A0A061IL51_CRIGR Loading...

Spermatogenesis-associated protein 16

AlphaFold DB , UniProt , Accession A0A061IL51, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene Spata16, Length 571 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	27.9	Very low	34.1	Very low	235 Å²	235	130.6 Å²	130.6	100%	1.158	70%	0.7	S	S	*	*				0	158.8	0	-74.2	170.4	172.3	0	0	109
2	D	27.1	Very low	34.7	Very low	154 Å²	154	121.8 Å²	121.8	82%	0.824	65%	0.654	S	S	*	*			trans	60.9	114.4	158.4	-60.9	10.1	0	0	0	121.3	G4	D2-G4 VanDerWaalsContact C-N 3.28Å; D2-G4 PolarHBondContact O-N 3.27Å; D2-G4 VanDerWaalsContact O-N 3.09Å
3	S	35.5	Very low	35.4	Very low	114 Å²	114	114.7 Å²	114.7	80%	0.797	62%	0.618	S	S	*	*			trans	-83.5	41.1	-175	46.6	0	0	0	0	114.3	K5	S3-K5 VanDerWaalsContact C-N 3.31Å; S3-K5 PolarHBondContact O-N 2.99Å; S3-K5 VanDerWaalsContact O-N 3.08Å
4	G	30	Very low	36	Very low	70 Å²	70	115.6 Å²	115.6	72%	0.722	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.5	-3.8	-165.6	0	0	0	0	0	118.8	D2	D2-G4 VanDerWaalsContact C-N 3.28Å; D2-G4 PolarHBondContact O-N 3.27Å; D2-G4 VanDerWaalsContact O-N 3.09Å
5	K	35.2	Very low	36.3	Very low	195 Å²	195	116.8 Å²	116.8	85%	0.848	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.5	-3.5	-167	-71.2	-171.8	176.3	-177.9	0	117.1	S3	S3-K5 VanDerWaalsContact C-N 3.31Å; S3-K5 PolarHBondContact O-N 2.99Å; S3-K5 VanDerWaalsContact O-N 3.08Å
6	S	36.8	Very low	36.8	Very low	78 Å²	78	110.7 Å²	110.7	55%	0.545	58%	0.575	S	S	.	*	H	α-helix	trans	-71.7	-40.8	-171.8	60.8	0	0	0	0	114.9	N8	S6-N8 PolarHBondContact O-N 3.36Å
7	R	32.6	Very low	36.8	Very low	205 Å²	205	105.5 Å²	105.5	77%	0.774	55%	0.551	S	S	*	*	H	α-helix	trans	-66.7	-28.6	-174	-82.1	-176.3	171.5	171.8	-1.3	114.6	T11	R7-T11 WeakPolarHBondContact O-CB 3.46Å; R7-T11 WeakPolarHBondContact O-CG2 3.4Å; R7-T11 PolarHBondContact O-N 2.91Å; R7-T11 VanDerWaalsContact O-N 3.07Å; R7-T11 PolarHBondContact O-OG1 3.01Å
8	N	38.1	Very low	36.8	Very low	116 Å²	116	110.2 Å²	110.2	62%	0.62	56%	0.56	S	S	*	*	H	α-helix	trans	-70.8	-46.4	-174.1	-74.4	7.2	0	0	0	112.1	S6 E10 T11 T12	S6-N8 PolarHBondContact O-N 3.36Å; N8-E10 VanDerWaalsContact C-N 3.35Å; N8-E10 PolarHBondContact O-N 3.28Å; N8-T11 PolarHBondContact O-N 3.13Å; N8-T11 PolarHBondContact O-OG1 3.08Å; N8-T11 VanDerWaalsContact O-OG1 3.1Å; N8-T12 WeakPolarHBondContact O-CB 3.48Å; N8-T12 PolarHBondContact O-N 3.16Å; N8-T12 PolarHBondContact O-OG1 3.33Å
9	L	37.3	Very low	37.2	Very low	87 Å²	87	107.3 Å²	107.3	46%	0.455	55%	0.546	S	S	.	.	H	α-helix	trans	-64.5	-40.6	-178.4	-168.6	70.6	0	0	0	112	T12 V13	L9-T12 PolarHBondContact O-N 3.11Å; L9-V13 WeakPolarHBondContact O-CG2 3.47Å; L9-V13 PolarHBondContact O-N 3.45Å
10	E	35.6	Very low	37.4	Very low	111 Å²	111	104.5 Å²	104.5	52%	0.519	53%	0.532	S	S	.	.	H	α-helix	trans	-69.6	-33.4	178.5	-157.8	-167.3	159.1	0	0	112.2	N8 K14	N8-E10 VanDerWaalsContact C-N 3.35Å; N8-E10 PolarHBondContact O-N 3.28Å; E10-K14 HydrophobicContact CG-CD 4.33Å; E10-K14 VanDerWaalsContact O-CB 3.26Å; E10-K14 WeakPolarHBondContact O-CB 3.28Å; E10-K14 WeakPolarHBondContact O-CD 3.5Å; E10-K14 WeakPolarHBondContact O-CG 3.47Å; E10-K14 PolarHBondContact O-N 3Å; E10-K14 WeakPolarHBondContact OE1-CE 3.45Å; E10-K14 IonicContact OE1-NZ 2.62Å; E10-K14 PolarHBondContact OE1-NZ 3.48Å
11	T	39.4	Very low	37.5	Very low	72 Å²	72	104.7 Å²	104.7	44%	0.442	53%	0.529	S	S	.	.	H	α-helix	trans	-76.6	-32.4	173.5	51.7	0	0	0	0	113	R7 N8 R15	R7-T11 WeakPolarHBondContact O-CB 3.46Å; R7-T11 WeakPolarHBondContact O-CG2 3.4Å; R7-T11 PolarHBondContact O-N 2.91Å; R7-T11 VanDerWaalsContact O-N 3.07Å; R7-T11 PolarHBondContact O-OG1 3.01Å; N8-T11 PolarHBondContact O-N 3.13Å; N8-T11 PolarHBondContact O-OG1 3.08Å; N8-T11 VanDerWaalsContact O-OG1 3.1Å; T11-R15 WeakPolarHBondContact O-CB 3.37Å; T11-R15 PolarHBondContact O-N 2.87Å
12	T	41	Very low	37.5	Very low	24 Å²	24	98.4 Å²	98.4	15%	0.147	50%	0.499	C	S	.	.	H	α-helix	trans	-63.7	-50.9	169.6	-70.1	0	0	0	0	110.9	N8 L9 K14 R15 V16 E502	N8-T12 WeakPolarHBondContact O-CB 3.48Å; N8-T12 PolarHBondContact O-N 3.16Å; N8-T12 PolarHBondContact O-OG1 3.33Å; L9-T12 PolarHBondContact O-N 3.11Å; T12-K14 VanDerWaalsContact C-N 3.33Å; T12-K14 PolarHBondContact O-N 3.29Å; T12-R15 PolarHBondContact O-N 3.5Å; T12-R15 VanDerWaalsContact O-N 3.09Å; T12-V16 HydrophobicContact CG2-CG2 4.23Å; T12-V16 WeakPolarHBondContact O-CG2 3.28Å; T12-V16 PolarHBondContact O-N 3.01Å; T12-E502 HydrophobicContact CG2-CB 4.42Å; T12-E502 WeakPolarHBondContact CG2-OE2 3.13Å
13	V	43.2	Very low	37.6	Very low	30 Å²	30	95.1 Å²	95.1	18%	0.182	49%	0.487	C	S	.	.	H	α-helix	trans	-60.7	-42.2	177.5	173.7	0	0	0	0	111.4	L9 C17 V525 T528	L9-V13 WeakPolarHBondContact O-CG2 3.47Å; L9-V13 PolarHBondContact O-N 3.45Å; V13-C17 WeakPolarHBondContact O-CB 3.37Å; V13-C17 PolarHBondContact O-N 3.47Å; V13-C17 PolarHBondContact O-SG 3.13Å; V13-V525 HydrophobicContact CG2-CG2 3.79Å; V13-T528 HydrophobicContact CG1-CG2 4.27Å
14	K	44.8	Very low	37.2	Very low	127 Å²	127	99.6 Å²	99.6	55%	0.552	49%	0.492	S	S	*	.	H	α-helix	trans	-65.5	-35.4	174.6	-75.4	171	175.7	174.4	0	112.6	E10 T12 R18	E10-K14 HydrophobicContact CG-CD 4.33Å; E10-K14 VanDerWaalsContact O-CB 3.26Å; E10-K14 WeakPolarHBondContact O-CB 3.28Å; E10-K14 WeakPolarHBondContact O-CD 3.5Å; E10-K14 WeakPolarHBondContact O-CG 3.47Å; E10-K14 PolarHBondContact O-N 3Å; E10-K14 WeakPolarHBondContact OE1-CE 3.45Å; E10-K14 IonicContact OE1-NZ 2.62Å; E10-K14 PolarHBondContact OE1-NZ 3.48Å; T12-K14 VanDerWaalsContact C-N 3.33Å; T12-K14 PolarHBondContact O-N 3.29Å; K14-R18 WeakPolarHBondContact O-CB 3.49Å; K14-R18 PolarHBondContact O-N 2.82Å
15	R	40.6	Very low	37	Very low	134 Å²	134	101.6 Å²	101.6	51%	0.506	49%	0.485	S	S	.	.	H	α-helix	trans	-69.9	-50.8	176.2	-178.1	-176.5	-69.7	148.2	-4.4	111.6	T11 T12 C17 R18 D19	T11-R15 WeakPolarHBondContact O-CB 3.37Å; T11-R15 PolarHBondContact O-N 2.87Å; T12-R15 PolarHBondContact O-N 3.5Å; T12-R15 VanDerWaalsContact O-N 3.09Å; R15-C17 VanDerWaalsContact C-N 3.28Å; R15-C17 PolarHBondContact O-N 3.17Å; R15-R18 PolarHBondContact O-N 3.11Å; R15-D19 VanDerWaalsContact CG-OD2 3.26Å; R15-D19 WeakPolarHBondContact CG-OD2 3.25Å; R15-D19 WeakPolarHBondContact O-CB 3.5Å; R15-D19 PolarHBondContact O-N 2.96Å
16	V	43.3	Very low	36.6	Very low	19 Å²	19	100 Å²	100	12%	0.115	49%	0.485	C	S	.	.	H	α-helix	trans	-54.8	-44.9	176.4	171.2	0	0	0	0	110.7	T12 L20 L503	T12-V16 HydrophobicContact CG2-CG2 4.23Å; T12-V16 WeakPolarHBondContact O-CG2 3.28Å; T12-V16 PolarHBondContact O-N 3.01Å; V16-L20 HydrophobicContact CG1-CD1 4.35Å; V16-L20 WeakPolarHBondContact O-CD1 3.49Å; V16-L20 VanDerWaalsContact O-CG 3.27Å; V16-L20 WeakPolarHBondContact O-CG 3.45Å; V16-L20 PolarHBondContact O-N 3.3Å; V16-L503 HydrophobicContact CG1-CD1 4.49Å; V16-L503 HydrophobicContact CG1-CD2 4.4Å
17	C	37.7	Very low	36.1	Very low	23 Å²	23	101.9 Å²	101.9	16%	0.155	49%	0.494	C	S	.	.	H	α-helix	trans	-63.7	-48.7	172.8	-65.5	0	0	0	0	112.2	V13 R15 D19 L20 F21	V13-C17 WeakPolarHBondContact O-CB 3.37Å; V13-C17 PolarHBondContact O-N 3.47Å; V13-C17 PolarHBondContact O-SG 3.13Å; R15-C17 VanDerWaalsContact C-N 3.28Å; R15-C17 PolarHBondContact O-N 3.17Å; C17-D19 VanDerWaalsContact C-N 3.34Å; C17-D19 PolarHBondContact O-N 3.03Å; C17-L20 PolarHBondContact O-N 3.38Å; C17-F21 HydrophobicContact CB-CE2 4.45Å; C17-F21 WeakPolarHBondContact O-CD2 3.47Å; C17-F21 PolarHBondContact O-N 3.26Å
18	R	35.9	Very low	35.9	Very low	190 Å²	190	97.5 Å²	97.5	72%	0.717	50%	0.495	S	S	*	.	H	α-helix	trans	-62.8	-36.3	-175.4	-168.7	-178.9	-141.8	179.6	5.2	113.3	K14 R15 F21	K14-R18 WeakPolarHBondContact O-CB 3.49Å; K14-R18 PolarHBondContact O-N 2.82Å; R15-R18 PolarHBondContact O-N 3.11Å; R18-F21 PolarHBondContact O-N 3.35Å
19	D	44.3	Very low	35.4	Very low	55 Å²	55	101.7 Å²	101.7	29%	0.294	51%	0.507	S	S	.	.	H	α-helix	trans	-83.2	-30	-175.4	-62.9	-9.5	0	0	0	111.6	R15 C17 F21 I22 Q499	R15-D19 VanDerWaalsContact CG-OD2 3.26Å; R15-D19 WeakPolarHBondContact CG-OD2 3.25Å; R15-D19 WeakPolarHBondContact O-CB 3.5Å; R15-D19 PolarHBondContact O-N 2.96Å; C17-D19 VanDerWaalsContact C-N 3.34Å; C17-D19 PolarHBondContact O-N 3.03Å; D19-F21 PolarHBondContact O-N 3.31Å; D19-I22 PolarHBondContact O-N 3.37Å; D19-Q499 PolarHBondContact OD2-NE2 3.02Å
20	L	41.7	Very low	34.8	Very low	51 Å²	51	107.1 Å²	107.1	27%	0.267	53%	0.527	S	S	.	.	H	α-helix	trans	-56.2	-36.8	165.6	-77.4	167.6	0	0	0	111.8	V16 C17 I22 K405 L406	V16-L20 HydrophobicContact CG1-CD1 4.35Å; V16-L20 WeakPolarHBondContact O-CD1 3.49Å; V16-L20 VanDerWaalsContact O-CG 3.27Å; V16-L20 WeakPolarHBondContact O-CG 3.45Å; V16-L20 PolarHBondContact O-N 3.3Å; C17-L20 PolarHBondContact O-N 3.38Å; L20-I22 PolarHBondContact O-N 3.08Å; L20-K405 PolarHBondContact O-NZ 2.81Å; L20-L406 HydrophobicContact CD1-CD2 4.29Å
21	F	38.8	Very low	34.2	Very low	108 Å²	108	110.1 Å²	110.1	47%	0.474	54%	0.543	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	6.2	-177.3	-71.1	-52.2	0	0	0	116.2	C17 R18 D19 P23 L406 V532	C17-F21 HydrophobicContact CB-CE2 4.45Å; C17-F21 WeakPolarHBondContact O-CD2 3.47Å; C17-F21 PolarHBondContact O-N 3.26Å; R18-F21 PolarHBondContact O-N 3.35Å; D19-F21 PolarHBondContact O-N 3.31Å; F21-P23 WeakPolarHBondContact O-CD 3.32Å; F21-L406 HydrophobicContact CE1-CD1 4.25Å; F21-V532 HydrophobicContact CE1-CG1 4.15Å; F21-V532 HydrophobicContact CE2-CG1 4.35Å; F21-V532 HydrophobicContact CZ-CG1 3.53Å; F21-V532 HydrophobicContact CZ-CG2 4.34Å
22	I	28.3	Very low	33.7	Very low	103 Å²	103	112.1 Å²	112.1	53%	0.528	56%	0.557	S	S	.	*			trans	-94.7	101.4	177.2	-54.9	-179.1	0	0	0	111.3	D19 L20	D19-I22 PolarHBondContact O-N 3.37Å; L20-I22 PolarHBondContact O-N 3.08Å
23	P	29.1	Very low	32.9	Very low	86 Å²	86	117.4 Å²	117.4	56%	0.558	59%	0.59	S	S	*	*			trans	-70.9	136.7	158.3	30.7	-34	0	0	0	109.7	F21 I25	F21-P23 WeakPolarHBondContact O-CD 3.32Å; P23-I25 HydrophobicContact CB-CD1 4.37Å; P23-I25 HydrophobicContact CB-CG1 4.06Å; P23-I25 HydrophobicContact CG-CD1 3.75Å; P23-I25 HydrophobicContact CG-CG1 3.93Å; P23-I25 PolarHBondContact O-N 2.9Å
24	K	27.2	Very low	32.1	Very low	208 Å²	208	123.9 Å²	123.9	90%	0.904	62%	0.622	S	S	*	*			trans	-72	76.2	172.1	-78.5	-173.2	175.7	178.5	0	110.8	N26	K24-N26 PolarHBondContact O-N 3.06Å
25	I	26.1	Very low	31.1	Very low	112 Å²	112	123.1 Å²	123.1	57%	0.574	63%	0.629	S	S	*	*			trans	-81.5	106.9	175.8	-65.5	176	0	0	0	109	P23 T27	P23-I25 HydrophobicContact CB-CD1 4.37Å; P23-I25 HydrophobicContact CB-CG1 4.06Å; P23-I25 HydrophobicContact CG-CD1 3.75Å; P23-I25 HydrophobicContact CG-CG1 3.93Å; P23-I25 PolarHBondContact O-N 2.9Å; I25-T27 VanDerWaalsContact C-N 3.3Å; I25-T27 HydrophobicContact CG2-CG2 3.5Å; I25-T27 PolarHBondContact O-N 3.39Å
26	N	27.9	Very low	30.3	Very low	161 Å²	161	124.6 Å²	124.6	86%	0.861	65%	0.647	S	S	*	*			trans	-75.7	76.9	170.9	-80.2	-11	0	0	0	111	K24 S28	K24-N26 PolarHBondContact O-N 3.06Å; N26-S28 PolarHBondContact O-N 3.37Å
27	T	26.3	Very low	29.5	Very low	118 Å²	118	128.5 Å²	128.5	72%	0.724	68%	0.675	S	S	*	*			trans	-95.1	82	173.9	34.9	0	0	0	0	112.6	I25 K29	I25-T27 VanDerWaalsContact C-N 3.3Å; I25-T27 HydrophobicContact CG2-CG2 3.5Å; I25-T27 PolarHBondContact O-N 3.39Å; T27-K29 VanDerWaalsContact C-N 3.34Å; T27-K29 PolarHBondContact O-N 2.97Å; T27-K29 VanDerWaalsContact O-N 3.1Å
28	S	27.4	Very low	29.1	Very low	113 Å²	113	133.4 Å²	133.4	79%	0.79	71%	0.707	S	S	*	*			trans	-79.4	74.9	167.4	46.3	0	0	0	0	112	N26	N26-S28 PolarHBondContact O-N 3.37Å
29	K	27.3	Very low	28.4	Very low	204 Å²	204	131.8 Å²	131.8	89%	0.887	71%	0.712	S	S	*	*			trans	-164.4	133.8	158.5	-108	149.9	-171.6	178.4	0	112.4	T27	T27-K29 VanDerWaalsContact C-N 3.34Å; T27-K29 PolarHBondContact O-N 2.97Å; T27-K29 VanDerWaalsContact O-N 3.1Å
30	K	24.4	Very low	27.4	Very low	200 Å²	200	134 Å²	134	87%	0.87	73%	0.732	S	S	*	*			trans	-86.8	168	173.4	-69.2	-177.6	176.4	-179.4	0	111.5
31	M	23.7	Very low	26.6	Very low	174 Å²	174	138.9 Å²	138.9	86%	0.857	76%	0.757	S	S	*	*			trans	118.9	146.2	160.7	-67.3	-60.1	-160.9	0	0	113.6
32	P	28.4	Very low	25.8	Very low	114 Å²	114	141.5 Å²	141.5	74%	0.74	77%	0.771	S	S	*	*				-128.1	173.6	-65.4	28.3	-9	0	0	0	112.3
33	T	25.6	Very low	25.9	Very low	135 Å²	135	143 Å²	143	83%	0.828	79%	0.785	S	S	*	*			trans	-64.7	136.9	179	-35.5	0	0	0	0	112.2
34	L	25.1	Very low	25.9	Very low	166 Å²	166	144.2 Å²	144.2	87%	0.869	79%	0.792	S	S	*	*			trans	-143	122.5	160.3	-129.2	160.5	0	0	0	109.5
35	T	23.3	Very low	26.2	Very low	111 Å²	111	140 Å²	140	68%	0.681	79%	0.787	S	S	*	*			trans	-81.3	143.7	-176.2	46	0	0	0	0	111.9
36	N	25	Very low	26.2	Very low	165 Å²	165	142.1 Å²	142.1	88%	0.882	80%	0.799	S	S	*	*			trans	-167.3	145.3	136.9	-94.7	-24.2	0	0	0	110.7
37	S	25.2	Very low	26.1	Very low	101 Å²	101	142.9 Å²	142.9	71%	0.706	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-101.1	141.9	179.7	50.4	0	0	0	0	111.8
38	P	29.4	Very low	26.1	Very low	127 Å²	127	146 Å²	146	83%	0.825	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-86.1	127.6	166.6	33.2	-29.6	0	0	0	110.7
39	N	22.3	Very low	26	Very low	156 Å²	156	150.4 Å²	150.4	83%	0.834	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-87.3	167.1	166.4	-101.4	-3	0	0	0	111.4
40	S	23	Very low	25.7	Very low	102 Å²	102	146.6 Å²	146.6	71%	0.713	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-53.9	150.8	178.1	52.2	0	0	0	0	115.3
41	L	25.4	Very low	25.6	Very low	152 Å²	152	143.2 Å²	143.2	80%	0.796	81%	0.809	S	S	*	*				173.8	147.4	120.9	-86.2	155	0	0	0	106.3
42	E	22.2	Very low	25.5	Very low	164 Å²	164	138.4 Å²	138.4	77%	0.766	80%	0.804	S	S	*	*			cis	163.3	156.8	-16	171.5	161.5	-112.2	0	0	104.1
43	V	30.3	Very low	25.2	Very low	134 Å²	134	140.4 Å²	140.4	81%	0.812	80%	0.804	S	S	*	*			trans	-129.2	127.9	-170.2	178.6	0	0	0	0	112.2
44	P	27.6	Very low	25.1	Very low	111 Å²	111	141.6 Å²	141.6	72%	0.721	80%	0.797	S	S	*	*			trans	-123.8	167.4	160.7	41.6	-28.9	0	0	0	111.8
45	P	34.2	Very low	25.1	Very low	121 Å²	121	141.3 Å²	141.3	79%	0.786	79%	0.792	S	S	*	*				-135.8	-168.6	-95	32.6	-9.1	0	0	0	115.3
46	D	25.4	Very low	25	Very low	156 Å²	156	141.6 Å²	141.6	83%	0.834	79%	0.793	S	S	*	*			trans	-58.4	148.1	179.9	-69.2	-66.1	0	0	0	116.2
47	I	27.2	Very low	24.9	Very low	176 Å²	176	142 Å²	142	90%	0.903	79%	0.79	S	S	*	*			trans	-131.2	148.6	153.4	-63	-176.7	0	0	0	108.7
48	K	24.8	Very low	24.9	Very low	185 Å²	185	143.6 Å²	143.6	80%	0.804	79%	0.789	S	S	*	*			trans	-138.7	147.8	-157.3	-156.1	172.6	-168.8	165.8	0	113.1
49	K	25.7	Very low	24.6	Very low	205 Å²	205	144 Å²	144	89%	0.891	79%	0.789	S	S	*	*			trans	73.6	159	179.4	-56.9	-177.5	176.3	-179.5	0	113.9
50	S	21	Very low	24.6	Very low	123 Å²	123	140.4 Å²	140.4	86%	0.86	78%	0.781	S	S	*	*			cis	-132.5	-160.1	12.1	67.8	0	0	0	0	114.1
51	C	21.8	Very low	24.7	Very low	129 Å²	129	142.2 Å²	142.2	87%	0.872	78%	0.779	S	S	*	*			trans	-116.9	152.7	-167.6	-173.1	0	0	0	0	111.8
52	G	21.8	Very low	24.8	Very low	74 Å²	74	144.4 Å²	144.4	76%	0.763	78%	0.776	S	S	*	*			trans	-164.7	154.7	175.8	0	0	0	0	0	110.4
53	E	22.1	Very low	25.1	Very low	156 Å²	156	144.2 Å²	144.2	73%	0.729	78%	0.779	S	S	*	*			trans	-143.3	168.6	-159.7	-157.9	-169.6	-134.8	0	0	112.2
54	K	24.4	Very low	24.8	Very low	160 Å²	160	146.8 Å²	146.8	70%	0.696	78%	0.779	S	S	*	*			trans	75.8	152.8	164.4	-66	-172.5	174.3	83.2	0	117.8
55	Q	23.9	Very low	24.8	Very low	160 Å²	160	148.7 Å²	148.7	75%	0.748	78%	0.782	S	S	*	*			cis	-166.6	-165.7	-28.3	-154.3	165.5	-7	0	0	108.7
56	T	22.7	Very low	24.3	Very low	116 Å²	116	148.4 Å²	148.4	71%	0.712	78%	0.779	S	S	*	*			trans	69	121.3	177.4	55.1	0	0	0	0	115.8
57	E	21.9	Very low	24.3	Very low	174 Å²	174	150.3 Å²	150.3	81%	0.813	78%	0.78	S	S	*	*			cis	86.6	128.4	44.3	-164	173.7	-127.8	0	0	111.2
58	I	25.8	Very low	24.3	Very low	135 Å²	135	150.4 Å²	150.4	69%	0.692	78%	0.778	S	S	*	*				179.8	128.4	100.5	-90.8	170.8	0	0	0	110.8
59	T	22.7	Very low	24.3	Very low	134 Å²	134	149.5 Å²	149.5	82%	0.822	78%	0.781	S	S	*	*			trans	47.5	165.3	152.6	64	0	0	0	0	122.8
60	A	23.2	Very low	24.2	Very low	82 Å²	82	147.5 Å²	147.5	68%	0.678	77%	0.772	S	S	*	*			cis	-172.5	-170.2	-29.5	0	0	0	0	0	108.8
61	E	24.3	Very low	24.3	Very low	140 Å²	140	146.6 Å²	146.6	65%	0.654	76%	0.757	S	S	*	*			trans	72.4	153.9	169	-48.9	-145	133.3	0	0	115.9
62	R	27.1	Very low	24.5	Very low	198 Å²	198	149.5 Å²	149.5	75%	0.747	76%	0.755	S	S	*	*			cis	-163.8	167.1	-8	-118.4	169.5	-170.4	157.1	-0.9	107
