795	S	S	*	*			trans	-51	171	161.8	-77.4	167.7	0	0	0	114.4
370	P	36	Very low	27.7	Very low	124 Å²	124	136.7 Å²	136.7	81%	0.805	80%	0.797	S	S	*	*			cis	-145	-178.8	30.4	43.6	-23.4	0	0	0	118.9
371	A	29	Very low	27.7	Very low	97 Å²	97	133 Å²	133	80%	0.802	79%	0.785	S	S	*	*			trans	-106.3	150.3	172.1	0	0	0	0	0	112.5
372	R	27	Very low	27.7	Very low	237 Å²	237	137.7 Å²	137.7	89%	0.894	79%	0.792	S	S	*	*			trans	-155.6	124.3	158.4	-156.4	166	-173	170	1.6	115.2
373	T	25.6	Very low	27.8	Very low	114 Å²	114	136.6 Å²	136.6	70%	0.699	79%	0.788	S	S	*	*			trans	11.2	129.8	147	-39.6	0	0	0	0	121
374	Q	27.4	Very low	27.9	Very low	185 Å²	185	142 Å²	142	86%	0.864	80%	0.795	S	S	*	*			trans	-157.6	161.7	130.6	-113.7	171.9	17.5	0	0	112.3
375	C	24.5	Very low	27.9	Very low	104 Å²	104	144 Å²	144	70%	0.703	80%	0.797	S	S	*	*			trans	-133.9	138.6	-172.5	-54.3	0	0	0	0	111.7
376	F	25.5	Very low	28	Very low	203 Å²	203	143.7 Å²	143.7	89%	0.89	80%	0.801	S	S	*	*			trans	-162.5	160.7	154.7	-76.1	-69.3	0	0	0	108.5
377	A	25.1	Very low	28	Very low	74 Å²	74	144.6 Å²	144.6	61%	0.612	80%	0.802	S	S	*	*			cis	-178.3	134	-44.5	0	0	0	0	0	108.4
378	S	25.5	Very low	28.1	Very low	126 Å²	126	144.6 Å²	144.6	88%	0.881	81%	0.807	S	S	*	*			trans	62.1	164.2	172.1	75.5	0	0	0	0	116.2
379	S	29	Very low	28.2	Very low	102 Å²	102	144 Å²	144	71%	0.713	80%	0.802	S	S	*	*			cis	-143.9	167.8	5.6	59.3	0	0	0	0	113.7
380	D	26	Very low	28.3	Very low	137 Å²	137	145 Å²	145	73%	0.733	80%	0.803	S	S	*	*			trans	-2.8	132.8	165	-71.7	-72.6	0	0	0	122.4
381	S	27.7	Very low	27.9	Very low	95 Å²	95	147.5 Å²	147.5	66%	0.664	81%	0.809	S	S	*	*				73.5	103.6	63.8	-50	0	0	0	0	115.1
382	K	29.5	Very low	27.8	Very low	207 Å²	207	150 Å²	150	90%	0.9	80%	0.804	S	S	*	*				-171.8	138.3	117.8	-103.9	158.5	-173.4	171.8	0	113.9
383	R	29.9	Very low	28.1	Very low	235 Å²	235	144.8 Å²	144.8	89%	0.887	80%	0.801	S	S	*	*			trans	-73	148.9	155.7	-63.9	169.5	170.7	168	-6.4	108.8
384	M	28.9	Very low	28	Very low	191 Å²	191	144.6 Å²	144.6	94%	0.941	80%	0.799	S	S	*	*			trans	-135.7	132.2	136.4	-74.9	-159.8	72	0	0	109.2
385	S	29.9	Very low	27.9	Very low	114 Å²	114	144 Å²	144	80%	0.797	80%	0.799	S	S	*	*			trans	-107.3	141.8	174.2	48.5	0	0	0	0	108.8
386	A	29.8	Very low	27.8	Very low	108 Å²	108	148 Å²	148	89%	0.893	81%	0.807	S	S	*	*			trans	-138.2	124.3	165.6	0	0	0	0	0	108.6
387	D	28.7	Very low	27.8	Very low	142 Å²	142	145.6 Å²	145.6	76%	0.759	80%	0.802	S	S	*	*			trans	-121.9	129	172.4	171.7	27.8	0	0	0	106.1
388	L	31.3	Very low	27.9	Very low	173 Å²	173	148 Å²	148	91%	0.906	81%	0.81	S	S	*	*			trans	-153.3	145.4	169.6	-83.7	-171.2	0	0	0	109.8
389	S	30	Very low	28.4	Very low	98 Å²	98	148 Å²	148	69%	0.685	81%	0.806	S	S	*	*			trans	-110.1	166.8	-162.7	-35.2	0	0	0	0	113.2
390	E	27.9	Very low	28.3	Very low	180 Å²	180	148 Å²	148	84%	0.841	81%	0.812	S	S	*	*			trans	60.9	128.2	155.9	-63.5	-178.2	177.3	0	0	120
391	L	28.2	Very low	28.4	Very low	176 Å²	176	146.1 Å²	146.1	92%	0.921	82%	0.816	S	S	*	*				-174.4	140.9	114.6	-97.8	164.1	0	0	0	110.6
392	E	27.3	Very low	28.2	Very low	148 Å²	148	152.2 Å²	152.2	69%	0.692	82%	0.824	S	S	*	*			trans	-76.6	175.4	165.9	-63.2	-162.4	145	0	0	111.3
393	P	31.8	Very low	28.1	Very low	128 Å²	128	147.7 Å²	147.7	83%	0.831	82%	0.819	S	S	*	*				-139.7	141.2	94.7	36.6	-24.3	0	0	0	115.7
394	T	24.6	Very low	28	Very low	110 Å²	110	142.7 Å²	142.7	68%	0.675	81%	0.805	S	S	*	*			trans	-67.1	143.9	160.7	39.1	0	0	0	0	112.5
395	M	25.5	Very low	28	Very low	173 Å²	173	144.6 Å²	144.6	85%	0.852	80%	0.804	S	S	*	*			trans	-148.8	135.3	143	-76.7	-149.7	81.9	0	0	111
396	Q	22	Very low	28	Very low	189 Å²	189	148 Å²	148	88%	0.883	80%	0.804	S	S	*	*			trans	-115.4	132.3	167.2	-65.7	-179.7	-3.4	0	0	109.3
397	I	25.4	Very low	28	Very low	151 Å²	151	148.2 Å²	148.2	77%	0.774	80%	0.796	S	S	*	*			trans	-141.1	139.5	160.4	-60.8	-175.7	0	0	0	108.6
398	T	26	Very low	28	Very low	126 Å²	126	145.1 Å²	145.1	77%	0.773	80%	0.798	S	S	*	*			trans	-130.8	-172.6	174.8	59.9	0	0	0	0	109.8
399	P	38.1	Very low	27.9	Very low	125 Å²	125	145.8 Å²	145.8	81%	0.812	80%	0.796	S	S	*	*				-116.4	161	-92.6	36.4	-22	0	0	0	114
400	A	25.8	Very low	27.8	Very low	101 Å²	101	151.7 Å²	151.7	84%	0.835	80%	0.804	S	S	*	*			trans	-139.9	125.6	178.5	0	0	0	0	0	115.9
401	A	27.4	Very low	27.8	Very low	98 Å²	98	153.3 Å²	153.3	81%	0.81	81%	0.808	S	S	*	*			trans	43.9	105.6	144.8	0	0	0	0	0	122.3
402	R	25.1	Very low	27.9	Very low	224 Å²	224	151.2 Å²	151.2	85%	0.845	80%	0.802	S	S	*	*			trans	12.4	136.6	131.1	-65.5	176.2	175.1	165.5	-1.5	119.6
403	S	27.4	Very low	27.9	Very low	112 Å²	112	149.1 Å²	149.1	78%	0.783	81%	0.811	S	S	*	*				-126.2	152.8	126.5	-173	0	0	0	0	110
404	Q	27	Very low	27.8	Very low	129 Å²	129	148.3 Å²	148.3	60%	0.603	81%	0.808	S	S	*	*			trans	-128.3	134.3	179.2	-70.5	-175.7	-18.3	0	0	110.1
405	Y	28	Very low	28.1	Very low	232 Å²	232	152.5 Å²	152.5	91%	0.91	82%	0.817	S	S	*	*			trans	-129.1	152	154.2	-87.6	-81.7	0	0	0	110.3
406	K	29.9	Very low	28.3	Very low	184 Å²	184	148 Å²	148	80%	0.8	82%	0.815	S	S	*	*			trans	-108.4	164.3	-159.4	-93.8	-177.5	178	178.3	0	113.3
407	P	31.4	Very low	28.7	Very low	113 Å²	113	144.9 Å²	144.9	73%	0.734	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-89.4	152	-153.2	33.8	-37.5	0	0	0	116.3
408	G	27.3	Very low	28.9	Very low	77 Å²	77	145.4 Å²	145.4	79%	0.794	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-75.5	161.3	165.4	0	0	0	0	0	113.3
409	H	30	Very low	29.3	Very low	187 Å²	187	146.1 Å²	146.1	87%	0.866	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-88.7	153.8	-164.7	-95.3	56.7	0	0	0	116.5
410	R	28.2	Very low	28.8	Very low	223 Å²	223	147.5 Å²	147.5	84%	0.842	81%	0.811	S	S	*	*			trans	-45.3	146.3	172.7	-57.9	166.9	175.3	163.9	-4.2	114.2
411	K	28.4	Very low	29.1	Very low	214 Å²	214	147.4 Å²	147.4	93%	0.93	80%	0.799	S	S	*	*				-132.1	116.8	128.7	-76.2	-167.2	177.8	-179.4	0	109.9
412	T	29.5	Very low	29.2	Very low	131 Å²	131	148.2 Å²	148.2	80%	0.804	80%	0.796	S	S	*	*			trans	-92.1	129.4	169.3	44.5	0	0	0	0	109.2
413	A	27.6	Very low	29.3	Very low	105 Å²	105	147.3 Å²	147.3	87%	0.868	80%	0.798	S	S	*	*			trans	-112.6	138.5	164.4	0	0	0	0	0	108.5
414	S	28.6	Very low	29.6	Very low	110 Å²	110	145.3 Å²	145.3	77%	0.769	78%	0.778	S	S	*	*			trans	-95.4	162.9	-167.8	51.2	0	0	0	0	113.8
415	F	32	Very low	29.8	Very low	198 Å²	198	144.5 Å²	144.5	87%	0.868	78%	0.782	S	S	*	*			trans	-19.3	127.2	161.8	-68.6	-96.4	0	0	0	116
416	G	28.3	Very low	30	Very low	78 Å²	78	136.7 Å²	136.7	80%	0.804	76%	0.758	S	S	*	*			trans	-124	91.5	162.4	0	0	0	0	0	109.9	I418	G416-I418 PolarHBondContact O-N 3.04Å
417	T	32.2	Very low	30	Very low	124 Å²	124	133 Å²	133	76%	0.761	75%	0.751	S	S	*	*			trans	-83.9	108.7	176.6	-23.1	0	0	0	0	109.3
418	I	29.7	Very low	29.9	Very low	162 Å²	162	131 Å²	131	83%	0.831	74%	0.744	S	S	*	*			trans	-129.3	109.7	164	-63.2	-176.8	0	0	0	107.9	G416	G416-I418 PolarHBondContact O-N 3.04Å
419	L	32.7	Very low	30	Very low	142 Å²	142	132.6 Å²	132.6	74%	0.743	74%	0.739	S	S	*	*			trans	-94.9	111.8	162.7	-77	166.3	0	0	0	107.3
420	D	27.6	Very low	30	Very low	154 Å²	154	129.1 Å²	129.1	82%	0.824	73%	0.734	S	S	*	*			trans	-164.1	118.3	133.6	-112.4	-24.6	0	0	0	109.1
421	V	33.3	Very low	29.8	Very low	99 Å²	99	126 Å²	126	60%	0.6	73%	0.729	S	S	*	*			trans	-131.5	115.6	174.2	-178.9	0	0	0	0	106.7	I424	V421-I424 HydrophobicContact CG1-CD1 4.31Å; V421-I424 HydrophobicContact CG1-CG1 4.29Å
422	P	28.5	Very low	29.8	Very low	115 Å²	115	120.6 Å²	120.6	75%	0.747	72%	0.724	S	S	*	*			trans	-65.7	155.2	-177.4	27.3	-34.5	0	0	0	111.3	I424	P422-I424 PolarHBondContact O-N 2.78Å
423	K	26.5	Very low	29.7	Very low	204 Å²	204	122.3 Å²	122.3	89%	0.887	72%	0.723	S	S	*	*			trans	-47.4	108.7	-175.5	-159.1	175.2	-172.1	179.8	0	111.4	V425	K423-V425 PolarHBondContact O-N 3.28Å; K423-V425 VanDerWaalsContact O-N 3.07Å
424	I	35.2	Very low	29.7	Very low	71 Å²	71	128.1 Å²	128.1	36%	0.364	72%	0.723	S	S	.	*			trans	-72.8	103.5	-171.5	-55	178.1	0	0	0	109.7	V421 P422 V426	V421-I424 HydrophobicContact CG1-CD1 4.31Å; V421-I424 HydrophobicContact CG1-CG1 4.29Å; P422-I424 PolarHBondContact O-N 2.78Å; I424-V426 HydrophobicContact CG2-CG2 3.85Å
425	V	30.4	Very low	29.6	Very low	112 Å²	112	134.9 Å²	134.9	68%	0.679	73%	0.731	S	S	*	*			trans	-97.5	96.7	169.4	-173.5	0	0	0	0	108.5	K423 T427	K423-V425 PolarHBondContact O-N 3.28Å; K423-V425 VanDerWaalsContact O-N 3.07Å; V425-T427 HydrophobicContact CG1-CG2 3.88Å; V425-T427 PolarHBondContact O-N 2.89Å; V425-T427 VanDerWaalsContact O-N 3.1Å
426	V	32.7	Very low	29.4	Very low	68 Å²	68	136.2 Å²	136.2	41%	0.412	73%	0.731	S	S	.	*			trans	-77.8	90.8	168.7	-175.2	0	0	0	0	108.1	A118 I424 A428	A118-V426 HydrophobicContact CB-CB 3.8Å; A118-V426 HydrophobicContact CB-CG1 4.21Å; A118-V426 HydrophobicContact CB-CG2 3.78Å; I424-V426 HydrophobicContact CG2-CG2 3.85Å; V426-A428 PolarHBondContact O-N 2.73Å
427	T	30	Very low	29.2	Very low	105 Å²	105	137.7 Å²	137.7	64%	0.644	73%	0.729	S	S	*	*			trans	-71.2	97	170.5	52.4	0	0	0	0	109.6	V425 T429	V425-T427 HydrophobicContact CG1-CG2 3.88Å; V425-T427 PolarHBondContact O-N 2.89Å; V425-T427 VanDerWaalsContact O-N 3.1Å; T427-T429 PolarHBondContact O-N 2.99Å
428	A	28.6	Very low	29	Very low	71 Å²	71	138.5 Å²	138.5	59%	0.587	73%	0.733	S	S	*	*			trans	-65.9	100.2	164.7	0	0	0	0	0	108.7	V426 C430	V426-A428 PolarHBondContact O-N 2.73Å; A428-C430 PolarHBondContact O-N 3.22Å
429	T	29.3	Very low	29	Very low	111 Å²	111	138.6 Å²	138.6	68%	0.681	73%	0.73	S	S	*	*			trans	-78.3	91	-175.5	51.6	0	0	0	0	111.1	T427 E431	T427-T429 PolarHBondContact O-N 2.99Å; T429-E431 PolarHBondContact O-N 3.49Å
430	C	29.6	Very low	28.7	Very low	115 Å²	115	139.3 Å²	139.3	78%	0.777	74%	0.735	S	S	*	*			trans	-72.4	68.3	169.3	-67.5	0	0	0	0	111.7	A428 A432	A428-C430 PolarHBondContact O-N 3.22Å; C430-A432 PolarHBondContact O-N 3.03Å
