A0A087XF82_POEFO Loading...

ER membrane protein complex subunit 3

AlphaFold DB , UniProt , Accession A0A087XF82, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 261 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.4	Very low	70.6	Confident	242 Å²	242	120.3 Å²	120.3	100%	1.192	66%	0.662	S	S	*	*				0	110.8	0	-69.1	175.5	-157.7	0	0	105.7	E3	M1-E3 PolarHBondContact O-N 3.43Å
2	A	45.5	Very low	72.3	Confident	104 Å²	104	112.9 Å²	112.9	86%	0.86	62%	0.621	S	S	*	*			trans	-71.8	122.5	179.3	0	0	0	0	0	108.1
3	E	44.5	Very low	73.7	Confident	168 Å²	168	115.8 Å²	115.8	79%	0.785	62%	0.617	S	S	*	*			trans	-57.6	138.1	174	-60.9	-171.7	164	0	0	109.4	M1 E5	M1-E3 PolarHBondContact O-N 3.43Å; E3-E5 PolarHBondContact O-N 2.68Å
4	P	55.9	Low	75	Confident	120 Å²	120	114.3 Å²	114.3	78%	0.779	61%	0.608	S	S	*	*			trans	-69.3	97.9	168.8	27.2	-29.1	0	0	0	108.2	L6	P4-L6 PolarHBondContact O-N 2.95Å
5	E	71.3	Confident	76.2	Confident	147 Å²	147	119 Å²	119	69%	0.687	61%	0.614	S	S	*	*	S	Bend	trans	-56.7	-13.3	-177.2	-74.8	179.4	144.4	0	0	114.9	E3	E3-E5 PolarHBondContact O-N 2.68Å
6	L	79	Confident	77.2	Confident	73 Å²	73	112.1 Å²	112.1	38%	0.382	58%	0.579	S	S	.	*			trans	-142.3	127.5	175.5	-125.6	91.6	0	0	0	110.8	P4 L8 L161 W165	P4-L6 PolarHBondContact O-N 2.95Å; L6-L8 HydrophobicContact CD2-CD2 4.13Å; L6-L161 HydrophobicContact CD1-CD1 4.48Å; L6-W165 HydrophobicContact CB-CH2 3.47Å; L6-W165 VanDerWaalsContact CB-CH2 3.47Å; L6-W165 HydrophobicContact CB-CZ2 3.52Å; L6-W165 HydrophobicContact CB-CZ3 4.28Å
7	L	84.4	Confident	78.1	Confident	166 Å²	166	107 Å²	107	87%	0.869	55%	0.554	S	S	*	*			trans	-90.2	115.8	169.4	-168.8	157.5	0	0	0	108.7
8	L	86	Confident	78.9	Confident	56 Å²	56	106.5 Å²	106.5	29%	0.293	55%	0.552	S	S	.	*			trans	-94.3	148.6	175.4	-65.6	177.1	0	0	0	110.9	L6 S10 V136 W165	L6-L8 HydrophobicContact CD2-CD2 4.13Å; L8-S10 PolarHBondContact O-N 3.44Å; L8-V136 HydrophobicContact CD2-CB 4.3Å; L8-W165 HydrophobicContact CD1-CZ3 3.9Å; L8-W165 HydrophobicContact CG-CZ3 4.31Å
9	D	90.1	Very high	79.6	Confident	89 Å²	89	102.9 Å²	102.9	48%	0.476	54%	0.536	S	S	.	.			trans	-62.7	130.4	172.7	-175.5	-1.4	0	0	0	110.3	N11 I12	D9-N11 PolarHBondContact O-N 2.94Å; D9-N11 PolarHBondContact OD1-N 3.36Å; D9-N11 PolarHBondContact OD1-ND2 3.4Å; D9-N11 WeakPolarHBondContact OD2-CB 3.43Å; D9-N11 PolarHBondContact OD2-ND2 3.5Å; D9-I12 HydrophobicContact CB-CD1 4.28Å; D9-I12 HydrophobicContact CB-CG1 4.31Å; D9-I12 WeakPolarHBondContact O-CB 3.34Å; D9-I12 PolarHBondContact O-N 3.32Å
10	S	90.3	Very high	80.3	Confident	71 Å²	71	97.8 Å²	97.8	50%	0.497	51%	0.509	S	S	.	.	H	α-helix	trans	-59.7	-24.1	175.8	-72.7	0	0	0	0	112.9	L8 I12 R13	L8-S10 PolarHBondContact O-N 3.44Å; S10-I12 VanDerWaalsContact C-N 3.29Å; S10-I12 PolarHBondContact O-N 3.46Å; S10-R13 WeakPolarHBondContact O-CB 2.98Å; S10-R13 PolarHBondContact O-N 3.38Å
11	N	92	Very high	80.9	Confident	87 Å²	87	95.2 Å²	95.2	47%	0.465	50%	0.497	S	S	.	.	H	α-helix	trans	-62.7	-34.9	174.6	-66.3	-43.2	0	0	0	112.3	D9 R13 L14 W15	D9-N11 PolarHBondContact O-N 2.94Å; D9-N11 PolarHBondContact OD1-N 3.36Å; D9-N11 PolarHBondContact OD1-ND2 3.4Å; D9-N11 WeakPolarHBondContact OD2-CB 3.43Å; D9-N11 PolarHBondContact OD2-ND2 3.5Å; N11-R13 PolarHBondContact O-N 3.31Å; N11-L14 PolarHBondContact O-N 3.19Å; N11-L14 VanDerWaalsContact O-N 3.12Å; N11-W15 WeakPolarHBondContact O-CB 3.2Å; N11-W15 VanDerWaalsContact O-CD1 3.29Å; N11-W15 PolarHBondContact O-N 3.02Å
12	I	90.9	Very high	83.5	Confident	32 Å²	32	89.8 Å²	89.8	16%	0.164	47%	0.468	C	S	.	.	H	α-helix	trans	-59.4	-37.9	178.9	-63.6	172.1	0	0	0	110.4	D9 S10 L14 V16 V17 F135	D9-I12 HydrophobicContact CB-CD1 4.28Å; D9-I12 HydrophobicContact CB-CG1 4.31Å; D9-I12 WeakPolarHBondContact O-CB 3.34Å; D9-I12 PolarHBondContact O-N 3.32Å; S10-I12 VanDerWaalsContact C-N 3.29Å; S10-I12 PolarHBondContact O-N 3.46Å; I12-L14 PolarHBondContact O-N 3.24Å; I12-V16 HydrophobicContact CG2-CB 4.22Å; I12-V16 HydrophobicContact CG2-CG2 4.3Å; I12-V16 WeakPolarHBondContact O-CA 3.47Å; I12-V16 VanDerWaalsContact O-CB 3.26Å; I12-V16 WeakPolarHBondContact O-CB 3.24Å; I12-V16 PolarHBondContact O-N 3.46Å; I12-V17 PolarHBondContact O-N 2.93Å; I12-V17 VanDerWaalsContact O-N 3.09Å; I12-F135 HydrophobicContact CD1-CD2 4.26Å; I12-F135 HydrophobicContact CG2-CD2 4.27Å; I12-F135 HydrophobicContact CG2-CE2 4.05Å
13	R	90.4	Very high	85.7	Confident	150 Å²	150	87.2 Å²	87.2	57%	0.566	44%	0.439	S	S	*	.	I	π-helix	trans	-62.9	-44	177.6	-177.6	177.1	59	-168.7	-4.4	112.2	S10 N11 V17 L18	S10-R13 WeakPolarHBondContact O-CB 2.98Å; S10-R13 PolarHBondContact O-N 3.38Å; N11-R13 PolarHBondContact O-N 3.31Å; R13-V17 WeakPolarHBondContact O-CB 3.04Å; R13-L18 PolarHBondContact O-N 3.36Å
14	L	92.6	Very high	87.9	Confident	95 Å²	95	79.4 Å²	79.4	50%	0.497	40%	0.403	S	S	.	.	I	π-helix	trans	-80.2	-35.5	-175.9	-68.2	174.7	0	0	0	112.8	N11 I12 L18 P19	N11-L14 PolarHBondContact O-N 3.19Å; N11-L14 VanDerWaalsContact O-N 3.12Å; I12-L14 PolarHBondContact O-N 3.24Å; L14-L18 HydrophobicContact CD2-CD1 4Å; L14-P19 VanDerWaalsContact O-CD 3.23Å; L14-P19 WeakPolarHBondContact O-CD 3.38Å; L14-P19 WeakPolarHBondContact O-CG 3.21Å
15	W	92.5	Very high	89.5	Confident	185 Å²	185	76.5 Å²	76.5	70%	0.701	38%	0.378	S	S	*	.	I	π-helix	trans	-100.5	-14.8	-171.8	-68.6	102.5	0	0	0	114.6	N11 P19	N11-W15 WeakPolarHBondContact O-CB 3.2Å; N11-W15 VanDerWaalsContact O-CD1 3.29Å; N11-W15 PolarHBondContact O-N 3.02Å; W15-P19 WeakPolarHBondContact O-CG 3.49Å
16	V	91.8	Very high	90.4	Very high	9 Å²	9	72.8 Å²	72.8	6%	0.055	36%	0.362	C	S	.	.	I	π-helix	trans	-123.7	-55.2	-178.3	-170.8	0	0	0	0	110.9	I12 I20 F132 F135 T137	I12-V16 HydrophobicContact CG2-CB 4.22Å; I12-V16 HydrophobicContact CG2-CG2 4.3Å; I12-V16 WeakPolarHBondContact O-CA 3.47Å; I12-V16 VanDerWaalsContact O-CB 3.26Å; I12-V16 WeakPolarHBondContact O-CB 3.24Å; I12-V16 PolarHBondContact O-N 3.46Å; V16-I20 HydrophobicContact CG1-CD1 3.68Å; V16-I20 WeakPolarHBondContact O-CB 3.33Å; V16-I20 WeakPolarHBondContact O-CD1 3.16Å; V16-I20 WeakPolarHBondContact O-CG1 3.08Å; V16-I20 PolarHBondContact O-N 3.35Å; V16-F132 HydrophobicContact CB-CD1 4.5Å; V16-F132 HydrophobicContact CG1-CB 4.32Å; V16-F132 HydrophobicContact CG1-CD1 4Å; V16-F132 HydrophobicContact CG1-CE1 4.47Å; V16-F132 HydrophobicContact CG1-CG 4.09Å; V16-F132 HydrophobicContact CG2-CD1 3.92Å; V16-F132 HydrophobicContact CG2-CE1 4.07Å; V16-F135 HydrophobicContact CB-CE2 4.26Å; V16-F135 HydrophobicContact CB-CZ 4.34Å; V16-F135 HydrophobicContact CG1-CE2 3.9Å; V16-F135 HydrophobicContact CG1-CZ 3.89Å; V16-F135 HydrophobicContact CG2-CE2 3.85Å; V16-F135 HydrophobicContact CG2-CZ 3.65Å; V16-T137 HydrophobicContact CG1-CG2 4.49Å
17	V	92.6	Very high	90.9	Very high	25 Å²	25	71.6 Å²	71.6	15%	0.152	36%	0.358	C	S	.	.	I	π-helix	trans	-63.5	-56.4	-174.6	178.2	0	0	0	0	111.5	I12 R13 I20 V21 T137 W171	I12-V17 PolarHBondContact O-N 2.93Å; I12-V17 VanDerWaalsContact O-N 3.09Å; R13-V17 WeakPolarHBondContact O-CB 3.04Å; V17-I20 PolarHBondContact O-N 2.8Å; V17-V21 WeakPolarHBondContact O-CG2 3.34Å; V17-V21 PolarHBondContact O-N 3.34Å; V17-T137 HydrophobicContact CG2-CG2 3.74Å; V17-W171 HydrophobicContact CG1-CZ2 3.77Å; V17-W171 PolarHBondContact O-NE1 2.96Å
18	L	92.5	Very high	90.9	Very high	98 Å²	98	63.9 Å²	63.9	51%	0.513	32%	0.319	S	S	.	.	H	α-helix	trans	-65.3	-43.7	-178.8	-66.9	176.6	0	0	0	113.1	R13 L14 I20 V21 F22	R13-L18 PolarHBondContact O-N 3.36Å; L14-L18 HydrophobicContact CD2-CD1 4Å; L18-I20 VanDerWaalsContact C-N 3.34Å; L18-I20 PolarHBondContact O-N 3.16Å; L18-V21 PolarHBondContact O-N 2.75Å; L18-F22 PolarHBondContact O-N 3.45Å
19	P	93.6	Very high	91	Very high	39 Å²	39	62.7 Å²	62.7	25%	0.253	31%	0.314	S	S	.	.	H	α-helix	trans	-62.8	-38.2	177.8	-29.5	41.2	0	0	0	113.1	L14 W15 V21 F22 I23	L14-P19 VanDerWaalsContact O-CD 3.23Å; L14-P19 WeakPolarHBondContact O-CD 3.38Å; L14-P19 WeakPolarHBondContact O-CG 3.21Å; W15-P19 WeakPolarHBondContact O-CG 3.49Å; P19-V21 PolarHBondContact O-N 3.17Å; P19-F22 PolarHBondContact O-N 2.83Å; P19-I23 WeakPolarHBondContact O-CB 3.44Å; P19-I23 WeakPolarHBondContact O-CG1 3.31Å; P19-I23 PolarHBondContact O-N 3.21Å
20	I	93.3	Very high	90.9	Very high	0 Å²	0	63.3 Å²	63.3	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-61.7	-44.9	175.3	-71.3	170.8	0	0	0	110.7	V16 V17 L18 F22 I23 T24 I128 Y172	V16-I20 HydrophobicContact CG1-CD1 3.68Å; V16-I20 WeakPolarHBondContact O-CB 3.33Å; V16-I20 WeakPolarHBondContact O-CD1 3.16Å; V16-I20 WeakPolarHBondContact O-CG1 3.08Å; V16-I20 PolarHBondContact O-N 3.35Å; V17-I20 PolarHBondContact O-N 2.8Å; L18-I20 VanDerWaalsContact C-N 3.34Å; L18-I20 PolarHBondContact O-N 3.16Å; I20-F22 VanDerWaalsContact C-N 3.34Å; I20-F22 PolarHBondContact O-N 2.79Å; I20-I23 PolarHBondContact O-N 3.37Å; I20-T24 HydrophobicContact CG2-CG2 4.19Å; I20-T24 WeakPolarHBondContact O-CB 3.44Å; I20-T24 WeakPolarHBondContact O-CG2 3.42Å; I20-T24 PolarHBondContact O-N 2.92Å; I20-T24 PolarHBondContact O-OG1 3.5Å; I20-T24 VanDerWaalsContact O-OG1 3.09Å; I20-I128 HydrophobicContact CD1-CG2 3.97Å; I20-I128 HydrophobicContact CG1-CG2 4.42Å; I20-Y172 HydrophobicContact CG2-CD2 4.45Å
21	V	92.6	Very high	90.5	Very high	43 Å²	43	62.5 Å²	62.5	26%	0.261	30%	0.302	S	S	.	.	H	α-helix	trans	-58.9	-48	176.1	177.1	0	0	0	0	110.3	V17 L18 P19 T24 F25 W171	V17-V21 WeakPolarHBondContact O-CG2 3.34Å; V17-V21 PolarHBondContact O-N 3.34Å; L18-V21 PolarHBondContact O-N 2.75Å; P19-V21 PolarHBondContact O-N 3.17Å; V21-T24 WeakPolarHBondContact CA-OG1 3.17Å; V21-T24 PolarHBondContact O-N 3.19Å; V21-T24 PolarHBondContact O-OG1 3.43Å; V21-F25 WeakPolarHBondContact O-CB 3.46Å; V21-F25 PolarHBondContact O-N 3.25Å; V21-W171 HydrophobicContact CG2-CZ2 3.77Å
22	F	92.6	Very high	90.1	Very high	129 Å²	129	59 Å²	59	57%	0.566	28%	0.283	S	S	*	.	H	α-helix	trans	-63.8	-44.7	-179.2	-172.6	-106.7	0	0	0	112.9	L18 P19 I20 F25 L26	L18-F22 PolarHBondContact O-N 3.45Å; P19-F22 PolarHBondContact O-N 2.83Å; I20-F22 VanDerWaalsContact C-N 3.34Å; I20-F22 PolarHBondContact O-N 2.79Å; F22-F25 PolarHBondContact O-N 3.35Å; F22-L26 HydrophobicContact CD1-CD1 3.84Å; F22-L26 HydrophobicContact CD1-CG 4.39Å; F22-L26 HydrophobicContact CE1-CD1 3.22Å; F22-L26 HydrophobicContact CE1-CG 4.06Å; F22-L26 HydrophobicContact CE2-CD1 4.24Å; F22-L26 HydrophobicContact CE2-CG 4.32Å; F22-L26 HydrophobicContact CZ-CD1 3.47Å; F22-L26 VanDerWaalsContact CZ-CD1 3.47Å; F22-L26 HydrophobicContact CZ-CD2 4.39Å; F22-L26 HydrophobicContact CZ-CG 4.02Å; F22-L26 PolarHBondContact O-N 3.11Å
23	I	91.4	Very high	89.8	Confident	49 Å²	49	63.6 Å²	63.6	25%	0.251	30%	0.299	S	S	.	.	H	α-helix	trans	-61.4	-47.7	176.3	-69.8	167.1	0	0	0	110.1	P19 I20 F25 L26 V27 W127	P19-I23 WeakPolarHBondContact O-CB 3.44Å; P19-I23 WeakPolarHBondContact O-CG1 3.31Å; P19-I23 PolarHBondContact O-N 3.21Å; I20-I23 PolarHBondContact O-N 3.37Å; I23-F25 VanDerWaalsContact C-N 3.29Å; I23-F25 PolarHBondContact O-N 3.08Å; I23-L26 PolarHBondContact O-N 2.98Å; I23-V27 HydrophobicContact CG2-CG2 4.12Å; I23-V27 VanDerWaalsContact O-CB 3.3Å; I23-V27 WeakPolarHBondContact O-CB 3.33Å; I23-V27 WeakPolarHBondContact O-CG2 3.35Å; I23-V27 PolarHBondContact O-N 3.3Å; I23-W127 HydrophobicContact CD1-CH2 4.47Å; I23-W127 HydrophobicContact CD1-CZ3 4.26Å
24	T	90.3	Very high	89.6	Confident	5 Å²	5	59.5 Å²	59.5	3%	0.031	29%	0.291	C	S	.	.	H	α-helix	trans	-58.7	-43.6	179.3	57.1	0	0	0	0	111.7	I20 V21 G28 Y172 N175 V176 L179 Y183	I20-T24 HydrophobicContact CG2-CG2 4.19Å; I20-T24 WeakPolarHBondContact O-CB 3.44Å; I20-T24 WeakPolarHBondContact O-CG2 3.42Å; I20-T24 PolarHBondContact O-N 2.92Å; I20-T24 PolarHBondContact O-OG1 3.5Å; I20-T24 VanDerWaalsContact O-OG1 3.09Å; V21-T24 WeakPolarHBondContact CA-OG1 3.17Å; V21-T24 PolarHBondContact O-N 3.19Å; V21-T24 PolarHBondContact O-OG1 3.43Å; T24-G28 PolarHBondContact O-N 3.39Å; T24-Y172 HydrophobicContact CG2-CD2 3.2Å; T24-Y172 HydrophobicContact CG2-CE2 3.44Å; T24-Y172 VanDerWaalsContact CG2-CE2 3.44Å; T24-Y172 HydrophobicContact CG2-CG 4.3Å; T24-N175 HydrophobicContact CG2-CB 4.03Å; T24-V176 HydrophobicContact CG2-CG2 4.26Å; T24-L179 WeakPolarHBondContact OG1-CD1 3.45Å; T24-Y183 PolarHBondContact O-OH 2.86Å
25	F	89.8	Confident	88.9	Confident	58 Å²	58	57 Å²	57	25%	0.254	28%	0.281	S	S	.	.	H	α-helix	trans	-61.8	-54.5	177.9	-179	-105.1	0	0	0	112.4	V21 F22 I23 V27 G28 V29 L179 M182 Y183 I186	V21-F25 WeakPolarHBondContact O-CB 3.46Å; V21-F25 PolarHBondContact O-N 3.25Å; F22-F25 PolarHBondContact O-N 3.35Å; I23-F25 VanDerWaalsContact C-N 3.29Å; I23-F25 PolarHBondContact O-N 3.08Å; F25-V27 PolarHBondContact O-N 2.92Å; F25-G28 PolarHBondContact O-N 2.96Å; F25-G28 VanDerWaalsContact O-N 3.14Å; F25-V29 HydrophobicContact CE1-CG2 4.2Å; F25-V29 HydrophobicContact CE2-CG2 4.36Å; F25-V29 HydrophobicContact CZ-CG2 4.06Å; F25-V29 WeakPolarHBondContact O-CG2 3.19Å; F25-V29 PolarHBondContact O-N 3.33Å; F25-V29 VanDerWaalsContact O-N 3.08Å; F25-L179 HydrophobicContact CB-CD1 4.37Å; F25-M182 HydrophobicContact CD2-CE 3.31Å; F25-M182 HydrophobicContact CE2-CE 3.48Å; F25-M182 VanDerWaalsContact CE2-CE 3.48Å; F25-M182 HydrophobicContact CG-CE 4.46Å; F25-Y183 VanDerWaalsContact CA-OH 3.28Å; F25-Y183 WeakPolarHBondContact CA-OH 3.49Å; F25-Y183 HydrophobicContact CD2-CD1 4.21Å; F25-Y183 AromaticContact CD2-CE1 3.5Å; F25-Y183 HydrophobicContact CD2-CE1 3.5Å; F25-Y183 VanDerWaalsContact CD2-CE1 3.5Å; F25-Y183 HydrophobicContact CE2-CD1 4.1Å; F25-Y183 AromaticContact CE2-CE1 3.84Å; F25-Y183 HydrophobicContact CE2-CE1 3.84Å; F25-Y183 HydrophobicContact CG-CE1 4.4Å; F25-I186 HydrophobicContact CE2-CD1 3.92Å; F25-I186 HydrophobicContact CZ-CD1 4.04Å
26	L	90.2	Very high	88.4	Confident	70 Å²	70	52.4 Å²	52.4	37%	0.366	27%	0.269	S	S	.	.	H	α-helix	trans	-62.8	-41.8	-178.7	-73	-174.2	0	0	0	112.6	F22 I23 G28 V29 I30	F22-L26 HydrophobicContact CD1-CD1 3.84Å; F22-L26 HydrophobicContact CD1-CG 4.39Å; F22-L26 HydrophobicContact CE1-CD1 3.22Å; F22-L26 HydrophobicContact CE1-CG 4.06Å; F22-L26 HydrophobicContact CE2-CD1 4.24Å; F22-L26 HydrophobicContact CE2-CG 4.32Å; F22-L26 HydrophobicContact CZ-CD1 3.47Å; F22-L26 VanDerWaalsContact CZ-CD1 3.47Å; F22-L26 HydrophobicContact CZ-CD2 4.39Å; F22-L26 HydrophobicContact CZ-CG 4.02Å; F22-L26 PolarHBondContact O-N 3.11Å; I23-L26 PolarHBondContact O-N 2.98Å; L26-G28 VanDerWaalsContact C-N 3.27Å; L26-G28 PolarHBondContact O-N 3.39Å; L26-V29 PolarHBondContact O-N 3.43Å; L26-I30 VanDerWaalsContact O-CG1 3.3Å; L26-I30 WeakPolarHBondContact O-CG1 3.5Å; L26-I30 PolarHBondContact O-N 2.85Å
27	V	88.1	Confident	88	Confident	47 Å²	47	59 Å²	59	29%	0.285	30%	0.304	S	S	.	.	H	α-helix	trans	-61.4	-40.2	175.8	168.2	0	0	0	0	110.5	I23 F25 V29 I30 R31 I124	I23-V27 HydrophobicContact CG2-CG2 4.12Å; I23-V27 VanDerWaalsContact O-CB 3.3Å; I23-V27 WeakPolarHBondContact O-CB 3.33Å; I23-V27 WeakPolarHBondContact O-CG2 3.35Å; I23-V27 PolarHBondContact O-N 3.3Å; F25-V27 PolarHBondContact O-N 2.92Å; V27-V29 VanDerWaalsContact C-N 3.34Å; V27-V29 PolarHBondContact O-N 2.95Å; V27-I30 PolarHBondContact O-N 2.82Å; V27-R31 VanDerWaalsContact O-CB 3.23Å; V27-R31 WeakPolarHBondContact O-CB 3.31Å; V27-R31 PolarHBondContact O-N 3.09Å; V27-I124 HydrophobicContact CB-CD1 4.31Å; V27-I124 HydrophobicContact CG1-CD1 3.49Å; V27-I124 VanDerWaalsContact CG1-CD1 3.49Å; V27-I124 HydrophobicContact CG2-CD1 3.92Å
28	G	85.6	Confident	87.3	Confident	5 Å²	5	63 Å²	63	5%	0.052	32%	0.324	C	S	.	.	H	α-helix	trans	-58.5	-45.3	174.9	0	0	0	0	0	112.5	T24 F25 L26 H32	T24-G28 PolarHBondContact O-N 3.39Å; F25-G28 PolarHBondContact O-N 2.96Å; F25-G28 VanDerWaalsContact O-N 3.14Å; L26-G28 VanDerWaalsContact C-N 3.27Å; L26-G28 PolarHBondContact O-N 3.39Å; G28-H32 PolarHBondContact O-N 3.48Å; G28-H32 VanDerWaalsContact O-N 3.11Å
29	V	86.9	Confident	86.4	Confident	30 Å²	30	65.2 Å²	65.2	18%	0.182	33%	0.331	C	S	.	.	H	α-helix	trans	-66.6	-47.7	177.4	175.7	0	0	0	0	111.7	F25 L26 V27 R31 H32 Y33	F25-V29 HydrophobicContact CE1-CG2 4.2Å; F25-V29 HydrophobicContact CE2-CG2 4.36Å; F25-V29 HydrophobicContact CZ-CG2 4.06Å; F25-V29 WeakPolarHBondContact O-CG2 3.19Å; F25-V29 PolarHBondContact O-N 3.33Å; F25-V29 VanDerWaalsContact O-N 3.08Å; L26-V29 PolarHBondContact O-N 3.43Å; V27-V29 VanDerWaalsContact C-N 3.34Å; V27-V29 PolarHBondContact O-N 2.95Å; V29-R31 VanDerWaalsContact C-N 3.29Å; V29-R31 PolarHBondContact O-N 2.83Å; V29-H32 WeakPolarHBondContact O-CB 3.26Å; V29-H32 PolarHBondContact O-N 3.4Å; V29-Y33 HydrophobicContact CG1-CD2 3.91Å; V29-Y33 HydrophobicContact CG1-CE2 3.58Å; V29-Y33 VanDerWaalsContact O-CD2 3.26Å; V29-Y33 WeakPolarHBondContact O-CD2 3.39Å; V29-Y33 PolarHBondContact O-N 3.4Å