63	I	28.6	Very low	24.7	Very low	159 Å²	159	155 Å²	155	82%	0.815	76%	0.761	S	S	*	*			cis	-132.3	-114.6	5	-36.3	161.5	0	0	0	110.7
64	K	25	Very low	24.7	Very low	189 Å²	189	152 Å²	152	82%	0.822	76%	0.757	S	S	*	*			trans	-146.6	-172.9	176.6	-65.3	171.3	-178.7	171.7	0	105.7
65	L	26.8	Very low	24.6	Very low	150 Å²	150	151.3 Å²	151.3	79%	0.785	76%	0.761	S	S	*	*			cis	-169.5	126.2	30.6	-176.4	70.9	0	0	0	113.7
66	T	23.8	Very low	24.6	Very low	116 Å²	116	150.8 Å²	150.8	71%	0.712	76%	0.759	S	S	*	*			trans	17.8	130	136.1	-40.8	0	0	0	0	123.1
67	K	26.4	Very low	24.7	Very low	196 Å²	196	151.9 Å²	151.9	85%	0.852	76%	0.759	S	S	*	*				-170.2	154.6	114.2	-109.1	-178.1	-179.7	-178.8	0	115.8
68	M	25.6	Very low	24.8	Very low	178 Å²	178	151.8 Å²	151.8	88%	0.877	76%	0.759	S	S	*	*			trans	-109.6	159.4	167.6	-76.5	-175.9	168	0	0	110.7
69	I	26.3	Very low	25	Very low	166 Å²	166	154.6 Å²	154.6	85%	0.851	77%	0.766	S	S	*	*			trans	-179.7	164.5	147.8	-93.8	147.3	0	0	0	107.7
70	K	23.9	Very low	25.1	Very low	162 Å²	162	154.7 Å²	154.7	70%	0.704	77%	0.766	S	S	*	*				-169.8	145.5	-66	-158.4	-151.8	177.8	-146.9	0	107.8
71	D	22.8	Very low	25.1	Very low	105 Å²	105	155.4 Å²	155.4	56%	0.561	77%	0.772	S	S	*	*			trans	56.8	123	159.6	-68.8	-7.4	0	0	0	123.7
72	K	25.6	Very low	25.2	Very low	190 Å²	190	156.7 Å²	156.7	83%	0.826	78%	0.782	S	S	*	*			trans	53.6	116.2	130.6	-63	-176	176.2	-176.9	0	122.6
73	Q	25.6	Very low	25.1	Very low	190 Å²	190	157 Å²	157	89%	0.888	79%	0.789	S	S	*	*			trans	-162.3	174.1	132.1	-100.7	163.7	2.2	0	0	108.7
74	S	22.7	Very low	25	Very low	91 Å²	91	161.4 Å²	161.4	64%	0.636	80%	0.795	S	S	*	*				167.4	142.2	-76.1	57.1	0	0	0	0	110.2
75	N	22.6	Very low	25	Very low	146 Å²	146	162.2 Å²	162.2	78%	0.781	80%	0.799	S	S	*	*			trans	65.2	164.1	176.8	-67.2	36.7	0	0	0	115.7
76	E	22.3	Very low	24.9	Very low	150 Å²	150	159.9 Å²	159.9	70%	0.701	80%	0.801	S	S	*	*			cis	-168.9	176.4	-40.9	-158.4	174.8	-171.7	0	0	107.4
77	L	26	Very low	24.8	Very low	139 Å²	139	164 Å²	164	73%	0.728	81%	0.813	S	S	*	*			trans	70.8	153.5	164.5	-57	154	0	0	0	115.5
78	E	24.3	Very low	24.6	Very low	171 Å²	171	158.5 Å²	158.5	80%	0.799	81%	0.811	S	S	*	*			cis	-147.1	172.2	-9.2	-141.1	169	-178.9	0	0	112.7
79	K	28.8	Very low	24.6	Very low	195 Å²	195	158.6 Å²	158.6	85%	0.848	81%	0.809	S	S	*	*			trans	-96.7	136.9	169.7	-59.9	167.6	-177	166.6	0	110
80	V	25.2	Very low	24.4	Very low	136 Å²	136	160.2 Å²	160.2	82%	0.824	81%	0.813	S	S	*	*			trans	-131.2	131.3	153.3	-178.3	0	0	0	0	109
81	A	23.2	Very low	24.5	Very low	96 Å²	96	160.6 Å²	160.6	79%	0.793	82%	0.815	S	S	*	*			trans	-128.6	135.3	175.2	0	0	0	0	0	109.6
82	L	26.1	Very low	24.6	Very low	168 Å²	168	163 Å²	163	88%	0.88	83%	0.828	S	S	*	*			trans	-128.7	117.1	172.6	-81.7	171.3	0	0	0	110.5
83	K	25.8	Very low	24.7	Very low	203 Å²	203	159.9 Å²	159.9	88%	0.883	83%	0.826	S	S	*	*			trans	-85.2	153.2	166.2	-67	175.5	176.7	174.6	0	109.7
84	R	26.6	Very low	24.5	Very low	252 Å²	252	154 Å²	154	95%	0.951	82%	0.817	S	S	*	*			trans	-155.6	152.6	135.3	-107.3	162.5	-164.2	-178.5	4.6	110.4
85	K	25	Very low	24.6	Very low	207 Å²	207	160 Å²	160	90%	0.9	83%	0.831	S	S	*	*			trans	-125.4	151.1	170.6	-81.9	-169.6	169.8	-162.9	0	107.6
86	A	24.8	Very low	25.1	Very low	101 Å²	101	162.4 Å²	162.4	84%	0.835	84%	0.835	S	S	*	*			trans	-171.7	161.5	141	0	0	0	0	0	109.5
87	E	21.8	Very low	25.4	Very low	203 Å²	203	164.8 Å²	164.8	95%	0.949	85%	0.846	S	S	*	*			trans	-107.9	168.3	-177.9	-70.1	151.8	106.8	0	0	112.1
88	G	22.5	Very low	25.5	Very low	80 Å²	80	162.9 Å²	162.9	83%	0.825	85%	0.85	S	S	*	*			trans	169.8	116.9	169	0	0	0	0	0	112.3
89	E	24.7	Very low	25.6	Very low	179 Å²	179	163.2 Å²	163.2	84%	0.836	85%	0.849	S	S	*	*			trans	-97.1	141.6	172.6	-74.7	-162.2	114.3	0	0	111.7
90	E	22.6	Very low	25.7	Very low	200 Å²	200	161.8 Å²	161.8	94%	0.935	85%	0.849	S	S	*	*			trans	-156.3	165.6	140.8	-133.1	177	-173	0	0	111
91	K	25.3	Very low	25.8	Very low	170 Å²	170	163.5 Å²	163.5	74%	0.739	85%	0.85	S	S	*	*			trans	-119.9	117.1	-162.6	-73.9	175.8	179.2	164.2	0	115.5
92	L	24.3	Very low	25.9	Very low	157 Å²	157	165.2 Å²	165.2	82%	0.822	84%	0.842	S	S	*	*			trans	65.3	162.2	143.1	-71.9	167	0	0	0	117.4
93	P	27.6	Very low	25.9	Very low	123 Å²	123	163.1 Å²	163.1	80%	0.799	83%	0.831	S	S	*	*			cis	-131.4	138.9	15	38	-19.6	0	0	0	118.3
94	G	22.3	Very low	26.4	Very low	67 Å²	67	157.1 Å²	157.1	69%	0.691	81%	0.808	S	S	*	*				69.1	107.8	127.2	0	0	0	0	0	121.6
95	K	24.8	Very low	26.8	Very low	216 Å²	216	151.4 Å²	151.4	94%	0.939	80%	0.796	S	S	*	*				-152.8	172.7	123.9	-111.4	162.4	-172.4	175	0	111.2
96	K	33.8	Very low	27.7	Very low	198 Å²	198	147.8 Å²	147.8	86%	0.861	78%	0.783	S	S	*	*			trans	-88.1	-178.4	-165.8	-65.4	177.8	179.7	176.8	0	112.5
97	E	28.2	Very low	28.7	Very low	200 Å²	200	146.9 Å²	146.9	94%	0.935	76%	0.764	S	S	*	*			trans	84.7	40.1	165.4	-51.3	-167.5	133.4	0	0	118.6
98	A	27.7	Very low	30	Very low	98 Å²	98	139.4 Å²	139.4	81%	0.81	73%	0.732	S	S	*	*			trans	-144.2	63.2	162.1	0	0	0	0	0	112.4
99	K	27.3	Very low	31	Very low	178 Å²	178	140.4 Å²	140.4	77%	0.774	72%	0.722	S	S	*	*	S	Bend	trans	-155.3	11.7	178.1	-126.6	169.2	-171.6	176.6	0	118.8
100	I	30.4	Very low	32.3	Very low	166 Å²	166	134.6 Å²	134.6	85%	0.851	70%	0.699	S	S	*	*	S	Bend	trans	-95.8	-33	179.7	-63.3	176.6	0	0	0	112
101	M	26.9	Very low	33.8	Very low	171 Å²	171	130.3 Å²	130.3	84%	0.842	69%	0.686	S	S	*	*	S	Bend	trans	-82.4	-20.6	-170.9	-147.8	172.4	81	0	0	114.5
102	E	24.9	Very low	35.6	Very low	133 Å²	133	127.3 Å²	127.3	62%	0.621	68%	0.684	S	S	*	*	S	Bend	trans	-83.4	-26.6	-174.1	-165.9	169.7	-137.5	0	0	113.2	D104	E102-D104 PolarHBondContact O-N 3.27Å
103	L	27.2	Very low	37.7	Very low	123 Å²	123	121.1 Å²	121.1	64%	0.644	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.6	-27.5	-176.1	-153.3	76.1	0	0	0	113.2
104	D	35.1	Very low	40	Very low	78 Å²	78	118.5 Å²	118.5	42%	0.417	63%	0.634	S	S	.	*	T	Hydrogen-bonded Turn	trans	-78.1	-24.1	-176.8	-155.4	51.2	0	0	0	112.2	E102 K343	E102-D104 PolarHBondContact O-N 3.27Å; D104-K343 IonicContact OD1-NZ 3.83Å; D104-K343 IonicContact OD2-NZ 3.84Å; D104-K343 PolarHBondContact OD2-NZ 3.46Å
105	N	35.2	Very low	43	Very low	131 Å²	131	121.6 Å²	121.6	70%	0.701	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.6	-29.8	174	-80	-7.7	0	0	0	113.1	L107 V108	N105-L107 PolarHBondContact O-N 2.6Å; N105-V108 PolarHBondContact O-N 2.9Å
106	Q	43.8	Very low	46	Very low	132 Å²	132	111.8 Å²	111.8	62%	0.617	59%	0.588	S	S	*	*	G	3₁₀ helix	trans	-69.1	-16.1	179.5	-67.2	-175	0.4	0	0	113.1	V108	Q106-V108 PolarHBondContact O-N 3.26Å
107	L	46.8	Very low	48.7	Very low	82 Å²	82	105.2 Å²	105.2	43%	0.429	57%	0.566	S	S	.	*	G	3₁₀ helix	trans	-69	-14.1	178.9	-116.2	80.4	0	0	0	114.4	N105	N105-L107 PolarHBondContact O-N 2.6Å
108	V	48.4	Very low	51.6	Low	46 Å²	46	100.4 Å²	100.4	28%	0.279	55%	0.546	S	S	.	.	G	3₁₀ helix	trans	-129.5	36.1	-170.4	-151	0	0	0	0	113.1	N105 Q106 T110 V347	N105-V108 PolarHBondContact O-N 2.9Å; Q106-V108 PolarHBondContact O-N 3.26Å; V108-T110 VanDerWaalsContact C-N 3.3Å; V108-T110 PolarHBondContact O-N 2.74Å; V108-V347 HydrophobicContact CG1-CB 4.36Å; V108-V347 HydrophobicContact CG1-CG1 3.95Å; V108-V347 HydrophobicContact CG1-CG2 4.22Å
109	T	43.4	Very low	54.8	Low	101 Å²	101	103.9 Å²	103.9	62%	0.62	54%	0.543	S	S	*	.			trans	-71.7	87.7	162.2	-53.5	0	0	0	0	109.2	V111	T109-V111 HydrophobicContact CG2-CG2 4.36Å; T109-V111 PolarHBondContact O-N 3.15Å
110	T	51.8	Low	57.9	Low	57 Å²	57	98.6 Å²	98.6	35%	0.35	52%	0.523	S	S	.	.			trans	-67	100.9	170.9	47.7	0	0	0	0	109.5	V108 P112 M328	V108-T110 VanDerWaalsContact C-N 3.3Å; V108-T110 PolarHBondContact O-N 2.74Å; T110-P112 VanDerWaalsContact O-CD 3.26Å; T110-P112 WeakPolarHBondContact O-CD 3.43Å; T110-M328 HydrophobicContact CG2-CG 3.76Å; T110-M328 HydrophobicContact CG2-SD 3.74Å
111	V	54	Low	60.9	Low	109 Å²	109	91 Å²	91	66%	0.661	48%	0.484	S	S	*	.			trans	-77.7	112.4	172.5	-178.7	0	0	0	0	108.1	T109	T109-V111 HydrophobicContact CG2-CG2 4.36Å; T109-V111 PolarHBondContact O-N 3.15Å
112	P	64.1	Low	64.1	Low	107 Å²	107	87.7 Å²	87.7	70%	0.695	47%	0.467	S	S	*	.	P	Polyproline II helix	trans	-63.2	141.4	170.1	28.1	-33.8	0	0	0	109.1	T110 P114	T110-P112 VanDerWaalsContact O-CD 3.26Å; T110-P112 WeakPolarHBondContact O-CD 3.43Å; P112-P114 WeakPolarHBondContact O-CD 3.08Å
113	L	67.4	Low	67.4	Low	28 Å²	28	84.6 Å²	84.6	15%	0.147	46%	0.455	C	S	.	.	P	Polyproline II helix	trans	-58.5	120.1	175.3	-73.1	153.5	0	0	0	108.3	H115 Q312 I315 I319	L113-H115 PolarHBondContact O-N 3.39Å; L113-Q312 HydrophobicContact CD2-CG 4.11Å; L113-I315 HydrophobicContact CD1-CB 4.42Å; L113-I315 HydrophobicContact CD1-CG2 3.6Å; L113-I319 HydrophobicContact CD1-CD1 4Å
114	P	77	Confident	70.7	Confident	67 Å²	67	78.7 Å²	78.7	44%	0.435	43%	0.425	S	S	.	.	P	Polyproline II helix	trans	-70.6	134.9	-172.9	25.1	-31.8	0	0	0	110.6	P112 I116 Q312	P112-P114 WeakPolarHBondContact O-CD 3.08Å; P114-I116 PolarHBondContact O-N 3Å; P114-Q312 PolarHBondContact O-NE2 3.35Å; P114-Q312 VanDerWaalsContact O-NE2 3.07Å
115	H	84.6	Confident	73.6	Confident	133 Å²	133	75.3 Å²	75.3	62%	0.616	41%	0.406	S	S	*	.	P	Polyproline II helix	trans	-58	129	-171.3	179.4	60.3	0	0	0	113	L113 P117 E316	L113-H115 PolarHBondContact O-N 3.39Å; H115-P117 WeakPolarHBondContact O-CD 3.46Å; H115-E316 WeakPolarHBondContact CA-OE1 3.5Å; H115-E316 WeakPolarHBondContact CA-OE2 3.44Å; H115-E316 IonicContact CE1-OE1 3.64Å; H115-E316 IonicContact CG-OE1 2.6Å; H115-E316 IonicContact ND1-OE1 3.92Å; H115-E316 PolarHBondContact ND1-OE1 3.47Å; H115-E316 IonicContact ND1-OE2 3.46Å
116	I	88.6	Confident	76.5	Confident	10 Å²	10	74 Å²	74	5%	0.051	40%	0.397	C	S	.	.			trans	-102.6	109.6	176.3	-62.5	177.3	0	0	0	110.1	P114 L118 N120 I121 L309 Q312 A313 E316	P114-I116 PolarHBondContact O-N 3Å; I116-L118 PolarHBondContact O-N 3.37Å; I116-N120 HydrophobicContact CG2-CB 4.06Å; I116-I121 HydrophobicContact CG2-CG1 3.97Å; I116-L309 HydrophobicContact CD1-CD1 3.56Å; I116-L309 HydrophobicContact CD1-CG 4.03Å; I116-L309 WeakPolarHBondContact CD1-O 3.48Å; I116-L309 HydrophobicContact CG1-CD1 4.16Å; I116-L309 HydrophobicContact CG2-CD1 4.37Å; I116-L309 HydrophobicContact CG2-CG 4.33Å; I116-Q312 HydrophobicContact CD1-CB 3.66Å; I116-Q312 HydrophobicContact CD1-CG 3.58Å; I116-A313 HydrophobicContact CB-CB 3.93Å; I116-A313 HydrophobicContact CD1-CB 4.02Å; I116-A313 HydrophobicContact CG2-CB 4.04Å; I116-E316 PolarHBondContact N-OE2 3.09Å
117	P	89.9	Confident	78.9	Confident	59 Å²	59	72.6 Å²	72.6	38%	0.383	39%	0.389	S	S	.	.			trans	-60	139.9	179.5	-24.8	34.6	0	0	0	112.5	H115 K119 N120 I121	H115-P117 WeakPolarHBondContact O-CD 3.46Å; P117-K119 PolarHBondContact O-N 3.24Å; P117-N120 WeakPolarHBondContact O-CB 3.27Å; P117-N120 PolarHBondContact O-N 3.36Å; P117-I121 PolarHBondContact O-N 2.9Å
118	L	89.7	Confident	81.2	Confident	99 Å²	99	69 Å²	69	52%	0.518	37%	0.37	S	S	.	.	H	α-helix	trans	-49.6	-32.7	179.5	-180	61.8	0	0	0	113.9	I116 N120 I121 M122	I116-L118 PolarHBondContact O-N 3.37Å; L118-N120 VanDerWaalsContact C-N 3.27Å; L118-N120 PolarHBondContact O-N 3.11Å; L118-I121 HydrophobicContact CD1-CB 4.47Å; L118-I121 HydrophobicContact CD1-CD1 4.36Å; L118-I121 WeakPolarHBondContact O-CB 3.38Å; L118-I121 PolarHBondContact O-N 3.3Å; L118-M122 HydrophobicContact CD1-CG 4.32Å; L118-M122 HydrophobicContact CG-CG 4.38Å; L118-M122 HydrophobicContact CG-SD 4.25Å; L118-M122 WeakPolarHBondContact O-CG 3.38Å; L118-M122 PolarHBondContact O-N 3.01Å
119	K	93.8	Very high	83.4	Confident	172 Å²	172	66.8 Å²	66.8	75%	0.748	36%	0.357	S	S	*	.	H	α-helix	trans	-55.6	-40.5	174.2	-176	-177.9	176.4	-175	0	112.5	P117 D123	P117-K119 PolarHBondContact O-N 3.24Å; K119-D123 WeakPolarHBondContact O-CB 3.26Å; K119-D123 PolarHBondContact O-N 3.35Å
120	N	92.6	Very high	85.8	Confident	67 Å²	67	63.1 Å²	63.1	36%	0.358	33%	0.332	S	S	.	.	H	α-helix	trans	-73.6	-37.8	-179.7	-62.2	3.8	0	0	0	110.7	I116 P117 L118 D123 V124 L309	I116-N120 HydrophobicContact CG2-CB 4.06Å; P117-N120 WeakPolarHBondContact O-CB 3.27Å; P117-N120 PolarHBondContact O-N 3.36Å; L118-N120 VanDerWaalsContact C-N 3.27Å; L118-N120 PolarHBondContact O-N 3.11Å; N120-D123 PolarHBondContact O-N 3.02Å; N120-V124 WeakPolarHBondContact O-CG2 3.41Å; N120-V124 PolarHBondContact O-N 3.48Å; N120-L309 HydrophobicContact CB-CD2 4.36Å
121	I	94.6	Very high	87.6	Confident	6 Å²	6	62.5 Å²	62.5	3%	0.031	33%	0.327	C	S	.	.	H	α-helix	trans	-60	-47.1	173.7	-50.3	178	0	0	0	110	I116 P117 L118 D123 V124 E125 Y310 A313 M314	I116-I121 HydrophobicContact CG2-CG1 3.97Å; P117-I121 PolarHBondContact O-N 2.9Å; L118-I121 HydrophobicContact CD1-CB 4.47Å; L118-I121 HydrophobicContact CD1-CD1 4.36Å; L118-I121 WeakPolarHBondContact O-CB 3.38Å; L118-I121 PolarHBondContact O-N 3.3Å; I121-D123 VanDerWaalsContact C-N 3.34Å; I121-D123 PolarHBondContact O-N 2.92Å; I121-V124 PolarHBondContact O-N 3.19Å; I121-E125 PolarHBondContact O-N 3.01Å; I121-Y310 HydrophobicContact CG2-CD2 3.78Å; I121-Y310 HydrophobicContact CG2-CE2 3.53Å; I121-A313 HydrophobicContact CD1-CB 3.67Å; I121-A313 HydrophobicContact CG1-CB 3.87Å; I121-M314 HydrophobicContact CD1-CE 4.23Å; I121-M314 HydrophobicContact CG2-CE 4.35Å
122	M	93.7	Very high	89.1	Confident	101 Å²	101	58.9 Å²	58.9	50%	0.498	30%	0.304	S	S	.	.	H	α-helix	trans	-64.9	-33.9	177.6	-69.2	-178.6	70.1	0	0	113.2	L118 E125 M126	L118-M122 HydrophobicContact CD1-CG 4.32Å; L118-M122 HydrophobicContact CG-CG 4.38Å; L118-M122 HydrophobicContact CG-SD 4.25Å; L118-M122 WeakPolarHBondContact O-CG 3.38Å; L118-M122 PolarHBondContact O-N 3.01Å; M122-E125 PolarHBondContact O-N 3.41Å; M122-M126 VanDerWaalsContact O-CG 3.32Å; M122-M126 WeakPolarHBondContact O-CG 3.3Å; M122-M126 PolarHBondContact O-N 3.49Å
123	D	94.9	Very high	90	Very high	68 Å²	68	54.6 Å²	54.6	36%	0.364	28%	0.275	S	S	.	.	H	α-helix	trans	-66.1	-42	173.4	179.3	58	0	0	0	111.7	K119 N120 I121 M126 K127	K119-D123 WeakPolarHBondContact O-CB 3.26Å; K119-D123 PolarHBondContact O-N 3.35Å; N120-D123 PolarHBondContact O-N 3.02Å; I121-D123 VanDerWaalsContact C-N 3.34Å; I121-D123 PolarHBondContact O-N 2.92Å; D123-M126 PolarHBondContact O-N 3.44Å; D123-K127 WeakPolarHBondContact O-CB 3.5Å; D123-K127 VanDerWaalsContact O-CG 3.31Å; D123-K127 WeakPolarHBondContact O-CG 3.44Å; D123-K127 PolarHBondContact O-N 2.88Å; D123-K127 WeakPolarHBondContact OD1-CE 3.5Å; D123-K127 IonicContact OD1-NZ 3.91Å; D123-K127 PolarHBondContact OD1-NZ 3.14Å; D123-K127 WeakPolarHBondContact OD2-CE 3.34Å; D123-K127 IonicContact OD2-NZ 2.75Å; D123-K127 PolarHBondContact OD2-NZ 3.12Å
124	V	95.5	Very high	90.4	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-60.9	-45.4	171.7	177	0	0	0	0	111.4	N120 I121 M126 K127 L128 L306 L309 Y310	N120-V124 WeakPolarHBondContact O-CG2 3.41Å; N120-V124 PolarHBondContact O-N 3.48Å; I121-V124 PolarHBondContact O-N 3.19Å; V124-M126 VanDerWaalsContact C-N 3.34Å; V124-M126 PolarHBondContact O-N 3.49Å; V124-K127 PolarHBondContact O-N 3.4Å; V124-K127 VanDerWaalsContact O-N 3.15Å; V124-L128 HydrophobicContact CG1-CD1 4.08Å; V124-L128 PolarHBondContact O-N 3.16Å; V124-L306 HydrophobicContact CG1-CB 4.18Å; V124-L306 HydrophobicContact CG2-CB 4.24Å; V124-L306 HydrophobicContact CG2-CD2 3.79Å; V124-L309 HydrophobicContact CG2-CD2 4Å; V124-Y310 HydrophobicContact CB-CD2 4.33Å; V124-Y310 HydrophobicContact CG1-CD2 4.11Å; V124-Y310 HydrophobicContact CG1-CG 4.42Å
125	E	96.1	Very high	90.3	Very high	7 Å²	7	62.2 Å²	62.2	3%	0.033	31%	0.308	C	S	.	.	I	π-helix	trans	-61.5	-42.4	177.8	-68.3	-170.8	169.9	0	0	112.1	I121 M122 K127 V129 Y130 R274 Y310	I121-E125 PolarHBondContact O-N 3.01Å; M122-E125 PolarHBondContact O-N 3.41Å; E125-K127 VanDerWaalsContact C-N 3.28Å; E125-K127 PolarHBondContact O-N 3.34Å; E125-V129 HydrophobicContact CB-CB 4.16Å; E125-V129 HydrophobicContact CB-CG2 4.31Å; E125-V129 HydrophobicContact CG-CG2 4.22Å; E125-V129 WeakPolarHBondContact O-CA 3.45Å; E125-V129 WeakPolarHBondContact O-CB 3.29Å; E125-V129 PolarHBondContact O-N 3.18Å; E125-Y130 HydrophobicContact CB-CD2 3.94Å; E125-Y130 HydrophobicContact CB-CE2 3.66Å; E125-Y130 VanDerWaalsContact O-CD2 3.3Å; E125-Y130 WeakPolarHBondContact O-CD2 3.43Å; E125-Y130 PolarHBondContact O-N 3.25Å; E125-R274 IonicContact OE1-CZ 3.68Å; E125-R274 IonicContact OE1-NE 2.85Å; E125-R274 PolarHBondContact OE1-NE 3.03Å; E125-R274 IonicContact OE1-NH2 3.13Å; E125-R274 PolarHBondContact OE1-NH2 2.95Å; E125-R274 IonicContact OE2-NH2 3.46Å; E125-R274 PolarHBondContact OE2-NH2 2.8Å; E125-Y310 HydrophobicContact CG-CD2 4.44Å; E125-Y310 HydrophobicContact CG-CE2 3.73Å; E125-Y310 PolarHBondContact OE1-OH 3.02Å