431	E	25.3	Very low	28.7	Very low	157 Å²	157	140.2 Å²	140.2	73%	0.734	74%	0.739	S	S	*	*			trans	-86	102	169.4	-72.1	-162.8	149.1	0	0	110.9	T429 Q433	T429-E431 PolarHBondContact O-N 3.49Å; E431-Q433 PolarHBondContact O-N 3.23Å
432	A	27.4	Very low	28.7	Very low	100 Å²	100	141.6 Å²	141.6	83%	0.826	75%	0.75	S	S	*	*			trans	-72.3	88.2	171.1	0	0	0	0	0	110.6	C430 R434	C430-A432 PolarHBondContact O-N 3.03Å; A432-R434 PolarHBondContact O-N 3.34Å
433	Q	27.4	Very low	28.5	Very low	167 Å²	167	140.9 Å²	140.9	78%	0.78	75%	0.753	S	S	*	*			trans	-68.4	89.1	179.1	-71.7	-170.2	-49.5	0	0	112	E431 R435	E431-Q433 PolarHBondContact O-N 3.23Å; Q433-R435 PolarHBondContact O-N 3.32Å
434	R	27.5	Very low	28.6	Very low	227 Å²	227	139.3 Å²	139.3	86%	0.857	75%	0.753	S	S	*	*			trans	-53.3	123.9	161.4	-81.8	-171.2	175	-165.2	0.8	109.3	A432 R436	A432-R434 PolarHBondContact O-N 3.34Å; R434-R436 PolarHBondContact O-N 3Å
435	R	27.7	Very low	28.1	Very low	252 Å²	252	138.8 Å²	138.8	95%	0.951	77%	0.765	S	S	*	*			trans	-53.7	125.6	162.5	-69.3	-176.7	176.6	-171.2	-1	108.8	Q433	Q433-R435 PolarHBondContact O-N 3.32Å
436	R	27	Very low	28	Very low	226 Å²	226	139.3 Å²	139.3	85%	0.853	77%	0.769	S	S	*	*			trans	-115.1	139.3	162.6	-77	-168.2	176.2	-166.7	0.6	108.8	R434	R434-R436 PolarHBondContact O-N 3Å
437	S	25.4	Very low	27.7	Very low	110 Å²	110	144.8 Å²	144.8	77%	0.769	79%	0.79	S	S	*	*			trans	-65.3	150.5	174	-169.1	0	0	0	0	110.7
438	V	28.1	Very low	27.5	Very low	140 Å²	140	144.2 Å²	144.2	85%	0.848	79%	0.79	S	S	*	*			trans	-98.7	105.5	173.3	178.1	0	0	0	0	108.7
439	Q	28.3	Very low	27.4	Very low	165 Å²	165	145.6 Å²	145.6	77%	0.771	80%	0.795	S	S	*	*			trans	-137.5	155.2	162.1	-75.1	-173	-40.5	0	0	109.4
440	D	26.7	Very low	27.6	Very low	156 Å²	156	149.8 Å²	149.8	83%	0.834	81%	0.807	S	S	*	*			trans	66.3	106.7	171.9	-55.8	-19.5	0	0	0	119.2
441	L	28.6	Very low	27.5	Very low	174 Å²	174	147.7 Å²	147.7	91%	0.911	81%	0.805	S	S	*	*			trans	-114.7	125.9	159.4	-82.9	168.5	0	0	0	109.2
442	P	32.2	Very low	27.7	Very low	128 Å²	128	145.4 Å²	145.4	83%	0.831	81%	0.806	S	S	*	*			trans	-84.9	157.1	163.9	34	-32	0	0	0	111.4
443	A	25.3	Very low	27.8	Very low	99 Å²	99	152.2 Å²	152.2	82%	0.818	81%	0.811	S	S	*	*			trans	-113	151.1	-166.3	0	0	0	0	0	115.5
444	I	28.1	Very low	27.9	Very low	171 Å²	171	149 Å²	149	88%	0.877	81%	0.807	S	S	*	*			trans	-140.2	123	160.2	-57.4	179.8	0	0	0	103.5
445	G	25.1	Very low	28	Very low	61 Å²	61	143.2 Å²	143.2	63%	0.629	80%	0.801	S	S	*	*				80.3	125.2	75.3	0	0	0	0	0	110
446	T	28.1	Very low	28.2	Very low	123 Å²	123	136.9 Å²	136.9	76%	0.755	80%	0.796	S	S	*	*			cis	-161.2	160	14.8	42.6	0	0	0	0	112
447	E	25.4	Very low	28.3	Very low	182 Å²	182	137.9 Å²	137.9	85%	0.85	80%	0.8	S	S	*	*			trans	68.7	149.8	152.8	-77.5	177.6	-152.1	0	0	120.6
448	S	27.2	Very low	28.5	Very low	93 Å²	93	138 Å²	138	65%	0.65	80%	0.8	S	S	*	*			cis	-159.4	165.3	-15.1	68.6	0	0	0	0	114.6
449	S	26.7	Very low	28.6	Very low	100 Å²	100	136.8 Å²	136.8	70%	0.699	80%	0.798	S	S	*	*			trans	81.8	135.8	143.8	-57.2	0	0	0	0	123.2
450	Q	32.4	Very low	28.7	Very low	199 Å²	199	134.7 Å²	134.7	93%	0.93	80%	0.801	S	S	*	*			trans	68.7	132.1	171.6	-45.8	-170.6	17.1	0	0	115.7
451	G	26.8	Very low	29.1	Very low	71 Å²	71	133.5 Å²	133.5	73%	0.732	80%	0.802	S	S	*	*			cis	128.5	136.4	6.2	0	0	0	0	0	109.9
452	S	29.9	Very low	29	Very low	109 Å²	109	130.6 Å²	130.6	76%	0.762	80%	0.796	S	S	*	*			cis	-161.7	163.4	3	-54.1	0	0	0	0	110.7
453	R	30.2	Very low	28.8	Very low	243 Å²	243	130.3 Å²	130.3	92%	0.917	79%	0.792	S	S	*	*			trans	70.5	150.4	165.8	-57.2	168.5	-177	176.4	0	115.6
454	S	29.4	Very low	28.8	Very low	99 Å²	99	136.8 Å²	136.8	69%	0.692	80%	0.795	S	S	*	*			cis	-168.4	150.2	-14.7	44.6	0	0	0	0	110.8
455	S	29.7	Very low	29.2	Very low	106 Å²	106	134 Å²	134	74%	0.741	79%	0.789	S	S	*	*			trans	33.7	127	150	62.6	0	0	0	0	119.9
456	S	31.7	Very low	29.7	Very low	120 Å²	120	137.2 Å²	137.2	84%	0.839	80%	0.798	S	S	*	*				-164.8	172.2	55.6	-73.8	0	0	0	0	113.6
457	R	29	Very low	29.6	Very low	247 Å²	247	138.3 Å²	138.3	93%	0.932	80%	0.799	S	S	*	*			trans	-105.8	138.8	178.6	-53.3	156	85.8	-176.1	9.9	111.1
458	S	30.1	Very low	29.9	Very low	111 Å²	111	138.2 Å²	138.2	78%	0.776	80%	0.796	S	S	*	*			trans	-170.2	110.5	145.2	54.6	0	0	0	0	115
459	S	30.2	Very low	29.9	Very low	115 Å²	115	139.5 Å²	139.5	80%	0.804	81%	0.805	S	S	*	*			trans	44.4	104.9	130.5	-47.7	0	0	0	0	122.5
460	S	30.5	Very low	30	Very low	121 Å²	121	142.3 Å²	142.3	85%	0.846	81%	0.812	S	S	*	*			trans	41	142.9	131.8	-53	0	0	0	0	123.9
461	P	34.3	Very low	29.8	Very low	131 Å²	131	138.4 Å²	138.4	85%	0.851	81%	0.807	S	S	*	*			trans	-100.6	170.2	-172.2	40.8	-38	0	0	0	116
462	S	25.8	Very low	29.9	Very low	113 Å²	113	146.1 Å²	146.1	79%	0.79	81%	0.814	S	S	*	*			trans	-150.8	102.7	163	-162.7	0	0	0	0	115.6
463	V	28.8	Very low	29.8	Very low	122 Å²	122	145.9 Å²	145.9	74%	0.739	81%	0.812	S	S	*	*			trans	46.8	107.9	135.8	-170.5	0	0	0	0	122.3
464	R	25.9	Very low	29.7	Very low	236 Å²	236	144.9 Å²	144.9	89%	0.891	81%	0.81	S	S	*	*			trans	66.3	164.1	145.6	-76.1	-177.4	177.9	-154.2	-0.2	120.7
465	P	36.4	Very low	29.7	Very low	113 Å²	113	149.1 Å²	149.1	73%	0.734	82%	0.817	S	S	*	*			cis	-120.3	170.3	-18	36.6	-22.4	0	0	0	113.4
466	P	35.1	Very low	30	Very low	127 Å²	127	149.4 Å²	149.4	83%	0.825	82%	0.816	S	S	*	*			trans	-88.1	153.1	171.5	35.5	-33.9	0	0	0	113.1
467	D	26.4	Very low	30	Very low	146 Å²	146	152.4 Å²	152.4	78%	0.781	82%	0.816	S	S	*	*			trans	-136.6	170.2	163.7	-149.2	-18.5	0	0	0	110.9
468	K	31.2	Very low	30.1	Very low	181 Å²	181	148.3 Å²	148.3	79%	0.787	81%	0.813	S	S	*	*			trans	-84	151.3	-155.5	-54	139.4	-172.5	161.7	0	114.6
469	S	28	Very low	30.1	Very low	120 Å²	120	150.3 Å²	150.3	84%	0.839	82%	0.815	S	S	*	*				177.7	161.8	114.8	45.8	0	0	0	0	115.4
470	N	27.7	Very low	31	Very low	158 Å²	158	150.2 Å²	150.2	85%	0.845	81%	0.812	S	S	*	*			trans	-33.7	136.5	-179.3	-64.6	-21.2	0	0	0	120.2
471	S	28.5	Very low	31	Very low	117 Å²	117	151.2 Å²	151.2	82%	0.818	81%	0.812	S	S	*	*				-163.1	115.6	116.3	16.4	0	0	0	0	108.4
472	R	28.4	Very low	31	Very low	233 Å²	233	152.2 Å²	152.2	88%	0.879	81%	0.811	S	S	*	*				80.3	112.6	74.6	-165.1	174.5	-165.2	164.7	5.1	111.8
473	S	28.9	Very low	31.3	Very low	105 Å²	105	153.3 Å²	153.3	73%	0.734	81%	0.813	S	S	*	*			trans	-65.1	148.8	-176.3	41	0	0	0	0	113.9
474	Y	27.9	Very low	31.7	Very low	222 Å²	222	155.4 Å²	155.4	87%	0.871	82%	0.82	S	S	*	*			trans	-123.1	121.9	164	-97.8	-91.6	0	0	0	109.2
475	F	28.5	Very low	31.8	Very low	188 Å²	188	147.5 Å²	147.5	83%	0.825	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-97	137.2	155.4	-80.8	-91.1	0	0	0	107.4
476	P	36.8	Very low	32.2	Very low	112 Å²	112	148.3 Å²	148.3	73%	0.727	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-72.6	134.1	161.9	-12	28.6	0	0	0	110.2
477	H	31.7	Very low	32.3	Very low	182 Å²	182	149 Å²	149	84%	0.843	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-89.3	143.3	149.6	-98	-97.9	0	0	0	107.3
478	D	31.8	Very low	33	Very low	161 Å²	161	149.6 Å²	149.6	86%	0.861	82%	0.82	S	S	*	*			trans	-138.5	147.8	157	-87.5	-55.2	0	0	0	108.8
479	D	28.4	Very low	33.4	Very low	153 Å²	153	145.1 Å²	145.1	82%	0.818	81%	0.811	S	S	*	*			trans	-111.3	156.7	-168.4	-140.7	24.1	0	0	0	110.4
480	P	49.2	Very low	34.4	Very low	114 Å²	114	143.3 Å²	143.3	74%	0.74	79%	0.792	S	S	*	*			trans	-87.4	128.6	-161.1	32.7	-34.3	0	0	0	114.6
481	T	31.9	Very low	35.4	Very low	141 Å²	141	140.4 Å²	140.4	87%	0.865	78%	0.781	S	S	*	*			trans	-144.6	148.3	155.1	35.6	0	0	0	0	111
482	D	33.8	Very low	36.8	Very low	153 Å²	153	138.7 Å²	138.7	82%	0.818	76%	0.761	S	S	*	*			trans	-73.2	144.2	-170	-61.7	-81.7	0	0	0	115.3
483	T	31.8	Very low	38.3	Very low	135 Å²	135	128.9 Å²	128.9	83%	0.828	73%	0.73	S	S	*	*				-162.7	102.1	128.6	4.8	0	0	0	0	113.6	G485	T483-G485 PolarHBondContact O-N 3.04Å
484	N	37.2	Very low	40	Very low	167 Å²	167	125.4 Å²	125.4	89%	0.893	70%	0.701	S	S	*	*			trans	27.7	76.1	150.4	-65.9	-26.4	0	0	0	119
485	G	29	Very low	41.8	Very low	70 Å²	70	116.9 Å²	116.9	72%	0.722	67%	0.67	S	S	*	*			trans	-106.1	116.4	153.6	0	0	0	0	0	109.9	T483 D487	T483-G485 PolarHBondContact O-N 3.04Å; G485-D487 VanDerWaalsContact C-N 3.26Å; G485-D487 PolarHBondContact O-N 3.24Å
486	S	43.8	Very low	43.6	Very low	130 Å²	130	111 Å²	111	91%	0.909	65%	0.65	S	S	*	*			trans	-82.6	61.1	-174	63.2	0	0	0	0	113	N488	S486-N488 PolarHBondContact O-N 3.11Å
487	D	37.3	Very low	45.3	Very low	140 Å²	140	106.1 Å²	106.1	75%	0.749	62%	0.618	S	S	*	*			trans	-100.7	81.3	-176.7	-160.6	5.8	0	0	0	111.9	G485	G485-D487 VanDerWaalsContact C-N 3.26Å; G485-D487 PolarHBondContact O-N 3.24Å
488	N	41.8	Very low	47.1	Very low	160 Å²	160	103.6 Å²	103.6	86%	0.856	61%	0.611	S	S	*	*			trans	-136.7	44.2	-175.4	-143.3	-1.5	0	0	0	111.2	S486	S486-N488 PolarHBondContact O-N 3.11Å
489	S	39.4	Very low	48.6	Very low	86 Å²	86	103.4 Å²	103.4	60%	0.601	60%	0.604	S	S	*	*			trans	-118.4	28.6	-169.1	67.6	0	0	0	0	115.5
490	I	48.2	Very low	50.8	Low	83 Å²	83	105.1 Å²	105.1	43%	0.426	61%	0.607	S	S	.	*			trans	-118.9	50.8	166.3	-37.5	-177.3	0	0	0	114.2	M492 A493 Q525	I490-M492 VanDerWaalsContact C-N 3.35Å; I490-M492 PolarHBondContact O-N 3.39Å; I490-M492 VanDerWaalsContact O-N 3.1Å; I490-A493 HydrophobicContact CG2-CB 3.78Å; I490-Q525 PolarHBondContact O-NE2 2.89Å
491	P	50	Low	51.9	Low	96 Å²	96	103.9 Å²	103.9	62%	0.623	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.9	72.2	172.9	37.2	-35.3	0	0	0	111.3
