A0A060YNN9_ONCMY Loading...

Regulator of G protein signaling 13b

AlphaFold DB , UniProt , Accession A0A060YNN9, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene n/a, Length 188 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	37.5	Very low	48.8	Very low	230 Å²	230	129.5 Å²	129.5	100%	1.133	70%	0.704	S	S	*	*				0	91.6	0	-70.6	-66.6	172.9	0	0	109
2	P	43.9	Very low	49.1	Very low	131 Å²	131	130.5 Å²	130.5	85%	0.851	70%	0.701	S	S	*	*			trans	-115.9	96	171.8	34.2	-17.4	0	0	0	109.6
3	S	47.4	Very low	49	Very low	97 Å²	97	126.2 Å²	126.2	68%	0.678	68%	0.682	S	S	*	*			trans	-157.7	103.2	173.5	47.3	0	0	0	0	107
4	L	48.6	Very low	49.2	Very low	146 Å²	146	126 Å²	126	76%	0.764	67%	0.674	S	S	*	*	S	Bend	trans	178.4	-11.1	156.6	-94.9	155.7	0	0	0	114.2	T7	L4-T7 PolarHBondContact O-OG1 3.3Å
5	I	49.2	Very low	49.2	Very low	138 Å²	138	124.8 Å²	124.8	71%	0.708	66%	0.663	S	S	*	*	S	Bend	trans	-84.8	-17.7	-175.5	-58	-166.4	0	0	0	114.3	T7 T9	I5-T7 PolarHBondContact O-N 3.44Å; I5-T9 PolarHBondContact O-OG1 2.77Å
6	I	50.5	Low	49.2	Very low	149 Å²	149	124.1 Å²	124.1	76%	0.764	65%	0.652	S	S	*	*	H	α-helix	trans	-76.8	-23.7	-175	-62.2	172.4	0	0	0	112.6	T9	I6-T9 PolarHBondContact O-OG1 2.72Å
7	T	51.5	Low	49.6	Very low	84 Å²	84	121.4 Å²	121.4	52%	0.515	64%	0.639	S	S	.	*	H	α-helix	trans	-81.1	-32.9	-176	40.5	0	0	0	0	113.5	L4 I5 I11	L4-T7 PolarHBondContact O-OG1 3.3Å; I5-T7 PolarHBondContact O-N 3.44Å; T7-I11 WeakPolarHBondContact O-CD1 3.42Å; T7-I11 VanDerWaalsContact O-CG1 3.3Å; T7-I11 WeakPolarHBondContact O-CG1 3.47Å; T7-I11 PolarHBondContact O-N 3.08Å
8	E	50.4	Low	49.7	Very low	143 Å²	143	121.1 Å²	121.1	67%	0.668	64%	0.635	S	S	*	*	H	α-helix	trans	-69	-43	-176.7	-121.8	173.9	177.8	0	0	112.2	L10 I11 Q12	E8-L10 PolarHBondContact O-N 2.69Å; E8-I11 PolarHBondContact O-N 3.08Å; E8-Q12 WeakPolarHBondContact O-CB 3.41Å; E8-Q12 PolarHBondContact O-N 2.78Å
9	T	51	Low	49.9	Very low	81 Å²	81	118.6 Å²	118.6	50%	0.497	62%	0.62	S	S	.	*	H	α-helix	trans	-66.6	-35.3	178.6	32.6	0	0	0	0	112.6	I5 I6 T13	I5-T9 PolarHBondContact O-OG1 2.77Å; I6-T9 PolarHBondContact O-OG1 2.72Å; T9-T13 WeakPolarHBondContact O-CB 3.37Å; T9-T13 PolarHBondContact O-N 2.69Å; T9-T13 PolarHBondContact O-OG1 3.35Å
10	L	53.2	Low	50	Low	112 Å²	112	116.1 Å²	116.1	59%	0.586	61%	0.605	S	S	*	*	H	α-helix	trans	-70.7	-40.3	178.5	-155.5	82.2	0	0	0	111.9	E8 T13 Q14	E8-L10 PolarHBondContact O-N 2.69Å; L10-T13 PolarHBondContact O-N 3.11Å; L10-Q14 WeakPolarHBondContact O-CB 3.36Å; L10-Q14 WeakPolarHBondContact O-CG 3.42Å; L10-Q14 PolarHBondContact O-N 3.11Å
11	I	54.1	Low	50.2	Low	113 Å²	113	115 Å²	115	58%	0.579	60%	0.6	S	S	*	*	H	α-helix	trans	-66.6	-42.9	176.4	-66.8	168.1	0	0	0	110.5	T7 E8 T13 Q14 H15	T7-I11 WeakPolarHBondContact O-CD1 3.42Å; T7-I11 VanDerWaalsContact O-CG1 3.3Å; T7-I11 WeakPolarHBondContact O-CG1 3.47Å; T7-I11 PolarHBondContact O-N 3.08Å; E8-I11 PolarHBondContact O-N 3.08Å; I11-T13 VanDerWaalsContact C-N 3.33Å; I11-T13 PolarHBondContact O-N 2.98Å; I11-Q14 PolarHBondContact O-N 3.34Å; I11-H15 WeakPolarHBondContact O-CB 3.15Å; I11-H15 PolarHBondContact O-N 3.01Å
12	Q	51.9	Low	51.1	Low	142 Å²	142	108.7 Å²	108.7	66%	0.664	57%	0.57	S	S	*	*	H	α-helix	trans	-64.7	-38.4	177.7	-144.4	168.7	13.4	0	0	111.8	E8 F16	E8-Q12 WeakPolarHBondContact O-CB 3.41Å; E8-Q12 PolarHBondContact O-N 2.78Å; Q12-F16 WeakPolarHBondContact O-CB 3.1Å; Q12-F16 PolarHBondContact O-N 3.48Å
13	T	48.3	Very low	51.6	Low	75 Å²	75	109.2 Å²	109.2	46%	0.46	56%	0.555	S	S	.	*	H	α-helix	trans	-69.3	-39.3	175.7	-53.1	0	0	0	0	111.9	T9 L10 I11 N17	T9-T13 WeakPolarHBondContact O-CB 3.37Å; T9-T13 PolarHBondContact O-N 2.69Å; T9-T13 PolarHBondContact O-OG1 3.35Å; L10-T13 PolarHBondContact O-N 3.11Å; I11-T13 VanDerWaalsContact C-N 3.33Å; I11-T13 PolarHBondContact O-N 2.98Å; T13-N17 WeakPolarHBondContact O-CB 3.4Å; T13-N17 PolarHBondContact O-N 2.95Å; T13-N17 PolarHBondContact O-ND2 2.84Å
14	Q	50.7	Low	52.1	Low	123 Å²	123	111.9 Å²	111.9	58%	0.575	55%	0.551	S	S	*	*	H	α-helix	trans	-66.9	-41.8	175	-77.7	-179.3	-9.9	0	0	112.5	L10 I11 N17 M18	L10-Q14 WeakPolarHBondContact O-CB 3.36Å; L10-Q14 WeakPolarHBondContact O-CG 3.42Å; L10-Q14 PolarHBondContact O-N 3.11Å; I11-Q14 PolarHBondContact O-N 3.34Å; Q14-N17 PolarHBondContact O-N 3.39Å; Q14-M18 WeakPolarHBondContact O-CB 3.19Å; Q14-M18 PolarHBondContact O-N 3.05Å
15	H	49.4	Very low	52.5	Low	108 Å²	108	114.1 Å²	114.1	50%	0.5	55%	0.549	S	S	.	.	H	α-helix	trans	-62.6	-43.5	175.6	-164.5	-83.3	0	0	0	111.6	I11 M18 E19	I11-H15 WeakPolarHBondContact O-CB 3.15Å; I11-H15 PolarHBondContact O-N 3.01Å; H15-M18 PolarHBondContact O-N 3.34Å; H15-E19 IonicContact CE1-OE1 3.14Å; H15-E19 PolarHBondContact CE1-OE1 3.17Å; H15-E19 VanDerWaalsContact CE1-OE1 3.28Å; H15-E19 IonicContact ND1-OE1 2.69Å; H15-E19 PolarHBondContact ND1-OE1 3.09Å; H15-E19 PolarHBondContact O-N 3.46Å; H15-E19 VanDerWaalsContact O-N 3.09Å
16	F	49.1	Very low	52.7	Low	113 Å²	113	110.2 Å²	110.2	50%	0.496	53%	0.53	S	S	.	.	H	α-helix	trans	-65.1	-39.3	176.8	-171.8	-108.5	0	0	0	113	Q12 Q20	Q12-F16 WeakPolarHBondContact O-CB 3.1Å; Q12-F16 PolarHBondContact O-N 3.48Å; F16-Q20 VanDerWaalsContact CZ-NE2 3.27Å; F16-Q20 WeakPolarHBondContact O-CG 3.45Å; F16-Q20 PolarHBondContact O-N 3.32Å; F16-Q20 VanDerWaalsContact O-N 3.12Å
17	N	57	Low	53	Low	78 Å²	78	108.6 Å²	108.6	42%	0.417	52%	0.517	S	S	.	.	H	α-helix	trans	-67.8	-38.6	176.8	-73.8	-19	0	0	0	112.3	T13 Q14 Q20 D21	T13-N17 WeakPolarHBondContact O-CB 3.4Å; T13-N17 PolarHBondContact O-N 2.95Å; T13-N17 PolarHBondContact O-ND2 2.84Å; Q14-N17 PolarHBondContact O-N 3.39Å; N17-Q20 PolarHBondContact O-N 2.95Å; N17-D21 PolarHBondContact O-N 2.88Å
18	M	50.3	Low	53.4	Low	116 Å²	116	109 Å²	109	57%	0.571	52%	0.516	S	S	*	.	H	α-helix	trans	-66.8	-41.9	177.5	-160.9	168.9	59.2	0	0	111.7	Q14 H15 Q20 D21 D22	Q14-M18 WeakPolarHBondContact O-CB 3.19Å; Q14-M18 PolarHBondContact O-N 3.05Å; H15-M18 PolarHBondContact O-N 3.34Å; M18-Q20 VanDerWaalsContact C-N 3.31Å; M18-Q20 PolarHBondContact O-N 3.22Å; M18-D21 PolarHBondContact O-N 3.18Å; M18-D22 PolarHBondContact O-N 3.45Å
19	E	53.3	Low	53.9	Low	74 Å²	74	107.3 Å²	107.3	35%	0.346	51%	0.511	S	S	.	.	H	α-helix	trans	-62.4	-35.4	172.2	-75.3	-171.5	-175.6	0	0	113.2	H15 R23	H15-E19 IonicContact CE1-OE1 3.14Å; H15-E19 PolarHBondContact CE1-OE1 3.17Å; H15-E19 VanDerWaalsContact CE1-OE1 3.28Å; H15-E19 IonicContact ND1-OE1 2.69Å; H15-E19 PolarHBondContact ND1-OE1 3.09Å; H15-E19 PolarHBondContact O-N 3.46Å; H15-E19 VanDerWaalsContact O-N 3.09Å; E19-R23 WeakPolarHBondContact O-CB 3.37Å; E19-R23 WeakPolarHBondContact O-CG 3.49Å; E19-R23 PolarHBondContact O-N 3.18Å; E19-R23 IonicContact OE2-NH2 3.64Å; E19-R23 PolarHBondContact OE2-NH2 3.45Å; E19-R23 VanDerWaalsContact OE2-NH2 3.14Å
20	Q	53.3	Low	54.4	Low	69 Å²	69	103.6 Å²	103.6	32%	0.322	49%	0.489	S	S	.	.	H	α-helix	trans	-70.3	-38.3	176.6	-77	-169.5	14.1	0	0	112.3	F16 N17 M18 R23 R24	F16-Q20 VanDerWaalsContact CZ-NE2 3.27Å; F16-Q20 WeakPolarHBondContact O-CG 3.45Å; F16-Q20 PolarHBondContact O-N 3.32Å; F16-Q20 VanDerWaalsContact O-N 3.12Å; N17-Q20 PolarHBondContact O-N 2.95Å; M18-Q20 VanDerWaalsContact C-N 3.31Å; M18-Q20 PolarHBondContact O-N 3.22Å; Q20-R23 PolarHBondContact O-N 3.47Å; Q20-R24 WeakPolarHBondContact O-CB 3.35Å; Q20-R24 VanDerWaalsContact O-CG 3.27Å; Q20-R24 WeakPolarHBondContact O-CG 3.45Å; Q20-R24 PolarHBondContact O-N 3.29Å
21	D	54	Low	55	Low	94 Å²	94	104.6 Å²	104.6	50%	0.503	49%	0.489	S	S	.	.	H	α-helix	trans	-70.8	-37.9	176.5	-81.6	-17.9	0	0	0	111.8	N17 M18 R24 R25	N17-D21 PolarHBondContact O-N 2.88Å; M18-D21 PolarHBondContact O-N 3.18Å; D21-R24 PolarHBondContact O-N 2.88Å; D21-R25 VanDerWaalsContact O-CB 3.25Å; D21-R25 WeakPolarHBondContact O-CB 3.5Å; D21-R25 PolarHBondContact O-N 3.39Å
22	D	55.1	Low	55.8	Low	96 Å²	96	104.1 Å²	104.1	51%	0.513	49%	0.487	S	S	.	.	H	α-helix	trans	-61.9	-45	170.4	-78.2	-26.5	0	0	0	111.2	M18 R24 R25 N26	M18-D22 PolarHBondContact O-N 3.45Å; D22-R24 VanDerWaalsContact C-N 3.34Å; D22-R24 PolarHBondContact O-N 3.43Å; D22-R25 PolarHBondContact O-N 3.03Å; D22-N26 WeakPolarHBondContact O-CB 3.43Å; D22-N26 PolarHBondContact O-N 3.49Å
23	R	54.9	Low	56.9	Low	142 Å²	142	98.5 Å²	98.5	54%	0.536	46%	0.461	S	S	.	.	H	α-helix	trans	-61.5	-39.3	173.6	-74	179	-144	-156.9	8.5	112.3	E19 Q20 K27	E19-R23 WeakPolarHBondContact O-CB 3.37Å; E19-R23 WeakPolarHBondContact O-CG 3.49Å; E19-R23 PolarHBondContact O-N 3.18Å; E19-R23 IonicContact OE2-NH2 3.64Å; E19-R23 PolarHBondContact OE2-NH2 3.45Å; E19-R23 VanDerWaalsContact OE2-NH2 3.14Å; Q20-R23 PolarHBondContact O-N 3.47Å; R23-K27 WeakPolarHBondContact O-CB 3.43Å; R23-K27 WeakPolarHBondContact O-CG 3.38Å; R23-K27 PolarHBondContact O-N 3Å
24	R	57.8	Low	58	Low	153 Å²	153	95.3 Å²	95.3	58%	0.577	44%	0.441	S	S	*	.	H	α-helix	trans	-67.7	-41.5	176.4	-78.3	172.7	176.4	-175.6	0.2	111.6	Q20 D21 D22 K27 N28	Q20-R24 WeakPolarHBondContact O-CB 3.35Å; Q20-R24 VanDerWaalsContact O-CG 3.27Å; Q20-R24 WeakPolarHBondContact O-CG 3.45Å; Q20-R24 PolarHBondContact O-N 3.29Å; D21-R24 PolarHBondContact O-N 2.88Å; D22-R24 VanDerWaalsContact C-N 3.34Å; D22-R24 PolarHBondContact O-N 3.43Å; R24-K27 PolarHBondContact O-N 3.15Å; R24-N28 PolarHBondContact O-N 3.45Å
25	R	57.4	Low	59	Low	193 Å²	193	93.2 Å²	93.2	73%	0.728	44%	0.439	S	S	*	.	H	α-helix	trans	-67.2	-41	177.7	-160	173.5	-173.4	178.9	1.1	111.2	D21 D22 N28 L29	D21-R25 VanDerWaalsContact O-CB 3.25Å; D21-R25 WeakPolarHBondContact O-CB 3.5Å; D21-R25 PolarHBondContact O-N 3.39Å; D22-R25 PolarHBondContact O-N 3.03Å; R25-N28 PolarHBondContact O-N 3.34Å; R25-L29 PolarHBondContact O-N 2.98Å
26	N	53.3	Low	60.1	Low	57 Å²	57	97 Å²	97	31%	0.305	45%	0.449	S	S	.	.	H	α-helix	trans	-69.8	-36.1	174.4	-109.1	-9.8	0	0	0	113.1	D22 N28 L29 G30 D172	D22-N26 WeakPolarHBondContact O-CB 3.43Å; D22-N26 PolarHBondContact O-N 3.49Å; N26-N28 VanDerWaalsContact C-N 3.31Å; N26-N28 PolarHBondContact O-N 3.21Å; N26-L29 WeakPolarHBondContact O-CB 3.2Å; N26-L29 PolarHBondContact O-N 3.37Å; N26-G30 PolarHBondContact O-N 3.47Å; N26-D172 HydrophobicContact CB-CB 3.92Å; N26-D172 WeakPolarHBondContact ND2-CB 3.38Å; N26-D172 PolarHBondContact ND2-OD2 3.15Å
27	K	57.6	Low	61.3	Low	114 Å²	114	91.6 Å²	91.6	50%	0.496	43%	0.425	S	S	.	.	H	α-helix	trans	-60.4	-40.3	170.1	-79.7	175.9	-179.6	-171.4	0	112.2	R23 R24 G30 K31	R23-K27 WeakPolarHBondContact O-CB 3.43Å; R23-K27 WeakPolarHBondContact O-CG 3.38Å; R23-K27 PolarHBondContact O-N 3Å; R24-K27 PolarHBondContact O-N 3.15Å; K27-G30 PolarHBondContact O-N 3.39Å; K27-K31 WeakPolarHBondContact O-CG 3.47Å; K27-K31 PolarHBondContact O-N 3.42Å
28	N	59.7	Low	62.1	Low	93 Å²	93	91 Å²	91	50%	0.497	42%	0.42	S	S	.	.	H	α-helix	trans	-70.2	-36	175.2	-73.2	-17.7	0	0	0	112.2	R24 R25 N26 K31 N32	R24-N28 PolarHBondContact O-N 3.45Å; R25-N28 PolarHBondContact O-N 3.34Å; N26-N28 VanDerWaalsContact C-N 3.31Å; N26-N28 PolarHBondContact O-N 3.21Å; N28-K31 PolarHBondContact O-N 3.02Å; N28-N32 WeakPolarHBondContact O-CB 3.34Å; N28-N32 VanDerWaalsContact O-CG 3.29Å; N28-N32 PolarHBondContact O-N 3.37Å; N28-N32 PolarHBondContact O-ND2 2.94Å; N28-N32 VanDerWaalsContact O-ND2 3.15Å
29	L	60.9	Low	63.2	Low	107 Å²	107	89.4 Å²	89.4	56%	0.56	42%	0.419	S	S	*	.	H	α-helix	trans	-62.1	-44.9	172.7	-172.4	64.1	0	0	0	111	R25 N26 N32 F33	R25-L29 PolarHBondContact O-N 2.98Å; N26-L29 WeakPolarHBondContact O-CB 3.2Å; N26-L29 PolarHBondContact O-N 3.37Å; L29-N32 PolarHBondContact O-N 3.02Å; L29-F33 WeakPolarHBondContact O-CB 3.49Å; L29-F33 PolarHBondContact O-N 3.32Å
30	G	61.7	Low	64	Low	4 Å²	4	91.5 Å²	91.5	4%	0.041	43%	0.431	C	S	.	.	H	α-helix	trans	-60.5	-44.8	175.5	0	0	0	0	0	113	N26 K27 F33 M34	N26-G30 PolarHBondContact O-N 3.47Å; K27-G30 PolarHBondContact O-N 3.39Å; G30-F33 PolarHBondContact O-N 3.47Å; G30-M34 WeakPolarHBondContact O-CB 3.39Å; G30-M34 VanDerWaalsContact O-CG 3.28Å; G30-M34 WeakPolarHBondContact O-CG 3.44Å; G30-M34 PolarHBondContact O-N 3.22Å
31	K	64.8	Low	64.8	Low	132 Å²	132	90.6 Å²	90.6	57%	0.574	43%	0.426	S	S	*	.	H	α-helix	trans	-63.5	-45.7	175.6	-74.3	179.2	179.1	-179.5	0	112.9	K27 N28 F33 M34 C35	K27-K31 WeakPolarHBondContact O-CG 3.47Å; K27-K31 PolarHBondContact O-N 3.42Å; N28-K31 PolarHBondContact O-N 3.02Å; K31-F33 VanDerWaalsContact C-N 3.32Å; K31-F33 PolarHBondContact O-N 3.03Å; K31-M34 PolarHBondContact O-N 3.3Å; K31-C35 PolarHBondContact O-N 3.27Å
32	N	71.9	Confident	65.2	Low	103 Å²	103	90.3 Å²	90.3	55%	0.551	43%	0.431	S	S	*	.	H	α-helix	trans	-64.7	-39.2	177.2	-74	-32.1	0	0	0	111.7	N28 L29 M34 R36	N28-N32 WeakPolarHBondContact O-CB 3.34Å; N28-N32 VanDerWaalsContact O-CG 3.29Å; N28-N32 PolarHBondContact O-N 3.37Å; N28-N32 PolarHBondContact O-ND2 2.94Å; N28-N32 VanDerWaalsContact O-ND2 3.15Å; L29-N32 PolarHBondContact O-N 3.02Å; N32-M34 VanDerWaalsContact C-N 3.34Å; N32-R36 WeakPolarHBondContact O-CG 3.47Å; N32-R36 PolarHBondContact O-N 3.45Å
33	F	74.8	Confident	65.2	Low	25 Å²	25	94 Å²	94	11%	0.11	45%	0.445	C	S	.	.	H	α-helix	trans	-62.2	-42.6	173.6	176.5	-100.6	0	0	0	111.1	L29 G30 K31 R36 L37 T75 T78 I173	L29-F33 WeakPolarHBondContact O-CB 3.49Å; L29-F33 PolarHBondContact O-N 3.32Å; G30-F33 PolarHBondContact O-N 3.47Å; K31-F33 VanDerWaalsContact C-N 3.32Å; K31-F33 PolarHBondContact O-N 3.03Å; F33-R36 WeakPolarHBondContact O-CB 3.15Å; F33-R36 PolarHBondContact O-N 2.87Å; F33-L37 HydrophobicContact CE1-CB 4.35Å; F33-L37 HydrophobicContact CE1-CD1 4.41Å; F33-L37 HydrophobicContact CE1-CD2 3.93Å; F33-L37 HydrophobicContact CE1-CG 4.47Å; F33-L37 HydrophobicContact CZ-CB 4.48Å; F33-L37 HydrophobicContact CZ-CD1 3.99Å; F33-L37 HydrophobicContact CZ-CD2 4.33Å; F33-L37 WeakPolarHBondContact O-CB 3.44Å; F33-L37 PolarHBondContact O-N 3.42Å; F33-T75 HydrophobicContact CE1-CG2 3.77Å; F33-T75 HydrophobicContact CZ-CG2 4.11Å; F33-T78 HydrophobicContact CD2-CG2 4.08Å; F33-T78 HydrophobicContact CE2-CG2 3.68Å; F33-T78 WeakPolarHBondContact CE2-OG1 3.42Å; F33-T78 HydrophobicContact CZ-CG2 4.47Å; F33-I173 HydrophobicContact CD1-CD1 3.81Å; F33-I173 HydrophobicContact CD1-CG1 3.8Å; F33-I173 HydrophobicContact CD2-CD1 4.1Å; F33-I173 HydrophobicContact CE1-CD1 3.74Å; F33-I173 HydrophobicContact CE1-CG1 3.96Å; F33-I173 HydrophobicContact CE2-CD1 4.04Å; F33-I173 HydrophobicContact CG-CD1 4Å; F33-I173 HydrophobicContact CG-CG1 4.3Å; F33-I173 HydrophobicContact CZ-CD1 3.86Å
34	M	72	Confident	64.9	Low	7 Å²	7	89.6 Å²	89.6	3%	0.034	44%	0.436	C	S	.	.	H	α-helix	trans	-64	-45.8	178.9	-81.7	-58.3	-74.8	0	0	114.2	G30 K31 N32 R36 L37 Q38 L51 L177 L181	G30-M34 WeakPolarHBondContact O-CB 3.39Å; G30-M34 VanDerWaalsContact O-CG 3.28Å; G30-M34 WeakPolarHBondContact O-CG 3.44Å; G30-M34 PolarHBondContact O-N 3.22Å; K31-M34 PolarHBondContact O-N 3.3Å; N32-M34 VanDerWaalsContact C-N 3.34Å; M34-R36 VanDerWaalsContact C-N 3.26Å; M34-R36 PolarHBondContact O-N 3.02Å; M34-L37 PolarHBondContact O-N 3.28Å; M34-L37 HydrophobicContact SD-CD2 4.14Å; M34-Q38 WeakPolarHBondContact O-CB 3.41Å; M34-Q38 WeakPolarHBondContact O-CG 3.35Å; M34-Q38 PolarHBondContact O-N 2.91Å; M34-L51 HydrophobicContact CE-CD2 4.27Å; M34-L177 HydrophobicContact CE-CD1 3.26Å; M34-L177 HydrophobicContact CG-CD1 4.29Å; M34-L177 HydrophobicContact SD-CB 4.36Å; M34-L177 HydrophobicContact SD-CD1 3.12Å; M34-L177 WeakPolarHBondContact SD-CD1 3.47Å; M34-L177 HydrophobicContact SD-CG 4.25Å; M34-L181 HydrophobicContact CE-CD2 4.46Å
35	C	70.3	Confident	64.3	Low	80 Å²	80	88.8 Å²	88.8	54%	0.541	45%	0.45	S	S	.	.	H	α-helix	trans	-57.9	-43.1	173.2	-78.8	0	0	0	0	111	K31 C39	K31-C35 PolarHBondContact O-N 3.27Å; C35-C39 WeakPolarHBondContact O-CB 3.49Å; C35-C39 PolarHBondContact O-N 2.96Å; C35-C39 PolarHBondContact O-SG 2.69Å