126	M	94.9	Very high	89.9	Confident	104 Å²	104	56.5 Å²	56.5	51%	0.512	28%	0.283	S	S	.	.	I	π-helix	trans	-62	-36.5	175.3	-74.3	-68	-154	0	0	112.4	M122 D123 V124 Y130 R241	M122-M126 VanDerWaalsContact O-CG 3.32Å; M122-M126 WeakPolarHBondContact O-CG 3.3Å; M122-M126 PolarHBondContact O-N 3.49Å; D123-M126 PolarHBondContact O-N 3.44Å; V124-M126 VanDerWaalsContact C-N 3.34Å; V124-M126 PolarHBondContact O-N 3.49Å; M126-Y130 HydrophobicContact SD-CD2 4.25Å; M126-R241 PolarHBondContact SD-NH1 3Å; M126-R241 PolarHBondContact SD-NH2 2.97Å; M126-R241 VanDerWaalsContact SD-NH2 3.39Å
127	K	94.8	Very high	89.1	Confident	102 Å²	102	57.3 Å²	57.3	44%	0.443	29%	0.289	S	S	.	.	I	π-helix	trans	-82.4	-24.9	-177.5	-75	170	176.3	166.1	0	115.1	D123 V124 E125 V131 L306	D123-K127 WeakPolarHBondContact O-CB 3.5Å; D123-K127 VanDerWaalsContact O-CG 3.31Å; D123-K127 WeakPolarHBondContact O-CG 3.44Å; D123-K127 PolarHBondContact O-N 2.88Å; D123-K127 WeakPolarHBondContact OD1-CE 3.5Å; D123-K127 IonicContact OD1-NZ 3.91Å; D123-K127 PolarHBondContact OD1-NZ 3.14Å; D123-K127 WeakPolarHBondContact OD2-CE 3.34Å; D123-K127 IonicContact OD2-NZ 2.75Å; D123-K127 PolarHBondContact OD2-NZ 3.12Å; V124-K127 PolarHBondContact O-N 3.4Å; V124-K127 VanDerWaalsContact O-N 3.15Å; E125-K127 VanDerWaalsContact C-N 3.28Å; E125-K127 PolarHBondContact O-N 3.34Å; K127-V131 WeakPolarHBondContact O-CG2 3.38Å; K127-L306 HydrophobicContact CB-CD1 4.29Å; K127-L306 HydrophobicContact CD-CD1 4.19Å; K127-L306 HydrophobicContact CD-CD2 4.47Å
128	L	94.6	Very high	87.8	Confident	5 Å²	5	55.9 Å²	55.9	3%	0.026	28%	0.276	C	S	.	.	I	π-helix	trans	-129.1	-38.6	-174.8	-61	-177.4	0	0	0	115	V124 L267 V303 L306 I307	V124-L128 HydrophobicContact CG1-CD1 4.08Å; V124-L128 PolarHBondContact O-N 3.16Å; L128-L267 HydrophobicContact CB-CD2 3.4Å; L128-L267 VanDerWaalsContact CB-CD2 3.4Å; L128-L267 HydrophobicContact CD1-CD2 3.77Å; L128-L267 HydrophobicContact CG-CD2 4.26Å; L128-V303 HydrophobicContact CD1-CG1 4.36Å; L128-V303 HydrophobicContact CD2-CB 4.48Å; L128-V303 HydrophobicContact CD2-CG1 3.99Å; L128-V303 HydrophobicContact CD2-CG2 4.11Å; L128-L306 HydrophobicContact CD1-CB 3.74Å; L128-L306 HydrophobicContact CG-CB 4.46Å; L128-L306 HydrophobicContact CG-CD1 4.46Å; L128-I307 HydrophobicContact CD1-CG1 3.66Å
129	V	95.1	Very high	86.4	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	28%	0.277	C	S	.	.	I	π-helix	trans	-80.7	-48.9	-175.5	171.1	0	0	0	0	111.1	E125 T237 L240 L267 R268 A271	E125-V129 HydrophobicContact CB-CB 4.16Å; E125-V129 HydrophobicContact CB-CG2 4.31Å; E125-V129 HydrophobicContact CG-CG2 4.22Å; E125-V129 WeakPolarHBondContact O-CA 3.45Å; E125-V129 WeakPolarHBondContact O-CB 3.29Å; E125-V129 PolarHBondContact O-N 3.18Å; V129-T237 VanDerWaalsContact O-CG2 3.31Å; V129-T237 WeakPolarHBondContact O-CG2 3.49Å; V129-L240 HydrophobicContact CG1-CD1 4.11Å; V129-L267 HydrophobicContact CG2-CD2 4.03Å; V129-L267 HydrophobicContact CG2-CG 3.82Å; V129-R268 HydrophobicContact CG1-CG 4Å; V129-R268 PolarHBondContact O-NE 3.17Å; V129-R268 PolarHBondContact O-NH2 2.9Å; V129-A271 HydrophobicContact CG1-CB 3.72Å; V129-A271 HydrophobicContact CG2-CB 4.03Å
130	Y	94.1	Very high	84.8	Confident	25 Å²	25	50.6 Å²	50.6	10%	0.098	25%	0.251	C	S	.	.	S	Bend	trans	-91.2	6.5	-173.1	-62.8	-69.1	0	0	0	115	E125 M126 D132 Y188 L240 R241	E125-Y130 HydrophobicContact CB-CD2 3.94Å; E125-Y130 HydrophobicContact CB-CE2 3.66Å; E125-Y130 VanDerWaalsContact O-CD2 3.3Å; E125-Y130 WeakPolarHBondContact O-CD2 3.43Å; E125-Y130 PolarHBondContact O-N 3.25Å; M126-Y130 HydrophobicContact SD-CD2 4.25Å; Y130-D132 PolarHBondContact O-N 3.31Å; Y130-Y188 PolarHBondContact O-OH 2.94Å; Y130-L240 HydrophobicContact CE1-CB 3.64Å; Y130-L240 HydrophobicContact CE1-CD1 4.43Å; Y130-R241 VanDerWaalsContact CB-NH2 3.26Å; Y130-R241 HydrophobicContact CD1-CG 3.88Å; Y130-R241 HydrophobicContact CE1-CG 4.01Å; Y130-R241 VanDerWaalsContact CG-CZ 3.48Å
131	V	89.6	Confident	83.1	Confident	43 Å²	43	48.7 Å²	48.7	26%	0.261	24%	0.244	S	C	.	.			trans	-56.4	133.9	176.9	-177.8	0	0	0	0	109.9	K127 E133 R268	K127-V131 WeakPolarHBondContact O-CG2 3.38Å; V131-E133 PolarHBondContact O-N 2.95Å; V131-R268 PolarHBondContact O-NH2 3.26Å; V131-R268 VanDerWaalsContact O-NH2 3.16Å
132	D	85.1	Confident	81	Confident	33 Å²	33	56.1 Å²	56.1	18%	0.176	28%	0.279	C	S	.	.			trans	-91.4	83.8	176.7	-166.1	36.7	0	0	0	110.4	Y130 E134 Y188 R189 K234	Y130-D132 PolarHBondContact O-N 3.31Å; D132-E134 PolarHBondContact O-N 3.46Å; D132-Y188 HydrophobicContact CB-CD1 4.19Å; D132-Y188 HydrophobicContact CB-CE1 3.99Å; D132-R189 IonicContact OD2-CZ 2.75Å; D132-R189 VanDerWaalsContact OD2-CZ 3.23Å; D132-R189 IonicContact OD2-NE 3.06Å; D132-R189 PolarHBondContact OD2-NE 3.17Å; D132-R189 IonicContact OD2-NH2 3.13Å; D132-R189 PolarHBondContact OD2-NH2 3.33Å; D132-K234 IonicContact OD1-NZ 2.72Å; D132-K234 PolarHBondContact OD1-NZ 3.21Å
133	E	82.9	Confident	78.7	Confident	17 Å²	17	54.3 Å²	54.3	8%	0.079	28%	0.275	C	S	.	.			trans	-53.7	125.1	170	-68.9	104	-154	0	0	110.8	V131 F230 K234 R264 R268	V131-E133 PolarHBondContact O-N 2.95Å; E133-F230 HydrophobicContact CB-CE2 3.94Å; E133-K234 WeakPolarHBondContact O-CE 3.34Å; E133-K234 PolarHBondContact O-NZ 3.13Å; E133-R264 WeakPolarHBondContact OE1-CD 3.29Å; E133-R264 IonicContact OE1-CZ 3.28Å; E133-R264 IonicContact OE1-NE 2.64Å; E133-R264 IonicContact OE1-NH1 2.69Å; E133-R264 PolarHBondContact OE1-NH1 3.31Å; E133-R268 IonicContact OE1-CZ 2.75Å; E133-R268 IonicContact OE1-NH1 3.46Å; E133-R268 PolarHBondContact OE1-NH1 3.39Å; E133-R268 IonicContact OE1-NH2 2.62Å; E133-R268 PolarHBondContact OE1-NH2 3.41Å; E133-R268 IonicContact OE2-CZ 3.15Å; E133-R268 VanDerWaalsContact OE2-CZ 3.29Å; E133-R268 IonicContact OE2-NH1 2.98Å; E133-R268 PolarHBondContact OE2-NH1 2.89Å; E133-R268 IonicContact OE2-NH2 2.8Å; E133-R268 PolarHBondContact OE2-NH2 2.87Å
134	E	76.7	Confident	76	Confident	134 Å²	134	59.6 Å²	59.6	63%	0.626	29%	0.291	S	S	*	.	S	Bend	trans	-76.9	-33.3	177.9	-49.2	-146.5	113	0	0	111.5	D132 R189	D132-E134 PolarHBondContact O-N 3.46Å; E134-R189 IonicContact OE1-CZ 2.71Å; E134-R189 IonicContact OE1-NH1 3.18Å; E134-R189 PolarHBondContact OE1-NH1 2.61Å; E134-R189 IonicContact OE1-NH2 2.84Å; E134-R189 PolarHBondContact OE1-NH2 3.18Å
135	D	74.9	Confident	72.8	Confident	122 Å²	122	67 Å²	67	65%	0.652	33%	0.328	S	S	*	.	S	Bend	trans	-117.8	159.2	-172.6	-62.3	-66.1	0	0	0	113.5	F230	D135-F230 WeakPolarHBondContact O-CE2 3.43Å
136	V	75.3	Confident	69.6	Low	13 Å²	13	75.9 Å²	75.9	8%	0.079	36%	0.361	C	S	.	.			trans	-78.4	125.8	173.2	177.8	0	0	0	0	109.3	Y138 I173 V227 F230	V136-Y138 HydrophobicContact CB-CD2 4.34Å; V136-Y138 HydrophobicContact CB-CE2 3.73Å; V136-Y138 HydrophobicContact CG1-CD2 4.08Å; V136-Y138 HydrophobicContact CG1-CE1 4.26Å; V136-Y138 HydrophobicContact CG1-CE2 3.76Å; V136-Y138 VanDerWaalsContact O-CD2 3.24Å; V136-Y138 WeakPolarHBondContact O-CD2 3.35Å; V136-Y138 WeakPolarHBondContact O-CE2 3.47Å; V136-I173 HydrophobicContact CG2-CD1 3.73Å; V136-V227 HydrophobicContact CG1-CG2 4.2Å; V136-V227 HydrophobicContact CG2-CG2 4.43Å; V136-F230 HydrophobicContact CB-CG 4.46Å; V136-F230 HydrophobicContact CG1-CB 4.27Å; V136-F230 HydrophobicContact CG2-CB 3.96Å; V136-F230 HydrophobicContact CG2-CD1 3.83Å; V136-F230 HydrophobicContact CG2-CD2 4.11Å; V136-F230 HydrophobicContact CG2-CE1 4.29Å; V136-F230 HydrophobicContact CG2-CG 3.72Å
137	S	71.6	Confident	66.4	Low	26 Å²	26	76.5 Å²	76.5	18%	0.182	37%	0.371	C	S	.	.			trans	-77.1	129.4	162	170.4	0	0	0	0	109.7	E139 S226	S137-E139 VanDerWaalsContact OG-CB 3.29Å; S137-E139 WeakPolarHBondContact OG-CB 3.4Å; S137-E139 VanDerWaalsContact OG-CD 3.24Å; S137-E139 VanDerWaalsContact OG-CG 3.24Å; S137-E139 WeakPolarHBondContact OG-CG 3.46Å; S137-E139 PolarHBondContact OG-N 2.81Å; S137-E139 VanDerWaalsContact OG-N 3.13Å; S137-E139 PolarHBondContact OG-OE2 3.31Å; S137-S226 WeakPolarHBondContact O-CB 3.35Å; S137-S226 PolarHBondContact O-OG 3.03Å
138	Y	64.1	Low	63.2	Low	29 Å²	29	74.1 Å²	74.1	11%	0.114	38%	0.375	C	S	.	.			trans	-99.2	14.4	173.8	-65.5	-97.1	0	0	0	111.7	V136 F140 L170 P171 I173 D223 V227	V136-Y138 HydrophobicContact CB-CD2 4.34Å; V136-Y138 HydrophobicContact CB-CE2 3.73Å; V136-Y138 HydrophobicContact CG1-CD2 4.08Å; V136-Y138 HydrophobicContact CG1-CE1 4.26Å; V136-Y138 HydrophobicContact CG1-CE2 3.76Å; V136-Y138 VanDerWaalsContact O-CD2 3.24Å; V136-Y138 WeakPolarHBondContact O-CD2 3.35Å; V136-Y138 WeakPolarHBondContact O-CE2 3.47Å; Y138-F140 PolarHBondContact O-N 3.16Å; Y138-L170 HydrophobicContact CD2-CD1 3.59Å; Y138-L170 HydrophobicContact CD2-CD2 4.41Å; Y138-L170 HydrophobicContact CD2-CG 4.06Å; Y138-L170 HydrophobicContact CE2-CD1 3.93Å; Y138-L170 HydrophobicContact CE2-CD2 4.02Å; Y138-L170 HydrophobicContact CE2-CG 3.85Å; Y138-L170 HydrophobicContact CG-CD1 4.28Å; Y138-P171 HydrophobicContact CD1-CB 4.35Å; Y138-P171 HydrophobicContact CD1-CG 3.84Å; Y138-P171 HydrophobicContact CE1-CB 3.75Å; Y138-P171 HydrophobicContact CE1-CG 3.76Å; Y138-P171 PolarHBondContact OH-O 2.77Å; Y138-I173 WeakPolarHBondContact OH-CG1 3.14Å; Y138-D223 HydrophobicContact CD1-CB 4.03Å; Y138-D223 HydrophobicContact CE1-CB 4.04Å; Y138-V227 HydrophobicContact CE1-CG2 4.1Å
139	E	60.1	Low	60.2	Low	114 Å²	114	81.6 Å²	81.6	53%	0.533	41%	0.413	S	S	.	.			trans	-75.6	108.1	-174.2	-63	159.8	142.7	0	0	111	S137 N259	S137-E139 VanDerWaalsContact OG-CB 3.29Å; S137-E139 WeakPolarHBondContact OG-CB 3.4Å; S137-E139 VanDerWaalsContact OG-CD 3.24Å; S137-E139 VanDerWaalsContact OG-CG 3.24Å; S137-E139 WeakPolarHBondContact OG-CG 3.46Å; S137-E139 PolarHBondContact OG-N 2.81Å; S137-E139 VanDerWaalsContact OG-N 3.13Å; S137-E139 PolarHBondContact OG-OE2 3.31Å; E139-N259 PolarHBondContact O-ND2 3.4Å
140	F	59.2	Low	57	Low	46 Å²	46	90 Å²	90	20%	0.202	45%	0.453	C	S	.	.			trans	-107.1	117.2	155.6	-69.4	-93.4	0	0	0	108.2	Y138 E222 A225 S226 L258 N259	Y138-F140 PolarHBondContact O-N 3.16Å; F140-E222 HydrophobicContact CD2-CB 3.87Å; F140-E222 HydrophobicContact CD2-CG 4.06Å; F140-E222 HydrophobicContact CE2-CB 3.64Å; F140-E222 HydrophobicContact CE2-CG 4.1Å; F140-E222 VanDerWaalsContact CE2-O 3.3Å; F140-E222 WeakPolarHBondContact CE2-O 3.46Å; F140-E222 HydrophobicContact CZ-CB 4.37Å; F140-A225 HydrophobicContact CZ-CB 4.26Å; F140-S226 WeakPolarHBondContact CE2-OG 3.35Å; F140-L258 WeakPolarHBondContact CE1-O 3.45Å; F140-L258 WeakPolarHBondContact CZ-O 3.44Å; F140-N259 HydrophobicContact CE1-CB 4.15Å; F140-N259 HydrophobicContact CZ-CB 4.15Å
141	A	56.5	Low	53.9	Low	27 Å²	27	93.1 Å²	93.1	22%	0.223	48%	0.484	C	S	.	.	P	Polyproline II helix	trans	-65.7	146.8	166.4	0	0	0	0	0	109.8	A261 Y492	A141-A261 HydrophobicContact CB-CB 4.28Å; A141-Y492 HydrophobicContact CB-CE1 4.45Å; A141-Y492 WeakPolarHBondContact O-CE1 3.16Å
142	Q	50.7	Low	51.2	Low	162 Å²	162	98.4 Å²	98.4	76%	0.757	52%	0.516	S	S	*	.	P	Polyproline II helix	trans	-80.9	141.7	162.9	-69.6	-169.7	-3.6	0	0	109.4	Y144	Q142-Y144 PolarHBondContact O-N 3.1Å
143	P	45.5	Very low	48.5	Very low	64 Å²	64	99.6 Å²	99.6	42%	0.416	54%	0.537	S	S	.	.	P	Polyproline II helix	trans	-51.1	122.9	167.9	-30.6	38.3	0	0	0	111.5	M145 P491	P143-M145 PolarHBondContact O-N 3.12Å; P143-P491 WeakPolarHBondContact CB-O 2.95Å; P143-P491 HydrophobicContact CG-CB 4.34Å
144	Y	39.7	Very low	46.3	Very low	179 Å²	179	104.3 Å²	104.3	70%	0.702	57%	0.568	S	S	*	*			trans	-81	88	-171.2	-150.3	-78	0	0	0	110.5	Q142 W146	Q142-Y144 PolarHBondContact O-N 3.1Å; Y144-W146 PolarHBondContact O-N 2.83Å
145	M	28.3	Very low	44.3	Very low	156 Å²	156	105.9 Å²	105.9	77%	0.768	58%	0.581	S	S	*	*			trans	-55.2	98.9	178	-73.2	-86.1	177.1	0	0	111.2	P143 T147	P143-M145 PolarHBondContact O-N 3.12Å; M145-T147 PolarHBondContact O-N 3.33Å
146	W	28.9	Very low	42.1	Very low	192 Å²	192	104.7 Å²	104.7	73%	0.727	59%	0.588	S	S	*	*			trans	-77.1	96.8	-178.6	-175.3	-92.1	0	0	0	110.7	Y144 G148 D495	Y144-W146 PolarHBondContact O-N 2.83Å; W146-G148 VanDerWaalsContact C-N 3.27Å; W146-G148 PolarHBondContact O-N 2.96Å; W146-D495 PolarHBondContact N-OD1 3.36Å
147	T	27.3	Very low	39.9	Very low	118 Å²	118	110.3 Å²	110.3	72%	0.724	62%	0.623	S	S	*	*			trans	-68.4	83.4	173.6	37.7	0	0	0	0	110.8	M145 I149	M145-T147 PolarHBondContact O-N 3.33Å; T147-I149 PolarHBondContact O-N 3.48Å
148	G	26.8	Very low	38	Very low	52 Å²	52	117.7 Å²	117.7	54%	0.536	66%	0.657	S	S	.	*			trans	-56	120.1	-176.9	0	0	0	0	0	113.2	W146	W146-G148 VanDerWaalsContact C-N 3.27Å; W146-G148 PolarHBondContact O-N 2.96Å
149	I	31.2	Very low	36.3	Very low	161 Å²	161	123.9 Å²	123.9	83%	0.826	69%	0.689	S	S	*	*			trans	47	83.1	168.1	-46.2	178	0	0	0	113	T147 A151	T147-I149 PolarHBondContact O-N 3.48Å; I149-A151 PolarHBondContact O-N 2.84Å
150	Q	28.3	Very low	34.7	Very low	177 Å²	177	123.3 Å²	123.3	83%	0.827	70%	0.695	S	S	*	*			trans	-57.5	109.2	159.8	-79.1	-170.9	-18.6	0	0	109.3
151	A	28.7	Very low	33.3	Very low	91 Å²	91	127.1 Å²	127.1	75%	0.752	72%	0.724	S	S	*	*			trans	-65	133	169.4	0	0	0	0	0	109	I149 G153	I149-A151 PolarHBondContact O-N 2.84Å; A151-G153 PolarHBondContact O-N 3.35Å
152	T	32.8	Very low	32.1	Very low	154 Å²	154	130.3 Å²	130.3	95%	0.945	75%	0.75	S	S	*	*			trans	-62.8	99.4	-171.7	-44.2	0	0	0	0	112.1
153	G	29.2	Very low	31.3	Very low	58 Å²	58	127.9 Å²	127.9	60%	0.598	75%	0.751	S	S	*	*			trans	-127.4	117.7	171.2	0	0	0	0	0	109.7	A151	A151-G153 PolarHBondContact O-N 3.35Å
154	P	36.2	Very low	30.7	Very low	115 Å²	115	129.2 Å²	129.2	75%	0.747	77%	0.768	S	S	*	*	S	Bend	trans	-68.9	151.7	175.7	29.1	-33.6	0	0	0	111
155	N	34.8	Very low	30.7	Very low	167 Å²	167	128 Å²	128	89%	0.893	76%	0.762	S	S	*	*			trans	73.3	69.9	176.7	-52.6	-16.3	0	0	0	116.2
156	A	29.5	Very low	30.9	Very low	97 Å²	97	127.6 Å²	127.6	80%	0.802	76%	0.763	S	S	*	*			trans	-115.8	120.7	145.3	0	0	0	0	0	108.3	M158	A156-M158 PolarHBondContact O-N 2.85Å
157	T	28.5	Very low	31.3	Very low	132 Å²	132	126.6 Å²	126.6	81%	0.81	77%	0.771	S	S	*	*			trans	-63.4	132.4	-176.9	-50.1	0	0	0	0	110.8	M159	T157-M159 PolarHBondContact O-N 2.88Å
158	M	31.6	Very low	31.8	Very low	181 Å²	181	126.6 Å²	126.6	89%	0.892	77%	0.771	S	S	*	*			trans	-64.2	95.5	171.7	-87.5	-179.2	61.3	0	0	110.7	A156	A156-M158 PolarHBondContact O-N 2.85Å
159	M	27.7	Very low	33.2	Very low	159 Å²	159	130 Å²	130	78%	0.783	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-78.4	128.9	154.3	-68.7	-63.5	-68.1	0	0	107.8	T157	T157-M159 PolarHBondContact O-N 2.88Å
160	P	27	Very low	34.7	Very low	102 Å²	102	128.3 Å²	128.3	66%	0.662	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-64.5	149.3	173.9	28.3	-34.1	0	0	0	110.1	A162	P160-A162 PolarHBondContact O-N 3.3Å
161	P	31.1	Very low	36.8	Very low	125 Å²	125	121.6 Å²	121.6	81%	0.812	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-58.8	133.3	173.4	25.7	-33.6	0	0	0	109.8	S163	P161-S163 PolarHBondContact O-N 3.25Å
162	A	30.9	Very low	39.3	Very low	94 Å²	94	123.9 Å²	123.9	78%	0.777	74%	0.741	S	S	*	*	S	Bend	trans	-67.3	126.9	-174.7	0	0	0	0	0	111.2	P160	P160-A162 PolarHBondContact O-N 3.3Å
163	S	33.9	Very low	41.6	Very low	112 Å²	112	117.8 Å²	117.8	78%	0.783	70%	0.702	S	S	*	*			trans	47.5	98.1	173.8	56.3	0	0	0	0	115.9	P161	P161-S163 PolarHBondContact O-N 3.25Å
164	A	32.2	Very low	44.4	Very low	92 Å²	92	116.4 Å²	116.4	76%	0.76	68%	0.681	S	S	*	*			trans	-56.3	139.7	141.5	0	0	0	0	0	108.3	D166	A164-D166 PolarHBondContact O-N 2.88Å
165	R	39.2	Very low	46.8	Very low	153 Å²	153	118.2 Å²	118.2	58%	0.577	68%	0.677	S	S	*	*			trans	-62	135.9	172.6	-71.2	-176.4	175.4	-176.2	-2.6	108.6	L167 E222	R165-L167 PolarHBondContact O-N 3.49Å; R165-E222 IonicContact CZ-OE2 3.02Å; R165-E222 VanDerWaalsContact CZ-OE2 3.27Å; R165-E222 IonicContact NH1-OE2 3.22Å; R165-E222 PolarHBondContact NH1-OE2 3.29Å; R165-E222 IonicContact NH2-OE1 3.38Å; R165-E222 PolarHBondContact NH2-OE1 3.06Å; R165-E222 IonicContact NH2-OE2 3.83Å; R165-E222 PolarHBondContact NH2-OE2 2.87Å
166	D	32.5	Very low	49.2	Very low	148 Å²	148	120.1 Å²	120.1	79%	0.791	67%	0.672	S	S	*	*			trans	-64.6	104.8	175.2	-80.2	-57.9	0	0	0	110.5	A164 T168	A164-D166 PolarHBondContact O-N 2.88Å; D166-T168 PolarHBondContact O-N 2.96Å