492	M	57.6	Low	54.2	Low	81 Å²	81	99.6 Å²	99.6	40%	0.399	56%	0.564	S	S	.	*	T	Hydrogen-bonded Turn	trans	173.9	4.4	149.1	-117.2	60.7	90.1	0	0	116.1	I490 Y494 L495	I490-M492 VanDerWaalsContact C-N 3.35Å; I490-M492 PolarHBondContact O-N 3.39Å; I490-M492 VanDerWaalsContact O-N 3.1Å; M492-Y494 HydrophobicContact CG-CE1 4.42Å; M492-Y494 PolarHBondContact O-N 3.46Å; M492-Y494 HydrophobicContact SD-CE1 4.12Å; M492-Y494 PolarHBondContact SD-OH 2.97Å; M492-L495 HydrophobicContact CB-CD1 4.16Å; M492-L495 HydrophobicContact CB-CG 4.5Å; M492-L495 HydrophobicContact CG-CD1 3.33Å; M492-L495 HydrophobicContact CG-CG 3.83Å; M492-L495 PolarHBondContact O-N 2.78Å
493	A	59.1	Low	56.4	Low	28 Å²	28	93 Å²	93	23%	0.231	53%	0.529	C	S	.	.	G	3₁₀ helix	trans	-47.1	-36.2	-171.9	0	0	0	0	0	114.9	I490 L495 T496 Q525 L528	I490-A493 HydrophobicContact CG2-CB 3.78Å; A493-L495 PolarHBondContact O-N 3.01Å; A493-L495 VanDerWaalsContact O-N 3.09Å; A493-T496 WeakPolarHBondContact O-CB 3.47Å; A493-T496 PolarHBondContact O-N 3.36Å; A493-T496 PolarHBondContact O-OG1 3.08Å; A493-Q525 HydrophobicContact CB-CG 4.35Å; A493-L528 VanDerWaalsContact C-CD1 3.44Å; A493-L528 HydrophobicContact CB-CD1 3.87Å; A493-L528 WeakPolarHBondContact O-CD1 3.41Å
494	Y	65.4	Low	58.6	Low	32 Å²	32	93.6 Å²	93.6	13%	0.125	53%	0.527	C	S	.	.	G	3₁₀ helix	trans	-54.5	-23.9	177.3	63.1	-100.2	0	0	0	115.2	M492 T496 L497 P503 C521	M492-Y494 HydrophobicContact CG-CE1 4.42Å; M492-Y494 PolarHBondContact O-N 3.46Å; M492-Y494 HydrophobicContact SD-CE1 4.12Å; M492-Y494 PolarHBondContact SD-OH 2.97Å; Y494-T496 PolarHBondContact O-N 3.29Å; Y494-L497 VanDerWaalsContact O-CB 3.26Å; Y494-L497 WeakPolarHBondContact O-CB 3.3Å; Y494-L497 WeakPolarHBondContact O-CG 3.45Å; Y494-L497 PolarHBondContact O-N 3.09Å; Y494-L497 VanDerWaalsContact O-N 3.11Å; Y494-P503 HydrophobicContact CD2-CG 3.87Å; Y494-P503 HydrophobicContact CE2-CG 4.43Å; Y494-P503 HydrophobicContact CG-CG 3.91Å; Y494-C521 HydrophobicContact CD1-CB 4.13Å; Y494-C521 HydrophobicContact CE1-CB 4.34Å; Y494-C521 VanDerWaalsContact CE1-SG 3.56Å
495	L	66.1	Low	60.7	Low	42 Å²	42	89.9 Å²	89.9	22%	0.22	52%	0.52	C	S	.	.	G	3₁₀ helix	trans	-68.2	-14	175.3	-66.3	-177.7	0	0	0	113.7	E193 M492 A493 L497 Q502	E193-L495 VanDerWaalsContact O-CD1 3.25Å; E193-L495 WeakPolarHBondContact O-CD1 3.31Å; M492-L495 HydrophobicContact CB-CD1 4.16Å; M492-L495 HydrophobicContact CB-CG 4.5Å; M492-L495 HydrophobicContact CG-CD1 3.33Å; M492-L495 HydrophobicContact CG-CG 3.83Å; M492-L495 PolarHBondContact O-N 2.78Å; A493-L495 PolarHBondContact O-N 3.01Å; A493-L495 VanDerWaalsContact O-N 3.09Å; L495-L497 VanDerWaalsContact C-N 3.26Å; L495-Q502 PolarHBondContact O-NE2 3.07Å
496	T	66.4	Low	63.4	Low	64 Å²	64	88.4 Å²	88.4	39%	0.393	50%	0.497	S	S	.	.	G	3₁₀ helix	trans	-78.7	-9.3	172.3	64.4	0	0	0	0	113.4	A493 Y494 L528	A493-T496 WeakPolarHBondContact O-CB 3.47Å; A493-T496 PolarHBondContact O-N 3.36Å; A493-T496 PolarHBondContact O-OG1 3.08Å; Y494-T496 PolarHBondContact O-N 3.29Å; T496-L528 WeakPolarHBondContact OG1-CD1 3.37Å; T496-L528 VanDerWaalsContact OG1-CD2 3.31Å; T496-L528 WeakPolarHBondContact OG1-CD2 3.42Å
497	L	70.9	Confident	65.3	Low	11 Å²	11	85.9 Å²	85.9	6%	0.058	48%	0.479	C	S	.	.	S	Bend	trans	-73.9	155.7	174.2	-62	178.8	0	0	0	112.5	Y494 L495 L501 Q502 A524 Y527 L528	Y494-L497 VanDerWaalsContact O-CB 3.26Å; Y494-L497 WeakPolarHBondContact O-CB 3.3Å; Y494-L497 WeakPolarHBondContact O-CG 3.45Å; Y494-L497 PolarHBondContact O-N 3.09Å; Y494-L497 VanDerWaalsContact O-N 3.11Å; L495-L497 VanDerWaalsContact C-N 3.26Å; L497-L501 HydrophobicContact CB-CB 4.19Å; L497-L501 HydrophobicContact CD1-CB 4.13Å; L497-L501 WeakPolarHBondContact CD1-O 3.49Å; L497-Q502 HydrophobicContact CB-CG 4.09Å; L497-Q502 PolarHBondContact O-NE2 2.85Å; L497-A524 HydrophobicContact CD1-CB 3.5Å; L497-Y527 HydrophobicContact CD2-CD1 3.38Å; L497-Y527 HydrophobicContact CD2-CE1 3.5Å; L497-Y527 HydrophobicContact CD2-CG 4.44Å; L497-L528 HydrophobicContact CD2-CD1 4.33Å; L497-L528 HydrophobicContact CD2-CD2 3.68Å; L497-L528 HydrophobicContact CD2-CG 3.83Å; L497-L528 HydrophobicContact CG-CD1 4.38Å; L497-L528 HydrophobicContact CG-CD2 4.44Å; L497-L528 HydrophobicContact CG-CG 4.41Å
498	D	69.2	Low	67.3	Low	129 Å²	129	84.3 Å²	84.3	69%	0.69	48%	0.476	S	S	*	.			trans	-57.4	143	163.8	-74	-50.3	0	0	0	110.9	Q500 L501 Q502	D498-Q500 PolarHBondContact O-N 3.49Å; D498-L501 PolarHBondContact O-N 2.85Å; D498-Q502 PolarHBondContact O-N 3.32Å
499	H	63.3	Low	69.6	Low	157 Å²	157	84.8 Å²	84.8	73%	0.727	48%	0.479	S	S	*	.	G	3₁₀ helix	trans	-53.5	-32.9	-169.5	179.8	53.2	0	0	0	114.7	L501 Q502	H499-L501 PolarHBondContact O-N 3.03Å; H499-Q502 PolarHBondContact O-N 3.07Å
500	Q	75.2	Confident	72.1	Confident	188 Å²	188	82.4 Å²	82.4	88%	0.879	46%	0.462	S	S	*	.	G	3₁₀ helix	trans	-70.1	-16.2	177.9	-64.1	-177.2	-3.5	0	0	114.2	D498	D498-Q500 PolarHBondContact O-N 3.49Å
501	L	73.1	Confident	74.1	Confident	89 Å²	89	86.7 Å²	86.7	47%	0.466	48%	0.478	S	S	.	.	G	3₁₀ helix	trans	-106.1	-3.1	180	-57.3	178.1	0	0	0	112.4	L497 D498 H499 Y527	L497-L501 HydrophobicContact CB-CB 4.19Å; L497-L501 HydrophobicContact CD1-CB 4.13Å; L497-L501 WeakPolarHBondContact CD1-O 3.49Å; D498-L501 PolarHBondContact O-N 2.85Å; H499-L501 PolarHBondContact O-N 3.03Å; L501-Y527 HydrophobicContact CD1-CE1 4.41Å; L501-Y527 HydrophobicContact CD1-CE2 4.49Å
502	Q	79.5	Confident	75.9	Confident	50 Å²	50	88.4 Å²	88.4	23%	0.234	48%	0.477	C	S	.	.	S	Bend	trans	-75.1	144.2	178.5	-66.8	-173.9	-1	0	0	111.4	L495 L497 D498 H499 L504	L495-Q502 PolarHBondContact O-NE2 3.07Å; L497-Q502 HydrophobicContact CB-CG 4.09Å; L497-Q502 PolarHBondContact O-NE2 2.85Å; D498-Q502 PolarHBondContact O-N 3.32Å; H499-Q502 PolarHBondContact O-N 3.07Å; Q502-L504 PolarHBondContact O-N 3.46Å
503	P	79.8	Confident	77.2	Confident	14 Å²	14	86 Å²	86	9%	0.091	47%	0.469	C	S	.	.	P	Polyproline II helix	trans	-56.5	128.6	169.6	-22.5	32.7	0	0	0	111.5	Y494 F517 H520	Y494-P503 HydrophobicContact CD2-CG 3.87Å; Y494-P503 HydrophobicContact CE2-CG 4.43Å; Y494-P503 HydrophobicContact CG-CG 3.91Å; P503-F517 HydrophobicContact CB-CD2 3.54Å; P503-F517 HydrophobicContact CB-CE2 3.67Å; P503-H520 HydrophobicContact CB-CB 3.75Å; P503-H520 HydrophobicContact CG-CB 3.91Å
504	L	78.8	Confident	78.3	Confident	149 Å²	149	88.6 Å²	88.6	78%	0.78	48%	0.477	S	S	*	.	P	Polyproline II helix	trans	-67.3	137.1	173.4	-66.4	175.7	0	0	0	110.2	Q502 F517	Q502-L504 PolarHBondContact O-N 3.46Å; L504-F517 VanDerWaalsContact O-CD2 3.24Å; L504-F517 WeakPolarHBondContact O-CD2 3.22Å
505	A	80.7	Confident	79.3	Confident	89 Å²	89	89.7 Å²	89.7	74%	0.736	49%	0.493	S	S	*	.	P	Polyproline II helix	trans	-56.2	130.9	-178.5	0	0	0	0	0	111.7
506	P	85.8	Confident	80	Confident	38 Å²	38	91.4 Å²	91.4	25%	0.247	51%	0.505	C	S	.	.	P	Polyproline II helix	trans	-75.5	146.8	-174.3	30.2	-34	0	0	0	111.6	P508 M514 F517	P506-P508 VanDerWaalsContact O-CD 3.25Å; P506-P508 WeakPolarHBondContact O-CD 3.44Å; P506-M514 HydrophobicContact CB-CG 4.12Å; P506-F517 HydrophobicContact CB-CB 3.81Å; P506-F517 HydrophobicContact CB-CD1 4.36Å; P506-F517 HydrophobicContact CB-CG 4.09Å; P506-F517 HydrophobicContact CG-CB 4.12Å; P506-F517 HydrophobicContact CG-CD1 3.76Å; P506-F517 HydrophobicContact CG-CD2 4.34Å; P506-F517 HydrophobicContact CG-CE1 4.2Å; P506-F517 HydrophobicContact CG-CG 3.82Å
507	C	83.8	Confident	81	Confident	78 Å²	78	90.6 Å²	90.6	53%	0.527	50%	0.496	S	S	.	.			trans	-75.1	111.6	167.7	-66.4	0	0	0	0	109	N509 S510 S513	C507-N509 PolarHBondContact O-N 3.02Å; C507-S510 PolarHBondContact O-N 3.38Å; C507-S513 PolarHBondContact N-OG 2.89Å
508	P	79.9	Confident	81.5	Confident	107 Å²	107	94.9 Å²	94.9	70%	0.695	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-18.4	-169.9	-24.9	36.1	0	0	0	114.9	P506	P506-P508 VanDerWaalsContact O-CD 3.25Å; P506-P508 WeakPolarHBondContact O-CD 3.44Å
509	N	89.1	Confident	82.3	Confident	170 Å²	170	94.4 Å²	94.4	91%	0.909	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.6	-0.4	-178.8	-61.9	-8.9	0	0	0	113.5	C507	C507-N509 PolarHBondContact O-N 3.02Å
510	S	91.8	Very high	83.2	Confident	36 Å²	36	91.1 Å²	91.1	25%	0.252	49%	0.494	S	S	.	.			trans	-119.6	120.7	175.8	163.7	0	0	0	0	110.4	C507 E512 S513 M514	C507-S510 PolarHBondContact O-N 3.38Å; S510-E512 PolarHBondContact O-N 3.33Å; S510-E512 PolarHBondContact OG-N 3.43Å; S510-E512 PolarHBondContact OG-OE2 2.88Å; S510-S513 PolarHBondContact O-N 2.7Å; S510-S513 PolarHBondContact OG-N 2.82Å; S510-M514 PolarHBondContact O-N 3.1Å; S510-M514 VanDerWaalsContact O-N 3.13Å
511	K	89.8	Confident	83.4	Confident	173 Å²	173	83 Å²	83	75%	0.752	46%	0.457	S	S	*	.	H	α-helix	trans	-67.2	-32.1	177.8	-63.5	-177	-179.7	-177.8	0	111.3	M514 A515	K511-M514 PolarHBondContact O-N 3.27Å; K511-A515 WeakPolarHBondContact O-CB 3.26Å; K511-A515 PolarHBondContact O-N 3.41Å
512	E	88.3	Confident	83.9	Confident	131 Å²	131	84.5 Å²	84.5	61%	0.612	46%	0.46	S	S	*	.	H	α-helix	trans	-66.2	-45.5	178	-50.9	67.8	-145.5	0	0	109.8	S510 A515 V516	S510-E512 PolarHBondContact O-N 3.33Å; S510-E512 PolarHBondContact OG-N 3.43Å; S510-E512 PolarHBondContact OG-OE2 2.88Å; E512-A515 PolarHBondContact O-N 3.25Å; E512-V516 WeakPolarHBondContact O-CG2 3.37Å; E512-V516 PolarHBondContact O-N 3.24Å
513	S	86.3	Confident	84	Confident	32 Å²	32	87.8 Å²	87.8	22%	0.224	48%	0.477	C	S	.	.	H	α-helix	trans	-64.3	-40.3	175.5	-174.7	0	0	0	0	112.4	C507 S510 F517	C507-S513 PolarHBondContact N-OG 2.89Å; S510-S513 PolarHBondContact O-N 2.7Å; S510-S513 PolarHBondContact OG-N 2.82Å; S513-F517 PolarHBondContact O-N 3.11Å; S513-F517 VanDerWaalsContact O-N 3.14Å
514	M	82.3	Confident	84	Confident	81 Å²	81	87.3 Å²	87.3	40%	0.399	48%	0.475	S	S	.	.	H	α-helix	trans	-64.4	-44.6	173.9	-69.6	-173.9	68	0	0	112.3	P506 S510 K511 V516 F517 E518	P506-M514 HydrophobicContact CB-CG 4.12Å; S510-M514 PolarHBondContact O-N 3.1Å; S510-M514 VanDerWaalsContact O-N 3.13Å; K511-M514 PolarHBondContact O-N 3.27Å; M514-V516 PolarHBondContact O-N 3.04Å; M514-F517 WeakPolarHBondContact O-CB 3.43Å; M514-F517 PolarHBondContact O-N 3.06Å; M514-E518 PolarHBondContact O-N 3.41Å