36	R	73.3	Confident	63.7	Low	186 Å²	186	83 Å²	83	70%	0.702	44%	0.437	S	S	*	.	H	α-helix	trans	-63.7	-44.2	176.3	-71.2	177.5	-177.1	-159.6	1.1	112	N32 F33 M34 C39 M40	N32-R36 WeakPolarHBondContact O-CG 3.47Å; N32-R36 PolarHBondContact O-N 3.45Å; F33-R36 WeakPolarHBondContact O-CB 3.15Å; F33-R36 PolarHBondContact O-N 2.87Å; M34-R36 VanDerWaalsContact C-N 3.26Å; M34-R36 PolarHBondContact O-N 3.02Å; R36-C39 PolarHBondContact O-N 3.16Å; R36-M40 VanDerWaalsContact O-CG 3.31Å; R36-M40 WeakPolarHBondContact O-CG 3.29Å; R36-M40 PolarHBondContact O-N 2.85Å
37	L	75.1	Confident	63.3	Low	0 Å²	0	86.8 Å²	86.8	0%	0	47%	0.467	C	S	.	.	H	α-helix	trans	-61.8	-46.6	179.8	-167.3	71.2	0	0	0	111	F33 M34 M40 F41 L51 Y71 A74	F33-L37 HydrophobicContact CE1-CB 4.35Å; F33-L37 HydrophobicContact CE1-CD1 4.41Å; F33-L37 HydrophobicContact CE1-CD2 3.93Å; F33-L37 HydrophobicContact CE1-CG 4.47Å; F33-L37 HydrophobicContact CZ-CB 4.48Å; F33-L37 HydrophobicContact CZ-CD1 3.99Å; F33-L37 HydrophobicContact CZ-CD2 4.33Å; F33-L37 WeakPolarHBondContact O-CB 3.44Å; F33-L37 PolarHBondContact O-N 3.42Å; M34-L37 PolarHBondContact O-N 3.28Å; M34-L37 HydrophobicContact SD-CD2 4.14Å; L37-M40 HydrophobicContact CB-CE 4.46Å; L37-M40 HydrophobicContact CD1-CE 3.68Å; L37-M40 PolarHBondContact O-N 3.46Å; L37-F41 HydrophobicContact CD1-CD2 4.39Å; L37-F41 HydrophobicContact CD1-CE2 3.79Å; L37-F41 HydrophobicContact CG-CD2 4.46Å; L37-F41 HydrophobicContact CG-CE2 4.3Å; L37-F41 WeakPolarHBondContact O-CD2 3.38Å; L37-F41 PolarHBondContact O-N 2.94Å; L37-L51 HydrophobicContact CD2-CD2 4.43Å; L37-Y71 HydrophobicContact CD1-CD1 4.47Å; L37-Y71 HydrophobicContact CD2-CD1 3.81Å; L37-Y71 HydrophobicContact CG-CD1 3.8Å; L37-Y71 HydrophobicContact CG-CE1 4.37Å; L37-A74 HydrophobicContact CD1-CB 3.73Å
38	Q	73.8	Confident	62.9	Low	65 Å²	65	87 Å²	87	30%	0.304	47%	0.47	S	S	.	.	H	α-helix	trans	-63.4	-44.4	175.9	-72	175.4	-1	0	0	111.8	M34 M40 F41 S42	M34-Q38 WeakPolarHBondContact O-CB 3.41Å; M34-Q38 WeakPolarHBondContact O-CG 3.35Å; M34-Q38 PolarHBondContact O-N 2.91Å; Q38-M40 VanDerWaalsContact C-N 3.33Å; Q38-M40 PolarHBondContact O-N 3.06Å; Q38-F41 PolarHBondContact O-N 3.24Å; Q38-S42 PolarHBondContact O-N 3.16Å; Q38-S42 PolarHBondContact O-OG 2.89Å
39	C	72.1	Confident	62.8	Low	84 Å²	84	86.6 Å²	86.6	57%	0.568	48%	0.475	S	S	*	.	H	α-helix	trans	-61.3	-38.6	176.1	-72	0	0	0	0	112.8	C35 R36 F41 S42	C35-C39 WeakPolarHBondContact O-CB 3.49Å; C35-C39 PolarHBondContact O-N 2.96Å; C35-C39 PolarHBondContact O-SG 2.69Å; R36-C39 PolarHBondContact O-N 3.16Å; C39-F41 PolarHBondContact O-N 2.81Å; C39-S42 PolarHBondContact O-N 2.97Å
40	M	71.4	Confident	63.3	Low	118 Å²	118	91.2 Å²	91.2	58%	0.581	48%	0.484	S	S	*	.	H	α-helix	trans	-60	-30	177.6	-78.6	-169.6	-60	0	0	112.8	R36 L37 Q38	R36-M40 VanDerWaalsContact O-CG 3.31Å; R36-M40 WeakPolarHBondContact O-CG 3.29Å; R36-M40 PolarHBondContact O-N 2.85Å; L37-M40 HydrophobicContact CB-CE 4.46Å; L37-M40 HydrophobicContact CD1-CE 3.68Å; L37-M40 PolarHBondContact O-N 3.46Å; Q38-M40 VanDerWaalsContact C-N 3.33Å; Q38-M40 PolarHBondContact O-N 3.06Å
41	F	69.9	Low	64.2	Low	50 Å²	50	91.7 Å²	91.7	22%	0.219	49%	0.486	C	S	.	.	H	α-helix	trans	-108.7	-1.9	-177.2	-62.8	-67.7	0	0	0	114.4	L37 Q38 C39 H43 S44 K70 Y71 A74	L37-F41 HydrophobicContact CD1-CD2 4.39Å; L37-F41 HydrophobicContact CD1-CE2 3.79Å; L37-F41 HydrophobicContact CG-CD2 4.46Å; L37-F41 HydrophobicContact CG-CE2 4.3Å; L37-F41 WeakPolarHBondContact O-CD2 3.38Å; L37-F41 PolarHBondContact O-N 2.94Å; Q38-F41 PolarHBondContact O-N 3.24Å; C39-F41 PolarHBondContact O-N 2.81Å; F41-H43 PolarHBondContact O-N 3.42Å; F41-H43 VanDerWaalsContact O-N 3.17Å; F41-S44 PolarHBondContact O-N 2.93Å; F41-S44 PolarHBondContact O-OG 2.9Å; F41-K70 HydrophobicContact CE1-CB 4.1Å; F41-K70 HydrophobicContact CZ-CB 4.26Å; F41-Y71 HydrophobicContact CB-CE1 3.95Å; F41-Y71 WeakPolarHBondContact CB-OH 3.34Å; F41-Y71 AromaticContact CD2-CD1 3.6Å; F41-Y71 HydrophobicContact CD2-CD1 3.6Å; F41-Y71 AromaticContact CD2-CE1 3.32Å; F41-Y71 HydrophobicContact CD2-CE1 3.32Å; F41-Y71 HydrophobicContact CD2-CG 4.34Å; F41-Y71 AromaticContact CD2-CZ 3.87Å; F41-Y71 AromaticContact CE2-CD1 3.9Å; F41-Y71 HydrophobicContact CE2-CD1 3.9Å; F41-Y71 HydrophobicContact CE2-CE1 4.11Å; F41-Y71 HydrophobicContact CE2-CG 4.42Å; F41-Y71 HydrophobicContact CG-CD1 4.5Å; F41-Y71 AromaticContact CG-CE1 3.93Å; F41-Y71 HydrophobicContact CG-CE1 3.93Å; F41-A74 HydrophobicContact CE2-CB 4.14Å; F41-A74 HydrophobicContact CZ-CB 4.07Å
42	S	61.7	Low	65.1	Low	87 Å²	87	87.3 Å²	87.3	61%	0.608	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-13.5	-178.8	-65.1	0	0	0	0	115	Q38 C39	Q38-S42 PolarHBondContact O-N 3.16Å; Q38-S42 PolarHBondContact O-OG 2.89Å; C39-S42 PolarHBondContact O-N 2.97Å
43	H	55.5	Low	65.8	Low	174 Å²	174	84.7 Å²	84.7	81%	0.806	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.3	10.4	-176.9	-64.7	85.4	0	0	0	113.6	F41	F41-H43 PolarHBondContact O-N 3.42Å; F41-H43 VanDerWaalsContact O-N 3.17Å
44	S	48.7	Very low	66.4	Low	50 Å²	50	89.9 Å²	89.9	35%	0.35	48%	0.482	S	S	.	.			trans	-75.4	128.1	176.1	65.1	0	0	0	0	110.8	F41 T46	F41-S44 PolarHBondContact O-N 2.93Å; F41-S44 PolarHBondContact O-OG 2.9Å; S44-T46 PolarHBondContact O-N 3.27Å; S44-T46 VanDerWaalsContact O-N 3.08Å
45	P	45.5	Very low	67	Low	136 Å²	136	93 Å²	93	88%	0.883	50%	0.499	S	S	*	.	S	Bend	trans	-72.6	2.3	-178.3	29.7	-34.7	0	0	0	113.9
46	T	44.4	Very low	68	Low	72 Å²	72	89.2 Å²	89.2	44%	0.442	47%	0.474	S	S	.	.	S	Bend	trans	-95	127.3	175.5	46.9	0	0	0	0	109.3	S44 E48	S44-T46 PolarHBondContact O-N 3.27Å; S44-T46 VanDerWaalsContact O-N 3.08Å; T46-E48 PolarHBondContact O-N 2.85Å
47	S	44	Very low	68.9	Low	135 Å²	135	84.9 Å²	84.9	94%	0.944	46%	0.461	S	S	*	.			trans	-62.2	40.7	171.4	-64.9	0	0	0	0	114.1	S49	S47-S49 PolarHBondContact O-N 3.35Å
48	E	48.8	Very low	69.8	Low	120 Å²	120	88.6 Å²	88.6	56%	0.561	48%	0.479	S	S	*	.			trans	-76.4	113.9	166.7	-85.9	175.2	-176.1	0	0	107.6	T46 K70	T46-E48 PolarHBondContact O-N 2.85Å; E48-K70 IonicContact OE1-NZ 3.88Å; E48-K70 IonicContact OE2-NZ 3.26Å; E48-K70 PolarHBondContact OE2-NZ 2.87Å
49	S	57.4	Low	70.9	Confident	84 Å²	84	85.7 Å²	85.7	59%	0.587	47%	0.465	S	S	*	.			trans	-45.9	147.6	-175.7	43.2	0	0	0	0	113.1	S47 L51	S47-S49 PolarHBondContact O-N 3.35Å; S49-L51 PolarHBondContact O-N 3.31Å
50	R	72.7	Confident	72	Confident	203 Å²	203	84.3 Å²	84.3	77%	0.766	46%	0.456	S	S	*	.	S	Bend	trans	-40	136.3	162.2	-68.2	172.6	63.6	170.4	-1.3	109.3	S52	R50-S52 PolarHBondContact O-N 2.6Å; R50-S52 VanDerWaalsContact O-N 3.12Å
51	L	80.1	Confident	73.2	Confident	14 Å²	14	85 Å²	85	7%	0.073	46%	0.458	C	S	.	.			trans	-48.7	120.8	178.3	-178.9	62	0	0	0	110.3	M34 L37 S49 T56 W59 Y71 L177 L181	M34-L51 HydrophobicContact CE-CD2 4.27Å; L37-L51 HydrophobicContact CD2-CD2 4.43Å; S49-L51 PolarHBondContact O-N 3.31Å; L51-T56 WeakPolarHBondContact CD1-OG1 3.31Å; L51-W59 HydrophobicContact CD1-CH2 4.23Å; L51-W59 HydrophobicContact CD1-CZ2 3.72Å; L51-W59 HydrophobicContact CD2-CH2 4.2Å; L51-Y71 HydrophobicContact CB-CD1 4.17Å; L51-Y71 HydrophobicContact CB-CD2 4.27Å; L51-Y71 HydrophobicContact CB-CE1 4.16Å; L51-Y71 HydrophobicContact CB-CE2 4.27Å; L51-Y71 HydrophobicContact CB-CG 4.23Å; L51-Y71 HydrophobicContact CD1-CD1 4.48Å; L51-Y71 HydrophobicContact CD1-CD2 3.94Å; L51-Y71 HydrophobicContact CD1-CG 3.84Å; L51-Y71 HydrophobicContact CD2-CD1 4.03Å; L51-Y71 HydrophobicContact CD2-CG 4.13Å; L51-Y71 HydrophobicContact CG-CD1 4.47Å; L51-Y71 HydrophobicContact CG-CG 4.3Å; L51-L177 HydrophobicContact CD2-CD1 3.6Å; L51-L177 HydrophobicContact CD2-CD2 4.46Å; L51-L181 HydrophobicContact CD2-CD1 4.27Å; L51-L181 HydrophobicContact CG-CD1 4.12Å; L51-L181 WeakPolarHBondContact O-CD2 3.49Å
52	S	84.5	Confident	74.6	Confident	40 Å²	40	84.1 Å²	84.1	28%	0.28	46%	0.458	S	S	.	.			trans	-98.4	159.2	-179.9	79.1	0	0	0	0	111.7	R50 E54 D55 T56	R50-S52 PolarHBondContact O-N 2.6Å; R50-S52 VanDerWaalsContact O-N 3.12Å; S52-E54 VanDerWaalsContact C-N 3.31Å; S52-D55 WeakPolarHBondContact CB-OD2 3.24Å; S52-D55 WeakPolarHBondContact OG-CB 3.41Å; S52-D55 PolarHBondContact OG-N 2.78Å; S52-D55 PolarHBondContact OG-OD2 3.29Å; S52-T56 PolarHBondContact O-N 3.13Å; S52-T56 PolarHBondContact O-OG1 2.79Å
53	L	86.4	Confident	76.3	Confident	48 Å²	48	80 Å²	80	25%	0.251	43%	0.429	S	S	.	.	H	α-helix	trans	-61.3	-43.2	174.2	179.9	63.1	0	0	0	111	T56 Q57 L178 L181 A182	L53-T56 PolarHBondContact O-N 3.01Å; L53-Q57 WeakPolarHBondContact O-CG 3.38Å; L53-Q57 PolarHBondContact O-N 3.24Å; L53-L178 HydrophobicContact CD1-CD2 3.76Å; L53-L181 HydrophobicContact CB-CB 4.09Å; L53-L181 HydrophobicContact CD1-CB 4.03Å; L53-A182 HydrophobicContact CD1-CB 4.47Å; L53-A182 HydrophobicContact CD2-CB 4.11Å
54	E	85.7	Confident	78.3	Confident	135 Å²	135	77.2 Å²	77.2	63%	0.631	42%	0.417	S	S	*	.	H	α-helix	trans	-62.1	-46.9	-179.5	-174.1	173	-172.9	0	0	111.5	S52 T56 Q57 Q58	S52-E54 VanDerWaalsContact C-N 3.31Å; E54-T56 PolarHBondContact O-N 3.38Å; E54-Q57 WeakPolarHBondContact O-CB 3.3Å; E54-Q57 PolarHBondContact O-N 2.64Å; E54-Q57 VanDerWaalsContact O-N 3.16Å; E54-Q58 PolarHBondContact O-N 3.26Å
55	D	86.3	Confident	80.5	Confident	73 Å²	73	81 Å²	81	39%	0.39	42%	0.423	S	S	.	.	H	α-helix	trans	-58.7	-39.5	176	-66.8	-41.6	0	0	0	111.7	S52 Q58 W59	S52-D55 WeakPolarHBondContact CB-OD2 3.24Å; S52-D55 WeakPolarHBondContact OG-CB 3.41Å; S52-D55 PolarHBondContact OG-N 2.78Å; S52-D55 PolarHBondContact OG-OD2 3.29Å; D55-Q58 WeakPolarHBondContact O-CB 3.48Å; D55-Q58 PolarHBondContact O-N 3.29Å; D55-W59 PolarHBondContact O-NE1 3Å; D55-W59 VanDerWaalsContact O-NE1 3.15Å
56	T	90.3	Very high	83	Confident	0 Å²	0	74.5 Å²	74.5	0%	0	38%	0.381	C	S	.	.	H	α-helix	trans	-71	-33	-179.2	-54.6	0	0	0	0	111.9	L51 S52 L53 E54 Q58 W59 Y174 L177 L178 L181	L51-T56 WeakPolarHBondContact CD1-OG1 3.31Å; S52-T56 PolarHBondContact O-N 3.13Å; S52-T56 PolarHBondContact O-OG1 2.79Å; L53-T56 PolarHBondContact O-N 3.01Å; E54-T56 PolarHBondContact O-N 3.38Å; T56-Q58 VanDerWaalsContact C-N 3.3Å; T56-W59 HydrophobicContact CG2-CD2 4.29Å; T56-W59 HydrophobicContact CG2-CE3 4.02Å; T56-W59 HydrophobicContact CG2-CH2 4.23Å; T56-W59 HydrophobicContact CG2-CZ2 4.48Å; T56-W59 HydrophobicContact CG2-CZ3 4.01Å; T56-W59 WeakPolarHBondContact O-CB 3.48Å; T56-W59 PolarHBondContact O-N 3.46Å; T56-Y174 HydrophobicContact CG2-CD2 4.45Å; T56-Y174 HydrophobicContact CG2-CE2 3.78Å; T56-Y174 PolarHBondContact O-OH 2.96Å; T56-L177 HydrophobicContact CG2-CD2 3.51Å; T56-L177 HydrophobicContact CG2-CG 3.82Å; T56-L178 HydrophobicContact CG2-CD2 3.56Å; T56-L178 HydrophobicContact CG2-CG 4.17Å; T56-L181 HydrophobicContact CG2-CD1 4.37Å; T56-L181 WeakPolarHBondContact OG1-CD1 3.26Å
57	Q	92.6	Very high	85.4	Confident	94 Å²	94	71.8 Å²	71.8	44%	0.439	36%	0.364	S	S	.	.	H	α-helix	trans	-68.4	-28.9	174	-73.4	173.1	-25.9	0	0	112.1	L53 E54 W59 S60 L178	L53-Q57 WeakPolarHBondContact O-CG 3.38Å; L53-Q57 PolarHBondContact O-N 3.24Å; E54-Q57 WeakPolarHBondContact O-CB 3.3Å; E54-Q57 PolarHBondContact O-N 2.64Å; E54-Q57 VanDerWaalsContact O-N 3.16Å; Q57-W59 PolarHBondContact O-N 3.15Å; Q57-S60 PolarHBondContact O-N 3.49Å; Q57-S60 PolarHBondContact O-OG 2.93Å; Q57-L178 HydrophobicContact CG-CD2 4Å
58	Q	93.8	Very high	87.8	Confident	79 Å²	79	71.1 Å²	71.1	37%	0.369	35%	0.346	S	S	.	.	H	α-helix	trans	-63.3	-24.3	175.1	-62.1	-53.5	-48.8	0	0	112.8	E54 D55 T56 S60 Q61 R65	E54-Q58 PolarHBondContact O-N 3.26Å; D55-Q58 WeakPolarHBondContact O-CB 3.48Å; D55-Q58 PolarHBondContact O-N 3.29Å; T56-Q58 VanDerWaalsContact C-N 3.3Å; Q58-S60 PolarHBondContact O-N 3.14Å; Q58-Q61 WeakPolarHBondContact O-CB 3.36Å; Q58-Q61 PolarHBondContact O-N 3.33Å; Q58-R65 WeakPolarHBondContact O-CB 3.22Å
59	W	96.3	Very high	89.9	Confident	3 Å²	3	66.6 Å²	66.6	1%	0.011	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-22.1	-179.8	-58.7	-2.2	0	0	0	113.3	L51 D55 T56 Q57 Q61 L66 S69 G72 T75 Y165 F168 Y174 L177	L51-W59 HydrophobicContact CD1-CH2 4.23Å; L51-W59 HydrophobicContact CD1-CZ2 3.72Å; L51-W59 HydrophobicContact CD2-CH2 4.2Å; D55-W59 PolarHBondContact O-NE1 3Å; D55-W59 VanDerWaalsContact O-NE1 3.15Å; T56-W59 HydrophobicContact CG2-CD2 4.29Å; T56-W59 HydrophobicContact CG2-CE3 4.02Å; T56-W59 HydrophobicContact CG2-CH2 4.23Å; T56-W59 HydrophobicContact CG2-CZ2 4.48Å; T56-W59 HydrophobicContact CG2-CZ3 4.01Å; T56-W59 WeakPolarHBondContact O-CB 3.48Å; T56-W59 PolarHBondContact O-N 3.46Å; Q57-W59 PolarHBondContact O-N 3.15Å; W59-Q61 VanDerWaalsContact C-N 3.33Å; W59-L66 HydrophobicContact CB-CB 4.17Å; W59-L66 HydrophobicContact CB-CD1 3.77Å; W59-L66 HydrophobicContact CD2-CD1 3.72Å; W59-L66 HydrophobicContact CE3-CD1 3.7Å; W59-L66 HydrophobicContact CG-CD1 3.74Å; W59-S69 PolarHBondContact NE1-OG 3.29Å; W59-G72 VanDerWaalsContact CE2-CA 3.49Å; W59-G72 VanDerWaalsContact CZ2-CA 3.45Å; W59-T75 HydrophobicContact CZ3-CG2 4.49Å; W59-Y165 WeakPolarHBondContact O-CE2 3.5Å; W59-Y165 PolarHBondContact O-OH 2.73Å; W59-F168 HydrophobicContact CE3-CZ 4.21Å; W59-Y174 HydrophobicContact CB-CE2 4.21Å; W59-Y174 HydrophobicContact CD2-CE2 4.38Å; W59-Y174 AromaticContact CE3-CD2 3.93Å; W59-Y174 HydrophobicContact CE3-CD2 3.93Å; W59-Y174 AromaticContact CE3-CE2 3.66Å; W59-Y174 HydrophobicContact CE3-CE2 3.66Å; W59-Y174 HydrophobicContact CZ3-CD2 4.36Å; W59-Y174 HydrophobicContact CZ3-CE2 4.38Å; W59-L177 HydrophobicContact CE3-CD2 4.27Å; W59-L177 HydrophobicContact CH2-CD2 3.6Å; W59-L177 HydrophobicContact CZ3-CD2 3.28Å
60	S	96.4	Very high	91.5	Very high	55 Å²	55	67.4 Å²	67.4	39%	0.385	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-5.7	176.9	71.6	0	0	0	0	113.7	Q57 Q58 Y165	Q57-S60 PolarHBondContact O-N 3.49Å; Q57-S60 PolarHBondContact O-OG 2.93Å; Q58-S60 PolarHBondContact O-N 3.14Å; S60-Y165 VanDerWaalsContact C-OH 3.25Å; S60-Y165 WeakPolarHBondContact CA-OH 3.38Å; S60-Y165 PolarHBondContact O-OH 3.24Å
61	Q	96.8	Very high	92.4	Very high	133 Å²	133	59.4 Å²	59.4	62%	0.621	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-39	-178.3	-60.4	-61.2	-33.8	0	0	112	Q58 W59	Q58-Q61 WeakPolarHBondContact O-CB 3.36Å; Q58-Q61 PolarHBondContact O-N 3.33Å; W59-Q61 VanDerWaalsContact C-N 3.33Å
62	S	97.6	Very high	93.1	Very high	32 Å²	32	58.7 Å²	58.7	22%	0.224	29%	0.287	C	S	.	.			trans	-160.9	159.1	171.7	69	0	0	0	0	111.3	E64 R65 L66 Y165	S62-E64 PolarHBondContact O-N 3.48Å; S62-R65 PolarHBondContact O-N 2.86Å; S62-R65 WeakPolarHBondContact OG-CG 3.45Å; S62-R65 PolarHBondContact OG-N 3.3Å; S62-R65 VanDerWaalsContact OG-N 3.16Å; S62-L66 PolarHBondContact O-N 3.4Å; S62-Y165 WeakPolarHBondContact CA-OH 3.43Å; S62-Y165 PolarHBondContact N-OH 3.08Å; S62-Y165 PolarHBondContact O-OH 3.44Å
63	L	97.9	Very high	93.6	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-60.1	-37	171.7	175.8	59.7	0	0	0	110.6	R65 L66 L67 F76 Y157 M160 E161 Y165	L63-R65 PolarHBondContact O-N 3.39Å; L63-L66 HydrophobicContact CD1-CD2 3.99Å; L63-L66 WeakPolarHBondContact O-CB 3.47Å; L63-L66 PolarHBondContact O-N 3.36Å; L63-L66 VanDerWaalsContact O-N 3.16Å; L63-L67 HydrophobicContact CD1-CD1 4.16Å; L63-L67 HydrophobicContact CD1-CD2 4Å; L63-L67 HydrophobicContact CD1-CG 3.85Å; L63-L67 HydrophobicContact CG-CD1 4.04Å; L63-L67 HydrophobicContact CG-CG 4.13Å; L63-L67 VanDerWaalsContact O-CG 3.3Å; L63-L67 WeakPolarHBondContact O-CG 3.35Å; L63-L67 PolarHBondContact O-N 3.32Å; L63-F76 HydrophobicContact CD1-CD1 4.34Å; L63-F76 HydrophobicContact CD1-CE1 3.82Å; L63-F76 HydrophobicContact CD1-CZ 4.15Å; L63-Y157 HydrophobicContact CB-CE2 4.27Å; L63-Y157 HydrophobicContact CD2-CD2 3.96Å; L63-Y157 HydrophobicContact CD2-CE1 4.35Å; L63-Y157 HydrophobicContact CD2-CE2 3.69Å; L63-Y157 HydrophobicContact CD2-CG 4.43Å; L63-Y157 HydrophobicContact CG-CD2 4.5Å; L63-Y157 HydrophobicContact CG-CE2 3.8Å; L63-M160 HydrophobicContact CD2-CB 3.88Å; L63-E161 HydrophobicContact CD2-CB 3.92Å; L63-Y165 HydrophobicContact CB-CD1 4.16Å; L63-Y165 HydrophobicContact CB-CD2 4.3Å; L63-Y165 HydrophobicContact CB-CE1 4.35Å; L63-Y165 HydrophobicContact CB-CE2 4.47Å; L63-Y165 HydrophobicContact CB-CG 4.13Å; L63-Y165 HydrophobicContact CD1-CD2 3.93Å; L63-Y165 HydrophobicContact CD1-CG 4.18Å