30	I	87.9	Confident	85.2	Confident	102 Å²	102	67.7 Å²	67.7	52%	0.523	35%	0.349	S	S	.	.	H	α-helix	trans	-58.6	-45	177.4	-69.5	167.2	0	0	0	110.1	L26 V27 H32 Y33 V34	L26-I30 VanDerWaalsContact O-CG1 3.3Å; L26-I30 WeakPolarHBondContact O-CG1 3.5Å; L26-I30 PolarHBondContact O-N 2.85Å; V27-I30 PolarHBondContact O-N 2.82Å; I30-H32 VanDerWaalsContact C-N 3.32Å; I30-H32 PolarHBondContact O-N 3Å; I30-Y33 PolarHBondContact O-N 2.82Å; I30-V34 HydrophobicContact CG2-CG2 4.08Å; I30-V34 WeakPolarHBondContact O-CB 3.37Å; I30-V34 VanDerWaalsContact O-CG2 3.3Å; I30-V34 WeakPolarHBondContact O-CG2 3.18Å; I30-V34 PolarHBondContact O-N 2.65Å
31	R	82.5	Confident	84	Confident	54 Å²	54	75 Å²	75	20%	0.204	39%	0.388	C	S	.	.	H	α-helix	trans	-58.5	-44	178	-178	-178.3	69.7	139.7	-14.2	111.8	V27 V29 Y33 V34 S35 A193	V27-R31 VanDerWaalsContact O-CB 3.23Å; V27-R31 WeakPolarHBondContact O-CB 3.31Å; V27-R31 PolarHBondContact O-N 3.09Å; V29-R31 VanDerWaalsContact C-N 3.29Å; V29-R31 PolarHBondContact O-N 2.83Å; R31-Y33 PolarHBondContact O-N 3.47Å; R31-V34 PolarHBondContact O-N 2.83Å; R31-S35 WeakPolarHBondContact O-CB 3.4Å; R31-S35 PolarHBondContact O-N 3.22Å; R31-A193 PolarHBondContact NH2-O 3.3Å
32	H	83.2	Confident	82.8	Confident	13 Å²	13	78.7 Å²	78.7	6%	0.06	40%	0.401	C	S	.	.	H	α-helix	trans	-56.1	-50.8	177.7	171.6	85	0	0	0	111.2	G28 V29 I30 S35 I36 L187 N191	G28-H32 PolarHBondContact O-N 3.48Å; G28-H32 VanDerWaalsContact O-N 3.11Å; V29-H32 WeakPolarHBondContact O-CB 3.26Å; V29-H32 PolarHBondContact O-N 3.4Å; I30-H32 VanDerWaalsContact C-N 3.32Å; I30-H32 PolarHBondContact O-N 3Å; H32-S35 WeakPolarHBondContact O-CB 3.12Å; H32-S35 PolarHBondContact O-N 3.3Å; H32-I36 VanDerWaalsContact NE2-CD1 3.34Å; H32-I36 WeakPolarHBondContact NE2-CD1 3.37Å; H32-I36 WeakPolarHBondContact O-CG1 3.46Å; H32-I36 PolarHBondContact O-N 3.36Å; H32-I36 VanDerWaalsContact O-N 3.11Å; H32-L187 HydrophobicContact CB-CD1 3.91Å; H32-N191 PolarHBondContact ND1-OD1 2.97Å
33	Y	86.1	Confident	81.7	Confident	129 Å²	129	82.4 Å²	82.4	51%	0.506	42%	0.417	S	S	.	.	H	α-helix	trans	-67.3	-39.4	179	-69.8	-62.5	0	0	0	113.3	V29 I30 R31 S35 I36 L37	V29-Y33 HydrophobicContact CG1-CD2 3.91Å; V29-Y33 HydrophobicContact CG1-CE2 3.58Å; V29-Y33 VanDerWaalsContact O-CD2 3.26Å; V29-Y33 WeakPolarHBondContact O-CD2 3.39Å; V29-Y33 PolarHBondContact O-N 3.4Å; I30-Y33 PolarHBondContact O-N 2.82Å; R31-Y33 PolarHBondContact O-N 3.47Å; Y33-S35 VanDerWaalsContact C-N 3.28Å; Y33-S35 PolarHBondContact O-N 3.5Å; Y33-I36 PolarHBondContact O-N 2.98Å; Y33-L37 WeakPolarHBondContact O-CG 3.09Å; Y33-L37 PolarHBondContact O-N 2.97Å
34	V	84.8	Confident	80.8	Confident	65 Å²	65	85.7 Å²	85.7	39%	0.394	43%	0.434	S	S	.	.	H	α-helix	trans	-61.9	-38.9	174.6	170.1	0	0	0	0	110.9	I30 R31 L37 L38	I30-V34 HydrophobicContact CG2-CG2 4.08Å; I30-V34 WeakPolarHBondContact O-CB 3.37Å; I30-V34 VanDerWaalsContact O-CG2 3.3Å; I30-V34 WeakPolarHBondContact O-CG2 3.18Å; I30-V34 PolarHBondContact O-N 2.65Å; R31-V34 PolarHBondContact O-N 2.83Å; V34-L37 PolarHBondContact O-N 3.02Å; V34-L38 HydrophobicContact CG1-CD1 3.59Å; V34-L38 HydrophobicContact CG1-CG 4.17Å; V34-L38 WeakPolarHBondContact O-CB 3.4Å; V34-L38 VanDerWaalsContact O-CG 3.31Å; V34-L38 WeakPolarHBondContact O-CG 3.38Å; V34-L38 PolarHBondContact O-N 3.45Å
35	S	78.6	Confident	80.3	Confident	43 Å²	43	88.9 Å²	88.9	30%	0.301	45%	0.454	S	S	.	.	H	α-helix	trans	-62.7	-42.1	176	-172.3	0	0	0	0	111.8	R31 H32 Y33 L37 L38 Q39	R31-S35 WeakPolarHBondContact O-CB 3.4Å; R31-S35 PolarHBondContact O-N 3.22Å; H32-S35 WeakPolarHBondContact O-CB 3.12Å; H32-S35 PolarHBondContact O-N 3.3Å; Y33-S35 VanDerWaalsContact C-N 3.28Å; Y33-S35 PolarHBondContact O-N 3.5Å; S35-L37 VanDerWaalsContact C-N 3.34Å; S35-L38 PolarHBondContact O-N 3.05Å; S35-Q39 PolarHBondContact O-N 3.36Å
36	I	81.3	Confident	80	Confident	87 Å²	87	93.7 Å²	93.7	45%	0.446	48%	0.481	S	S	.	.	H	α-helix	trans	-62.5	-43.9	175.5	-67.8	169.7	0	0	0	110.4	H32 Y33 L38 Q39	H32-I36 VanDerWaalsContact NE2-CD1 3.34Å; H32-I36 WeakPolarHBondContact NE2-CD1 3.37Å; H32-I36 WeakPolarHBondContact O-CG1 3.46Å; H32-I36 PolarHBondContact O-N 3.36Å; H32-I36 VanDerWaalsContact O-N 3.11Å; Y33-I36 PolarHBondContact O-N 2.98Å; I36-L38 VanDerWaalsContact C-N 3.33Å; I36-L38 PolarHBondContact O-N 3.08Å; I36-Q39 WeakPolarHBondContact O-CB 3.31Å; I36-Q39 PolarHBondContact O-N 3.47Å
37	L	83.5	Confident	79.7	Confident	148 Å²	148	95 Å²	95	78%	0.775	49%	0.486	S	S	*	.	H	α-helix	trans	-68.4	-31.2	179.8	-68.5	174	0	0	0	113.4	Y33 V34 S35	Y33-L37 WeakPolarHBondContact O-CG 3.09Å; Y33-L37 PolarHBondContact O-N 2.97Å; V34-L37 PolarHBondContact O-N 3.02Å; S35-L37 VanDerWaalsContact C-N 3.34Å
38	L	77.8	Confident	79.3	Confident	110 Å²	110	97.6 Å²	97.6	58%	0.576	50%	0.495	S	S	*	.	H	α-helix	trans	-87.6	-7.7	178.6	-71.5	175.4	0	0	0	113.4	V34 S35 I36 S40	V34-L38 HydrophobicContact CG1-CD1 3.59Å; V34-L38 HydrophobicContact CG1-CG 4.17Å; V34-L38 WeakPolarHBondContact O-CB 3.4Å; V34-L38 VanDerWaalsContact O-CG 3.31Å; V34-L38 WeakPolarHBondContact O-CG 3.38Å; V34-L38 PolarHBondContact O-N 3.45Å; S35-L38 PolarHBondContact O-N 3.05Å; I36-L38 VanDerWaalsContact C-N 3.33Å; I36-L38 PolarHBondContact O-N 3.08Å; L38-S40 PolarHBondContact O-N 3.06Å; L38-S40 VanDerWaalsContact O-N 3.08Å
39	Q	73.8	Confident	79.3	Confident	143 Å²	143	99.9 Å²	99.9	67%	0.668	51%	0.507	S	S	*	.			trans	-66.2	110.4	177.3	-170.9	170	-9.5	0	0	108.8	S35 I36	S35-Q39 PolarHBondContact O-N 3.36Å; I36-Q39 WeakPolarHBondContact O-CB 3.31Å; I36-Q39 PolarHBondContact O-N 3.47Å
40	S	68.6	Low	79.3	Confident	91 Å²	91	101.2 Å²	101.2	64%	0.636	52%	0.518	S	S	*	.			trans	-99.8	127.6	177	63.1	0	0	0	0	110.5	L38 K42	L38-S40 PolarHBondContact O-N 3.06Å; L38-S40 VanDerWaalsContact O-N 3.08Å; S40-K42 PolarHBondContact O-N 3.4Å; S40-K42 VanDerWaalsContact O-N 3.17Å
41	D	69.1	Low	79.2	Confident	153 Å²	153	96.5 Å²	96.5	82%	0.818	49%	0.494	S	S	*	.			trans	-66.9	113.9	168.9	-69.7	-40.3	0	0	0	109.5	K43	D41-K43 PolarHBondContact O-N 3.43Å
42	K	67.3	Low	79.3	Confident	121 Å²	121	96.7 Å²	96.7	53%	0.526	50%	0.503	S	S	.	.			trans	-65.4	125.5	173.5	-69.3	-172.4	173.8	-165.2	0	108.2	S40 L44 D109	S40-K42 PolarHBondContact O-N 3.4Å; S40-K42 VanDerWaalsContact O-N 3.17Å; K42-L44 PolarHBondContact O-N 2.9Å; K42-D109 WeakPolarHBondContact CE-OD2 3.41Å; K42-D109 IonicContact NZ-OD2 3.55Å; K42-D109 PolarHBondContact NZ-OD2 3.49Å
43	K	69.1	Low	79.6	Confident	208 Å²	208	102 Å²	102	90%	0.904	53%	0.528	S	S	*	.			trans	-67.3	97.8	172.2	-67.1	-173.7	179.7	-177.3	0	108.6	D41	D41-K43 PolarHBondContact O-N 3.43Å
44	L	71.5	Confident	79.8	Confident	117 Å²	117	97 Å²	97	61%	0.613	51%	0.511	S	S	*	.			trans	-75.5	140.2	173.8	-63.6	173.5	0	0	0	109.6	K42 V49	K42-L44 PolarHBondContact O-N 2.9Å; L44-V49 HydrophobicContact CB-CG2 3.74Å; L44-V49 HydrophobicContact CD1-CG2 4.04Å
45	T	81.1	Confident	80	Confident	72 Å²	72	95.5 Å²	95.5	44%	0.442	50%	0.501	S	S	.	.			trans	-75.2	147.2	170.8	65.1	0	0	0	0	109.7	E47 Q48 V49	T45-E47 PolarHBondContact O-N 2.97Å; T45-E47 VanDerWaalsContact O-N 3.16Å; T45-Q48 PolarHBondContact O-N 3.03Å; T45-Q48 VanDerWaalsContact O-N 3.09Å; T45-Q48 WeakPolarHBondContact OG1-CB 3.23Å; T45-Q48 WeakPolarHBondContact OG1-CG 3.44Å; T45-Q48 PolarHBondContact OG1-N 3.09Å; T45-Q48 PolarHBondContact OG1-OE1 3.26Å; T45-V49 PolarHBondContact O-N 2.81Å; T45-V49 VanDerWaalsContact O-N 3.13Å
46	L	83.6	Confident	80.6	Confident	159 Å²	159	97.6 Å²	97.6	83%	0.832	51%	0.508	S	S	*	.	H	α-helix	trans	-54.9	-35	176.8	-72.2	171.4	0	0	0	112	V49 S50	L46-V49 PolarHBondContact O-N 3.48Å; L46-S50 WeakPolarHBondContact O-CB 3.46Å; L46-S50 PolarHBondContact O-N 2.89Å
47	E	83.9	Confident	81.1	Confident	98 Å²	98	100.1 Å²	100.1	46%	0.458	51%	0.512	S	S	.	.	H	α-helix	trans	-63.2	-46.5	177.1	-171.7	176.8	-179.6	0	0	112.2	T45 V49 S50 D51 R93	T45-E47 PolarHBondContact O-N 2.97Å; T45-E47 VanDerWaalsContact O-N 3.16Å; E47-V49 PolarHBondContact O-N 3.47Å; E47-S50 PolarHBondContact O-N 3.13Å; E47-D51 WeakPolarHBondContact O-CB 3.41Å; E47-D51 VanDerWaalsContact O-CG 3.32Å; E47-D51 PolarHBondContact O-N 2.92Å; E47-R93 VanDerWaalsContact CG-CZ 3.5Å; E47-R93 WeakPolarHBondContact OE1-CD 3.11Å; E47-R93 IonicContact OE1-CZ 3.9Å; E47-R93 IonicContact OE1-NE 3.41Å; E47-R93 PolarHBondContact OE1-NE 2.95Å; E47-R93 IonicContact OE1-NH1 3.92Å; E47-R93 PolarHBondContact OE1-NH1 2.98Å
48	Q	79.8	Confident	81.5	Confident	102 Å²	102	93 Å²	93	48%	0.477	48%	0.475	S	S	.	.	H	α-helix	trans	-63.9	-40.3	177.3	-75.5	170.6	-24	0	0	112.3	T45 S52	T45-Q48 PolarHBondContact O-N 3.03Å; T45-Q48 VanDerWaalsContact O-N 3.09Å; T45-Q48 WeakPolarHBondContact OG1-CB 3.23Å; T45-Q48 WeakPolarHBondContact OG1-CG 3.44Å; T45-Q48 PolarHBondContact OG1-N 3.09Å; T45-Q48 PolarHBondContact OG1-OE1 3.26Å; Q48-S52 WeakPolarHBondContact O-CB 3.48Å; Q48-S52 PolarHBondContact O-N 2.9Å
49	V	84.8	Confident	82.2	Confident	52 Å²	52	94 Å²	94	32%	0.315	47%	0.471	S	S	.	.	H	α-helix	trans	-65.3	-45.2	177.5	177.3	0	0	0	0	110.4	L44 T45 L46 E47 S52 Q53	L44-V49 HydrophobicContact CB-CG2 3.74Å; L44-V49 HydrophobicContact CD1-CG2 4.04Å; T45-V49 PolarHBondContact O-N 2.81Å; T45-V49 VanDerWaalsContact O-N 3.13Å; L46-V49 PolarHBondContact O-N 3.48Å; E47-V49 PolarHBondContact O-N 3.47Å; V49-S52 PolarHBondContact O-N 2.83Å; V49-Q53 WeakPolarHBondContact O-CG 3.47Å; V49-Q53 PolarHBondContact O-N 3.41Å
50	S	86.8	Confident	83.1	Confident	58 Å²	58	91.4 Å²	91.4	41%	0.406	46%	0.461	S	S	.	.	H	α-helix	trans	-59.1	-48.9	176.9	-175.3	0	0	0	0	111.6	L46 E47 S52 Q53 V54	L46-S50 WeakPolarHBondContact O-CB 3.46Å; L46-S50 PolarHBondContact O-N 2.89Å; E47-S50 PolarHBondContact O-N 3.13Å; S50-S52 VanDerWaalsContact C-N 3.34Å; S50-S52 PolarHBondContact O-N 3.41Å; S50-Q53 PolarHBondContact O-N 2.94Å; S50-V54 WeakPolarHBondContact O-CG2 3.18Å; S50-V54 PolarHBondContact O-N 3.18Å
51	D	86.4	Confident	84.2	Confident	4 Å²	4	87.8 Å²	87.8	2%	0.021	43%	0.434	C	S	.	.	H	α-helix	trans	-62.7	-40.7	179.8	-72.8	-10.7	0	0	0	112.1	E47 V54 L55 R93 F218	E47-D51 WeakPolarHBondContact O-CB 3.41Å; E47-D51 VanDerWaalsContact O-CG 3.32Å; E47-D51 PolarHBondContact O-N 2.92Å; D51-V54 PolarHBondContact O-N 3.24Å; D51-L55 WeakPolarHBondContact O-CG 3.29Å; D51-L55 PolarHBondContact O-N 2.92Å; D51-R93 IonicContact OD1-CZ 3.56Å; D51-R93 IonicContact OD1-NE 3.16Å; D51-R93 PolarHBondContact OD1-NE 3.26Å; D51-R93 IonicContact OD1-NH2 2.77Å; D51-R93 PolarHBondContact OD1-NH2 2.94Å; D51-R93 IonicContact OD2-CZ 2.64Å; D51-R93 IonicContact OD2-NE 2.8Å; D51-R93 PolarHBondContact OD2-NE 3.49Å; D51-R93 IonicContact OD2-NH2 3.27Å; D51-F218 HydrophobicContact CB-CE1 4.35Å; D51-F218 HydrophobicContact CB-CZ 3.88Å
52	S	84.7	Confident	85.4	Confident	57 Å²	57	84.5 Å²	84.5	40%	0.399	41%	0.41	S	S	.	.	H	α-helix	trans	-61.3	-45.9	174.7	-179.2	0	0	0	0	111.9	Q48 V49 S50 V54 L55 I56	Q48-S52 WeakPolarHBondContact O-CB 3.48Å; Q48-S52 PolarHBondContact O-N 2.9Å; V49-S52 PolarHBondContact O-N 2.83Å; S50-S52 VanDerWaalsContact C-N 3.34Å; S50-S52 PolarHBondContact O-N 3.41Å; S52-V54 VanDerWaalsContact C-N 3.33Å; S52-V54 PolarHBondContact O-N 2.99Å; S52-L55 WeakPolarHBondContact O-CB 3.43Å; S52-L55 PolarHBondContact O-N 3.31Å; S52-I56 WeakPolarHBondContact O-CG1 3.46Å; S52-I56 PolarHBondContact O-N 3.19Å
53	Q	88.3	Confident	86.5	Confident	125 Å²	125	83.5 Å²	83.5	58%	0.584	41%	0.407	S	S	*	.	H	α-helix	trans	-64.2	-37.2	177.4	-72.7	176.8	-2.4	0	0	112.3	V49 S50 I56 R57	V49-Q53 WeakPolarHBondContact O-CG 3.47Å; V49-Q53 PolarHBondContact O-N 3.41Å; S50-Q53 PolarHBondContact O-N 2.94Å; Q53-I56 PolarHBondContact O-N 3.46Å; Q53-R57 WeakPolarHBondContact O-CB 3.42Å; Q53-R57 PolarHBondContact O-N 2.94Å
54	V	91.4	Very high	87.7	Confident	23 Å²	23	77.3 Å²	77.3	14%	0.139	38%	0.384	C	S	.	.	H	α-helix	trans	-65.5	-41.7	175.5	174.2	0	0	0	0	111.4	S50 D51 S52 R57 S58 F80 F87 F88	S50-V54 WeakPolarHBondContact O-CG2 3.18Å; S50-V54 PolarHBondContact O-N 3.18Å; D51-V54 PolarHBondContact O-N 3.24Å; S52-V54 VanDerWaalsContact C-N 3.33Å; S52-V54 PolarHBondContact O-N 2.99Å; V54-R57 WeakPolarHBondContact O-CB 3.18Å; V54-R57 PolarHBondContact O-N 3.33Å; V54-S58 PolarHBondContact O-N 3.35Å; V54-F80 HydrophobicContact CG1-CE1 3.84Å; V54-F87 HydrophobicContact CB-CE1 4.15Å; V54-F87 HydrophobicContact CB-CZ 4.34Å; V54-F87 HydrophobicContact CG1-CD1 3.71Å; V54-F87 HydrophobicContact CG1-CE1 3.47Å; V54-F87 VanDerWaalsContact CG1-CE1 3.47Å; V54-F87 HydrophobicContact CG1-CG 4.44Å; V54-F87 HydrophobicContact CG1-CZ 4Å; V54-F87 HydrophobicContact CG2-CE1 4.42Å; V54-F87 HydrophobicContact CG2-CZ 4.15Å; V54-F88 HydrophobicContact CG1-CE1 4.39Å
55	L	89.6	Confident	88.7	Confident	34 Å²	34	72 Å²	72	18%	0.178	36%	0.357	C	S	.	.	H	α-helix	trans	-60.8	-46.3	173.7	-75.6	169.8	0	0	0	111.8	D51 S52 R57 S58 R59 F88 A217 F218 E221	D51-L55 WeakPolarHBondContact O-CG 3.29Å; D51-L55 PolarHBondContact O-N 2.92Å; S52-L55 WeakPolarHBondContact O-CB 3.43Å; S52-L55 PolarHBondContact O-N 3.31Å; L55-R57 VanDerWaalsContact C-N 3.32Å; L55-R57 PolarHBondContact O-N 2.99Å; L55-S58 WeakPolarHBondContact O-CB 3.49Å; L55-S58 PolarHBondContact O-N 3Å; L55-R59 PolarHBondContact O-N 2.93Å; L55-F88 HydrophobicContact CD2-CE1 4.22Å; L55-A217 HydrophobicContact CD1-CB 3.91Å; L55-A217 HydrophobicContact CD2-CB 4.39Å; L55-F218 HydrophobicContact CD1-CD1 4.47Å; L55-F218 HydrophobicContact CD1-CE1 4.24Å; L55-F218 HydrophobicContact CD2-CD1 3.75Å; L55-F218 HydrophobicContact CD2-CE1 4.12Å; L55-F218 HydrophobicContact CG-CD1 4.13Å; L55-F218 HydrophobicContact CG-CE1 3.96Å; L55-E221 HydrophobicContact CD2-CB 4.16Å; L55-E221 HydrophobicContact CD2-CG 3.9Å
56	I	89.9	Confident	89.3	Confident	88 Å²	88	72.7 Å²	72.7	45%	0.451	35%	0.354	S	S	.	.	H	α-helix	trans	-60.1	-44.1	176.3	-67.3	165.3	0	0	0	110.4	S52 Q53 S58 R59 I60	S52-I56 WeakPolarHBondContact O-CG1 3.46Å; S52-I56 PolarHBondContact O-N 3.19Å; Q53-I56 PolarHBondContact O-N 3.46Å; I56-S58 VanDerWaalsContact C-N 3.32Å; I56-S58 PolarHBondContact O-N 3.48Å; I56-R59 PolarHBondContact O-N 3.25Å; I56-I60 HydrophobicContact CG2-CD1 3.77Å; I56-I60 HydrophobicContact CG2-CG1 4.37Å; I56-I60 WeakPolarHBondContact O-CG1 3.34Å; I56-I60 PolarHBondContact O-N 3.43Å
57	R	92.6	Very high	89.8	Confident	139 Å²	139	71 Å²	71	53%	0.525	34%	0.337	S	S	.	.	H	α-helix	trans	-59.8	-42	176.6	179.9	179.5	176.3	-173.3	-1	112	Q53 V54 L55 I60 L61 F80	Q53-R57 WeakPolarHBondContact O-CB 3.42Å; Q53-R57 PolarHBondContact O-N 2.94Å; V54-R57 WeakPolarHBondContact O-CB 3.18Å; V54-R57 PolarHBondContact O-N 3.33Å; L55-R57 VanDerWaalsContact C-N 3.32Å; L55-R57 PolarHBondContact O-N 2.99Å; R57-I60 PolarHBondContact O-N 3.31Å; R57-L61 WeakPolarHBondContact O-CB 3.34Å; R57-L61 PolarHBondContact O-N 3.45Å; R57-F80 HydrophobicContact CG-CZ 4.43Å
58	S	91.9	Very high	90.4	Very high	0 Å²	0	68.6 Å²	68.6	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-64.3	-42.5	176.1	-172.8	0	0	0	0	111.9	V54 L55 I56 L61 R62 F88	V54-S58 PolarHBondContact O-N 3.35Å; L55-S58 WeakPolarHBondContact O-CB 3.49Å; L55-S58 PolarHBondContact O-N 3Å; I56-S58 VanDerWaalsContact C-N 3.32Å; I56-S58 PolarHBondContact O-N 3.48Å; S58-L61 WeakPolarHBondContact O-CB 3.49Å; S58-L61 PolarHBondContact O-N 3.05Å; S58-R62 WeakPolarHBondContact O-CB 3.1Å; S58-R62 PolarHBondContact O-N 3.2Å; S58-F88 WeakPolarHBondContact OG-CZ 3.43Å
59	R	91.1	Very high	91.1	Very high	130 Å²	130	67.2 Å²	67.2	49%	0.491	33%	0.327	S	S	.	.	H	α-helix	trans	-61.5	-46.9	175.6	-174.6	-179	-63.1	177.7	-0.8	111.9	L55 I56 L61 R62 E63 E221	L55-R59 PolarHBondContact O-N 2.93Å; I56-R59 PolarHBondContact O-N 3.25Å; R59-L61 VanDerWaalsContact C-N 3.3Å; R59-L61 PolarHBondContact O-N 3.18Å; R59-R62 WeakPolarHBondContact O-CB 3.38Å; R59-R62 PolarHBondContact O-N 2.87Å; R59-R62 VanDerWaalsContact O-N 3.13Å; R59-E63 HydrophobicContact CG-CG 4.39Å; R59-E63 VanDerWaalsContact CG-OE1 3.23Å; R59-E63 WeakPolarHBondContact CG-OE1 3.49Å; R59-E63 WeakPolarHBondContact O-CG 3.44Å; R59-E63 PolarHBondContact O-N 2.93Å; R59-E221 IonicContact NE-OE1 3.39Å
60	I	92.9	Very high	91.5	Very high	89 Å²	89	70.9 Å²	70.9	46%	0.456	34%	0.339	S	S	.	.	H	α-helix	trans	-61.9	-40	176.5	-67	168.5	0	0	0	110.7	I56 R57 R62 E63 N64	I56-I60 HydrophobicContact CG2-CD1 3.77Å; I56-I60 HydrophobicContact CG2-CG1 4.37Å; I56-I60 WeakPolarHBondContact O-CG1 3.34Å; I56-I60 PolarHBondContact O-N 3.43Å; R57-I60 PolarHBondContact O-N 3.31Å; I60-R62 VanDerWaalsContact C-N 3.32Å; I60-R62 PolarHBondContact O-N 3.41Å; I60-E63 PolarHBondContact O-N 3.22Å; I60-N64 HydrophobicContact CG2-CB 4.41Å; I60-N64 WeakPolarHBondContact O-CA 3.43Å; I60-N64 WeakPolarHBondContact O-CB 3.45Å; I60-N64 PolarHBondContact O-N 3.4Å
61	L	93.4	Very high	91.9	Very high	15 Å²	15	74.3 Å²	74.3	8%	0.079	35%	0.348	C	S	.	.	H	α-helix	trans	-61.8	-41.3	175.1	179.2	65.8	0	0	0	111.4	R57 S58 R59 G65 I68 F73 R76 F80	R57-L61 WeakPolarHBondContact O-CB 3.34Å; R57-L61 PolarHBondContact O-N 3.45Å; S58-L61 WeakPolarHBondContact O-CB 3.49Å; S58-L61 PolarHBondContact O-N 3.05Å; R59-L61 VanDerWaalsContact C-N 3.3Å; R59-L61 PolarHBondContact O-N 3.18Å; L61-G65 WeakPolarHBondContact O-CA 3.4Å; L61-G65 PolarHBondContact O-N 2.96Å; L61-I68 HydrophobicContact CD1-CD1 3.93Å; L61-F73 HydrophobicContact CD1-CD2 3.77Å; L61-F73 HydrophobicContact CD1-CE2 4.13Å; L61-F73 HydrophobicContact CG-CD2 4.26Å; L61-F73 HydrophobicContact CG-CE2 4.12Å; L61-R76 HydrophobicContact CD1-CB 4.15Å; L61-R76 HydrophobicContact CD2-CB 3.68Å; L61-F80 HydrophobicContact CD2-CD2 3.87Å; L61-F80 HydrophobicContact CD2-CE2 3.95Å