515	A	84.9	Confident	83.9	Confident	55 Å²	55	83 Å²	83	46%	0.455	45%	0.451	S	S	.	.	H	α-helix	trans	-62.3	-40.9	179.1	0	0	0	0	0	112.8	K511 E512 E518 Q519	K511-A515 WeakPolarHBondContact O-CB 3.26Å; K511-A515 PolarHBondContact O-N 3.41Å; E512-A515 PolarHBondContact O-N 3.25Å; A515-E518 PolarHBondContact O-N 3.48Å; A515-Q519 WeakPolarHBondContact O-CB 3.49Å; A515-Q519 PolarHBondContact O-N 3.4Å
516	V	82.4	Confident	84	Confident	78 Å²	78	83.4 Å²	83.4	47%	0.473	44%	0.437	S	S	.	.	H	α-helix	trans	-64.1	-41.9	174.8	171.4	0	0	0	0	111.3	E512 M514 Q519 H520	E512-V516 WeakPolarHBondContact O-CG2 3.37Å; E512-V516 PolarHBondContact O-N 3.24Å; M514-V516 PolarHBondContact O-N 3.04Å; V516-Q519 PolarHBondContact O-N 2.81Å; V516-H520 WeakPolarHBondContact O-CB 3.17Å; V516-H520 PolarHBondContact O-CD2 3.13Å; V516-H520 VanDerWaalsContact O-CD2 3.28Å; V516-H520 PolarHBondContact O-N 2.75Å
517	F	85.6	Confident	83.8	Confident	47 Å²	47	86.3 Å²	86.3	21%	0.206	44%	0.444	C	S	.	.	H	α-helix	trans	-62.2	-45.6	175.4	171.7	-104.2	0	0	0	112.1	P503 L504 P506 S513 M514 Q519 H520 C521	P503-F517 HydrophobicContact CB-CD2 3.54Å; P503-F517 HydrophobicContact CB-CE2 3.67Å; L504-F517 VanDerWaalsContact O-CD2 3.24Å; L504-F517 WeakPolarHBondContact O-CD2 3.22Å; P506-F517 HydrophobicContact CB-CB 3.81Å; P506-F517 HydrophobicContact CB-CD1 4.36Å; P506-F517 HydrophobicContact CB-CG 4.09Å; P506-F517 HydrophobicContact CG-CB 4.12Å; P506-F517 HydrophobicContact CG-CD1 3.76Å; P506-F517 HydrophobicContact CG-CD2 4.34Å; P506-F517 HydrophobicContact CG-CE1 4.2Å; P506-F517 HydrophobicContact CG-CG 3.82Å; S513-F517 PolarHBondContact O-N 3.11Å; S513-F517 VanDerWaalsContact O-N 3.14Å; M514-F517 WeakPolarHBondContact O-CB 3.43Å; M514-F517 PolarHBondContact O-N 3.06Å; F517-Q519 VanDerWaalsContact C-N 3.33Å; F517-Q519 PolarHBondContact O-N 3.39Å; F517-H520 PolarHBondContact O-N 2.89Å; F517-C521 PolarHBondContact O-N 3.27Å; F517-C521 PolarHBondContact O-SG 2.99Å
518	E	81.9	Confident	83.5	Confident	101 Å²	101	84.2 Å²	84.2	47%	0.472	43%	0.427	S	S	.	.	H	α-helix	trans	-61	-40	175.4	-74.8	-177.5	-153.4	0	0	112.6	M514 A515 C521 K522	M514-E518 PolarHBondContact O-N 3.41Å; A515-E518 PolarHBondContact O-N 3.48Å; E518-C521 PolarHBondContact O-N 3.22Å; E518-K522 WeakPolarHBondContact O-CG 3.44Å; E518-K522 PolarHBondContact O-N 3.23Å; E518-K522 VanDerWaalsContact O-N 3.11Å
519	Q	85.7	Confident	83.3	Confident	119 Å²	119	84.9 Å²	84.9	56%	0.556	42%	0.419	S	S	*	.	H	α-helix	trans	-64.8	-44.4	175.4	-176.8	175.2	-9.3	0	0	111.5	A515 V516 F517 C521 K522 M523	A515-Q519 WeakPolarHBondContact O-CB 3.49Å; A515-Q519 PolarHBondContact O-N 3.4Å; V516-Q519 PolarHBondContact O-N 2.81Å; F517-Q519 VanDerWaalsContact C-N 3.33Å; F517-Q519 PolarHBondContact O-N 3.39Å; Q519-C521 VanDerWaalsContact C-N 3.34Å; Q519-C521 PolarHBondContact O-N 3.32Å; Q519-K522 PolarHBondContact O-N 2.83Å; Q519-M523 HydrophobicContact CG-SD 4.37Å; Q519-M523 WeakPolarHBondContact O-CG 3.49Å; Q519-M523 PolarHBondContact O-N 3.34Å
520	H	82.6	Confident	82.9	Confident	89 Å²	89	80.2 Å²	80.2	41%	0.412	40%	0.397	S	S	.	.	H	α-helix	trans	-63.1	-38.2	175	-81.8	-137.1	0	0	0	111.9	P503 V516 F517 K522 M523 A524	P503-H520 HydrophobicContact CB-CB 3.75Å; P503-H520 HydrophobicContact CG-CB 3.91Å; V516-H520 WeakPolarHBondContact O-CB 3.17Å; V516-H520 PolarHBondContact O-CD2 3.13Å; V516-H520 VanDerWaalsContact O-CD2 3.28Å; V516-H520 PolarHBondContact O-N 2.75Å; F517-H520 PolarHBondContact O-N 2.89Å; H520-K522 VanDerWaalsContact C-N 3.35Å; H520-K522 PolarHBondContact O-N 3.36Å; H520-M523 PolarHBondContact O-N 3.05Å; H520-A524 VanDerWaalsContact O-CB 3.27Å; H520-A524 WeakPolarHBondContact O-CB 3.48Å; H520-A524 PolarHBondContact O-N 2.69Å
521	C	80.2	Confident	82.4	Confident	16 Å²	16	82.2 Å²	82.2	11%	0.108	40%	0.402	C	S	.	.	H	α-helix	trans	-60.3	-42.4	174.5	-68.8	0	0	0	0	112.2	Y494 F517 E518 Q519 A524 Q525	Y494-C521 HydrophobicContact CD1-CB 4.13Å; Y494-C521 HydrophobicContact CE1-CB 4.34Å; Y494-C521 VanDerWaalsContact CE1-SG 3.56Å; F517-C521 PolarHBondContact O-N 3.27Å; F517-C521 PolarHBondContact O-SG 2.99Å; E518-C521 PolarHBondContact O-N 3.22Å; Q519-C521 VanDerWaalsContact C-N 3.34Å; Q519-C521 PolarHBondContact O-N 3.32Å; C521-A524 PolarHBondContact O-N 3.07Å; C521-Q525 WeakPolarHBondContact O-CG 3.34Å; C521-Q525 PolarHBondContact O-N 3.5Å
522	K	82.2	Confident	81.7	Confident	122 Å²	122	76.4 Å²	76.4	53%	0.53	38%	0.381	S	S	.	.	H	α-helix	trans	-66.4	-46	175.9	-70.3	164.2	-177	164.5	0	111.6	E518 Q519 H520 A524 Q525 E526	E518-K522 WeakPolarHBondContact O-CG 3.44Å; E518-K522 PolarHBondContact O-N 3.23Å; E518-K522 VanDerWaalsContact O-N 3.11Å; Q519-K522 PolarHBondContact O-N 2.83Å; H520-K522 VanDerWaalsContact C-N 3.35Å; H520-K522 PolarHBondContact O-N 3.36Å; K522-A524 VanDerWaalsContact C-N 3.28Å; K522-A524 PolarHBondContact O-N 3.28Å; K522-Q525 WeakPolarHBondContact O-CB 3.44Å; K522-Q525 PolarHBondContact O-N 3.48Å; K522-E526 PolarHBondContact O-N 2.67Å; K522-E526 VanDerWaalsContact O-N 3.07Å
523	M	81.8	Confident	81.4	Confident	118 Å²	118	75.9 Å²	75.9	58%	0.581	38%	0.379	S	S	*	.	H	α-helix	trans	-60.1	-38.3	175.6	-72.2	177.9	61.8	0	0	112.5	Q519 H520 E526 Y527	Q519-M523 HydrophobicContact CG-SD 4.37Å; Q519-M523 WeakPolarHBondContact O-CG 3.49Å; Q519-M523 PolarHBondContact O-N 3.34Å; H520-M523 PolarHBondContact O-N 3.05Å; M523-E526 PolarHBondContact O-N 3.26Å; M523-Y527 WeakPolarHBondContact O-CB 3.48Å; M523-Y527 PolarHBondContact O-N 3.06Å
524	A	79.9	Confident	81.3	Confident	5 Å²	5	77.8 Å²	77.8	4%	0.041	39%	0.386	C	S	.	.	H	α-helix	trans	-66.9	-37.8	175.7	0	0	0	0	0	112.9	L497 H520 C521 K522 L528	L497-A524 HydrophobicContact CD1-CB 3.5Å; H520-A524 VanDerWaalsContact O-CB 3.27Å; H520-A524 WeakPolarHBondContact O-CB 3.48Å; H520-A524 PolarHBondContact O-N 2.69Å; C521-A524 PolarHBondContact O-N 3.07Å; K522-A524 VanDerWaalsContact C-N 3.28Å; K522-A524 PolarHBondContact O-N 3.28Å; A524-L528 WeakPolarHBondContact O-CD1 3.29Å; A524-L528 VanDerWaalsContact O-CG 3.29Å; A524-L528 WeakPolarHBondContact O-CG 3.27Å; A524-L528 PolarHBondContact O-N 3.11Å
525	Q	77.8	Confident	81.2	Confident	59 Å²	59	75.8 Å²	75.8	28%	0.276	38%	0.382	S	S	.	.	H	α-helix	trans	-61.7	-47.2	171.9	-74.1	168.5	-21.8	0	0	111.4	I490 A493 C521 K522 L528 K529	I490-Q525 PolarHBondContact O-NE2 2.89Å; A493-Q525 HydrophobicContact CB-CG 4.35Å; C521-Q525 WeakPolarHBondContact O-CG 3.34Å; C521-Q525 PolarHBondContact O-N 3.5Å; K522-Q525 WeakPolarHBondContact O-CB 3.44Å; K522-Q525 PolarHBondContact O-N 3.48Å; Q525-L528 PolarHBondContact O-N 3.32Å; Q525-K529 WeakPolarHBondContact O-CG 3.38Å; Q525-K529 PolarHBondContact O-N 3.11Å; Q525-K529 VanDerWaalsContact O-N 3.11Å
526	E	81.9	Confident	81.1	Confident	96 Å²	96	78.2 Å²	78.2	45%	0.449	39%	0.387	S	S	.	.	H	α-helix	trans	-65.2	-41.2	177.5	-60.8	-46	126.8	0	0	112.5	K522 M523 L528 K529 V530	K522-E526 PolarHBondContact O-N 2.67Å; K522-E526 VanDerWaalsContact O-N 3.07Å; M523-E526 PolarHBondContact O-N 3.26Å; E526-L528 VanDerWaalsContact C-N 3.28Å; E526-L528 PolarHBondContact O-N 3.46Å; E526-K529 WeakPolarHBondContact O-CB 3.48Å; E526-K529 PolarHBondContact O-N 3.14Å; E526-K529 WeakPolarHBondContact OE1-CE 3.41Å; E526-K529 IonicContact OE1-NZ 2.78Å; E526-K529 PolarHBondContact OE1-NZ 3.21Å; E526-K529 WeakPolarHBondContact OE2-CD 3.38Å; E526-K529 IonicContact OE2-NZ 2.75Å; E526-K529 PolarHBondContact OE2-NZ 2.96Å; E526-V530 WeakPolarHBondContact O-CG2 3.37Å; E526-V530 PolarHBondContact O-N 2.93Å
527	Y	82	Confident	81.3	Confident	99 Å²	99	79.7 Å²	79.7	39%	0.388	39%	0.391	S	S	.	.	H	α-helix	trans	-57	-42.5	173.9	178.1	-82.7	0	0	0	111.6	L497 L501 M523 V530 Q531	L497-Y527 HydrophobicContact CD2-CD1 3.38Å; L497-Y527 HydrophobicContact CD2-CE1 3.5Å; L497-Y527 HydrophobicContact CD2-CG 4.44Å; L501-Y527 HydrophobicContact CD1-CE1 4.41Å; L501-Y527 HydrophobicContact CD1-CE2 4.49Å; M523-Y527 WeakPolarHBondContact O-CB 3.48Å; M523-Y527 PolarHBondContact O-N 3.06Å; Y527-V530 PolarHBondContact O-N 3.03Å; Y527-Q531 HydrophobicContact CD1-CG 3.73Å; Y527-Q531 HydrophobicContact CE1-CG 3.34Å; Y527-Q531 HydrophobicContact CE2-CG 4.46Å; Y527-Q531 HydrophobicContact CG-CG 4.45Å; Y527-Q531 WeakPolarHBondContact O-CG 3.47Å; Y527-Q531 PolarHBondContact O-N 2.78Å; Y527-Q531 PolarHBondContact OH-NE2 2.94Å
528	L	76.5	Confident	81.3	Confident	35 Å²	35	82.3 Å²	82.3	18%	0.183	41%	0.407	C	S	.	.	H	α-helix	trans	-68.6	-34.7	179.3	-74	164.5	0	0	0	113.1	A493 T496 L497 A524 Q525 E526 T532	A493-L528 VanDerWaalsContact C-CD1 3.44Å; A493-L528 HydrophobicContact CB-CD1 3.87Å; A493-L528 WeakPolarHBondContact O-CD1 3.41Å; T496-L528 WeakPolarHBondContact OG1-CD1 3.37Å; T496-L528 VanDerWaalsContact OG1-CD2 3.31Å; T496-L528 WeakPolarHBondContact OG1-CD2 3.42Å; L497-L528 HydrophobicContact CD2-CD1 4.33Å; L497-L528 HydrophobicContact CD2-CD2 3.68Å; L497-L528 HydrophobicContact CD2-CG 3.83Å; L497-L528 HydrophobicContact CG-CD1 4.38Å; L497-L528 HydrophobicContact CG-CD2 4.44Å; L497-L528 HydrophobicContact CG-CG 4.41Å; A524-L528 WeakPolarHBondContact O-CD1 3.29Å; A524-L528 VanDerWaalsContact O-CG 3.29Å; A524-L528 WeakPolarHBondContact O-CG 3.27Å; A524-L528 PolarHBondContact O-N 3.11Å; Q525-L528 PolarHBondContact O-N 3.32Å; E526-L528 VanDerWaalsContact C-N 3.28Å; E526-L528 PolarHBondContact O-N 3.46Å; L528-T532 WeakPolarHBondContact O-CB 3.38Å; L528-T532 PolarHBondContact O-N 3.1Å; L528-T532 PolarHBondContact O-OG1 3.35Å