64	E	96.9	Very high	93.9	Very high	116 Å²	116	56.7 Å²	56.7	54%	0.542	28%	0.275	S	S	.	.	H	α-helix	trans	-53.8	-51.9	174.2	-176.9	176.7	-154.5	0	0	112.2	S62 L66 L67 E68 Y157	S62-E64 PolarHBondContact O-N 3.48Å; E64-L66 VanDerWaalsContact C-N 3.27Å; E64-L66 PolarHBondContact O-N 3.15Å; E64-L67 PolarHBondContact O-N 3.03Å; E64-E68 WeakPolarHBondContact O-CG 3.45Å; E64-E68 PolarHBondContact O-N 3.48Å; E64-Y157 PolarHBondContact N-OH 3.15Å; E64-Y157 VanDerWaalsContact N-OH 3.14Å
65	R	96.4	Very high	94.3	Very high	128 Å²	128	50.2 Å²	50.2	48%	0.483	25%	0.245	S	C	.	.	H	α-helix	trans	-58.8	-38.6	177.4	-69	-61.6	-167.5	-177	4.9	112.6	Q58 S62 L63 E68 S69	Q58-R65 WeakPolarHBondContact O-CB 3.22Å; S62-R65 PolarHBondContact O-N 2.86Å; S62-R65 WeakPolarHBondContact OG-CG 3.45Å; S62-R65 PolarHBondContact OG-N 3.3Å; S62-R65 VanDerWaalsContact OG-N 3.16Å; L63-R65 PolarHBondContact O-N 3.39Å; R65-E68 IonicContact NH1-OE2 3.53Å; R65-S69 PolarHBondContact O-N 2.89Å
66	L	97.1	Very high	94.9	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-64	-42.6	175.6	173.2	66.9	0	0	0	111.6	W59 S62 L63 E64 S69 G72 L73 F76 Y165 F168	W59-L66 HydrophobicContact CB-CB 4.17Å; W59-L66 HydrophobicContact CB-CD1 3.77Å; W59-L66 HydrophobicContact CD2-CD1 3.72Å; W59-L66 HydrophobicContact CE3-CD1 3.7Å; W59-L66 HydrophobicContact CG-CD1 3.74Å; S62-L66 PolarHBondContact O-N 3.4Å; L63-L66 HydrophobicContact CD1-CD2 3.99Å; L63-L66 WeakPolarHBondContact O-CB 3.47Å; L63-L66 PolarHBondContact O-N 3.36Å; L63-L66 VanDerWaalsContact O-N 3.16Å; E64-L66 VanDerWaalsContact C-N 3.27Å; E64-L66 PolarHBondContact O-N 3.15Å; L66-S69 PolarHBondContact O-N 3.43Å; L66-G72 VanDerWaalsContact CD1-CA 3.44Å; L66-G72 WeakPolarHBondContact CD1-O 3.3Å; L66-G72 CarbonylContact O-C 3.44Å; L66-G72 WeakPolarHBondContact O-CA 3.12Å; L66-L73 PolarHBondContact O-N 3.04Å; L66-F76 HydrophobicContact CD1-CB 4.41Å; L66-F76 HydrophobicContact CD2-CB 3.9Å; L66-F76 HydrophobicContact CD2-CD1 4.18Å; L66-F76 HydrophobicContact CD2-CD2 3.84Å; L66-F76 HydrophobicContact CD2-CE2 4.41Å; L66-F76 HydrophobicContact CD2-CG 3.71Å; L66-F76 HydrophobicContact CG-CB 4.27Å; L66-Y165 HydrophobicContact CB-CE2 4.25Å; L66-Y165 HydrophobicContact CD2-CD2 3.6Å; L66-Y165 HydrophobicContact CD2-CE2 3.67Å; L66-F168 HydrophobicContact CD1-CE1 3.67Å; L66-F168 HydrophobicContact CD1-CZ 3.97Å; L66-F168 HydrophobicContact CD2-CD1 3.77Å; L66-F168 HydrophobicContact CD2-CE1 3.67Å; L66-F168 HydrophobicContact CD2-CZ 4.46Å; L66-F168 HydrophobicContact CG-CE1 4.36Å
67	L	96.3	Very high	95.2	Very high	16 Å²	16	51.4 Å²	51.4	8%	0.084	24%	0.244	C	C	.	.	H	α-helix	trans	-76.8	-27.2	-177.6	-62.2	-172.5	0	0	0	113.4	L63 E64 S69 L73 F76 I89 W92 Y157	L63-L67 HydrophobicContact CD1-CD1 4.16Å; L63-L67 HydrophobicContact CD1-CD2 4Å; L63-L67 HydrophobicContact CD1-CG 3.85Å; L63-L67 HydrophobicContact CG-CD1 4.04Å; L63-L67 HydrophobicContact CG-CG 4.13Å; L63-L67 VanDerWaalsContact O-CG 3.3Å; L63-L67 WeakPolarHBondContact O-CG 3.35Å; L63-L67 PolarHBondContact O-N 3.32Å; E64-L67 PolarHBondContact O-N 3.03Å; L67-S69 VanDerWaalsContact C-N 3.31Å; L67-L73 HydrophobicContact CD2-CD1 3.85Å; L67-F76 HydrophobicContact CD2-CD1 3.9Å; L67-F76 HydrophobicContact CD2-CE1 4.38Å; L67-I89 HydrophobicContact CD1-CD1 4.12Å; L67-I89 HydrophobicContact CD2-CD1 3.61Å; L67-W92 HydrophobicContact CB-CH2 4.43Å; L67-W92 HydrophobicContact CB-CZ3 4.41Å; L67-W92 HydrophobicContact CD1-CD2 4.21Å; L67-W92 HydrophobicContact CD1-CE3 4Å; L67-W92 HydrophobicContact CD1-CH2 3.94Å; L67-W92 HydrophobicContact CD1-CZ2 4.13Å; L67-W92 HydrophobicContact CD1-CZ3 3.86Å; L67-Y157 HydrophobicContact CD1-CD2 4.4Å; L67-Y157 HydrophobicContact CD1-CE2 4.17Å
68	E	93.6	Very high	95.2	Very high	121 Å²	121	49.6 Å²	49.6	57%	0.565	24%	0.24	S	C	*	.	H	α-helix	trans	-67.4	-31.9	172.1	-73.6	178.5	159.3	0	0	112.3	E64 R65	E64-E68 WeakPolarHBondContact O-CG 3.45Å; E64-E68 PolarHBondContact O-N 3.48Å; R65-E68 IonicContact NH1-OE2 3.53Å
69	S	93.1	Very high	95.3	Very high	25 Å²	25	46.3 Å²	46.3	18%	0.175	22%	0.224	C	C	.	.	S	Bend	trans	-77	125	177.5	-178.5	0	0	0	0	111.6	W59 R65 L66 L67 Y71 G72 L73	W59-S69 PolarHBondContact NE1-OG 3.29Å; R65-S69 PolarHBondContact O-N 2.89Å; L66-S69 PolarHBondContact O-N 3.43Å; L67-S69 VanDerWaalsContact C-N 3.31Å; S69-Y71 VanDerWaalsContact C-N 3.27Å; S69-Y71 PolarHBondContact O-N 3.2Å; S69-Y71 PolarHBondContact OG-N 2.98Å; S69-G72 PolarHBondContact O-N 3.35Å; S69-G72 PolarHBondContact OG-N 3.04Å; S69-G72 VanDerWaalsContact OG-N 3.15Å; S69-L73 WeakPolarHBondContact O-CB 3.44Å; S69-L73 PolarHBondContact O-N 3.24Å
70	K	90.6	Very high	95.4	Very high	100 Å²	100	46.2 Å²	46.2	44%	0.435	22%	0.224	S	C	.	.	H	α-helix	trans	-56	-43.2	173.1	-68.6	175.2	-176.8	159.7	0	112.1	F41 E48 A74	F41-K70 HydrophobicContact CE1-CB 4.1Å; F41-K70 HydrophobicContact CZ-CB 4.26Å; E48-K70 IonicContact OE1-NZ 3.88Å; E48-K70 IonicContact OE2-NZ 3.26Å; E48-K70 PolarHBondContact OE2-NZ 2.87Å; K70-A74 WeakPolarHBondContact O-CB 3.25Å; K70-A74 PolarHBondContact O-N 3.28Å; K70-A74 VanDerWaalsContact O-N 3.16Å
71	Y	91.6	Very high	95.3	Very high	35 Å²	35	49.2 Å²	49.2	14%	0.137	23%	0.23	C	C	.	.	H	α-helix	trans	-70.7	-42.2	177.3	-69.7	-83.6	0	0	0	111.5	L37 F41 L51 S69 A74 T75	L37-Y71 HydrophobicContact CD1-CD1 4.47Å; L37-Y71 HydrophobicContact CD2-CD1 3.81Å; L37-Y71 HydrophobicContact CG-CD1 3.8Å; L37-Y71 HydrophobicContact CG-CE1 4.37Å; F41-Y71 HydrophobicContact CB-CE1 3.95Å; F41-Y71 WeakPolarHBondContact CB-OH 3.34Å; F41-Y71 AromaticContact CD2-CD1 3.6Å; F41-Y71 HydrophobicContact CD2-CD1 3.6Å; F41-Y71 AromaticContact CD2-CE1 3.32Å; F41-Y71 HydrophobicContact CD2-CE1 3.32Å; F41-Y71 HydrophobicContact CD2-CG 4.34Å; F41-Y71 AromaticContact CD2-CZ 3.87Å; F41-Y71 AromaticContact CE2-CD1 3.9Å; F41-Y71 HydrophobicContact CE2-CD1 3.9Å; F41-Y71 HydrophobicContact CE2-CE1 4.11Å; F41-Y71 HydrophobicContact CE2-CG 4.42Å; F41-Y71 HydrophobicContact CG-CD1 4.5Å; F41-Y71 AromaticContact CG-CE1 3.93Å; F41-Y71 HydrophobicContact CG-CE1 3.93Å; L51-Y71 HydrophobicContact CB-CD1 4.17Å; L51-Y71 HydrophobicContact CB-CD2 4.27Å; L51-Y71 HydrophobicContact CB-CE1 4.16Å; L51-Y71 HydrophobicContact CB-CE2 4.27Å; L51-Y71 HydrophobicContact CB-CG 4.23Å; L51-Y71 HydrophobicContact CD1-CD1 4.48Å; L51-Y71 HydrophobicContact CD1-CD2 3.94Å; L51-Y71 HydrophobicContact CD1-CG 3.84Å; L51-Y71 HydrophobicContact CD2-CD1 4.03Å; L51-Y71 HydrophobicContact CD2-CG 4.13Å; L51-Y71 HydrophobicContact CG-CD1 4.47Å; L51-Y71 HydrophobicContact CG-CG 4.3Å; S69-Y71 VanDerWaalsContact C-N 3.27Å; S69-Y71 PolarHBondContact O-N 3.2Å; S69-Y71 PolarHBondContact OG-N 2.98Å; Y71-A74 PolarHBondContact O-N 3.04Å; Y71-T75 WeakPolarHBondContact O-CB 3.14Å; Y71-T75 PolarHBondContact O-N 3.12Å; Y71-T75 PolarHBondContact O-OG1 3.32Å
72	G	94.6	Very high	95.2	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-59.2	-53.2	177.1	0	0	0	0	0	111.7	W59 L66 S69 A74 T75 F76	W59-G72 VanDerWaalsContact CE2-CA 3.49Å; W59-G72 VanDerWaalsContact CZ2-CA 3.45Å; L66-G72 VanDerWaalsContact CD1-CA 3.44Å; L66-G72 WeakPolarHBondContact CD1-O 3.3Å; L66-G72 CarbonylContact O-C 3.44Å; L66-G72 WeakPolarHBondContact O-CA 3.12Å; S69-G72 PolarHBondContact O-N 3.35Å; S69-G72 PolarHBondContact OG-N 3.04Å; S69-G72 VanDerWaalsContact OG-N 3.15Å; G72-A74 PolarHBondContact O-N 3.48Å; G72-T75 PolarHBondContact O-N 2.92Å; G72-F76 WeakPolarHBondContact O-CB 3.1Å; G72-F76 PolarHBondContact O-N 3.43Å
73	L	95.4	Very high	95	Very high	27 Å²	27	48.2 Å²	48.2	14%	0.141	23%	0.231	C	C	.	.	H	α-helix	trans	-58.1	-44	177.3	175.6	61.2	0	0	0	112.7	L66 L67 S69 T75 F76 R77 I89 L93	L66-L73 PolarHBondContact O-N 3.04Å; L67-L73 HydrophobicContact CD2-CD1 3.85Å; S69-L73 WeakPolarHBondContact O-CB 3.44Å; S69-L73 PolarHBondContact O-N 3.24Å; L73-T75 VanDerWaalsContact C-N 3.35Å; L73-F76 PolarHBondContact O-N 2.96Å; L73-R77 HydrophobicContact CD1-CG 4.17Å; L73-R77 WeakPolarHBondContact O-CB 3.4Å; L73-R77 WeakPolarHBondContact O-CG 3.45Å; L73-R77 PolarHBondContact O-N 2.94Å; L73-I89 HydrophobicContact CD1-CD1 3.84Å; L73-I89 HydrophobicContact CD1-CG1 3.77Å; L73-L93 HydrophobicContact CD1-CD1 3.89Å; L73-L93 HydrophobicContact CD2-CD1 4Å; L73-L93 HydrophobicContact CD2-CD2 4.12Å; L73-L93 HydrophobicContact CG-CD1 4.47Å
74	A	93.3	Very high	94.8	Very high	18 Å²	18	56.9 Å²	56.9	15%	0.149	27%	0.269	C	S	.	.	H	α-helix	trans	-64.8	-39.8	178.7	0	0	0	0	0	112.3	L37 F41 K70 Y71 G72 T78	L37-A74 HydrophobicContact CD1-CB 3.73Å; F41-A74 HydrophobicContact CE2-CB 4.14Å; F41-A74 HydrophobicContact CZ-CB 4.07Å; K70-A74 WeakPolarHBondContact O-CB 3.25Å; K70-A74 PolarHBondContact O-N 3.28Å; K70-A74 VanDerWaalsContact O-N 3.16Å; Y71-A74 PolarHBondContact O-N 3.04Å; G72-A74 PolarHBondContact O-N 3.48Å; A74-T78 PolarHBondContact O-N 3.3Å; A74-T78 VanDerWaalsContact O-N 3.14Å; A74-T78 PolarHBondContact O-OG1 2.73Å
75	T	94.5	Very high	94.8	Very high	0 Å²	0	52 Å²	52	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-67.5	-46.1	176.4	-50.5	0	0	0	0	110.8	F33 W59 Y71 G72 L73 R77 T78 F79 F168 I173	F33-T75 HydrophobicContact CE1-CG2 3.77Å; F33-T75 HydrophobicContact CZ-CG2 4.11Å; W59-T75 HydrophobicContact CZ3-CG2 4.49Å; Y71-T75 WeakPolarHBondContact O-CB 3.14Å; Y71-T75 PolarHBondContact O-N 3.12Å; Y71-T75 PolarHBondContact O-OG1 3.32Å; G72-T75 PolarHBondContact O-N 2.92Å; L73-T75 VanDerWaalsContact C-N 3.35Å; T75-R77 PolarHBondContact O-N 3.23Å; T75-T78 WeakPolarHBondContact O-CB 3.23Å; T75-T78 PolarHBondContact O-N 3.06Å; T75-T78 VanDerWaalsContact O-N 3.14Å; T75-F79 PolarHBondContact O-N 3.4Å; T75-F168 HydrophobicContact CG2-CE2 3.72Å; T75-F168 HydrophobicContact CG2-CZ 4.05Å; T75-I173 HydrophobicContact CG2-CD1 3.91Å; T75-I173 HydrophobicContact CG2-CG1 3.87Å
76	F	97.3	Very high	94.9	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-63.7	-41.8	178.5	-170.2	-127.9	0	0	0	112.4	L63 L66 L67 G72 L73 T78 F79 L80 M160 F168	L63-F76 HydrophobicContact CD1-CD1 4.34Å; L63-F76 HydrophobicContact CD1-CE1 3.82Å; L63-F76 HydrophobicContact CD1-CZ 4.15Å; L66-F76 HydrophobicContact CD1-CB 4.41Å; L66-F76 HydrophobicContact CD2-CB 3.9Å; L66-F76 HydrophobicContact CD2-CD1 4.18Å; L66-F76 HydrophobicContact CD2-CD2 3.84Å; L66-F76 HydrophobicContact CD2-CE2 4.41Å; L66-F76 HydrophobicContact CD2-CG 3.71Å; L66-F76 HydrophobicContact CG-CB 4.27Å; L67-F76 HydrophobicContact CD2-CD1 3.9Å; L67-F76 HydrophobicContact CD2-CE1 4.38Å; G72-F76 WeakPolarHBondContact O-CB 3.1Å; G72-F76 PolarHBondContact O-N 3.43Å; L73-F76 PolarHBondContact O-N 2.96Å; F76-T78 VanDerWaalsContact C-N 3.29Å; F76-T78 PolarHBondContact O-N 2.68Å; F76-F79 HydrophobicContact CD2-CD1 4.17Å; F76-F79 HydrophobicContact CE2-CD1 4.12Å; F76-F79 WeakPolarHBondContact O-CB 3.25Å; F76-F79 PolarHBondContact O-N 3.15Å; F76-L80 HydrophobicContact CD1-CD1 3.84Å; F76-L80 HydrophobicContact CD1-CG 4.45Å; F76-L80 HydrophobicContact CD2-CG 4.44Å; F76-L80 HydrophobicContact CE1-CD1 3.58Å; F76-L80 HydrophobicContact CE1-CD2 4.47Å; F76-L80 HydrophobicContact CE1-CG 4.23Å; F76-L80 HydrophobicContact CE2-CD1 4.43Å; F76-L80 HydrophobicContact CE2-CD2 4.14Å; F76-L80 HydrophobicContact CE2-CG 4.19Å; F76-L80 HydrophobicContact CG-CD1 4.39Å; F76-L80 HydrophobicContact CZ-CD1 3.9Å; F76-L80 HydrophobicContact CZ-CD2 3.95Å; F76-L80 HydrophobicContact CZ-CG 4.09Å; F76-L80 WeakPolarHBondContact O-CG 3.37Å; F76-L80 PolarHBondContact O-N 2.83Å; F76-M160 HydrophobicContact CE1-SD 4Å; F76-M160 HydrophobicContact CZ-CB 4.42Å; F76-F168 HydrophobicContact CD2-CB 3.79Å; F76-F168 HydrophobicContact CD2-CD1 4.05Å; F76-F168 AromaticContact CD2-CD2 3.86Å; F76-F168 HydrophobicContact CD2-CD2 3.86Å; F76-F168 HydrophobicContact CD2-CE2 4.48Å; F76-F168 AromaticContact CD2-CG 3.61Å; F76-F168 HydrophobicContact CD2-CG 3.61Å; F76-F168 HydrophobicContact CE2-CB 3.76Å; F76-F168 HydrophobicContact CE2-CG 4.09Å
77	R	96.2	Very high	94.9	Very high	98 Å²	98	49 Å²	49	37%	0.37	24%	0.24	S	C	.	.	H	α-helix	trans	-57.9	-40.8	171.9	-83.7	171.4	158	-176.5	-13.6	112.6	L73 T75 F79 L80 K81 I89	L73-R77 HydrophobicContact CD1-CG 4.17Å; L73-R77 WeakPolarHBondContact O-CB 3.4Å; L73-R77 WeakPolarHBondContact O-CG 3.45Å; L73-R77 PolarHBondContact O-N 2.94Å; T75-R77 PolarHBondContact O-N 3.23Å; R77-F79 VanDerWaalsContact C-N 3.34Å; R77-L80 PolarHBondContact O-N 3.41Å; R77-K81 WeakPolarHBondContact O-CG 3.31Å; R77-K81 PolarHBondContact O-N 3.14Å; R77-I89 HydrophobicContact CG-CG1 4.12Å; R77-I89 HydrophobicContact CG-CG2 3.79Å
78	T	94.3	Very high	95	Very high	56 Å²	56	48.5 Å²	48.5	34%	0.344	24%	0.237	S	C	.	.	H	α-helix	trans	-65.3	-42.4	178	-58	0	0	0	0	110.8	F33 A74 T75 F76 K81 S82 I173	F33-T78 HydrophobicContact CD2-CG2 4.08Å; F33-T78 HydrophobicContact CE2-CG2 3.68Å; F33-T78 WeakPolarHBondContact CE2-OG1 3.42Å; F33-T78 HydrophobicContact CZ-CG2 4.47Å; A74-T78 PolarHBondContact O-N 3.3Å; A74-T78 VanDerWaalsContact O-N 3.14Å; A74-T78 PolarHBondContact O-OG1 2.73Å; T75-T78 WeakPolarHBondContact O-CB 3.23Å; T75-T78 PolarHBondContact O-N 3.06Å; T75-T78 VanDerWaalsContact O-N 3.14Å; F76-T78 VanDerWaalsContact C-N 3.29Å; F76-T78 PolarHBondContact O-N 2.68Å; T78-K81 PolarHBondContact O-N 3.4Å; T78-S82 PolarHBondContact O-N 2.97Å; T78-S82 VanDerWaalsContact O-N 3.15Å; T78-I173 HydrophobicContact CG2-CD1 3.94Å
79	F	96.3	Very high	95.2	Very high	10 Å²	10	42.8 Å²	42.8	4%	0.044	21%	0.21	C	C	.	.	H	α-helix	trans	-60	-51.1	174.2	171.4	-97.3	0	0	0	111.9	T75 F76 R77 K81 S82 E83 S164 R167 F168 I173	T75-F79 PolarHBondContact O-N 3.4Å; F76-F79 HydrophobicContact CD2-CD1 4.17Å; F76-F79 HydrophobicContact CE2-CD1 4.12Å; F76-F79 WeakPolarHBondContact O-CB 3.25Å; F76-F79 PolarHBondContact O-N 3.15Å; R77-F79 VanDerWaalsContact C-N 3.34Å; F79-K81 VanDerWaalsContact C-N 3.29Å; F79-K81 PolarHBondContact O-N 3.46Å; F79-S82 WeakPolarHBondContact O-CB 3.25Å; F79-S82 PolarHBondContact O-N 2.98Å; F79-S82 PolarHBondContact O-OG 3.18Å; F79-E83 VanDerWaalsContact CE1-OE2 3.23Å; F79-E83 WeakPolarHBondContact CE1-OE2 3.28Å; F79-E83 HydrophobicContact CE2-CG 4.34Å; F79-E83 WeakPolarHBondContact CE2-OE1 3.43Å; F79-E83 HydrophobicContact CZ-CG 4.23Å; F79-E83 WeakPolarHBondContact CZ-OE1 3.45Å; F79-E83 WeakPolarHBondContact CZ-OE2 3.35Å; F79-E83 PolarHBondContact O-N 3.01Å; F79-S164 VanDerWaalsContact CE1-O 3.24Å; F79-S164 WeakPolarHBondContact CE1-O 3.3Å; F79-R167 HydrophobicContact CE1-CB 4.48Å; F79-R167 HydrophobicContact CZ-CB 3.8Å; F79-F168 HydrophobicContact CB-CD2 3.77Å; F79-F168 HydrophobicContact CB-CE2 4.41Å; F79-F168 HydrophobicContact CD1-CB 3.68Å; F79-F168 HydrophobicContact CD1-CD2 4.1Å; F79-F168 HydrophobicContact CD1-CG 4.36Å; F79-F168 HydrophobicContact CD2-CB 4.5Å; F79-F168 HydrophobicContact CD2-CD2 4.31Å; F79-F168 HydrophobicContact CE1-CB 3.71Å; F79-F168 HydrophobicContact CG-CB 4.09Å; F79-F168 AromaticContact CG-CD2 3.79Å; F79-F168 HydrophobicContact CG-CD2 3.79Å; F79-F168 HydrophobicContact CG-CG 4.44Å; F79-F168 HydrophobicContact CZ-CB 4.14Å; F79-I173 HydrophobicContact CB-CG2 4.34Å; F79-I173 HydrophobicContact CD2-CG2 4.27Å