167	L	37.1	Very low	52.1	Low	171 Å²	171	115.5 Å²	115.5	90%	0.895	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.2	15.9	-173.2	-76.4	165.4	0	0	0	114.5	R165	R165-L167 PolarHBondContact O-N 3.49Å
168	T	38.9	Very low	55	Low	118 Å²	118	113.2 Å²	113.2	72%	0.724	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.8	-15.6	-160.2	50.8	0	0	0	0	115.6	D166	D166-T168 PolarHBondContact O-N 2.96Å
169	T	55.8	Low	57.7	Low	124 Å²	124	108.4 Å²	108.4	76%	0.761	59%	0.594	S	S	*	*			trans	-142.9	115.4	169.4	50.7	0	0	0	0	112.1
170	L	62.9	Low	60.8	Low	124 Å²	124	101.8 Å²	101.8	65%	0.649	57%	0.565	S	S	*	*			trans	-66.4	142.6	172.5	-163.4	70.2	0	0	0	110.8	Y138 Q172	Y138-L170 HydrophobicContact CD2-CD1 3.59Å; Y138-L170 HydrophobicContact CD2-CD2 4.41Å; Y138-L170 HydrophobicContact CD2-CG 4.06Å; Y138-L170 HydrophobicContact CE2-CD1 3.93Å; Y138-L170 HydrophobicContact CE2-CD2 4.02Å; Y138-L170 HydrophobicContact CE2-CG 3.85Å; Y138-L170 HydrophobicContact CG-CD1 4.28Å; L170-Q172 PolarHBondContact O-N 3.41Å
171	P	72.7	Confident	63.9	Low	37 Å²	37	97.5 Å²	97.5	24%	0.24	54%	0.536	C	S	.	.			trans	-56.5	124.3	178.3	-26.4	34.9	0	0	0	112.5	Y138 I173 L213 D223	Y138-P171 HydrophobicContact CD1-CB 4.35Å; Y138-P171 HydrophobicContact CD1-CG 3.84Å; Y138-P171 HydrophobicContact CE1-CB 3.75Å; Y138-P171 HydrophobicContact CE1-CG 3.76Å; Y138-P171 PolarHBondContact OH-O 2.77Å; P171-I173 PolarHBondContact O-N 2.87Å; P171-L213 HydrophobicContact CB-CD1 4.45Å; P171-L213 HydrophobicContact CB-CD2 3.73Å; P171-D223 HydrophobicContact CB-CB 4.21Å; P171-D223 HydrophobicContact CG-CB 4.07Å
172	Q	80.6	Confident	66.8	Low	139 Å²	139	97.5 Å²	97.5	65%	0.65	52%	0.523	S	S	*	.			trans	-76.3	109.7	-179.2	-174.3	169.8	25.6	0	0	110.7	L170 L213 G214	L170-Q172 PolarHBondContact O-N 3.41Å; Q172-L213 CarbonylContact O-C 3.58Å; Q172-L213 WeakPolarHBondContact O-CA 3.48Å; Q172-G214 PolarHBondContact O-N 2.89Å
173	I	82.2	Confident	69.7	Low	26 Å²	26	96.9 Å²	96.9	13%	0.133	51%	0.507	C	S	.	.	B	Isolated β-bridge	trans	-53	140.3	168.1	-55.5	179.1	0	0	0	109.8	V136 Y138 P171 L177 Q178 L181 V227	V136-I173 HydrophobicContact CG2-CD1 3.73Å; Y138-I173 WeakPolarHBondContact OH-CG1 3.14Å; P171-I173 PolarHBondContact O-N 2.87Å; I173-L177 HydrophobicContact CG2-CB 4.14Å; I173-L177 HydrophobicContact CG2-CD2 3.83Å; I173-L177 HydrophobicContact CG2-CG 3.95Å; I173-Q178 HydrophobicContact CG2-CB 4.19Å; I173-L181 HydrophobicContact CG2-CD1 4.45Å; I173-V227 HydrophobicContact CG1-CG2 4.35Å
174	D	87.4	Confident	72.5	Confident	29 Å²	29	91.5 Å²	91.5	16%	0.155	47%	0.47	C	S	.	.			trans	-54.7	146.9	174.9	170.9	-103.7	0	0	0	111.7	W176 L177 Q178 A211 A212	D174-W176 PolarHBondContact O-N 3.12Å; D174-W176 WeakPolarHBondContact OD1-CA 3.46Å; D174-W176 VanDerWaalsContact OD1-CB 3.31Å; D174-W176 WeakPolarHBondContact OD1-CB 3.37Å; D174-W176 PolarHBondContact OD1-N 3.05Å; D174-L177 HydrophobicContact CB-CB 4.1Å; D174-L177 PolarHBondContact O-N 3.47Å; D174-L177 PolarHBondContact OD1-N 3.49Å; D174-L177 VanDerWaalsContact OD1-N 3.1Å; D174-Q178 VanDerWaalsContact O-CB 3.32Å; D174-Q178 WeakPolarHBondContact O-CB 3.42Å; D174-Q178 PolarHBondContact O-N 3.48Å; D174-A211 WeakPolarHBondContact CB-O 3.17Å; D174-A212 PolarHBondContact N-O 2.85Å
175	K	86.6	Confident	75.5	Confident	152 Å²	152	87.7 Å²	87.7	66%	0.661	44%	0.437	S	S	*	.	H	α-helix	trans	-66.1	-39.2	-174.7	-66.2	-179.6	-179.2	176.5	0	112.8	V179	K175-V179 WeakPolarHBondContact O-CG2 3.4Å; K175-V179 PolarHBondContact O-N 2.82Å
176	W	85.7	Confident	78.1	Confident	207 Å²	207	82.9 Å²	82.9	78%	0.784	43%	0.427	S	S	*	.	H	α-helix	trans	-71.4	-41.7	178	-63	95	0	0	0	110.8	D174 V179 A180	D174-W176 PolarHBondContact O-N 3.12Å; D174-W176 WeakPolarHBondContact OD1-CA 3.46Å; D174-W176 VanDerWaalsContact OD1-CB 3.31Å; D174-W176 WeakPolarHBondContact OD1-CB 3.37Å; D174-W176 PolarHBondContact OD1-N 3.05Å; W176-V179 PolarHBondContact O-N 3.25Å; W176-A180 PolarHBondContact O-N 3.42Å
177	L	89.6	Confident	81.1	Confident	0 Å²	0	76.6 Å²	76.6	0%	0	40%	0.395	C	S	.	.	H	α-helix	trans	-61.5	-46.3	173.8	-177.9	61.1	0	0	0	111.6	I173 D174 V179 A180 L181 A203 C207 A211 A212 V227 I231	I173-L177 HydrophobicContact CG2-CB 4.14Å; I173-L177 HydrophobicContact CG2-CD2 3.83Å; I173-L177 HydrophobicContact CG2-CG 3.95Å; D174-L177 HydrophobicContact CB-CB 4.1Å; D174-L177 PolarHBondContact O-N 3.47Å; D174-L177 PolarHBondContact OD1-N 3.49Å; D174-L177 VanDerWaalsContact OD1-N 3.1Å; L177-V179 VanDerWaalsContact C-N 3.28Å; L177-V179 PolarHBondContact O-N 2.97Å; L177-A180 PolarHBondContact O-N 2.99Å; L177-A180 VanDerWaalsContact O-N 3.11Å; L177-L181 HydrophobicContact CD1-CD1 4.33Å; L177-L181 HydrophobicContact CD1-CD2 4.31Å; L177-L181 HydrophobicContact CD1-CG 4.09Å; L177-L181 HydrophobicContact CG-CD1 4.03Å; L177-L181 HydrophobicContact CG-CG 4.22Å; L177-L181 VanDerWaalsContact O-CG 3.3Å; L177-L181 WeakPolarHBondContact O-CG 3.34Å; L177-L181 PolarHBondContact O-N 2.69Å; L177-A203 HydrophobicContact CD1-CB 3.62Å; L177-C207 WeakPolarHBondContact CD2-SG 3.32Å; L177-A211 WeakPolarHBondContact CD2-O 3.42Å; L177-A212 WeakPolarHBondContact CD2-O 3.37Å; L177-V227 HydrophobicContact CD2-CG1 3.67Å; L177-I231 HydrophobicContact CD1-CD1 4.09Å
178	Q	89.3	Confident	83.8	Confident	84 Å²	84	69 Å²	69	39%	0.393	35%	0.354	S	S	.	.	H	α-helix	trans	-60.6	-36.9	-179.7	-162.6	-167.7	47.3	0	0	112.2	I173 D174 K182	I173-Q178 HydrophobicContact CG2-CB 4.19Å; D174-Q178 VanDerWaalsContact O-CB 3.32Å; D174-Q178 WeakPolarHBondContact O-CB 3.42Å; D174-Q178 PolarHBondContact O-N 3.48Å; Q178-K182 HydrophobicContact CG-CD 4.47Å; Q178-K182 WeakPolarHBondContact O-CB 3.36Å; Q178-K182 WeakPolarHBondContact O-CG 3.45Å; Q178-K182 PolarHBondContact O-N 2.93Å; Q178-K182 VanDerWaalsContact O-N 3.13Å
179	V	89.4	Confident	86.5	Confident	80 Å²	80	69.6 Å²	69.6	49%	0.485	34%	0.343	S	S	.	.	H	α-helix	trans	-65.2	-50.7	172	172.4	0	0	0	0	110.6	K175 W176 L177 L181 K182 D183	K175-V179 WeakPolarHBondContact O-CG2 3.4Å; K175-V179 PolarHBondContact O-N 2.82Å; W176-V179 PolarHBondContact O-N 3.25Å; L177-V179 VanDerWaalsContact C-N 3.28Å; L177-V179 PolarHBondContact O-N 2.97Å; V179-L181 VanDerWaalsContact C-N 3.28Å; V179-L181 PolarHBondContact O-N 2.95Å; V179-K182 PolarHBondContact O-N 2.92Å; V179-K182 VanDerWaalsContact O-N 3.08Å; V179-D183 PolarHBondContact O-N 2.81Å
180	A	91.2	Very high	88.4	Confident	20 Å²	20	68.3 Å²	68.3	17%	0.165	33%	0.329	C	S	.	.	H	α-helix	trans	-58.4	-37.4	179.8	0	0	0	0	0	113.2	W176 L177 A184 A203	W176-A180 PolarHBondContact O-N 3.42Å; L177-A180 PolarHBondContact O-N 2.99Å; L177-A180 VanDerWaalsContact O-N 3.11Å; A180-A184 VanDerWaalsContact O-CB 3.27Å; A180-A184 WeakPolarHBondContact O-CB 3.36Å; A180-A184 PolarHBondContact O-N 3.07Å; A180-A203 HydrophobicContact CB-CB 4.43Å
181	L	92.4	Very high	90	Very high	12 Å²	12	70 Å²	70	6%	0.063	33%	0.33	C	S	.	.	H	α-helix	trans	-68	-41.9	174.8	-65	178.3	0	0	0	112.3	I173 L177 V179 A184 S185 F200 A203 F230 I231	I173-L181 HydrophobicContact CG2-CD1 4.45Å; L177-L181 HydrophobicContact CD1-CD1 4.33Å; L177-L181 HydrophobicContact CD1-CD2 4.31Å; L177-L181 HydrophobicContact CD1-CG 4.09Å; L177-L181 HydrophobicContact CG-CD1 4.03Å; L177-L181 HydrophobicContact CG-CG 4.22Å; L177-L181 VanDerWaalsContact O-CG 3.3Å; L177-L181 WeakPolarHBondContact O-CG 3.34Å; L177-L181 PolarHBondContact O-N 2.69Å; V179-L181 VanDerWaalsContact C-N 3.28Å; V179-L181 PolarHBondContact O-N 2.95Å; L181-A184 PolarHBondContact O-N 2.9Å; L181-S185 WeakPolarHBondContact O-CB 3.39Å; L181-S185 PolarHBondContact O-N 2.96Å; L181-S185 PolarHBondContact O-OG 3.49Å; L181-F200 HydrophobicContact CD2-CD1 4.07Å; L181-F200 HydrophobicContact CD2-CE1 4.12Å; L181-A203 HydrophobicContact CD2-CB 3.8Å; L181-F230 HydrophobicContact CD1-CE1 4.47Å; L181-I231 HydrophobicContact CD2-CD1 4.01Å; L181-I231 HydrophobicContact CD2-CG1 3.66Å
182	K	91.4	Very high	91.1	Very high	125 Å²	125	73.3 Å²	73.3	54%	0.543	34%	0.341	S	S	.	.	H	α-helix	trans	-64.8	-41.8	176.9	-76.7	172.6	177.3	174.7	0	111.8	Q178 V179 S186	Q178-K182 HydrophobicContact CG-CD 4.47Å; Q178-K182 WeakPolarHBondContact O-CB 3.36Å; Q178-K182 WeakPolarHBondContact O-CG 3.45Å; Q178-K182 PolarHBondContact O-N 2.93Å; Q178-K182 VanDerWaalsContact O-N 3.13Å; V179-K182 PolarHBondContact O-N 2.92Å; V179-K182 VanDerWaalsContact O-N 3.08Å; K182-S186 VanDerWaalsContact O-CB 3.3Å; K182-S186 WeakPolarHBondContact O-CB 3.41Å; K182-S186 PolarHBondContact O-N 2.79Å
183	D	91.6	Very high	91.9	Very high	81 Å²	81	68.8 Å²	68.8	43%	0.433	32%	0.318	S	S	.	.	H	α-helix	trans	-65.6	-41.1	176.2	-72	-19.1	0	0	0	112.2	V179 S186 C187 Q199	V179-D183 PolarHBondContact O-N 2.81Å; D183-S186 WeakPolarHBondContact O-CB 3.49Å; D183-S186 PolarHBondContact O-N 2.86Å; D183-C187 PolarHBondContact O-N 3.01Å; D183-C187 PolarHBondContact O-SG 3.08Å; D183-C187 VanDerWaalsContact O-SG 3.39Å; D183-Q199 PolarHBondContact O-OE1 2.78Å
184	A	94.5	Very high	92.7	Very high	0 Å²	0	70.7 Å²	70.7	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-64.8	-45.6	176.5	0	0	0	0	0	112.3	A180 L181 C187 Y188 A196 Q199 F200	A180-A184 VanDerWaalsContact O-CB 3.27Å; A180-A184 WeakPolarHBondContact O-CB 3.36Å; A180-A184 PolarHBondContact O-N 3.07Å; L181-A184 PolarHBondContact O-N 2.9Å; A184-C187 PolarHBondContact O-N 2.74Å; A184-Y188 PolarHBondContact O-N 3.01Å; A184-A196 WeakPolarHBondContact O-CB 3.33Å; A184-Q199 HydrophobicContact CB-CB 3.66Å; A184-F200 HydrophobicContact CB-CD1 3.59Å; A184-F200 HydrophobicContact CB-CD2 3.84Å; A184-F200 HydrophobicContact CB-CE1 3.45Å; A184-F200 VanDerWaalsContact CB-CE1 3.45Å; A184-F200 HydrophobicContact CB-CE2 3.7Å; A184-F200 HydrophobicContact CB-CG 3.77Å; A184-F200 HydrophobicContact CB-CZ 3.49Å; A184-F200 VanDerWaalsContact CB-CZ 3.49Å
185	S	93.7	Very high	93.1	Very high	12 Å²	12	73 Å²	73	8%	0.084	35%	0.353	C	S	.	.	H	α-helix	trans	-64.8	-37.9	174.6	-66	0	0	0	0	112.1	L181 C187 Y188 R189	L181-S185 WeakPolarHBondContact O-CB 3.39Å; L181-S185 PolarHBondContact O-N 2.96Å; L181-S185 PolarHBondContact O-OG 3.49Å; S185-C187 VanDerWaalsContact C-N 3.35Å; S185-C187 PolarHBondContact O-N 2.91Å; S185-Y188 WeakPolarHBondContact O-CB 3.47Å; S185-Y188 PolarHBondContact O-N 3.13Å; S185-R189 WeakPolarHBondContact O-CG 3.44Å; S185-R189 PolarHBondContact O-N 3.22Å
186	S	94.1	Very high	93.6	Very high	51 Å²	51	65.8 Å²	65.8	36%	0.357	32%	0.322	S	S	.	.	H	α-helix	trans	-59.6	-44.3	171.5	-174.9	0	0	0	0	111.6	K182 D183 Y188 R189 Q190	K182-S186 VanDerWaalsContact O-CB 3.3Å; K182-S186 WeakPolarHBondContact O-CB 3.41Å; K182-S186 PolarHBondContact O-N 2.79Å; D183-S186 WeakPolarHBondContact O-CB 3.49Å; D183-S186 PolarHBondContact O-N 2.86Å; S186-Y188 PolarHBondContact O-N 3.09Å; S186-R189 PolarHBondContact O-N 3.17Å; S186-Q190 WeakPolarHBondContact O-CB 3.42Å; S186-Q190 VanDerWaalsContact O-CG 3.24Å; S186-Q190 WeakPolarHBondContact O-CG 3.48Å; S186-Q190 PolarHBondContact O-N 2.8Å; S186-Q190 PolarHBondContact O-NE2 3.37Å; S186-Q190 PolarHBondContact OG-NE2 2.97Å
187	C	95.3	Very high	94.2	Very high	17 Å²	17	56.1 Å²	56.1	12%	0.115	29%	0.286	C	S	.	.	H	α-helix	trans	-65.4	-36	174.1	-71.3	0	0	0	0	112.9	D183 A184 S185 Q190 K191 K192 V195 A196 Q199	D183-C187 PolarHBondContact O-N 3.01Å; D183-C187 PolarHBondContact O-SG 3.08Å; D183-C187 VanDerWaalsContact O-SG 3.39Å; A184-C187 PolarHBondContact O-N 2.74Å; S185-C187 VanDerWaalsContact C-N 3.35Å; S185-C187 PolarHBondContact O-N 2.91Å; C187-Q190 CarbonylContact O-C 3.5Å; C187-Q190 PolarHBondContact O-N 2.62Å; C187-K191 PolarHBondContact O-N 3.29Å; C187-K192 HydrophobicContact CB-CB 4.23Å; C187-K192 WeakPolarHBondContact O-CA 3.31Å; C187-K192 WeakPolarHBondContact O-CB 3.48Å; C187-K192 PolarHBondContact O-N 3.36Å; C187-V195 HydrophobicContact CB-CB 4.47Å; C187-V195 HydrophobicContact CB-CG1 4.45Å; C187-A196 HydrophobicContact CB-CB 3.93Å; C187-Q199 PolarHBondContact SG-OE1 3Å
188	Y	94.8	Very high	94.5	Very high	12 Å²	12	57.6 Å²	57.6	5%	0.047	30%	0.302	C	S	.	.	H	α-helix	trans	-63.2	-45.1	174.3	-179.4	-96.6	0	0	0	111.7	Y130 D132 A184 S185 S186 Q190 K191 Y193 R241	Y130-Y188 PolarHBondContact O-OH 2.94Å; D132-Y188 HydrophobicContact CB-CD1 4.19Å; D132-Y188 HydrophobicContact CB-CE1 3.99Å; A184-Y188 PolarHBondContact O-N 3.01Å; S185-Y188 WeakPolarHBondContact O-CB 3.47Å; S185-Y188 PolarHBondContact O-N 3.13Å; S186-Y188 PolarHBondContact O-N 3.09Å; Y188-Q190 PolarHBondContact O-N 2.88Å; Y188-K191 WeakPolarHBondContact O-CA 3.19Å; Y188-K191 PolarHBondContact O-N 2.93Å; Y188-Y193 AromaticContact CD2-CD1 3.52Å; Y188-Y193 HydrophobicContact CD2-CD1 3.52Å; Y188-Y193 AromaticContact CD2-CE1 3.66Å; Y188-Y193 HydrophobicContact CD2-CE1 3.66Å; Y188-Y193 AromaticContact CE2-CD1 3.78Å; Y188-Y193 HydrophobicContact CE2-CD1 3.78Å; Y188-Y193 AromaticContact CE2-CE1 3.65Å; Y188-Y193 HydrophobicContact CE2-CE1 3.65Å; Y188-Y193 HydrophobicContact CG-CD1 4.33Å; Y188-Y193 HydrophobicContact CG-CE1 4.22Å; Y188-Y193 WeakPolarHBondContact O-CE1 3.12Å; Y188-R241 HydrophobicContact CE2-CG 4.03Å
189	R	94.6	Very high	94.8	Very high	130 Å²	130	56.1 Å²	56.1	49%	0.491	30%	0.295	S	S	.	.	H	α-helix	trans	-62	-40.5	175	-69.2	168.7	-165.5	-152.6	-6.4	112.4	D132 E134 S185 S186 K191	D132-R189 IonicContact OD2-CZ 2.75Å; D132-R189 VanDerWaalsContact OD2-CZ 3.23Å; D132-R189 IonicContact OD2-NE 3.06Å; D132-R189 PolarHBondContact OD2-NE 3.17Å; D132-R189 IonicContact OD2-NH2 3.13Å; D132-R189 PolarHBondContact OD2-NH2 3.33Å; E134-R189 IonicContact OE1-CZ 2.71Å; E134-R189 IonicContact OE1-NH1 3.18Å; E134-R189 PolarHBondContact OE1-NH1 2.61Å; E134-R189 IonicContact OE1-NH2 2.84Å; E134-R189 PolarHBondContact OE1-NH2 3.18Å; S185-R189 WeakPolarHBondContact O-CG 3.44Å; S185-R189 PolarHBondContact O-N 3.22Å; S186-R189 PolarHBondContact O-N 3.17Å; R189-K191 PolarHBondContact O-N 3.45Å; R189-K191 VanDerWaalsContact O-N 3.09Å
190	Q	95.8	Very high	95.2	Very high	97 Å²	97	52.3 Å²	52.3	45%	0.453	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	4.5	172.2	-67	173.1	47.3	0	0	113.7	S186 C187 Y188 K192	S186-Q190 WeakPolarHBondContact O-CB 3.42Å; S186-Q190 VanDerWaalsContact O-CG 3.24Å; S186-Q190 WeakPolarHBondContact O-CG 3.48Å; S186-Q190 PolarHBondContact O-N 2.8Å; S186-Q190 PolarHBondContact O-NE2 3.37Å; S186-Q190 PolarHBondContact OG-NE2 2.97Å; C187-Q190 CarbonylContact O-C 3.5Å; C187-Q190 PolarHBondContact O-N 2.62Å; Y188-Q190 PolarHBondContact O-N 2.88Å; Q190-K192 HydrophobicContact CB-CD 4.07Å; Q190-K192 HydrophobicContact CB-CG 4.12Å; Q190-K192 PolarHBondContact O-N 3.28Å; Q190-K192 VanDerWaalsContact O-N 3.16Å
191	K	96.3	Very high	95.4	Very high	158 Å²	158	57.1 Å²	57.1	69%	0.687	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.5	15.5	-177.5	-48.9	179.4	-175.9	171.1	0	114.2	C187 Y188 R189 Y193	C187-K191 PolarHBondContact O-N 3.29Å; Y188-K191 WeakPolarHBondContact O-CA 3.19Å; Y188-K191 PolarHBondContact O-N 2.93Å; R189-K191 PolarHBondContact O-N 3.45Å; R189-K191 VanDerWaalsContact O-N 3.09Å; K191-Y193 HydrophobicContact CB-CE2 3.93Å; K191-Y193 VanDerWaalsContact O-CD2 3.31Å; K191-Y193 WeakPolarHBondContact O-CD2 3.38Å; K191-Y193 PolarHBondContact O-N 3Å
192	K	97.2	Very high	95.5	Very high	107 Å²	107	60.1 Å²	60.1	47%	0.465	31%	0.305	S	S	.	.			trans	-81.7	52.3	176.9	-63.5	173.1	177.2	169.8	0	110.5	C187 Q190 A194 V195 A196	C187-K192 HydrophobicContact CB-CB 4.23Å; C187-K192 WeakPolarHBondContact O-CA 3.31Å; C187-K192 WeakPolarHBondContact O-CB 3.48Å; C187-K192 PolarHBondContact O-N 3.36Å; Q190-K192 HydrophobicContact CB-CD 4.07Å; Q190-K192 HydrophobicContact CB-CG 4.12Å; Q190-K192 PolarHBondContact O-N 3.28Å; Q190-K192 VanDerWaalsContact O-N 3.16Å; K192-A194 PolarHBondContact O-N 3.01Å; K192-A194 VanDerWaalsContact O-N 3.09Å; K192-V195 HydrophobicContact CB-CB 4.19Å; K192-V195 HydrophobicContact CB-CG2 4.22Å; K192-V195 WeakPolarHBondContact O-CA 3.26Å; K192-V195 WeakPolarHBondContact O-CB 3.45Å; K192-V195 PolarHBondContact O-N 3.15Å; K192-A196 PolarHBondContact O-N 2.93Å