529	K	77.4	Confident	81.6	Confident	120 Å²	120	82.7 Å²	82.7	52%	0.522	41%	0.408	S	S	.	.	H	α-helix	trans	-60.3	-50.9	169.7	-65.9	174	-168.4	168.5	0	110.4	Q525 E526 Q531 T532 E533	Q525-K529 WeakPolarHBondContact O-CG 3.38Å; Q525-K529 PolarHBondContact O-N 3.11Å; Q525-K529 VanDerWaalsContact O-N 3.11Å; E526-K529 WeakPolarHBondContact O-CB 3.48Å; E526-K529 PolarHBondContact O-N 3.14Å; E526-K529 WeakPolarHBondContact OE1-CE 3.41Å; E526-K529 IonicContact OE1-NZ 2.78Å; E526-K529 PolarHBondContact OE1-NZ 3.21Å; E526-K529 WeakPolarHBondContact OE2-CD 3.38Å; E526-K529 IonicContact OE2-NZ 2.75Å; E526-K529 PolarHBondContact OE2-NZ 2.96Å; K529-Q531 PolarHBondContact O-N 2.84Å; K529-T532 WeakPolarHBondContact O-CB 3.37Å; K529-T532 PolarHBondContact O-N 3.08Å; K529-T532 VanDerWaalsContact O-N 3.12Å; K529-E533 PolarHBondContact O-N 2.9Å
530	V	80.8	Confident	81.7	Confident	72 Å²	72	81.7 Å²	81.7	44%	0.436	40%	0.4	S	S	.	.	H	α-helix	trans	-62.8	-41.4	-179.5	173.7	0	0	0	0	111.9	E526 Y527 T532 E533 I534	E526-V530 WeakPolarHBondContact O-CG2 3.37Å; E526-V530 PolarHBondContact O-N 2.93Å; Y527-V530 PolarHBondContact O-N 3.03Å; V530-T532 VanDerWaalsContact C-N 3.33Å; V530-T532 PolarHBondContact O-N 3.36Å; V530-E533 PolarHBondContact O-N 3.28Å; V530-I534 HydrophobicContact CG1-CD1 3.81Å; V530-I534 HydrophobicContact CG1-CG1 4.43Å; V530-I534 WeakPolarHBondContact O-CB 3.37Å; V530-I534 VanDerWaalsContact O-CG1 3.25Å; V530-I534 WeakPolarHBondContact O-CG1 3.39Å; V530-I534 PolarHBondContact O-N 2.78Å
531	Q	79.9	Confident	82.1	Confident	78 Å²	78	84 Å²	84	36%	0.364	41%	0.409	S	S	.	.	H	α-helix	trans	-63.8	-37.2	173.7	-71.1	-57.7	-35.3	0	0	112.5	Y527 K529 A535	Y527-Q531 HydrophobicContact CD1-CG 3.73Å; Y527-Q531 HydrophobicContact CE1-CG 3.34Å; Y527-Q531 HydrophobicContact CE2-CG 4.46Å; Y527-Q531 HydrophobicContact CG-CG 4.45Å; Y527-Q531 WeakPolarHBondContact O-CG 3.47Å; Y527-Q531 PolarHBondContact O-N 2.78Å; Y527-Q531 PolarHBondContact OH-NE2 2.94Å; K529-Q531 PolarHBondContact O-N 2.84Å; Q531-A535 WeakPolarHBondContact O-CB 3.46Å; Q531-A535 PolarHBondContact O-N 2.75Å
532	T	74.4	Confident	82.5	Confident	52 Å²	52	87.5 Å²	87.5	32%	0.319	43%	0.429	S	S	.	.	H	α-helix	trans	-66.7	-42.4	176.1	-56.8	0	0	0	0	111.1	F228 L528 K529 V530 A535 L536	F228-T532 HydrophobicContact CZ-CG2 4.41Å; L528-T532 WeakPolarHBondContact O-CB 3.38Å; L528-T532 PolarHBondContact O-N 3.1Å; L528-T532 PolarHBondContact O-OG1 3.35Å; K529-T532 WeakPolarHBondContact O-CB 3.37Å; K529-T532 PolarHBondContact O-N 3.08Å; K529-T532 VanDerWaalsContact O-N 3.12Å; V530-T532 VanDerWaalsContact C-N 3.33Å; V530-T532 PolarHBondContact O-N 3.36Å; T532-A535 PolarHBondContact O-N 3.41Å; T532-L536 HydrophobicContact CG2-CD1 4.33Å; T532-L536 WeakPolarHBondContact O-CG 3.26Å; T532-L536 PolarHBondContact O-N 2.86Å
533	E	83.9	Confident	82.9	Confident	119 Å²	119	85 Å²	85	56%	0.556	42%	0.419	S	S	*	.	H	α-helix	trans	-63.4	-45.7	175	-172.8	175.7	-169.6	0	0	111.8	K529 V530 A535 L536 L537	K529-E533 PolarHBondContact O-N 2.9Å; V530-E533 PolarHBondContact O-N 3.28Å; E533-A535 VanDerWaalsContact C-N 3.31Å; E533-A535 PolarHBondContact O-N 3.46Å; E533-L536 PolarHBondContact O-N 3.21Å; E533-L537 HydrophobicContact CG-CD1 4.1Å; E533-L537 WeakPolarHBondContact O-CB 3.45Å; E533-L537 VanDerWaalsContact O-CG 3.31Å; E533-L537 WeakPolarHBondContact O-CG 3.31Å; E533-L537 PolarHBondContact O-N 2.96Å
534	I	84	Confident	83.4	Confident	72 Å²	72	83.6 Å²	83.6	37%	0.369	41%	0.414	S	S	.	.	H	α-helix	trans	-57.5	-43.6	173.7	-71.3	166.7	0	0	0	111	V530 L537 I538	V530-I534 HydrophobicContact CG1-CD1 3.81Å; V530-I534 HydrophobicContact CG1-CG1 4.43Å; V530-I534 WeakPolarHBondContact O-CB 3.37Å; V530-I534 VanDerWaalsContact O-CG1 3.25Å; V530-I534 WeakPolarHBondContact O-CG1 3.39Å; V530-I534 PolarHBondContact O-N 2.78Å; I534-L537 PolarHBondContact O-N 2.97Å; I534-I538 HydrophobicContact CG2-CD1 3.73Å; I534-I538 HydrophobicContact CG2-CG1 4.44Å; I534-I538 WeakPolarHBondContact O-CB 3.31Å; I534-I538 VanDerWaalsContact O-CG1 3.26Å; I534-I538 WeakPolarHBondContact O-CG1 3.48Å; I534-I538 PolarHBondContact O-N 2.97Å
535	A	78.9	Confident	84	Confident	40 Å²	40	87.4 Å²	87.4	33%	0.331	43%	0.433	S	S	.	.	H	α-helix	trans	-63.7	-41.4	177.7	0	0	0	0	0	112.5	Q531 T532 E533 I538 Q539	Q531-A535 WeakPolarHBondContact O-CB 3.46Å; Q531-A535 PolarHBondContact O-N 2.75Å; T532-A535 PolarHBondContact O-N 3.41Å; E533-A535 VanDerWaalsContact C-N 3.31Å; E533-A535 PolarHBondContact O-N 3.46Å; A535-I538 PolarHBondContact O-N 3.07Å; A535-Q539 PolarHBondContact O-N 2.93Å
536	L	82.3	Confident	84.6	Confident	105 Å²	105	87.4 Å²	87.4	55%	0.55	44%	0.443	S	S	.	.	H	α-helix	trans	-65.7	-40.6	175.3	-70.3	168.8	0	0	0	112	T532 E533 Q539 R540	T532-L536 HydrophobicContact CG2-CD1 4.33Å; T532-L536 WeakPolarHBondContact O-CG 3.26Å; T532-L536 PolarHBondContact O-N 2.86Å; E533-L536 PolarHBondContact O-N 3.21Å; L536-Q539 PolarHBondContact O-N 3Å; L536-R540 PolarHBondContact O-N 3.41Å
537	L	88.4	Confident	85.1	Confident	109 Å²	109	87 Å²	87	57%	0.571	44%	0.441	S	S	*	.	H	α-helix	trans	-65.8	-38.1	175.4	-70.6	170.1	0	0	0	112.1	E533 I534 K541	E533-L537 HydrophobicContact CG-CD1 4.1Å; E533-L537 WeakPolarHBondContact O-CB 3.45Å; E533-L537 VanDerWaalsContact O-CG 3.31Å; E533-L537 WeakPolarHBondContact O-CG 3.31Å; E533-L537 PolarHBondContact O-N 2.96Å; I534-L537 PolarHBondContact O-N 2.97Å; L537-K541 WeakPolarHBondContact O-CB 3.47Å; L537-K541 PolarHBondContact O-N 3.11Å
538	I	85.3	Confident	85.6	Confident	102 Å²	102	87.2 Å²	87.2	52%	0.523	45%	0.448	S	S	.	.	H	α-helix	trans	-65.3	-41.3	172.9	-71.4	166.9	0	0	0	111.1	I534 A535 K541 T542	I534-I538 HydrophobicContact CG2-CD1 3.73Å; I534-I538 HydrophobicContact CG2-CG1 4.44Å; I534-I538 WeakPolarHBondContact O-CB 3.31Å; I534-I538 VanDerWaalsContact O-CG1 3.26Å; I534-I538 WeakPolarHBondContact O-CG1 3.48Å; I534-I538 PolarHBondContact O-N 2.97Å; A535-I538 PolarHBondContact O-N 3.07Å; I538-K541 PolarHBondContact O-N 2.71Å; I538-T542 PolarHBondContact O-N 3.38Å; I538-T542 PolarHBondContact O-OG1 2.9Å
539	Q	87	Confident	86.3	Confident	109 Å²	109	89.2 Å²	89.2	51%	0.509	46%	0.459	S	S	.	.	H	α-helix	trans	-61.5	-52.4	174.5	-173.4	-173	-43.5	0	0	110.7	A535 L536 K541 T542 E543	A535-Q539 PolarHBondContact O-N 2.93Å; L536-Q539 PolarHBondContact O-N 3Å; Q539-K541 VanDerWaalsContact C-N 3.27Å; Q539-K541 PolarHBondContact O-N 3.25Å; Q539-T542 WeakPolarHBondContact O-CA 3.34Å; Q539-T542 WeakPolarHBondContact O-CB 3.26Å; Q539-T542 PolarHBondContact O-N 2.94Å; Q539-E543 WeakPolarHBondContact CG-OE1 3.37Å; Q539-E543 PolarHBondContact NE2-OE1 3.47Å; Q539-E543 PolarHBondContact O-N 2.95Å
540	R	89	Confident	87	Confident	99 Å²	99	87.7 Å²	87.7	37%	0.374	45%	0.454	S	S	.	.	H	α-helix	trans	-64.2	-31.3	-178.9	-173	61.9	-162.2	144.9	11.7	112.6	L536 E543 L544 E547	L536-R540 PolarHBondContact O-N 3.41Å; R540-E543 WeakPolarHBondContact CD-OE2 3.25Å; R540-E543 IonicContact CZ-OE2 2.67Å; R540-E543 IonicContact NE-OE2 2.96Å; R540-E543 IonicContact NH1-OE2 2.65Å; R540-E543 PolarHBondContact NH1-OE2 2.93Å; R540-E543 PolarHBondContact O-N 3.3Å; R540-L544 HydrophobicContact CG-CD1 4.25Å; R540-L544 WeakPolarHBondContact O-CB 3.33Å; R540-L544 VanDerWaalsContact O-CG 3.31Å; R540-L544 WeakPolarHBondContact O-CG 3.36Å; R540-L544 PolarHBondContact O-N 2.86Å; R540-E547 IonicContact CZ-OE1 2.67Å; R540-E547 VanDerWaalsContact CZ-OE1 3.25Å; R540-E547 IonicContact CZ-OE2 3.71Å; R540-E547 IonicContact NH1-OE1 3.79Å; R540-E547 PolarHBondContact NH1-OE1 3.18Å; R540-E547 VanDerWaalsContact NH2-CD 3.3Å; R540-E547 IonicContact NH2-OE1 3.6Å; R540-E547 PolarHBondContact NH2-OE1 3.02Å; R540-E547 IonicContact NH2-OE2 3.39Å; R540-E547 PolarHBondContact NH2-OE2 3.28Å
541	K	91.3	Very high	87.5	Confident	138 Å²	138	90 Å²	90	60%	0.6	46%	0.464	S	S	*	.	H	α-helix	trans	-61.6	-44.4	169.3	177.6	-176.4	172.3	-174.9	0	111.8	L537 I538 Q539 L544 I545	L537-K541 WeakPolarHBondContact O-CB 3.47Å; L537-K541 PolarHBondContact O-N 3.11Å; I538-K541 PolarHBondContact O-N 2.71Å; Q539-K541 VanDerWaalsContact C-N 3.27Å; Q539-K541 PolarHBondContact O-N 3.25Å; K541-L544 PolarHBondContact O-N 3.48Å; K541-I545 HydrophobicContact CG-CD1 4.02Å; K541-I545 VanDerWaalsContact O-CG1 3.3Å; K541-I545 WeakPolarHBondContact O-CG1 3.44Å; K541-I545 PolarHBondContact O-N 3.37Å
542	T	88.4	Confident	88.1	Confident	89 Å²	89	91.4 Å²	91.4	55%	0.546	47%	0.47	S	S	.	.	H	α-helix	trans	-64.9	-40.2	178	-55.7	0	0	0	0	111.5	I538 Q539 I545 A546	I538-T542 PolarHBondContact O-N 3.38Å; I538-T542 PolarHBondContact O-OG1 2.9Å; Q539-T542 WeakPolarHBondContact O-CA 3.34Å; Q539-T542 WeakPolarHBondContact O-CB 3.26Å; Q539-T542 PolarHBondContact O-N 2.94Å; T542-I545 PolarHBondContact O-N 3.32Å; T542-A546 PolarHBondContact O-N 3.36Å; T542-A546 VanDerWaalsContact O-N 3.07Å
543	E	90.4	Very high	88.9	Confident	68 Å²	68	93.5 Å²	93.5	32%	0.318	48%	0.475	S	S	.	.	H	α-helix	trans	-60.9	-48.7	173.5	-66.9	168.3	-168.6	0	0	111.7	Q539 R540 I545 A546 E547	Q539-E543 WeakPolarHBondContact CG-OE1 3.37Å; Q539-E543 PolarHBondContact NE2-OE1 3.47Å; Q539-E543 PolarHBondContact O-N 2.95Å; R540-E543 WeakPolarHBondContact CD-OE2 3.25Å; R540-E543 IonicContact CZ-OE2 2.67Å; R540-E543 IonicContact NE-OE2 2.96Å; R540-E543 IonicContact NH1-OE2 2.65Å; R540-E543 PolarHBondContact NH1-OE2 2.93Å; R540-E543 PolarHBondContact O-N 3.3Å; E543-I545 VanDerWaalsContact C-N 3.28Å; E543-I545 PolarHBondContact O-N 3.47Å; E543-A546 PolarHBondContact O-N 3.31Å; E543-A546 VanDerWaalsContact O-N 3.09Å; E543-E547 WeakPolarHBondContact O-CG 3.27Å; E543-E547 PolarHBondContact O-N 3.38Å