80	L	96.9	Very high	95.5	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-61	-36.6	179.6	-66.8	173.5	0	0	0	112.6	F76 R77 S82 E83 F84 S85 D86 I89 M160	F76-L80 HydrophobicContact CD1-CD1 3.84Å; F76-L80 HydrophobicContact CD1-CG 4.45Å; F76-L80 HydrophobicContact CD2-CG 4.44Å; F76-L80 HydrophobicContact CE1-CD1 3.58Å; F76-L80 HydrophobicContact CE1-CD2 4.47Å; F76-L80 HydrophobicContact CE1-CG 4.23Å; F76-L80 HydrophobicContact CE2-CD1 4.43Å; F76-L80 HydrophobicContact CE2-CD2 4.14Å; F76-L80 HydrophobicContact CE2-CG 4.19Å; F76-L80 HydrophobicContact CG-CD1 4.39Å; F76-L80 HydrophobicContact CZ-CD1 3.9Å; F76-L80 HydrophobicContact CZ-CD2 3.95Å; F76-L80 HydrophobicContact CZ-CG 4.09Å; F76-L80 WeakPolarHBondContact O-CG 3.37Å; F76-L80 PolarHBondContact O-N 2.83Å; R77-L80 PolarHBondContact O-N 3.41Å; L80-S82 VanDerWaalsContact C-N 3.32Å; L80-S82 PolarHBondContact O-N 2.9Å; L80-E83 CarbonylContact O-C 3.41Å; L80-E83 PolarHBondContact O-N 3.43Å; L80-E83 VanDerWaalsContact O-N 3.15Å; L80-F84 PolarHBondContact O-N 3.42Å; L80-S85 VanDerWaalsContact CD2-OG 3.25Å; L80-S85 WeakPolarHBondContact CD2-OG 3.31Å; L80-S85 PolarHBondContact O-N 3.11Å; L80-D86 HydrophobicContact CB-CB 4.13Å; L80-I89 HydrophobicContact CD1-CB 3.58Å; L80-I89 HydrophobicContact CD1-CG1 4.49Å; L80-I89 HydrophobicContact CD1-CG2 3.41Å; L80-I89 VanDerWaalsContact CD1-CG2 3.41Å; L80-M160 HydrophobicContact CD1-SD 4.22Å
81	K	95	Very high	95.9	Very high	119 Å²	119	39.1 Å²	39.1	52%	0.517	19%	0.192	S	C	.	.	H	α-helix	trans	-63.2	-37.3	173.5	-77.8	179.2	173.9	-175.7	0	112.8	R77 T78 F79 E83 F84 D86	R77-K81 WeakPolarHBondContact O-CG 3.31Å; R77-K81 PolarHBondContact O-N 3.14Å; T78-K81 PolarHBondContact O-N 3.4Å; F79-K81 VanDerWaalsContact C-N 3.29Å; F79-K81 PolarHBondContact O-N 3.46Å; K81-E83 PolarHBondContact O-N 3.12Å; K81-F84 PolarHBondContact O-N 3.04Å; K81-D86 HydrophobicContact CB-CB 4.5Å; K81-D86 HydrophobicContact CG-CB 3.59Å
82	S	93.7	Very high	96.2	Very high	81 Å²	81	39.7 Å²	39.7	57%	0.566	19%	0.194	S	C	*	.	H	α-helix	trans	-67.7	-20.7	176.8	74.4	0	0	0	0	112.9	T78 F79 L80	T78-S82 PolarHBondContact O-N 2.97Å; T78-S82 VanDerWaalsContact O-N 3.15Å; F79-S82 WeakPolarHBondContact O-CB 3.25Å; F79-S82 PolarHBondContact O-N 2.98Å; F79-S82 PolarHBondContact O-OG 3.18Å; L80-S82 VanDerWaalsContact C-N 3.32Å; L80-S82 PolarHBondContact O-N 2.9Å
83	E	95	Very high	96.4	Very high	62 Å²	62	41.1 Å²	41.1	29%	0.29	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.9	8.9	178.8	-59.4	-168.5	146.1	0	0	113.1	F79 L80 K81 S85 R167	F79-E83 VanDerWaalsContact CE1-OE2 3.23Å; F79-E83 WeakPolarHBondContact CE1-OE2 3.28Å; F79-E83 HydrophobicContact CE2-CG 4.34Å; F79-E83 WeakPolarHBondContact CE2-OE1 3.43Å; F79-E83 HydrophobicContact CZ-CG 4.23Å; F79-E83 WeakPolarHBondContact CZ-OE1 3.45Å; F79-E83 WeakPolarHBondContact CZ-OE2 3.35Å; F79-E83 PolarHBondContact O-N 3.01Å; L80-E83 CarbonylContact O-C 3.41Å; L80-E83 PolarHBondContact O-N 3.43Å; L80-E83 VanDerWaalsContact O-N 3.15Å; K81-E83 PolarHBondContact O-N 3.12Å; E83-S85 PolarHBondContact O-N 2.94Å; E83-R167 IonicContact OE1-CZ 2.93Å; E83-R167 IonicContact OE1-NH1 3.16Å; E83-R167 PolarHBondContact OE1-NH1 3.18Å; E83-R167 IonicContact OE2-CZ 2.69Å; E83-R167 IonicContact OE2-NH1 3.86Å; E83-R167 PolarHBondContact OE2-NH1 3.23Å; E83-R167 IonicContact OE2-NH2 3.16Å; E83-R167 PolarHBondContact OE2-NH2 3.32Å; E83-R167 VanDerWaalsContact OE2-NH2 3.16Å
84	F	93.6	Very high	96.5	Very high	182 Å²	182	41 Å²	41	80%	0.798	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.9	38.4	-179.4	-53.8	-88.1	0	0	0	113.6	L80 K81	L80-F84 PolarHBondContact O-N 3.42Å; K81-F84 PolarHBondContact O-N 3.04Å
85	S	97.1	Very high	96.8	Very high	14 Å²	14	40.2 Å²	40.2	10%	0.098	20%	0.195	C	C	.	.			trans	-129.1	23.4	-177.9	70.5	0	0	0	0	112.8	L80 E83 E87 N88	L80-S85 VanDerWaalsContact CD2-OG 3.25Å; L80-S85 WeakPolarHBondContact CD2-OG 3.31Å; L80-S85 PolarHBondContact O-N 3.11Å; E83-S85 PolarHBondContact O-N 2.94Å; S85-E87 VanDerWaalsContact C-N 3.3Å; S85-E87 WeakPolarHBondContact CA-OE2 3.45Å; S85-E87 PolarHBondContact O-N 3.21Å; S85-N88 PolarHBondContact O-ND2 3.37Å; S85-N88 VanDerWaalsContact O-ND2 3.14Å
86	D	97.2	Very high	96.9	Very high	26 Å²	26	42.9 Å²	42.9	14%	0.139	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75	-14.8	-176.8	64	-72	0	0	0	114.1	L80 K81 N88 I89 E90 K125	L80-D86 HydrophobicContact CB-CB 4.13Å; K81-D86 HydrophobicContact CB-CB 4.5Å; K81-D86 HydrophobicContact CG-CB 3.59Å; D86-N88 PolarHBondContact O-N 3.22Å; D86-I89 VanDerWaalsContact O-CG2 3.28Å; D86-I89 WeakPolarHBondContact O-CG2 3.24Å; D86-I89 PolarHBondContact O-N 3.22Å; D86-E90 WeakPolarHBondContact O-CB 3.22Å; D86-E90 WeakPolarHBondContact O-CG 3.19Å; D86-E90 PolarHBondContact O-N 3.49Å; D86-K125 IonicContact OD2-NZ 2.69Å; D86-K125 PolarHBondContact OD2-NZ 3.5Å
87	E	98.2	Very high	97	Very high	39 Å²	39	48 Å²	48	18%	0.182	23%	0.232	C	C	.	.	H	α-helix	trans	-56	-34.4	172.1	72.1	-66.4	158.1	0	0	112.4	S85 E90 F91 K125 I127	S85-E87 VanDerWaalsContact C-N 3.3Å; S85-E87 WeakPolarHBondContact CA-OE2 3.45Å; S85-E87 PolarHBondContact O-N 3.21Å; E87-E90 PolarHBondContact O-N 3.1Å; E87-F91 VanDerWaalsContact O-CB 3.24Å; E87-F91 WeakPolarHBondContact O-CB 3.47Å; E87-F91 PolarHBondContact O-N 3.44Å; E87-K125 HydrophobicContact CB-CB 3.84Å; E87-K125 HydrophobicContact CB-CD 4.24Å; E87-K125 HydrophobicContact CB-CG 4.39Å; E87-I127 HydrophobicContact CG-CG2 4.36Å
88	N	98.1	Very high	97.1	Very high	6 Å²	6	43.4 Å²	43.4	3%	0.032	21%	0.214	C	C	.	.	H	α-helix	trans	-63.9	-49.4	-178.7	-64.4	-58.4	0	0	0	111.9	S85 D86 W92 V156 M160	S85-N88 PolarHBondContact O-ND2 3.37Å; S85-N88 VanDerWaalsContact O-ND2 3.14Å; D86-N88 PolarHBondContact O-N 3.22Å; N88-W92 WeakPolarHBondContact O-CB 3.41Å; N88-W92 PolarHBondContact O-N 2.91Å; N88-V156 HydrophobicContact CB-CG1 3.67Å; N88-V156 VanDerWaalsContact O-CG1 3.25Å; N88-V156 WeakPolarHBondContact O-CG1 3.41Å; N88-M160 HydrophobicContact CB-CG 3.71Å; N88-M160 HydrophobicContact CB-SD 3.74Å
89	I	98.3	Very high	97.2	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-74.1	-33.5	179.7	-171.2	56.4	0	0	0	111.7	L67 L73 R77 L80 D86 W92 L93 M160	L67-I89 HydrophobicContact CD1-CD1 4.12Å; L67-I89 HydrophobicContact CD2-CD1 3.61Å; L73-I89 HydrophobicContact CD1-CD1 3.84Å; L73-I89 HydrophobicContact CD1-CG1 3.77Å; R77-I89 HydrophobicContact CG-CG1 4.12Å; R77-I89 HydrophobicContact CG-CG2 3.79Å; L80-I89 HydrophobicContact CD1-CB 3.58Å; L80-I89 HydrophobicContact CD1-CG1 4.49Å; L80-I89 HydrophobicContact CD1-CG2 3.41Å; L80-I89 VanDerWaalsContact CD1-CG2 3.41Å; D86-I89 VanDerWaalsContact O-CG2 3.28Å; D86-I89 WeakPolarHBondContact O-CG2 3.24Å; D86-I89 PolarHBondContact O-N 3.22Å; I89-W92 HydrophobicContact CD1-CE3 4.18Å; I89-W92 PolarHBondContact O-N 3.4Å; I89-L93 HydrophobicContact CD1-CD1 4.24Å; I89-L93 HydrophobicContact CD1-CG 4.21Å; I89-L93 HydrophobicContact CG1-CD1 3.99Å; I89-L93 HydrophobicContact CG1-CG 4.43Å; I89-L93 WeakPolarHBondContact O-CB 3.42Å; I89-L93 VanDerWaalsContact O-CG 3.31Å; I89-L93 WeakPolarHBondContact O-CG 3.29Å; I89-L93 PolarHBondContact O-N 3.33Å; I89-M160 HydrophobicContact CB-SD 3.9Å; I89-M160 HydrophobicContact CD1-CE 4.2Å; I89-M160 HydrophobicContact CD1-SD 4.28Å
90	E	98.4	Very high	97.3	Very high	49 Å²	49	51.4 Å²	51.4	23%	0.229	24%	0.244	C	C	.	.	H	α-helix	trans	-64.9	-43.7	175.1	-75.8	-170.6	-174.5	0	0	111.9	D86 E87 T94 F118 K125	D86-E90 WeakPolarHBondContact O-CB 3.22Å; D86-E90 WeakPolarHBondContact O-CG 3.19Å; D86-E90 PolarHBondContact O-N 3.49Å; E87-E90 PolarHBondContact O-N 3.1Å; E90-T94 VanDerWaalsContact O-CB 3.29Å; E90-T94 WeakPolarHBondContact O-CB 3.4Å; E90-T94 PolarHBondContact O-N 3.35Å; E90-T94 PolarHBondContact O-OG1 3.41Å; E90-F118 HydrophobicContact CB-CE1 4.07Å; E90-F118 HydrophobicContact CB-CZ 4.06Å; E90-K125 IonicContact OE1-NZ 3.11Å; E90-K125 PolarHBondContact OE1-NZ 3.27Å; E90-K125 WeakPolarHBondContact OE2-CD 3.24Å; E90-K125 WeakPolarHBondContact OE2-CE 3.39Å; E90-K125 IonicContact OE2-NZ 2.89Å; E90-K125 PolarHBondContact OE2-NZ 2.98Å
91	F	98.8	Very high	97.3	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-60.3	-51.3	173.8	174.2	-107.5	0	0	0	111	E87 L93 T94 C95 I114 F118 I119 I127 F149 A152 Q153 V156	E87-F91 VanDerWaalsContact O-CB 3.24Å; E87-F91 WeakPolarHBondContact O-CB 3.47Å; E87-F91 PolarHBondContact O-N 3.44Å; F91-L93 VanDerWaalsContact C-N 3.33Å; F91-L93 PolarHBondContact O-N 3.49Å; F91-T94 WeakPolarHBondContact O-CB 3.4Å; F91-T94 PolarHBondContact O-N 3.45Å; F91-C95 VanDerWaalsContact CE2-SG 3.58Å; F91-C95 WeakPolarHBondContact CZ-SG 3.36Å; F91-C95 PolarHBondContact O-N 3.45Å; F91-C95 PolarHBondContact O-SG 3.44Å; F91-I114 HydrophobicContact CD2-CG2 4.23Å; F91-I114 HydrophobicContact CE2-CG2 3.77Å; F91-F118 HydrophobicContact CB-CD1 3.69Å; F91-F118 HydrophobicContact CB-CE1 3.85Å; F91-F118 HydrophobicContact CB-CG 4.05Å; F91-F118 HydrophobicContact CB-CZ 4.33Å; F91-F118 HydrophobicContact CD2-CB 3.61Å; F91-F118 HydrophobicContact CD2-CD1 4.19Å; F91-F118 AromaticContact CD2-CD2 3.87Å; F91-F118 HydrophobicContact CD2-CD2 3.87Å; F91-F118 AromaticContact CD2-CG 3.65Å; F91-F118 HydrophobicContact CD2-CG 3.65Å; F91-F118 HydrophobicContact CE2-CB 4.21Å; F91-F118 HydrophobicContact CG-CB 4.39Å; F91-F118 HydrophobicContact CG-CD1 4.37Å; F91-F118 HydrophobicContact CG-CG 4.28Å; F91-I119 HydrophobicContact CE2-CD1 3.7Å; F91-I119 HydrophobicContact CE2-CG1 4.49Å; F91-I119 HydrophobicContact CZ-CD1 3.95Å; F91-I127 HydrophobicContact CB-CG2 3.79Å; F91-I127 HydrophobicContact CD1-CD1 3.67Å; F91-I127 HydrophobicContact CD1-CG2 4.3Å; F91-I127 HydrophobicContact CD2-CD1 4.11Å; F91-I127 HydrophobicContact CE1-CD1 3.47Å; F91-I127 VanDerWaalsContact CE1-CD1 3.47Å; F91-I127 HydrophobicContact CE2-CD1 3.95Å; F91-I127 HydrophobicContact CG-CD1 3.96Å; F91-I127 HydrophobicContact CG-CG2 3.95Å; F91-I127 HydrophobicContact CZ-CD1 3.63Å; F91-F149 HydrophobicContact CZ-CB 4.33Å; F91-A152 HydrophobicContact CE1-CB 3.98Å; F91-A152 HydrophobicContact CZ-CB 3.79Å; F91-Q153 HydrophobicContact CE1-CB 4.37Å; F91-V156 HydrophobicContact CD1-CB 4.09Å; F91-V156 HydrophobicContact CD1-CG1 4.2Å; F91-V156 HydrophobicContact CD1-CG2 3.8Å; F91-V156 HydrophobicContact CE1-CB 4.44Å; F91-V156 HydrophobicContact CE1-CG2 4.04Å
92	W	98.6	Very high	97.3	Very high	47 Å²	47	56.7 Å²	56.7	18%	0.178	27%	0.268	C	S	.	.	H	α-helix	trans	-56.6	-45.4	-178.2	-175	91.9	0	0	0	112.2	L67 N88 I89 C95 E96 Q153 Y157 M160	L67-W92 HydrophobicContact CB-CH2 4.43Å; L67-W92 HydrophobicContact CB-CZ3 4.41Å; L67-W92 HydrophobicContact CD1-CD2 4.21Å; L67-W92 HydrophobicContact CD1-CE3 4Å; L67-W92 HydrophobicContact CD1-CH2 3.94Å; L67-W92 HydrophobicContact CD1-CZ2 4.13Å; L67-W92 HydrophobicContact CD1-CZ3 3.86Å; N88-W92 WeakPolarHBondContact O-CB 3.41Å; N88-W92 PolarHBondContact O-N 2.91Å; I89-W92 HydrophobicContact CD1-CE3 4.18Å; I89-W92 PolarHBondContact O-N 3.4Å; W92-C95 WeakPolarHBondContact O-CB 3.33Å; W92-C95 PolarHBondContact O-N 3.25Å; W92-E96 HydrophobicContact CD2-CG 4.37Å; W92-E96 HydrophobicContact CE3-CG 4.16Å; W92-E96 HydrophobicContact CH2-CG 3.87Å; W92-E96 HydrophobicContact CZ2-CG 4.08Å; W92-E96 HydrophobicContact CZ3-CG 3.91Å; W92-E96 PolarHBondContact O-N 3.47Å; W92-E96 VanDerWaalsContact O-N 3.12Å; W92-Q153 VanDerWaalsContact CD1-CG 3.41Å; W92-Q153 HydrophobicContact CG-CG 4.17Å; W92-Q153 PolarHBondContact O-NE2 2.65Å; W92-Y157 AromaticContact NE1-CD2 3.58Å; W92-M160 HydrophobicContact CB-CE 4.1Å; W92-M160 HydrophobicContact CG-CE 4.3Å
93	L	98.2	Very high	97.5	Very high	29 Å²	29	55.3 Å²	55.3	15%	0.152	26%	0.258	C	S	.	.	H	α-helix	trans	-68.5	-36.4	177	-69.7	169.1	0	0	0	112.6	L73 I89 F91 C95 E96 E97	L73-L93 HydrophobicContact CD1-CD1 3.89Å; L73-L93 HydrophobicContact CD2-CD1 4Å; L73-L93 HydrophobicContact CD2-CD2 4.12Å; L73-L93 HydrophobicContact CG-CD1 4.47Å; I89-L93 HydrophobicContact CD1-CD1 4.24Å; I89-L93 HydrophobicContact CD1-CG 4.21Å; I89-L93 HydrophobicContact CG1-CD1 3.99Å; I89-L93 HydrophobicContact CG1-CG 4.43Å; I89-L93 WeakPolarHBondContact O-CB 3.42Å; I89-L93 VanDerWaalsContact O-CG 3.31Å; I89-L93 WeakPolarHBondContact O-CG 3.29Å; I89-L93 PolarHBondContact O-N 3.33Å; F91-L93 VanDerWaalsContact C-N 3.33Å; F91-L93 PolarHBondContact O-N 3.49Å; L93-C95 VanDerWaalsContact C-N 3.25Å; L93-C95 PolarHBondContact O-N 3.45Å; L93-E96 PolarHBondContact O-N 3Å; L93-E97 PolarHBondContact O-N 3.03Å
94	T	98.4	Very high	97.5	Very high	25 Å²	25	57 Å²	57	15%	0.153	28%	0.277	C	S	.	.	H	α-helix	trans	-62.8	-35.8	175.4	-59.2	0	0	0	0	111.1	E90 F91 Y98 I114 F118	E90-T94 VanDerWaalsContact O-CB 3.29Å; E90-T94 WeakPolarHBondContact O-CB 3.4Å; E90-T94 PolarHBondContact O-N 3.35Å; E90-T94 PolarHBondContact O-OG1 3.41Å; F91-T94 WeakPolarHBondContact O-CB 3.4Å; F91-T94 PolarHBondContact O-N 3.45Å; T94-Y98 VanDerWaalsContact O-CB 3.28Å; T94-Y98 WeakPolarHBondContact O-CB 3.42Å; T94-Y98 PolarHBondContact O-N 3.05Å; T94-I114 HydrophobicContact CG2-CD1 3.82Å; T94-I114 HydrophobicContact CG2-CG1 3.57Å; T94-F118 HydrophobicContact CG2-CE2 4.35Å
95	C	98.4	Very high	97.7	Very high	1 Å²	1	56.4 Å²	56.4	1%	0.007	28%	0.275	C	S	.	.	H	α-helix	trans	-65.8	-42.6	172	-68.4	0	0	0	0	112.2	F91 W92 L93 E97 Y98 K99 Q153	F91-C95 VanDerWaalsContact CE2-SG 3.58Å; F91-C95 WeakPolarHBondContact CZ-SG 3.36Å; F91-C95 PolarHBondContact O-N 3.45Å; F91-C95 PolarHBondContact O-SG 3.44Å; W92-C95 WeakPolarHBondContact O-CB 3.33Å; W92-C95 PolarHBondContact O-N 3.25Å; L93-C95 VanDerWaalsContact C-N 3.25Å; L93-C95 PolarHBondContact O-N 3.45Å; C95-E97 VanDerWaalsContact C-N 3.32Å; C95-E97 PolarHBondContact O-N 3.46Å; C95-Y98 WeakPolarHBondContact O-CB 3.36Å; C95-Y98 PolarHBondContact O-N 2.92Å; C95-Y98 VanDerWaalsContact O-N 3.12Å; C95-K99 WeakPolarHBondContact O-CG 3.41Å; C95-K99 PolarHBondContact O-N 3.29Å; C95-Q153 HydrophobicContact CB-CB 4.29Å; C95-Q153 HydrophobicContact CB-CG 3.93Å
96	E	97.9	Very high	97.7	Very high	57 Å²	57	63.5 Å²	63.5	27%	0.266	30%	0.299	S	S	.	.	H	α-helix	trans	-62.3	-37.5	175.6	-71.7	-56.2	105.8	0	0	112.8	W92 L93 K99 K100 Q153	W92-E96 HydrophobicContact CD2-CG 4.37Å; W92-E96 HydrophobicContact CE3-CG 4.16Å; W92-E96 HydrophobicContact CH2-CG 3.87Å; W92-E96 HydrophobicContact CZ2-CG 4.08Å; W92-E96 HydrophobicContact CZ3-CG 3.91Å; W92-E96 PolarHBondContact O-N 3.47Å; W92-E96 VanDerWaalsContact O-N 3.12Å; L93-E96 PolarHBondContact O-N 3Å; E96-K99 IonicContact OE1-NZ 2.65Å; E96-K99 PolarHBondContact OE1-NZ 3.49Å; E96-K100 WeakPolarHBondContact O-CE 3.42Å; E96-K100 WeakPolarHBondContact O-CG 3.28Å; E96-Q153 PolarHBondContact OE1-NE2 3.07Å
97	E	97.4	Very high	97.7	Very high	107 Å²	107	63.2 Å²	63.2	50%	0.5	30%	0.297	S	S	.	.	H	α-helix	trans	-66.9	-42.1	170.8	-70.2	179.9	174.6	0	0	112.4	L93 C95 K99 K100 K110	L93-E97 PolarHBondContact O-N 3.03Å; C95-E97 VanDerWaalsContact C-N 3.32Å; C95-E97 PolarHBondContact O-N 3.46Å; E97-K99 VanDerWaalsContact C-N 3.32Å; E97-K99 PolarHBondContact O-N 3.28Å; E97-K100 WeakPolarHBondContact O-CB 3.46Å; E97-K100 PolarHBondContact O-N 2.93Å; E97-K100 VanDerWaalsContact O-N 3.1Å; E97-K110 IonicContact OE2-NZ 2.97Å; E97-K110 PolarHBondContact OE2-NZ 3.49Å
98	Y	98.4	Very high	97.7	Very high	2 Å²	2	63 Å²	63	1%	0.008	30%	0.3	C	S	.	.	H	α-helix	trans	-60.4	-41.8	-177.9	173.8	-93.7	0	0	0	111.8	T94 C95 K100 I101 M107 K110 A111 I114 P144 T145 C148 F149	T94-Y98 VanDerWaalsContact O-CB 3.28Å; T94-Y98 WeakPolarHBondContact O-CB 3.42Å; T94-Y98 PolarHBondContact O-N 3.05Å; C95-Y98 WeakPolarHBondContact O-CB 3.36Å; C95-Y98 PolarHBondContact O-N 2.92Å; C95-Y98 VanDerWaalsContact O-N 3.12Å; Y98-K100 PolarHBondContact O-N 3.32Å; Y98-K100 VanDerWaalsContact O-N 3.11Å; Y98-I101 HydrophobicContact CD2-CD1 4.16Å; Y98-I101 WeakPolarHBondContact O-CB 3.24Å; Y98-I101 WeakPolarHBondContact O-CG1 3.35Å; Y98-I101 PolarHBondContact O-N 2.98Å; Y98-M107 HydrophobicContact CE2-CG 3.7Å; Y98-M107 WeakPolarHBondContact OH-CG 3.33Å; Y98-K110 HydrophobicContact CD2-CB 4.12Å; Y98-K110 HydrophobicContact CD2-CG 3.87Å; Y98-A111 HydrophobicContact CE2-CB 3.85Å; Y98-I114 HydrophobicContact CD2-CD1 3.77Å; Y98-I114 HydrophobicContact CG-CD1 3.95Å; Y98-P144 VanDerWaalsContact OH-CB 3.3Å; Y98-P144 WeakPolarHBondContact OH-CB 3.46Å; Y98-T145 WeakPolarHBondContact CE1-O 3.45Å; Y98-T145 PolarHBondContact OH-O 3.42Å; Y98-C148 HydrophobicContact CE1-CB 4.21Å; Y98-F149 AromaticContact CD1-CD2 3.81Å; Y98-F149 HydrophobicContact CD1-CD2 3.81Å; Y98-F149 HydrophobicContact CD1-CE2 4.11Å; Y98-F149 HydrophobicContact CD2-CE2 4.12Å; Y98-F149 AromaticContact CE1-CD2 3.78Å; Y98-F149 HydrophobicContact CE1-CD2 3.78Å; Y98-F149 AromaticContact CE1-CE2 3.88Å; Y98-F149 HydrophobicContact CE1-CE2 3.88Å; Y98-F149 AromaticContact CE2-CE2 3.9Å; Y98-F149 HydrophobicContact CE2-CE2 3.9Å; Y98-F149 HydrophobicContact CG-CD2 4.21Å; Y98-F149 HydrophobicContact CG-CE2 4.23Å; Y98-F149 AromaticContact CZ-CE2 3.77Å