62	R	92.3	Very high	92.4	Very high	84 Å²	84	75.9 Å²	75.9	32%	0.317	36%	0.36	S	S	.	.	H	α-helix	trans	-66.7	-44.2	177.6	175	160.3	70.4	73.8	6.9	112.7	S58 R59 I60 E221 L225 T228	S58-R62 WeakPolarHBondContact O-CB 3.1Å; S58-R62 PolarHBondContact O-N 3.2Å; R59-R62 WeakPolarHBondContact O-CB 3.38Å; R59-R62 PolarHBondContact O-N 2.87Å; R59-R62 VanDerWaalsContact O-N 3.13Å; I60-R62 VanDerWaalsContact C-N 3.32Å; I60-R62 PolarHBondContact O-N 3.41Å; R62-E221 IonicContact NE-OE2 3.47Å; R62-E221 PolarHBondContact NE-OE2 3.04Å; R62-E221 IonicContact NH2-OE1 2.73Å; R62-E221 IonicContact NH2-OE2 3.78Å; R62-L225 HydrophobicContact CB-CD1 4.1Å; R62-T228 HydrophobicContact CB-CG2 4.43Å; R62-T228 VanDerWaalsContact CD-CG2 3.44Å; R62-T228 HydrophobicContact CG-CG2 3.44Å; R62-T228 VanDerWaalsContact CG-CG2 3.44Å
63	E	91.8	Very high	92.9	Very high	100 Å²	100	73.4 Å²	73.4	47%	0.467	34%	0.342	S	S	.	.	H	α-helix	trans	-80.9	-41.1	-175.5	-69	171.5	-175.8	0	0	112.8	R59 I60	R59-E63 HydrophobicContact CG-CG 4.39Å; R59-E63 VanDerWaalsContact CG-OE1 3.23Å; R59-E63 WeakPolarHBondContact CG-OE1 3.49Å; R59-E63 WeakPolarHBondContact O-CG 3.44Å; R59-E63 PolarHBondContact O-N 2.93Å; I60-E63 PolarHBondContact O-N 3.22Å
64	N	94	Very high	93.2	Very high	78 Å²	78	71.1 Å²	71.1	42%	0.417	33%	0.333	S	S	.	.	H	α-helix	trans	-114.5	8.4	-172.1	-65	-41.1	0	0	0	113.6	I60 K66 Y67	I60-N64 HydrophobicContact CG2-CB 4.41Å; I60-N64 WeakPolarHBondContact O-CA 3.43Å; I60-N64 WeakPolarHBondContact O-CB 3.45Å; I60-N64 PolarHBondContact O-N 3.4Å; N64-K66 PolarHBondContact O-N 3.27Å; N64-K66 VanDerWaalsContact O-N 3.08Å; N64-Y67 HydrophobicContact CB-CD2 4.29Å; N64-Y67 HydrophobicContact CB-CE2 4.43Å; N64-Y67 WeakPolarHBondContact O-CD2 3.22Å; N64-Y67 PolarHBondContact O-N 3.02Å
65	G	92.5	Very high	93.3	Very high	4 Å²	4	75.9 Å²	75.9	4%	0.041	36%	0.355	C	S	.	.	G	3₁₀ helix	trans	-62.1	-14.8	177.6	0	0	0	0	0	114.8	L61 Y67 I68 H230	L61-G65 WeakPolarHBondContact O-CA 3.4Å; L61-G65 PolarHBondContact O-N 2.96Å; G65-Y67 PolarHBondContact O-N 3.41Å; G65-I68 WeakPolarHBondContact O-CG1 3.27Å; G65-I68 PolarHBondContact O-N 3.48Å; G65-H230 PolarHBondContact O-CD2 3.3Å; G65-H230 PolarHBondContact O-NE2 2.96Å
66	K	93.7	Very high	93.6	Very high	87 Å²	87	78.8 Å²	78.8	38%	0.378	36%	0.364	S	S	.	.	G	3₁₀ helix	trans	-63.2	-18.6	177.3	60.2	-175.9	-176.3	179.9	0	115.5	N64 Q231 A233	N64-K66 PolarHBondContact O-N 3.27Å; N64-K66 VanDerWaalsContact O-N 3.08Å; K66-Q231 WeakPolarHBondContact CA-O 3.26Å; K66-Q231 WeakPolarHBondContact CB-O 3.2Å; K66-A233 HydrophobicContact CB-CB 4.28Å; K66-A233 HydrophobicContact CD-CB 4.35Å; K66-A233 HydrophobicContact CG-CB 4.29Å; K66-A233 PolarHBondContact O-N 3.17Å
67	Y	94.8	Very high	93.8	Very high	123 Å²	123	76 Å²	76	48%	0.482	35%	0.348	S	S	.	.	G	3₁₀ helix	trans	-94.2	-9.2	-179.1	-55.7	-68.9	0	0	0	114.1	N64 G65 A233	N64-Y67 HydrophobicContact CB-CD2 4.29Å; N64-Y67 HydrophobicContact CB-CE2 4.43Å; N64-Y67 WeakPolarHBondContact O-CD2 3.22Å; N64-Y67 PolarHBondContact O-N 3.02Å; G65-Y67 PolarHBondContact O-N 3.41Å; Y67-A233 HydrophobicContact CD1-CB 4.19Å; Y67-A233 HydrophobicContact CE1-CB 4.12Å
68	I	95	Very high	93.8	Very high	48 Å²	48	75.5 Å²	75.5	25%	0.246	35%	0.35	C	S	.	.	S	Bend	trans	-103.6	147.4	177	58.6	164.8	0	0	0	111.7	L61 G65 K70 F73 H230 W232	L61-I68 HydrophobicContact CD1-CD1 3.93Å; G65-I68 WeakPolarHBondContact O-CG1 3.27Å; G65-I68 PolarHBondContact O-N 3.48Å; I68-K70 PolarHBondContact O-N 3.31Å; I68-F73 HydrophobicContact CD1-CB 4.02Å; I68-F73 HydrophobicContact CG1-CB 4.17Å; I68-H230 PolarHBondContact O-NE2 3.17Å; I68-W232 WeakPolarHBondContact O-CZ3 3.37Å
69	P	95.3	Very high	93.9	Very high	73 Å²	73	81.6 Å²	81.6	47%	0.474	38%	0.375	S	S	.	.			trans	-53.2	144.8	-174.3	-27.7	34	0	0	0	111.9	Q71 S72 F73 W232	P69-Q71 VanDerWaalsContact C-N 3.26Å; P69-Q71 PolarHBondContact O-N 3.48Å; P69-Q71 VanDerWaalsContact O-N 3.16Å; P69-S72 CarbonylContact O-C 3.6Å; P69-S72 WeakPolarHBondContact O-CA 3.4Å; P69-S72 WeakPolarHBondContact O-CB 3.35Å; P69-S72 PolarHBondContact O-N 3.11Å; P69-F73 PolarHBondContact O-N 3.13Å; P69-W232 VanDerWaalsContact CA-CZ3 3.48Å; P69-W232 HydrophobicContact CB-CH2 4.36Å; P69-W232 HydrophobicContact CG-CH2 4.08Å; P69-W232 VanDerWaalsContact N-CZ3 3.31Å
70	K	94	Very high	94.1	Very high	129 Å²	129	75.6 Å²	75.6	56%	0.561	35%	0.352	S	S	*	.	H	α-helix	trans	-50.3	-45.7	-176.4	-175.9	168.2	-178.9	172.9	0	112.7	I68 S72 F73 L74 H230	I68-K70 PolarHBondContact O-N 3.31Å; K70-S72 VanDerWaalsContact C-N 3.31Å; K70-S72 PolarHBondContact O-N 3.38Å; K70-F73 PolarHBondContact O-N 3.05Å; K70-L74 HydrophobicContact CG-CD1 4.03Å; K70-L74 HydrophobicContact CG-CG 4.4Å; K70-L74 VanDerWaalsContact O-CG 3.31Å; K70-L74 WeakPolarHBondContact O-CG 3.32Å; K70-L74 PolarHBondContact O-N 3.34Å; K70-H230 WeakPolarHBondContact CB-ND1 3.41Å; K70-H230 HydrophobicContact CG-CB 4.3Å
71	Q	95.4	Very high	94.1	Very high	130 Å²	130	71.7 Å²	71.7	61%	0.607	33%	0.332	S	S	*	.	H	α-helix	trans	-58.5	-43.6	176.7	-174.3	63.3	10.7	0	0	112.3	P69 L74 M75	P69-Q71 VanDerWaalsContact C-N 3.26Å; P69-Q71 PolarHBondContact O-N 3.48Å; P69-Q71 VanDerWaalsContact O-N 3.16Å; Q71-L74 PolarHBondContact O-N 3.07Å; Q71-M75 WeakPolarHBondContact O-CB 3.04Å; Q71-M75 VanDerWaalsContact O-CG 3.31Å; Q71-M75 WeakPolarHBondContact O-CG 3.46Å; Q71-M75 PolarHBondContact O-N 3.04Å
72	S	95	Very high	94	Very high	38 Å²	38	72.7 Å²	72.7	27%	0.266	34%	0.338	S	S	.	.	H	α-helix	trans	-65	-38.4	178.3	-111.7	0	0	0	0	112.4	P69 K70 R76	P69-S72 CarbonylContact O-C 3.6Å; P69-S72 WeakPolarHBondContact O-CA 3.4Å; P69-S72 WeakPolarHBondContact O-CB 3.35Å; P69-S72 PolarHBondContact O-N 3.11Å; K70-S72 VanDerWaalsContact C-N 3.31Å; K70-S72 PolarHBondContact O-N 3.38Å; S72-R76 VanDerWaalsContact C-NH1 3.3Å; S72-R76 WeakPolarHBondContact O-CG 3.41Å; S72-R76 PolarHBondContact O-N 3.2Å; S72-R76 PolarHBondContact O-NH1 2.81Å; S72-R76 PolarHBondContact OG-NH1 3.3Å
73	F	95.8	Very high	93.7	Very high	5 Å²	5	75.9 Å²	75.9	2%	0.022	36%	0.356	C	S	.	.	H	α-helix	trans	-66.2	-49.6	173.9	175.5	-95.2	0	0	0	111.1	L61 I68 P69 K70 M75 R76 K77 H230	L61-F73 HydrophobicContact CD1-CD2 3.77Å; L61-F73 HydrophobicContact CD1-CE2 4.13Å; L61-F73 HydrophobicContact CG-CD2 4.26Å; L61-F73 HydrophobicContact CG-CE2 4.12Å; I68-F73 HydrophobicContact CD1-CB 4.02Å; I68-F73 HydrophobicContact CG1-CB 4.17Å; P69-F73 PolarHBondContact O-N 3.13Å; K70-F73 PolarHBondContact O-N 3.05Å; F73-M75 VanDerWaalsContact C-N 3.34Å; F73-M75 PolarHBondContact O-N 3.27Å; F73-R76 PolarHBondContact O-N 3.48Å; F73-R76 VanDerWaalsContact O-N 3.09Å; F73-K77 HydrophobicContact CE1-CB 4.45Å; F73-K77 HydrophobicContact CE1-CD 4.08Å; F73-K77 PolarHBondContact O-N 2.9Å; F73-H230 HydrophobicContact CD1-CB 3.62Å; F73-H230 AromaticContact CD1-CD2 3.99Å; F73-H230 HydrophobicContact CE1-CB 3.97Å; F73-H230 HydrophobicContact CG-CB 4.2Å; F73-H230 AromaticContact CG-CD2 3.64Å
74	L	94.8	Very high	93.2	Very high	76 Å²	76	78.6 Å²	78.6	40%	0.398	37%	0.369	S	S	.	.	H	α-helix	trans	-60.8	-40.9	-179.5	-68.5	175	0	0	0	112.3	K70 Q71 R76 K77 F78	K70-L74 HydrophobicContact CG-CD1 4.03Å; K70-L74 HydrophobicContact CG-CG 4.4Å; K70-L74 VanDerWaalsContact O-CG 3.31Å; K70-L74 WeakPolarHBondContact O-CG 3.32Å; K70-L74 PolarHBondContact O-N 3.34Å; Q71-L74 PolarHBondContact O-N 3.07Å; L74-R76 VanDerWaalsContact C-N 3.33Å; L74-R76 PolarHBondContact O-N 3.48Å; L74-K77 PolarHBondContact O-N 3.09Å; L74-F78 VanDerWaalsContact O-CB 3.26Å; L74-F78 WeakPolarHBondContact O-CB 3.12Å; L74-F78 PolarHBondContact O-N 2.79Å
75	M	94.6	Very high	92.9	Very high	123 Å²	123	79.8 Å²	79.8	61%	0.606	38%	0.375	S	S	*	.	H	α-helix	trans	-60.7	-40.8	174.3	-75.3	-177.1	67.4	0	0	112.6	Q71 F73 Y79	Q71-M75 WeakPolarHBondContact O-CB 3.04Å; Q71-M75 VanDerWaalsContact O-CG 3.31Å; Q71-M75 WeakPolarHBondContact O-CG 3.46Å; Q71-M75 PolarHBondContact O-N 3.04Å; F73-M75 VanDerWaalsContact C-N 3.34Å; F73-M75 PolarHBondContact O-N 3.27Å; M75-Y79 PolarHBondContact O-N 3.44Å
76	R	94.7	Very high	92.7	Very high	95 Å²	95	79.6 Å²	79.6	36%	0.358	37%	0.373	S	S	.	.	H	α-helix	trans	-73	-40.5	178.5	-69.6	171.7	178.3	83.4	-6.1	111.6	L61 S72 F73 L74 F78 Y79 F80	L61-R76 HydrophobicContact CD1-CB 4.15Å; L61-R76 HydrophobicContact CD2-CB 3.68Å; S72-R76 VanDerWaalsContact C-NH1 3.3Å; S72-R76 WeakPolarHBondContact O-CG 3.41Å; S72-R76 PolarHBondContact O-N 3.2Å; S72-R76 PolarHBondContact O-NH1 2.81Å; S72-R76 PolarHBondContact OG-NH1 3.3Å; F73-R76 PolarHBondContact O-N 3.48Å; F73-R76 VanDerWaalsContact O-N 3.09Å; L74-R76 VanDerWaalsContact C-N 3.33Å; L74-R76 PolarHBondContact O-N 3.48Å; R76-F78 VanDerWaalsContact C-N 3.32Å; R76-F78 PolarHBondContact O-N 3.39Å; R76-Y79 PolarHBondContact O-N 2.77Å; R76-F80 WeakPolarHBondContact O-CD2 3.33Å; R76-F80 PolarHBondContact O-N 2.9Å
77	K	94	Very high	92.5	Very high	29 Å²	29	77.1 Å²	77.1	13%	0.126	36%	0.362	C	S	.	.	H	α-helix	trans	-58.8	-45.6	172	-177.5	175.5	177.5	177.9	0	110.3	F73 L74 Y79 F80 N81 L225 E226 T228	F73-K77 HydrophobicContact CE1-CB 4.45Å; F73-K77 HydrophobicContact CE1-CD 4.08Å; F73-K77 PolarHBondContact O-N 2.9Å; L74-K77 PolarHBondContact O-N 3.09Å; K77-Y79 PolarHBondContact O-N 3.17Å; K77-F80 PolarHBondContact O-N 3.32Å; K77-N81 WeakPolarHBondContact O-CB 3.28Å; K77-N81 PolarHBondContact O-N 3.38Å; K77-L225 WeakPolarHBondContact CE-O 3.1Å; K77-L225 HydrophobicContact CG-CG 4.33Å; K77-E226 PolarHBondContact NZ-O 3.36Å; K77-T228 PolarHBondContact NZ-O 3.03Å
78	F	93.7	Very high	92.2	Very high	129 Å²	129	71.9 Å²	71.9	57%	0.566	34%	0.342	S	S	*	.	H	α-helix	trans	-60.1	-46	175.9	-176.1	-99.6	0	0	0	112	L74 R76 F80 N81 N82	L74-F78 VanDerWaalsContact O-CB 3.26Å; L74-F78 WeakPolarHBondContact O-CB 3.12Å; L74-F78 PolarHBondContact O-N 2.79Å; R76-F78 VanDerWaalsContact C-N 3.32Å; R76-F78 PolarHBondContact O-N 3.39Å; F78-F80 VanDerWaalsContact C-N 3.26Å; F78-F80 PolarHBondContact O-N 3.49Å; F78-N81 PolarHBondContact O-N 3.48Å; F78-N82 HydrophobicContact CD2-CB 4.29Å; F78-N82 HydrophobicContact CE1-CB 4.33Å; F78-N82 HydrophobicContact CE2-CB 4.06Å; F78-N82 HydrophobicContact CZ-CB 4.08Å; F78-N82 WeakPolarHBondContact CZ-ND2 3.21Å; F78-N82 WeakPolarHBondContact O-CB 3.36Å; F78-N82 PolarHBondContact O-N 2.95Å
79	Y	94.1	Very high	91.7	Very high	129 Å²	129	73.6 Å²	73.6	51%	0.506	35%	0.348	S	S	.	.	H	α-helix	trans	-56.6	-36.9	176.2	171.9	-97	0	0	0	113.6	M75 R76 K77 G86 F87	M75-Y79 PolarHBondContact O-N 3.44Å; R76-Y79 PolarHBondContact O-N 2.77Å; K77-Y79 PolarHBondContact O-N 3.17Å; Y79-G86 WeakPolarHBondContact O-CA 3.39Å; Y79-F87 HydrophobicContact CE1-CB 4.37Å; Y79-F87 PolarHBondContact O-N 3.31Å
80	F	93.7	Very high	91.3	Very high	3 Å²	3	76.9 Å²	76.9	1%	0.013	35%	0.354	C	S	.	.	H	α-helix	trans	-83	-42.3	179	-74.1	-59.6	0	0	0	113.3	V54 R57 L61 R76 K77 F78 G86 F87 F88 L225	V54-F80 HydrophobicContact CG1-CE1 3.84Å; R57-F80 HydrophobicContact CG-CZ 4.43Å; L61-F80 HydrophobicContact CD2-CD2 3.87Å; L61-F80 HydrophobicContact CD2-CE2 3.95Å; R76-F80 WeakPolarHBondContact O-CD2 3.33Å; R76-F80 PolarHBondContact O-N 2.9Å; K77-F80 PolarHBondContact O-N 3.32Å; F78-F80 VanDerWaalsContact C-N 3.26Å; F78-F80 PolarHBondContact O-N 3.49Å; F80-G86 WeakPolarHBondContact O-CA 3.32Å; F80-F87 HydrophobicContact CD1-CB 4.12Å; F80-F87 PolarHBondContact O-N 2.99Å; F80-F88 HydrophobicContact CB-CD2 4.04Å; F80-F88 HydrophobicContact CB-CE2 3.81Å; F80-F88 HydrophobicContact CD1-CD2 4.47Å; F80-F88 AromaticContact CD1-CE2 3.91Å; F80-F88 HydrophobicContact CD1-CE2 3.91Å; F80-F88 AromaticContact CD1-CZ 4Å; F80-F88 HydrophobicContact CD1-CZ 4Å; F80-F88 HydrophobicContact CG-CE2 4.06Å; F80-L225 HydrophobicContact CB-CD2 3.65Å; F80-L225 HydrophobicContact CD2-CD2 4.2Å; F80-L225 HydrophobicContact CG-CD2 4.24Å
81	N	93	Very high	90.6	Very high	8 Å²	8	72.1 Å²	72.1	4%	0.043	34%	0.336	C	S	.	.	H	α-helix	trans	-103.8	-4.5	-167.2	-80.7	19.7	0	0	0	115.9	K77 F78 Q83 W222 E226	K77-N81 WeakPolarHBondContact O-CB 3.28Å; K77-N81 PolarHBondContact O-N 3.38Å; F78-N81 PolarHBondContact O-N 3.48Å; N81-Q83 PolarHBondContact O-N 3.43Å; N81-W222 PolarHBondContact ND2-O 3.17Å; N81-W222 PolarHBondContact O-NE1 3.35Å; N81-W222 VanDerWaalsContact OD1-CD1 3.25Å; N81-E226 WeakPolarHBondContact CB-OE2 3.42Å; N81-E226 VanDerWaalsContact ND2-CA 3.33Å; N81-E226 WeakPolarHBondContact ND2-CA 3.26Å; N81-E226 PolarHBondContact ND2-N 2.94Å; N81-E226 PolarHBondContact ND2-OE2 2.85Å
82	N	92.3	Very high	89.9	Confident	36 Å²	36	74.1 Å²	74.1	19%	0.193	34%	0.343	C	S	.	.			trans	-52	135.8	176.9	-175.1	17.6	0	0	0	111.1	F78 E84 D85 G86	F78-N82 HydrophobicContact CD2-CB 4.29Å; F78-N82 HydrophobicContact CE1-CB 4.33Å; F78-N82 HydrophobicContact CE2-CB 4.06Å; F78-N82 HydrophobicContact CZ-CB 4.08Å; F78-N82 WeakPolarHBondContact CZ-ND2 3.21Å; F78-N82 WeakPolarHBondContact O-CB 3.36Å; F78-N82 PolarHBondContact O-N 2.95Å; N82-E84 VanDerWaalsContact C-N 3.32Å; N82-E84 PolarHBondContact O-N 3.41Å; N82-D85 PolarHBondContact ND2-N 3.23Å; N82-G86 WeakPolarHBondContact O-CA 3.48Å; N82-G86 PolarHBondContact O-N 2.98Å
83	Q	84.8	Confident	89.1	Confident	151 Å²	151	75.4 Å²	75.4	71%	0.706	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-35.4	-173.8	-65.9	-174.5	-5.4	0	0	112.1	N81	N81-Q83 PolarHBondContact O-N 3.43Å
84	E	83.3	Confident	87.7	Confident	157 Å²	157	85.1 Å²	85.1	73%	0.734	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.8	-51.1	-177.5	-62.8	-64.6	141.2	0	0	112.3	N82	N82-E84 VanDerWaalsContact C-N 3.32Å; N82-E84 PolarHBondContact O-N 3.41Å
85	D	86.5	Confident	86.1	Confident	103 Å²	103	83.3 Å²	83.3	55%	0.551	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.5	3.9	-172.2	-76.2	-51.7	0	0	0	115.1	N82 F87 K90	N82-D85 PolarHBondContact ND2-N 3.23Å; D85-F87 PolarHBondContact O-N 3.06Å; D85-K90 IonicContact OD1-NZ 3.52Å
86	G	88.8	Confident	84.1	Confident	0 Å²	0	82.8 Å²	82.8	0%	0	38%	0.38	C	S	.	.			trans	-62.9	136.1	-177.2	0	0	0	0	0	112	Y79 F80 N82 F88 K89 K90	Y79-G86 WeakPolarHBondContact O-CA 3.39Å; F80-G86 WeakPolarHBondContact O-CA 3.32Å; N82-G86 WeakPolarHBondContact O-CA 3.48Å; N82-G86 PolarHBondContact O-N 2.98Å; G86-F88 PolarHBondContact O-N 3.28Å; G86-K89 PolarHBondContact O-N 3.21Å; G86-K90 WeakPolarHBondContact O-CB 3.17Å; G86-K90 PolarHBondContact O-N 2.73Å
87	F	89.9	Confident	82	Confident	34 Å²	34	82.4 Å²	82.4	15%	0.149	39%	0.389	C	S	.	.	H	α-helix	trans	-52.6	-42.9	-178.8	-179.5	-89.8	0	0	0	112.4	V54 Y79 F80 D85 K89 T91 F218	V54-F87 HydrophobicContact CB-CE1 4.15Å; V54-F87 HydrophobicContact CB-CZ 4.34Å; V54-F87 HydrophobicContact CG1-CD1 3.71Å; V54-F87 HydrophobicContact CG1-CE1 3.47Å; V54-F87 VanDerWaalsContact CG1-CE1 3.47Å; V54-F87 HydrophobicContact CG1-CG 4.44Å; V54-F87 HydrophobicContact CG1-CZ 4Å; V54-F87 HydrophobicContact CG2-CE1 4.42Å; V54-F87 HydrophobicContact CG2-CZ 4.15Å; Y79-F87 HydrophobicContact CE1-CB 4.37Å; Y79-F87 PolarHBondContact O-N 3.31Å; F80-F87 HydrophobicContact CD1-CB 4.12Å; F80-F87 PolarHBondContact O-N 2.99Å; D85-F87 PolarHBondContact O-N 3.06Å; F87-K89 VanDerWaalsContact C-N 3.28Å; F87-K89 PolarHBondContact O-N 3Å; F87-T91 HydrophobicContact CE2-CG2 4.5Å; F87-T91 HydrophobicContact CZ-CG2 4.17Å; F87-T91 VanDerWaalsContact O-CB 3.27Å; F87-T91 WeakPolarHBondContact O-CB 3.41Å; F87-T91 PolarHBondContact O-N 3.39Å; F87-T91 PolarHBondContact O-OG1 3.16Å; F87-F218 HydrophobicContact CE1-CE1 4.19Å; F87-F218 HydrophobicContact CE1-CZ 4.1Å
88	F	88.1	Confident	79.9	Confident	14 Å²	14	84.6 Å²	84.6	6%	0.061	41%	0.407	C	S	.	.	H	α-helix	trans	-71.9	-17.3	-178.5	-62.8	-45.9	0	0	0	114.5	V54 L55 S58 F80 G86 F218 E221 W222 L225	V54-F88 HydrophobicContact CG1-CE1 4.39Å; L55-F88 HydrophobicContact CD2-CE1 4.22Å; S58-F88 WeakPolarHBondContact OG-CZ 3.43Å; F80-F88 HydrophobicContact CB-CD2 4.04Å; F80-F88 HydrophobicContact CB-CE2 3.81Å; F80-F88 HydrophobicContact CD1-CD2 4.47Å; F80-F88 AromaticContact CD1-CE2 3.91Å; F80-F88 HydrophobicContact CD1-CE2 3.91Å; F80-F88 AromaticContact CD1-CZ 4Å; F80-F88 HydrophobicContact CD1-CZ 4Å; F80-F88 HydrophobicContact CG-CE2 4.06Å; G86-F88 PolarHBondContact O-N 3.28Å; F88-F218 HydrophobicContact CB-CB 4.26Å; F88-F218 HydrophobicContact CD1-CB 3.82Å; F88-F218 AromaticContact CD1-CD1 3.65Å; F88-F218 HydrophobicContact CD1-CD1 3.65Å; F88-F218 HydrophobicContact CD1-CE1 4.46Å; F88-F218 AromaticContact CD1-CG 3.89Å; F88-F218 HydrophobicContact CD1-CG 3.89Å; F88-F218 AromaticContact CE1-CD1 3.82Å; F88-F218 HydrophobicContact CE1-CD1 3.82Å; F88-F218 HydrophobicContact CE1-CE1 4.42Å; F88-F218 HydrophobicContact CG-CB 4.4Å; F88-E221 HydrophobicContact CE2-CB 4.37Å; F88-E221 HydrophobicContact CZ-CB 4.22Å; F88-W222 HydrophobicContact CB-CB 3.98Å; F88-W222 HydrophobicContact CB-CG 4.43Å; F88-W222 HydrophobicContact CD2-CB 4.08Å; F88-W222 HydrophobicContact CG-CB 4.34Å; F88-L225 HydrophobicContact CE2-CD2 4.5Å