544	L	91.5	Very high	89.3	Confident	90 Å²	90	91.2 Å²	91.2	47%	0.471	47%	0.466	S	S	.	.	H	α-helix	trans	-61.5	-32.1	177.3	-75.4	165.4	0	0	0	113.5	R540 K541 L548	R540-L544 HydrophobicContact CG-CD1 4.25Å; R540-L544 WeakPolarHBondContact O-CB 3.33Å; R540-L544 VanDerWaalsContact O-CG 3.31Å; R540-L544 WeakPolarHBondContact O-CG 3.36Å; R540-L544 PolarHBondContact O-N 2.86Å; K541-L544 PolarHBondContact O-N 3.48Å; L544-L548 WeakPolarHBondContact O-CB 3.39Å; L544-L548 PolarHBondContact O-N 2.69Å; L544-L548 VanDerWaalsContact O-N 3.08Å
545	I	92	Very high	89.7	Confident	84 Å²	84	94.4 Å²	94.4	43%	0.431	48%	0.48	S	S	.	.	H	α-helix	trans	-68.7	-43.9	173	-69.9	163.9	0	0	0	110.2	K541 T542 E543 E547 L548 D549	K541-I545 HydrophobicContact CG-CD1 4.02Å; K541-I545 VanDerWaalsContact O-CG1 3.3Å; K541-I545 WeakPolarHBondContact O-CG1 3.44Å; K541-I545 PolarHBondContact O-N 3.37Å; T542-I545 PolarHBondContact O-N 3.32Å; E543-I545 VanDerWaalsContact C-N 3.28Å; E543-I545 PolarHBondContact O-N 3.47Å; I545-E547 VanDerWaalsContact C-N 3.35Å; I545-E547 PolarHBondContact O-N 2.89Å; I545-L548 PolarHBondContact O-N 2.95Å; I545-D549 WeakPolarHBondContact O-CB 3.2Å; I545-D549 PolarHBondContact O-N 3.46Å
546	A	90.1	Very high	90.3	Very high	59 Å²	59	97.2 Å²	97.2	49%	0.488	49%	0.486	S	S	.	.	H	α-helix	trans	-67.4	-33.5	177.5	0	0	0	0	0	113.1	T542 E543 Q550	T542-A546 PolarHBondContact O-N 3.36Å; T542-A546 VanDerWaalsContact O-N 3.07Å; E543-A546 PolarHBondContact O-N 3.31Å; E543-A546 VanDerWaalsContact O-N 3.09Å; A546-Q550 PolarHBondContact O-N 3.06Å
547	E	93.1	Very high	90.8	Very high	88 Å²	88	95.5 Å²	95.5	41%	0.411	48%	0.478	S	S	.	.	H	α-helix	trans	-61.4	-49.8	170.2	-72.5	166	-153.3	0	0	110.4	R540 E543 I545 Q550 D551	R540-E547 IonicContact CZ-OE1 2.67Å; R540-E547 VanDerWaalsContact CZ-OE1 3.25Å; R540-E547 IonicContact CZ-OE2 3.71Å; R540-E547 IonicContact NH1-OE1 3.79Å; R540-E547 PolarHBondContact NH1-OE1 3.18Å; R540-E547 VanDerWaalsContact NH2-CD 3.3Å; R540-E547 IonicContact NH2-OE1 3.6Å; R540-E547 PolarHBondContact NH2-OE1 3.02Å; R540-E547 IonicContact NH2-OE2 3.39Å; R540-E547 PolarHBondContact NH2-OE2 3.28Å; E543-E547 WeakPolarHBondContact O-CG 3.27Å; E543-E547 PolarHBondContact O-N 3.38Å; I545-E547 VanDerWaalsContact C-N 3.35Å; I545-E547 PolarHBondContact O-N 2.89Å; E547-Q550 WeakPolarHBondContact O-CB 3.34Å; E547-Q550 PolarHBondContact O-N 3.37Å; E547-Q550 VanDerWaalsContact O-N 3.11Å; E547-D551 PolarHBondContact O-N 3.07Å
548	L	92.8	Very high	91	Very high	103 Å²	103	94.3 Å²	94.3	54%	0.539	48%	0.475	S	S	.	.	H	α-helix	trans	-67.4	-39.7	-180	-172.5	141.5	0	0	0	113.4	L544 I545 Q550 D551 E552	L544-L548 WeakPolarHBondContact O-CB 3.39Å; L544-L548 PolarHBondContact O-N 2.69Å; L544-L548 VanDerWaalsContact O-N 3.08Å; I545-L548 PolarHBondContact O-N 2.95Å; L548-Q550 PolarHBondContact O-N 3.41Å; L548-D551 PolarHBondContact O-N 3.47Å; L548-E552 PolarHBondContact O-N 3.5Å; L548-E552 VanDerWaalsContact O-N 3.07Å
549	D	92.1	Very high	91.4	Very high	78 Å²	78	92.9 Å²	92.9	42%	0.417	47%	0.474	S	S	.	.	H	α-helix	trans	-59.7	-26.7	172	-86.4	5.5	0	0	0	112	I545 K553	I545-D549 WeakPolarHBondContact O-CB 3.2Å; I545-D549 PolarHBondContact O-N 3.46Å; D549-K553 WeakPolarHBondContact O-CE 3.44Å; D549-K553 VanDerWaalsContact O-CG 3.31Å; D549-K553 WeakPolarHBondContact O-CG 3.49Å; D549-K553 PolarHBondContact O-NZ 2.87Å
550	Q	91.4	Very high	91.7	Very high	88 Å²	88	95.1 Å²	95.1	41%	0.411	48%	0.478	S	S	.	.	H	α-helix	trans	-84.1	-43.6	177.2	-176.3	56.2	37.8	0	0	111.3	A546 E547 L548 E552 K553 D554	A546-Q550 PolarHBondContact O-N 3.06Å; E547-Q550 WeakPolarHBondContact O-CB 3.34Å; E547-Q550 PolarHBondContact O-N 3.37Å; E547-Q550 VanDerWaalsContact O-N 3.11Å; L548-Q550 PolarHBondContact O-N 3.41Å; Q550-E552 VanDerWaalsContact C-N 3.3Å; Q550-E552 PolarHBondContact O-N 3.45Å; Q550-K553 WeakPolarHBondContact O-CB 3.37Å; Q550-K553 PolarHBondContact O-N 2.72Å; Q550-D554 VanDerWaalsContact NE2-CG 3.27Å; Q550-D554 PolarHBondContact NE2-OD1 3.4Å; Q550-D554 PolarHBondContact NE2-OD2 2.84Å; Q550-D554 PolarHBondContact O-N 3.36Å
551	D	91.7	Very high	91.9	Very high	119 Å²	119	95.7 Å²	95.7	64%	0.636	49%	0.487	S	S	*	.	H	α-helix	trans	-56.5	-40.5	174.7	-82.5	-10.6	0	0	0	112.1	E547 L548 K553 D554 Q555	E547-D551 PolarHBondContact O-N 3.07Å; L548-D551 PolarHBondContact O-N 3.47Å; D551-K553 PolarHBondContact O-N 3.09Å; D551-D554 PolarHBondContact O-N 2.85Å; D551-Q555 WeakPolarHBondContact O-CB 3.32Å; D551-Q555 PolarHBondContact O-N 3.15Å
552	E	92.6	Very high	92.1	Very high	108 Å²	108	93.7 Å²	93.7	51%	0.505	49%	0.487	S	S	.	.	H	α-helix	trans	-60.9	-42.2	173.8	-80.9	-151.5	158.8	0	0	112.5	L548 Q550 Q555 Q556	L548-E552 PolarHBondContact O-N 3.5Å; L548-E552 VanDerWaalsContact O-N 3.07Å; Q550-E552 VanDerWaalsContact C-N 3.3Å; Q550-E552 PolarHBondContact O-N 3.45Å; E552-Q555 PolarHBondContact O-N 3.3Å; E552-Q556 WeakPolarHBondContact O-CB 3.25Å; E552-Q556 VanDerWaalsContact O-CG 3.29Å; E552-Q556 WeakPolarHBondContact O-CG 3.33Å; E552-Q556 PolarHBondContact O-N 2.79Å
553	K	91.3	Very high	92.4	Very high	97 Å²	97	96.3 Å²	96.3	42%	0.422	49%	0.493	S	S	.	.	H	α-helix	trans	-65.5	-41.3	179.5	-67.1	173.8	-166.4	98.5	0	111	D549 Q550 D551 Q556 N557	D549-K553 WeakPolarHBondContact O-CE 3.44Å; D549-K553 VanDerWaalsContact O-CG 3.31Å; D549-K553 WeakPolarHBondContact O-CG 3.49Å; D549-K553 PolarHBondContact O-NZ 2.87Å; Q550-K553 WeakPolarHBondContact O-CB 3.37Å; Q550-K553 PolarHBondContact O-N 2.72Å; D551-K553 PolarHBondContact O-N 3.09Å; K553-Q556 PolarHBondContact O-N 3.01Å; K553-N557 WeakPolarHBondContact O-CB 3.21Å; K553-N557 VanDerWaalsContact O-CG 3.29Å; K553-N557 PolarHBondContact O-N 2.72Å; K553-N557 PolarHBondContact O-ND2 3.3Å
554	D	91.6	Very high	92.6	Very high	70 Å²	70	98.6 Å²	98.6	37%	0.374	50%	0.504	S	S	.	.	H	α-helix	trans	-75.1	-30.2	-179.5	-69	-27.7	0	0	0	112.2	Q550 D551 T558	Q550-D554 VanDerWaalsContact NE2-CG 3.27Å; Q550-D554 PolarHBondContact NE2-OD1 3.4Å; Q550-D554 PolarHBondContact NE2-OD2 2.84Å; Q550-D554 PolarHBondContact O-N 3.36Å; D551-D554 PolarHBondContact O-N 2.85Å; D554-T558 VanDerWaalsContact O-CB 3.27Å; D554-T558 WeakPolarHBondContact O-CB 3.35Å; D554-T558 PolarHBondContact O-N 2.85Å; D554-T558 PolarHBondContact O-OG1 2.88Å
555	Q	93.4	Very high	92.8	Very high	140 Å²	140	100.1 Å²	100.1	65%	0.654	51%	0.508	S	S	*	.	H	α-helix	trans	-66.5	-40.9	167.2	-168	176.2	47.2	0	0	112.4	D551 E552 S559	D551-Q555 WeakPolarHBondContact O-CB 3.32Å; D551-Q555 PolarHBondContact O-N 3.15Å; E552-Q555 PolarHBondContact O-N 3.3Å; Q555-S559 WeakPolarHBondContact O-CB 3.47Å; Q555-S559 PolarHBondContact O-N 3.47Å; Q555-S559 PolarHBondContact O-OG 3.25Å
556	Q	91.3	Very high	93	Very high	98 Å²	98	102.2 Å²	102.2	46%	0.458	51%	0.514	S	S	.	.	H	α-helix	trans	-64.1	-44.7	173.3	-73.6	178.7	39.3	0	0	111.9	E552 K553 S559 R560	E552-Q556 WeakPolarHBondContact O-CB 3.25Å; E552-Q556 VanDerWaalsContact O-CG 3.29Å; E552-Q556 WeakPolarHBondContact O-CG 3.33Å; E552-Q556 PolarHBondContact O-N 2.79Å; K553-Q556 PolarHBondContact O-N 3.01Å; Q556-S559 PolarHBondContact O-N 3.31Å; Q556-R560 WeakPolarHBondContact O-CG 3.45Å; Q556-R560 PolarHBondContact O-N 2.89Å
557	N	92.6	Very high	93.3	Very high	70 Å²	70	105.1 Å²	105.1	37%	0.374	52%	0.515	S	S	.	.	H	α-helix	trans	-62.1	-45.6	176.6	-75	-29.9	0	0	0	111.7	K553 S559 R560 L561	K553-N557 WeakPolarHBondContact O-CB 3.21Å; K553-N557 VanDerWaalsContact O-CG 3.29Å; K553-N557 PolarHBondContact O-N 2.72Å; K553-N557 PolarHBondContact O-ND2 3.3Å; N557-S559 VanDerWaalsContact C-N 3.3Å; N557-S559 PolarHBondContact O-N 2.67Å; N557-R560 PolarHBondContact O-N 3.39Å; N557-L561 PolarHBondContact O-N 2.97Å
558	T	92.8	Very high	93.4	Very high	84 Å²	84	105.2 Å²	105.2	52%	0.515	52%	0.518	S	S	.	.	H	α-helix	trans	-58.5	-42.4	174.7	-59.7	0	0	0	0	111.3	D554 R560 L561 V562	D554-T558 VanDerWaalsContact O-CB 3.27Å; D554-T558 WeakPolarHBondContact O-CB 3.35Å; D554-T558 PolarHBondContact O-N 2.85Å; D554-T558 PolarHBondContact O-OG1 2.88Å; T558-R560 PolarHBondContact O-N 3.42Å; T558-L561 PolarHBondContact O-N 3.09Å; T558-V562 WeakPolarHBondContact O-CG2 3.21Å; T558-V562 PolarHBondContact O-N 3Å
559	S	92.5	Very high	93.5	Very high	71 Å²	71	105.2 Å²	105.2	50%	0.497	52%	0.518	S	S	.	.	H	α-helix	trans	-63.8	-40.5	178.2	-58.9	0	0	0	0	112.4	Q555 Q556 N557 Q563	Q555-S559 WeakPolarHBondContact O-CB 3.47Å; Q555-S559 PolarHBondContact O-N 3.47Å; Q555-S559 PolarHBondContact O-OG 3.25Å; Q556-S559 PolarHBondContact O-N 3.31Å; N557-S559 VanDerWaalsContact C-N 3.3Å; N557-S559 PolarHBondContact O-N 2.67Å; S559-Q563 PolarHBondContact O-N 3.46Å; S559-Q563 VanDerWaalsContact O-N 3.11Å
560	R	94.2	Very high	93.7	Very high	157 Å²	157	106.9 Å²	106.9	59%	0.592	52%	0.524	S	S	*	.	H	α-helix	trans	-62.9	-47.7	173.9	-70.1	172	-177.8	175.6	2.1	111.7	Q556 N557 T558 V562 Q563 E564	Q556-R560 WeakPolarHBondContact O-CG 3.45Å; Q556-R560 PolarHBondContact O-N 2.89Å; N557-R560 PolarHBondContact O-N 3.39Å; T558-R560 PolarHBondContact O-N 3.42Å; R560-V562 VanDerWaalsContact C-N 3.33Å; R560-V562 PolarHBondContact O-N 3.09Å; R560-Q563 PolarHBondContact O-N 2.79Å; R560-Q563 VanDerWaalsContact O-N 3.13Å; R560-E564 PolarHBondContact O-N 2.92Å
561	L	93.5	Very high	93.9	Very high	110 Å²	110	106.5 Å²	106.5	58%	0.576	52%	0.522	S	S	*	.	H	α-helix	trans	-59.1	-41.4	177.9	-79.9	160.8	0	0	0	112.4	N557 T558 E564 H565	N557-L561 PolarHBondContact O-N 2.97Å; T558-L561 PolarHBondContact O-N 3.09Å; L561-E564 PolarHBondContact O-N 2.9Å; L561-H565 VanDerWaalsContact O-CB 3.32Å; L561-H565 WeakPolarHBondContact O-CB 3.41Å; L561-H565 PolarHBondContact O-N 2.74Å
562	V	94.8	Very high	94.2	Very high	96 Å²	96	106 Å²	106	58%	0.582	52%	0.519	S	S	*	.	H	α-helix	trans	-64.4	-40.3	175.1	169.6	0	0	0	0	111.6	T558 R560 K566	T558-V562 WeakPolarHBondContact O-CG2 3.21Å; T558-V562 PolarHBondContact O-N 3Å; R560-V562 VanDerWaalsContact C-N 3.33Å; R560-V562 PolarHBondContact O-N 3.09Å; V562-K566 PolarHBondContact O-N 3.35Å