99	K	97.9	Very high	97.7	Very high	75 Å²	75	65.1 Å²	65.1	33%	0.326	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-18.3	176.6	-70.4	174.7	-171.5	167.3	0	114.1	C95 E96 E97 L146 D150	C95-K99 WeakPolarHBondContact O-CG 3.41Å; C95-K99 PolarHBondContact O-N 3.29Å; E96-K99 IonicContact OE1-NZ 2.65Å; E96-K99 PolarHBondContact OE1-NZ 3.49Å; E97-K99 VanDerWaalsContact C-N 3.32Å; E97-K99 PolarHBondContact O-N 3.28Å; K99-L146 WeakPolarHBondContact O-CD2 3.49Å; K99-D150 VanDerWaalsContact CE-OD1 3.27Å; K99-D150 WeakPolarHBondContact CE-OD1 3.46Å; K99-D150 IonicContact NZ-OD1 2.74Å
100	K	97.4	Very high	97.7	Very high	159 Å²	159	67.8 Å²	67.8	69%	0.691	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	-6.5	178.4	-60.7	169.6	-171.5	175.6	0	112.6	E96 E97 Y98 K102	E96-K100 WeakPolarHBondContact O-CE 3.42Å; E96-K100 WeakPolarHBondContact O-CG 3.28Å; E97-K100 WeakPolarHBondContact O-CB 3.46Å; E97-K100 PolarHBondContact O-N 2.93Å; E97-K100 VanDerWaalsContact O-N 3.1Å; Y98-K100 PolarHBondContact O-N 3.32Å; Y98-K100 VanDerWaalsContact O-N 3.11Å; K100-K102 PolarHBondContact O-N 3.42Å
101	I	97.4	Very high	97.7	Very high	19 Å²	19	65.4 Å²	65.4	10%	0.097	32%	0.316	C	S	.	.			trans	-78.3	119.4	-176.9	-60.2	175.1	0	0	0	110.7	Y98 S103 R106 M107 K110	Y98-I101 HydrophobicContact CD2-CD1 4.16Å; Y98-I101 WeakPolarHBondContact O-CB 3.24Å; Y98-I101 WeakPolarHBondContact O-CG1 3.35Å; Y98-I101 PolarHBondContact O-N 2.98Å; I101-S103 WeakPolarHBondContact CG2-O 3.46Å; I101-R106 HydrophobicContact CG2-CB 3.75Å; I101-M107 HydrophobicContact CG2-CB 3.98Å; I101-M107 VanDerWaalsContact O-CE 3.24Å; I101-M107 WeakPolarHBondContact O-CE 3.4Å; I101-K110 HydrophobicContact CD1-CB 3.72Å; I101-K110 HydrophobicContact CD1-CG 3.8Å
102	K	95.1	Very high	97.7	Very high	210 Å²	210	71.4 Å²	71.4	91%	0.913	34%	0.342	S	S	*	.			trans	-93.6	-25	176.1	-59.3	-176.6	179.5	-178	0	114.1	K100	K100-K102 PolarHBondContact O-N 3.42Å
103	S	97.5	Very high	97.7	Very high	52 Å²	52	75.8 Å²	75.8	36%	0.364	36%	0.362	S	S	.	.			trans	-82.5	121.8	-177.7	168.8	0	0	0	0	111	I101 F105 R106 M107	I101-S103 WeakPolarHBondContact CG2-O 3.46Å; S103-F105 VanDerWaalsContact C-N 3.31Å; S103-F105 PolarHBondContact O-N 3Å; S103-R106 PolarHBondContact O-N 3.12Å; S103-R106 PolarHBondContact OG-N 3.4Å; S103-M107 WeakPolarHBondContact O-CB 3.39Å; S103-M107 PolarHBondContact O-N 2.91Å
104	S	96.1	Very high	97.7	Very high	99 Å²	99	74.6 Å²	74.6	69%	0.692	36%	0.356	S	S	*	.	H	α-helix	trans	-55.8	-42.8	177.4	175.9	0	0	0	0	112.6	R106 M107 S108	S104-R106 PolarHBondContact O-N 3.09Å; S104-M107 WeakPolarHBondContact O-CB 3.31Å; S104-M107 PolarHBondContact O-N 3.29Å; S104-S108 PolarHBondContact O-N 3.16Å
105	F	96.6	Very high	97.7	Very high	169 Å²	169	74.9 Å²	74.9	74%	0.741	35%	0.354	S	S	*	.	H	α-helix	trans	-60.9	-47.8	176.4	177	-100.7	0	0	0	112.3	S103 M107 S108 S109	S103-F105 VanDerWaalsContact C-N 3.31Å; S103-F105 PolarHBondContact O-N 3Å; F105-M107 VanDerWaalsContact C-N 3.31Å; F105-M107 PolarHBondContact O-N 3.28Å; F105-S108 PolarHBondContact O-N 2.72Å; F105-S109 PolarHBondContact O-N 2.65Å
106	R	97.3	Very high	97.7	Very high	162 Å²	162	79.2 Å²	79.2	61%	0.611	38%	0.375	S	S	*	.	H	α-helix	trans	-65.2	-37	177.6	-68.3	-173.9	65.4	-161	-2.1	111.8	I101 S103 S104 S109 K110	I101-R106 HydrophobicContact CG2-CB 3.75Å; S103-R106 PolarHBondContact O-N 3.12Å; S103-R106 PolarHBondContact OG-N 3.4Å; S104-R106 PolarHBondContact O-N 3.09Å; R106-S109 PolarHBondContact O-N 2.74Å; R106-K110 WeakPolarHBondContact O-CB 3.39Å; R106-K110 PolarHBondContact O-N 3.16Å
107	M	98	Very high	97.8	Very high	21 Å²	21	80 Å²	80	10%	0.103	38%	0.378	C	S	.	.	H	α-helix	trans	-62.8	-50.2	177.5	-174.4	-179.9	-63.5	0	0	110.2	Y98 I101 S103 S104 F105 S109 K110 A111 P144 L146	Y98-M107 HydrophobicContact CE2-CG 3.7Å; Y98-M107 WeakPolarHBondContact OH-CG 3.33Å; I101-M107 HydrophobicContact CG2-CB 3.98Å; I101-M107 VanDerWaalsContact O-CE 3.24Å; I101-M107 WeakPolarHBondContact O-CE 3.4Å; S103-M107 WeakPolarHBondContact O-CB 3.39Å; S103-M107 PolarHBondContact O-N 2.91Å; S104-M107 WeakPolarHBondContact O-CB 3.31Å; S104-M107 PolarHBondContact O-N 3.29Å; F105-M107 VanDerWaalsContact C-N 3.31Å; F105-M107 PolarHBondContact O-N 3.28Å; M107-S109 VanDerWaalsContact C-N 3.33Å; M107-S109 PolarHBondContact O-N 3.26Å; M107-K110 PolarHBondContact O-N 3.46Å; M107-A111 VanDerWaalsContact O-CB 3.26Å; M107-A111 WeakPolarHBondContact O-CB 3.34Å; M107-A111 PolarHBondContact O-N 3.03Å; M107-P144 HydrophobicContact CG-CB 4.26Å; M107-P144 HydrophobicContact CG-CG 4.49Å; M107-L146 HydrophobicContact CE-CD2 3.41Å; M107-L146 VanDerWaalsContact CE-CD2 3.41Å; M107-L146 HydrophobicContact CE-CG 4Å
108	S	97.9	Very high	97.8	Very high	34 Å²	34	75.3 Å²	75.3	24%	0.238	36%	0.356	C	S	.	.	H	α-helix	trans	-58.8	-43.7	176.3	-171.4	0	0	0	0	112.5	S104 F105 K112	S104-S108 PolarHBondContact O-N 3.16Å; F105-S108 PolarHBondContact O-N 2.72Å; S108-K112 WeakPolarHBondContact O-CG 3.47Å; S108-K112 PolarHBondContact O-N 3.43Å
109	S	98	Very high	97.8	Very high	50 Å²	50	75.2 Å²	75.2	35%	0.35	36%	0.356	S	S	.	.	H	α-helix	trans	-63.3	-46.8	176.8	-172.3	0	0	0	0	112.6	F105 R106 M107 K113	F105-S109 PolarHBondContact O-N 2.65Å; R106-S109 PolarHBondContact O-N 2.74Å; M107-S109 VanDerWaalsContact C-N 3.33Å; M107-S109 PolarHBondContact O-N 3.26Å; S109-K113 WeakPolarHBondContact O-CG 3.4Å; S109-K113 PolarHBondContact O-N 3.28Å
110	K	98.3	Very high	97.8	Very high	56 Å²	56	75.8 Å²	75.8	24%	0.243	36%	0.358	C	S	.	.	H	α-helix	trans	-69.3	-38.8	180	-173.5	80.3	165.9	-172.9	0	111.3	E97 Y98 I101 R106 M107 K112 K113 I114	E97-K110 IonicContact OE2-NZ 2.97Å; E97-K110 PolarHBondContact OE2-NZ 3.49Å; Y98-K110 HydrophobicContact CD2-CB 4.12Å; Y98-K110 HydrophobicContact CD2-CG 3.87Å; I101-K110 HydrophobicContact CD1-CB 3.72Å; I101-K110 HydrophobicContact CD1-CG 3.8Å; R106-K110 WeakPolarHBondContact O-CB 3.39Å; R106-K110 PolarHBondContact O-N 3.16Å; M107-K110 PolarHBondContact O-N 3.46Å; K110-K112 PolarHBondContact O-N 3.36Å; K110-K113 PolarHBondContact O-N 2.86Å; K110-I114 HydrophobicContact CG-CD1 3.95Å; K110-I114 HydrophobicContact CG-CG1 4.4Å; K110-I114 VanDerWaalsContact O-CG1 3.31Å; K110-I114 WeakPolarHBondContact O-CG1 3.47Å; K110-I114 PolarHBondContact O-N 3.27Å
111	A	98.6	Very high	97.7	Very high	0 Å²	0	71 Å²	71	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-59	-45.7	176.9	0	0	0	0	0	111.8	Y98 M107 K113 I114 Y115 V141 P144 F149	Y98-A111 HydrophobicContact CE2-CB 3.85Å; M107-A111 VanDerWaalsContact O-CB 3.26Å; M107-A111 WeakPolarHBondContact O-CB 3.34Å; M107-A111 PolarHBondContact O-N 3.03Å; A111-K113 VanDerWaalsContact C-N 3.35Å; A111-K113 PolarHBondContact O-N 3.4Å; A111-I114 PolarHBondContact O-N 3.28Å; A111-Y115 WeakPolarHBondContact O-CB 3.41Å; A111-Y115 PolarHBondContact O-N 2.99Å; A111-V141 HydrophobicContact CB-CG1 4.39Å; A111-P144 HydrophobicContact CB-CB 3.76Å; A111-P144 HydrophobicContact CB-CG 4.06Å; A111-F149 HydrophobicContact CB-CE2 4.2Å; A111-F149 HydrophobicContact CB-CZ 4.09Å
112	K	98.3	Very high	97.6	Very high	125 Å²	125	78.9 Å²	78.9	54%	0.543	39%	0.385	S	S	.	.	H	α-helix	trans	-60.5	-42.9	174.9	-70.9	175.2	-176.6	179.7	0	112.1	S108 K110 Y115 E116	S108-K112 WeakPolarHBondContact O-CG 3.47Å; S108-K112 PolarHBondContact O-N 3.43Å; K110-K112 PolarHBondContact O-N 3.36Å; K112-Y115 PolarHBondContact O-N 3.43Å; K112-E116 WeakPolarHBondContact O-CG 3.49Å; K112-E116 PolarHBondContact O-N 2.81Å
113	K	98.5	Very high	97.8	Very high	140 Å²	140	69.5 Å²	69.5	61%	0.609	35%	0.346	S	S	*	.	H	α-helix	trans	-63.6	-43.8	177.1	-71.8	178.5	179.1	-175.2	0	112.3	S109 K110 A111 Y115 H117	S109-K113 WeakPolarHBondContact O-CG 3.4Å; S109-K113 PolarHBondContact O-N 3.28Å; K110-K113 PolarHBondContact O-N 2.86Å; A111-K113 VanDerWaalsContact C-N 3.35Å; A111-K113 PolarHBondContact O-N 3.4Å; K113-Y115 VanDerWaalsContact C-N 3.3Å; K113-Y115 PolarHBondContact O-N 2.99Å; K113-H117 WeakPolarHBondContact O-CB 3.31Å; K113-H117 PolarHBondContact O-N 3.29Å
114	I	98.7	Very high	97.8	Very high	3 Å²	3	72 Å²	72	2%	0.015	36%	0.361	C	S	.	.	H	α-helix	trans	-60.4	-44.9	176	-67.6	166.6	0	0	0	109.8	F91 T94 Y98 K110 A111 H117 F118 I119 F149	F91-I114 HydrophobicContact CD2-CG2 4.23Å; F91-I114 HydrophobicContact CE2-CG2 3.77Å; T94-I114 HydrophobicContact CG2-CD1 3.82Å; T94-I114 HydrophobicContact CG2-CG1 3.57Å; Y98-I114 HydrophobicContact CD2-CD1 3.77Å; Y98-I114 HydrophobicContact CG-CD1 3.95Å; K110-I114 HydrophobicContact CG-CD1 3.95Å; K110-I114 HydrophobicContact CG-CG1 4.4Å; K110-I114 VanDerWaalsContact O-CG1 3.31Å; K110-I114 WeakPolarHBondContact O-CG1 3.47Å; K110-I114 PolarHBondContact O-N 3.27Å; A111-I114 PolarHBondContact O-N 3.28Å; I114-H117 PolarHBondContact O-N 3.41Å; I114-F118 HydrophobicContact CG2-CD2 4.29Å; I114-F118 PolarHBondContact O-N 2.64Å; I114-I119 HydrophobicContact CG2-CG1 4.47Å; I114-F149 HydrophobicContact CB-CE1 4.09Å; I114-F149 HydrophobicContact CB-CE2 4.19Å; I114-F149 HydrophobicContact CB-CZ 3.74Å; I114-F149 HydrophobicContact CD1-CD2 4.12Å; I114-F149 HydrophobicContact CD1-CE2 3.68Å; I114-F149 HydrophobicContact CD1-CZ 4.14Å; I114-F149 HydrophobicContact CG2-CD1 3.86Å; I114-F149 HydrophobicContact CG2-CD2 4.41Å; I114-F149 HydrophobicContact CG2-CE1 3.49Å; I114-F149 VanDerWaalsContact CG2-CE1 3.49Å; I114-F149 HydrophobicContact CG2-CE2 4.1Å; I114-F149 HydrophobicContact CG2-CG 4.3Å; I114-F149 HydrophobicContact CG2-CZ 3.63Å
115	Y	98.7	Very high	97.8	Very high	31 Å²	31	69.8 Å²	69.8	12%	0.122	34%	0.339	C	S	.	.	I	π-helix	trans	-59.1	-53.5	179	-177.9	-98	0	0	0	112.6	A111 K112 K113 H117 I119 K120 I137 K138 V141	A111-Y115 WeakPolarHBondContact O-CB 3.41Å; A111-Y115 PolarHBondContact O-N 2.99Å; K112-Y115 PolarHBondContact O-N 3.43Å; K113-Y115 VanDerWaalsContact C-N 3.3Å; K113-Y115 PolarHBondContact O-N 2.99Å; Y115-H117 VanDerWaalsContact C-N 3.27Å; Y115-H117 PolarHBondContact O-N 2.85Å; Y115-I119 HydrophobicContact CD2-CB 3.72Å; Y115-I119 HydrophobicContact CD2-CG1 4.48Å; Y115-I119 HydrophobicContact CD2-CG2 3.67Å; Y115-I119 HydrophobicContact CE2-CB 4.17Å; Y115-I119 HydrophobicContact CE2-CG2 3.74Å; Y115-I119 HydrophobicContact CG-CB 4.39Å; Y115-I119 CarbonylContact O-C 3.59Å; Y115-I119 WeakPolarHBondContact O-CA 3.43Å; Y115-I119 PolarHBondContact O-N 2.59Å; Y115-K120 HydrophobicContact CD1-CB 4.36Å; Y115-K120 HydrophobicContact CE1-CB 3.98Å; Y115-K120 HydrophobicContact CE1-CD 4.43Å; Y115-K120 HydrophobicContact CE1-CG 4.2Å; Y115-K120 PolarHBondContact O-N 3.48Å; Y115-I137 HydrophobicContact CD2-CG2 4.22Å; Y115-K138 HydrophobicContact CE2-CB 3.77Å; Y115-K138 HydrophobicContact CE2-CG 4.16Å; Y115-K138 WeakPolarHBondContact OH-CG 3.37Å; Y115-V141 HydrophobicContact CD2-CG1 4.43Å; Y115-V141 HydrophobicContact CD2-CG2 4.17Å; Y115-V141 HydrophobicContact CG-CG2 4.24Å
116	E	98.5	Very high	97.9	Very high	93 Å²	93	65.2 Å²	65.2	44%	0.435	32%	0.32	S	S	.	.	I	π-helix	trans	-66.8	-27.6	-178.3	-66.6	-64.6	140.6	0	0	113.1	K112 K120 A123	K112-E116 WeakPolarHBondContact O-CG 3.49Å; K112-E116 PolarHBondContact O-N 2.81Å; E116-K120 IonicContact OE1-NZ 3.93Å; E116-K120 WeakPolarHBondContact OE2-CD 3.42Å; E116-K120 IonicContact OE2-NZ 2.78Å; E116-K120 PolarHBondContact OE2-NZ 2.8Å; E116-A123 WeakPolarHBondContact O-CB 3.46Å
117	H	98.4	Very high	97.9	Very high	72 Å²	72	57.6 Å²	57.6	33%	0.333	29%	0.291	S	S	.	.	I	π-helix	trans	-90.7	-34.1	-174.8	-161.5	73.5	0	0	0	113.9	K113 I114 Y115 A123 K125	K113-H117 WeakPolarHBondContact O-CB 3.31Å; K113-H117 PolarHBondContact O-N 3.29Å; I114-H117 PolarHBondContact O-N 3.41Å; Y115-H117 VanDerWaalsContact C-N 3.27Å; Y115-H117 PolarHBondContact O-N 2.85Å; H117-A123 WeakPolarHBondContact O-CB 3.4Å; H117-K125 CarbonylContact O-C 3.41Å; H117-K125 WeakPolarHBondContact O-CA 3.42Å; H117-K125 PolarHBondContact O-N 2.96Å; H117-K125 VanDerWaalsContact O-N 3.11Å
118	F	98.6	Very high	97.8	Very high	9 Å²	9	62.2 Å²	62.2	4%	0.039	32%	0.317	C	S	.	.	I	π-helix	trans	-122.4	-30.4	-173	-61.7	-78.1	0	0	0	114.4	E90 F91 T94 I114 K125 E126 I127	E90-F118 HydrophobicContact CB-CE1 4.07Å; E90-F118 HydrophobicContact CB-CZ 4.06Å; F91-F118 HydrophobicContact CB-CD1 3.69Å; F91-F118 HydrophobicContact CB-CE1 3.85Å; F91-F118 HydrophobicContact CB-CG 4.05Å; F91-F118 HydrophobicContact CB-CZ 4.33Å; F91-F118 HydrophobicContact CD2-CB 3.61Å; F91-F118 HydrophobicContact CD2-CD1 4.19Å; F91-F118 AromaticContact CD2-CD2 3.87Å; F91-F118 HydrophobicContact CD2-CD2 3.87Å; F91-F118 AromaticContact CD2-CG 3.65Å; F91-F118 HydrophobicContact CD2-CG 3.65Å; F91-F118 HydrophobicContact CE2-CB 4.21Å; F91-F118 HydrophobicContact CG-CB 4.39Å; F91-F118 HydrophobicContact CG-CD1 4.37Å; F91-F118 HydrophobicContact CG-CG 4.28Å; T94-F118 HydrophobicContact CG2-CE2 4.35Å; I114-F118 HydrophobicContact CG2-CD2 4.29Å; I114-F118 PolarHBondContact O-N 2.64Å; F118-K125 WeakPolarHBondContact CA-O 3.09Å; F118-K125 HydrophobicContact CD1-CB 3.91Å; F118-K125 VanDerWaalsContact CD1-O 3.29Å; F118-K125 WeakPolarHBondContact CD1-O 3.26Å; F118-K125 HydrophobicContact CE1-CB 3.95Å; F118-K125 HydrophobicContact CE1-CD 4.37Å; F118-E126 WeakPolarHBondContact O-CA 3.2Å; F118-I127 HydrophobicContact CB-CG2 4.26Å; F118-I127 HydrophobicContact CD1-CG2 4.14Å; F118-I127 WeakPolarHBondContact O-CG1 3.34Å; F118-I127 PolarHBondContact O-N 3.43Å
119	I	98.4	Very high	97.8	Very high	0 Å²	0	61 Å²	61	0%	0	31%	0.307	C	S	.	.	I	π-helix	trans	-103.4	-35.8	-166.1	-52.4	-60.6	0	0	0	113.1	F91 I114 Y115 I127 I129 R134 I137 F149	F91-I119 HydrophobicContact CE2-CD1 3.7Å; F91-I119 HydrophobicContact CE2-CG1 4.49Å; F91-I119 HydrophobicContact CZ-CD1 3.95Å; I114-I119 HydrophobicContact CG2-CG1 4.47Å; Y115-I119 HydrophobicContact CD2-CB 3.72Å; Y115-I119 HydrophobicContact CD2-CG1 4.48Å; Y115-I119 HydrophobicContact CD2-CG2 3.67Å; Y115-I119 HydrophobicContact CE2-CB 4.17Å; Y115-I119 HydrophobicContact CE2-CG2 3.74Å; Y115-I119 HydrophobicContact CG-CB 4.39Å; Y115-I119 CarbonylContact O-C 3.59Å; Y115-I119 WeakPolarHBondContact O-CA 3.43Å; Y115-I119 PolarHBondContact O-N 2.59Å; I119-I127 HydrophobicContact CD1-CD1 3.62Å; I119-I127 HydrophobicContact CD1-CG1 4.15Å; I119-I129 HydrophobicContact CD1-CD1 4.11Å; I119-I129 HydrophobicContact CG2-CD1 4.23Å; I119-R134 HydrophobicContact CG2-CG 3.94Å; I119-R134 WeakPolarHBondContact O-CD 3.4Å; I119-R134 WeakPolarHBondContact O-CG 3.4Å; I119-R134 PolarHBondContact O-NH1 2.74Å; I119-I137 HydrophobicContact CD1-CD1 4.01Å; I119-I137 HydrophobicContact CG1-CG2 4.19Å; I119-I137 HydrophobicContact CG2-CB 4.09Å; I119-I137 HydrophobicContact CG2-CD1 4.25Å; I119-I137 HydrophobicContact CG2-CG2 3.89Å; I119-F149 HydrophobicContact CG1-CE1 4.36Å