193	Y	97.4	Very high	95.6	Very high	44 Å²	44	54.2 Å²	54.2	17%	0.173	28%	0.279	C	S	.	.	H	α-helix	trans	-56.1	-32.6	-167.5	-55.9	-57.1	0	0	0	114.5	Y188 K191 A197 R241	Y188-Y193 AromaticContact CD2-CD1 3.52Å; Y188-Y193 HydrophobicContact CD2-CD1 3.52Å; Y188-Y193 AromaticContact CD2-CE1 3.66Å; Y188-Y193 HydrophobicContact CD2-CE1 3.66Å; Y188-Y193 AromaticContact CE2-CD1 3.78Å; Y188-Y193 HydrophobicContact CE2-CD1 3.78Å; Y188-Y193 AromaticContact CE2-CE1 3.65Å; Y188-Y193 HydrophobicContact CE2-CE1 3.65Å; Y188-Y193 HydrophobicContact CG-CD1 4.33Å; Y188-Y193 HydrophobicContact CG-CE1 4.22Å; Y188-Y193 WeakPolarHBondContact O-CE1 3.12Å; K191-Y193 HydrophobicContact CB-CE2 3.93Å; K191-Y193 VanDerWaalsContact O-CD2 3.31Å; K191-Y193 WeakPolarHBondContact O-CD2 3.38Å; K191-Y193 PolarHBondContact O-N 3Å; Y193-A197 VanDerWaalsContact O-CB 3.29Å; Y193-A197 WeakPolarHBondContact O-CB 3.37Å; Y193-A197 PolarHBondContact O-N 3.23Å; Y193-R241 HydrophobicContact CD1-CB 3.85Å; Y193-R241 HydrophobicContact CD1-CG 4.07Å; Y193-R241 HydrophobicContact CD2-CB 3.66Å; Y193-R241 HydrophobicContact CD2-CG 4.46Å; Y193-R241 HydrophobicContact CE1-CB 3.99Å; Y193-R241 HydrophobicContact CE1-CG 3.79Å; Y193-R241 HydrophobicContact CE2-CB 3.79Å; Y193-R241 HydrophobicContact CE2-CG 4.2Å; Y193-R241 HydrophobicContact CG-CB 3.69Å; Y193-R241 HydrophobicContact CG-CG 4.4Å
194	A	97.5	Very high	95.8	Very high	66 Å²	66	51.2 Å²	51.2	55%	0.545	26%	0.262	S	S	.	.	H	α-helix	trans	-69	-35.7	175.2	0	0	0	0	0	113.2	K192 G198 M242	K192-A194 PolarHBondContact O-N 3.01Å; K192-A194 VanDerWaalsContact O-N 3.09Å; A194-G198 PolarHBondContact O-N 3.48Å; A194-G198 VanDerWaalsContact O-N 3.17Å; A194-M242 HydrophobicContact CB-CE 3.78Å; A194-M242 HydrophobicContact CB-SD 4.2Å
195	V	97.4	Very high	95.7	Very high	78 Å²	78	56 Å²	56	47%	0.473	29%	0.285	S	S	.	.	H	α-helix	trans	-73.3	-45.8	176.5	-175.7	0	0	0	0	109.7	C187 K192 A197 G198 Q199	C187-V195 HydrophobicContact CB-CB 4.47Å; C187-V195 HydrophobicContact CB-CG1 4.45Å; K192-V195 HydrophobicContact CB-CB 4.19Å; K192-V195 HydrophobicContact CB-CG2 4.22Å; K192-V195 WeakPolarHBondContact O-CA 3.26Å; K192-V195 WeakPolarHBondContact O-CB 3.45Å; K192-V195 PolarHBondContact O-N 3.15Å; V195-A197 VanDerWaalsContact C-N 3.34Å; V195-A197 PolarHBondContact O-N 3.29Å; V195-G198 WeakPolarHBondContact O-CA 3.4Å; V195-G198 PolarHBondContact O-N 2.95Å; V195-Q199 PolarHBondContact O-N 2.83Å
196	A	97.1	Very high	95.4	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-56.4	-46.4	174.3	0	0	0	0	0	111.7	A184 C187 K192 G198 Q199 F200	A184-A196 WeakPolarHBondContact O-CB 3.33Å; C187-A196 HydrophobicContact CB-CB 3.93Å; K192-A196 PolarHBondContact O-N 2.93Å; A196-G198 VanDerWaalsContact C-N 3.28Å; A196-G198 PolarHBondContact O-N 3.47Å; A196-Q199 PolarHBondContact O-N 2.87Å; A196-F200 HydrophobicContact CB-CD2 4.35Å; A196-F200 HydrophobicContact CB-CE2 4.22Å; A196-F200 WeakPolarHBondContact O-CB 3.26Å; A196-F200 WeakPolarHBondContact O-CD2 3.44Å; A196-F200 PolarHBondContact O-N 2.97Å
197	A	97.2	Very high	95.2	Very high	4 Å²	4	55.9 Å²	55.9	3%	0.033	28%	0.28	C	S	.	.	H	α-helix	trans	-61.7	-33.7	174.8	0	0	0	0	0	113.1	Y193 V195 R201 L235 C238 Y239 M242	Y193-A197 VanDerWaalsContact O-CB 3.29Å; Y193-A197 WeakPolarHBondContact O-CB 3.37Å; Y193-A197 PolarHBondContact O-N 3.23Å; V195-A197 VanDerWaalsContact C-N 3.34Å; V195-A197 PolarHBondContact O-N 3.29Å; A197-R201 VanDerWaalsContact O-CG 3.28Å; A197-R201 WeakPolarHBondContact O-CG 3.5Å; A197-R201 PolarHBondContact O-N 2.93Å; A197-R201 VanDerWaalsContact O-N 3.15Å; A197-L235 HydrophobicContact CB-CD2 4.32Å; A197-L235 WeakPolarHBondContact O-CD2 3.19Å; A197-C238 HydrophobicContact CB-CB 3.92Å; A197-Y239 HydrophobicContact CB-CE1 4.12Å; A197-M242 HydrophobicContact CB-SD 4.5Å
198	G	96.8	Very high	94.7	Very high	32 Å²	32	59.6 Å²	59.6	33%	0.33	31%	0.306	S	S	.	.	H	α-helix	trans	-63.8	-51.3	171.6	0	0	0	0	0	111.9	A194 V195 A196 R201 T202	A194-G198 PolarHBondContact O-N 3.48Å; A194-G198 VanDerWaalsContact O-N 3.17Å; V195-G198 WeakPolarHBondContact O-CA 3.4Å; V195-G198 PolarHBondContact O-N 2.95Å; A196-G198 VanDerWaalsContact C-N 3.28Å; A196-G198 PolarHBondContact O-N 3.47Å; G198-R201 WeakPolarHBondContact O-CB 3.44Å; G198-R201 PolarHBondContact O-N 3.37Å; G198-R201 VanDerWaalsContact O-N 3.16Å; G198-T202 PolarHBondContact O-N 3.29Å; G198-T202 VanDerWaalsContact O-N 3.1Å; G198-T202 PolarHBondContact O-OG1 3.44Å
199	Q	95.9	Very high	94.3	Very high	52 Å²	52	66.3 Å²	66.3	24%	0.243	34%	0.335	C	S	.	.	H	α-helix	trans	-65.7	-39.6	-179.3	-67.3	168.9	-57.9	0	0	112.4	D183 A184 C187 V195 A196 R201 T202 A203	D183-Q199 PolarHBondContact O-OE1 2.78Å; A184-Q199 HydrophobicContact CB-CB 3.66Å; C187-Q199 PolarHBondContact SG-OE1 3Å; V195-Q199 PolarHBondContact O-N 2.83Å; A196-Q199 PolarHBondContact O-N 2.87Å; Q199-R201 VanDerWaalsContact C-N 3.32Å; Q199-R201 PolarHBondContact O-N 3.47Å; Q199-T202 WeakPolarHBondContact O-CB 3.37Å; Q199-T202 PolarHBondContact O-N 3.33Å; Q199-A203 PolarHBondContact O-N 3.35Å
200	F	96.6	Very high	93.7	Very high	0 Å²	0	61.8 Å²	61.8	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-64.9	-31.6	173.1	-73.5	-56.6	0	0	0	112.5	L181 A184 A196 A203 L204 I231 K234 L235	L181-F200 HydrophobicContact CD2-CD1 4.07Å; L181-F200 HydrophobicContact CD2-CE1 4.12Å; A184-F200 HydrophobicContact CB-CD1 3.59Å; A184-F200 HydrophobicContact CB-CD2 3.84Å; A184-F200 HydrophobicContact CB-CE1 3.45Å; A184-F200 VanDerWaalsContact CB-CE1 3.45Å; A184-F200 HydrophobicContact CB-CE2 3.7Å; A184-F200 HydrophobicContact CB-CG 3.77Å; A184-F200 HydrophobicContact CB-CZ 3.49Å; A184-F200 VanDerWaalsContact CB-CZ 3.49Å; A196-F200 HydrophobicContact CB-CD2 4.35Å; A196-F200 HydrophobicContact CB-CE2 4.22Å; A196-F200 WeakPolarHBondContact O-CB 3.26Å; A196-F200 WeakPolarHBondContact O-CD2 3.44Å; A196-F200 PolarHBondContact O-N 2.97Å; F200-A203 PolarHBondContact O-N 2.93Å; F200-L204 WeakPolarHBondContact O-CB 3.31Å; F200-L204 PolarHBondContact O-N 3.01Å; F200-I231 HydrophobicContact CB-CG2 4.23Å; F200-I231 WeakPolarHBondContact O-CG2 3.28Å; F200-K234 HydrophobicContact CD1-CB 3.95Å; F200-K234 HydrophobicContact CD1-CG 4.43Å; F200-K234 HydrophobicContact CD2-CB 3.97Å; F200-K234 HydrophobicContact CE1-CB 3.79Å; F200-K234 HydrophobicContact CE1-CD 4.4Å; F200-K234 HydrophobicContact CE1-CG 3.85Å; F200-K234 HydrophobicContact CE2-CB 3.82Å; F200-K234 HydrophobicContact CE2-CD 4.47Å; F200-K234 HydrophobicContact CE2-CG 4.4Å; F200-K234 HydrophobicContact CG-CB 4.07Å; F200-K234 HydrophobicContact CZ-CB 3.74Å; F200-K234 HydrophobicContact CZ-CD 3.94Å; F200-K234 HydrophobicContact CZ-CG 3.85Å; F200-L235 HydrophobicContact CB-CD2 3.6Å; F200-L235 HydrophobicContact CB-CG 3.82Å
201	R	96	Very high	93	Very high	121 Å²	121	58.6 Å²	58.6	46%	0.457	32%	0.319	S	S	.	.	H	α-helix	trans	-65	-44.6	169.4	-73.3	169.3	-175	-168.2	-1.8	111.5	A197 G198 Q199 A203 L204 E205 L235 Y239	A197-R201 VanDerWaalsContact O-CG 3.28Å; A197-R201 WeakPolarHBondContact O-CG 3.5Å; A197-R201 PolarHBondContact O-N 2.93Å; A197-R201 VanDerWaalsContact O-N 3.15Å; G198-R201 WeakPolarHBondContact O-CB 3.44Å; G198-R201 PolarHBondContact O-N 3.37Å; G198-R201 VanDerWaalsContact O-N 3.16Å; Q199-R201 VanDerWaalsContact C-N 3.32Å; Q199-R201 PolarHBondContact O-N 3.47Å; R201-A203 VanDerWaalsContact C-N 3.3Å; R201-A203 PolarHBondContact O-N 3.29Å; R201-L204 WeakPolarHBondContact O-CB 3.03Å; R201-L204 PolarHBondContact O-N 3.16Å; R201-L204 VanDerWaalsContact O-N 3.14Å; R201-E205 PolarHBondContact O-N 3.04Å; R201-L235 HydrophobicContact CG-CD1 4.46Å; R201-L235 HydrophobicContact CG-CD2 4.02Å; R201-Y239 VanDerWaalsContact CZ-OH 3.31Å; R201-Y239 PolarHBondContact NE-OH 3.21Å; R201-Y239 PolarHBondContact NH2-OH 3.01Å
202	T	94.4	Very high	92.3	Very high	76 Å²	76	51.1 Å²	51.1	47%	0.466	29%	0.288	S	S	.	.	H	α-helix	trans	-61.2	-40	176.1	-53	0	0	0	0	111.5	G198 Q199 E205 L206	G198-T202 PolarHBondContact O-N 3.29Å; G198-T202 VanDerWaalsContact O-N 3.1Å; G198-T202 PolarHBondContact O-OG1 3.44Å; Q199-T202 WeakPolarHBondContact O-CB 3.37Å; Q199-T202 PolarHBondContact O-N 3.33Å; T202-E205 PolarHBondContact O-N 3.2Å; T202-L206 WeakPolarHBondContact O-CG 3.29Å; T202-L206 PolarHBondContact O-N 2.94Å
203	A	94.6	Very high	91.6	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-60.6	-44	172	0	0	0	0	0	112.3	L177 A180 L181 Q199 F200 R201 E205 L206 C207 I231	L177-A203 HydrophobicContact CD1-CB 3.62Å; A180-A203 HydrophobicContact CB-CB 4.43Å; L181-A203 HydrophobicContact CD2-CB 3.8Å; Q199-A203 PolarHBondContact O-N 3.35Å; F200-A203 PolarHBondContact O-N 2.93Å; R201-A203 VanDerWaalsContact C-N 3.3Å; R201-A203 PolarHBondContact O-N 3.29Å; A203-E205 VanDerWaalsContact C-N 3.33Å; A203-E205 PolarHBondContact O-N 3.2Å; A203-L206 WeakPolarHBondContact O-CB 3.44Å; A203-L206 PolarHBondContact O-N 2.89Å; A203-C207 PolarHBondContact O-N 2.88Å; A203-C207 PolarHBondContact O-SG 3.24Å; A203-I231 HydrophobicContact CB-CD1 4.07Å; A203-I231 HydrophobicContact CB-CG2 4.39Å
204	L	94.1	Very high	90.4	Very high	18 Å²	18	46.4 Å²	46.4	9%	0.094	28%	0.281	C	S	.	.	H	α-helix	trans	-63.1	-38	176.3	-170.1	62.8	0	0	0	112.3	F200 R201 C207 S208 I231 E232 L235	F200-L204 WeakPolarHBondContact O-CB 3.31Å; F200-L204 PolarHBondContact O-N 3.01Å; R201-L204 WeakPolarHBondContact O-CB 3.03Å; R201-L204 PolarHBondContact O-N 3.16Å; R201-L204 VanDerWaalsContact O-N 3.14Å; L204-C207 PolarHBondContact O-N 2.94Å; L204-S208 WeakPolarHBondContact O-CB 3.43Å; L204-S208 PolarHBondContact O-N 3.34Å; L204-S208 PolarHBondContact O-OG 3.04Å; L204-I231 HydrophobicContact CB-CG2 3.75Å; L204-I231 HydrophobicContact CD1-CB 4.34Å; L204-I231 HydrophobicContact CD1-CG2 4.21Å; L204-I231 HydrophobicContact CG-CG2 4.49Å; L204-E232 HydrophobicContact CD1-CG 4.2Å; L204-E232 WeakPolarHBondContact CD2-OE1 3.23Å; L204-L235 HydrophobicContact CD2-CD1 4Å
205	E	92.1	Very high	89.4	Confident	100 Å²	100	49 Å²	49	47%	0.467	28%	0.28	S	S	.	.	H	α-helix	trans	-66.3	-36.2	173.2	-76.7	-174.9	-139.5	0	0	112.9	R201 T202 A203 S208 K209	R201-E205 PolarHBondContact O-N 3.04Å; T202-E205 PolarHBondContact O-N 3.2Å; A203-E205 VanDerWaalsContact C-N 3.33Å; A203-E205 PolarHBondContact O-N 3.2Å; E205-S208 PolarHBondContact O-N 3.45Å; E205-K209 VanDerWaalsContact O-CD 3.31Å; E205-K209 WeakPolarHBondContact O-CD 3.49Å; E205-K209 VanDerWaalsContact O-CG 3.23Å; E205-K209 WeakPolarHBondContact O-CG 3.49Å; E205-K209 PolarHBondContact O-N 3.16Å; E205-K209 VanDerWaalsContact O-N 3.09Å; E205-K209 IonicContact OE2-NZ 2.63Å; E205-K209 PolarHBondContact OE2-NZ 2.69Å
206	L	89.4	Confident	87.8	Confident	50 Å²	50	47.8 Å²	47.8	26%	0.262	27%	0.273	S	S	.	.	H	α-helix	trans	-65.4	-47.1	174.1	-71.9	171.2	0	0	0	110.8	T202 A203 S208 K209 G210 A211	T202-L206 WeakPolarHBondContact O-CG 3.29Å; T202-L206 PolarHBondContact O-N 2.94Å; A203-L206 WeakPolarHBondContact O-CB 3.44Å; A203-L206 PolarHBondContact O-N 2.89Å; L206-S208 VanDerWaalsContact C-N 3.3Å; L206-S208 PolarHBondContact O-N 2.99Å; L206-K209 CarbonylContact O-C 3.56Å; L206-K209 PolarHBondContact O-N 3.43Å; L206-K209 VanDerWaalsContact O-N 3.08Å; L206-G210 PolarHBondContact O-N 3.48Å; L206-A211 HydrophobicContact CB-CB 4.31Å; L206-A211 WeakPolarHBondContact O-CB 3.5Å; L206-A211 PolarHBondContact O-N 3.4Å
207	C	88.1	Confident	86.3	Confident	12 Å²	12	57.9 Å²	57.9	8%	0.081	32%	0.318	C	S	.	.	H	α-helix	trans	-54.7	-46.2	171.3	-68.3	0	0	0	0	111.9	L177 A203 L204 K209 G210 A212 I231	L177-C207 WeakPolarHBondContact CD2-SG 3.32Å; A203-C207 PolarHBondContact O-N 2.88Å; A203-C207 PolarHBondContact O-SG 3.24Å; L204-C207 PolarHBondContact O-N 2.94Å; C207-K209 PolarHBondContact O-N 3.04Å; C207-G210 PolarHBondContact O-N 3.44Å; C207-A212 HydrophobicContact CB-CB 4.38Å; C207-I231 WeakPolarHBondContact SG-CD1 3.38Å
208	S	85.3	Confident	85	Confident	94 Å²	94	64.1 Å²	64.1	66%	0.657	35%	0.346	S	S	*	.	H	α-helix	trans	-65.6	-19.3	-179.8	-55.9	0	0	0	0	113.5	L204 E205 L206	L204-S208 WeakPolarHBondContact O-CB 3.43Å; L204-S208 PolarHBondContact O-N 3.34Å; L204-S208 PolarHBondContact O-OG 3.04Å; E205-S208 PolarHBondContact O-N 3.45Å; L206-S208 VanDerWaalsContact C-N 3.3Å; L206-S208 PolarHBondContact O-N 2.99Å
209	K	86.5	Confident	84	Confident	153 Å²	153	64 Å²	64	67%	0.665	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.1	7.3	174	-67.8	161.2	-167.2	160.6	0	112.5	E205 L206 C207	E205-K209 VanDerWaalsContact O-CD 3.31Å; E205-K209 WeakPolarHBondContact O-CD 3.49Å; E205-K209 VanDerWaalsContact O-CG 3.23Å; E205-K209 WeakPolarHBondContact O-CG 3.49Å; E205-K209 PolarHBondContact O-N 3.16Å; E205-K209 VanDerWaalsContact O-N 3.09Å; E205-K209 IonicContact OE2-NZ 2.63Å; E205-K209 PolarHBondContact OE2-NZ 2.69Å; L206-K209 CarbonylContact O-C 3.56Å; L206-K209 PolarHBondContact O-N 3.43Å; L206-K209 VanDerWaalsContact O-N 3.08Å; C207-K209 PolarHBondContact O-N 3.04Å
210	G	81.7	Confident	83.3	Confident	36 Å²	36	67.9 Å²	67.9	37%	0.371	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	95.1	-4.7	177.8	0	0	0	0	0	115.4	L206 C207 A212 P216	L206-G210 PolarHBondContact O-N 3.48Å; C207-G210 PolarHBondContact O-N 3.44Å; G210-A212 PolarHBondContact O-N 3.21Å; G210-P216 WeakPolarHBondContact O-CB 3.41Å
211	A	81.4	Confident	82.7	Confident	29 Å²	29	71.8 Å²	71.8	24%	0.24	39%	0.392	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	43.6	-178.8	0	0	0	0	0	113	D174 L177 L206	D174-A211 WeakPolarHBondContact CB-O 3.17Å; L177-A211 WeakPolarHBondContact CD2-O 3.42Å; L206-A211 HydrophobicContact CB-CB 4.31Å; L206-A211 WeakPolarHBondContact O-CB 3.5Å; L206-A211 PolarHBondContact O-N 3.4Å
212	A	81.4	Confident	82.2	Confident	2 Å²	2	69.4 Å²	69.4	2%	0.017	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82	-42	179.8	0	0	0	0	0	112.7	D174 L177 C207 G210 I224	D174-A212 PolarHBondContact N-O 2.85Å; L177-A212 WeakPolarHBondContact CD2-O 3.37Å; C207-A212 HydrophobicContact CB-CB 4.38Å; G210-A212 PolarHBondContact O-N 3.21Å; A212-I224 HydrophobicContact CB-CB 4.5Å; A212-I224 HydrophobicContact CB-CG1 4.32Å; A212-I224 HydrophobicContact CB-CG2 3.97Å
213	L	82.8	Confident	81.8	Confident	7 Å²	7	66.7 Å²	66.7	4%	0.037	37%	0.369	C	S	.	.	B	Isolated β-bridge	trans	-136.4	148.6	-174.5	-66.8	162.8	0	0	0	108.7	P171 Q172 K215 P216 A219 D223 I224 V227	P171-L213 HydrophobicContact CB-CD1 4.45Å; P171-L213 HydrophobicContact CB-CD2 3.73Å; Q172-L213 CarbonylContact O-C 3.58Å; Q172-L213 WeakPolarHBondContact O-CA 3.48Å; L213-K215 PolarHBondContact O-N 2.82Å; L213-P216 WeakPolarHBondContact O-CD 3.34Å; L213-A219 HydrophobicContact CB-CB 4.26Å; L213-A219 HydrophobicContact CD1-CB 3.48Å; L213-A219 VanDerWaalsContact CD1-CB 3.48Å; L213-D223 HydrophobicContact CD1-CB 3.56Å; L213-I224 HydrophobicContact CD1-CG1 3.79Å; L213-V227 HydrophobicContact CD2-CG2 4.18Å
214	G	72.9	Confident	81.4	Confident	44 Å²	44	69.4 Å²	69.4	45%	0.454	38%	0.382	S	S	.	.	S	Bend	trans	-64.1	-10.2	-172.5	0	0	0	0	0	115.4	Q172	Q172-G214 PolarHBondContact O-N 2.89Å
215	K	75.3	Confident	81.3	Confident	121 Å²	121	69.5 Å²	69.5	53%	0.526	39%	0.386	S	S	.	.	S	Bend	trans	-134.1	77.9	169.2	-67.7	-157.7	-177.5	-170.6	0	110.5	L213 F217 E218 A219	L213-K215 PolarHBondContact O-N 2.82Å; K215-F217 VanDerWaalsContact C-N 3.25Å; K215-F217 PolarHBondContact O-N 3.48Å; K215-F217 VanDerWaalsContact O-N 3.17Å; K215-E218 HydrophobicContact CB-CB 4.15Å; K215-E218 HydrophobicContact CD-CB 4.33Å; K215-E218 HydrophobicContact CD-CG 4.21Å; K215-E218 VanDerWaalsContact CD-OE1 3.29Å; K215-E218 WeakPolarHBondContact CD-OE1 3.37Å; K215-E218 WeakPolarHBondContact CD-OE2 3.41Å; K215-E218 WeakPolarHBondContact CE-OE2 3.38Å; K215-E218 IonicContact NZ-OE1 2.75Å; K215-E218 PolarHBondContact NZ-OE1 2.91Å; K215-E218 IonicContact NZ-OE2 2.66Å; K215-E218 PolarHBondContact NZ-OE2 3.23Å; K215-E218 PolarHBondContact O-N 3.35Å; K215-E218 VanDerWaalsContact O-N 3.11Å; K215-A219 PolarHBondContact O-N 3.18Å
216	P	63.4	Low	81.2	Confident	52 Å²	52	64.9 Å²	64.9	34%	0.338	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-18.1	-166.5	28.2	-35.2	0	0	0	114.5	G210 L213	G210-P216 WeakPolarHBondContact O-CB 3.41Å; L213-P216 WeakPolarHBondContact O-CD 3.34Å
217	F	67.3	Low	81.3	Confident	213 Å²	213	62.5 Å²	62.5	93%	0.934	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89	-12.7	175.4	-58.5	-72.4	0	0	0	114.1	K215	K215-F217 VanDerWaalsContact C-N 3.25Å; K215-F217 PolarHBondContact O-N 3.48Å; K215-F217 VanDerWaalsContact O-N 3.17Å