563	Q	94	Very high	94.3	Very high	145 Å²	145	108.3 Å²	108.3	68%	0.678	53%	0.527	S	S	*	.	H	α-helix	trans	-68.5	-39.7	177.7	-172.2	173.3	-0.3	0	0	112.3	S559 R560 K566 K567	S559-Q563 PolarHBondContact O-N 3.46Å; S559-Q563 VanDerWaalsContact O-N 3.11Å; R560-Q563 PolarHBondContact O-N 2.79Å; R560-Q563 VanDerWaalsContact O-N 3.13Å; Q563-K566 PolarHBondContact O-N 2.91Å; Q563-K567 PolarHBondContact O-N 3.12Å; Q563-K567 VanDerWaalsContact O-N 3.08Å
564	E	95	Very high	94.6	Very high	116 Å²	116	107.3 Å²	107.3	54%	0.542	53%	0.533	S	S	.	.	H	α-helix	trans	-66.2	-46.6	174.9	-177.8	169.8	-152.7	0	0	111.9	R560 L561 K566 K567 L568	R560-E564 PolarHBondContact O-N 2.92Å; L561-E564 PolarHBondContact O-N 2.9Å; E564-K566 VanDerWaalsContact C-N 3.26Å; E564-K566 PolarHBondContact O-N 3.21Å; E564-K567 WeakPolarHBondContact O-CB 3.41Å; E564-K567 PolarHBondContact O-N 3Å; E564-L568 HydrophobicContact CG-CD1 4.2Å; E564-L568 WeakPolarHBondContact O-CG 3.32Å; E564-L568 PolarHBondContact O-N 2.88Å
565	H	95.3	Very high	94.7	Very high	122 Å²	122	109.6 Å²	109.6	57%	0.565	55%	0.545	S	S	*	.	H	α-helix	trans	-58.4	-38.3	175.2	179.6	-106	0	0	0	112.1	L561 L568 L569	L561-H565 VanDerWaalsContact O-CB 3.32Å; L561-H565 WeakPolarHBondContact O-CB 3.41Å; L561-H565 PolarHBondContact O-N 2.74Å; H565-L568 PolarHBondContact O-N 3.06Å; H565-L569 PolarHBondContact O-N 3.03Å
566	K	96.4	Very high	94.8	Very high	128 Å²	128	105.8 Å²	105.8	56%	0.557	53%	0.533	S	S	*	.	H	α-helix	trans	-63	-44.6	172.5	-177.1	-175.9	168.1	-172.5	0	112.2	V562 Q563 E564 L569 E570	V562-K566 PolarHBondContact O-N 3.35Å; Q563-K566 PolarHBondContact O-N 2.91Å; E564-K566 VanDerWaalsContact C-N 3.26Å; E564-K566 PolarHBondContact O-N 3.21Å; K566-L569 WeakPolarHBondContact O-CB 3.35Å; K566-L569 PolarHBondContact O-N 3.46Å; K566-E570 WeakPolarHBondContact CE-OE1 3.28Å; K566-E570 IonicContact NZ-OE1 2.69Å; K566-E570 PolarHBondContact O-N 2.85Å; K566-E570 VanDerWaalsContact O-N 3.09Å
567	K	96.2	Very high	95	Very high	119 Å²	119	104.7 Å²	104.7	52%	0.517	53%	0.533	S	S	.	.	H	α-helix	trans	-60.7	-44.6	176.8	-179.7	175.4	175.7	-70.3	0	111.5	Q563 E564 L569 E570 E571	Q563-K567 PolarHBondContact O-N 3.12Å; Q563-K567 VanDerWaalsContact O-N 3.08Å; E564-K567 WeakPolarHBondContact O-CB 3.41Å; E564-K567 PolarHBondContact O-N 3Å; K567-L569 VanDerWaalsContact C-N 3.34Å; K567-L569 PolarHBondContact O-N 3.23Å; K567-E570 PolarHBondContact O-N 3.11Å; K567-E571 VanDerWaalsContact CE-OE1 3.32Å; K567-E571 WeakPolarHBondContact CE-OE1 3.16Å; K567-E571 IonicContact NZ-OE1 2.73Å; K567-E571 PolarHBondContact NZ-OE1 3.35Å; K567-E571 IonicContact NZ-OE2 3.82Å; K567-E571 WeakPolarHBondContact O-CG 3.34Å; K567-E571 PolarHBondContact O-N 3.3Å
568	L	95.5	Very high	95.1	Very high	91 Å²	91	108.8 Å²	108.8	48%	0.476	55%	0.545	S	S	.	.	H	α-helix	trans	-63.4	-35.8	176.4	-68.7	171	0	0	0	112.6	E564 H565 N572	E564-L568 HydrophobicContact CG-CD1 4.2Å; E564-L568 WeakPolarHBondContact O-CG 3.32Å; E564-L568 PolarHBondContact O-N 2.88Å; H565-L568 PolarHBondContact O-N 3.06Å; L568-N572 WeakPolarHBondContact O-CB 3.18Å; L568-N572 PolarHBondContact O-N 3.28Å
569	L	96	Very high	95.2	Very high	102 Å²	102	111.5 Å²	111.5	53%	0.534	55%	0.546	S	S	.	.	H	α-helix	trans	-63.4	-42	172	-87.2	164.9	0	0	0	112.6	H565 K566 K567 K573	H565-L569 PolarHBondContact O-N 3.03Å; K566-L569 WeakPolarHBondContact O-CB 3.35Å; K566-L569 PolarHBondContact O-N 3.46Å; K567-L569 VanDerWaalsContact C-N 3.34Å; K567-L569 PolarHBondContact O-N 3.23Å; L569-K573 WeakPolarHBondContact O-CB 3.38Å; L569-K573 PolarHBondContact O-N 2.92Å
570	E	96.2	Very high	95.3	Very high	113 Å²	113	112.6 Å²	112.6	53%	0.528	54%	0.544	S	S	.	.	H	α-helix	trans	-68.8	-41.2	177.5	-70.8	175.9	-170	0	0	111.7	K566 K567 K573 S574	K566-E570 WeakPolarHBondContact CE-OE1 3.28Å; K566-E570 IonicContact NZ-OE1 2.69Å; K566-E570 PolarHBondContact O-N 2.85Å; K566-E570 VanDerWaalsContact O-N 3.09Å; K567-E570 PolarHBondContact O-N 3.11Å; E570-K573 PolarHBondContact O-N 2.89Å; E570-S574 WeakPolarHBondContact O-CB 3.43Å; E570-S574 PolarHBondContact O-N 2.92Å
571	E	96	Very high	95.3	Very high	80 Å²	80	111.8 Å²	111.8	37%	0.374	54%	0.544	S	S	.	.	H	α-helix	trans	-64.8	-45.3	174.5	-74.7	173.6	-177	0	0	112.3	K567 K573 S574 L575	K567-E571 VanDerWaalsContact CE-OE1 3.32Å; K567-E571 WeakPolarHBondContact CE-OE1 3.16Å; K567-E571 IonicContact NZ-OE1 2.73Å; K567-E571 PolarHBondContact NZ-OE1 3.35Å; K567-E571 IonicContact NZ-OE2 3.82Å; K567-E571 WeakPolarHBondContact O-CG 3.34Å; K567-E571 PolarHBondContact O-N 3.3Å; E571-K573 PolarHBondContact O-N 2.89Å; E571-S574 WeakPolarHBondContact O-CB 3.25Å; E571-S574 PolarHBondContact O-N 3.35Å; E571-S574 VanDerWaalsContact O-N 3.14Å; E571-L575 WeakPolarHBondContact O-CB 3.48Å; E571-L575 WeakPolarHBondContact O-CG 3.43Å; E571-L575 PolarHBondContact O-N 2.67Å
572	N	96.2	Very high	95.3	Very high	108 Å²	108	108.5 Å²	108.5	58%	0.578	53%	0.53	S	S	*	.	H	α-helix	trans	-60.8	-43.3	176.1	-172.2	-29.9	0	0	0	111.3	L568 S574 L575 S576	L568-N572 WeakPolarHBondContact O-CB 3.18Å; L568-N572 PolarHBondContact O-N 3.28Å; N572-S574 VanDerWaalsContact C-N 3.32Å; N572-S574 PolarHBondContact O-N 3.37Å; N572-L575 PolarHBondContact O-N 2.9Å; N572-S576 VanDerWaalsContact O-CB 3.29Å; N572-S576 WeakPolarHBondContact O-CB 3.09Å; N572-S576 PolarHBondContact O-N 3.46Å
573	K	96.3	Very high	95.3	Very high	157 Å²	157	109.4 Å²	109.4	68%	0.683	53%	0.527	S	S	*	.	H	α-helix	trans	-61	-38.2	173.6	-173.7	178.3	179.8	-178.2	0	112.6	L569 E570 E571 T577	L569-K573 WeakPolarHBondContact O-CB 3.38Å; L569-K573 PolarHBondContact O-N 2.92Å; E570-K573 PolarHBondContact O-N 2.89Å; E571-K573 PolarHBondContact O-N 2.89Å; K573-T577 WeakPolarHBondContact O-CB 3.49Å; K573-T577 PolarHBondContact O-N 2.9Å; K573-T577 VanDerWaalsContact O-N 3.12Å; K573-T577 PolarHBondContact O-OG1 2.91Å
574	S	96	Very high	95.3	Very high	77 Å²	77	109.8 Å²	109.8	54%	0.538	53%	0.526	S	S	.	.	H	α-helix	trans	-66.4	-50.5	174.2	-168.4	0	0	0	0	111.8	E570 E571 N572 S576 T577 Y578	E570-S574 WeakPolarHBondContact O-CB 3.43Å; E570-S574 PolarHBondContact O-N 2.92Å; E571-S574 WeakPolarHBondContact O-CB 3.25Å; E571-S574 PolarHBondContact O-N 3.35Å; E571-S574 VanDerWaalsContact O-N 3.14Å; N572-S574 VanDerWaalsContact C-N 3.32Å; N572-S574 PolarHBondContact O-N 3.37Å; S574-S576 PolarHBondContact O-N 3.28Å; S574-T577 CarbonylContact O-C 3.54Å; S574-T577 WeakPolarHBondContact O-CA 3.29Å; S574-T577 WeakPolarHBondContact O-CB 3.31Å; S574-T577 PolarHBondContact O-N 2.67Å; S574-T577 VanDerWaalsContact O-N 3.1Å; S574-Y578 PolarHBondContact O-N 3.23Å
575	L	95.6	Very high	95.1	Very high	118 Å²	118	110 Å²	110	62%	0.618	53%	0.527	S	S	*	.	H	α-helix	trans	-59.7	-42.9	178	-73.1	168.5	0	0	0	112.2	E571 N572 T577 Y578 Y579	E571-L575 WeakPolarHBondContact O-CB 3.48Å; E571-L575 WeakPolarHBondContact O-CG 3.43Å; E571-L575 PolarHBondContact O-N 2.67Å; N572-L575 PolarHBondContact O-N 2.9Å; L575-T577 VanDerWaalsContact C-N 3.33Å; L575-T577 PolarHBondContact O-N 2.74Å; L575-Y578 PolarHBondContact O-N 3.13Å; L575-Y579 WeakPolarHBondContact O-CB 3.5Å; L575-Y579 PolarHBondContact O-N 3.42Å
576	S	94.9	Very high	94.9	Very high	60 Å²	60	108.5 Å²	108.5	42%	0.42	52%	0.523	S	S	.	.	H	α-helix	trans	-61.7	-41.1	174.5	-176.2	0	0	0	0	111.6	N572 S574 Y579 Q580	N572-S576 VanDerWaalsContact O-CB 3.29Å; N572-S576 WeakPolarHBondContact O-CB 3.09Å; N572-S576 PolarHBondContact O-N 3.46Å; S574-S576 PolarHBondContact O-N 3.28Å; S576-Y579 PolarHBondContact O-N 3.06Å; S576-Q580 VanDerWaalsContact O-CG 3.27Å; S576-Q580 WeakPolarHBondContact O-CG 3.27Å; S576-Q580 PolarHBondContact O-N 2.9Å
577	T	94.8	Very high	94.7	Very high	74 Å²	74	106.9 Å²	106.9	45%	0.454	52%	0.517	S	S	.	.	H	α-helix	trans	-65.5	-39.8	175	-57.4	0	0	0	0	111.9	K573 S574 L575 K581	K573-T577 WeakPolarHBondContact O-CB 3.49Å; K573-T577 PolarHBondContact O-N 2.9Å; K573-T577 VanDerWaalsContact O-N 3.12Å; K573-T577 PolarHBondContact O-OG1 2.91Å; S574-T577 CarbonylContact O-C 3.54Å; S574-T577 WeakPolarHBondContact O-CA 3.29Å; S574-T577 WeakPolarHBondContact O-CB 3.31Å; S574-T577 PolarHBondContact O-N 2.67Å; S574-T577 VanDerWaalsContact O-N 3.1Å; L575-T577 VanDerWaalsContact C-N 3.33Å; L575-T577 PolarHBondContact O-N 2.74Å; T577-K581 WeakPolarHBondContact O-CG 3.37Å; T577-K581 PolarHBondContact O-N 3.23Å
578	Y	95	Very high	94.4	Very high	157 Å²	157	106.5 Å²	106.5	62%	0.616	52%	0.52	S	S	*	.	H	α-helix	trans	-65.8	-48.2	175.5	-178.9	-97.9	0	0	0	111.6	S574 L575 Q580 K581 C582	S574-Y578 PolarHBondContact O-N 3.23Å; L575-Y578 PolarHBondContact O-N 3.13Å; Y578-Q580 VanDerWaalsContact C-N 3.3Å; Y578-Q580 PolarHBondContact O-N 3.26Å; Y578-K581 WeakPolarHBondContact O-CA 3.44Å; Y578-K581 WeakPolarHBondContact O-CB 3.25Å; Y578-K581 PolarHBondContact O-N 3.18Å; Y578-C582 WeakPolarHBondContact CE1-SG 3.24Å; Y578-C582 VanDerWaalsContact CZ-SG 3.54Å; Y578-C582 PolarHBondContact O-N 3.1Å; Y578-C582 PolarHBondContact O-SG 3.18Å
579	Y	95.3	Very high	94.2	Very high	141 Å²	141	105.9 Å²	105.9	55%	0.553	52%	0.516	S	S	*	.	H	α-helix	trans	-55.2	-43.1	175.4	171.3	-112.6	0	0	0	112.3	L575 S576 K581 C582 K583	L575-Y579 WeakPolarHBondContact O-CB 3.5Å; L575-Y579 PolarHBondContact O-N 3.42Å; S576-Y579 PolarHBondContact O-N 3.06Å; Y579-K581 VanDerWaalsContact C-N 3.33Å; Y579-K581 PolarHBondContact O-N 2.78Å; Y579-C582 PolarHBondContact O-N 3.07Å; Y579-K583 WeakPolarHBondContact O-CB 3.41Å; Y579-K583 PolarHBondContact O-N 3.46Å