120	K	97.5	Very high	97.7	Very high	88 Å²	88	63.2 Å²	63.2	38%	0.383	32%	0.315	S	S	.	.	S	Bend	trans	-62.2	145.6	-178.5	-172.2	-179.4	177.5	-175.6	0	109.9	Y115 E116 E122 A123 R134	Y115-K120 HydrophobicContact CD1-CB 4.36Å; Y115-K120 HydrophobicContact CE1-CB 3.98Å; Y115-K120 HydrophobicContact CE1-CD 4.43Å; Y115-K120 HydrophobicContact CE1-CG 4.2Å; Y115-K120 PolarHBondContact O-N 3.48Å; E116-K120 IonicContact OE1-NZ 3.93Å; E116-K120 WeakPolarHBondContact OE2-CD 3.42Å; E116-K120 IonicContact OE2-NZ 2.78Å; E116-K120 PolarHBondContact OE2-NZ 2.8Å; K120-E122 PolarHBondContact O-N 3Å; K120-A123 HydrophobicContact CB-CB 4.27Å; K120-A123 WeakPolarHBondContact O-CB 3.27Å; K120-A123 PolarHBondContact O-N 2.81Å; K120-A123 VanDerWaalsContact O-N 3.11Å; K120-R134 PolarHBondContact O-NH1 3.2Å
121	A	95.9	Very high	97.7	Very high	58 Å²	58	68.9 Å²	68.9	48%	0.479	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	136.7	171.9	0	0	0	0	0	109.1	A123	A121-A123 PolarHBondContact O-N 3.24Å
122	E	95.8	Very high	97.6	Very high	185 Å²	185	74.3 Å²	74.3	86%	0.864	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.3	22.9	-176.5	-48.2	176.8	145.1	0	0	113.1	K120 E126	K120-E122 PolarHBondContact O-N 3Å; E122-E126 WeakPolarHBondContact CA-OE2 3.21Å; E122-E126 PolarHBondContact N-OE2 2.86Å
123	A	97.6	Very high	97.6	Very high	12 Å²	12	68.9 Å²	68.9	10%	0.099	34%	0.338	C	S	.	.			trans	-63.1	147.4	171.8	0	0	0	0	0	110.4	E116 H117 K120 A121 K125 E126	E116-A123 WeakPolarHBondContact O-CB 3.46Å; H117-A123 WeakPolarHBondContact O-CB 3.4Å; K120-A123 HydrophobicContact CB-CB 4.27Å; K120-A123 WeakPolarHBondContact O-CB 3.27Å; K120-A123 PolarHBondContact O-N 2.81Å; K120-A123 VanDerWaalsContact O-N 3.11Å; A121-A123 PolarHBondContact O-N 3.24Å; A123-K125 PolarHBondContact O-N 3.47Å; A123-K125 VanDerWaalsContact O-N 3.08Å; A123-E126 HydrophobicContact CB-CB 4.09Å; A123-E126 WeakPolarHBondContact O-CB 3.34Å; A123-E126 PolarHBondContact O-N 3.17Å; A123-E126 VanDerWaalsContact O-N 3.08Å
124	P	97.2	Very high	97.6	Very high	105 Å²	105	64 Å²	64	68%	0.682	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-25.9	-175.3	24.6	-36.2	0	0	0	113.9
125	K	97.6	Very high	97.5	Very high	53 Å²	53	65.7 Å²	65.7	23%	0.23	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-128.9	44.6	174.4	-71	-153.7	171.5	-161.9	0	110.5	D86 E87 E90 H117 F118 A123 I127	D86-K125 IonicContact OD2-NZ 2.69Å; D86-K125 PolarHBondContact OD2-NZ 3.5Å; E87-K125 HydrophobicContact CB-CB 3.84Å; E87-K125 HydrophobicContact CB-CD 4.24Å; E87-K125 HydrophobicContact CB-CG 4.39Å; E90-K125 IonicContact OE1-NZ 3.11Å; E90-K125 PolarHBondContact OE1-NZ 3.27Å; E90-K125 WeakPolarHBondContact OE2-CD 3.24Å; E90-K125 WeakPolarHBondContact OE2-CE 3.39Å; E90-K125 IonicContact OE2-NZ 2.89Å; E90-K125 PolarHBondContact OE2-NZ 2.98Å; H117-K125 CarbonylContact O-C 3.41Å; H117-K125 WeakPolarHBondContact O-CA 3.42Å; H117-K125 PolarHBondContact O-N 2.96Å; H117-K125 VanDerWaalsContact O-N 3.11Å; F118-K125 WeakPolarHBondContact CA-O 3.09Å; F118-K125 HydrophobicContact CD1-CB 3.91Å; F118-K125 VanDerWaalsContact CD1-O 3.29Å; F118-K125 WeakPolarHBondContact CD1-O 3.26Å; F118-K125 HydrophobicContact CE1-CB 3.95Å; F118-K125 HydrophobicContact CE1-CD 4.37Å; A123-K125 PolarHBondContact O-N 3.47Å; A123-K125 VanDerWaalsContact O-N 3.08Å; K125-I127 PolarHBondContact O-N 2.91Å
126	E	98	Very high	97.5	Very high	72 Å²	72	68.1 Å²	68.1	34%	0.336	34%	0.337	S	S	.	.			trans	-53.2	124.6	-179.3	-176.4	175.6	178.8	0	0	112.2	F118 E122 A123 R134	F118-E126 WeakPolarHBondContact O-CA 3.2Å; E122-E126 WeakPolarHBondContact CA-OE2 3.21Å; E122-E126 PolarHBondContact N-OE2 2.86Å; A123-E126 HydrophobicContact CB-CB 4.09Å; A123-E126 WeakPolarHBondContact O-CB 3.34Å; A123-E126 PolarHBondContact O-N 3.17Å; A123-E126 VanDerWaalsContact O-N 3.08Å; E126-R134 IonicContact OE1-CZ 3.94Å; E126-R134 IonicContact OE1-NH1 2.69Å; E126-R134 PolarHBondContact OE1-NH1 2.96Å; E126-R134 IonicContact OE1-NH2 2.88Å; E126-R134 PolarHBondContact OE1-NH2 3.02Å
127	I	98.1	Very high	97.4	Very high	2 Å²	2	64 Å²	64	1%	0.01	32%	0.318	C	S	.	.			trans	-85.7	150.7	176.1	61.5	172.5	0	0	0	111.4	E87 F91 F118 I119 K125 I129 A152 V156	E87-I127 HydrophobicContact CG-CG2 4.36Å; F91-I127 HydrophobicContact CB-CG2 3.79Å; F91-I127 HydrophobicContact CD1-CD1 3.67Å; F91-I127 HydrophobicContact CD1-CG2 4.3Å; F91-I127 HydrophobicContact CD2-CD1 4.11Å; F91-I127 HydrophobicContact CE1-CD1 3.47Å; F91-I127 VanDerWaalsContact CE1-CD1 3.47Å; F91-I127 HydrophobicContact CE2-CD1 3.95Å; F91-I127 HydrophobicContact CG-CD1 3.96Å; F91-I127 HydrophobicContact CG-CG2 3.95Å; F91-I127 HydrophobicContact CZ-CD1 3.63Å; F118-I127 HydrophobicContact CB-CG2 4.26Å; F118-I127 HydrophobicContact CD1-CG2 4.14Å; F118-I127 WeakPolarHBondContact O-CG1 3.34Å; F118-I127 PolarHBondContact O-N 3.43Å; I119-I127 HydrophobicContact CD1-CD1 3.62Å; I119-I127 HydrophobicContact CD1-CG1 4.15Å; K125-I127 PolarHBondContact O-N 2.91Å; I127-I129 HydrophobicContact CD1-CD1 4.25Å; I127-I129 HydrophobicContact CD1-CG2 3.8Å; I127-I129 HydrophobicContact CG1-CD1 4.29Å; I127-I129 HydrophobicContact CG1-CG1 4.23Å; I127-I129 HydrophobicContact CG1-CG2 4.02Å; I127-I129 PolarHBondContact O-N 2.91Å; I127-A152 HydrophobicContact CD1-CB 4.2Å; I127-V156 HydrophobicContact CB-CG2 4.05Å; I127-V156 HydrophobicContact CD1-CG2 3.67Å; I127-V156 HydrophobicContact CG1-CG2 4.36Å; I127-V156 HydrophobicContact CG2-CG2 4.35Å
128	N	96.3	Very high	97.4	Very high	119 Å²	119	64.9 Å²	64.9	64%	0.636	32%	0.32	S	S	*	.			trans	-77.5	90.8	178.5	-172.6	3.5	0	0	0	111.7	L159	N128-L159 HydrophobicContact CB-CD2 4.1Å
129	I	97.1	Very high	97.4	Very high	9 Å²	9	72.1 Å²	72.1	5%	0.046	35%	0.348	C	S	.	.			trans	-130.6	152.5	174.2	59.8	173.1	0	0	0	111.1	I119 I127 T133 R134 I137 A152 I155	I119-I129 HydrophobicContact CD1-CD1 4.11Å; I119-I129 HydrophobicContact CG2-CD1 4.23Å; I127-I129 HydrophobicContact CD1-CD1 4.25Å; I127-I129 HydrophobicContact CD1-CG2 3.8Å; I127-I129 HydrophobicContact CG1-CD1 4.29Å; I127-I129 HydrophobicContact CG1-CG1 4.23Å; I127-I129 HydrophobicContact CG1-CG2 4.02Å; I127-I129 PolarHBondContact O-N 2.91Å; I129-T133 HydrophobicContact CB-CG2 4.43Å; I129-T133 HydrophobicContact CD1-CG2 4.18Å; I129-R134 HydrophobicContact CD1-CB 4.12Å; I129-I137 HydrophobicContact CD1-CD1 4.25Å; I129-A152 HydrophobicContact CD1-CB 4.47Å; I129-A152 HydrophobicContact CG2-CB 4.27Å; I129-I155 HydrophobicContact CG2-CB 4.47Å; I129-I155 HydrophobicContact CG2-CG2 4.06Å
130	D	96.6	Very high	97.3	Very high	95 Å²	95	73.7 Å²	73.7	51%	0.508	36%	0.361	S	S	.	.			trans	-69.3	163.7	179	73	5.9	0	0	0	112.8	H132 T133 R134	D130-H132 VanDerWaalsContact C-N 3.27Å; D130-H132 PolarHBondContact O-N 3.43Å; D130-H132 PolarHBondContact OD1-N 2.78Å; D130-T133 PolarHBondContact O-N 3.22Å; D130-T133 WeakPolarHBondContact OD1-CB 3.29Å; D130-T133 PolarHBondContact OD1-N 3.48Å; D130-T133 PolarHBondContact OD1-OG1 2.89Å; D130-R134 PolarHBondContact O-N 2.85Å; D130-R134 VanDerWaalsContact O-N 3.15Å
131	Y	96.8	Very high	97.3	Very high	175 Å²	175	70.2 Å²	70.2	69%	0.686	35%	0.346	S	S	*	.	H	α-helix	trans	-58.3	-40.3	-179.6	174.3	-97.5	0	0	0	112.2	R134 E135	Y131-R134 PolarHBondContact O-N 3.37Å; Y131-E135 WeakPolarHBondContact O-CB 3.42Å; Y131-E135 PolarHBondContact O-N 3.14Å
132	H	97.2	Very high	97.3	Very high	115 Å²	115	74.8 Å²	74.8	53%	0.532	36%	0.356	S	S	.	.	H	α-helix	trans	-62.7	-50.6	-178.4	-177.1	-90.2	0	0	0	112	D130 R134 E135 Q136	D130-H132 VanDerWaalsContact C-N 3.27Å; D130-H132 PolarHBondContact O-N 3.43Å; D130-H132 PolarHBondContact OD1-N 2.78Å; H132-R134 VanDerWaalsContact C-N 3.29Å; H132-R134 PolarHBondContact O-N 2.88Å; H132-E135 PolarHBondContact O-N 3.05Å; H132-Q136 PolarHBondContact CE1-NE2 3.39Å; H132-Q136 VanDerWaalsContact CE1-NE2 3.29Å; H132-Q136 PolarHBondContact CE1-OE1 2.82Å; H132-Q136 VanDerWaalsContact CE1-OE1 3.29Å; H132-Q136 PolarHBondContact ND1-OE1 2.86Å; H132-Q136 VanDerWaalsContact ND1-OE1 3.13Å; H132-Q136 WeakPolarHBondContact O-CG 3.32Å; H132-Q136 PolarHBondContact O-N 3.47Å
133	T	97.5	Very high	97.3	Very high	10 Å²	10	72.8 Å²	72.8	6%	0.061	35%	0.351	C	S	.	.	H	α-helix	trans	-57.3	-45.1	177	-55.7	0	0	0	0	110.7	I129 D130 E135 Q136 I137 A152 I155	I129-T133 HydrophobicContact CB-CG2 4.43Å; I129-T133 HydrophobicContact CD1-CG2 4.18Å; D130-T133 PolarHBondContact O-N 3.22Å; D130-T133 WeakPolarHBondContact OD1-CB 3.29Å; D130-T133 PolarHBondContact OD1-N 3.48Å; D130-T133 PolarHBondContact OD1-OG1 2.89Å; T133-E135 VanDerWaalsContact C-N 3.35Å; T133-E135 PolarHBondContact O-N 3.37Å; T133-Q136 PolarHBondContact O-N 3.2Å; T133-I137 HydrophobicContact CG2-CD1 3.98Å; T133-I137 WeakPolarHBondContact O-CG1 3.2Å; T133-I137 PolarHBondContact O-N 2.81Å; T133-A152 HydrophobicContact CG2-CB 4.08Å; T133-I155 HydrophobicContact CG2-CD1 3.99Å
134	R	98.3	Very high	97.2	Very high	37 Å²	37	73.5 Å²	73.5	14%	0.14	36%	0.355	C	S	.	.	H	α-helix	trans	-60.1	-44	178.9	-171.5	-176.3	-52.4	-114.7	8.4	112.6	I119 K120 E126 I129 D130 Y131 H132 I137 K138	I119-R134 HydrophobicContact CG2-CG 3.94Å; I119-R134 WeakPolarHBondContact O-CD 3.4Å; I119-R134 WeakPolarHBondContact O-CG 3.4Å; I119-R134 PolarHBondContact O-NH1 2.74Å; K120-R134 PolarHBondContact O-NH1 3.2Å; E126-R134 IonicContact OE1-CZ 3.94Å; E126-R134 IonicContact OE1-NH1 2.69Å; E126-R134 PolarHBondContact OE1-NH1 2.96Å; E126-R134 IonicContact OE1-NH2 2.88Å; E126-R134 PolarHBondContact OE1-NH2 3.02Å; I129-R134 HydrophobicContact CD1-CB 4.12Å; D130-R134 PolarHBondContact O-N 2.85Å; D130-R134 VanDerWaalsContact O-N 3.15Å; Y131-R134 PolarHBondContact O-N 3.37Å; H132-R134 VanDerWaalsContact C-N 3.29Å; H132-R134 PolarHBondContact O-N 2.88Å; R134-I137 PolarHBondContact O-N 3.05Å; R134-K138 WeakPolarHBondContact O-CB 3.29Å; R134-K138 PolarHBondContact O-N 3.46Å
135	E	97.8	Very high	97.2	Very high	40 Å²	40	71.9 Å²	71.9	19%	0.187	34%	0.343	C	S	.	.	H	α-helix	trans	-71.7	-33.7	-178.7	-166.5	60.2	-162.8	0	0	111.9	Y131 H132 T133 K138 R139	Y131-E135 WeakPolarHBondContact O-CB 3.42Å; Y131-E135 PolarHBondContact O-N 3.14Å; H132-E135 PolarHBondContact O-N 3.05Å; T133-E135 VanDerWaalsContact C-N 3.35Å; T133-E135 PolarHBondContact O-N 3.37Å; E135-K138 PolarHBondContact O-N 3.4Å; E135-K138 IonicContact OE1-NZ 3.82Å; E135-K138 WeakPolarHBondContact OE2-CD 3.45Å; E135-K138 IonicContact OE2-NZ 3.5Å; E135-R139 WeakPolarHBondContact O-CG 3.38Å; E135-R139 PolarHBondContact O-N 3.16Å
136	Q	97.7	Very high	97.2	Very high	82 Å²	82	72.5 Å²	72.5	38%	0.383	35%	0.348	S	S	.	.	H	α-helix	trans	-60.9	-48.3	170.1	-72.6	177.5	-58	0	0	111.4	H132 T133 K138 R139 A140	H132-Q136 PolarHBondContact CE1-NE2 3.39Å; H132-Q136 VanDerWaalsContact CE1-NE2 3.29Å; H132-Q136 PolarHBondContact CE1-OE1 2.82Å; H132-Q136 VanDerWaalsContact CE1-OE1 3.29Å; H132-Q136 PolarHBondContact ND1-OE1 2.86Å; H132-Q136 VanDerWaalsContact ND1-OE1 3.13Å; H132-Q136 WeakPolarHBondContact O-CG 3.32Å; H132-Q136 PolarHBondContact O-N 3.47Å; T133-Q136 PolarHBondContact O-N 3.2Å; Q136-K138 PolarHBondContact O-N 2.8Å; Q136-R139 PolarHBondContact O-N 2.96Å; Q136-R139 VanDerWaalsContact O-N 3.16Å; Q136-A140 PolarHBondContact O-N 2.97Å
137	I	98.2	Very high	97.1	Very high	7 Å²	7	74.5 Å²	74.5	4%	0.036	36%	0.358	C	S	.	.	H	α-helix	trans	-62.8	-43.3	178.7	-65.3	166.9	0	0	0	110.7	Y115 I119 I129 T133 R134 R139 A140 V141 F149 A152	Y115-I137 HydrophobicContact CD2-CG2 4.22Å; I119-I137 HydrophobicContact CD1-CD1 4.01Å; I119-I137 HydrophobicContact CG1-CG2 4.19Å; I119-I137 HydrophobicContact CG2-CB 4.09Å; I119-I137 HydrophobicContact CG2-CD1 4.25Å; I119-I137 HydrophobicContact CG2-CG2 3.89Å; I129-I137 HydrophobicContact CD1-CD1 4.25Å; T133-I137 HydrophobicContact CG2-CD1 3.98Å; T133-I137 WeakPolarHBondContact O-CG1 3.2Å; T133-I137 PolarHBondContact O-N 2.81Å; R134-I137 PolarHBondContact O-N 3.05Å; I137-R139 PolarHBondContact O-N 2.88Å; I137-R139 VanDerWaalsContact O-N 3.16Å; I137-A140 PolarHBondContact O-N 3.21Å; I137-V141 HydrophobicContact CG2-CG1 3.87Å; I137-V141 WeakPolarHBondContact O-CG1 3.27Å; I137-V141 WeakPolarHBondContact O-CG2 3.38Å; I137-V141 PolarHBondContact O-N 3.23Å; I137-F149 HydrophobicContact CG2-CD1 3.81Å; I137-F149 HydrophobicContact CG2-CE1 3.56Å; I137-A152 HydrophobicContact CD1-CB 3.49Å; I137-A152 VanDerWaalsContact CD1-CB 3.49Å
138	K	97.9	Very high	97.1	Very high	89 Å²	89	74.8 Å²	74.8	39%	0.387	36%	0.36	S	S	.	.	H	α-helix	trans	-54.6	-34.5	176.3	-175.9	-174.8	-177.7	-175.2	0	112.9	Y115 R134 E135 Q136 V141	Y115-K138 HydrophobicContact CE2-CB 3.77Å; Y115-K138 HydrophobicContact CE2-CG 4.16Å; Y115-K138 WeakPolarHBondContact OH-CG 3.37Å; R134-K138 WeakPolarHBondContact O-CB 3.29Å; R134-K138 PolarHBondContact O-N 3.46Å; E135-K138 PolarHBondContact O-N 3.4Å; E135-K138 IonicContact OE1-NZ 3.82Å; E135-K138 WeakPolarHBondContact OE2-CD 3.45Å; E135-K138 IonicContact OE2-NZ 3.5Å; Q136-K138 PolarHBondContact O-N 2.8Å; K138-V141 WeakPolarHBondContact O-CG2 3.41Å
139	R	97.5	Very high	97.2	Very high	162 Å²	162	69.3 Å²	69.3	61%	0.611	33%	0.33	S	S	*	.	H	α-helix	trans	-77	-44.8	174	-64.4	172	-166	173.4	4.5	111.2	E135 Q136 I137 V141 K142	E135-R139 WeakPolarHBondContact O-CG 3.38Å; E135-R139 PolarHBondContact O-N 3.16Å; Q136-R139 PolarHBondContact O-N 2.96Å; Q136-R139 VanDerWaalsContact O-N 3.16Å; I137-R139 PolarHBondContact O-N 2.88Å; I137-R139 VanDerWaalsContact O-N 3.16Å; R139-V141 PolarHBondContact O-N 3.19Å; R139-K142 WeakPolarHBondContact O-CB 3.33Å; R139-K142 PolarHBondContact O-N 2.65Å
140	A	96.5	Very high	97.3	Very high	33 Å²	33	70.7 Å²	70.7	27%	0.273	34%	0.338	S	S	.	.	H	α-helix	trans	-61.4	-38.8	-178.6	0	0	0	0	0	112.8	Q136 I137 K142 N143 P144 C148	Q136-A140 PolarHBondContact O-N 2.97Å; I137-A140 PolarHBondContact O-N 3.21Å; A140-K142 PolarHBondContact O-N 3.43Å; A140-K142 VanDerWaalsContact O-N 3.09Å; A140-N143 CarbonylContact O-C 3.05Å; A140-N143 PolarHBondContact O-N 3.25Å; A140-N143 VanDerWaalsContact O-O 3.12Å; A140-P144 WeakPolarHBondContact O-CA 3.39Å; A140-C148 WeakPolarHBondContact CB-SG 3.28Å
141	V	97.2	Very high	97.3	Very high	14 Å²	14	70.3 Å²	70.3	9%	0.085	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-12.9	-179.4	-62.9	0	0	0	0	114.2	A111 Y115 I137 K138 R139 F149	A111-V141 HydrophobicContact CB-CG1 4.39Å; Y115-V141 HydrophobicContact CD2-CG1 4.43Å; Y115-V141 HydrophobicContact CD2-CG2 4.17Å; Y115-V141 HydrophobicContact CG-CG2 4.24Å; I137-V141 HydrophobicContact CG2-CG1 3.87Å; I137-V141 WeakPolarHBondContact O-CG1 3.27Å; I137-V141 WeakPolarHBondContact O-CG2 3.38Å; I137-V141 PolarHBondContact O-N 3.23Å; K138-V141 WeakPolarHBondContact O-CG2 3.41Å; R139-V141 PolarHBondContact O-N 3.19Å; V141-F149 HydrophobicContact CG1-CE1 3.97Å; V141-F149 HydrophobicContact CG1-CZ 3.84Å
142	K	95.8	Very high	97.4	Very high	155 Å²	155	62 Å²	62	67%	0.674	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	-37.8	171.7	-62.3	-177.2	-179.7	-178.4	0	111.7	R139 A140	R139-K142 WeakPolarHBondContact O-CB 3.33Å; R139-K142 PolarHBondContact O-N 2.65Å; A140-K142 PolarHBondContact O-N 3.43Å; A140-K142 VanDerWaalsContact O-N 3.09Å
143	N	95.8	Very high	97.5	Very high	142 Å²	142	57 Å²	57	76%	0.759	28%	0.28	S	S	*	.	S	Bend	trans	-133	75.1	175.9	-68.6	-50.8	0	0	0	108.9	A140	A140-N143 CarbonylContact O-C 3.05Å; A140-N143 PolarHBondContact O-N 3.25Å; A140-N143 VanDerWaalsContact O-O 3.12Å
144	P	96.8	Very high	97.5	Very high	28 Å²	28	63.1 Å²	63.1	18%	0.182	31%	0.306	C	S	.	.			trans	-69.1	139.9	-166.5	18.6	-23.3	0	0	0	112.7	Y98 M107 A111 A140	Y98-P144 VanDerWaalsContact OH-CB 3.3Å; Y98-P144 WeakPolarHBondContact OH-CB 3.46Å; M107-P144 HydrophobicContact CG-CB 4.26Å; M107-P144 HydrophobicContact CG-CG 4.49Å; A111-P144 HydrophobicContact CB-CB 3.76Å; A111-P144 HydrophobicContact CB-CG 4.06Å; A140-P144 WeakPolarHBondContact O-CA 3.39Å