89	K	84.6	Confident	77.3	Confident	83 Å²	83	81.2 Å²	81.2	36%	0.361	40%	0.399	S	S	.	.	H	α-helix	trans	-95.4	-40.9	176.9	-67	-70.4	-177.9	176.7	0	111.9	G86 F87	G86-K89 PolarHBondContact O-N 3.21Å; F87-K89 VanDerWaalsContact C-N 3.28Å; F87-K89 PolarHBondContact O-N 3Å
90	K	85.6	Confident	75.1	Confident	142 Å²	142	81.1 Å²	81.1	62%	0.617	41%	0.414	S	S	*	.	H	α-helix	trans	-75.5	-42.6	-176.8	-172.3	173	-173.2	163.6	0	112.7	D85 G86 K92	D85-K90 IonicContact OD1-NZ 3.52Å; G86-K90 WeakPolarHBondContact O-CB 3.17Å; G86-K90 PolarHBondContact O-N 2.73Å; K90-K92 PolarHBondContact O-N 2.95Å; K90-K92 VanDerWaalsContact O-N 3.09Å
91	T	80.1	Confident	72.9	Confident	29 Å²	29	89.3 Å²	89.3	18%	0.178	46%	0.455	C	S	.	.			trans	-83.4	89.6	-176.8	-52.9	0	0	0	0	110	F87 F218	F87-T91 HydrophobicContact CE2-CG2 4.5Å; F87-T91 HydrophobicContact CZ-CG2 4.17Å; F87-T91 VanDerWaalsContact O-CB 3.27Å; F87-T91 WeakPolarHBondContact O-CB 3.41Å; F87-T91 PolarHBondContact O-N 3.39Å; F87-T91 PolarHBondContact O-OG1 3.16Å; T91-F218 HydrophobicContact CG2-CE2 4.26Å
92	K	80.3	Confident	70.8	Confident	172 Å²	172	93 Å²	93	75%	0.748	48%	0.478	S	S	*	.			trans	-96	118.8	168.2	-67.6	-173.8	-179.8	178.1	0	109.4	K90	K90-K92 PolarHBondContact O-N 2.95Å; K90-K92 VanDerWaalsContact O-N 3.09Å
93	R	79.3	Confident	68.6	Low	65 Å²	65	96 Å²	96	25%	0.245	49%	0.493	C	S	.	.			trans	-85.6	140.9	175.1	-60.1	-57.5	-169.5	-173.4	-7.8	109.1	E47 D51 V95 T214 N215 F218	E47-R93 VanDerWaalsContact CG-CZ 3.5Å; E47-R93 WeakPolarHBondContact OE1-CD 3.11Å; E47-R93 IonicContact OE1-CZ 3.9Å; E47-R93 IonicContact OE1-NE 3.41Å; E47-R93 PolarHBondContact OE1-NE 2.95Å; E47-R93 IonicContact OE1-NH1 3.92Å; E47-R93 PolarHBondContact OE1-NH1 2.98Å; D51-R93 IonicContact OD1-CZ 3.56Å; D51-R93 IonicContact OD1-NE 3.16Å; D51-R93 PolarHBondContact OD1-NE 3.26Å; D51-R93 IonicContact OD1-NH2 2.77Å; D51-R93 PolarHBondContact OD1-NH2 2.94Å; D51-R93 IonicContact OD2-CZ 2.64Å; D51-R93 IonicContact OD2-NE 2.8Å; D51-R93 PolarHBondContact OD2-NE 3.49Å; D51-R93 IonicContact OD2-NH2 3.27Å; R93-V95 HydrophobicContact CB-CG2 4.07Å; R93-V95 PolarHBondContact O-N 2.64Å; R93-T214 WeakPolarHBondContact CB-OG1 3.48Å; R93-N215 PolarHBondContact N-OD1 3.22Å; R93-N215 PolarHBondContact O-ND2 3.38Å; R93-N215 PolarHBondContact O-OD1 3.24Å; R93-F218 HydrophobicContact CG-CE2 4.17Å
94	K	66.2	Low	67	Low	210 Å²	210	92.7 Å²	92.7	91%	0.913	49%	0.485	S	S	*	.			trans	-72.8	78	167.8	-70.9	-175.8	-178.7	179.1	0	107.9	V96	K94-V96 PolarHBondContact O-N 2.77Å
95	V	60.1	Low	65.8	Low	37 Å²	37	87.9 Å²	87.9	22%	0.224	47%	0.469	C	S	.	.			trans	-75.1	108.2	170	-178.6	0	0	0	0	105.3	R93 P97 D213 T214 N215	R93-V95 HydrophobicContact CB-CG2 4.07Å; R93-V95 PolarHBondContact O-N 2.64Å; V95-P97 VanDerWaalsContact O-CD 3.3Å; V95-P97 WeakPolarHBondContact O-CD 3.45Å; V95-P97 VanDerWaalsContact O-N 3.15Å; V95-D213 HydrophobicContact CG1-CB 4.14Å; V95-D213 WeakPolarHBondContact CG2-OD1 3.48Å; V95-T214 WeakPolarHBondContact CG2-OG1 3.43Å; V95-N215 WeakPolarHBondContact CG2-ND2 3.23Å
96	V	54	Low	64.3	Low	112 Å²	112	88.9 Å²	88.9	68%	0.679	47%	0.472	S	S	*	.			trans	-59.1	117.7	162.5	179	0	0	0	0	104.6	K94 P98	K94-V96 PolarHBondContact O-N 2.77Å; V96-P98 WeakPolarHBondContact O-CD 3.3Å; V96-P98 VanDerWaalsContact O-N 3.1Å
97	P	48.8	Very low	63	Low	87 Å²	87	93.1 Å²	93.1	57%	0.565	49%	0.494	S	S	*	.			trans	-51.5	126.8	-179.4	-22.6	30.7	0	0	0	107.2	V95 S99	V95-P97 VanDerWaalsContact O-CD 3.3Å; V95-P97 WeakPolarHBondContact O-CD 3.45Å; V95-P97 VanDerWaalsContact O-N 3.15Å; P97-S99 PolarHBondContact O-N 3.27Å
98	P	50.2	Low	61.8	Low	76 Å²	76	95 Å²	95	49%	0.494	51%	0.508	S	S	.	.			trans	-68	80.8	172.9	27.5	-32	0	0	0	106.5	V96 A212	V96-P98 WeakPolarHBondContact O-CD 3.3Å; V96-P98 VanDerWaalsContact O-N 3.1Å; P98-A212 HydrophobicContact CB-CB 4.42Å; P98-A212 HydrophobicContact CG-CB 3.77Å
99	S	40.5	Very low	60.5	Low	57 Å²	57	97.5 Å²	97.5	40%	0.399	52%	0.522	S	S	.	.			trans	-68.9	130.7	163.6	-55.8	0	0	0	0	104.4	P97 M101 T102	P97-S99 PolarHBondContact O-N 3.27Å; S99-M101 PolarHBondContact O-N 3.47Å; S99-T102 WeakPolarHBondContact CB-OG1 3.19Å; S99-T102 PolarHBondContact O-N 2.82Å; S99-T102 PolarHBondContact O-OG1 3.01Å; S99-T102 VanDerWaalsContact O-OG1 3.11Å
100	P	47.7	Very low	59.4	Low	127 Å²	127	99.1 Å²	99.1	83%	0.825	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-9.2	176.8	-24.4	32	0	0	0	114.2
101	M	46.3	Very low	58.3	Low	176 Å²	176	97.1 Å²	97.1	87%	0.867	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.5	-16.2	-177.7	-136.8	168.2	86	0	0	114.3	S99	S99-M101 PolarHBondContact O-N 3.47Å
102	T	49.1	Very low	57.6	Low	85 Å²	85	101.7 Å²	101.7	52%	0.521	54%	0.544	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.6	-19.6	-170.5	43.1	0	0	0	0	115.1	S99	S99-T102 WeakPolarHBondContact CB-OG1 3.19Å; S99-T102 PolarHBondContact O-N 2.82Å; S99-T102 PolarHBondContact O-OG1 3.01Å; S99-T102 VanDerWaalsContact O-OG1 3.11Å
103	D	46.7	Very low	56.9	Low	98 Å²	98	95 Å²	95	52%	0.524	52%	0.524	S	S	.	.			trans	-130.6	80.6	173.9	-129	-34.4	0	0	0	111.6	S105	D103-S105 PolarHBondContact O-N 3.4Å; D103-S105 PolarHBondContact OD1-OG 2.8Å
104	P	51.3	Low	56.3	Low	83 Å²	83	94 Å²	94	54%	0.539	52%	0.524	S	S	.	.	H	α-helix	trans	-54.4	-21.3	174.7	-23.3	32.3	0	0	0	112.8	T108	P104-T108 WeakPolarHBondContact O-CB 3.49Å; P104-T108 PolarHBondContact O-N 2.71Å; P104-T108 PolarHBondContact O-OG1 3.5Å
105	S	58.7	Low	56.6	Low	56 Å²	56	87.5 Å²	87.5	39%	0.392	50%	0.501	S	S	.	.	H	α-helix	trans	-65.9	-46.1	-175	66.4	0	0	0	0	113.7	D103 T108 D109	D103-S105 PolarHBondContact O-N 3.4Å; D103-S105 PolarHBondContact OD1-OG 2.8Å; S105-T108 PolarHBondContact O-N 3.22Å; S105-D109 PolarHBondContact O-N 2.88Å
106	M	54.9	Low	57.1	Low	123 Å²	123	88.8 Å²	88.8	61%	0.606	51%	0.509	S	S	*	.	H	α-helix	trans	-73.1	-39.5	-177.2	-68.7	-163.3	72	0	0	113	T108 D109 M110	M106-T108 VanDerWaalsContact C-N 3.34Å; M106-D109 PolarHBondContact O-N 2.62Å; M106-M110 PolarHBondContact O-N 3.09Å
107	L	61	Low	58	Low	90 Å²	90	84.8 Å²	84.8	47%	0.471	48%	0.484	S	S	.	.	H	α-helix	trans	-65.2	-42.2	172.2	-176.9	118.4	0	0	0	110.2	D109 M110 M111	L107-D109 VanDerWaalsContact C-N 3.32Å; L107-D109 PolarHBondContact O-N 3.16Å; L107-M110 PolarHBondContact O-N 2.7Å; L107-M111 HydrophobicContact CD2-SD 3.46Å; L107-M111 WeakPolarHBondContact CD2-SD 3.25Å; L107-M111 HydrophobicContact CG-CG 4.34Å; L107-M111 HydrophobicContact CG-SD 3.86Å; L107-M111 VanDerWaalsContact O-CB 3.3Å; L107-M111 WeakPolarHBondContact O-CB 3.44Å; L107-M111 VanDerWaalsContact O-CG 3.26Å; L107-M111 WeakPolarHBondContact O-CG 2.93Å; L107-M111 PolarHBondContact O-N 3.06Å
108	T	63.9	Low	59.4	Low	72 Å²	72	83.2 Å²	83.2	44%	0.442	47%	0.472	S	S	.	.	H	α-helix	trans	-61.6	-39.6	175.2	-63	0	0	0	0	111.2	P104 S105 M106 K112	P104-T108 WeakPolarHBondContact O-CB 3.49Å; P104-T108 PolarHBondContact O-N 2.71Å; P104-T108 PolarHBondContact O-OG1 3.5Å; S105-T108 PolarHBondContact O-N 3.22Å; M106-T108 VanDerWaalsContact C-N 3.34Å; T108-K112 WeakPolarHBondContact O-CA 3.34Å; T108-K112 WeakPolarHBondContact O-CB 3.11Å; T108-K112 PolarHBondContact O-N 2.86Å
109	D	61.7	Low	60.9	Low	67 Å²	67	83.7 Å²	83.7	36%	0.358	47%	0.471	S	S	.	.	H	α-helix	trans	-66.1	-41.8	179.2	-74.1	-17.7	0	0	0	112.7	K42 S105 M106 L107 G113	K42-D109 WeakPolarHBondContact CE-OD2 3.41Å; K42-D109 IonicContact NZ-OD2 3.55Å; K42-D109 PolarHBondContact NZ-OD2 3.49Å; S105-D109 PolarHBondContact O-N 2.88Å; M106-D109 PolarHBondContact O-N 2.62Å; L107-D109 VanDerWaalsContact C-N 3.32Å; L107-D109 PolarHBondContact O-N 3.16Å; D109-G113 PolarHBondContact O-N 3.27Å
110	M	60.1	Low	63	Low	118 Å²	118	83.3 Å²	83.3	58%	0.581	47%	0.467	S	S	*	.	H	α-helix	trans	-69.3	-44.3	177.1	-170.2	-176.7	78.3	0	0	111.4	M106 L107 K112 G113 N114	M106-M110 PolarHBondContact O-N 3.09Å; L107-M110 PolarHBondContact O-N 2.7Å; M110-K112 VanDerWaalsContact C-N 3.35Å; M110-G113 PolarHBondContact O-N 3.38Å; M110-N114 PolarHBondContact O-N 2.88Å; M110-N114 VanDerWaalsContact O-N 3.14Å
111	M	63.3	Low	64.8	Low	100 Å²	100	78.3 Å²	78.3	49%	0.493	43%	0.433	S	S	.	.	H	α-helix	trans	-65.6	-39.4	175.4	-70.7	-176	79	0	0	111.3	L107 G113 N114 V115	L107-M111 HydrophobicContact CD2-SD 3.46Å; L107-M111 WeakPolarHBondContact CD2-SD 3.25Å; L107-M111 HydrophobicContact CG-CG 4.34Å; L107-M111 HydrophobicContact CG-SD 3.86Å; L107-M111 VanDerWaalsContact O-CB 3.3Å; L107-M111 WeakPolarHBondContact O-CB 3.44Å; L107-M111 VanDerWaalsContact O-CG 3.26Å; L107-M111 WeakPolarHBondContact O-CG 2.93Å; L107-M111 PolarHBondContact O-N 3.06Å; M111-G113 PolarHBondContact O-N 3.15Å; M111-N114 PolarHBondContact O-N 3.05Å; M111-V115 WeakPolarHBondContact O-CB 3.42Å; M111-V115 WeakPolarHBondContact O-CG2 3.35Å; M111-V115 PolarHBondContact O-N 3.15Å
112	K	65.4	Low	66.8	Low	124 Å²	124	74.7 Å²	74.7	54%	0.539	42%	0.416	S	S	.	.	H	α-helix	trans	-63.5	-42	177.2	-177.8	179.4	179.4	-172.5	0	110.3	T108 M110 T116	T108-K112 WeakPolarHBondContact O-CA 3.34Å; T108-K112 WeakPolarHBondContact O-CB 3.11Å; T108-K112 PolarHBondContact O-N 2.86Å; M110-K112 VanDerWaalsContact C-N 3.35Å; K112-T116 WeakPolarHBondContact O-CB 3.21Å; K112-T116 PolarHBondContact O-N 3.13Å; K112-T116 PolarHBondContact O-OG1 2.84Å
113	G	65.6	Low	68.7	Low	31 Å²	31	75.9 Å²	75.9	32%	0.32	42%	0.418	S	S	.	.	H	α-helix	trans	-57.8	-51.1	173.1	0	0	0	0	0	112.2	D109 M110 M111 N117	D109-G113 PolarHBondContact O-N 3.27Å; M110-G113 PolarHBondContact O-N 3.38Å; M111-G113 PolarHBondContact O-N 3.15Å; G113-N117 WeakPolarHBondContact O-CB 3.39Å; G113-N117 PolarHBondContact O-N 3.48Å; G113-N117 PolarHBondContact O-ND2 3.32Å
114	N	66.6	Low	70.8	Confident	46 Å²	46	72.8 Å²	72.8	25%	0.246	40%	0.401	C	S	.	.	H	α-helix	trans	-68.7	-42.2	-178.9	-74.7	-5.4	0	0	0	113.2	M110 M111 N117 V118 Q202	M110-N114 PolarHBondContact O-N 2.88Å; M110-N114 VanDerWaalsContact O-N 3.14Å; M111-N114 PolarHBondContact O-N 3.05Å; N114-N117 PolarHBondContact O-N 3.47Å; N114-V118 WeakPolarHBondContact O-CB 3.47Å; N114-V118 WeakPolarHBondContact O-CG2 3.42Å; N114-V118 PolarHBondContact O-N 3.36Å; N114-Q202 PolarHBondContact ND2-NE2 3.35Å; N114-Q202 PolarHBondContact ND2-OE1 3.48Å; N114-Q202 VanDerWaalsContact ND2-OE1 3.15Å
115	V	71.9	Confident	72.6	Confident	73 Å²	73	69 Å²	69	44%	0.442	38%	0.378	S	S	.	.	H	α-helix	trans	-70.2	-43.5	180	172.1	0	0	0	0	110.8	M111 N117 V118 L119	M111-V115 WeakPolarHBondContact O-CB 3.42Å; M111-V115 WeakPolarHBondContact O-CG2 3.35Å; M111-V115 PolarHBondContact O-N 3.15Å; V115-N117 PolarHBondContact O-N 3.09Å; V115-V118 PolarHBondContact O-N 2.97Å; V115-L119 HydrophobicContact CG1-CB 4.15Å; V115-L119 HydrophobicContact CG1-CD2 4.17Å; V115-L119 WeakPolarHBondContact O-CB 3.5Å; V115-L119 PolarHBondContact O-N 3.22Å
116	T	71.5	Confident	74.1	Confident	64 Å²	64	68.3 Å²	68.3	39%	0.393	38%	0.379	S	S	.	.	H	α-helix	trans	-62.7	-27.5	177.3	-53.3	0	0	0	0	111.3	K112 P120	K112-T116 WeakPolarHBondContact O-CB 3.21Å; K112-T116 PolarHBondContact O-N 3.13Å; K112-T116 PolarHBondContact O-OG1 2.84Å; T116-P120 WeakPolarHBondContact O-CD 3.28Å; T116-P120 VanDerWaalsContact O-CG 3.29Å; T116-P120 WeakPolarHBondContact O-CG 3.43Å
117	N	72.2	Confident	75.9	Confident	27 Å²	27	68.2 Å²	68.2	14%	0.144	37%	0.372	C	S	.	.	H	α-helix	trans	-82.8	-38.9	177.3	-74.9	-28.1	0	0	0	114	G113 N114 V115	G113-N117 WeakPolarHBondContact O-CB 3.39Å; G113-N117 PolarHBondContact O-N 3.48Å; G113-N117 PolarHBondContact O-ND2 3.32Å; N114-N117 PolarHBondContact O-N 3.47Å; V115-N117 PolarHBondContact O-N 3.09Å
118	V	78.4	Confident	77.4	Confident	54 Å²	54	64 Å²	64	33%	0.327	35%	0.35	S	S	.	.	H	α-helix	trans	-92.4	-35.7	-173.8	174.1	0	0	0	0	112.7	N114 V115 M121 I122	N114-V118 WeakPolarHBondContact O-CB 3.47Å; N114-V118 WeakPolarHBondContact O-CG2 3.42Å; N114-V118 PolarHBondContact O-N 3.36Å; V115-V118 PolarHBondContact O-N 2.97Å; V118-M121 WeakPolarHBondContact O-CB 3.28Å; V118-M121 PolarHBondContact O-N 3.16Å; V118-I122 HydrophobicContact CG1-CD1 3.58Å; V118-I122 HydrophobicContact CG1-CG1 4.1Å; V118-I122 PolarHBondContact O-N 3.11Å
119	L	83.3	Confident	78.6	Confident	87 Å²	87	61.9 Å²	61.9	46%	0.455	34%	0.336	S	S	.	.	H	α-helix	trans	-60.7	-45.8	-173.9	-177.2	67.1	0	0	0	112.8	V115 M121 I122 L123	V115-L119 HydrophobicContact CG1-CB 4.15Å; V115-L119 HydrophobicContact CG1-CD2 4.17Å; V115-L119 WeakPolarHBondContact O-CB 3.5Å; V115-L119 PolarHBondContact O-N 3.22Å; L119-M121 VanDerWaalsContact C-N 3.27Å; L119-M121 PolarHBondContact O-N 2.78Å; L119-I122 PolarHBondContact O-N 3Å; L119-L123 HydrophobicContact CD1-CD1 4.15Å; L119-L123 HydrophobicContact CD1-CG 4.12Å; L119-L123 HydrophobicContact CD2-CD1 4.45Å; L119-L123 HydrophobicContact CG-CD1 3.84Å; L119-L123 HydrophobicContact CG-CG 4.24Å; L119-L123 WeakPolarHBondContact O-CB 3.14Å; L119-L123 VanDerWaalsContact O-CG 3.3Å; L119-L123 WeakPolarHBondContact O-CG 3.42Å; L119-L123 PolarHBondContact O-N 2.65Å
120	P	83.7	Confident	80	Confident	48 Å²	48	68.1 Å²	68.1	31%	0.312	36%	0.355	S	S	.	.	H	α-helix	trans	-61.4	-36.6	179.3	-23.4	35.4	0	0	0	112.7	T116 I124	T116-P120 WeakPolarHBondContact O-CD 3.28Å; T116-P120 VanDerWaalsContact O-CG 3.29Å; T116-P120 WeakPolarHBondContact O-CG 3.43Å; P120-I124 WeakPolarHBondContact O-CB 3.37Å; P120-I124 WeakPolarHBondContact O-CD1 3.42Å; P120-I124 VanDerWaalsContact O-CG1 3.23Å; P120-I124 WeakPolarHBondContact O-CG1 3.16Å; P120-I124 PolarHBondContact O-N 2.7Å
121	M	85.3	Confident	81.4	Confident	23 Å²	23	65.3 Å²	65.3	11%	0.113	34%	0.344	C	S	.	.	H	α-helix	trans	-64.8	-45.3	178.8	180	179.7	178.6	0	0	111.8	V118 L119 G125 Y172 F173 V176 F177	V118-M121 WeakPolarHBondContact O-CB 3.28Å; V118-M121 PolarHBondContact O-N 3.16Å; L119-M121 VanDerWaalsContact C-N 3.27Å; L119-M121 PolarHBondContact O-N 2.78Å; M121-G125 PolarHBondContact O-N 3.39Å; M121-Y172 WeakPolarHBondContact CA-OH 2.99Å; M121-Y172 HydrophobicContact CG-CE1 4.3Å; M121-Y172 WeakPolarHBondContact O-CE1 3.15Å; M121-Y172 PolarHBondContact O-OH 3.34Å; M121-F173 HydrophobicContact CE-CD1 3.38Å; M121-F173 HydrophobicContact CE-CE1 3.54Å; M121-F173 HydrophobicContact CG-CE1 4.19Å; M121-V176 HydrophobicContact CE-CB 3.77Å; M121-V176 HydrophobicContact CE-CG1 3.3Å; M121-V176 HydrophobicContact CE-CG2 4.37Å; M121-V176 HydrophobicContact CG-CG1 4.12Å; M121-V176 HydrophobicContact SD-CG1 3.63Å; M121-F177 HydrophobicContact CE-CE1 3.82Å; M121-F177 HydrophobicContact CE-CE2 4.2Å; M121-F177 HydrophobicContact CE-CZ 3.63Å
122	I	87.8	Confident	82.7	Confident	99 Å²	99	62.5 Å²	62.5	51%	0.508	33%	0.33	S	S	.	.	H	α-helix	trans	-67.9	-42.7	178.6	-64.4	178	0	0	0	110.9	V118 L119 I124 G125 G126	V118-I122 HydrophobicContact CG1-CD1 3.58Å; V118-I122 HydrophobicContact CG1-CG1 4.1Å; V118-I122 PolarHBondContact O-N 3.11Å; L119-I122 PolarHBondContact O-N 3Å; I122-I124 PolarHBondContact O-N 3.02Å; I122-G125 PolarHBondContact O-N 3.22Å; I122-G126 PolarHBondContact O-N 3.14Å
123	L	90.3	Very high	83.8	Confident	110 Å²	110	59.6 Å²	59.6	58%	0.576	32%	0.324	S	S	*	.	H	α-helix	trans	-61.6	-45.3	179.6	-72.5	175.2	0	0	0	111.8	L119 G126 W127	L119-L123 HydrophobicContact CD1-CD1 4.15Å; L119-L123 HydrophobicContact CD1-CG 4.12Å; L119-L123 HydrophobicContact CD2-CD1 4.45Å; L119-L123 HydrophobicContact CG-CD1 3.84Å; L119-L123 HydrophobicContact CG-CG 4.24Å; L119-L123 WeakPolarHBondContact O-CB 3.14Å; L119-L123 VanDerWaalsContact O-CG 3.3Å; L119-L123 WeakPolarHBondContact O-CG 3.42Å; L119-L123 PolarHBondContact O-N 2.65Å; L123-G126 PolarHBondContact O-N 3.45Å; L123-W127 WeakPolarHBondContact O-CB 3.23Å; L123-W127 PolarHBondContact O-N 2.95Å
124	I	89.5	Confident	84.7	Confident	34 Å²	34	61 Å²	61	17%	0.174	34%	0.34	C	S	.	.	H	α-helix	trans	-68.9	-40.6	178.6	-65.8	166.6	0	0	0	110.6	V27 P120 I122 G126 W127 I128 Y172	V27-I124 HydrophobicContact CB-CD1 4.31Å; V27-I124 HydrophobicContact CG1-CD1 3.49Å; V27-I124 VanDerWaalsContact CG1-CD1 3.49Å; V27-I124 HydrophobicContact CG2-CD1 3.92Å; P120-I124 WeakPolarHBondContact O-CB 3.37Å; P120-I124 WeakPolarHBondContact O-CD1 3.42Å; P120-I124 VanDerWaalsContact O-CG1 3.23Å; P120-I124 WeakPolarHBondContact O-CG1 3.16Å; P120-I124 PolarHBondContact O-N 2.7Å; I122-I124 PolarHBondContact O-N 3.02Å; I124-G126 VanDerWaalsContact C-N 3.31Å; I124-G126 PolarHBondContact O-N 3.25Å; I124-W127 PolarHBondContact O-N 2.92Å; I124-I128 HydrophobicContact CG2-CD1 3.83Å; I124-I128 HydrophobicContact CG2-CG1 4.37Å; I124-I128 WeakPolarHBondContact O-CB 3.38Å; I124-I128 WeakPolarHBondContact O-CG1 3.14Å; I124-I128 PolarHBondContact O-N 3.23Å; I124-Y172 HydrophobicContact CB-CE2 4.34Å; I124-Y172 HydrophobicContact CG2-CD2 4.35Å; I124-Y172 HydrophobicContact CG2-CE2 3.56Å