580	Q	94.8	Very high	93.8	Very high	94 Å²	94	107.2 Å²	107.2	44%	0.439	51%	0.514	S	S	.	.	H	α-helix	trans	-65.7	-32.3	175.8	-67.7	-70.4	-3.1	0	0	113.1	S576 Y578 K584	S576-Q580 VanDerWaalsContact O-CG 3.27Å; S576-Q580 WeakPolarHBondContact O-CG 3.27Å; S576-Q580 PolarHBondContact O-N 2.9Å; Y578-Q580 VanDerWaalsContact C-N 3.3Å; Y578-Q580 PolarHBondContact O-N 3.26Å; Q580-K584 WeakPolarHBondContact O-CG 3.31Å; Q580-K584 PolarHBondContact O-N 3.13Å
581	K	94.6	Very high	93.3	Very high	139 Å²	139	104.9 Å²	104.9	60%	0.604	51%	0.508	S	S	*	.	H	α-helix	trans	-67.2	-50.9	171.6	-70.3	173.9	178.9	179.5	0	110.9	T577 Y578 Y579 K583 K584 Q585	T577-K581 WeakPolarHBondContact O-CG 3.37Å; T577-K581 PolarHBondContact O-N 3.23Å; Y578-K581 WeakPolarHBondContact O-CA 3.44Å; Y578-K581 WeakPolarHBondContact O-CB 3.25Å; Y578-K581 PolarHBondContact O-N 3.18Å; Y579-K581 VanDerWaalsContact C-N 3.33Å; Y579-K581 PolarHBondContact O-N 2.78Å; K581-K583 VanDerWaalsContact C-N 3.33Å; K581-K583 PolarHBondContact O-N 3.42Å; K581-K584 PolarHBondContact O-N 3.07Å; K581-Q585 PolarHBondContact O-N 3.38Å
582	C	93.1	Very high	92.7	Very high	42 Å²	42	106.9 Å²	106.9	28%	0.284	52%	0.517	S	S	.	.	H	α-helix	trans	-58.9	-42.7	178.3	-64.8	0	0	0	0	112	Y578 Y579 K584 Q585 L586	Y578-C582 WeakPolarHBondContact CE1-SG 3.24Å; Y578-C582 VanDerWaalsContact CZ-SG 3.54Å; Y578-C582 PolarHBondContact O-N 3.1Å; Y578-C582 PolarHBondContact O-SG 3.18Å; Y579-C582 PolarHBondContact O-N 3.07Å; C582-K584 PolarHBondContact O-N 3.14Å; C582-Q585 PolarHBondContact O-N 3.06Å; C582-L586 WeakPolarHBondContact O-CB 3.41Å; C582-L586 PolarHBondContact O-N 3.27Å
583	K	94.4	Very high	91.8	Very high	115 Å²	115	107.1 Å²	107.1	50%	0.5	51%	0.514	S	S	.	.	H	α-helix	trans	-59.7	-44.9	176.1	-174.3	175.3	179.3	178.9	0	112.2	Y579 K581 L586 E587	Y579-K583 WeakPolarHBondContact O-CB 3.41Å; Y579-K583 PolarHBondContact O-N 3.46Å; K581-K583 VanDerWaalsContact C-N 3.33Å; K581-K583 PolarHBondContact O-N 3.42Å; K583-L586 PolarHBondContact O-N 2.91Å; K583-E587 PolarHBondContact O-N 3.43Å; K583-E587 VanDerWaalsContact O-N 3.09Å
584	K	93.8	Very high	90.8	Very high	152 Å²	152	105.9 Å²	105.9	66%	0.661	51%	0.511	S	S	*	.	H	α-helix	trans	-62.8	-41.3	174.9	-74.7	177.6	178.2	-174.2	0	112.3	Q580 K581 C582 E587 L588	Q580-K584 WeakPolarHBondContact O-CG 3.31Å; Q580-K584 PolarHBondContact O-N 3.13Å; K581-K584 PolarHBondContact O-N 3.07Å; C582-K584 PolarHBondContact O-N 3.14Å; K584-E587 PolarHBondContact O-N 3.34Å; K584-L588 WeakPolarHBondContact O-CG 3.47Å; K584-L588 PolarHBondContact O-N 2.99Å
585	Q	91.8	Very high	89.6	Confident	122 Å²	122	109.7 Å²	109.7	57%	0.57	52%	0.518	S	S	*	.	H	α-helix	trans	-67.9	-39.9	179.6	-171.1	173.4	-1.3	0	0	112.3	K581 C582 L588 I589	K581-Q585 PolarHBondContact O-N 3.38Å; C582-Q585 PolarHBondContact O-N 3.06Å; Q585-L588 PolarHBondContact O-N 2.86Å; Q585-I589 HydrophobicContact CG-CD1 4.5Å; Q585-I589 WeakPolarHBondContact O-CG1 3.49Å; Q585-I589 PolarHBondContact O-N 3.47Å; Q585-I589 VanDerWaalsContact O-N 3.08Å
586	L	91	Very high	88.1	Confident	90 Å²	90	113.6 Å²	113.6	47%	0.471	52%	0.524	S	S	.	.	H	α-helix	trans	-66.2	-38.1	176.5	-162.2	156.2	0	0	0	111.3	C582 K583 I589 R590	C582-L586 WeakPolarHBondContact O-CB 3.41Å; C582-L586 PolarHBondContact O-N 3.27Å; K583-L586 PolarHBondContact O-N 2.91Å; L586-I589 PolarHBondContact O-N 3.11Å; L586-R590 HydrophobicContact CD2-CG 4.29Å; L586-R590 WeakPolarHBondContact O-CG 3.5Å; L586-R590 PolarHBondContact O-N 3.27Å
587	E	92	Very high	86.3	Confident	93 Å²	93	118.4 Å²	118.4	44%	0.435	54%	0.541	S	S	.	.	H	α-helix	trans	-67.9	-38.4	175.1	-155.5	63.7	-166.2	0	0	112.5	K583 K584 I589 R590 V591	K583-E587 PolarHBondContact O-N 3.43Å; K583-E587 VanDerWaalsContact O-N 3.09Å; K584-E587 PolarHBondContact O-N 3.34Å; E587-I589 VanDerWaalsContact C-N 3.32Å; E587-I589 PolarHBondContact O-N 3.42Å; E587-R590 PolarHBondContact O-N 3.02Å; E587-R590 WeakPolarHBondContact OE2-CD 3.35Å; E587-R590 IonicContact OE2-CZ 3.27Å; E587-R590 IonicContact OE2-NE 2.71Å; E587-R590 IonicContact OE2-NH1 2.87Å; E587-R590 PolarHBondContact OE2-NH1 3.13Å; E587-V591 WeakPolarHBondContact O-CG2 3.43Å; E587-V591 PolarHBondContact O-N 3.45Å
588	L	90	Very high	84.5	Confident	111 Å²	111	118.1 Å²	118.1	58%	0.581	55%	0.552	S	S	*	*	H	α-helix	trans	-59.9	-40.8	171.1	-74.6	168	0	0	0	112.1	K584 Q585 V591 Q592	K584-L588 WeakPolarHBondContact O-CG 3.47Å; K584-L588 PolarHBondContact O-N 2.99Å; Q585-L588 PolarHBondContact O-N 2.86Å; L588-V591 PolarHBondContact O-N 3.36Å; L588-Q592 WeakPolarHBondContact O-CG 3.47Å; L588-Q592 PolarHBondContact O-N 3.06Å
589	I	89.8	Confident	82.5	Confident	79 Å²	79	116 Å²	116	41%	0.405	56%	0.556	S	S	.	*	H	α-helix	trans	-64.5	-43.5	176.5	-68.9	164.1	0	0	0	110.8	Q585 L586 E587 V591 Q592 Q593	Q585-I589 HydrophobicContact CG-CD1 4.5Å; Q585-I589 WeakPolarHBondContact O-CG1 3.49Å; Q585-I589 PolarHBondContact O-N 3.47Å; Q585-I589 VanDerWaalsContact O-N 3.08Å; L586-I589 PolarHBondContact O-N 3.11Å; E587-I589 VanDerWaalsContact C-N 3.32Å; E587-I589 PolarHBondContact O-N 3.42Å; I589-V591 PolarHBondContact O-N 2.93Å; I589-Q592 PolarHBondContact O-N 2.96Å; I589-Q593 HydrophobicContact CG2-CG 4.42Å; I589-Q593 WeakPolarHBondContact O-CG 3.45Å; I589-Q593 PolarHBondContact O-N 3.22Å
590	R	88.1	Confident	80.1	Confident	130 Å²	130	117.6 Å²	117.6	49%	0.491	59%	0.587	S	S	.	*	H	α-helix	trans	-58.6	-47.2	175.1	-74.6	169.2	169.8	171	-5.3	112.3	L586 E587 Q592 Q593 Q594	L586-R590 HydrophobicContact CD2-CG 4.29Å; L586-R590 WeakPolarHBondContact O-CG 3.5Å; L586-R590 PolarHBondContact O-N 3.27Å; E587-R590 PolarHBondContact O-N 3.02Å; E587-R590 WeakPolarHBondContact OE2-CD 3.35Å; E587-R590 IonicContact OE2-CZ 3.27Å; E587-R590 IonicContact OE2-NE 2.71Å; E587-R590 IonicContact OE2-NH1 2.87Å; E587-R590 PolarHBondContact OE2-NH1 3.13Å; R590-Q592 VanDerWaalsContact C-N 3.3Å; R590-Q592 PolarHBondContact O-N 3.43Å; R590-Q593 PolarHBondContact O-N 3.14Å; R590-Q594 WeakPolarHBondContact O-CG 3.39Å; R590-Q594 PolarHBondContact O-N 2.98Å
591	V	86.2	Confident	79.4	Confident	64 Å²	64	118.8 Å²	118.8	39%	0.388	60%	0.595	S	S	.	*	H	α-helix	trans	-62.9	-36.9	177.6	172.3	0	0	0	0	111.4	E587 L588 I589 K595	E587-V591 WeakPolarHBondContact O-CG2 3.43Å; E587-V591 PolarHBondContact O-N 3.45Å; L588-V591 PolarHBondContact O-N 3.36Å; I589-V591 PolarHBondContact O-N 2.93Å; V591-K595 WeakPolarHBondContact O-CB 3.47Å; V591-K595 WeakPolarHBondContact O-CG 3.5Å; V591-K595 PolarHBondContact O-N 3.05Å; V591-K595 VanDerWaalsContact O-N 3.1Å
592	Q	82.3	Confident	78.6	Confident	121 Å²	121	117.7 Å²	117.7	57%	0.565	59%	0.594	S	S	*	*	H	α-helix	trans	-68.3	-37.6	173.7	-73.2	177.3	4.9	0	0	112.9	L588 I589 R590 K595 R596	L588-Q592 WeakPolarHBondContact O-CG 3.47Å; L588-Q592 PolarHBondContact O-N 3.06Å; I589-Q592 PolarHBondContact O-N 2.96Å; R590-Q592 VanDerWaalsContact C-N 3.3Å; R590-Q592 PolarHBondContact O-N 3.43Å; Q592-K595 PolarHBondContact O-N 3.36Å; Q592-R596 WeakPolarHBondContact O-CG 3.38Å; Q592-R596 PolarHBondContact O-N 2.92Å
593	Q	79.1	Confident	77.8	Confident	113 Å²	113	121.9 Å²	121.9	53%	0.528	61%	0.611	S	S	.	*	H	α-helix	trans	-68	-45.2	176.5	-74.3	172.9	-16.2	0	0	111.7	I589 R590 K595 R596 Q597	I589-Q593 HydrophobicContact CG2-CG 4.42Å; I589-Q593 WeakPolarHBondContact O-CG 3.45Å; I589-Q593 PolarHBondContact O-N 3.22Å; R590-Q593 PolarHBondContact O-N 3.14Å; Q593-K595 VanDerWaalsContact C-N 3.32Å; Q593-K595 PolarHBondContact O-N 3.44Å; Q593-R596 PolarHBondContact O-N 2.62Å; Q593-Q597 PolarHBondContact O-N 2.96Å; Q593-Q597 VanDerWaalsContact O-N 3.07Å
594	Q	75.3	Confident	76.8	Confident	132 Å²	132	122.3 Å²	122.3	62%	0.617	62%	0.618	S	S	*	*	H	α-helix	trans	-58.3	-42.8	173.8	-73.6	175.9	-19	0	0	111.8	R590 R596 Q597 G598	R590-Q594 WeakPolarHBondContact O-CG 3.39Å; R590-Q594 PolarHBondContact O-N 2.98Å; Q594-R596 PolarHBondContact O-N 3.44Å; Q594-Q597 PolarHBondContact O-N 3.49Å; Q594-Q597 VanDerWaalsContact O-N 3.16Å; Q594-G598 PolarHBondContact O-N 3.26Å
595	K	70.1	Confident	75.7	Confident	156 Å²	156	120.4 Å²	120.4	68%	0.678	62%	0.615	S	S	*	*	H	α-helix	trans	-63.2	-23.5	174.6	-78.1	-173.8	176.5	-169.2	0	114.5	V591 Q592 Q593	V591-K595 WeakPolarHBondContact O-CB 3.47Å; V591-K595 WeakPolarHBondContact O-CG 3.5Å; V591-K595 PolarHBondContact O-N 3.05Å; V591-K595 VanDerWaalsContact O-N 3.1Å; Q592-K595 PolarHBondContact O-N 3.36Å; Q593-K595 VanDerWaalsContact C-N 3.32Å; Q593-K595 PolarHBondContact O-N 3.44Å
596	R	63	Low	74.7	Confident	200 Å²	200	120.3 Å²	120.3	76%	0.755	62%	0.618	S	S	*	*	H	α-helix	trans	-86.8	-22.5	174.3	-73.6	178.4	174.2	-176.4	-1.6	113.4	Q592 Q593 Q594 T599	Q592-R596 WeakPolarHBondContact O-CG 3.38Å; Q592-R596 PolarHBondContact O-N 2.92Å; Q593-R596 PolarHBondContact O-N 2.62Å; Q594-R596 PolarHBondContact O-N 3.44Å; R596-T599 PolarHBondContact O-OG1 2.65Å
597	Q	59	Low	73.5	Confident	162 Å²	162	122.5 Å²	122.5	76%	0.757	63%	0.629	S	S	*	*	H	α-helix	trans	-83.9	-20.9	176	-72.7	179.3	-27.7	0	0	112.9	Q593 Q594 T599	Q593-Q597 PolarHBondContact O-N 2.96Å; Q593-Q597 VanDerWaalsContact O-N 3.07Å; Q594-Q597 PolarHBondContact O-N 3.49Å; Q594-Q597 VanDerWaalsContact O-N 3.16Å; Q597-T599 VanDerWaalsContact C-N 3.3Å; Q597-T599 PolarHBondContact O-N 2.96Å
598	G	55.6	Low	72.1	Confident	68 Å²	68	124.8 Å²	124.8	70%	0.701	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86	15.9	174	0	0	0	0	0	115.5	Q594	Q594-G598 PolarHBondContact O-N 3.26Å
599	T	52.8	Low	70.6	Confident	112 Å²	112	125.9 Å²	125.9	69%	0.687	65%	0.649	S	S	*	*			trans	-135.8	42	-175.9	60.9	0	0	0	0	112.2	R596 Q597	R596-T599 PolarHBondContact O-OG1 2.65Å; Q597-T599 VanDerWaalsContact C-N 3.3Å; Q597-T599 PolarHBondContact O-N 2.96Å
600	S	45.8	Very low	68.8	Low	174 Å²	174	130.2 Å²	130.2	100%	1.217	67%	0.671	S	S	*	*			trans	-142.3	0	174.3	-175.5	0	0	0	0	110.7

Retrieved 600 of 600 residues in 607.7 ms (Link to these results)

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