145	T	97.2	Very high	97.5	Very high	70 Å²	70	64.4 Å²	64.4	43%	0.429	32%	0.315	S	S	.	.			trans	-114.6	173.9	169.4	65.9	0	0	0	0	110	Y98 Q147 C148	Y98-T145 WeakPolarHBondContact CE1-O 3.45Å; Y98-T145 PolarHBondContact OH-O 3.42Å; T145-Q147 PolarHBondContact O-N 3.17Å; T145-Q147 PolarHBondContact OG1-N 3.37Å; T145-C148 VanDerWaalsContact O-CB 3.24Å; T145-C148 WeakPolarHBondContact O-CB 3.37Å; T145-C148 PolarHBondContact O-N 3.41Å
146	L	96.8	Very high	97.5	Very high	66 Å²	66	62.5 Å²	62.5	35%	0.346	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-28.2	174	-66.6	174.8	0	0	0	112.4	K99 M107 C148	K99-L146 WeakPolarHBondContact O-CD2 3.49Å; M107-L146 HydrophobicContact CE-CD2 3.41Å; M107-L146 VanDerWaalsContact CE-CD2 3.41Å; M107-L146 HydrophobicContact CE-CG 4Å; L146-C148 VanDerWaalsContact C-N 3.32Å
147	Q	96.9	Very high	97.6	Very high	115 Å²	115	60.7 Å²	60.7	54%	0.537	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	6.3	-178.7	-60.2	73.9	28.6	0	0	113.3	T145 F149 D150	T145-Q147 PolarHBondContact O-N 3.17Å; T145-Q147 PolarHBondContact OG1-N 3.37Å; Q147-F149 PolarHBondContact O-N 3.14Å; Q147-D150 WeakPolarHBondContact CB-OD2 3.4Å; Q147-D150 VanDerWaalsContact CG-OD2 3.29Å; Q147-D150 WeakPolarHBondContact CG-OD2 3.2Å; Q147-D150 PolarHBondContact O-N 3.29Å
148	C	97.4	Very high	97.6	Very high	8 Å²	8	60.7 Å²	60.7	5%	0.054	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-23.5	-172.7	-170.2	0	0	0	0	114.3	Y98 A140 T145 L146	Y98-C148 HydrophobicContact CE1-CB 4.21Å; A140-C148 WeakPolarHBondContact CB-SG 3.28Å; T145-C148 VanDerWaalsContact O-CB 3.24Å; T145-C148 WeakPolarHBondContact O-CB 3.37Å; T145-C148 PolarHBondContact O-N 3.41Å; L146-C148 VanDerWaalsContact C-N 3.32Å
149	F	98.4	Very high	97.6	Very high	3 Å²	3	58.5 Å²	58.5	1%	0.013	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-124.1	8.2	-175.7	-55.3	-73.4	0	0	0	113.5	F91 Y98 A111 I114 I119 I137 V141 Q147 D151 A152 Q153	F91-F149 HydrophobicContact CZ-CB 4.33Å; Y98-F149 AromaticContact CD1-CD2 3.81Å; Y98-F149 HydrophobicContact CD1-CD2 3.81Å; Y98-F149 HydrophobicContact CD1-CE2 4.11Å; Y98-F149 HydrophobicContact CD2-CE2 4.12Å; Y98-F149 AromaticContact CE1-CD2 3.78Å; Y98-F149 HydrophobicContact CE1-CD2 3.78Å; Y98-F149 AromaticContact CE1-CE2 3.88Å; Y98-F149 HydrophobicContact CE1-CE2 3.88Å; Y98-F149 AromaticContact CE2-CE2 3.9Å; Y98-F149 HydrophobicContact CE2-CE2 3.9Å; Y98-F149 HydrophobicContact CG-CD2 4.21Å; Y98-F149 HydrophobicContact CG-CE2 4.23Å; Y98-F149 AromaticContact CZ-CE2 3.77Å; A111-F149 HydrophobicContact CB-CE2 4.2Å; A111-F149 HydrophobicContact CB-CZ 4.09Å; I114-F149 HydrophobicContact CB-CE1 4.09Å; I114-F149 HydrophobicContact CB-CE2 4.19Å; I114-F149 HydrophobicContact CB-CZ 3.74Å; I114-F149 HydrophobicContact CD1-CD2 4.12Å; I114-F149 HydrophobicContact CD1-CE2 3.68Å; I114-F149 HydrophobicContact CD1-CZ 4.14Å; I114-F149 HydrophobicContact CG2-CD1 3.86Å; I114-F149 HydrophobicContact CG2-CD2 4.41Å; I114-F149 HydrophobicContact CG2-CE1 3.49Å; I114-F149 VanDerWaalsContact CG2-CE1 3.49Å; I114-F149 HydrophobicContact CG2-CE2 4.1Å; I114-F149 HydrophobicContact CG2-CG 4.3Å; I114-F149 HydrophobicContact CG2-CZ 3.63Å; I119-F149 HydrophobicContact CG1-CE1 4.36Å; I137-F149 HydrophobicContact CG2-CD1 3.81Å; I137-F149 HydrophobicContact CG2-CE1 3.56Å; V141-F149 HydrophobicContact CG1-CE1 3.97Å; V141-F149 HydrophobicContact CG1-CZ 3.84Å; Q147-F149 PolarHBondContact O-N 3.14Å; F149-D151 VanDerWaalsContact C-N 3.34Å; F149-D151 PolarHBondContact O-N 3.28Å; F149-A152 PolarHBondContact O-N 3.34Å; F149-Q153 VanDerWaalsContact O-CB 3.31Å; F149-Q153 WeakPolarHBondContact O-CB 3.36Å; F149-Q153 PolarHBondContact O-N 3.43Å
150	D	98.1	Very high	97.6	Very high	39 Å²	39	50.8 Å²	50.8	21%	0.209	26%	0.261	C	S	.	.	H	α-helix	trans	-59.9	-42.5	-170.6	-79.3	-0.6	0	0	0	112.6	K99 Q147 Q153 K154	K99-D150 VanDerWaalsContact CE-OD1 3.27Å; K99-D150 WeakPolarHBondContact CE-OD1 3.46Å; K99-D150 IonicContact NZ-OD1 2.74Å; Q147-D150 WeakPolarHBondContact CB-OD2 3.4Å; Q147-D150 VanDerWaalsContact CG-OD2 3.29Å; Q147-D150 WeakPolarHBondContact CG-OD2 3.2Å; Q147-D150 PolarHBondContact O-N 3.29Å; D150-Q153 PolarHBondContact O-N 3.32Å; D150-K154 VanDerWaalsContact O-CG 3.29Å; D150-K154 WeakPolarHBondContact O-CG 3.18Å; D150-K154 PolarHBondContact O-N 3.28Å
151	D	97.8	Very high	97.7	Very high	87 Å²	87	52.9 Å²	52.9	47%	0.465	27%	0.265	S	S	.	.	H	α-helix	trans	-69.3	-45.9	-178.3	-66.3	-23.8	0	0	0	111.7	F149 Q153 K154 I155	F149-D151 VanDerWaalsContact C-N 3.34Å; F149-D151 PolarHBondContact O-N 3.28Å; D151-Q153 VanDerWaalsContact C-N 3.3Å; D151-Q153 PolarHBondContact O-N 3.22Å; D151-K154 PolarHBondContact O-N 3.34Å; D151-K154 IonicContact OD1-NZ 3.88Å; D151-I155 VanDerWaalsContact O-CG1 3.31Å; D151-I155 WeakPolarHBondContact O-CG1 3.34Å; D151-I155 PolarHBondContact O-N 2.99Å
152	A	98.4	Very high	97.7	Very high	1 Å²	1	60.9 Å²	60.9	1%	0.008	29%	0.293	C	S	.	.	H	α-helix	trans	-61.6	-39.4	173.6	0	0	0	0	0	111.9	F91 I127 I129 T133 I137 F149 K154 I155 V156	F91-A152 HydrophobicContact CE1-CB 3.98Å; F91-A152 HydrophobicContact CZ-CB 3.79Å; I127-A152 HydrophobicContact CD1-CB 4.2Å; I129-A152 HydrophobicContact CD1-CB 4.47Å; I129-A152 HydrophobicContact CG2-CB 4.27Å; T133-A152 HydrophobicContact CG2-CB 4.08Å; I137-A152 HydrophobicContact CD1-CB 3.49Å; I137-A152 VanDerWaalsContact CD1-CB 3.49Å; F149-A152 PolarHBondContact O-N 3.34Å; A152-K154 PolarHBondContact O-N 3.44Å; A152-I155 PolarHBondContact O-N 2.97Å; A152-V156 WeakPolarHBondContact O-CG2 3.47Å; A152-V156 PolarHBondContact O-N 3.06Å
153	Q	98.6	Very high	97.8	Very high	9 Å²	9	56.8 Å²	56.8	4%	0.042	28%	0.279	C	S	.	.	H	α-helix	trans	-63.7	-41	178.1	-169.8	-176.2	11.2	0	0	111.8	F91 W92 C95 E96 F149 D150 D151 V156 Y157	F91-Q153 HydrophobicContact CE1-CB 4.37Å; W92-Q153 VanDerWaalsContact CD1-CG 3.41Å; W92-Q153 HydrophobicContact CG-CG 4.17Å; W92-Q153 PolarHBondContact O-NE2 2.65Å; C95-Q153 HydrophobicContact CB-CB 4.29Å; C95-Q153 HydrophobicContact CB-CG 3.93Å; E96-Q153 PolarHBondContact OE1-NE2 3.07Å; F149-Q153 VanDerWaalsContact O-CB 3.31Å; F149-Q153 WeakPolarHBondContact O-CB 3.36Å; F149-Q153 PolarHBondContact O-N 3.43Å; D150-Q153 PolarHBondContact O-N 3.32Å; D151-Q153 VanDerWaalsContact C-N 3.3Å; D151-Q153 PolarHBondContact O-N 3.22Å; Q153-V156 PolarHBondContact O-N 3.16Å; Q153-Y157 WeakPolarHBondContact O-CB 3.39Å; Q153-Y157 PolarHBondContact O-N 3.07Å
154	K	98.3	Very high	97.9	Very high	138 Å²	138	50.1 Å²	50.1	60%	0.6	24%	0.243	S	C	*	.	H	α-helix	trans	-63.1	-43	173.9	-71.9	168.1	-170.8	165.9	0	111.9	D150 D151 A152 Y157 G158	D150-K154 VanDerWaalsContact O-CG 3.29Å; D150-K154 WeakPolarHBondContact O-CG 3.18Å; D150-K154 PolarHBondContact O-N 3.28Å; D151-K154 PolarHBondContact O-N 3.34Å; D151-K154 IonicContact OD1-NZ 3.88Å; A152-K154 PolarHBondContact O-N 3.44Å; K154-Y157 PolarHBondContact O-N 3.42Å; K154-G158 PolarHBondContact O-N 2.71Å
155	I	98.3	Very high	98	Very high	64 Å²	64	49.7 Å²	49.7	33%	0.328	24%	0.238	S	C	.	.	H	α-helix	trans	-60.5	-49.8	177.7	-69.3	163.4	0	0	0	110.4	I129 T133 D151 A152 G158 L159	I129-I155 HydrophobicContact CG2-CB 4.47Å; I129-I155 HydrophobicContact CG2-CG2 4.06Å; T133-I155 HydrophobicContact CG2-CD1 3.99Å; D151-I155 VanDerWaalsContact O-CG1 3.31Å; D151-I155 WeakPolarHBondContact O-CG1 3.34Å; D151-I155 PolarHBondContact O-N 2.99Å; A152-I155 PolarHBondContact O-N 2.97Å; I155-G158 PolarHBondContact O-N 3.31Å; I155-L159 WeakPolarHBondContact O-CB 3.46Å; I155-L159 PolarHBondContact O-N 3.11Å
156	V	98.4	Very high	98.1	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-65.6	-40.1	-179.6	172.3	0	0	0	0	112	N88 F91 I127 A152 Q153 L159 M160	N88-V156 HydrophobicContact CB-CG1 3.67Å; N88-V156 VanDerWaalsContact O-CG1 3.25Å; N88-V156 WeakPolarHBondContact O-CG1 3.41Å; F91-V156 HydrophobicContact CD1-CB 4.09Å; F91-V156 HydrophobicContact CD1-CG1 4.2Å; F91-V156 HydrophobicContact CD1-CG2 3.8Å; F91-V156 HydrophobicContact CE1-CB 4.44Å; F91-V156 HydrophobicContact CE1-CG2 4.04Å; I127-V156 HydrophobicContact CB-CG2 4.05Å; I127-V156 HydrophobicContact CD1-CG2 3.67Å; I127-V156 HydrophobicContact CG1-CG2 4.36Å; I127-V156 HydrophobicContact CG2-CG2 4.35Å; A152-V156 WeakPolarHBondContact O-CG2 3.47Å; A152-V156 PolarHBondContact O-N 3.06Å; Q153-V156 PolarHBondContact O-N 3.16Å; V156-L159 WeakPolarHBondContact O-CB 3.09Å; V156-L159 PolarHBondContact O-N 3.32Å; V156-M160 HydrophobicContact CG1-CE 4.27Å; V156-M160 PolarHBondContact O-N 3.16Å
157	Y	98.6	Very high	98.1	Very high	45 Å²	45	49 Å²	49	18%	0.176	23%	0.228	C	C	.	.	H	α-helix	trans	-58.5	-49.9	173	-179.4	-85.9	0	0	0	110.9	L63 E64 L67 W92 Q153 K154 L159 M160 E161	L63-Y157 HydrophobicContact CB-CE2 4.27Å; L63-Y157 HydrophobicContact CD2-CD2 3.96Å; L63-Y157 HydrophobicContact CD2-CE1 4.35Å; L63-Y157 HydrophobicContact CD2-CE2 3.69Å; L63-Y157 HydrophobicContact CD2-CG 4.43Å; L63-Y157 HydrophobicContact CG-CD2 4.5Å; L63-Y157 HydrophobicContact CG-CE2 3.8Å; E64-Y157 PolarHBondContact N-OH 3.15Å; E64-Y157 VanDerWaalsContact N-OH 3.14Å; L67-Y157 HydrophobicContact CD1-CD2 4.4Å; L67-Y157 HydrophobicContact CD1-CE2 4.17Å; W92-Y157 AromaticContact NE1-CD2 3.58Å; Q153-Y157 WeakPolarHBondContact O-CB 3.39Å; Q153-Y157 PolarHBondContact O-N 3.07Å; K154-Y157 PolarHBondContact O-N 3.42Å; Y157-L159 VanDerWaalsContact C-N 3.29Å; Y157-L159 PolarHBondContact O-N 3.39Å; Y157-M160 PolarHBondContact O-N 2.92Å; Y157-E161 HydrophobicContact CE1-CB 4.35Å; Y157-E161 WeakPolarHBondContact CE1-OE1 3.49Å; Y157-E161 WeakPolarHBondContact O-CB 3.34Å; Y157-E161 PolarHBondContact O-N 3.02Å
158	G	98.3	Very high	98.2	Very high	6 Å²	6	43.5 Å²	43.5	6%	0.062	20%	0.203	C	C	.	.	H	α-helix	trans	-64.3	-31.2	178.1	0	0	0	0	0	113.6	K154 I155 R162	K154-G158 PolarHBondContact O-N 2.71Å; I155-G158 PolarHBondContact O-N 3.31Å; G158-R162 WeakPolarHBondContact O-CB 3.33Å; G158-R162 WeakPolarHBondContact O-CG 3.36Å; G158-R162 PolarHBondContact O-N 3.15Å; G158-R162 PolarHBondContact O-NE 3.05Å; G158-R162 PolarHBondContact O-NH1 2.88Å
159	L	97.8	Very high	98.2	Very high	44 Å²	44	45.1 Å²	45.1	23%	0.23	21%	0.211	C	C	.	.	H	α-helix	trans	-63.4	-52.1	172.5	177.3	63.6	0	0	0	110.7	N128 I155 V156 Y157 E161 R162 D163	N128-L159 HydrophobicContact CB-CD2 4.1Å; I155-L159 WeakPolarHBondContact O-CB 3.46Å; I155-L159 PolarHBondContact O-N 3.11Å; V156-L159 WeakPolarHBondContact O-CB 3.09Å; V156-L159 PolarHBondContact O-N 3.32Å; Y157-L159 VanDerWaalsContact C-N 3.29Å; Y157-L159 PolarHBondContact O-N 3.39Å; L159-E161 VanDerWaalsContact C-N 3.32Å; L159-E161 PolarHBondContact O-N 3.14Å; L159-R162 PolarHBondContact O-N 3.44Å; L159-D163 WeakPolarHBondContact O-CB 3.48Å; L159-D163 PolarHBondContact O-N 3.48Å
160	M	98.4	Very high	98.1	Very high	0 Å²	0	52 Å²	52	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-59.9	-43.6	176.3	-69.3	-172.4	-65.8	0	0	111.4	L63 F76 L80 N88 I89 W92 V156 Y157 R162 S164 Y165	L63-M160 HydrophobicContact CD2-CB 3.88Å; F76-M160 HydrophobicContact CE1-SD 4Å; F76-M160 HydrophobicContact CZ-CB 4.42Å; L80-M160 HydrophobicContact CD1-SD 4.22Å; N88-M160 HydrophobicContact CB-CG 3.71Å; N88-M160 HydrophobicContact CB-SD 3.74Å; I89-M160 HydrophobicContact CB-SD 3.9Å; I89-M160 HydrophobicContact CD1-CE 4.2Å; I89-M160 HydrophobicContact CD1-SD 4.28Å; W92-M160 HydrophobicContact CB-CE 4.1Å; W92-M160 HydrophobicContact CG-CE 4.3Å; V156-M160 HydrophobicContact CG1-CE 4.27Å; V156-M160 PolarHBondContact O-N 3.16Å; Y157-M160 PolarHBondContact O-N 2.92Å; M160-R162 PolarHBondContact O-N 3.19Å; M160-S164 PolarHBondContact O-N 3.32Å; M160-S164 VanDerWaalsContact O-N 3.16Å; M160-Y165 WeakPolarHBondContact O-CB 3.39Å; M160-Y165 PolarHBondContact O-N 3.01Å
161	E	98.4	Very high	97.9	Very high	77 Å²	77	50.9 Å²	50.9	36%	0.36	23%	0.232	S	C	.	.	H	α-helix	trans	-63.4	-37.2	-177.8	-174.1	174.4	-118.4	0	0	113	L63 Y157 L159 P166	L63-E161 HydrophobicContact CD2-CB 3.92Å; Y157-E161 HydrophobicContact CE1-CB 4.35Å; Y157-E161 WeakPolarHBondContact CE1-OE1 3.49Å; Y157-E161 WeakPolarHBondContact O-CB 3.34Å; Y157-E161 PolarHBondContact O-N 3.02Å; L159-E161 VanDerWaalsContact C-N 3.32Å; L159-E161 PolarHBondContact O-N 3.14Å; E161-P166 WeakPolarHBondContact O-CD 3.41Å
162	R	98.1	Very high	97.6	Very high	182 Å²	182	49.4 Å²	49.4	69%	0.687	22%	0.224	S	C	*	.	H	α-helix	trans	-88.1	-24.7	-178.6	-68.1	-174.6	-60.2	-90.2	-1.1	114	G158 L159 M160	G158-R162 WeakPolarHBondContact O-CB 3.33Å; G158-R162 WeakPolarHBondContact O-CG 3.36Å; G158-R162 PolarHBondContact O-N 3.15Å; G158-R162 PolarHBondContact O-NE 3.05Å; G158-R162 PolarHBondContact O-NH1 2.88Å; L159-R162 PolarHBondContact O-N 3.44Å; M160-R162 PolarHBondContact O-N 3.19Å
163	D	97.7	Very high	97.2	Very high	69 Å²	69	50.9 Å²	50.9	37%	0.369	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-114.3	-73.6	-174.5	176.4	58.6	0	0	0	112.9	L159 Y165 P166 R167	L159-D163 WeakPolarHBondContact O-CB 3.48Å; L159-D163 PolarHBondContact O-N 3.48Å; D163-Y165 PolarHBondContact O-N 2.91Å; D163-P166 WeakPolarHBondContact O-CD 3.38Å; D163-R167 WeakPolarHBondContact O-CG 3.43Å; D163-R167 PolarHBondContact O-N 3.49Å; D163-R167 IonicContact OD1-CZ 3.49Å; D163-R167 IonicContact OD1-NE 3.73Å; D163-R167 PolarHBondContact OD1-NE 3.28Å; D163-R167 IonicContact OD1-NH2 3.56Å; D163-R167 IonicContact OD2-CZ 3.28Å; D163-R167 IonicContact OD2-NE 2.72Å; D163-R167 IonicContact OD2-NH2 3.78Å; D163-R167 PolarHBondContact OD2-NH2 2.61Å
164	S	97.9	Very high	96.9	Very high	2 Å²	2	50.9 Å²	50.9	1%	0.014	23%	0.231	C	C	.	.	H	α-helix	trans	-72.4	-33	-168.6	-35.6	0	0	0	0	112.6	F79 M160 R167 F168	F79-S164 VanDerWaalsContact CE1-O 3.24Å; F79-S164 WeakPolarHBondContact CE1-O 3.3Å; M160-S164 PolarHBondContact O-N 3.32Å; M160-S164 VanDerWaalsContact O-N 3.16Å; S164-R167 PolarHBondContact O-N 3.2Å; S164-F168 WeakPolarHBondContact O-CB 3.34Å; S164-F168 PolarHBondContact O-N 2.69Å
165	Y	98.6	Very high	96.6	Very high	18 Å²	18	50.2 Å²	50.2	7%	0.071	23%	0.225	C	C	.	.	H	α-helix	trans	-66.7	-48.5	-178.9	171.9	-115	0	0	0	113.1	W59 S60 S62 L63 L66 M160 D163 R167 F168 L169	W59-Y165 WeakPolarHBondContact O-CE2 3.5Å; W59-Y165 PolarHBondContact O-OH 2.73Å; S60-Y165 VanDerWaalsContact C-OH 3.25Å; S60-Y165 WeakPolarHBondContact CA-OH 3.38Å; S60-Y165 PolarHBondContact O-OH 3.24Å; S62-Y165 WeakPolarHBondContact CA-OH 3.43Å; S62-Y165 PolarHBondContact N-OH 3.08Å; S62-Y165 PolarHBondContact O-OH 3.44Å; L63-Y165 HydrophobicContact CB-CD1 4.16Å; L63-Y165 HydrophobicContact CB-CD2 4.3Å; L63-Y165 HydrophobicContact CB-CE1 4.35Å; L63-Y165 HydrophobicContact CB-CE2 4.47Å; L63-Y165 HydrophobicContact CB-CG 4.13Å; L63-Y165 HydrophobicContact CD1-CD2 3.93Å; L63-Y165 HydrophobicContact CD1-CG 4.18Å; L66-Y165 HydrophobicContact CB-CE2 4.25Å; L66-Y165 HydrophobicContact CD2-CD2 3.6Å; L66-Y165 HydrophobicContact CD2-CE2 3.67Å; M160-Y165 WeakPolarHBondContact O-CB 3.39Å; M160-Y165 PolarHBondContact O-N 3.01Å; D163-Y165 PolarHBondContact O-N 2.91Å; Y165-R167 PolarHBondContact O-N 3.32Å; Y165-F168 HydrophobicContact CD2-CD1 4.36Å; Y165-F168 WeakPolarHBondContact O-CB 3.35Å; Y165-F168 PolarHBondContact O-N 3.24Å; Y165-F168 VanDerWaalsContact O-N 3.15Å; Y165-L169 HydrophobicContact CD2-CG 4.39Å; Y165-L169 HydrophobicContact CE1-CD1 4Å; Y165-L169 HydrophobicContact CE2-CD1 4.04Å; Y165-L169 HydrophobicContact CE2-CD2 3.99Å; Y165-L169 HydrophobicContact CE2-CG 4.01Å; Y165-L169 WeakPolarHBondContact O-CG 3.12Å; Y165-L169 PolarHBondContact O-N 3.3Å
166	P	98.3	Very high	96.1	Very high	41 Å²	41	47.9 Å²	47.9	27%	0.266	21%	0.214	S	C	.	.	H	α-helix	trans	-60.5	-33	172.4	-26.2	33.9	0	0	0	113.4	E161 D163 R170	E161-P166 WeakPolarHBondContact O-CD 3.41Å; D163-P166 WeakPolarHBondContact O-CD 3.38Å; P166-R170 PolarHBondContact O-N 2.95Å; P166-R170 PolarHBondContact O-NE 3Å