218	E	69.6	Low	81.7	Confident	135 Å²	135	62.5 Å²	62.5	63%	0.631	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.8	-9.4	175	-67.2	179.5	-146.3	0	0	112.3	K215	K215-E218 HydrophobicContact CB-CB 4.15Å; K215-E218 HydrophobicContact CD-CB 4.33Å; K215-E218 HydrophobicContact CD-CG 4.21Å; K215-E218 VanDerWaalsContact CD-OE1 3.29Å; K215-E218 WeakPolarHBondContact CD-OE1 3.37Å; K215-E218 WeakPolarHBondContact CD-OE2 3.41Å; K215-E218 WeakPolarHBondContact CE-OE2 3.38Å; K215-E218 IonicContact NZ-OE1 2.75Å; K215-E218 PolarHBondContact NZ-OE1 2.91Å; K215-E218 IonicContact NZ-OE2 2.66Å; K215-E218 PolarHBondContact NZ-OE2 3.23Å; K215-E218 PolarHBondContact O-N 3.35Å; K215-E218 VanDerWaalsContact O-N 3.11Å
219	A	75.3	Confident	82.1	Confident	30 Å²	30	58.3 Å²	58.3	25%	0.248	32%	0.324	C	S	.	.	S	Bend	trans	-81.1	148.3	-174.1	0	0	0	0	0	113.9	L213 K215 I224	L213-A219 HydrophobicContact CB-CB 4.26Å; L213-A219 HydrophobicContact CD1-CB 3.48Å; L213-A219 VanDerWaalsContact CD1-CB 3.48Å; K215-A219 PolarHBondContact O-N 3.18Å; A219-I224 HydrophobicContact CB-CD1 4.24Å; A219-I224 HydrophobicContact CB-CG1 4.28Å
220	H	81.1	Confident	82.5	Confident	133 Å²	133	51.7 Å²	51.7	62%	0.616	30%	0.295	S	S	*	.			trans	-75.9	148.6	171.9	-61.3	-71.4	0	0	0	111.6	E222 D223 I224	H220-E222 PolarHBondContact O-N 3.2Å; H220-D223 WeakPolarHBondContact CB-OD2 3.46Å; H220-D223 IonicContact CD2-OD2 3.66Å; H220-D223 IonicContact CG-OD2 3.96Å; H220-D223 PolarHBondContact O-N 3.27Å; H220-D223 VanDerWaalsContact O-N 3.13Å; H220-I224 PolarHBondContact O-N 3.13Å
221	A	84.5	Confident	83.2	Confident	81 Å²	81	50 Å²	50	67%	0.669	28%	0.277	S	S	*	.	H	α-helix	trans	-62.2	-30.5	176.4	0	0	0	0	0	112.6	A225	A221-A225 VanDerWaalsContact O-CB 3.24Å; A221-A225 WeakPolarHBondContact O-CB 3.5Å; A221-A225 PolarHBondContact O-N 2.89Å
222	E	85.3	Confident	83.9	Confident	72 Å²	72	48.6 Å²	48.6	34%	0.336	27%	0.266	S	S	.	.	H	α-helix	trans	-56.4	-51.6	170.4	-73.3	173.8	-149.9	0	0	111.1	F140 R165 H220 I224 A225 S226	F140-E222 HydrophobicContact CD2-CB 3.87Å; F140-E222 HydrophobicContact CD2-CG 4.06Å; F140-E222 HydrophobicContact CE2-CB 3.64Å; F140-E222 HydrophobicContact CE2-CG 4.1Å; F140-E222 VanDerWaalsContact CE2-O 3.3Å; F140-E222 WeakPolarHBondContact CE2-O 3.46Å; F140-E222 HydrophobicContact CZ-CB 4.37Å; R165-E222 IonicContact CZ-OE2 3.02Å; R165-E222 VanDerWaalsContact CZ-OE2 3.27Å; R165-E222 IonicContact NH1-OE2 3.22Å; R165-E222 PolarHBondContact NH1-OE2 3.29Å; R165-E222 IonicContact NH2-OE1 3.38Å; R165-E222 PolarHBondContact NH2-OE1 3.06Å; R165-E222 IonicContact NH2-OE2 3.83Å; R165-E222 PolarHBondContact NH2-OE2 2.87Å; H220-E222 PolarHBondContact O-N 3.2Å; E222-I224 PolarHBondContact O-N 2.64Å; E222-A225 CarbonylContact O-C 3.55Å; E222-A225 PolarHBondContact O-N 3.11Å; E222-A225 VanDerWaalsContact O-N 3.12Å; E222-S226 PolarHBondContact O-N 3.23Å; E222-S226 PolarHBondContact O-OG 2.82Å
223	D	85.6	Confident	84.6	Confident	19 Å²	19	48.6 Å²	48.6	10%	0.102	27%	0.266	C	S	.	.	H	α-helix	trans	-63.2	-42.3	-177	-54.8	-40.3	0	0	0	111.9	Y138 P171 L213 H220 A225 S226 V227	Y138-D223 HydrophobicContact CD1-CB 4.03Å; Y138-D223 HydrophobicContact CE1-CB 4.04Å; P171-D223 HydrophobicContact CB-CB 4.21Å; P171-D223 HydrophobicContact CG-CB 4.07Å; L213-D223 HydrophobicContact CD1-CB 3.56Å; H220-D223 WeakPolarHBondContact CB-OD2 3.46Å; H220-D223 IonicContact CD2-OD2 3.66Å; H220-D223 IonicContact CG-OD2 3.96Å; H220-D223 PolarHBondContact O-N 3.27Å; H220-D223 VanDerWaalsContact O-N 3.13Å; D223-A225 VanDerWaalsContact C-N 3.34Å; D223-S226 PolarHBondContact O-N 3.45Å; D223-V227 WeakPolarHBondContact O-CG2 3.28Å; D223-V227 PolarHBondContact O-N 3.1Å
224	I	87.4	Confident	85.3	Confident	56 Å²	56	48.3 Å²	48.3	29%	0.287	26%	0.264	S	S	.	.	H	α-helix	trans	-62.9	-41.8	175.3	-62.2	173.1	0	0	0	110.5	A212 L213 A219 H220 E222 V227 A228	A212-I224 HydrophobicContact CB-CB 4.5Å; A212-I224 HydrophobicContact CB-CG1 4.32Å; A212-I224 HydrophobicContact CB-CG2 3.97Å; L213-I224 HydrophobicContact CD1-CG1 3.79Å; A219-I224 HydrophobicContact CB-CD1 4.24Å; A219-I224 HydrophobicContact CB-CG1 4.28Å; H220-I224 PolarHBondContact O-N 3.13Å; E222-I224 PolarHBondContact O-N 2.64Å; I224-V227 PolarHBondContact O-N 3.18Å; I224-A228 WeakPolarHBondContact O-CB 3.37Å; I224-A228 PolarHBondContact O-N 3.5Å
225	A	90.8	Very high	86.5	Confident	21 Å²	21	46.2 Å²	46.2	17%	0.174	24%	0.243	C	C	.	.	H	α-helix	trans	-68.1	-36.5	177.9	0	0	0	0	0	112.3	F140 A221 E222 D223 A228 S229 L258	F140-A225 HydrophobicContact CZ-CB 4.26Å; A221-A225 VanDerWaalsContact O-CB 3.24Å; A221-A225 WeakPolarHBondContact O-CB 3.5Å; A221-A225 PolarHBondContact O-N 2.89Å; E222-A225 CarbonylContact O-C 3.55Å; E222-A225 PolarHBondContact O-N 3.11Å; E222-A225 VanDerWaalsContact O-N 3.12Å; D223-A225 VanDerWaalsContact C-N 3.34Å; A225-A228 PolarHBondContact O-N 3.43Å; A225-S229 WeakPolarHBondContact O-CB 3.23Å; A225-S229 PolarHBondContact O-N 2.89Å; A225-L258 HydrophobicContact CB-CB 4.49Å; A225-L258 HydrophobicContact CB-CD2 4.16Å; A225-L258 WeakPolarHBondContact CB-O 3.44Å
226	S	90.8	Very high	87.5	Confident	2 Å²	2	40.4 Å²	40.4	1%	0.014	22%	0.218	C	C	.	.	H	α-helix	trans	-62.3	-46.8	172	-76.6	0	0	0	0	112.3	S137 F140 E222 D223 A228 S229 F230	S137-S226 WeakPolarHBondContact O-CB 3.35Å; S137-S226 PolarHBondContact O-OG 3.03Å; F140-S226 WeakPolarHBondContact CE2-OG 3.35Å; E222-S226 PolarHBondContact O-N 3.23Å; E222-S226 PolarHBondContact O-OG 2.82Å; D223-S226 PolarHBondContact O-N 3.45Å; S226-A228 PolarHBondContact O-N 2.76Å; S226-S229 PolarHBondContact O-N 3.44Å; S226-F230 WeakPolarHBondContact O-CB 3.45Å; S226-F230 PolarHBondContact O-N 2.72Å
227	V	92	Very high	89.2	Confident	0 Å²	0	38 Å²	38	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-62.4	-41.7	175.7	175.2	0	0	0	0	111.3	V136 Y138 I173 L177 L213 D223 I224 I231	V136-V227 HydrophobicContact CG1-CG2 4.2Å; V136-V227 HydrophobicContact CG2-CG2 4.43Å; Y138-V227 HydrophobicContact CE1-CG2 4.1Å; I173-V227 HydrophobicContact CG1-CG2 4.35Å; L177-V227 HydrophobicContact CD2-CG1 3.67Å; L213-V227 HydrophobicContact CD2-CG2 4.18Å; D223-V227 WeakPolarHBondContact O-CG2 3.28Å; D223-V227 PolarHBondContact O-N 3.1Å; I224-V227 PolarHBondContact O-N 3.18Å; V227-I231 HydrophobicContact CG1-CD1 4.4Å; V227-I231 WeakPolarHBondContact O-CG1 3.31Å; V227-I231 PolarHBondContact O-N 3.42Å
228	A	94.5	Very high	90.6	Very high	13 Å²	13	27.9 Å²	27.9	11%	0.107	16%	0.157	C	C	.	.	H	α-helix	trans	-65.5	-45.1	175	0	0	0	0	0	112.1	I224 A225 S226 F230 I231 E232 L258	I224-A228 WeakPolarHBondContact O-CB 3.37Å; I224-A228 PolarHBondContact O-N 3.5Å; A225-A228 PolarHBondContact O-N 3.43Å; S226-A228 PolarHBondContact O-N 2.76Å; A228-F230 VanDerWaalsContact C-N 3.32Å; A228-F230 PolarHBondContact O-N 3.37Å; A228-I231 PolarHBondContact O-N 3.36Å; A228-I231 VanDerWaalsContact O-N 3.08Å; A228-E232 VanDerWaalsContact O-CG 3.27Å; A228-E232 WeakPolarHBondContact O-CG 3.14Å; A228-E232 PolarHBondContact O-N 2.98Å; A228-L258 HydrophobicContact CB-CD1 3.82Å; A228-L258 HydrophobicContact CB-CD2 4.32Å
229	S	95.4	Very high	92	Very high	5 Å²	5	21.6 Å²	21.6	4%	0.035	13%	0.128	C	C	.	.	H	α-helix	trans	-57.1	-42.6	176.2	-176.7	0	0	0	0	112.2	A225 S226 I231 E232 T233 S255 N265	A225-S229 WeakPolarHBondContact O-CB 3.23Å; A225-S229 PolarHBondContact O-N 2.89Å; S226-S229 PolarHBondContact O-N 3.44Å; S229-I231 VanDerWaalsContact C-N 3.32Å; S229-I231 PolarHBondContact O-N 3.24Å; S229-E232 PolarHBondContact O-N 3.11Å; S229-T233 WeakPolarHBondContact O-CB 3.49Å; S229-T233 PolarHBondContact O-N 3.13Å; S229-S255 PolarHBondContact OG-O 3.14Å; S229-N265 PolarHBondContact OG-ND2 3.06Å
230	F	94.6	Very high	93	Very high	14 Å²	14	20.6 Å²	20.6	6%	0.061	12%	0.118	C	C	.	.	H	α-helix	trans	-57.7	-43.2	174.1	-179.5	-99.7	0	0	0	111.9	E133 D135 V136 L181 S226 A228 T233 K234	E133-F230 HydrophobicContact CB-CE2 3.94Å; D135-F230 WeakPolarHBondContact O-CE2 3.43Å; V136-F230 HydrophobicContact CB-CG 4.46Å; V136-F230 HydrophobicContact CG1-CB 4.27Å; V136-F230 HydrophobicContact CG2-CB 3.96Å; V136-F230 HydrophobicContact CG2-CD1 3.83Å; V136-F230 HydrophobicContact CG2-CD2 4.11Å; V136-F230 HydrophobicContact CG2-CE1 4.29Å; V136-F230 HydrophobicContact CG2-CG 3.72Å; L181-F230 HydrophobicContact CD1-CE1 4.47Å; S226-F230 WeakPolarHBondContact O-CB 3.45Å; S226-F230 PolarHBondContact O-N 2.72Å; A228-F230 VanDerWaalsContact C-N 3.32Å; A228-F230 PolarHBondContact O-N 3.37Å; F230-T233 VanDerWaalsContact O-CG2 3.3Å; F230-T233 WeakPolarHBondContact O-CG2 3.29Å; F230-T233 PolarHBondContact O-N 2.75Å; F230-K234 HydrophobicContact CD1-CG 4.36Å; F230-K234 HydrophobicContact CE1-CG 4.16Å; F230-K234 HydrophobicContact CZ-CD 4.48Å; F230-K234 HydrophobicContact CZ-CG 4.33Å; F230-K234 WeakPolarHBondContact O-CB 3.27Å; F230-K234 WeakPolarHBondContact O-CG 3.39Å; F230-K234 PolarHBondContact O-N 2.92Å
231	I	95.8	Very high	93.8	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-71.2	-42.4	-179.8	-61.6	165.8	0	0	0	111.4	L177 L181 F200 A203 L204 C207 V227 A228 S229 T233 K234 L235	L177-I231 HydrophobicContact CD1-CD1 4.09Å; L181-I231 HydrophobicContact CD2-CD1 4.01Å; L181-I231 HydrophobicContact CD2-CG1 3.66Å; F200-I231 HydrophobicContact CB-CG2 4.23Å; F200-I231 WeakPolarHBondContact O-CG2 3.28Å; A203-I231 HydrophobicContact CB-CD1 4.07Å; A203-I231 HydrophobicContact CB-CG2 4.39Å; L204-I231 HydrophobicContact CB-CG2 3.75Å; L204-I231 HydrophobicContact CD1-CB 4.34Å; L204-I231 HydrophobicContact CD1-CG2 4.21Å; L204-I231 HydrophobicContact CG-CG2 4.49Å; C207-I231 WeakPolarHBondContact SG-CD1 3.38Å; V227-I231 HydrophobicContact CG1-CD1 4.4Å; V227-I231 WeakPolarHBondContact O-CG1 3.31Å; V227-I231 PolarHBondContact O-N 3.42Å; A228-I231 PolarHBondContact O-N 3.36Å; A228-I231 VanDerWaalsContact O-N 3.08Å; S229-I231 VanDerWaalsContact C-N 3.32Å; S229-I231 PolarHBondContact O-N 3.24Å; I231-T233 VanDerWaalsContact C-N 3.34Å; I231-T233 PolarHBondContact O-N 3.31Å; I231-K234 PolarHBondContact O-N 2.85Å; I231-L235 HydrophobicContact CG2-CD1 4.36Å; I231-L235 WeakPolarHBondContact O-CG 3.35Å; I231-L235 PolarHBondContact O-N 3.25Å
232	E	97.3	Very high	94.4	Very high	1 Å²	1	16.5 Å²	16.5	1%	0.005	8%	0.083	C	C	.	.	H	α-helix	trans	-59.1	-44	174.4	-63.3	-79.2	-176.1	0	0	111.3	L204 A228 S229 L235 V236 H251 R254 L258	L204-E232 HydrophobicContact CD1-CG 4.2Å; L204-E232 WeakPolarHBondContact CD2-OE1 3.23Å; A228-E232 VanDerWaalsContact O-CG 3.27Å; A228-E232 WeakPolarHBondContact O-CG 3.14Å; A228-E232 PolarHBondContact O-N 2.98Å; S229-E232 PolarHBondContact O-N 3.11Å; E232-L235 WeakPolarHBondContact O-CB 3.1Å; E232-L235 PolarHBondContact O-N 3.16Å; E232-V236 WeakPolarHBondContact O-CG2 3.43Å; E232-V236 PolarHBondContact O-N 3.06Å; E232-H251 IonicContact OE2-CE1 3.55Å; E232-H251 IonicContact OE2-CG 2.77Å; E232-H251 IonicContact OE2-ND1 3.37Å; E232-H251 PolarHBondContact OE2-ND1 3.16Å; E232-R254 HydrophobicContact CG-CB 4.21Å; E232-R254 IonicContact OE1-CZ 2.68Å; E232-R254 IonicContact OE1-NE 2.84Å; E232-R254 PolarHBondContact OE1-NE 3.31Å; E232-R254 IonicContact OE1-NH2 2.74Å; E232-R254 PolarHBondContact OE1-NH2 3.04Å; E232-R254 IonicContact OE2-NE 3.27Å; E232-R254 PolarHBondContact OE2-NE 3.01Å; E232-L258 HydrophobicContact CG-CD1 3.91Å
233	T	95.8	Very high	94.9	Very high	2 Å²	2	24 Å²	24	1%	0.012	11%	0.108	C	C	.	.	H	α-helix	trans	-71.6	-31.6	-179.5	-150.1	0	0	0	0	112.4	S229 F230 I231 V236 T237 N265 R268	S229-T233 WeakPolarHBondContact O-CB 3.49Å; S229-T233 PolarHBondContact O-N 3.13Å; F230-T233 VanDerWaalsContact O-CG2 3.3Å; F230-T233 WeakPolarHBondContact O-CG2 3.29Å; F230-T233 PolarHBondContact O-N 2.75Å; I231-T233 VanDerWaalsContact C-N 3.34Å; I231-T233 PolarHBondContact O-N 3.31Å; T233-V236 WeakPolarHBondContact O-CB 3.43Å; T233-V236 PolarHBondContact O-N 2.93Å; T233-T237 PolarHBondContact O-N 3.26Å; T233-N265 WeakPolarHBondContact CB-OD1 3.21Å; T233-N265 PolarHBondContact OG1-OD1 3.19Å; T233-R268 WeakPolarHBondContact OG1-CD 3.38Å; T233-R268 PolarHBondContact OG1-NH1 3.36Å; T233-R268 VanDerWaalsContact OG1-NH1 3.15Å
234	K	96.6	Very high	95.5	Very high	0 Å²	0	28 Å²	28	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-67.2	-36.1	168.1	-70.8	-69.1	-173.2	-173.7	0	112.9	D132 E133 F200 F230 I231 T237 C238	D132-K234 IonicContact OD1-NZ 2.72Å; D132-K234 PolarHBondContact OD1-NZ 3.21Å; E133-K234 WeakPolarHBondContact O-CE 3.34Å; E133-K234 PolarHBondContact O-NZ 3.13Å; F200-K234 HydrophobicContact CD1-CB 3.95Å; F200-K234 HydrophobicContact CD1-CG 4.43Å; F200-K234 HydrophobicContact CD2-CB 3.97Å; F200-K234 HydrophobicContact CE1-CB 3.79Å; F200-K234 HydrophobicContact CE1-CD 4.4Å; F200-K234 HydrophobicContact CE1-CG 3.85Å; F200-K234 HydrophobicContact CE2-CB 3.82Å; F200-K234 HydrophobicContact CE2-CD 4.47Å; F200-K234 HydrophobicContact CE2-CG 4.4Å; F200-K234 HydrophobicContact CG-CB 4.07Å; F200-K234 HydrophobicContact CZ-CB 3.74Å; F200-K234 HydrophobicContact CZ-CD 3.94Å; F200-K234 HydrophobicContact CZ-CG 3.85Å; F230-K234 HydrophobicContact CD1-CG 4.36Å; F230-K234 HydrophobicContact CE1-CG 4.16Å; F230-K234 HydrophobicContact CZ-CD 4.48Å; F230-K234 HydrophobicContact CZ-CG 4.33Å; F230-K234 WeakPolarHBondContact O-CB 3.27Å; F230-K234 WeakPolarHBondContact O-CG 3.39Å; F230-K234 PolarHBondContact O-N 2.92Å; I231-K234 PolarHBondContact O-N 2.85Å; K234-T237 PolarHBondContact O-N 3.29Å; K234-T237 PolarHBondContact O-OG1 2.79Å; K234-C238 PolarHBondContact O-N 3.44Å; K234-C238 VanDerWaalsContact O-N 3.11Å; K234-C238 PolarHBondContact O-SG 3.45Å
235	L	97.5	Very high	96	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-63.3	-42.6	172.7	-75.6	168.8	0	0	0	111	A197 F200 R201 L204 I231 E232 T237 C238 Y239 H251	A197-L235 HydrophobicContact CB-CD2 4.32Å; A197-L235 WeakPolarHBondContact O-CD2 3.19Å; F200-L235 HydrophobicContact CB-CD2 3.6Å; F200-L235 HydrophobicContact CB-CG 3.82Å; R201-L235 HydrophobicContact CG-CD1 4.46Å; R201-L235 HydrophobicContact CG-CD2 4.02Å; L204-L235 HydrophobicContact CD2-CD1 4Å; I231-L235 HydrophobicContact CG2-CD1 4.36Å; I231-L235 WeakPolarHBondContact O-CG 3.35Å; I231-L235 PolarHBondContact O-N 3.25Å; E232-L235 WeakPolarHBondContact O-CB 3.1Å; E232-L235 PolarHBondContact O-N 3.16Å; L235-T237 PolarHBondContact O-N 2.98Å; L235-C238 PolarHBondContact O-N 2.98Å; L235-Y239 HydrophobicContact CB-CD2 4.48Å; L235-Y239 HydrophobicContact CB-CE2 3.93Å; L235-Y239 HydrophobicContact CD2-CE2 4.24Å; L235-Y239 WeakPolarHBondContact O-CD2 3.44Å; L235-Y239 PolarHBondContact O-N 3Å; L235-H251 HydrophobicContact CB-CB 4.39Å
236	V	98	Very high	96.2	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-55.8	-50.4	174.5	174.8	0	0	0	0	112	E232 T233 C238 Y239 L240 A248 H251 A252 R268 V272	E232-V236 WeakPolarHBondContact O-CG2 3.43Å; E232-V236 PolarHBondContact O-N 3.06Å; T233-V236 WeakPolarHBondContact O-CB 3.43Å; T233-V236 PolarHBondContact O-N 2.93Å; V236-C238 VanDerWaalsContact C-N 3.33Å; V236-C238 PolarHBondContact O-N 3.23Å; V236-Y239 PolarHBondContact O-N 3.26Å; V236-L240 HydrophobicContact CG1-CD1 3.82Å; V236-L240 HydrophobicContact CG1-CG 4.32Å; V236-L240 WeakPolarHBondContact O-CB 3.34Å; V236-L240 WeakPolarHBondContact O-CG 3.49Å; V236-L240 PolarHBondContact O-N 3.43Å; V236-A248 HydrophobicContact CG1-CB 4.32Å; V236-H251 HydrophobicContact CG2-CB 3.74Å; V236-A252 HydrophobicContact CG1-CB 4.36Å; V236-A252 HydrophobicContact CG2-CB 3.7Å; V236-A252 VanDerWaalsContact CG2-N 3.28Å; V236-R268 HydrophobicContact CG1-CB 3.95Å; V236-V272 HydrophobicContact CG1-CG2 3.79Å
237	T	97.2	Very high	96.4	Very high	1 Å²	1	33.9 Å²	33.9	1%	0.006	15%	0.154	C	C	.	.	H	α-helix	trans	-64.3	-37.6	-179.8	61.1	0	0	0	0	112	V129 T233 K234 L235 R241 R268	V129-T237 VanDerWaalsContact O-CG2 3.31Å; V129-T237 WeakPolarHBondContact O-CG2 3.49Å; T233-T237 PolarHBondContact O-N 3.26Å; K234-T237 PolarHBondContact O-N 3.29Å; K234-T237 PolarHBondContact O-OG1 2.79Å; L235-T237 PolarHBondContact O-N 2.98Å; T237-R241 WeakPolarHBondContact O-CB 3.49Å; T237-R241 VanDerWaalsContact O-CG 3.23Å; T237-R241 WeakPolarHBondContact O-CG 3.48Å; T237-R241 PolarHBondContact O-N 3.08Å; T237-R268 HydrophobicContact CG2-CG 4.42Å; T237-R268 VanDerWaalsContact CG2-NE 3.34Å
238	C	97.6	Very high	96.7	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-60.6	-49.3	174.3	-66.9	0	0	0	0	112.3	A197 K234 L235 V236 R241 M242	A197-C238 HydrophobicContact CB-CB 3.92Å; K234-C238 PolarHBondContact O-N 3.44Å; K234-C238 VanDerWaalsContact O-N 3.11Å; K234-C238 PolarHBondContact O-SG 3.45Å; L235-C238 PolarHBondContact O-N 2.98Å; V236-C238 VanDerWaalsContact C-N 3.33Å; V236-C238 PolarHBondContact O-N 3.23Å; C238-R241 PolarHBondContact O-N 2.64Å; C238-M242 VanDerWaalsContact O-CG 3.24Å; C238-M242 WeakPolarHBondContact O-CG 3.46Å; C238-M242 PolarHBondContact O-N 3.17Å