125	G	89.7	Confident	85.8	Confident	4 Å²	4	61.6 Å²	61.6	4%	0.041	34%	0.34	C	S	.	.	H	α-helix	trans	-59.7	-41.2	173.6	0	0	0	0	0	112.6	M121 I122 N129	M121-G125 PolarHBondContact O-N 3.39Å; I122-G125 PolarHBondContact O-N 3.22Å; G125-N129 WeakPolarHBondContact O-CB 3.3Å; G125-N129 PolarHBondContact O-N 2.85Å
126	G	90.8	Very high	86.7	Confident	41 Å²	41	58.8 Å²	58.8	42%	0.423	32%	0.323	S	S	.	.	H	α-helix	trans	-65.2	-42	174.1	0	0	0	0	0	112.9	I122 L123 I124 N129 W130	I122-G126 PolarHBondContact O-N 3.14Å; L123-G126 PolarHBondContact O-N 3.45Å; I124-G126 VanDerWaalsContact C-N 3.31Å; I124-G126 PolarHBondContact O-N 3.25Å; G126-N129 PolarHBondContact O-N 2.83Å; G126-W130 PolarHBondContact O-N 3Å
127	W	92.4	Very high	87.6	Confident	121 Å²	121	56 Å²	56	46%	0.458	31%	0.306	S	S	.	.	H	α-helix	trans	-63.7	-44.8	175.3	175.3	72.7	0	0	0	112	I23 L123 I124 N129 W130 T131	I23-W127 HydrophobicContact CD1-CH2 4.47Å; I23-W127 HydrophobicContact CD1-CZ3 4.26Å; L123-W127 WeakPolarHBondContact O-CB 3.23Å; L123-W127 PolarHBondContact O-N 2.95Å; I124-W127 PolarHBondContact O-N 2.92Å; W127-N129 VanDerWaalsContact C-N 3.33Å; W127-N129 PolarHBondContact O-N 2.62Å; W127-W130 PolarHBondContact O-N 3.41Å; W127-T131 WeakPolarHBondContact O-CB 3.26Å; W127-T131 PolarHBondContact O-N 3.39Å; W127-T131 PolarHBondContact O-OG1 3.45Å
128	I	91.5	Very high	88.5	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-61	-44.1	175.1	-72.3	169.4	0	0	0	110.6	I20 I124 W130 T131 F132 Y172	I20-I128 HydrophobicContact CD1-CG2 3.97Å; I20-I128 HydrophobicContact CG1-CG2 4.42Å; I124-I128 HydrophobicContact CG2-CD1 3.83Å; I124-I128 HydrophobicContact CG2-CG1 4.37Å; I124-I128 WeakPolarHBondContact O-CB 3.38Å; I124-I128 WeakPolarHBondContact O-CG1 3.14Å; I124-I128 PolarHBondContact O-N 3.23Å; I128-W130 VanDerWaalsContact C-N 3.31Å; I128-W130 PolarHBondContact O-N 3.16Å; I128-T131 PolarHBondContact O-N 3.3Å; I128-F132 HydrophobicContact CG2-CD2 4.16Å; I128-F132 WeakPolarHBondContact O-CA 3.46Å; I128-F132 WeakPolarHBondContact O-CB 3.41Å; I128-F132 PolarHBondContact O-N 3.27Å; I128-Y172 HydrophobicContact CD1-CD1 4.46Å; I128-Y172 HydrophobicContact CD1-CD2 3.18Å; I128-Y172 HydrophobicContact CD1-CE2 3.83Å; I128-Y172 HydrophobicContact CD1-CG 3.57Å
129	N	90.1	Very high	89.1	Confident	28 Å²	28	58.5 Å²	58.5	15%	0.15	31%	0.314	C	S	.	.	H	α-helix	trans	-61.2	-41	176.8	-172.5	30.6	0	0	0	111.6	G125 G126 W127 S133 Q154 A169	G125-N129 WeakPolarHBondContact O-CB 3.3Å; G125-N129 PolarHBondContact O-N 2.85Å; G126-N129 PolarHBondContact O-N 2.83Å; W127-N129 VanDerWaalsContact C-N 3.33Å; W127-N129 PolarHBondContact O-N 2.62Å; N129-S133 WeakPolarHBondContact O-CB 3.27Å; N129-S133 PolarHBondContact O-N 3.11Å; N129-Q154 PolarHBondContact ND2-NE2 3.18Å; N129-Q154 VanDerWaalsContact ND2-NE2 3.13Å; N129-A169 HydrophobicContact CB-CB 3.97Å
130	W	90.3	Very high	89.4	Confident	198 Å²	198	54.9 Å²	54.9	75%	0.75	30%	0.296	S	S	*	.	H	α-helix	trans	-67.4	-47.7	176.7	177.2	72.3	0	0	0	112.4	G126 W127 I128 S133	G126-W130 PolarHBondContact O-N 3Å; W127-W130 PolarHBondContact O-N 3.41Å; I128-W130 VanDerWaalsContact C-N 3.31Å; I128-W130 PolarHBondContact O-N 3.16Å; W130-S133 PolarHBondContact O-OG 3.35Å
131	T	90.7	Very high	89.6	Confident	60 Å²	60	58.8 Å²	58.8	37%	0.368	32%	0.321	S	S	.	.	H	α-helix	trans	-73.8	-34.9	-176.5	-59.8	0	0	0	0	113.5	W127 I128	W127-T131 WeakPolarHBondContact O-CB 3.26Å; W127-T131 PolarHBondContact O-N 3.39Å; W127-T131 PolarHBondContact O-OG1 3.45Å; I128-T131 PolarHBondContact O-N 3.3Å
132	F	89.3	Confident	89.7	Confident	41 Å²	41	62.8 Å²	62.8	18%	0.18	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.6	45.7	-175.1	-60.8	-68.6	0	0	0	111.9	V16 I128 F135 S168	V16-F132 HydrophobicContact CB-CD1 4.5Å; V16-F132 HydrophobicContact CG1-CB 4.32Å; V16-F132 HydrophobicContact CG1-CD1 4Å; V16-F132 HydrophobicContact CG1-CE1 4.47Å; V16-F132 HydrophobicContact CG1-CG 4.09Å; V16-F132 HydrophobicContact CG2-CD1 3.92Å; V16-F132 HydrophobicContact CG2-CE1 4.07Å; I128-F132 HydrophobicContact CG2-CD2 4.16Å; I128-F132 WeakPolarHBondContact O-CA 3.46Å; I128-F132 WeakPolarHBondContact O-CB 3.41Å; I128-F132 PolarHBondContact O-N 3.27Å; F132-F135 HydrophobicContact CB-CE1 4.18Å; F132-F135 HydrophobicContact CB-CZ 3.82Å; F132-F135 HydrophobicContact CD1-CZ 4.09Å; F132-F135 HydrophobicContact CG-CZ 4.42Å; F132-S168 WeakPolarHBondContact CB-OG 3.47Å; F132-S168 WeakPolarHBondContact O-CB 3.37Å; F132-S168 PolarHBondContact O-OG 3.07Å
133	S	88.3	Confident	89.6	Confident	62 Å²	62	63.8 Å²	63.8	43%	0.434	35%	0.351	S	S	.	.			trans	-89.4	162.8	173.4	49.4	0	0	0	0	112.4	N129 W130 F135	N129-S133 WeakPolarHBondContact O-CB 3.27Å; N129-S133 PolarHBondContact O-N 3.11Å; W130-S133 PolarHBondContact O-OG 3.35Å; S133-F135 WeakPolarHBondContact O-CD1 3.2Å
134	G	86.1	Confident	89.4	Confident	62 Å²	62	60.8 Å²	60.8	64%	0.639	34%	0.335	S	S	*	.	S	Bend	trans	92.9	-0.2	170.3	0	0	0	0	0	116	G155	G134-G155 VanDerWaalsContact CA-O 3.25Å; G134-G155 WeakPolarHBondContact CA-O 3.35Å; G134-G155 PolarHBondContact N-O 3.14Å; G134-G155 VanDerWaalsContact N-O 3.17Å
135	F	88.4	Confident	89.3	Confident	58 Å²	58	63 Å²	63	25%	0.254	35%	0.35	S	S	.	.	S	Bend	trans	-145.1	160.8	179.4	62.6	-89.7	0	0	0	113.2	I12 V16 F132 S133	I12-F135 HydrophobicContact CD1-CD2 4.26Å; I12-F135 HydrophobicContact CG2-CD2 4.27Å; I12-F135 HydrophobicContact CG2-CE2 4.05Å; V16-F135 HydrophobicContact CB-CE2 4.26Å; V16-F135 HydrophobicContact CB-CZ 4.34Å; V16-F135 HydrophobicContact CG1-CE2 3.9Å; V16-F135 HydrophobicContact CG1-CZ 3.89Å; V16-F135 HydrophobicContact CG2-CE2 3.85Å; V16-F135 HydrophobicContact CG2-CZ 3.65Å; F132-F135 HydrophobicContact CB-CE1 4.18Å; F132-F135 HydrophobicContact CB-CZ 3.82Å; F132-F135 HydrophobicContact CD1-CZ 4.09Å; F132-F135 HydrophobicContact CG-CZ 4.42Å; S133-F135 WeakPolarHBondContact O-CD1 3.2Å
136	V	90.8	Very high	89	Confident	13 Å²	13	68.6 Å²	68.6	8%	0.079	38%	0.379	C	S	.	.			trans	-84.5	133.1	176.5	178.8	0	0	0	0	109.6	L8 I156 L161 W165	L8-V136 HydrophobicContact CD2-CB 4.3Å; V136-I156 HydrophobicContact CG2-CD1 3.91Å; V136-L161 HydrophobicContact CG2-CD2 3.77Å; V136-W165 HydrophobicContact CG1-CB 3.94Å; V136-W165 HydrophobicContact CG1-CD2 4.13Å; V136-W165 HydrophobicContact CG1-CE3 3.43Å; V136-W165 VanDerWaalsContact CG1-CE3 3.43Å; V136-W165 HydrophobicContact CG1-CG 4.38Å; V136-W165 HydrophobicContact CG1-CZ3 4.23Å
137	T	90.7	Very high	88.9	Confident	5 Å²	5	77.5 Å²	77.5	3%	0.031	40%	0.4	C	S	.	.			trans	-94.7	-52.7	-176.6	-61.5	0	0	0	0	112.5	V16 V17 V166 S168 W171	V16-T137 HydrophobicContact CG1-CG2 4.49Å; V17-T137 HydrophobicContact CG2-CG2 3.74Å; T137-V166 PolarHBondContact N-O 3.46Å; T137-S168 VanDerWaalsContact OG1-CA 3.26Å; T137-S168 WeakPolarHBondContact OG1-CA 3.16Å; T137-S168 PolarHBondContact OG1-N 3.07Å; T137-W171 HydrophobicContact CG2-CB 4.07Å; T137-W171 HydrophobicContact CG2-CG 4.12Å
138	T	91.2	Very high	88.5	Confident	40 Å²	40	77.1 Å²	77.1	25%	0.245	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.1	167.9	-177.5	-169.3	0	0	0	0	111.4	V166 W171	T138-V166 HydrophobicContact CG2-CG2 3.53Å; T138-V166 WeakPolarHBondContact O-CG2 3.48Å; T138-V166 PolarHBondContact O-N 3.12Å; T138-W171 HydrophobicContact CG2-CD2 4.23Å; T138-W171 HydrophobicContact CG2-CE3 3.68Å; T138-W171 HydrophobicContact CG2-CZ3 4.19Å
139	K	90.8	Very high	88.1	Confident	95 Å²	95	78.1 Å²	78.1	41%	0.413	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	126.6	172.6	-177.2	175.7	179.9	172.2	0	108.9	S164 W165	K139-S164 WeakPolarHBondContact CA-O 3.28Å; K139-W165 HydrophobicContact CB-CD2 4.05Å; K139-W165 HydrophobicContact CB-CE3 3.72Å; K139-W165 HydrophobicContact CB-CH2 4.18Å; K139-W165 HydrophobicContact CB-CZ2 4.42Å; K139-W165 HydrophobicContact CB-CZ3 3.81Å; K139-W165 HydrophobicContact CD-CD2 4.44Å; K139-W165 HydrophobicContact CD-CH2 4.32Å; K139-W165 HydrophobicContact CD-CZ2 3.89Å; K139-W165 HydrophobicContact CG-CD2 4.33Å; K139-W165 HydrophobicContact CG-CE3 4.49Å
140	V	89.3	Confident	87.9	Confident	10 Å²	10	81.6 Å²	81.6	6%	0.061	43%	0.43	C	S	.	.			trans	-77.2	146.1	170.7	-64.2	0	0	0	0	110.6	F142 L144 S164 V166 L174	V140-F142 HydrophobicContact CB-CD1 4.45Å; V140-F142 HydrophobicContact CB-CE1 4.07Å; V140-F142 HydrophobicContact CB-CE2 4.29Å; V140-F142 HydrophobicContact CB-CZ 3.98Å; V140-F142 HydrophobicContact CG1-CZ 4.26Å; V140-F142 HydrophobicContact CG2-CD2 4.27Å; V140-F142 HydrophobicContact CG2-CE2 4.06Å; V140-F142 HydrophobicContact CG2-CZ 4.25Å; V140-F142 PolarHBondContact O-N 2.91Å; V140-L144 HydrophobicContact CG2-CD1 3.29Å; V140-L144 HydrophobicContact CG2-CG 4.32Å; V140-S164 WeakPolarHBondContact CG2-O 3.41Å; V140-S164 PolarHBondContact N-O 2.91Å; V140-V166 HydrophobicContact CG1-CG1 4.19Å; V140-L174 HydrophobicContact CG1-CD1 4.09Å
141	P	88.3	Confident	87.6	Confident	130 Å²	130	78.3 Å²	78.3	84%	0.844	42%	0.424	S	S	*	.	S	Bend	trans	-81.8	9.2	-173.1	33.5	-36.4	0	0	0	114.2
142	F	88.6	Confident	87.4	Confident	108 Å²	108	77 Å²	77	47%	0.474	42%	0.415	S	S	.	.	S	Bend	trans	-130.6	144.7	-179	50	-95.9	0	0	0	110.6	V140 L144	V140-F142 HydrophobicContact CB-CD1 4.45Å; V140-F142 HydrophobicContact CB-CE1 4.07Å; V140-F142 HydrophobicContact CB-CE2 4.29Å; V140-F142 HydrophobicContact CB-CZ 3.98Å; V140-F142 HydrophobicContact CG1-CZ 4.26Å; V140-F142 HydrophobicContact CG2-CD2 4.27Å; V140-F142 HydrophobicContact CG2-CE2 4.06Å; V140-F142 HydrophobicContact CG2-CZ 4.25Å; V140-F142 PolarHBondContact O-N 2.91Å; F142-L144 HydrophobicContact CD2-CG 4.26Å; F142-L144 HydrophobicContact CE2-CD1 4.3Å; F142-L144 HydrophobicContact CE2-CD2 4.16Å; F142-L144 HydrophobicContact CE2-CG 4.11Å
143	P	84.4	Confident	87.4	Confident	120 Å²	120	75.5 Å²	75.5	78%	0.779	41%	0.408	S	S	*	.			trans	-69.1	135	-178.9	28.8	-34.3	0	0	0	110.9
144	L	86.9	Confident	87.2	Confident	46 Å²	46	77.5 Å²	77.5	24%	0.241	41%	0.411	C	S	.	.			trans	-109.1	150.9	177	-79	147.7	0	0	0	110.9	V140 F142 L152 A163	V140-L144 HydrophobicContact CG2-CD1 3.29Å; V140-L144 HydrophobicContact CG2-CG 4.32Å; F142-L144 HydrophobicContact CD2-CG 4.26Å; F142-L144 HydrophobicContact CE2-CD1 4.3Å; F142-L144 HydrophobicContact CE2-CD2 4.16Å; F142-L144 HydrophobicContact CE2-CG 4.11Å; L144-L152 HydrophobicContact CB-CD1 4.48Å; L144-L152 HydrophobicContact CD1-CD1 3.85Å; L144-L152 HydrophobicContact CD2-CD1 4.01Å; L144-L152 HydrophobicContact CG-CD1 4.35Å; L144-A163 HydrophobicContact CB-CB 4.12Å
145	T	86.8	Confident	86.9	Confident	80 Å²	80	76.5 Å²	76.5	49%	0.491	40%	0.401	S	S	.	.			trans	-74.3	143.7	177.2	71.8	0	0	0	0	111.1	R147 F148	T145-R147 PolarHBondContact O-N 2.89Å; T145-F148 PolarHBondContact O-N 3.33Å; T145-F148 VanDerWaalsContact O-N 3.09Å; T145-F148 WeakPolarHBondContact OG1-CD2 3.3Å; T145-F148 VanDerWaalsContact OG1-CE2 3.28Å; T145-F148 WeakPolarHBondContact OG1-CE2 3.1Å
146	L	83.9	Confident	86.8	Confident	123 Å²	123	75 Å²	75	64%	0.644	40%	0.395	S	S	*	.	G	3₁₀ helix	trans	-60.2	-22.5	-177.5	-165.2	71.8	0	0	0	113.5	F148 K149	L146-F148 PolarHBondContact O-N 2.81Å; L146-K149 HydrophobicContact CD1-CB 4.49Å; L146-K149 HydrophobicContact CD1-CD 3.74Å; L146-K149 WeakPolarHBondContact O-CB 3.37Å; L146-K149 PolarHBondContact O-N 3.25Å; L146-K149 VanDerWaalsContact O-N 3.15Å
147	R	87.7	Confident	86.3	Confident	228 Å²	228	83.6 Å²	83.6	86%	0.86	43%	0.434	S	S	*	.	G	3₁₀ helix	trans	-67	-24.9	178.6	-64	-64.3	-176	178.4	-0.6	113	T145	T145-R147 PolarHBondContact O-N 2.89Å
148	F	83.8	Confident	85.8	Confident	113 Å²	113	88.2 Å²	88.2	50%	0.496	46%	0.458	S	S	.	.	G	3₁₀ helix	trans	-84.8	-11.1	175.5	-64	-61.7	0	0	0	113.2	T145 L146 M151 L152	T145-F148 PolarHBondContact O-N 3.33Å; T145-F148 VanDerWaalsContact O-N 3.09Å; T145-F148 WeakPolarHBondContact OG1-CD2 3.3Å; T145-F148 VanDerWaalsContact OG1-CE2 3.28Å; T145-F148 WeakPolarHBondContact OG1-CE2 3.1Å; L146-F148 PolarHBondContact O-N 2.81Å; F148-M151 WeakPolarHBondContact O-CB 3.12Å; F148-M151 PolarHBondContact O-N 2.6Å; F148-L152 HydrophobicContact CB-CD1 3.68Å; F148-L152 HydrophobicContact CB-CG 4.13Å; F148-L152 WeakPolarHBondContact O-CG 3.43Å; F148-L152 PolarHBondContact O-N 2.84Å
149	K	83.7	Confident	85.2	Confident	20 Å²	20	94 Å²	94	9%	0.087	49%	0.487	C	S	.	.	H	α-helix	trans	-50.9	-50.2	-178.7	-168.7	177.3	-178.3	171.7	0	114.9	L146 M151 L152 Q153 L159 L161 A163	L146-K149 HydrophobicContact CD1-CB 4.49Å; L146-K149 HydrophobicContact CD1-CD 3.74Å; L146-K149 WeakPolarHBondContact O-CB 3.37Å; L146-K149 PolarHBondContact O-N 3.25Å; L146-K149 VanDerWaalsContact O-N 3.15Å; K149-M151 PolarHBondContact O-N 2.64Å; K149-L152 PolarHBondContact O-N 3.3Å; K149-L152 VanDerWaalsContact O-N 3.16Å; K149-Q153 HydrophobicContact CG-CG 4.39Å; K149-Q153 WeakPolarHBondContact O-CB 3.48Å; K149-Q153 PolarHBondContact O-N 3.2Å; K149-L159 PolarHBondContact NZ-O 3.38Å; K149-L161 WeakPolarHBondContact CE-O 3.23Å; K149-L161 PolarHBondContact NZ-O 3.3Å; K149-A163 HydrophobicContact CB-CB 4.35Å
150	P	85.4	Confident	84.7	Confident	102 Å²	102	95 Å²	95	66%	0.662	51%	0.506	S	S	*	.	H	α-helix	trans	-63.1	-26.5	-179.8	24.9	-35.1	0	0	0	113.2
151	M	85.6	Confident	84.5	Confident	128 Å²	128	95.5 Å²	95.5	63%	0.631	51%	0.508	S	S	*	.	H	α-helix	trans	-79.8	-43	174.7	-176.8	-179.7	176.1	0	0	111.3	F148 K149	F148-M151 WeakPolarHBondContact O-CB 3.12Å; F148-M151 PolarHBondContact O-N 2.6Å; K149-M151 PolarHBondContact O-N 2.64Å
152	L	85.6	Confident	84.4	Confident	32 Å²	32	92.9 Å²	92.9	17%	0.168	49%	0.487	C	S	.	.	H	α-helix	trans	-79	-25.2	-172.3	-68.2	173.1	0	0	0	114.1	L144 F148 K149 S167 S170	L144-L152 HydrophobicContact CB-CD1 4.48Å; L144-L152 HydrophobicContact CD1-CD1 3.85Å; L144-L152 HydrophobicContact CD2-CD1 4.01Å; L144-L152 HydrophobicContact CG-CD1 4.35Å; F148-L152 HydrophobicContact CB-CD1 3.68Å; F148-L152 HydrophobicContact CB-CG 4.13Å; F148-L152 WeakPolarHBondContact O-CG 3.43Å; F148-L152 PolarHBondContact O-N 2.84Å; K149-L152 PolarHBondContact O-N 3.3Å; K149-L152 VanDerWaalsContact O-N 3.16Å; L152-S167 WeakPolarHBondContact O-CB 3.37Å; L152-S167 PolarHBondContact O-N 2.84Å; L152-S167 PolarHBondContact O-OG 2.92Å; L152-S167 VanDerWaalsContact O-OG 3.1Å; L152-S170 VanDerWaalsContact C-OG 3.3Å; L152-S170 WeakPolarHBondContact CA-OG 3.5Å; L152-S170 PolarHBondContact O-OG 3.16Å
153	Q	88.8	Confident	84.3	Confident	10 Å²	10	87.8 Å²	87.8	5%	0.047	47%	0.465	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.3	29.7	-177.2	-65.5	-178.4	-3.3	0	0	111.9	K149 G155 I156 D162 W165	K149-Q153 HydrophobicContact CG-CG 4.39Å; K149-Q153 WeakPolarHBondContact O-CB 3.48Å; K149-Q153 PolarHBondContact O-N 3.2Å; Q153-G155 PolarHBondContact O-N 3.3Å; Q153-I156 HydrophobicContact CB-CB 4.31Å; Q153-I156 HydrophobicContact CB-CD1 4.13Å; Q153-I156 HydrophobicContact CG-CD1 4.34Å; Q153-I156 PolarHBondContact O-N 2.71Å; Q153-D162 PolarHBondContact NE2-O 2.92Å; Q153-W165 VanDerWaalsContact CG-O 3.23Å; Q153-W165 WeakPolarHBondContact CG-O 3.42Å; Q153-W165 PolarHBondContact NE2-O 3.45Å
154	Q	84.5	Confident	84.5	Confident	104 Å²	104	82.3 Å²	82.3	49%	0.486	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	125.7	175.4	-166.5	173.7	-1.4	0	0	109.8	N129	N129-Q154 PolarHBondContact ND2-NE2 3.18Å; N129-Q154 VanDerWaalsContact ND2-NE2 3.13Å
155	G	80.8	Confident	84.6	Confident	41 Å²	41	81 Å²	81	42%	0.423	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.4	10.7	-176	0	0	0	0	0	115.5	G134 Q153	G134-G155 VanDerWaalsContact CA-O 3.25Å; G134-G155 WeakPolarHBondContact CA-O 3.35Å; G134-G155 PolarHBondContact N-O 3.14Å; G134-G155 VanDerWaalsContact N-O 3.17Å; Q153-G155 PolarHBondContact O-N 3.3Å
156	I	85.5	Confident	84.8	Confident	27 Å²	27	77.3 Å²	77.3	14%	0.138	40%	0.399	C	S	.	.			trans	-121.5	124.3	174.4	-58.5	160.2	0	0	0	108.9	V136 Q153 L158	V136-I156 HydrophobicContact CG2-CD1 3.91Å; Q153-I156 HydrophobicContact CB-CB 4.31Å; Q153-I156 HydrophobicContact CB-CD1 4.13Å; Q153-I156 HydrophobicContact CG-CD1 4.34Å; Q153-I156 PolarHBondContact O-N 2.71Å; I156-L158 VanDerWaalsContact C-N 3.35Å; I156-L158 HydrophobicContact CG2-CB 4.06Å; I156-L158 HydrophobicContact CG2-CD1 4.23Å; I156-L158 PolarHBondContact O-N 2.87Å
157	E	80.9	Confident	85.2	Confident	193 Å²	193	71.6 Å²	71.6	90%	0.902	37%	0.369	S	S	*	.			trans	-90.7	8.9	-174.2	-61.7	-174.9	167.1	0	0	114.1	L159	E157-L159 PolarHBondContact O-N 3.43Å
158	L	80.4	Confident	85.4	Confident	102 Å²	102	60.7 Å²	60.7	53%	0.534	33%	0.328	S	S	.	.			trans	-88.5	93.7	-175.6	-74.3	153.6	0	0	0	112.9	I156 S160 L161	I156-L158 VanDerWaalsContact C-N 3.35Å; I156-L158 HydrophobicContact CG2-CB 4.06Å; I156-L158 HydrophobicContact CG2-CD1 4.23Å; I156-L158 PolarHBondContact O-N 2.87Å; L158-S160 VanDerWaalsContact C-N 3.25Å; L158-S160 PolarHBondContact O-N 3.19Å; L158-L161 HydrophobicContact CB-CB 4.16Å; L158-L161 PolarHBondContact O-N 3.38Å