167	R	98.1	Very high	95.6	Very high	81 Å²	81	48 Å²	48	31%	0.306	22%	0.215	S	C	.	.	H	α-helix	trans	-70.4	-41.4	174.3	-67.8	-170.7	-68.8	122.4	2.3	111.4	F79 E83 D163 S164 Y165 L169 R170 S171	F79-R167 HydrophobicContact CE1-CB 4.48Å; F79-R167 HydrophobicContact CZ-CB 3.8Å; E83-R167 IonicContact OE1-CZ 2.93Å; E83-R167 IonicContact OE1-NH1 3.16Å; E83-R167 PolarHBondContact OE1-NH1 3.18Å; E83-R167 IonicContact OE2-CZ 2.69Å; E83-R167 IonicContact OE2-NH1 3.86Å; E83-R167 PolarHBondContact OE2-NH1 3.23Å; E83-R167 IonicContact OE2-NH2 3.16Å; E83-R167 PolarHBondContact OE2-NH2 3.32Å; E83-R167 VanDerWaalsContact OE2-NH2 3.16Å; D163-R167 WeakPolarHBondContact O-CG 3.43Å; D163-R167 PolarHBondContact O-N 3.49Å; D163-R167 IonicContact OD1-CZ 3.49Å; D163-R167 IonicContact OD1-NE 3.73Å; D163-R167 PolarHBondContact OD1-NE 3.28Å; D163-R167 IonicContact OD1-NH2 3.56Å; D163-R167 IonicContact OD2-CZ 3.28Å; D163-R167 IonicContact OD2-NE 2.72Å; D163-R167 IonicContact OD2-NH2 3.78Å; D163-R167 PolarHBondContact OD2-NH2 2.61Å; S164-R167 PolarHBondContact O-N 3.2Å; Y165-R167 PolarHBondContact O-N 3.32Å; R167-L169 PolarHBondContact O-N 2.83Å; R167-R170 CarbonylContact O-C 3.51Å; R167-R170 PolarHBondContact O-N 3.39Å; R167-R170 VanDerWaalsContact O-N 3.07Å; R167-S171 PolarHBondContact O-N 3.42Å
168	F	97.9	Very high	95.2	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-55.7	-47.2	172.5	167.1	-103.1	0	0	0	112	W59 L66 T75 F76 F79 S164 Y165 R170 S171 I173 Y174	W59-F168 HydrophobicContact CE3-CZ 4.21Å; L66-F168 HydrophobicContact CD1-CE1 3.67Å; L66-F168 HydrophobicContact CD1-CZ 3.97Å; L66-F168 HydrophobicContact CD2-CD1 3.77Å; L66-F168 HydrophobicContact CD2-CE1 3.67Å; L66-F168 HydrophobicContact CD2-CZ 4.46Å; L66-F168 HydrophobicContact CG-CE1 4.36Å; T75-F168 HydrophobicContact CG2-CE2 3.72Å; T75-F168 HydrophobicContact CG2-CZ 4.05Å; F76-F168 HydrophobicContact CD2-CB 3.79Å; F76-F168 HydrophobicContact CD2-CD1 4.05Å; F76-F168 AromaticContact CD2-CD2 3.86Å; F76-F168 HydrophobicContact CD2-CD2 3.86Å; F76-F168 HydrophobicContact CD2-CE2 4.48Å; F76-F168 AromaticContact CD2-CG 3.61Å; F76-F168 HydrophobicContact CD2-CG 3.61Å; F76-F168 HydrophobicContact CE2-CB 3.76Å; F76-F168 HydrophobicContact CE2-CG 4.09Å; F79-F168 HydrophobicContact CB-CD2 3.77Å; F79-F168 HydrophobicContact CB-CE2 4.41Å; F79-F168 HydrophobicContact CD1-CB 3.68Å; F79-F168 HydrophobicContact CD1-CD2 4.1Å; F79-F168 HydrophobicContact CD1-CG 4.36Å; F79-F168 HydrophobicContact CD2-CB 4.5Å; F79-F168 HydrophobicContact CD2-CD2 4.31Å; F79-F168 HydrophobicContact CE1-CB 3.71Å; F79-F168 HydrophobicContact CG-CB 4.09Å; F79-F168 AromaticContact CG-CD2 3.79Å; F79-F168 HydrophobicContact CG-CD2 3.79Å; F79-F168 HydrophobicContact CG-CG 4.44Å; F79-F168 HydrophobicContact CZ-CB 4.14Å; S164-F168 WeakPolarHBondContact O-CB 3.34Å; S164-F168 PolarHBondContact O-N 2.69Å; Y165-F168 HydrophobicContact CD2-CD1 4.36Å; Y165-F168 WeakPolarHBondContact O-CB 3.35Å; Y165-F168 PolarHBondContact O-N 3.24Å; Y165-F168 VanDerWaalsContact O-N 3.15Å; F168-R170 PolarHBondContact O-N 3.05Å; F168-R170 VanDerWaalsContact O-N 3.16Å; F168-S171 VanDerWaalsContact O-CB 3.26Å; F168-S171 WeakPolarHBondContact O-CB 3.39Å; F168-S171 PolarHBondContact O-N 3.34Å; F168-S171 PolarHBondContact O-OG 3.08Å; F168-I173 HydrophobicContact CE2-CG2 4.46Å; F168-Y174 AromaticContact CE1-CD2 3.89Å; F168-Y174 HydrophobicContact CE1-CD2 3.89Å; F168-Y174 HydrophobicContact CE1-CE2 4.42Å; F168-Y174 HydrophobicContact CE1-CG 4.16Å; F168-Y174 AromaticContact CZ-CD2 3.75Å; F168-Y174 HydrophobicContact CZ-CD2 3.75Å; F168-Y174 HydrophobicContact CZ-CG 4.13Å; F168-Y174 WeakPolarHBondContact O-CB 3.39Å
169	L	97.3	Very high	94.7	Very high	41 Å²	41	52.3 Å²	52.3	22%	0.215	24%	0.239	C	C	.	.	H	α-helix	trans	-64.8	-20.6	179.2	-63.4	179.9	0	0	0	113.6	Y165 R167 Y174	Y165-L169 HydrophobicContact CD2-CG 4.39Å; Y165-L169 HydrophobicContact CE1-CD1 4Å; Y165-L169 HydrophobicContact CE2-CD1 4.04Å; Y165-L169 HydrophobicContact CE2-CD2 3.99Å; Y165-L169 HydrophobicContact CE2-CG 4.01Å; Y165-L169 WeakPolarHBondContact O-CG 3.12Å; Y165-L169 PolarHBondContact O-N 3.3Å; R167-L169 PolarHBondContact O-N 2.83Å; L169-Y174 HydrophobicContact CB-CD1 4.47Å; L169-Y174 HydrophobicContact CD2-CD1 4.09Å; L169-Y174 HydrophobicContact CD2-CE1 3.72Å; L169-Y174 WeakPolarHBondContact O-CD1 3.41Å
170	R	95.9	Very high	94.2	Very high	147 Å²	147	51.8 Å²	51.8	56%	0.555	24%	0.24	S	C	*	.	H	α-helix	trans	-96.3	-7.5	174.3	-67.3	-177.6	-67.5	-129.2	-0.8	113.4	P166 R167 F168 R175	P166-R170 PolarHBondContact O-N 2.95Å; P166-R170 PolarHBondContact O-NE 3Å; R167-R170 CarbonylContact O-C 3.51Å; R167-R170 PolarHBondContact O-N 3.39Å; R167-R170 VanDerWaalsContact O-N 3.07Å; F168-R170 PolarHBondContact O-N 3.05Å; F168-R170 VanDerWaalsContact O-N 3.16Å; R170-R175 PolarHBondContact O-NE 3.16Å; R170-R175 PolarHBondContact O-NH1 3.29Å
171	S	94.8	Very high	93.6	Very high	16 Å²	16	52.5 Å²	52.5	11%	0.112	24%	0.243	C	C	.	.	S	Bend	trans	-72.4	152.6	-175.4	73.6	0	0	0	0	111.9	R167 F168 I173 Y174 R175	R167-S171 PolarHBondContact O-N 3.42Å; F168-S171 VanDerWaalsContact O-CB 3.26Å; F168-S171 WeakPolarHBondContact O-CB 3.39Å; F168-S171 PolarHBondContact O-N 3.34Å; F168-S171 PolarHBondContact O-OG 3.08Å; S171-I173 PolarHBondContact O-N 3.49Å; S171-I173 WeakPolarHBondContact OG-CG2 3.37Å; S171-Y174 PolarHBondContact O-N 2.91Å; S171-Y174 PolarHBondContact OG-N 2.81Å; S171-R175 WeakPolarHBondContact O-CG 3.36Å; S171-R175 PolarHBondContact O-N 3.31Å
172	D	91.4	Very high	93	Very high	57 Å²	57	50.6 Å²	50.6	31%	0.305	24%	0.241	S	C	.	.	H	α-helix	trans	-68.3	-24.7	179	-71	-26.5	0	0	0	112.6	N26 S176	N26-D172 HydrophobicContact CB-CB 3.92Å; N26-D172 WeakPolarHBondContact ND2-CB 3.38Å; N26-D172 PolarHBondContact ND2-OD2 3.15Å; D172-S176 WeakPolarHBondContact O-CB 3.46Å; D172-S176 PolarHBondContact O-N 3.29Å; D172-S176 PolarHBondContact O-OG 3.44Å
173	I	90.1	Very high	92.2	Very high	31 Å²	31	44.1 Å²	44.1	16%	0.159	23%	0.226	C	C	.	.	H	α-helix	trans	-65	-41	175	-171.9	173.1	0	0	0	111.4	F33 T75 T78 F79 F168 S171 L177	F33-I173 HydrophobicContact CD1-CD1 3.81Å; F33-I173 HydrophobicContact CD1-CG1 3.8Å; F33-I173 HydrophobicContact CD2-CD1 4.1Å; F33-I173 HydrophobicContact CE1-CD1 3.74Å; F33-I173 HydrophobicContact CE1-CG1 3.96Å; F33-I173 HydrophobicContact CE2-CD1 4.04Å; F33-I173 HydrophobicContact CG-CD1 4Å; F33-I173 HydrophobicContact CG-CG1 4.3Å; F33-I173 HydrophobicContact CZ-CD1 3.86Å; T75-I173 HydrophobicContact CG2-CD1 3.91Å; T75-I173 HydrophobicContact CG2-CG1 3.87Å; T78-I173 HydrophobicContact CG2-CD1 3.94Å; F79-I173 HydrophobicContact CB-CG2 4.34Å; F79-I173 HydrophobicContact CD2-CG2 4.27Å; F168-I173 HydrophobicContact CE2-CG2 4.46Å; S171-I173 PolarHBondContact O-N 3.49Å; S171-I173 WeakPolarHBondContact OG-CG2 3.37Å; I173-L177 WeakPolarHBondContact O-CB 3.22Å; I173-L177 PolarHBondContact O-N 3.27Å
174	Y	92.8	Very high	91.2	Very high	10 Å²	10	44.6 Å²	44.6	4%	0.039	23%	0.229	C	C	.	.	H	α-helix	trans	-76.2	-43	177	-177.9	-115.7	0	0	0	112.3	T56 W59 F168 L169 S171 L177 L178	T56-Y174 HydrophobicContact CG2-CD2 4.45Å; T56-Y174 HydrophobicContact CG2-CE2 3.78Å; T56-Y174 PolarHBondContact O-OH 2.96Å; W59-Y174 HydrophobicContact CB-CE2 4.21Å; W59-Y174 HydrophobicContact CD2-CE2 4.38Å; W59-Y174 AromaticContact CE3-CD2 3.93Å; W59-Y174 HydrophobicContact CE3-CD2 3.93Å; W59-Y174 AromaticContact CE3-CE2 3.66Å; W59-Y174 HydrophobicContact CE3-CE2 3.66Å; W59-Y174 HydrophobicContact CZ3-CD2 4.36Å; W59-Y174 HydrophobicContact CZ3-CE2 4.38Å; F168-Y174 AromaticContact CE1-CD2 3.89Å; F168-Y174 HydrophobicContact CE1-CD2 3.89Å; F168-Y174 HydrophobicContact CE1-CE2 4.42Å; F168-Y174 HydrophobicContact CE1-CG 4.16Å; F168-Y174 AromaticContact CZ-CD2 3.75Å; F168-Y174 HydrophobicContact CZ-CD2 3.75Å; F168-Y174 HydrophobicContact CZ-CG 4.13Å; F168-Y174 WeakPolarHBondContact O-CB 3.39Å; L169-Y174 HydrophobicContact CB-CD1 4.47Å; L169-Y174 HydrophobicContact CD2-CD1 4.09Å; L169-Y174 HydrophobicContact CD2-CE1 3.72Å; L169-Y174 WeakPolarHBondContact O-CD1 3.41Å; S171-Y174 PolarHBondContact O-N 2.91Å; S171-Y174 PolarHBondContact OG-N 2.81Å; Y174-L177 HydrophobicContact CD2-CD2 4.44Å; Y174-L177 WeakPolarHBondContact O-CB 3.49Å; Y174-L177 PolarHBondContact O-N 3.31Å; Y174-L178 HydrophobicContact CD1-CD1 4.13Å; Y174-L178 HydrophobicContact CE1-CD1 3.6Å; Y174-L178 HydrophobicContact CE1-CG 4.42Å; Y174-L178 HydrophobicContact CE2-CD1 4.42Å; Y174-L178 HydrophobicContact CE2-CG 4.42Å; Y174-L178 PolarHBondContact O-N 3.16Å; Y174-L178 VanDerWaalsContact O-N 3.11Å
175	R	92.1	Very high	90	Very high	123 Å²	123	47.6 Å²	47.6	46%	0.464	25%	0.253	S	S	.	.	H	α-helix	trans	-64.8	-45.4	179	-70.1	175	175.1	168.1	-1.9	112.6	R170 S171 L177 L178 D179	R170-R175 PolarHBondContact O-NE 3.16Å; R170-R175 PolarHBondContact O-NH1 3.29Å; S171-R175 WeakPolarHBondContact O-CG 3.36Å; S171-R175 PolarHBondContact O-N 3.31Å; R175-L177 PolarHBondContact O-N 3.3Å; R175-L178 PolarHBondContact O-N 3.22Å; R175-D179 PolarHBondContact O-N 3.18Å
176	S	88.1	Confident	88.6	Confident	16 Å²	16	52.8 Å²	52.8	11%	0.112	29%	0.286	C	S	.	.	H	α-helix	trans	-63.6	-32.3	178.2	-58.3	0	0	0	0	112	D172 S180	D172-S176 WeakPolarHBondContact O-CB 3.46Å; D172-S176 PolarHBondContact O-N 3.29Å; D172-S176 PolarHBondContact O-OG 3.44Å; S176-S180 WeakPolarHBondContact O-CB 3.37Å; S176-S180 PolarHBondContact O-N 3.41Å
177	L	87.8	Confident	86.8	Confident	1 Å²	1	59 Å²	59	1%	0.005	31%	0.309	C	S	.	.	H	α-helix	trans	-64	-50.3	173.9	162.6	68	0	0	0	110.9	M34 L51 T56 W59 I173 Y174 R175 D179 S180 L181	M34-L177 HydrophobicContact CE-CD1 3.26Å; M34-L177 HydrophobicContact CG-CD1 4.29Å; M34-L177 HydrophobicContact SD-CB 4.36Å; M34-L177 HydrophobicContact SD-CD1 3.12Å; M34-L177 WeakPolarHBondContact SD-CD1 3.47Å; M34-L177 HydrophobicContact SD-CG 4.25Å; L51-L177 HydrophobicContact CD2-CD1 3.6Å; L51-L177 HydrophobicContact CD2-CD2 4.46Å; T56-L177 HydrophobicContact CG2-CD2 3.51Å; T56-L177 HydrophobicContact CG2-CG 3.82Å; W59-L177 HydrophobicContact CE3-CD2 4.27Å; W59-L177 HydrophobicContact CH2-CD2 3.6Å; W59-L177 HydrophobicContact CZ3-CD2 3.28Å; I173-L177 WeakPolarHBondContact O-CB 3.22Å; I173-L177 PolarHBondContact O-N 3.27Å; Y174-L177 HydrophobicContact CD2-CD2 4.44Å; Y174-L177 WeakPolarHBondContact O-CB 3.49Å; Y174-L177 PolarHBondContact O-N 3.31Å; R175-L177 PolarHBondContact O-N 3.3Å; L177-D179 PolarHBondContact O-N 3.12Å; L177-S180 PolarHBondContact O-N 3.37Å; L177-L181 HydrophobicContact CD1-CD1 3.71Å; L177-L181 HydrophobicContact CD1-CG 4.16Å; L177-L181 HydrophobicContact CG-CD1 4.26Å; L177-L181 WeakPolarHBondContact O-CG 3.37Å; L177-L181 PolarHBondContact O-N 3.4Å; L177-L181 VanDerWaalsContact O-N 3.08Å
178	L	89.8	Confident	84.3	Confident	39 Å²	39	61.1 Å²	61.1	20%	0.204	36%	0.357	C	S	.	.	H	α-helix	trans	-59.3	-46.4	176.6	-72.9	173.3	0	0	0	111.9	L53 T56 Q57 Y174 R175 S180 L181 A182	L53-L178 HydrophobicContact CD1-CD2 3.76Å; T56-L178 HydrophobicContact CG2-CD2 3.56Å; T56-L178 HydrophobicContact CG2-CG 4.17Å; Q57-L178 HydrophobicContact CG-CD2 4Å; Y174-L178 HydrophobicContact CD1-CD1 4.13Å; Y174-L178 HydrophobicContact CE1-CD1 3.6Å; Y174-L178 HydrophobicContact CE1-CG 4.42Å; Y174-L178 HydrophobicContact CE2-CD1 4.42Å; Y174-L178 HydrophobicContact CE2-CG 4.42Å; Y174-L178 PolarHBondContact O-N 3.16Å; Y174-L178 VanDerWaalsContact O-N 3.11Å; R175-L178 PolarHBondContact O-N 3.22Å; L178-S180 VanDerWaalsContact C-N 3.33Å; L178-S180 PolarHBondContact O-N 3.31Å; L178-L181 PolarHBondContact O-N 3.11Å; L178-A182 WeakPolarHBondContact O-CB 3.39Å; L178-A182 PolarHBondContact O-N 3.36Å
179	D	88.5	Confident	83.6	Confident	103 Å²	103	64.2 Å²	64.2	55%	0.551	37%	0.374	S	S	*	.	H	α-helix	trans	-60.8	-41.8	179.1	-73.9	-10.7	0	0	0	111.9	R175 L177 A183	R175-D179 PolarHBondContact O-N 3.18Å; L177-D179 PolarHBondContact O-N 3.12Å; D179-A183 WeakPolarHBondContact O-CB 3.35Å; D179-A183 PolarHBondContact O-N 2.65Å
180	S	85.6	Confident	82.9	Confident	34 Å²	34	65.4 Å²	65.4	24%	0.238	38%	0.383	C	S	.	.	H	α-helix	trans	-64.2	-45.3	178.4	-169.1	0	0	0	0	111.4	S176 L177 L178 A183 D184	S176-S180 WeakPolarHBondContact O-CB 3.37Å; S176-S180 PolarHBondContact O-N 3.41Å; L177-S180 PolarHBondContact O-N 3.37Å; L178-S180 VanDerWaalsContact C-N 3.33Å; L178-S180 PolarHBondContact O-N 3.31Å; S180-A183 PolarHBondContact O-N 3.22Å; S180-D184 PolarHBondContact O-N 3.19Å; S180-D184 VanDerWaalsContact O-N 3.11Å
181	L	86	Confident	82.2	Confident	15 Å²	15	60.9 Å²	60.9	8%	0.079	37%	0.373	C	S	.	.	H	α-helix	trans	-68.5	-36.9	-179.8	-68.8	173.4	0	0	0	112	M34 L51 L53 T56 L177 L178 D184 A185	M34-L181 HydrophobicContact CE-CD2 4.46Å; L51-L181 HydrophobicContact CD2-CD1 4.27Å; L51-L181 HydrophobicContact CG-CD1 4.12Å; L51-L181 WeakPolarHBondContact O-CD2 3.49Å; L53-L181 HydrophobicContact CB-CB 4.09Å; L53-L181 HydrophobicContact CD1-CB 4.03Å; T56-L181 HydrophobicContact CG2-CD1 4.37Å; T56-L181 WeakPolarHBondContact OG1-CD1 3.26Å; L177-L181 HydrophobicContact CD1-CD1 3.71Å; L177-L181 HydrophobicContact CD1-CG 4.16Å; L177-L181 HydrophobicContact CG-CD1 4.26Å; L177-L181 WeakPolarHBondContact O-CG 3.37Å; L177-L181 PolarHBondContact O-N 3.4Å; L177-L181 VanDerWaalsContact O-N 3.08Å; L178-L181 PolarHBondContact O-N 3.11Å; L181-D184 PolarHBondContact O-N 3.35Å; L181-A185 WeakPolarHBondContact O-CB 3.42Å; L181-A185 PolarHBondContact O-N 3.34Å
182	A	85.9	Confident	81.4	Confident	37 Å²	37	63.5 Å²	63.5	31%	0.306	39%	0.389	S	S	.	.	H	α-helix	trans	-64.9	-41.1	174.1	0	0	0	0	0	111.9	L53 L178 D184 A185 V186	L53-A182 HydrophobicContact CD1-CB 4.47Å; L53-A182 HydrophobicContact CD2-CB 4.11Å; L178-A182 WeakPolarHBondContact O-CB 3.39Å; L178-A182 PolarHBondContact O-N 3.36Å; A182-D184 VanDerWaalsContact C-N 3.31Å; A182-D184 PolarHBondContact O-N 3.38Å; A182-A185 PolarHBondContact O-N 3Å; A182-V186 WeakPolarHBondContact O-CG2 3.48Å; A182-V186 PolarHBondContact O-N 3.04Å
183	A	81.8	Confident	80.8	Confident	45 Å²	45	63.9 Å²	63.9	37%	0.372	39%	0.394	S	S	.	.	H	α-helix	trans	-65.9	-32.9	177	0	0	0	0	0	113	D179 S180 K187	D179-A183 WeakPolarHBondContact O-CB 3.35Å; D179-A183 PolarHBondContact O-N 2.65Å; S180-A183 PolarHBondContact O-N 3.22Å; A183-K187 WeakPolarHBondContact O-CG 3.42Å
184	D	76.9	Confident	80.2	Confident	80 Å²	80	66.1 Å²	66.1	43%	0.428	41%	0.41	S	S	.	.	H	α-helix	trans	-74.3	-35.3	176.3	-70.8	-17.7	0	0	0	111.8	S180 L181 A182 V186 K187	S180-D184 PolarHBondContact O-N 3.19Å; S180-D184 VanDerWaalsContact O-N 3.11Å; L181-D184 PolarHBondContact O-N 3.35Å; A182-D184 VanDerWaalsContact C-N 3.31Å; A182-D184 PolarHBondContact O-N 3.38Å; D184-V186 VanDerWaalsContact C-N 3.29Å; D184-V186 PolarHBondContact O-N 3.05Å; D184-K187 PolarHBondContact O-N 3.3Å
185	A	72.4	Confident	79.3	Confident	65 Å²	65	70.1 Å²	70.1	54%	0.537	44%	0.436	S	S	.	.	H	α-helix	trans	-67.8	-24.2	177.8	0	0	0	0	0	114.1	L181 A182	L181-A185 WeakPolarHBondContact O-CB 3.42Å; L181-A185 PolarHBondContact O-N 3.34Å; A182-A185 PolarHBondContact O-N 3Å
186	V	70	Confident	78.3	Confident	126 Å²	126	66.1 Å²	66.1	76%	0.764	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	-14.8	178.2	176.7	0	0	0	0	112.5	A182 D184	A182-V186 WeakPolarHBondContact O-CG2 3.48Å; A182-V186 PolarHBondContact O-N 3.04Å; D184-V186 VanDerWaalsContact C-N 3.29Å; D184-V186 PolarHBondContact O-N 3.05Å
187	K	58.7	Low	77.5	Confident	172 Å²	172	70.3 Å²	70.3	75%	0.748	46%	0.461	S	S	*	.			trans	-99.3	-8.9	-176.4	-71.2	177.5	-177.1	176.2	0	114.4	A183 D184	A183-K187 WeakPolarHBondContact O-CG 3.42Å; D184-K187 PolarHBondContact O-N 3.3Å
188	G	46.1	Very low	76.5	Confident	126 Å²	126	76.5 Å²	76.5	100%	1.299	50%	0.502	S	S	*	.			trans	-98.5	0	175.4	0	0	0	0	0	111.2

Retrieved 188 of 188 residues in 222.8 ms (Link to these results)

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