239	Y	98.4	Very high	96.8	Very high	4 Å²	4	33.3 Å²	33.3	2%	0.016	15%	0.149	C	C	.	.	H	α-helix	trans	-69.9	-35.2	-179.4	-61	-57.2	0	0	0	113.3	A197 R201 L235 V236 M242 R243 K244 L247 A248 H251	A197-Y239 HydrophobicContact CB-CE1 4.12Å; R201-Y239 VanDerWaalsContact CZ-OH 3.31Å; R201-Y239 PolarHBondContact NE-OH 3.21Å; R201-Y239 PolarHBondContact NH2-OH 3.01Å; L235-Y239 HydrophobicContact CB-CD2 4.48Å; L235-Y239 HydrophobicContact CB-CE2 3.93Å; L235-Y239 HydrophobicContact CD2-CE2 4.24Å; L235-Y239 WeakPolarHBondContact O-CD2 3.44Å; L235-Y239 PolarHBondContact O-N 3Å; V236-Y239 PolarHBondContact O-N 3.26Å; Y239-M242 HydrophobicContact CD1-SD 4.37Å; Y239-M242 CarbonylContact O-C 3.42Å; Y239-M242 WeakPolarHBondContact O-CA 3.35Å; Y239-M242 PolarHBondContact O-N 3.4Å; Y239-M242 VanDerWaalsContact O-N 3.15Å; Y239-R243 PolarHBondContact O-N 3.42Å; Y239-R243 VanDerWaalsContact O-N 3.07Å; Y239-K244 PolarHBondContact O-N 3.21Å; Y239-L247 HydrophobicContact CD1-CB 3.85Å; Y239-L247 HydrophobicContact CD1-CD1 3.91Å; Y239-L247 HydrophobicContact CD2-CB 4.11Å; Y239-L247 HydrophobicContact CE1-CB 4.12Å; Y239-L247 HydrophobicContact CE1-CD1 3.95Å; Y239-L247 HydrophobicContact CE2-CB 4.39Å; Y239-L247 HydrophobicContact CG-CB 3.84Å; Y239-A248 HydrophobicContact CD2-CB 4.42Å; Y239-H251 AromaticContact CD2-CD2 3.99Å; Y239-H251 AromaticContact CE2-CD2 3.31Å; Y239-H251 WeakPolarHBondContact CE2-CD2 3.31Å; Y239-H251 AromaticContact CE2-NE2 3.52Å; Y239-H251 AromaticContact CZ-NE2 4Å
240	L	97.4	Very high	96.8	Very high	9 Å²	9	35.5 Å²	35.5	5%	0.047	16%	0.161	C	C	.	.	H	α-helix	trans	-61.4	-45.5	171.8	-76	174.9	0	0	0	111	V129 Y130 V236 M242 R243 A248 A271 V272 C275	V129-L240 HydrophobicContact CG1-CD1 4.11Å; Y130-L240 HydrophobicContact CE1-CB 3.64Å; Y130-L240 HydrophobicContact CE1-CD1 4.43Å; V236-L240 HydrophobicContact CG1-CD1 3.82Å; V236-L240 HydrophobicContact CG1-CG 4.32Å; V236-L240 WeakPolarHBondContact O-CB 3.34Å; V236-L240 WeakPolarHBondContact O-CG 3.49Å; V236-L240 PolarHBondContact O-N 3.43Å; L240-M242 PolarHBondContact O-N 3.41Å; L240-R243 PolarHBondContact O-N 3.19Å; L240-A248 HydrophobicContact CG-CB 4.41Å; L240-A271 HydrophobicContact CD1-CB 3.96Å; L240-V272 HydrophobicContact CD1-CG2 4.06Å; L240-V272 HydrophobicContact CD2-CG2 3.91Å; L240-V272 HydrophobicContact CG-CG2 4.09Å; L240-C275 HydrophobicContact CD2-CB 4.38Å
241	R	96.7	Very high	97	Very high	73 Å²	73	36.3 Å²	36.3	28%	0.275	17%	0.165	S	C	.	.	H	α-helix	trans	-59.2	-32.8	171.9	-72.5	-66.5	-166.6	-160.8	8	112.8	M126 Y130 Y188 Y193 T237 C238 R243	M126-R241 PolarHBondContact SD-NH1 3Å; M126-R241 PolarHBondContact SD-NH2 2.97Å; M126-R241 VanDerWaalsContact SD-NH2 3.39Å; Y130-R241 VanDerWaalsContact CB-NH2 3.26Å; Y130-R241 HydrophobicContact CD1-CG 3.88Å; Y130-R241 HydrophobicContact CE1-CG 4.01Å; Y130-R241 VanDerWaalsContact CG-CZ 3.48Å; Y188-R241 HydrophobicContact CE2-CG 4.03Å; Y193-R241 HydrophobicContact CD1-CB 3.85Å; Y193-R241 HydrophobicContact CD1-CG 4.07Å; Y193-R241 HydrophobicContact CD2-CB 3.66Å; Y193-R241 HydrophobicContact CD2-CG 4.46Å; Y193-R241 HydrophobicContact CE1-CB 3.99Å; Y193-R241 HydrophobicContact CE1-CG 3.79Å; Y193-R241 HydrophobicContact CE2-CB 3.79Å; Y193-R241 HydrophobicContact CE2-CG 4.2Å; Y193-R241 HydrophobicContact CG-CB 3.69Å; Y193-R241 HydrophobicContact CG-CG 4.4Å; T237-R241 WeakPolarHBondContact O-CB 3.49Å; T237-R241 VanDerWaalsContact O-CG 3.23Å; T237-R241 WeakPolarHBondContact O-CG 3.48Å; T237-R241 PolarHBondContact O-N 3.08Å; C238-R241 PolarHBondContact O-N 2.64Å; R241-R243 VanDerWaalsContact C-N 3.31Å
242	M	97.3	Very high	97.1	Very high	55 Å²	55	36.3 Å²	36.3	27%	0.271	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.5	0.4	174.4	-66.1	169.3	67.1	0	0	114.6	A194 A197 C238 Y239 L240 K244	A194-M242 HydrophobicContact CB-CE 3.78Å; A194-M242 HydrophobicContact CB-SD 4.2Å; A197-M242 HydrophobicContact CB-SD 4.5Å; C238-M242 VanDerWaalsContact O-CG 3.24Å; C238-M242 WeakPolarHBondContact O-CG 3.46Å; C238-M242 PolarHBondContact O-N 3.17Å; Y239-M242 HydrophobicContact CD1-SD 4.37Å; Y239-M242 CarbonylContact O-C 3.42Å; Y239-M242 WeakPolarHBondContact O-CA 3.35Å; Y239-M242 PolarHBondContact O-N 3.4Å; Y239-M242 VanDerWaalsContact O-N 3.15Å; L240-M242 PolarHBondContact O-N 3.41Å; M242-K244 HydrophobicContact CB-CG 4.36Å; M242-K244 HydrophobicContact CE-CD 4.44Å; M242-K244 PolarHBondContact O-N 2.98Å
243	R	96.9	Very high	97.1	Very high	228 Å²	228	36.2 Å²	36.2	86%	0.86	16%	0.164	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.5	42.2	-172.4	-54.8	-176.9	-179.3	-176.1	-0.3	113.8	Y239 L240 R241 P245	Y239-R243 PolarHBondContact O-N 3.42Å; Y239-R243 VanDerWaalsContact O-N 3.07Å; L240-R243 PolarHBondContact O-N 3.19Å; R241-R243 VanDerWaalsContact C-N 3.31Å; R243-P245 VanDerWaalsContact C-CD 3.45Å; R243-P245 WeakPolarHBondContact O-CD 3.45Å
244	K	97.6	Very high	97.1	Very high	103 Å²	103	41.3 Å²	41.3	45%	0.448	18%	0.183	S	C	.	.			trans	-121.9	64.5	177.8	-61.5	-168.2	180	-171.6	0	111.9	Y239 M242 D246 L247 A248	Y239-K244 PolarHBondContact O-N 3.21Å; M242-K244 HydrophobicContact CB-CG 4.36Å; M242-K244 HydrophobicContact CE-CD 4.44Å; M242-K244 PolarHBondContact O-N 2.98Å; K244-D246 PolarHBondContact O-N 3.08Å; K244-L247 HydrophobicContact CB-CB 4.37Å; K244-L247 HydrophobicContact CB-CD1 4Å; K244-L247 HydrophobicContact CB-CG 4.18Å; K244-L247 HydrophobicContact CD-CD1 3.76Å; K244-L247 PolarHBondContact O-N 3.13Å; K244-L247 VanDerWaalsContact O-N 3.13Å; K244-A248 PolarHBondContact O-N 2.68Å
245	P	97	Very high	97.1	Very high	17 Å²	17	41.3 Å²	41.3	11%	0.11	18%	0.183	C	C	.	.	H	α-helix	trans	-61.6	-29.5	-174.3	27.9	-36	0	0	0	113.5	R243 L247 A248 L249 V272 C275 L276	R243-P245 VanDerWaalsContact C-CD 3.45Å; R243-P245 WeakPolarHBondContact O-CD 3.45Å; P245-L247 VanDerWaalsContact C-N 3.28Å; P245-L247 PolarHBondContact O-N 2.98Å; P245-A248 WeakPolarHBondContact O-CA 3.26Å; P245-A248 WeakPolarHBondContact O-CB 3.42Å; P245-A248 PolarHBondContact O-N 2.87Å; P245-L249 PolarHBondContact O-N 3.07Å; P245-V272 HydrophobicContact CB-CG1 4.13Å; P245-V272 WeakPolarHBondContact O-CG1 3.28Å; P245-C275 HydrophobicContact CB-CB 3.76Å; P245-C275 HydrophobicContact CG-CB 4.07Å; P245-L276 HydrophobicContact CB-CD2 3.87Å; P245-L276 HydrophobicContact CB-CG 3.97Å; P245-L276 HydrophobicContact CG-CD2 3.7Å; P245-L276 HydrophobicContact CG-CG 4.27Å
246	D	95.6	Very high	97.1	Very high	108 Å²	108	41.3 Å²	41.3	58%	0.578	18%	0.184	S	C	*	.	H	α-helix	trans	-62.2	-35	176.7	-43.9	-93.7	0	0	0	112.6	K244	K244-D246 PolarHBondContact O-N 3.08Å
247	L	95.5	Very high	97	Very high	78 Å²	78	43.7 Å²	43.7	41%	0.408	20%	0.198	S	C	.	.	H	α-helix	trans	-73.3	-39.9	172.6	-60.7	-176.6	0	0	0	110.6	Y239 K244 P245 L249 H251	Y239-L247 HydrophobicContact CD1-CB 3.85Å; Y239-L247 HydrophobicContact CD1-CD1 3.91Å; Y239-L247 HydrophobicContact CD2-CB 4.11Å; Y239-L247 HydrophobicContact CE1-CB 4.12Å; Y239-L247 HydrophobicContact CE1-CD1 3.95Å; Y239-L247 HydrophobicContact CE2-CB 4.39Å; Y239-L247 HydrophobicContact CG-CB 3.84Å; K244-L247 HydrophobicContact CB-CB 4.37Å; K244-L247 HydrophobicContact CB-CD1 4Å; K244-L247 HydrophobicContact CB-CG 4.18Å; K244-L247 HydrophobicContact CD-CD1 3.76Å; K244-L247 PolarHBondContact O-N 3.13Å; K244-L247 VanDerWaalsContact O-N 3.13Å; P245-L247 VanDerWaalsContact C-N 3.28Å; P245-L247 PolarHBondContact O-N 2.98Å; L247-L249 VanDerWaalsContact C-N 3.32Å; L247-L249 PolarHBondContact O-N 3.42Å; L247-H251 PolarHBondContact O-CD2 3.36Å
248	A	97.7	Very high	96.8	Very high	0 Å²	0	46 Å²	46	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-63.1	-35.5	179.6	0	0	0	0	0	113.1	V236 Y239 L240 K244 P245 N250 H251 A252 V272	V236-A248 HydrophobicContact CG1-CB 4.32Å; Y239-A248 HydrophobicContact CD2-CB 4.42Å; L240-A248 HydrophobicContact CG-CB 4.41Å; K244-A248 PolarHBondContact O-N 2.68Å; P245-A248 WeakPolarHBondContact O-CA 3.26Å; P245-A248 WeakPolarHBondContact O-CB 3.42Å; P245-A248 PolarHBondContact O-N 2.87Å; A248-N250 PolarHBondContact O-N 2.98Å; A248-H251 PolarHBondContact O-N 2.85Å; A248-H251 VanDerWaalsContact O-N 3.13Å; A248-A252 PolarHBondContact O-N 3.11Å; A248-V272 HydrophobicContact CB-CG1 4.22Å; A248-V272 HydrophobicContact CB-CG2 3.57Å
249	L	97.1	Very high	96.7	Very high	1 Å²	1	46.1 Å²	46.1	1%	0.005	21%	0.21	C	C	.	.	H	α-helix	trans	-56.6	-49.5	-168.4	-176.5	64	0	0	0	114.2	P245 L247 H251 A252 H253 V272 F273 L276 Q478	P245-L249 PolarHBondContact O-N 3.07Å; L247-L249 VanDerWaalsContact C-N 3.32Å; L247-L249 PolarHBondContact O-N 3.42Å; L249-H251 VanDerWaalsContact C-N 3.32Å; L249-H251 PolarHBondContact O-N 2.91Å; L249-A252 PolarHBondContact O-N 3.21Å; L249-H253 VanDerWaalsContact CD1-NE2 3.3Å; L249-H253 WeakPolarHBondContact CD1-NE2 3.32Å; L249-H253 WeakPolarHBondContact CG-NE2 3.45Å; L249-H253 PolarHBondContact O-CD2 3.39Å; L249-H253 PolarHBondContact O-N 3.46Å; L249-V272 HydrophobicContact CB-CG1 3.9Å; L249-V272 HydrophobicContact CD1-CG1 3.9Å; L249-F273 HydrophobicContact CD1-CD1 4.06Å; L249-F273 HydrophobicContact CD1-CE1 3.74Å; L249-L276 HydrophobicContact CD1-CD1 4.21Å; L249-L276 HydrophobicContact CD2-CD1 3.92Å; L249-L276 HydrophobicContact CG-CD1 4.45Å; L249-Q478 VanDerWaalsContact CD2-CD 3.41Å; L249-Q478 HydrophobicContact CD2-CG 3.67Å; L249-Q478 HydrophobicContact CG-CG 4.49Å
250	N	95.6	Very high	96.4	Very high	51 Å²	51	46.3 Å²	46.3	27%	0.273	21%	0.212	S	C	.	.	H	α-helix	trans	-67.7	-33.2	180	-71.5	-59.2	0	0	0	112.4	A248 H253 R254 N481	A248-N250 PolarHBondContact O-N 2.98Å; N250-H253 PolarHBondContact O-N 2.77Å; N250-R254 WeakPolarHBondContact O-CB 3.45Å; N250-R254 WeakPolarHBondContact O-CD 3.44Å; N250-R254 VanDerWaalsContact O-CG 3.23Å; N250-R254 WeakPolarHBondContact O-CG 3.28Å; N250-R254 PolarHBondContact O-N 3.05Å; N250-N481 PolarHBondContact OD1-ND2 2.81Å
251	H	97.5	Very high	96.2	Very high	31 Å²	31	45.9 Å²	45.9	14%	0.144	21%	0.21	C	C	.	.	H	α-helix	trans	-68.9	-36.6	173.5	-65.3	-69.8	0	0	0	111.8	E232 L235 V236 Y239 L247 A248 L249 R254 S255	E232-H251 IonicContact OE2-CE1 3.55Å; E232-H251 IonicContact OE2-CG 2.77Å; E232-H251 IonicContact OE2-ND1 3.37Å; E232-H251 PolarHBondContact OE2-ND1 3.16Å; L235-H251 HydrophobicContact CB-CB 4.39Å; V236-H251 HydrophobicContact CG2-CB 3.74Å; Y239-H251 AromaticContact CD2-CD2 3.99Å; Y239-H251 AromaticContact CE2-CD2 3.31Å; Y239-H251 WeakPolarHBondContact CE2-CD2 3.31Å; Y239-H251 AromaticContact CE2-NE2 3.52Å; Y239-H251 AromaticContact CZ-NE2 4Å; L247-H251 PolarHBondContact O-CD2 3.36Å; A248-H251 PolarHBondContact O-N 2.85Å; A248-H251 VanDerWaalsContact O-N 3.13Å; L249-H251 VanDerWaalsContact C-N 3.32Å; L249-H251 PolarHBondContact O-N 2.91Å; H251-R254 PolarHBondContact O-N 3.5Å; H251-S255 PolarHBondContact O-N 3.39Å; H251-S255 PolarHBondContact O-OG 2.97Å
252	A	98.2	Very high	96	Very high	0 Å²	0	44 Å²	44	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-69.2	-31.2	175.9	0	0	0	0	0	113.1	V236 A248 L249 S255 I256 Q269 V272	V236-A252 HydrophobicContact CG1-CB 4.36Å; V236-A252 HydrophobicContact CG2-CB 3.7Å; V236-A252 VanDerWaalsContact CG2-N 3.28Å; A248-A252 PolarHBondContact O-N 3.11Å; L249-A252 PolarHBondContact O-N 3.21Å; A252-S255 PolarHBondContact O-OG 3.02Å; A252-I256 WeakPolarHBondContact O-CD1 3.31Å; A252-Q269 HydrophobicContact CB-CB 4.12Å; A252-Q269 HydrophobicContact CB-CG 4.37Å; A252-V272 HydrophobicContact CB-CG2 4.26Å
253	H	97.7	Very high	95.8	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-70.6	-45.3	168.7	-62.2	-42.3	0	0	0	111.3	L249 N250 S255 I256 V257 Q269 F273 N481 Q482 A485	L249-H253 VanDerWaalsContact CD1-NE2 3.3Å; L249-H253 WeakPolarHBondContact CD1-NE2 3.32Å; L249-H253 WeakPolarHBondContact CG-NE2 3.45Å; L249-H253 PolarHBondContact O-CD2 3.39Å; L249-H253 PolarHBondContact O-N 3.46Å; N250-H253 PolarHBondContact O-N 2.77Å; H253-S255 PolarHBondContact O-N 3.04Å; H253-I256 PolarHBondContact O-N 3.1Å; H253-V257 WeakPolarHBondContact O-CG2 3.32Å; H253-V257 PolarHBondContact O-N 2.88Å; H253-Q269 PolarHBondContact ND1-NE2 3.48Å; H253-F273 AromaticContact CE1-CZ 3.85Å; H253-N481 HydrophobicContact CB-CB 3.95Å; H253-Q482 VanDerWaalsContact CE1-CB 3.5Å; H253-Q482 WeakPolarHBondContact CE1-CB 3.36Å; H253-A485 HydrophobicContact CB-CB 4.22Å
254	R	96.4	Very high	95.7	Very high	108 Å²	108	33.9 Å²	33.9	41%	0.408	16%	0.163	S	C	.	.	H	α-helix	trans	-62.8	-40.4	-179.6	-74.5	162.3	60	111.4	2.6	112.9	E232 N250 H251 I256 V257 L258	E232-R254 HydrophobicContact CG-CB 4.21Å; E232-R254 IonicContact OE1-CZ 2.68Å; E232-R254 IonicContact OE1-NE 2.84Å; E232-R254 PolarHBondContact OE1-NE 3.31Å; E232-R254 IonicContact OE1-NH2 2.74Å; E232-R254 PolarHBondContact OE1-NH2 3.04Å; E232-R254 IonicContact OE2-NE 3.27Å; E232-R254 PolarHBondContact OE2-NE 3.01Å; N250-R254 WeakPolarHBondContact O-CB 3.45Å; N250-R254 WeakPolarHBondContact O-CD 3.44Å; N250-R254 VanDerWaalsContact O-CG 3.23Å; N250-R254 WeakPolarHBondContact O-CG 3.28Å; N250-R254 PolarHBondContact O-N 3.05Å; H251-R254 PolarHBondContact O-N 3.5Å; R254-I256 VanDerWaalsContact C-N 3.32Å; R254-I256 PolarHBondContact O-N 3.41Å; R254-V257 PolarHBondContact O-N 3.06Å; R254-L258 WeakPolarHBondContact O-CB 3.38Å; R254-L258 WeakPolarHBondContact O-CD1 3.39Å; R254-L258 VanDerWaalsContact O-CG 3.31Å; R254-L258 WeakPolarHBondContact O-CG 3.33Å; R254-L258 PolarHBondContact O-N 3.33Å
255	S	96.9	Very high	95.7	Very high	0 Å²	0	29 Å²	29	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-62.4	-37.1	176.6	65.7	0	0	0	0	112.7	S229 H251 A252 H253 L258 N259 N265	S229-S255 PolarHBondContact OG-O 3.14Å; H251-S255 PolarHBondContact O-N 3.39Å; H251-S255 PolarHBondContact O-OG 2.97Å; A252-S255 PolarHBondContact O-OG 3.02Å; H253-S255 PolarHBondContact O-N 3.04Å; S255-L258 PolarHBondContact O-N 3.08Å; S255-N259 PolarHBondContact O-N 3.3Å; S255-N265 PolarHBondContact O-ND2 2.92Å; S255-N265 VanDerWaalsContact O-ND2 3.14Å
256	I	97	Very high	95.7	Very high	1 Å²	1	28.2 Å²	28.2	1%	0.005	14%	0.136	C	C	.	.	H	α-helix	trans	-70.9	-38.7	174.6	-67.2	165.7	0	0	0	111.7	A252 H253 R254 L258 N259 P260 N265 H266 Q269 A485	A252-I256 WeakPolarHBondContact O-CD1 3.31Å; H253-I256 PolarHBondContact O-N 3.1Å; R254-I256 VanDerWaalsContact C-N 3.32Å; R254-I256 PolarHBondContact O-N 3.41Å; I256-L258 PolarHBondContact O-N 2.9Å; I256-N259 CarbonylContact O-C 3.54Å; I256-N259 VanDerWaalsContact O-C 3.29Å; I256-P260 HydrophobicContact CG2-CB 4.31Å; I256-P260 WeakPolarHBondContact O-CA 3.2Å; I256-P260 VanDerWaalsContact O-CB 3.25Å; I256-P260 WeakPolarHBondContact O-CB 3.43Å; I256-P260 VanDerWaalsContact O-CD 3.29Å; I256-P260 WeakPolarHBondContact O-CD 3.06Å; I256-N265 HydrophobicContact CG1-CB 3.68Å; I256-H266 WeakPolarHBondContact CD1-ND1 3.31Å; I256-Q269 HydrophobicContact CD1-CB 3.89Å; I256-Q269 HydrophobicContact CD1-CG 4.27Å; I256-A485 HydrophobicContact CB-CB 4.05Å; I256-A485 HydrophobicContact CG2-CB 3.86Å
257	V	95.3	Very high	95.8	Very high	49 Å²	49	23.1 Å²	23.1	30%	0.297	11%	0.109	S	C	.	.	H	α-helix	trans	-63	-32.1	174.4	174.2	0	0	0	0	111.7	H253 R254 M484 A485	H253-V257 WeakPolarHBondContact O-CG2 3.32Å; H253-V257 PolarHBondContact O-N 2.88Å; R254-V257 PolarHBondContact O-N 3.06Å; V257-M484 HydrophobicContact CG1-CE 4.27Å; V257-M484 HydrophobicContact CG2-CB 3.73Å; V257-A485 HydrophobicContact CG2-CB 4.19Å
258	L	94.3	Very high	95.9	Very high	50 Å²	50	19.4 Å²	19.4	26%	0.262	9%	0.089	S	C	.	.	H	α-helix	trans	-87.1	-39.1	-178.5	-70.1	163.7	0	0	0	113.7	F140 A225 A228 E232 R254 S255 I256	F140-L258 WeakPolarHBondContact CE1-O 3.45Å; F140-L258 WeakPolarHBondContact CZ-O 3.44Å; A225-L258 HydrophobicContact CB-CB 4.49Å; A225-L258 HydrophobicContact CB-CD2 4.16Å; A225-L258 WeakPolarHBondContact CB-O 3.44Å; A228-L258 HydrophobicContact CB-CD1 3.82Å; A228-L258 HydrophobicContact CB-CD2 4.32Å; E232-L258 HydrophobicContact CG-CD1 3.91Å; R254-L258 WeakPolarHBondContact O-CB 3.38Å; R254-L258 WeakPolarHBondContact O-CD1 3.39Å; R254-L258 VanDerWaalsContact O-CG 3.31Å; R254-L258 WeakPolarHBondContact O-CG 3.33Å; R254-L258 PolarHBondContact O-N 3.33Å; S255-L258 PolarHBondContact O-N 3.08Å; I256-L258 PolarHBondContact O-N 2.9Å