159	L	76.6	Confident	85.7	Confident	163 Å²	163	55.6 Å²	55.6	85%	0.853	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-18.9	179.3	-72.5	162.2	0	0	0	115	K149 E157	K149-L159 PolarHBondContact NZ-O 3.38Å; E157-L159 PolarHBondContact O-N 3.43Å
160	S	82.1	Confident	86	Confident	114 Å²	114	55.3 Å²	55.3	80%	0.797	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	-13.1	179.5	53.9	0	0	0	0	114.2	L158	L158-S160 VanDerWaalsContact C-N 3.25Å; L158-S160 PolarHBondContact O-N 3.19Å
161	L	84.3	Confident	86.4	Confident	22 Å²	22	52.6 Å²	52.6	12%	0.115	28%	0.284	C	S	.	.	S	Bend	trans	-67.4	140.6	-176.2	-168.8	66.5	0	0	0	111.9	L6 V136 K149 L158 W165	L6-L161 HydrophobicContact CD1-CD1 4.48Å; V136-L161 HydrophobicContact CG2-CD2 3.77Å; K149-L161 WeakPolarHBondContact CE-O 3.23Å; K149-L161 PolarHBondContact NZ-O 3.3Å; L158-L161 HydrophobicContact CB-CB 4.16Å; L158-L161 PolarHBondContact O-N 3.38Å; L161-W165 HydrophobicContact CD1-CB 4.43Å; L161-W165 HydrophobicContact CD1-CG 4.04Å; L161-W165 HydrophobicContact CD2-CB 3.67Å; L161-W165 HydrophobicContact CD2-CG 4.15Å; L161-W165 HydrophobicContact CG-CB 3.95Å; L161-W165 HydrophobicContact CG-CG 4.05Å
162	D	85.8	Confident	86.7	Confident	75 Å²	75	46.9 Å²	46.9	40%	0.401	26%	0.255	S	S	.	.			trans	-62.9	145.4	175.9	-177.9	30.2	0	0	0	111.8	Q153 S164 W165	Q153-D162 PolarHBondContact NE2-O 2.92Å; D162-S164 PolarHBondContact O-N 2.7Å; D162-S164 VanDerWaalsContact O-N 3.16Å; D162-S164 WeakPolarHBondContact OD2-CB 3.34Å; D162-S164 PolarHBondContact OD2-OG 3.02Å; D162-W165 PolarHBondContact O-N 2.94Å
163	A	85.9	Confident	86.9	Confident	1 Å²	1	48.4 Å²	48.4	1%	0.008	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-14.4	-178.9	0	0	0	0	0	113.3	L144 K149 W165	L144-A163 HydrophobicContact CB-CB 4.12Å; K149-A163 HydrophobicContact CB-CB 4.35Å; A163-W165 PolarHBondContact O-N 3.18Å
164	S	88.5	Confident	87	Confident	5 Å²	5	51.3 Å²	51.3	4%	0.035	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-21.1	174.3	-47.9	0	0	0	0	113.4	K139 V140 D162	K139-S164 WeakPolarHBondContact CA-O 3.28Å; V140-S164 WeakPolarHBondContact CG2-O 3.41Å; V140-S164 PolarHBondContact N-O 2.91Å; D162-S164 PolarHBondContact O-N 2.7Å; D162-S164 VanDerWaalsContact O-N 3.16Å; D162-S164 WeakPolarHBondContact OD2-CB 3.34Å; D162-S164 PolarHBondContact OD2-OG 3.02Å
165	W	89.5	Confident	87.3	Confident	17 Å²	17	47 Å²	47	6%	0.064	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	123.3	173.7	-66.8	99.5	0	0	0	110	L6 L8 V136 K139 Q153 L161 D162 A163	L6-W165 HydrophobicContact CB-CH2 3.47Å; L6-W165 VanDerWaalsContact CB-CH2 3.47Å; L6-W165 HydrophobicContact CB-CZ2 3.52Å; L6-W165 HydrophobicContact CB-CZ3 4.28Å; L8-W165 HydrophobicContact CD1-CZ3 3.9Å; L8-W165 HydrophobicContact CG-CZ3 4.31Å; V136-W165 HydrophobicContact CG1-CB 3.94Å; V136-W165 HydrophobicContact CG1-CD2 4.13Å; V136-W165 HydrophobicContact CG1-CE3 3.43Å; V136-W165 VanDerWaalsContact CG1-CE3 3.43Å; V136-W165 HydrophobicContact CG1-CG 4.38Å; V136-W165 HydrophobicContact CG1-CZ3 4.23Å; K139-W165 HydrophobicContact CB-CD2 4.05Å; K139-W165 HydrophobicContact CB-CE3 3.72Å; K139-W165 HydrophobicContact CB-CH2 4.18Å; K139-W165 HydrophobicContact CB-CZ2 4.42Å; K139-W165 HydrophobicContact CB-CZ3 3.81Å; K139-W165 HydrophobicContact CD-CD2 4.44Å; K139-W165 HydrophobicContact CD-CH2 4.32Å; K139-W165 HydrophobicContact CD-CZ2 3.89Å; K139-W165 HydrophobicContact CG-CD2 4.33Å; K139-W165 HydrophobicContact CG-CE3 4.49Å; Q153-W165 VanDerWaalsContact CG-O 3.23Å; Q153-W165 WeakPolarHBondContact CG-O 3.42Å; Q153-W165 PolarHBondContact NE2-O 3.45Å; L161-W165 HydrophobicContact CD1-CB 4.43Å; L161-W165 HydrophobicContact CD1-CG 4.04Å; L161-W165 HydrophobicContact CD2-CB 3.67Å; L161-W165 HydrophobicContact CD2-CG 4.15Å; L161-W165 HydrophobicContact CG-CB 3.95Å; L161-W165 HydrophobicContact CG-CG 4.05Å; D162-W165 PolarHBondContact O-N 2.94Å; A163-W165 PolarHBondContact O-N 3.18Å
166	V	91.2	Very high	87.5	Confident	4 Å²	4	46.6 Å²	46.6	2%	0.024	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	148.3	-170.5	-59.1	0	0	0	0	112.4	T137 T138 V140	T137-V166 PolarHBondContact N-O 3.46Å; T138-V166 HydrophobicContact CG2-CG2 3.53Å; T138-V166 WeakPolarHBondContact O-CG2 3.48Å; T138-V166 PolarHBondContact O-N 3.12Å; V140-V166 HydrophobicContact CG1-CG1 4.19Å
167	S	93	Very high	87.5	Confident	2 Å²	2	51.9 Å²	51.9	1%	0.014	27%	0.268	C	S	.	.			trans	-75.7	172.9	172.6	73.3	0	0	0	0	112.3	L152 A169 S170 W171	L152-S167 WeakPolarHBondContact O-CB 3.37Å; L152-S167 PolarHBondContact O-N 2.84Å; L152-S167 PolarHBondContact O-OG 2.92Å; L152-S167 VanDerWaalsContact O-OG 3.1Å; S167-A169 VanDerWaalsContact C-N 3.32Å; S167-A169 PolarHBondContact O-N 3.34Å; S167-S170 PolarHBondContact O-N 3.17Å; S167-S170 PolarHBondContact OG-OG 3.31Å; S167-W171 PolarHBondContact O-N 2.88Å
168	S	91.9	Very high	87.8	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-61.5	-38.1	177.3	57.4	0	0	0	0	112.6	F132 T137 W171 Y172	F132-S168 WeakPolarHBondContact CB-OG 3.47Å; F132-S168 WeakPolarHBondContact O-CB 3.37Å; F132-S168 PolarHBondContact O-OG 3.07Å; T137-S168 VanDerWaalsContact OG1-CA 3.26Å; T137-S168 WeakPolarHBondContact OG1-CA 3.16Å; T137-S168 PolarHBondContact OG1-N 3.07Å; S168-W171 WeakPolarHBondContact O-CB 3.29Å; S168-W171 PolarHBondContact O-N 3.07Å; S168-Y172 PolarHBondContact O-N 3.04Å
169	A	90	Very high	88.1	Confident	6 Å²	6	41.3 Å²	41.3	5%	0.05	23%	0.231	C	C	.	.	H	α-helix	trans	-64.1	-42.7	176.8	0	0	0	0	0	111.8	N129 S167 Y172 F173	N129-A169 HydrophobicContact CB-CB 3.97Å; S167-A169 VanDerWaalsContact C-N 3.32Å; S167-A169 PolarHBondContact O-N 3.34Å; A169-Y172 WeakPolarHBondContact O-CB 3.14Å; A169-Y172 PolarHBondContact O-N 2.96Å; A169-F173 VanDerWaalsContact O-CD2 3.23Å; A169-F173 WeakPolarHBondContact O-CD2 2.92Å; A169-F173 PolarHBondContact O-N 3.05Å
170	S	90.8	Very high	88.1	Confident	14 Å²	14	36.1 Å²	36.1	10%	0.098	20%	0.2	C	C	.	.	H	α-helix	trans	-65.8	-39.3	176.2	-60.2	0	0	0	0	112.2	L152 S167 Y172 F173 L174	L152-S170 VanDerWaalsContact C-OG 3.3Å; L152-S170 WeakPolarHBondContact CA-OG 3.5Å; L152-S170 PolarHBondContact O-OG 3.16Å; S167-S170 PolarHBondContact O-N 3.17Å; S167-S170 PolarHBondContact OG-OG 3.31Å; S170-Y172 VanDerWaalsContact C-N 3.34Å; S170-F173 PolarHBondContact O-N 2.96Å; S170-L174 WeakPolarHBondContact O-CB 3.37Å; S170-L174 PolarHBondContact O-N 2.82Å
171	W	92.8	Very high	88	Confident	45 Å²	45	35.4 Å²	35.4	17%	0.17	19%	0.194	C	C	.	.	H	α-helix	trans	-61.8	-41.3	172.2	178.4	-115.9	0	0	0	112	V17 V21 T137 T138 S167 S168 L174 N175	V17-W171 HydrophobicContact CG1-CZ2 3.77Å; V17-W171 PolarHBondContact O-NE1 2.96Å; V21-W171 HydrophobicContact CG2-CZ2 3.77Å; T137-W171 HydrophobicContact CG2-CB 4.07Å; T137-W171 HydrophobicContact CG2-CG 4.12Å; T138-W171 HydrophobicContact CG2-CD2 4.23Å; T138-W171 HydrophobicContact CG2-CE3 3.68Å; T138-W171 HydrophobicContact CG2-CZ3 4.19Å; S167-W171 PolarHBondContact O-N 2.88Å; S168-W171 WeakPolarHBondContact O-CB 3.29Å; S168-W171 PolarHBondContact O-N 3.07Å; W171-L174 HydrophobicContact CE3-CD1 4.4Å; W171-L174 HydrophobicContact CZ3-CD1 4.4Å; W171-L174 HydrophobicContact CZ3-CD2 4.34Å; W171-L174 PolarHBondContact O-N 3.05Å; W171-N175 WeakPolarHBondContact CZ2-ND2 3.01Å; W171-N175 PolarHBondContact NE1-ND2 2.95Å; W171-N175 PolarHBondContact O-N 2.9Å; W171-N175 PolarHBondContact O-ND2 2.93Å
172	Y	92.8	Very high	87.9	Confident	7 Å²	7	37.6 Å²	37.6	3%	0.027	21%	0.205	C	C	.	.	H	α-helix	trans	-58.4	-52.4	172.8	165.5	-98.4	0	0	0	111.8	I20 T24 M121 I124 I128 S168 A169 S170 L174 N175 V176	I20-Y172 HydrophobicContact CG2-CD2 4.45Å; T24-Y172 HydrophobicContact CG2-CD2 3.2Å; T24-Y172 HydrophobicContact CG2-CE2 3.44Å; T24-Y172 VanDerWaalsContact CG2-CE2 3.44Å; T24-Y172 HydrophobicContact CG2-CG 4.3Å; M121-Y172 WeakPolarHBondContact CA-OH 2.99Å; M121-Y172 HydrophobicContact CG-CE1 4.3Å; M121-Y172 WeakPolarHBondContact O-CE1 3.15Å; M121-Y172 PolarHBondContact O-OH 3.34Å; I124-Y172 HydrophobicContact CB-CE2 4.34Å; I124-Y172 HydrophobicContact CG2-CD2 4.35Å; I124-Y172 HydrophobicContact CG2-CE2 3.56Å; I128-Y172 HydrophobicContact CD1-CD1 4.46Å; I128-Y172 HydrophobicContact CD1-CD2 3.18Å; I128-Y172 HydrophobicContact CD1-CE2 3.83Å; I128-Y172 HydrophobicContact CD1-CG 3.57Å; S168-Y172 PolarHBondContact O-N 3.04Å; A169-Y172 WeakPolarHBondContact O-CB 3.14Å; A169-Y172 PolarHBondContact O-N 2.96Å; S170-Y172 VanDerWaalsContact C-N 3.34Å; Y172-L174 VanDerWaalsContact C-N 3.29Å; Y172-L174 PolarHBondContact O-N 3.34Å; Y172-N175 PolarHBondContact O-N 3.25Å; Y172-N175 VanDerWaalsContact O-N 3.08Å; Y172-V176 HydrophobicContact CD1-CG2 4.28Å; Y172-V176 HydrophobicContact CD2-CG2 4.14Å; Y172-V176 HydrophobicContact CE1-CG2 3.79Å; Y172-V176 HydrophobicContact CE2-CG2 3.64Å; Y172-V176 HydrophobicContact CG-CG2 4.43Å; Y172-V176 VanDerWaalsContact CZ-CG2 3.44Å; Y172-V176 WeakPolarHBondContact O-CG2 3.07Å; Y172-V176 PolarHBondContact O-N 2.92Å
173	F	88.9	Confident	87.8	Confident	64 Å²	64	34.5 Å²	34.5	28%	0.281	19%	0.188	S	C	.	.	H	α-helix	trans	-60.3	-39.7	179.7	-83.4	-70.2	0	0	0	112.2	M121 A169 S170 N175 V176 F177	M121-F173 HydrophobicContact CE-CD1 3.38Å; M121-F173 HydrophobicContact CE-CE1 3.54Å; M121-F173 HydrophobicContact CG-CE1 4.19Å; A169-F173 VanDerWaalsContact O-CD2 3.23Å; A169-F173 WeakPolarHBondContact O-CD2 2.92Å; A169-F173 PolarHBondContact O-N 3.05Å; S170-F173 PolarHBondContact O-N 2.96Å; F173-N175 VanDerWaalsContact C-N 3.34Å; F173-N175 PolarHBondContact O-N 3.38Å; F173-V176 PolarHBondContact O-N 2.96Å; F173-F177 HydrophobicContact CB-CE2 4.26Å; F173-F177 HydrophobicContact CD1-CE2 4.19Å; F173-F177 HydrophobicContact CD1-CZ 4.48Å; F173-F177 WeakPolarHBondContact O-CD2 3.18Å; F173-F177 PolarHBondContact O-N 3.08Å
174	L	90.2	Very high	87.4	Confident	72 Å²	72	36.6 Å²	36.6	38%	0.377	20%	0.202	S	C	.	.	H	α-helix	trans	-58.5	-46.1	174.1	-165	164.6	0	0	0	111	V140 S170 W171 Y172 F177 G178	V140-L174 HydrophobicContact CG1-CD1 4.09Å; S170-L174 WeakPolarHBondContact O-CB 3.37Å; S170-L174 PolarHBondContact O-N 2.82Å; W171-L174 HydrophobicContact CE3-CD1 4.4Å; W171-L174 HydrophobicContact CZ3-CD1 4.4Å; W171-L174 HydrophobicContact CZ3-CD2 4.34Å; W171-L174 PolarHBondContact O-N 3.05Å; Y172-L174 VanDerWaalsContact C-N 3.29Å; Y172-L174 PolarHBondContact O-N 3.34Å; L174-F177 PolarHBondContact O-N 3.43Å; L174-G178 PolarHBondContact O-N 3.1Å
175	N	90.8	Very high	87.2	Confident	14 Å²	14	43.5 Å²	43.5	8%	0.075	24%	0.238	C	C	.	.	H	α-helix	trans	-64.8	-41.1	176.4	-79.8	-77.4	0	0	0	112.8	T24 W171 Y172 F173 F177 G178 L179	T24-N175 HydrophobicContact CG2-CB 4.03Å; W171-N175 WeakPolarHBondContact CZ2-ND2 3.01Å; W171-N175 PolarHBondContact NE1-ND2 2.95Å; W171-N175 PolarHBondContact O-N 2.9Å; W171-N175 PolarHBondContact O-ND2 2.93Å; Y172-N175 PolarHBondContact O-N 3.25Å; Y172-N175 VanDerWaalsContact O-N 3.08Å; F173-N175 VanDerWaalsContact C-N 3.34Å; F173-N175 PolarHBondContact O-N 3.38Å; N175-F177 VanDerWaalsContact C-N 3.29Å; N175-F177 PolarHBondContact O-N 2.77Å; N175-G178 PolarHBondContact O-N 3.44Å; N175-L179 HydrophobicContact CB-CD1 4.14Å; N175-L179 HydrophobicContact CB-CG 4.46Å; N175-L179 VanDerWaalsContact O-CB 3.28Å; N175-L179 WeakPolarHBondContact O-CB 3.06Å; N175-L179 WeakPolarHBondContact O-CG 3.34Å; N175-L179 PolarHBondContact O-N 3.46Å
176	V	86.6	Confident	87	Confident	32 Å²	32	47.5 Å²	47.5	19%	0.194	26%	0.259	C	S	.	.	H	α-helix	trans	-60	-41.3	177.4	176.9	0	0	0	0	111.5	T24 M121 Y172 F173	T24-V176 HydrophobicContact CG2-CG2 4.26Å; M121-V176 HydrophobicContact CE-CB 3.77Å; M121-V176 HydrophobicContact CE-CG1 3.3Å; M121-V176 HydrophobicContact CE-CG2 4.37Å; M121-V176 HydrophobicContact CG-CG1 4.12Å; M121-V176 HydrophobicContact SD-CG1 3.63Å; Y172-V176 HydrophobicContact CD1-CG2 4.28Å; Y172-V176 HydrophobicContact CD2-CG2 4.14Å; Y172-V176 HydrophobicContact CE1-CG2 3.79Å; Y172-V176 HydrophobicContact CE2-CG2 3.64Å; Y172-V176 HydrophobicContact CG-CG2 4.43Å; Y172-V176 VanDerWaalsContact CZ-CG2 3.44Å; Y172-V176 WeakPolarHBondContact O-CG2 3.07Å; Y172-V176 PolarHBondContact O-N 2.92Å; F173-V176 PolarHBondContact O-N 2.96Å
177	F	85.2	Confident	86.4	Confident	137 Å²	137	49 Å²	49	60%	0.601	27%	0.267	S	S	*	.	H	α-helix	trans	-75.5	-37.5	177.3	-63.4	-54.2	0	0	0	113	M121 F173 L174 N175	M121-F177 HydrophobicContact CE-CE1 3.82Å; M121-F177 HydrophobicContact CE-CE2 4.2Å; M121-F177 HydrophobicContact CE-CZ 3.63Å; F173-F177 HydrophobicContact CB-CE2 4.26Å; F173-F177 HydrophobicContact CD1-CE2 4.19Å; F173-F177 HydrophobicContact CD1-CZ 4.48Å; F173-F177 WeakPolarHBondContact O-CD2 3.18Å; F173-F177 PolarHBondContact O-N 3.08Å; L174-F177 PolarHBondContact O-N 3.43Å; N175-F177 VanDerWaalsContact C-N 3.29Å; N175-F177 PolarHBondContact O-N 2.77Å
178	G	86.8	Confident	85.4	Confident	53 Å²	53	50.3 Å²	50.3	55%	0.546	28%	0.282	S	S	.	.	H	α-helix	trans	-75.9	-37.9	-176.7	0	0	0	0	0	114.7	L174 N175 R180	L174-G178 PolarHBondContact O-N 3.1Å; N175-G178 PolarHBondContact O-N 3.44Å; G178-R180 PolarHBondContact O-N 3.32Å; G178-R180 VanDerWaalsContact O-N 3.16Å
179	L	86.1	Confident	84	Confident	21 Å²	21	59.1 Å²	59.1	11%	0.11	32%	0.323	C	S	.	.	H	α-helix	trans	-74.6	-4.7	-176.4	-63	174.6	0	0	0	113.4	T24 F25 N175 M182 Y183	T24-L179 WeakPolarHBondContact OG1-CD1 3.45Å; F25-L179 HydrophobicContact CB-CD1 4.37Å; N175-L179 HydrophobicContact CB-CD1 4.14Å; N175-L179 HydrophobicContact CB-CG 4.46Å; N175-L179 VanDerWaalsContact O-CB 3.28Å; N175-L179 WeakPolarHBondContact O-CB 3.06Å; N175-L179 WeakPolarHBondContact O-CG 3.34Å; N175-L179 PolarHBondContact O-N 3.46Å; L179-M182 HydrophobicContact CB-CE 4.11Å; L179-M182 HydrophobicContact CD2-CE 3.4Å; L179-M182 HydrophobicContact CD2-SD 4.19Å; L179-M182 HydrophobicContact CG-CE 4.21Å; L179-M182 WeakPolarHBondContact O-CB 3.43Å; L179-M182 PolarHBondContact O-N 3.17Å; L179-Y183 HydrophobicContact CB-CE1 4.46Å; L179-Y183 HydrophobicContact CB-CE2 4Å; L179-Y183 VanDerWaalsContact O-CD2 3.3Å; L179-Y183 WeakPolarHBondContact O-CD2 3.34Å; L179-Y183 PolarHBondContact O-N 3.28Å
180	R	77.8	Confident	82.5	Confident	54 Å²	54	66.1 Å²	66.1	20%	0.204	36%	0.359	C	S	.	.	H	α-helix	trans	-62.3	-47.7	-176.8	-174.6	173.8	166.4	-140.8	-14.8	114	G178 M182 Y183 S184 D194 S196	G178-R180 PolarHBondContact O-N 3.32Å; G178-R180 VanDerWaalsContact O-N 3.16Å; R180-M182 PolarHBondContact O-N 3.47Å; R180-Y183 PolarHBondContact O-N 3.18Å; R180-S184 PolarHBondContact O-N 3.24Å; R180-D194 WeakPolarHBondContact CG-OD1 3.46Å; R180-D194 IonicContact CZ-OD1 2.71Å; R180-D194 IonicContact CZ-OD2 3.8Å; R180-D194 IonicContact NE-OD1 3.08Å; R180-D194 PolarHBondContact NE-OD1 2.75Å; R180-D194 IonicContact NH2-OD1 2.62Å; R180-D194 PolarHBondContact NH2-OD1 2.69Å; R180-D194 IonicContact NH2-OD2 3.8Å; R180-D194 PolarHBondContact NH2-OD2 2.85Å; R180-S196 PolarHBondContact NH1-OG 3.4Å; R180-S196 PolarHBondContact NH2-OG 3.32Å
181	S	79.1	Confident	81.1	Confident	98 Å²	98	65.9 Å²	65.9	69%	0.685	36%	0.357	S	S	*	.	H	α-helix	trans	-62.1	-37	176.5	174.6	0	0	0	0	111.1	S184 L185	S181-S184 PolarHBondContact O-N 2.98Å; S181-L185 PolarHBondContact O-N 3.01Å; S181-L185 VanDerWaalsContact O-N 3.14Å
182	M	82.7	Confident	79.4	Confident	69 Å²	69	65.2 Å²	65.2	34%	0.34	36%	0.364	S	S	.	.	H	α-helix	trans	-65.6	-38.5	176.2	-169.5	-175.5	66	0	0	111.9	F25 L179 R180 S184 L185 I186	F25-M182 HydrophobicContact CD2-CE 3.31Å; F25-M182 HydrophobicContact CE2-CE 3.48Å; F25-M182 VanDerWaalsContact CE2-CE 3.48Å; F25-M182 HydrophobicContact CG-CE 4.46Å; L179-M182 HydrophobicContact CB-CE 4.11Å; L179-M182 HydrophobicContact CD2-CE 3.4Å; L179-M182 HydrophobicContact CD2-SD 4.19Å; L179-M182 HydrophobicContact CG-CE 4.21Å; L179-M182 WeakPolarHBondContact O-CB 3.43Å; L179-M182 PolarHBondContact O-N 3.17Å; R180-M182 PolarHBondContact O-N 3.47Å; M182-S184 VanDerWaalsContact C-N 3.33Å; M182-S184 PolarHBondContact O-N 2.99Å; M182-L185 PolarHBondContact O-N 2.99Å; M182-I186 HydrophobicContact CG-CD1 3.97Å; M182-I186 WeakPolarHBondContact O-CG1 3.44Å; M182-I186 PolarHBondContact O-N 3.18Å; M182-I186 VanDerWaalsContact O-N 3.12Å
183	Y	82.9	Confident	77.6	Confident	10 Å²	10	65 Å²	65	4%	0.039	36%	0.363	C	S	.	.	H	α-helix	trans	-63.1	-38.3	173.1	-59.5	-45	0	0	0	112.4	T24 F25 L179 R180 L185 I186 L187 N191 A193	T24-Y183 PolarHBondContact O-OH 2.86Å; F25-Y183 VanDerWaalsContact CA-OH 3.28Å; F25-Y183 WeakPolarHBondContact CA-OH 3.49Å; F25-Y183 HydrophobicContact CD2-CD1 4.21Å; F25-Y183 AromaticContact CD2-CE1 3.5Å; F25-Y183 HydrophobicContact CD2-CE1 3.5Å; F25-Y183 VanDerWaalsContact CD2-CE1 3.5Å; F25-Y183 HydrophobicContact CE2-CD1 4.1Å; F25-Y183 AromaticContact CE2-CE1 3.84Å; F25-Y183 HydrophobicContact CE2-CE1 3.84Å; F25-Y183 HydrophobicContact CG-CE1 4.4Å; L179-Y183 HydrophobicContact CB-CE1 4.46Å; L179-Y183 HydrophobicContact CB-CE2 4Å; L179-Y183 VanDerWaalsContact O-CD2 3.3Å; L179-Y183 WeakPolarHBondContact O-CD2 3.34Å; L179-Y183 PolarHBondContact O-N 3.28Å; R180-Y183 PolarHBondContact O-N 3.18Å; Y183-L185 VanDerWaalsContact C-N 3.29Å; Y183-L185 PolarHBondContact O-N 3.21Å; Y183-I186 PolarHBondContact O-N 3.37Å; Y183-L187 VanDerWaalsContact O-CB 3.27Å; Y183-L187 WeakPolarHBondContact O-CB 3.49Å; Y183-L187 PolarHBondContact O-N 3.22Å; Y183-N191 WeakPolarHBondContact CB-ND2 3.28Å; Y183-A193 HydrophobicContact CD2-CB 4.41Å
184	S	78.9	Confident	76.1	Confident	45 Å²	45	64 Å²	64	32%	0.315	36%	0.361	S	S	.	.	H	α-helix	trans	-64.1	-35.1	175.9	-178.5	0	0	0	0	112.3	R180 S181 M182 G188	R180-S184 PolarHBondContact O-N 3.24Å; S181-S184 PolarHBondContact O-N 2.98Å; M182-S184 VanDerWaalsContact C-N 3.33Å; M182-S184 PolarHBondContact O-N 2.99Å; S184-G188 CarbonylContact O-C 3.47Å; S184-G188 VanDerWaalsContact O-CA 3.28Å; S184-G188 WeakPolarHBondContact O-CA 3.26Å; S184-G188 PolarHBondContact O-N 3.31Å
185	L	84.1	Confident	74.5	Confident	150 Å²	150	62.4 Å²	62.4	79%	0.785	35%	0.352	S	S	*	.	H	α-helix	trans	-67.7	-39.9	176.1	-173.3	67.4	0	0	0	112.4	S181 M182 Y183	S181-L185 PolarHBondContact O-N 3.01Å; S181-L185 VanDerWaalsContact O-N 3.14Å; M182-L185 PolarHBondContact O-N 2.99Å; Y183-L185 VanDerWaalsContact C-N 3.29Å; Y183-L185 PolarHBondContact O-N 3.21Å
186	I	84.8	Confident	72.8	Confident	100 Å²	100	64.1 Å²	64.1	51%	0.513	36%	0.364	S	S	.	.	H	α-helix	trans	-83.8	-39.4	-175.1	-63.3	167.6	0	0	0	111.9	F25 M182 Y183	F25-I186 HydrophobicContact CE2-CD1 3.92Å; F25-I186 HydrophobicContact CZ-CD1 4.04Å; M182-I186 HydrophobicContact CG-CD1 3.97Å; M182-I186 WeakPolarHBondContact O-CG1 3.44Å; M182-I186 PolarHBondContact O-N 3.18Å; M182-I186 VanDerWaalsContact O-N 3.12Å; Y183-I186 PolarHBondContact O-N 3.37Å
187	L	78.3	Confident	71.3	Confident	35 Å²	35	70.1 Å²	70.1	18%	0.183	38%	0.384	C	S	.	.	H	α-helix	trans	-103.6	-6.8	-171.6	-57.2	171.9	0	0	0	113.3	H32 Y183	H32-L187 HydrophobicContact CB-CD1 3.91Å; Y183-L187 VanDerWaalsContact O-CB 3.27Å; Y183-L187 WeakPolarHBondContact O-CB 3.49Å; Y183-L187 PolarHBondContact O-N 3.22Å
188	G	72.6	Confident	69.9	Low	31 Å²	31	66.9 Å²	66.9	32%	0.32	37%	0.372	S	S	.	.			trans	86	-170.4	-179.5	0	0	0	0	0	114.6	S184	S184-G188 CarbonylContact O-C 3.47Å; S184-G188 VanDerWaalsContact O-CA 3.28Å; S184-G188 WeakPolarHBondContact O-CA 3.26Å; S184-G188 PolarHBondContact O-N 3.31Å
189	Q	62	Low	68.2	Low	184 Å²	184	69.3 Å²	69.3	86%	0.86	37%	0.37	S	S	*	.	S	Bend	trans	-77.9	-21.8	-172.4	-69	-177.5	-6.4	0	0	114.1	N191	Q189-N191 PolarHBondContact O-N 3.5Å; Q189-N191 VanDerWaalsContact O-N 3.11Å
190	D	59.2	Low	66.7	Low	154 Å²	154	74.8 Å²	74.8	82%	0.824	40%	0.395	S	S	*	.			trans	-85.9	35.9	176.4	-69.6	-46.2	0	0	0	112.6	G192	D190-G192 PolarHBondContact O-N 2.84Å
191	N	61.1	Low	65.4	Low	9 Å²	9	75.7 Å²	75.7	5%	0.048	40%	0.402	C	S	.	.			trans	-76.8	102.3	-177.9	-169	7.9	0	0	0	110.3	H32 Y183 Q189 A193 D194	H32-N191 PolarHBondContact ND1-OD1 2.97Å; Y183-N191 WeakPolarHBondContact CB-ND2 3.28Å; Q189-N191 PolarHBondContact O-N 3.5Å; Q189-N191 VanDerWaalsContact O-N 3.11Å; N191-A193 PolarHBondContact O-N 3.41Å; N191-A193 WeakPolarHBondContact OD1-CB 3.17Å; N191-A193 PolarHBondContact OD1-N 2.6Å; N191-A193 VanDerWaalsContact OD1-N 3.07Å; N191-D194 VanDerWaalsContact O-CB 3.28Å; N191-D194 WeakPolarHBondContact O-CB 3.13Å; N191-D194 PolarHBondContact O-N 2.92Å
192	G	57.4	Low	63.9	Low	30 Å²	30	76.1 Å²	76.1	31%	0.309	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-9.1	170.4	0	0	0	0	0	114.3	D190	D190-G192 PolarHBondContact O-N 2.84Å
193	A	53	Low	61.9	Low	2 Å²	2	81.2 Å²	81.2	2%	0.017	42%	0.418	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-12.7	172.1	0	0	0	0	0	114.8	R31 Y183 N191 Q195	R31-A193 PolarHBondContact NH2-O 3.3Å; Y183-A193 HydrophobicContact CD2-CB 4.41Å; N191-A193 PolarHBondContact O-N 3.41Å; N191-A193 WeakPolarHBondContact OD1-CB 3.17Å; N191-A193 PolarHBondContact OD1-N 2.6Å; N191-A193 VanDerWaalsContact OD1-N 3.07Å; A193-Q195 PolarHBondContact O-N 3.37Å; A193-Q195 VanDerWaalsContact O-N 3.07Å
194	D	58.9	Low	60	Low	44 Å²	44	84.5 Å²	84.5	24%	0.235	44%	0.442	C	S	.	.			trans	-81.8	83.3	-169.2	-157	53.4	0	0	0	112.9	R180 N191	R180-D194 WeakPolarHBondContact CG-OD1 3.46Å; R180-D194 IonicContact CZ-OD1 2.71Å; R180-D194 IonicContact CZ-OD2 3.8Å; R180-D194 IonicContact NE-OD1 3.08Å; R180-D194 PolarHBondContact NE-OD1 2.75Å; R180-D194 IonicContact NH2-OD1 2.62Å; R180-D194 PolarHBondContact NH2-OD1 2.69Å; R180-D194 IonicContact NH2-OD2 3.8Å; R180-D194 PolarHBondContact NH2-OD2 2.85Å; N191-D194 VanDerWaalsContact O-CB 3.28Å; N191-D194 WeakPolarHBondContact O-CB 3.13Å; N191-D194 PolarHBondContact O-N 2.92Å
195	Q	57.1	Low	58.2	Low	39 Å²	39	84.6 Å²	84.6	18%	0.182	45%	0.45	C	S	.	.	H	α-helix	trans	-74.6	-25.3	-167.6	-169.3	176	5.8	0	0	115.9	A193 R197 I198 M199	A193-Q195 PolarHBondContact O-N 3.37Å; A193-Q195 VanDerWaalsContact O-N 3.07Å; Q195-R197 PolarHBondContact O-N 3.49Å; Q195-I198 PolarHBondContact O-N 3.24Å; Q195-M199 HydrophobicContact CG-CE 4.47Å; Q195-M199 WeakPolarHBondContact O-CB 3.3Å; Q195-M199 PolarHBondContact O-N 3.48Å
196	S	54.4	Low	55.9	Low	49 Å²	49	79.9 Å²	79.9	34%	0.343	43%	0.433	S	S	.	.	H	α-helix	trans	-76.8	-19.2	-176.9	75.1	0	0	0	0	114.3	R180 I198 Q200	R180-S196 PolarHBondContact NH1-OG 3.4Å; R180-S196 PolarHBondContact NH2-OG 3.32Å; S196-I198 VanDerWaalsContact C-N 3.33Å; S196-Q200 WeakPolarHBondContact O-CA 3.43Å; S196-Q200 WeakPolarHBondContact O-CB 3.36Å; S196-Q200 PolarHBondContact O-N 2.57Å
197	R	55.6	Low	53.5	Low	159 Å²	159	78.6 Å²	78.6	60%	0.6	44%	0.437	S	S	*	.	H	α-helix	trans	-61.8	-48.5	165.8	-89.2	-174.7	67.2	179	-0.4	109.9	Q195 Q200 E201	Q195-R197 PolarHBondContact O-N 3.49Å; R197-Q200 PolarHBondContact O-N 3.37Å; R197-E201 IonicContact NE-OE1 2.83Å; R197-E201 IonicContact NH2-OE1 3.73Å; R197-E201 WeakPolarHBondContact O-CB 3.42Å; R197-E201 WeakPolarHBondContact O-CG 3.37Å; R197-E201 PolarHBondContact O-N 3.08Å
198	I	54	Low	51.6	Low	68 Å²	68	85 Å²	85	35%	0.349	47%	0.469	S	S	.	.	H	α-helix	trans	-66.6	-44.9	-179.6	-58.8	172.3	0	0	0	111.6	Q195 S196 E201 Q202	Q195-I198 PolarHBondContact O-N 3.24Å; S196-I198 VanDerWaalsContact C-N 3.33Å; I198-E201 PolarHBondContact O-N 3.22Å; I198-Q202 VanDerWaalsContact O-CB 3.25Å; I198-Q202 WeakPolarHBondContact O-CB 3.23Å; I198-Q202 PolarHBondContact O-N 3.23Å
199	M	52.9	Low	49.9	Very low	104 Å²	104	87.3 Å²	87.3	51%	0.512	49%	0.485	S	S	.	.	H	α-helix	trans	-69.8	-36.7	-179.5	-169.9	176.7	-73.7	0	0	112.2	Q195 Q202 M203	Q195-M199 HydrophobicContact CG-CE 4.47Å; Q195-M199 WeakPolarHBondContact O-CB 3.3Å; Q195-M199 PolarHBondContact O-N 3.48Å; M199-Q202 PolarHBondContact O-N 2.99Å; M199-M203 PolarHBondContact O-N 3.36Å
200	Q	53.8	Low	48.9	Very low	136 Å²	136	86.3 Å²	86.3	64%	0.636	48%	0.482	S	S	*	.	H	α-helix	trans	-70.2	-40	173	-168.8	172	8.4	0	0	110.8	S196 R197 Q202 M203 S204	S196-Q200 WeakPolarHBondContact O-CA 3.43Å; S196-Q200 WeakPolarHBondContact O-CB 3.36Å; S196-Q200 PolarHBondContact O-N 2.57Å; R197-Q200 PolarHBondContact O-N 3.37Å; Q200-Q202 VanDerWaalsContact C-N 3.3Å; Q200-Q202 PolarHBondContact O-N 2.72Å; Q200-M203 PolarHBondContact O-N 3.36Å; Q200-S204 WeakPolarHBondContact O-CB 3.33Å; Q200-S204 PolarHBondContact O-N 2.86Å; Q200-S204 PolarHBondContact O-OG 3.05Å; Q200-S204 VanDerWaalsContact O-OG 3.05Å
201	E	50.9	Low	48.2	Very low	73 Å²	73	82.5 Å²	82.5	34%	0.341	47%	0.465	S	S	.	.	H	α-helix	trans	-65.4	-31.3	174.5	-78	168.2	-173.7	0	0	112.5	R197 I198 S204 G205 A206 A207	R197-E201 IonicContact NE-OE1 2.83Å; R197-E201 IonicContact NH2-OE1 3.73Å; R197-E201 WeakPolarHBondContact O-CB 3.42Å; R197-E201 WeakPolarHBondContact O-CG 3.37Å; R197-E201 PolarHBondContact O-N 3.08Å; I198-E201 PolarHBondContact O-N 3.22Å; E201-S204 WeakPolarHBondContact CA-OG 3.43Å; E201-S204 PolarHBondContact O-OG 3.44Å; E201-G205 PolarHBondContact O-N 3.09Å; E201-A206 PolarHBondContact O-N 3.42Å; E201-A207 PolarHBondContact O-N 3.46Å
202	Q	46.3	Very low	47.8	Very low	107 Å²	107	85.3 Å²	85.3	50%	0.5	49%	0.49	S	S	.	.	H	α-helix	trans	-78.2	-36.8	176.6	-164.7	176.1	-4.5	0	0	112.1	N114 I198 M199 Q200	N114-Q202 PolarHBondContact ND2-NE2 3.35Å; N114-Q202 PolarHBondContact ND2-OE1 3.48Å; N114-Q202 VanDerWaalsContact ND2-OE1 3.15Å; I198-Q202 VanDerWaalsContact O-CB 3.25Å; I198-Q202 WeakPolarHBondContact O-CB 3.23Å; I198-Q202 PolarHBondContact O-N 3.23Å; M199-Q202 PolarHBondContact O-N 2.99Å; Q200-Q202 VanDerWaalsContact C-N 3.3Å; Q200-Q202 PolarHBondContact O-N 2.72Å
203	M	40.9	Very low	48.5	Very low	177 Å²	177	85.2 Å²	85.2	87%	0.872	48%	0.483	S	S	*	.	H	α-helix	trans	-75.8	-30.2	171.3	-90.6	-165.3	174.4	0	0	113.1	M199 Q200 G205	M199-M203 PolarHBondContact O-N 3.36Å; Q200-M203 PolarHBondContact O-N 3.36Å; M203-G205 PolarHBondContact O-N 3.44Å
204	S	44.6	Very low	49.7	Very low	78 Å²	78	86.9 Å²	86.9	55%	0.545	49%	0.493	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	2.4	179.5	78.4	0	0	0	0	113.3	Q200 E201 A206	Q200-S204 WeakPolarHBondContact O-CB 3.33Å; Q200-S204 PolarHBondContact O-N 2.86Å; Q200-S204 PolarHBondContact O-OG 3.05Å; Q200-S204 VanDerWaalsContact O-OG 3.05Å; E201-S204 WeakPolarHBondContact CA-OG 3.43Å; E201-S204 PolarHBondContact O-OG 3.44Å; S204-A206 PolarHBondContact O-N 3.14Å; S204-A206 WeakPolarHBondContact OG-CB 3.49Å
205	G	39.8	Very low	50.8	Low	47 Å²	47	87.1 Å²	87.1	49%	0.485	49%	0.494	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.9	8.7	-178.4	0	0	0	0	0	114.4	E201 M203 A207 M208	E201-G205 PolarHBondContact O-N 3.09Å; M203-G205 PolarHBondContact O-N 3.44Å; G205-A207 VanDerWaalsContact C-N 3.34Å; G205-A207 PolarHBondContact O-N 2.89Å; G205-M208 PolarHBondContact O-N 3.03Å
206	A	35.6	Very low	52.2	Low	51 Å²	51	92.2 Å²	92.2	42%	0.421	52%	0.516	S	S	.	.	G	3₁₀ helix	trans	-74.6	-24.9	-175.4	0	0	0	0	0	112.4	E201 S204 M208 A209	E201-A206 PolarHBondContact O-N 3.42Å; S204-A206 PolarHBondContact O-N 3.14Å; S204-A206 WeakPolarHBondContact OG-CB 3.49Å; A206-M208 PolarHBondContact O-N 2.87Å; A206-A209 WeakPolarHBondContact O-CB 3.44Å; A206-A209 PolarHBondContact O-N 3.11Å; A206-A209 VanDerWaalsContact O-N 3.16Å
207	A	35	Very low	53.7	Low	73 Å²	73	90.4 Å²	90.4	60%	0.603	50%	0.503	S	S	*	.	G	3₁₀ helix	trans	-70.5	-6.1	173.9	0	0	0	0	0	114.2	E201 G205 A209	E201-A207 PolarHBondContact O-N 3.46Å; G205-A207 VanDerWaalsContact C-N 3.34Å; G205-A207 PolarHBondContact O-N 2.89Å; A207-A209 VanDerWaalsContact C-N 3.33Å
208	M	37.7	Very low	55.3	Low	170 Å²	170	82.9 Å²	82.9	84%	0.837	48%	0.475	S	S	*	.	G	3₁₀ helix	trans	-88.6	6.1	170.4	-84.4	-103.3	-78.8	0	0	113.3	G205 A206 M210	G205-M208 PolarHBondContact O-N 3.03Å; A206-M208 PolarHBondContact O-N 2.87Å; M208-M210 VanDerWaalsContact C-N 3.25Å; M208-M210 PolarHBondContact O-N 3.19Å
209	A	37.8	Very low	57	Low	80 Å²	80	85.8 Å²	85.8	66%	0.661	49%	0.485	S	S	*	.			trans	-82.6	10.7	-175.9	0	0	0	0	0	115	A206 A207 P211	A206-A209 WeakPolarHBondContact O-CB 3.44Å; A206-A209 PolarHBondContact O-N 3.11Å; A206-A209 VanDerWaalsContact O-N 3.16Å; A207-A209 VanDerWaalsContact C-N 3.33Å; A209-P211 WeakPolarHBondContact O-CD 3.44Å
210	M	40.2	Very low	58.8	Low	163 Å²	163	83.5 Å²	83.5	80%	0.803	48%	0.483	S	S	*	.	S	Bend	trans	-95	106.9	158.4	-74.7	-67.7	-80.9	0	0	107.1	M208 A212	M208-M210 VanDerWaalsContact C-N 3.25Å; M208-M210 PolarHBondContact O-N 3.19Å; M210-A212 PolarHBondContact O-N 3.39Å
211	P	44.1	Very low	60.5	Low	73 Å²	73	78 Å²	78	47%	0.474	46%	0.457	S	S	.	.			trans	-59.7	113.4	175.8	-19.4	32	0	0	0	108.1	A209 D213 A217	A209-P211 WeakPolarHBondContact O-CD 3.44Å; P211-D213 PolarHBondContact O-N 3.36Å; P211-A217 HydrophobicContact CB-CB 3.76Å; P211-A217 HydrophobicContact CG-CB 3.7Å
212	A	54.8	Low	62.5	Low	69 Å²	69	76.7 Å²	76.7	57%	0.57	45%	0.449	S	S	*	.	S	Bend	trans	-63.4	-3.8	172.8	0	0	0	0	0	112.3	P98 M210	P98-A212 HydrophobicContact CB-CB 4.42Å; P98-A212 HydrophobicContact CG-CB 3.77Å; M210-A212 PolarHBondContact O-N 3.39Å
213	D	70.3	Confident	64.6	Low	28 Å²	28	76 Å²	76	15%	0.15	45%	0.446	C	S	.	.			trans	-136.5	106.1	178.8	-171.5	-13.9	0	0	0	110	V95 P211 N215 K216 A217	V95-D213 HydrophobicContact CG1-CB 4.14Å; V95-D213 WeakPolarHBondContact CG2-OD1 3.48Å; P211-D213 PolarHBondContact O-N 3.36Å; D213-N215 PolarHBondContact O-N 2.85Å; D213-N215 WeakPolarHBondContact OD1-CB 3.33Å; D213-N215 PolarHBondContact OD1-N 3.48Å; D213-N215 VanDerWaalsContact OD1-N 3.07Å; D213-K216 HydrophobicContact CB-CB 4.13Å; D213-K216 HydrophobicContact CB-CD 3.95Å; D213-K216 HydrophobicContact CB-CG 4Å; D213-K216 PolarHBondContact O-N 3.11Å; D213-K216 VanDerWaalsContact O-N 3.13Å; D213-K216 WeakPolarHBondContact OD2-CE 3.31Å; D213-K216 WeakPolarHBondContact OD2-CG 3.43Å; D213-A217 PolarHBondContact O-N 2.98Å; D213-A217 VanDerWaalsContact O-N 3.11Å
214	T	78.2	Confident	67.1	Low	37 Å²	37	69 Å²	69	23%	0.227	42%	0.416	C	S	.	.	H	α-helix	trans	-59.4	-30.8	178.6	51	0	0	0	0	111.9	R93 V95 A217 F218	R93-T214 WeakPolarHBondContact CB-OG1 3.48Å; V95-T214 WeakPolarHBondContact CG2-OG1 3.43Å; T214-A217 WeakPolarHBondContact O-CB 3.34Å; T214-A217 PolarHBondContact O-N 3.27Å; T214-F218 WeakPolarHBondContact O-CD2 3.16Å; T214-F218 WeakPolarHBondContact O-CG 3.25Å; T214-F218 PolarHBondContact O-N 3.34Å
215	N	83.9	Confident	69.4	Low	49 Å²	49	65.3 Å²	65.3	26%	0.262	39%	0.39	S	S	.	.	H	α-helix	trans	-69.9	-37.1	177.8	-60.1	-51.7	0	0	0	111.8	R93 V95 D213 A217 F218 K219	R93-N215 PolarHBondContact N-OD1 3.22Å; R93-N215 PolarHBondContact O-ND2 3.38Å; R93-N215 PolarHBondContact O-OD1 3.24Å; V95-N215 WeakPolarHBondContact CG2-ND2 3.23Å; D213-N215 PolarHBondContact O-N 2.85Å; D213-N215 WeakPolarHBondContact OD1-CB 3.33Å; D213-N215 PolarHBondContact OD1-N 3.48Å; D213-N215 VanDerWaalsContact OD1-N 3.07Å; N215-A217 VanDerWaalsContact C-N 3.34Å; N215-F218 PolarHBondContact O-N 3.46Å; N215-K219 WeakPolarHBondContact O-CB 3.33Å; N215-K219 PolarHBondContact O-N 2.64Å
216	K	85.6	Confident	71.8	Confident	146 Å²	146	67.4 Å²	67.4	64%	0.635	39%	0.388	S	S	*	.	H	α-helix	trans	-66.4	-39.9	173.3	-70.5	-179.7	-171	175	0	110.9	D213 K219 A220	D213-K216 HydrophobicContact CB-CB 4.13Å; D213-K216 HydrophobicContact CB-CD 3.95Å; D213-K216 HydrophobicContact CB-CG 4Å; D213-K216 PolarHBondContact O-N 3.11Å; D213-K216 VanDerWaalsContact O-N 3.13Å; D213-K216 WeakPolarHBondContact OD2-CE 3.31Å; D213-K216 WeakPolarHBondContact OD2-CG 3.43Å; K216-K219 PolarHBondContact O-N 3.42Å; K216-A220 WeakPolarHBondContact O-CB 3.48Å; K216-A220 PolarHBondContact O-N 3.16Å
217	A	85.1	Confident	74.5	Confident	10 Å²	10	72.1 Å²	72.1	8%	0.083	41%	0.405	C	S	.	.	H	α-helix	trans	-60.5	-46	175	0	0	0	0	0	112	L55 P211 D213 T214 N215 K219 A220 E221	L55-A217 HydrophobicContact CD1-CB 3.91Å; L55-A217 HydrophobicContact CD2-CB 4.39Å; P211-A217 HydrophobicContact CB-CB 3.76Å; P211-A217 HydrophobicContact CG-CB 3.7Å; D213-A217 PolarHBondContact O-N 2.98Å; D213-A217 VanDerWaalsContact O-N 3.11Å; T214-A217 WeakPolarHBondContact O-CB 3.34Å; T214-A217 PolarHBondContact O-N 3.27Å; N215-A217 VanDerWaalsContact C-N 3.34Å; A217-K219 PolarHBondContact O-N 3.26Å; A217-A220 PolarHBondContact O-N 3.28Å; A217-E221 PolarHBondContact O-N 2.89Å
218	F	89.6	Confident	77.1	Confident	2 Å²	2	69.8 Å²	69.8	1%	0.009	38%	0.383	C	S	.	.	H	α-helix	trans	-62.4	-41	176.1	-66	-25.3	0	0	0	112.4	D51 L55 F87 F88 T91 R93 T214 N215 W222	D51-F218 HydrophobicContact CB-CE1 4.35Å; D51-F218 HydrophobicContact CB-CZ 3.88Å; L55-F218 HydrophobicContact CD1-CD1 4.47Å; L55-F218 HydrophobicContact CD1-CE1 4.24Å; L55-F218 HydrophobicContact CD2-CD1 3.75Å; L55-F218 HydrophobicContact CD2-CE1 4.12Å; L55-F218 HydrophobicContact CG-CD1 4.13Å; L55-F218 HydrophobicContact CG-CE1 3.96Å; F87-F218 HydrophobicContact CE1-CE1 4.19Å; F87-F218 HydrophobicContact CE1-CZ 4.1Å; F88-F218 HydrophobicContact CB-CB 4.26Å; F88-F218 HydrophobicContact CD1-CB 3.82Å; F88-F218 AromaticContact CD1-CD1 3.65Å; F88-F218 HydrophobicContact CD1-CD1 3.65Å; F88-F218 HydrophobicContact CD1-CE1 4.46Å; F88-F218 AromaticContact CD1-CG 3.89Å; F88-F218 HydrophobicContact CD1-CG 3.89Å; F88-F218 AromaticContact CE1-CD1 3.82Å; F88-F218 HydrophobicContact CE1-CD1 3.82Å; F88-F218 HydrophobicContact CE1-CE1 4.42Å; F88-F218 HydrophobicContact CG-CB 4.4Å; T91-F218 HydrophobicContact CG2-CE2 4.26Å; R93-F218 HydrophobicContact CG-CE2 4.17Å; T214-F218 WeakPolarHBondContact O-CD2 3.16Å; T214-F218 WeakPolarHBondContact O-CG 3.25Å; T214-F218 PolarHBondContact O-N 3.34Å; N215-F218 PolarHBondContact O-N 3.46Å; F218-W222 VanDerWaalsContact O-CB 3.29Å; F218-W222 WeakPolarHBondContact O-CB 3.48Å; F218-W222 PolarHBondContact O-N 3.08Å
219	K	89.6	Confident	79.7	Confident	128 Å²	128	67.8 Å²	67.8	56%	0.557	38%	0.376	S	S	*	.	H	α-helix	trans	-63.6	-45.2	176.3	-171.7	-179.1	176	-167.9	0	111.6	N215 K216 A217 W222 E223	N215-K219 WeakPolarHBondContact O-CB 3.33Å; N215-K219 PolarHBondContact O-N 2.64Å; K216-K219 PolarHBondContact O-N 3.42Å; A217-K219 PolarHBondContact O-N 3.26Å; K219-W222 PolarHBondContact O-N 3.4Å; K219-E223 WeakPolarHBondContact CE-OE1 3.47Å; K219-E223 IonicContact NZ-OE1 3.93Å; K219-E223 WeakPolarHBondContact O-CG 3.3Å; K219-E223 PolarHBondContact O-N 3.13Å
220	A	90.4	Very high	82.4	Confident	57 Å²	57	65 Å²	65	47%	0.471	35%	0.349	S	S	.	.	H	α-helix	trans	-62.8	-43.8	179.4	0	0	0	0	0	112.2	K216 A217 E223 A224	K216-A220 WeakPolarHBondContact O-CB 3.48Å; K216-A220 PolarHBondContact O-N 3.16Å; A217-A220 PolarHBondContact O-N 3.28Å; A220-E223 PolarHBondContact O-N 3.35Å; A220-A224 WeakPolarHBondContact O-CB 3.4Å; A220-A224 PolarHBondContact O-N 3.37Å
221	E	90.8	Very high	84.9	Confident	19 Å²	19	64 Å²	64	9%	0.089	34%	0.342	C	S	.	.	H	α-helix	trans	-71.8	-31	176	-84.1	-61.2	-178.7	0	0	113.1	L55 R59 R62 F88 A217 A224 L225	L55-E221 HydrophobicContact CD2-CB 4.16Å; L55-E221 HydrophobicContact CD2-CG 3.9Å; R59-E221 IonicContact NE-OE1 3.39Å; R62-E221 IonicContact NE-OE2 3.47Å; R62-E221 PolarHBondContact NE-OE2 3.04Å; R62-E221 IonicContact NH2-OE1 2.73Å; R62-E221 IonicContact NH2-OE2 3.78Å; F88-E221 HydrophobicContact CE2-CB 4.37Å; F88-E221 HydrophobicContact CZ-CB 4.22Å; A217-E221 PolarHBondContact O-N 2.89Å; E221-A224 PolarHBondContact O-N 2.94Å; E221-L225 WeakPolarHBondContact O-CB 3.44Å; E221-L225 PolarHBondContact O-N 3.25Å
222	W	91.6	Very high	87.2	Confident	46 Å²	46	64.7 Å²	64.7	17%	0.174	34%	0.336	C	S	.	.	H	α-helix	trans	-60.8	-48.1	171.9	180	84	0	0	0	111.3	N81 F88 F218 K219 L225 E226	N81-W222 PolarHBondContact ND2-O 3.17Å; N81-W222 PolarHBondContact O-NE1 3.35Å; N81-W222 VanDerWaalsContact OD1-CD1 3.25Å; F88-W222 HydrophobicContact CB-CB 3.98Å; F88-W222 HydrophobicContact CB-CG 4.43Å; F88-W222 HydrophobicContact CD2-CB 4.08Å; F88-W222 HydrophobicContact CG-CB 4.34Å; F218-W222 VanDerWaalsContact O-CB 3.29Å; F218-W222 WeakPolarHBondContact O-CB 3.48Å; F218-W222 PolarHBondContact O-N 3.08Å; K219-W222 PolarHBondContact O-N 3.4Å; W222-L225 PolarHBondContact O-N 2.91Å; W222-E226 WeakPolarHBondContact O-CB 3.42Å; W222-E226 PolarHBondContact O-N 3.44Å
223	E	91.8	Very high	89	Confident	92 Å²	92	63.7 Å²	63.7	43%	0.43	33%	0.328	S	S	.	.	H	α-helix	trans	-62.6	-44.4	177	-68.8	174.1	179.2	0	0	111.5	K219 A220 E226 L227	K219-E223 WeakPolarHBondContact CE-OE1 3.47Å; K219-E223 IonicContact NZ-OE1 3.93Å; K219-E223 WeakPolarHBondContact O-CG 3.3Å; K219-E223 PolarHBondContact O-N 3.13Å; A220-E223 PolarHBondContact O-N 3.35Å; E223-E226 PolarHBondContact O-N 3.46Å; E223-L227 WeakPolarHBondContact O-CG 3.23Å; E223-L227 PolarHBondContact O-N 2.85Å
224	A	92.5	Very high	90	Very high	31 Å²	31	65.6 Å²	65.6	26%	0.256	34%	0.337	S	S	.	.	H	α-helix	trans	-66.3	-41.3	179.2	0	0	0	0	0	112.6	A220 E221 E226 T228	A220-A224 WeakPolarHBondContact O-CB 3.4Å; A220-A224 PolarHBondContact O-N 3.37Å; E221-A224 PolarHBondContact O-N 2.94Å; A224-E226 VanDerWaalsContact C-N 3.31Å; A224-T228 WeakPolarHBondContact O-CG2 3.45Å
225	L	92.3	Very high	90.6	Very high	0 Å²	0	71.3 Å²	71.3	0%	0	36%	0.361	C	S	.	.	H	α-helix	trans	-70.3	-29.9	177.8	-171.7	65.1	0	0	0	111.4	R62 K77 F80 F88 E221 W222 L227 T228	R62-L225 HydrophobicContact CB-CD1 4.1Å; K77-L225 WeakPolarHBondContact CE-O 3.1Å; K77-L225 HydrophobicContact CG-CG 4.33Å; F80-L225 HydrophobicContact CB-CD2 3.65Å; F80-L225 HydrophobicContact CD2-CD2 4.2Å; F80-L225 HydrophobicContact CG-CD2 4.24Å; F88-L225 HydrophobicContact CE2-CD2 4.5Å; E221-L225 WeakPolarHBondContact O-CB 3.44Å; E221-L225 PolarHBondContact O-N 3.25Å; W222-L225 PolarHBondContact O-N 2.91Å; L225-L227 VanDerWaalsContact C-N 3.32Å; L225-L227 PolarHBondContact O-N 3.36Å; L225-T228 PolarHBondContact O-N 2.98Å; L225-T228 PolarHBondContact O-OG1 2.97Å
226	E	91.3	Very high	91	Very high	92 Å²	92	72.1 Å²	72.1	43%	0.43	37%	0.371	S	S	.	.	H	α-helix	trans	-64.5	-39.9	-180	-166.9	62.3	-170.3	0	0	111.8	K77 N81 W222 E223 A224 T228	K77-E226 PolarHBondContact NZ-O 3.36Å; N81-E226 WeakPolarHBondContact CB-OE2 3.42Å; N81-E226 VanDerWaalsContact ND2-CA 3.33Å; N81-E226 WeakPolarHBondContact ND2-CA 3.26Å; N81-E226 PolarHBondContact ND2-N 2.94Å; N81-E226 PolarHBondContact ND2-OE2 2.85Å; W222-E226 WeakPolarHBondContact O-CB 3.42Å; W222-E226 PolarHBondContact O-N 3.44Å; E223-E226 PolarHBondContact O-N 3.46Å; A224-E226 VanDerWaalsContact C-N 3.31Å; E226-T228 PolarHBondContact O-N 3.5Å
227	L	91.2	Very high	91.4	Very high	150 Å²	150	68 Å²	68	79%	0.785	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-2.6	178.8	-63.9	170.8	0	0	0	114.2	E223 L225	E223-L227 WeakPolarHBondContact O-CG 3.23Å; E223-L227 PolarHBondContact O-N 2.85Å; L225-L227 VanDerWaalsContact C-N 3.32Å; L225-L227 PolarHBondContact O-N 3.36Å
228	T	91.3	Very high	91.7	Very high	24 Å²	24	73.2 Å²	73.2	15%	0.147	38%	0.381	C	S	.	.			trans	-93.6	129.5	-172.8	63.7	0	0	0	0	112.6	R62 K77 A224 L225 E226	R62-T228 HydrophobicContact CB-CG2 4.43Å; R62-T228 VanDerWaalsContact CD-CG2 3.44Å; R62-T228 HydrophobicContact CG-CG2 3.44Å; R62-T228 VanDerWaalsContact CG-CG2 3.44Å; K77-T228 PolarHBondContact NZ-O 3.03Å; A224-T228 WeakPolarHBondContact O-CG2 3.45Å; L225-T228 PolarHBondContact O-N 2.98Å; L225-T228 PolarHBondContact O-OG1 2.97Å; E226-T228 PolarHBondContact O-N 3.5Å
229	D	90.8	Very high	91.9	Very high	128 Å²	128	79 Å²	79	68%	0.684	41%	0.412	S	S	*	.			trans	-106.7	146.5	173.6	-72.9	-38.3	0	0	0	111.4	Q231	D229-Q231 PolarHBondContact O-N 2.96Å
230	H	94.9	Very high	92	Very high	22 Å²	22	77.8 Å²	77.8	10%	0.102	41%	0.408	C	S	.	.			trans	-78.7	114.6	177.2	-176.2	-99.5	0	0	0	109.9	G65 I68 K70 F73 W232	G65-H230 PolarHBondContact O-CD2 3.3Å; G65-H230 PolarHBondContact O-NE2 2.96Å; I68-H230 PolarHBondContact O-NE2 3.17Å; K70-H230 WeakPolarHBondContact CB-ND1 3.41Å; K70-H230 HydrophobicContact CG-CB 4.3Å; F73-H230 HydrophobicContact CD1-CB 3.62Å; F73-H230 AromaticContact CD1-CD2 3.99Å; F73-H230 HydrophobicContact CE1-CB 3.97Å; F73-H230 HydrophobicContact CG-CB 4.2Å; F73-H230 AromaticContact CG-CD2 3.64Å; H230-W232 AromaticContact CE1-CE3 3.42Å; H230-W232 VanDerWaalsContact CE1-CE3 3.42Å; H230-W232 AromaticContact NE2-CE3 3.72Å
231	Q	92.1	Very high	92.1	Very high	140 Å²	140	80 Å²	80	65%	0.654	41%	0.412	S	S	*	.			trans	-106.4	111.9	170.6	-61.2	-61.7	-27.5	0	0	107.4	K66 D229 A233	K66-Q231 WeakPolarHBondContact CA-O 3.26Å; K66-Q231 WeakPolarHBondContact CB-O 3.2Å; D229-Q231 PolarHBondContact O-N 2.96Å; Q231-A233 PolarHBondContact O-N 3.06Å
232	W	93.6	Very high	92.2	Very high	88 Å²	88	86.9 Å²	86.9	33%	0.333	45%	0.446	S	S	.	.			trans	-76.9	109.5	-176.2	-174.3	-116.8	0	0	0	109.9	I68 P69 H230 L234 E235	I68-W232 WeakPolarHBondContact O-CZ3 3.37Å; P69-W232 VanDerWaalsContact CA-CZ3 3.48Å; P69-W232 HydrophobicContact CB-CH2 4.36Å; P69-W232 HydrophobicContact CG-CH2 4.08Å; P69-W232 VanDerWaalsContact N-CZ3 3.31Å; H230-W232 AromaticContact CE1-CE3 3.42Å; H230-W232 VanDerWaalsContact CE1-CE3 3.42Å; H230-W232 AromaticContact NE2-CE3 3.72Å; W232-L234 HydrophobicContact CD2-CB 4.45Å; W232-L234 HydrophobicContact CH2-CD1 4.07Å; W232-L234 HydrophobicContact CZ2-CB 4.02Å; W232-L234 HydrophobicContact CZ2-CD1 4.12Å; W232-L234 PolarHBondContact NE1-O 3.12Å; W232-L234 PolarHBondContact O-N 3.49Å; W232-E235 VanDerWaalsContact CD1-N 3.32Å
233	A	92.6	Very high	92.2	Very high	49 Å²	49	88.9 Å²	88.9	41%	0.405	47%	0.467	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-16.8	-176.9	0	0	0	0	0	113.3	K66 Y67 Q231	K66-A233 HydrophobicContact CB-CB 4.28Å; K66-A233 HydrophobicContact CD-CB 4.35Å; K66-A233 HydrophobicContact CG-CB 4.29Å; K66-A233 PolarHBondContact O-N 3.17Å; Y67-A233 HydrophobicContact CD1-CB 4.19Å; Y67-A233 HydrophobicContact CE1-CB 4.12Å; Q231-A233 PolarHBondContact O-N 3.06Å
234	L	91.8	Very high	92.1	Very high	67 Å²	67	93 Å²	93	35%	0.351	48%	0.478	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.3	25	-173.5	-56.2	172.7	0	0	0	112.1	W232 V237	W232-L234 HydrophobicContact CD2-CB 4.45Å; W232-L234 HydrophobicContact CH2-CD1 4.07Å; W232-L234 HydrophobicContact CZ2-CB 4.02Å; W232-L234 HydrophobicContact CZ2-CD1 4.12Å; W232-L234 PolarHBondContact NE1-O 3.12Å; W232-L234 PolarHBondContact O-N 3.49Å; L234-V237 HydrophobicContact CB-CG1 4.26Å
235	E	90.6	Very high	91.8	Very high	157 Å²	157	100.6 Å²	100.6	73%	0.734	51%	0.509	S	S	*	.	S	Bend	trans	-75.6	-34.9	-178.8	-164.7	168	-177.9	0	0	112.8	W232	W232-E235 VanDerWaalsContact CD1-N 3.32Å
236	S	91.3	Very high	91.6	Very high	67 Å²	67	105.5 Å²	105.5	47%	0.469	53%	0.534	S	S	.	.	S	Bend	trans	-112.4	20.2	-176.4	63.1	0	0	0	0	112.7	E238 D239 E240	S236-E238 VanDerWaalsContact C-N 3.33Å; S236-D239 PolarHBondContact O-N 2.94Å; S236-E240 WeakPolarHBondContact O-CB 3.17Å; S236-E240 PolarHBondContact O-N 2.89Å
237	V	93.5	Very high	91.4	Very high	60 Å²	60	107.7 Å²	107.7	36%	0.364	55%	0.549	S	S	.	.	H	α-helix	trans	-70.4	-33.4	-173.4	66.6	0	0	0	0	111.4	L234 L241	L234-V237 HydrophobicContact CB-CG1 4.26Å; V237-L241 VanDerWaalsContact O-CB 3.24Å; V237-L241 WeakPolarHBondContact O-CB 3.3Å; V237-L241 PolarHBondContact O-N 3.18Å
238	E	91.9	Very high	91.2	Very high	119 Å²	119	106.6 Å²	106.6	56%	0.556	54%	0.538	S	S	*	.	H	α-helix	trans	-64.6	-46.8	175.8	-65.5	81.9	176.9	0	0	110.9	S236 L241 M242	S236-E238 VanDerWaalsContact C-N 3.33Å; E238-L241 PolarHBondContact O-N 3.26Å; E238-M242 WeakPolarHBondContact O-CB 3.48Å; E238-M242 WeakPolarHBondContact O-CG 3.3Å; E238-M242 PolarHBondContact O-N 3.29Å
239	D	93.2	Very high	90.7	Very high	122 Å²	122	112.8 Å²	112.8	65%	0.652	57%	0.57	S	S	*	*	H	α-helix	trans	-65.9	-41.7	178.5	-67.2	-30	0	0	0	111.5	S236 L241 M242 S243	S236-D239 PolarHBondContact O-N 2.94Å; D239-L241 PolarHBondContact O-N 3.09Å; D239-M242 PolarHBondContact O-N 3.43Å; D239-S243 WeakPolarHBondContact O-CB 3.42Å; D239-S243 PolarHBondContact O-N 3.29Å
240	E	91.8	Very high	90.1	Very high	103 Å²	103	109.2 Å²	109.2	48%	0.481	56%	0.563	S	S	.	*	H	α-helix	trans	-62.4	-43.2	176.1	-174.2	176.7	-179.2	0	0	111.3	S236 S243	S236-E240 WeakPolarHBondContact O-CB 3.17Å; S236-E240 PolarHBondContact O-N 2.89Å; E240-S243 PolarHBondContact O-N 3.46Å; E240-S243 PolarHBondContact O-OG 2.98Å
241	L	92.4	Very high	89.1	Confident	105 Å²	105	114.4 Å²	114.4	55%	0.55	59%	0.589	S	S	.	*	H	α-helix	trans	-64.8	-43	178.2	-173.9	67	0	0	0	111.6	V237 E238 D239 S243 R244 L246	V237-L241 VanDerWaalsContact O-CB 3.24Å; V237-L241 WeakPolarHBondContact O-CB 3.3Å; V237-L241 PolarHBondContact O-N 3.18Å; E238-L241 PolarHBondContact O-N 3.26Å; D239-L241 PolarHBondContact O-N 3.09Å; L241-S243 VanDerWaalsContact C-N 3.27Å; L241-S243 PolarHBondContact O-N 3.42Å; L241-R244 PolarHBondContact O-N 3.41Å; L241-L246 HydrophobicContact CD1-CD2 3.73Å; L241-L246 HydrophobicContact CG-CD2 4.43Å
242	M	93.2	Very high	88.2	Confident	162 Å²	162	117.1 Å²	117.1	80%	0.798	60%	0.599	S	S	*	*	H	α-helix	trans	-73	-20.1	179.3	-66.3	-62.6	-67.2	0	0	112.9	E238 D239 R244	E238-M242 WeakPolarHBondContact O-CB 3.48Å; E238-M242 WeakPolarHBondContact O-CG 3.3Å; E238-M242 PolarHBondContact O-N 3.29Å; D239-M242 PolarHBondContact O-N 3.43Å; M242-R244 VanDerWaalsContact C-N 3.25Å; M242-R244 PolarHBondContact O-N 2.96Å
243	S	92.8	Very high	86.7	Confident	89 Å²	89	119.6 Å²	119.6	62%	0.622	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.4	-12.8	177.5	77.1	0	0	0	0	114.2	D239 E240 L241	D239-S243 WeakPolarHBondContact O-CB 3.42Å; D239-S243 PolarHBondContact O-N 3.29Å; E240-S243 PolarHBondContact O-N 3.46Å; E240-S243 PolarHBondContact O-OG 2.98Å; L241-S243 VanDerWaalsContact C-N 3.27Å; L241-S243 PolarHBondContact O-N 3.42Å
244	R	89.2	Confident	85.1	Confident	177 Å²	177	126.3 Å²	126.3	67%	0.668	64%	0.639	S	S	*	*	S	Bend	trans	-126.3	147.5	-178.4	-63.8	-177.3	-178.8	164.1	6.7	110.1	L241 M242	L241-R244 PolarHBondContact O-N 3.41Å; M242-R244 VanDerWaalsContact C-N 3.25Å; M242-R244 PolarHBondContact O-N 2.96Å
245	E	86.7	Confident	83.5	Confident	192 Å²	192	131.7 Å²	131.7	90%	0.897	66%	0.663	S	S	*	*			trans	-69.9	145.6	166.5	-67.9	-174.3	171.5	0	0	109.6	D247	E245-D247 PolarHBondContact O-N 2.84Å
246	L	88.3	Confident	81.9	Confident	103 Å²	103	131.6 Å²	131.6	54%	0.539	67%	0.666	S	S	.	*			trans	-70	120.3	176.4	-64.5	175.8	0	0	0	108.9	L241 F248	L241-L246 HydrophobicContact CD1-CD2 3.73Å; L241-L246 HydrophobicContact CG-CD2 4.43Å; L246-F248 HydrophobicContact CB-CD2 3.93Å; L246-F248 HydrophobicContact CB-CE1 4.4Å; L246-F248 HydrophobicContact CB-CE2 3.37Å; L246-F248 HydrophobicContact CB-CZ 3.64Å; L246-F248 HydrophobicContact CD1-CE2 3.83Å; L246-F248 HydrophobicContact CD1-CZ 3.57Å; L246-F248 HydrophobicContact CG-CE2 4.24Å; L246-F248 HydrophobicContact CG-CZ 4.25Å; L246-F248 WeakPolarHBondContact O-CD2 3.39Å; L246-F248 PolarHBondContact O-N 3.07Å; L246-F248 VanDerWaalsContact O-N 3.11Å
247	D	86.7	Confident	80.2	Confident	137 Å²	137	134.3 Å²	134.3	73%	0.733	68%	0.682	S	S	*	*			trans	-74	100.9	175.4	-173.7	3.6	0	0	0	109.9	E245 D249	E245-D247 PolarHBondContact O-N 2.84Å; D247-D249 WeakPolarHBondContact OD1-CB 3.48Å; D247-D249 PolarHBondContact OD1-N 2.89Å
248	F	85.6	Confident	78.3	Confident	127 Å²	127	137.5 Å²	137.5	56%	0.557	71%	0.707	S	S	*	*			trans	-103.5	9.9	173.3	-63.7	-64.9	0	0	0	112.4	L246 G250 M251	L246-F248 HydrophobicContact CB-CD2 3.93Å; L246-F248 HydrophobicContact CB-CE1 4.4Å; L246-F248 HydrophobicContact CB-CE2 3.37Å; L246-F248 HydrophobicContact CB-CZ 3.64Å; L246-F248 HydrophobicContact CD1-CE2 3.83Å; L246-F248 HydrophobicContact CD1-CZ 3.57Å; L246-F248 HydrophobicContact CG-CE2 4.24Å; L246-F248 HydrophobicContact CG-CZ 4.25Å; L246-F248 WeakPolarHBondContact O-CD2 3.39Å; L246-F248 PolarHBondContact O-N 3.07Å; L246-F248 VanDerWaalsContact O-N 3.11Å; F248-G250 PolarHBondContact O-N 2.93Å; F248-M251 HydrophobicContact CD1-SD 4.04Å; F248-M251 VanDerWaalsContact O-CB 3.31Å; F248-M251 WeakPolarHBondContact O-CB 3.47Å; F248-M251 PolarHBondContact O-N 2.85Å; F248-M251 VanDerWaalsContact O-N 3.09Å
249	D	81.8	Confident	76.4	Confident	155 Å²	155	134.9 Å²	134.9	83%	0.829	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63	127.3	179.7	-83.4	-16.9	0	0	0	110.1	D247	D247-D249 WeakPolarHBondContact OD1-CB 3.48Å; D247-D249 PolarHBondContact OD1-N 2.89Å
250	G	77.5	Confident	74.3	Confident	52 Å²	52	136.6 Å²	136.6	54%	0.536	72%	0.719	S	S	.	*	T	Hydrogen-bonded Turn	trans	94.2	-4.1	-175.5	0	0	0	0	0	115.7	F248 F252 N253	F248-G250 PolarHBondContact O-N 2.93Å; G250-F252 PolarHBondContact O-N 2.82Å; G250-N253 PolarHBondContact O-N 3.44Å; G250-N253 VanDerWaalsContact O-N 3.17Å
251	M	73.9	Confident	72	Confident	132 Å²	132	145.3 Å²	145.3	65%	0.65	76%	0.756	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.8	-30	178.9	-162.1	179.1	-158.6	0	0	113.1	F248	F248-M251 HydrophobicContact CD1-SD 4.04Å; F248-M251 VanDerWaalsContact O-CB 3.31Å; F248-M251 WeakPolarHBondContact O-CB 3.47Å; F248-M251 PolarHBondContact O-N 2.85Å; F248-M251 VanDerWaalsContact O-N 3.09Å
252	F	73.4	Confident	71	Confident	196 Å²	196	147.4 Å²	147.4	86%	0.86	77%	0.767	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.8	6.7	179	-61	-75.5	0	0	0	114.3	G250 K254	G250-F252 PolarHBondContact O-N 2.82Å; F252-K254 VanDerWaalsContact C-N 3.29Å; F252-K254 PolarHBondContact O-N 3.42Å
253	N	63.3	Low	69.8	Low	140 Å²	140	146.6 Å²	146.6	75%	0.749	77%	0.765	S	S	*	*			trans	-92.5	23.5	-172.7	-137.1	2.8	0	0	0	113.7	G250 E255	G250-N253 PolarHBondContact O-N 3.44Å; G250-N253 VanDerWaalsContact O-N 3.17Å; N253-E255 PolarHBondContact O-N 3.33Å
254	K	58.8	Low	68.6	Low	191 Å²	191	149.8 Å²	149.8	83%	0.83	77%	0.773	S	S	*	*			trans	-88.3	97	161.7	-87.3	-177.9	175.4	175.3	0	107.6	F252 L256	F252-K254 VanDerWaalsContact C-N 3.29Å; F252-K254 PolarHBondContact O-N 3.42Å; K254-L256 PolarHBondContact O-N 2.88Å
255	E	57.1	Low	67.4	Low	180 Å²	180	148.2 Å²	148.2	84%	0.841	78%	0.779	S	S	*	*			trans	-46.1	114.7	154.2	-69.6	-177.3	160.1	0	0	107.5	N253	N253-E255 PolarHBondContact O-N 3.33Å
256	L	58.4	Low	66.2	Low	155 Å²	155	145.4 Å²	145.4	81%	0.812	77%	0.772	S	S	*	*			trans	-54.1	132	163.6	-81.1	150.9	0	0	0	106.2	K254 S258	K254-L256 PolarHBondContact O-N 2.88Å; L256-S258 PolarHBondContact O-N 3.19Å
257	P	54.4	Low	64.7	Low	124 Å²	124	148.3 Å²	148.3	81%	0.805	79%	0.787	S	S	*	*			trans	-64.8	88.6	173.5	25.9	-31.4	0	0	0	108.6	G259	P257-G259 PolarHBondContact O-N 3.2Å
258	S	53.4	Low	63.1	Low	127 Å²	127	149.1 Å²	149.1	89%	0.888	79%	0.791	S	S	*	*			trans	-75.4	82.4	166.3	55.3	0	0	0	0	107.1	L256	L256-S258 PolarHBondContact O-N 3.19Å
259	G	52.6	Low	61.4	Low	63 Å²	63	150.8 Å²	150.8	65%	0.649	81%	0.809	S	S	*	*			trans	-168.6	50.8	-175.3	0	0	0	0	0	113	P257	P257-G259 PolarHBondContact O-N 3.2Å
260	I	48.9	Very low	59.7	Low	158 Å²	158	150.4 Å²	150.4	81%	0.81	81%	0.807	S	S	*	*			trans	-129.1	81.7	153.1	-53.3	178.1	0	0	0	106.7
261	F	44.3	Very low	58	Low	287 Å²	287	159.4 Å²	159.4	100%	1.259	83%	0.832	S	S	*	*			trans	-142.6	0	148.1	-78.5	-68.4	0	0	0	107.3

Retrieved 261 of 261 residues in 215.2 ms (Link to these results)

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