259	N	93.9	Very high	95.9	Very high	2 Å²	2	19.9 Å²	19.9	1%	0.011	9%	0.092	C	C	.	.			trans	-138.5	98.9	165.1	-172.5	-32.5	0	0	0	109.7	E139 F140 S255 I256 A261 Y262 N265	E139-N259 PolarHBondContact O-ND2 3.4Å; F140-N259 HydrophobicContact CE1-CB 4.15Å; F140-N259 HydrophobicContact CZ-CB 4.15Å; S255-N259 PolarHBondContact O-N 3.3Å; I256-N259 CarbonylContact O-C 3.54Å; I256-N259 VanDerWaalsContact O-C 3.29Å; N259-A261 PolarHBondContact OD1-N 3.38Å; N259-Y262 PolarHBondContact OD1-N 2.99Å; N259-N265 PolarHBondContact O-ND2 3Å; N259-N265 VanDerWaalsContact O-ND2 3.11Å
260	P	93.1	Very high	96	Very high	8 Å²	8	19.9 Å²	19.9	5%	0.052	9%	0.092	C	C	.	.	S	Bend	trans	-82.7	-14	179	30.7	-34.6	0	0	0	113.8	I256 H266 A488 Y492	I256-P260 HydrophobicContact CG2-CB 4.31Å; I256-P260 WeakPolarHBondContact O-CA 3.2Å; I256-P260 VanDerWaalsContact O-CB 3.25Å; I256-P260 WeakPolarHBondContact O-CB 3.43Å; I256-P260 VanDerWaalsContact O-CD 3.29Å; I256-P260 WeakPolarHBondContact O-CD 3.06Å; P260-H266 PolarHBondContact O-NE2 3.39Å; P260-A488 HydrophobicContact CB-CB 4.3Å; P260-A488 WeakPolarHBondContact CB-O 3.33Å; P260-A488 WeakPolarHBondContact CG-O 3.36Å; P260-Y492 HydrophobicContact CB-CD2 4.39Å; P260-Y492 HydrophobicContact CB-CE2 4.11Å; P260-Y492 HydrophobicContact CG-CD2 4.19Å; P260-Y492 HydrophobicContact CG-CE2 3.43Å; P260-Y492 VanDerWaalsContact CG-CE2 3.43Å
261	A	92	Very high	96.1	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	8%	0.079	C	C	.	.	S	Bend	trans	-76.8	-31.6	175.3	0	0	0	0	0	111.6	A141 N259 F263 C296 Y492	A141-A261 HydrophobicContact CB-CB 4.28Å; N259-A261 PolarHBondContact OD1-N 3.38Å; A261-F263 PolarHBondContact O-N 2.92Å; A261-C296 PolarHBondContact O-SG 3.04Å; A261-Y492 HydrophobicContact CB-CD1 4.38Å; A261-Y492 HydrophobicContact CB-CE1 3.92Å
262	Y	92.6	Very high	96.2	Very high	35 Å²	35	16 Å²	16	14%	0.137	7%	0.072	C	C	.	.			trans	-69.9	101.6	-172.5	-164.3	-118.8	0	0	0	113	N259 R264 N265	N259-Y262 PolarHBondContact OD1-N 2.99Å; Y262-R264 HydrophobicContact CD1-CB 4.1Å; Y262-R264 HydrophobicContact CE1-CB 3.71Å; Y262-R264 HydrophobicContact CE1-CG 4.32Å; Y262-R264 PolarHBondContact O-N 3.09Å; Y262-N265 WeakPolarHBondContact O-CB 3.3Å; Y262-N265 PolarHBondContact O-N 2.62Å
263	F	94	Very high	96.1	Very high	27 Å²	27	16 Å²	16	12%	0.118	7%	0.072	C	C	.	.	H	α-helix	trans	-53.3	-31.7	-171.8	80.2	-85	0	0	0	115.2	A261 N265 H266 L267 A289 M292 F293 V303 I307	A261-F263 PolarHBondContact O-N 2.92Å; F263-N265 VanDerWaalsContact C-N 3.28Å; F263-N265 PolarHBondContact O-N 2.96Å; F263-H266 PolarHBondContact O-N 2.93Å; F263-L267 PolarHBondContact O-N 2.97Å; F263-A289 WeakPolarHBondContact CB-O 3.47Å; F263-A289 WeakPolarHBondContact O-CB 3.3Å; F263-M292 HydrophobicContact CB-CB 4Å; F263-F293 HydrophobicContact CB-CB 4.03Å; F263-F293 HydrophobicContact CD1-CB 4.33Å; F263-F293 HydrophobicContact CD1-CD2 4.04Å; F263-F293 HydrophobicContact CD2-CB 4.09Å; F263-F293 HydrophobicContact CD2-CD2 4.26Å; F263-F293 AromaticContact CE1-CD2 3.79Å; F263-F293 HydrophobicContact CE1-CD2 3.79Å; F263-F293 HydrophobicContact CE1-CE2 4.48Å; F263-F293 HydrophobicContact CE2-CD2 4.02Å; F263-F293 HydrophobicContact CG-CB 3.91Å; F263-F293 HydrophobicContact CG-CD2 4.26Å; F263-F293 AromaticContact CZ-CD2 3.76Å; F263-F293 HydrophobicContact CZ-CD2 3.76Å; F263-F293 HydrophobicContact CZ-CE2 4.31Å; F263-V303 HydrophobicContact CE2-CG1 3.83Å; F263-V303 HydrophobicContact CZ-CG1 4.04Å; F263-I307 HydrophobicContact CD2-CD1 3.79Å; F263-I307 HydrophobicContact CE2-CD1 3.92Å
264	R	94.7	Very high	96.1	Very high	43 Å²	43	18 Å²	18	16%	0.162	8%	0.08	C	C	.	.	H	α-helix	trans	-70	-23.2	179.1	-65	-171.9	175.4	-174.6	0	113.1	E133 Y262 L267 R268	E133-R264 WeakPolarHBondContact OE1-CD 3.29Å; E133-R264 IonicContact OE1-CZ 3.28Å; E133-R264 IonicContact OE1-NE 2.64Å; E133-R264 IonicContact OE1-NH1 2.69Å; E133-R264 PolarHBondContact OE1-NH1 3.31Å; Y262-R264 HydrophobicContact CD1-CB 4.1Å; Y262-R264 HydrophobicContact CE1-CB 3.71Å; Y262-R264 HydrophobicContact CE1-CG 4.32Å; Y262-R264 PolarHBondContact O-N 3.09Å; R264-L267 PolarHBondContact O-N 2.74Å; R264-R268 WeakPolarHBondContact O-CB 3.15Å; R264-R268 WeakPolarHBondContact O-CD 3.43Å; R264-R268 WeakPolarHBondContact O-CG 3.01Å; R264-R268 PolarHBondContact O-N 2.92Å
265	N	96.7	Very high	96.2	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-65.4	-44.8	171.6	-73.3	-19.1	0	0	0	110.8	S229 T233 S255 I256 N259 Y262 F263 R268 Q269	S229-N265 PolarHBondContact OG-ND2 3.06Å; T233-N265 WeakPolarHBondContact CB-OD1 3.21Å; T233-N265 PolarHBondContact OG1-OD1 3.19Å; S255-N265 PolarHBondContact O-ND2 2.92Å; S255-N265 VanDerWaalsContact O-ND2 3.14Å; I256-N265 HydrophobicContact CG1-CB 3.68Å; N259-N265 PolarHBondContact O-ND2 3Å; N259-N265 VanDerWaalsContact O-ND2 3.11Å; Y262-N265 WeakPolarHBondContact O-CB 3.3Å; Y262-N265 PolarHBondContact O-N 2.62Å; F263-N265 VanDerWaalsContact C-N 3.28Å; F263-N265 PolarHBondContact O-N 2.96Å; N265-R268 PolarHBondContact O-N 3.25Å; N265-Q269 WeakPolarHBondContact O-CB 3.39Å; N265-Q269 PolarHBondContact O-N 3.45Å
266	H	97.6	Very high	96.2	Very high	1 Å²	1	17.4 Å²	17.4	1%	0.005	9%	0.087	C	C	.	.	H	α-helix	trans	-63.5	-43.2	173.8	-62.8	-68.7	0	0	0	112.3	I256 P260 F263 Q269 A270 S285 I288 A289 T489	I256-H266 WeakPolarHBondContact CD1-ND1 3.31Å; P260-H266 PolarHBondContact O-NE2 3.39Å; F263-H266 PolarHBondContact O-N 2.93Å; H266-Q269 WeakPolarHBondContact O-CB 3.27Å; H266-Q269 PolarHBondContact O-N 2.89Å; H266-A270 PolarHBondContact O-N 3.06Å; H266-S285 WeakPolarHBondContact O-CB 3.27Å; H266-I288 HydrophobicContact CB-CG2 4.24Å; H266-I288 WeakPolarHBondContact ND1-CG2 3.14Å; H266-A289 HydrophobicContact CB-CB 3.86Å; H266-T489 PolarHBondContact CE1-OG1 3.11Å
267	L	97.4	Very high	96.1	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-67.7	-36.6	177.9	-166.5	67.3	0	0	0	112.7	L128 V129 F263 R264 A270 A271 A289 I307 Y310	L128-L267 HydrophobicContact CB-CD2 3.4Å; L128-L267 VanDerWaalsContact CB-CD2 3.4Å; L128-L267 HydrophobicContact CD1-CD2 3.77Å; L128-L267 HydrophobicContact CG-CD2 4.26Å; V129-L267 HydrophobicContact CG2-CD2 4.03Å; V129-L267 HydrophobicContact CG2-CG 3.82Å; F263-L267 PolarHBondContact O-N 2.97Å; R264-L267 PolarHBondContact O-N 2.74Å; L267-A270 WeakPolarHBondContact O-CB 3.3Å; L267-A270 PolarHBondContact O-N 2.96Å; L267-A271 PolarHBondContact O-N 3.07Å; L267-A289 HydrophobicContact CB-CB 4Å; L267-A289 HydrophobicContact CD1-CB 4.38Å; L267-I307 HydrophobicContact CD1-CG2 4.18Å; L267-I307 HydrophobicContact CD2-CG1 4.38Å; L267-Y310 HydrophobicContact CD1-CD1 4.19Å; L267-Y310 HydrophobicContact CD1-CG 4.46Å
268	R	97.9	Very high	96.1	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-66.8	-38.7	172.7	-77.3	166.6	177.9	154.4	5.8	111.5	V129 V131 E133 T233 V236 T237 R264 N265 A270 A271 V272	V129-R268 HydrophobicContact CG1-CG 4Å; V129-R268 PolarHBondContact O-NE 3.17Å; V129-R268 PolarHBondContact O-NH2 2.9Å; V131-R268 PolarHBondContact O-NH2 3.26Å; V131-R268 VanDerWaalsContact O-NH2 3.16Å; E133-R268 IonicContact OE1-CZ 2.75Å; E133-R268 IonicContact OE1-NH1 3.46Å; E133-R268 PolarHBondContact OE1-NH1 3.39Å; E133-R268 IonicContact OE1-NH2 2.62Å; E133-R268 PolarHBondContact OE1-NH2 3.41Å; E133-R268 IonicContact OE2-CZ 3.15Å; E133-R268 VanDerWaalsContact OE2-CZ 3.29Å; E133-R268 IonicContact OE2-NH1 2.98Å; E133-R268 PolarHBondContact OE2-NH1 2.89Å; E133-R268 IonicContact OE2-NH2 2.8Å; E133-R268 PolarHBondContact OE2-NH2 2.87Å; T233-R268 WeakPolarHBondContact OG1-CD 3.38Å; T233-R268 PolarHBondContact OG1-NH1 3.36Å; T233-R268 VanDerWaalsContact OG1-NH1 3.15Å; V236-R268 HydrophobicContact CG1-CB 3.95Å; T237-R268 HydrophobicContact CG2-CG 4.42Å; T237-R268 VanDerWaalsContact CG2-NE 3.34Å; R264-R268 WeakPolarHBondContact O-CB 3.15Å; R264-R268 WeakPolarHBondContact O-CD 3.43Å; R264-R268 WeakPolarHBondContact O-CG 3.01Å; R264-R268 PolarHBondContact O-N 2.92Å; N265-R268 PolarHBondContact O-N 3.25Å; R268-A270 VanDerWaalsContact C-N 3.34Å; R268-A271 PolarHBondContact O-N 3.35Å; R268-V272 WeakPolarHBondContact O-CG2 3.21Å; R268-V272 PolarHBondContact O-N 3.17Å
269	Q	98.3	Very high	96.2	Very high	11 Å²	11	22.1 Å²	22.1	5%	0.051	10%	0.102	C	C	.	.	H	α-helix	trans	-60.9	-42.5	169.5	-174.1	-173.4	80.4	0	0	111.5	A252 H253 I256 N265 H266 A271 V272 F273 S285	A252-Q269 HydrophobicContact CB-CB 4.12Å; A252-Q269 HydrophobicContact CB-CG 4.37Å; H253-Q269 PolarHBondContact ND1-NE2 3.48Å; I256-Q269 HydrophobicContact CD1-CB 3.89Å; I256-Q269 HydrophobicContact CD1-CG 4.27Å; N265-Q269 WeakPolarHBondContact O-CB 3.39Å; N265-Q269 PolarHBondContact O-N 3.45Å; H266-Q269 WeakPolarHBondContact O-CB 3.27Å; H266-Q269 PolarHBondContact O-N 2.89Å; Q269-A271 VanDerWaalsContact C-N 3.3Å; Q269-A271 PolarHBondContact O-N 2.9Å; Q269-V272 PolarHBondContact O-N 3.13Å; Q269-V272 VanDerWaalsContact O-N 3.14Å; Q269-F273 HydrophobicContact CG-CD2 3.9Å; Q269-F273 HydrophobicContact CG-CE2 3.54Å; Q269-F273 HydrophobicContact CG-CZ 3.98Å; Q269-F273 PolarHBondContact O-N 3.43Å; Q269-S285 PolarHBondContact OE1-OG 2.9Å
270	A	98.4	Very high	96.2	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-60.7	-37.4	176.3	0	0	0	0	0	112.7	H266 L267 R268 R274 A282 A286 Y310	H266-A270 PolarHBondContact O-N 3.06Å; L267-A270 WeakPolarHBondContact O-CB 3.3Å; L267-A270 PolarHBondContact O-N 2.96Å; R268-A270 VanDerWaalsContact C-N 3.34Å; A270-R274 WeakPolarHBondContact O-CB 3.41Å; A270-R274 PolarHBondContact O-N 3.12Å; A270-A282 WeakPolarHBondContact CB-O 3.36Å; A270-A282 WeakPolarHBondContact O-CB 3.49Å; A270-A286 HydrophobicContact CB-CB 4.27Å; A270-Y310 HydrophobicContact CB-CE1 3.84Å; A270-Y310 PolarHBondContact O-OH 2.97Å
271	A	98.4	Very high	96.3	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-66.7	-40.1	172.8	0	0	0	0	0	112.9	V129 L240 L267 R268 Q269 R274 C275 Y310	V129-A271 HydrophobicContact CG1-CB 3.72Å; V129-A271 HydrophobicContact CG2-CB 4.03Å; L240-A271 HydrophobicContact CD1-CB 3.96Å; L267-A271 PolarHBondContact O-N 3.07Å; R268-A271 PolarHBondContact O-N 3.35Å; Q269-A271 VanDerWaalsContact C-N 3.3Å; Q269-A271 PolarHBondContact O-N 2.9Å; A271-R274 PolarHBondContact O-N 3.29Å; A271-C275 WeakPolarHBondContact O-CB 3.4Å; A271-C275 PolarHBondContact O-N 3.29Å; A271-C275 PolarHBondContact O-SG 2.93Å; A271-Y310 WeakPolarHBondContact CA-OH 3.45Å
272	V	98.6	Very high	96.6	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-63.2	-48	172.8	-179	0	0	0	0	111.2	V236 L240 P245 A248 L249 A252 R268 Q269 R274 C275 L276	V236-V272 HydrophobicContact CG1-CG2 3.79Å; L240-V272 HydrophobicContact CD1-CG2 4.06Å; L240-V272 HydrophobicContact CD2-CG2 3.91Å; L240-V272 HydrophobicContact CG-CG2 4.09Å; P245-V272 HydrophobicContact CB-CG1 4.13Å; P245-V272 WeakPolarHBondContact O-CG1 3.28Å; A248-V272 HydrophobicContact CB-CG1 4.22Å; A248-V272 HydrophobicContact CB-CG2 3.57Å; L249-V272 HydrophobicContact CB-CG1 3.9Å; L249-V272 HydrophobicContact CD1-CG1 3.9Å; A252-V272 HydrophobicContact CB-CG2 4.26Å; R268-V272 WeakPolarHBondContact O-CG2 3.21Å; R268-V272 PolarHBondContact O-N 3.17Å; Q269-V272 PolarHBondContact O-N 3.13Å; Q269-V272 VanDerWaalsContact O-N 3.14Å; V272-R274 VanDerWaalsContact C-N 3.35Å; V272-R274 PolarHBondContact O-N 3.02Å; V272-C275 CarbonylContact O-C 3.59Å; V272-C275 PolarHBondContact O-N 3.13Å; V272-C275 VanDerWaalsContact O-N 3.13Å; V272-L276 HydrophobicContact CG1-CD1 3.98Å; V272-L276 WeakPolarHBondContact O-CG 3.47Å; V272-L276 PolarHBondContact O-N 3.41Å; V272-L276 VanDerWaalsContact O-N 3.12Å
273	F	98	Very high	96.8	Very high	2 Å²	2	21.8 Å²	21.8	1%	0.009	10%	0.102	C	C	.	.	H	α-helix	trans	-60.1	-42.2	177.5	-72.9	-38.2	0	0	0	112.2	L249 H253 Q269 C275 L276 E277 R278 E281 A282 S285	L249-F273 HydrophobicContact CD1-CD1 4.06Å; L249-F273 HydrophobicContact CD1-CE1 3.74Å; H253-F273 AromaticContact CE1-CZ 3.85Å; Q269-F273 HydrophobicContact CG-CD2 3.9Å; Q269-F273 HydrophobicContact CG-CE2 3.54Å; Q269-F273 HydrophobicContact CG-CZ 3.98Å; Q269-F273 PolarHBondContact O-N 3.43Å; F273-C275 VanDerWaalsContact C-N 3.32Å; F273-C275 PolarHBondContact O-N 3.19Å; F273-L276 CarbonylContact O-C 3.4Å; F273-L276 PolarHBondContact O-N 3.21Å; F273-E277 PolarHBondContact O-N 3.06Å; F273-R278 HydrophobicContact CB-CB 4.11Å; F273-R278 HydrophobicContact CD1-CB 4.23Å; F273-R278 VanDerWaalsContact CE1-CZ 3.49Å; F273-R278 HydrophobicContact CG-CB 4.47Å; F273-R278 PolarHBondContact O-N 3.49Å; F273-E281 HydrophobicContact CB-CB 4.49Å; F273-E281 HydrophobicContact CD1-CB 4.23Å; F273-E281 VanDerWaalsContact CD2-C 3.47Å; F273-E281 HydrophobicContact CD2-CB 3.66Å; F273-E281 HydrophobicContact CE1-CB 4.31Å; F273-E281 HydrophobicContact CE2-CB 3.73Å; F273-E281 HydrophobicContact CG-CB 3.92Å; F273-E281 HydrophobicContact CZ-CB 4.06Å; F273-A282 HydrophobicContact CB-CB 3.73Å; F273-S285 WeakPolarHBondContact CE2-OG 3.28Å
274	R	97.4	Very high	96.8	Very high	41 Å²	41	21.8 Å²	21.8	16%	0.155	10%	0.101	C	C	.	.	H	α-helix	trans	-59.9	-41	173.7	-170.4	-169.1	65.1	69.3	-0.8	112.1	E125 A270 A271 V272 L276 E277 Y279 A282 Y310 M314	E125-R274 IonicContact OE1-CZ 3.68Å; E125-R274 IonicContact OE1-NE 2.85Å; E125-R274 PolarHBondContact OE1-NE 3.03Å; E125-R274 IonicContact OE1-NH2 3.13Å; E125-R274 PolarHBondContact OE1-NH2 2.95Å; E125-R274 IonicContact OE2-NH2 3.46Å; E125-R274 PolarHBondContact OE2-NH2 2.8Å; A270-R274 WeakPolarHBondContact O-CB 3.41Å; A270-R274 PolarHBondContact O-N 3.12Å; A271-R274 PolarHBondContact O-N 3.29Å; V272-R274 VanDerWaalsContact C-N 3.35Å; V272-R274 PolarHBondContact O-N 3.02Å; R274-L276 PolarHBondContact O-N 3.05Å; R274-E277 PolarHBondContact O-N 2.71Å; R274-E277 VanDerWaalsContact O-N 3.13Å; R274-Y279 HydrophobicContact CG-CD1 4.48Å; R274-Y279 HydrophobicContact CG-CE1 4.08Å; R274-A282 HydrophobicContact CB-CB 4.4Å; R274-Y310 WeakPolarHBondContact CB-OH 3.35Å; R274-Y310 WeakPolarHBondContact CD-OH 3.45Å; R274-Y310 PolarHBondContact NE-OH 2.84Å; R274-M314 HydrophobicContact CB-SD 3.74Å; R274-M314 HydrophobicContact CG-CE 3.88Å; R274-M314 HydrophobicContact CG-SD 3.54Å; R274-M314 VanDerWaalsContact CG-SD 3.54Å
275	C	97.1	Very high	96.9	Very high	50 Å²	50	19.9 Å²	19.9	34%	0.338	10%	0.095	S	C	.	.	H	α-helix	trans	-72.2	-7.1	177.1	-66.1	0	0	0	0	114	L240 P245 A271 V272 F273	L240-C275 HydrophobicContact CD2-CB 4.38Å; P245-C275 HydrophobicContact CB-CB 3.76Å; P245-C275 HydrophobicContact CG-CB 4.07Å; A271-C275 WeakPolarHBondContact O-CB 3.4Å; A271-C275 PolarHBondContact O-N 3.29Å; A271-C275 PolarHBondContact O-SG 2.93Å; V272-C275 CarbonylContact O-C 3.59Å; V272-C275 PolarHBondContact O-N 3.13Å; V272-C275 VanDerWaalsContact O-N 3.13Å; F273-C275 VanDerWaalsContact C-N 3.32Å; F273-C275 PolarHBondContact O-N 3.19Å
276	L	96.8	Very high	96.9	Very high	45 Å²	45	19.9 Å²	19.9	24%	0.236	10%	0.095	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.4	9.5	171.9	-63.7	171.6	0	0	0	112.3	P245 L249 V272 F273 R274 R278	P245-L276 HydrophobicContact CB-CD2 3.87Å; P245-L276 HydrophobicContact CB-CG 3.97Å; P245-L276 HydrophobicContact CG-CD2 3.7Å; P245-L276 HydrophobicContact CG-CG 4.27Å; L249-L276 HydrophobicContact CD1-CD1 4.21Å; L249-L276 HydrophobicContact CD2-CD1 3.92Å; L249-L276 HydrophobicContact CG-CD1 4.45Å; V272-L276 HydrophobicContact CG1-CD1 3.98Å; V272-L276 WeakPolarHBondContact O-CG 3.47Å; V272-L276 PolarHBondContact O-N 3.41Å; V272-L276 VanDerWaalsContact O-N 3.12Å; F273-L276 CarbonylContact O-C 3.4Å; F273-L276 PolarHBondContact O-N 3.21Å; R274-L276 PolarHBondContact O-N 3.05Å; L276-R278 HydrophobicContact CB-CG 4.02Å; L276-R278 PolarHBondContact O-N 2.95Å
277	E	95.5	Very high	96.8	Very high	122 Å²	122	20 Å²	20	57%	0.57	10%	0.095	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.6	22.2	-173.8	-55.4	-161.7	-170.2	0	0	114.6	F273 R274 Y279 R321	F273-E277 PolarHBondContact O-N 3.06Å; R274-E277 PolarHBondContact O-N 2.71Å; R274-E277 VanDerWaalsContact O-N 3.13Å; E277-Y279 VanDerWaalsContact C-N 3.28Å; E277-Y279 HydrophobicContact CB-CD2 4.37Å; E277-Y279 HydrophobicContact CB-CE2 3.69Å; E277-Y279 HydrophobicContact CG-CE2 4.18Å; E277-Y279 WeakPolarHBondContact O-CD2 3.38Å; E277-Y279 PolarHBondContact O-N 3.14Å; E277-Y279 VanDerWaalsContact O-N 3.11Å; E277-R321 IonicContact OE2-CZ 3.8Å; E277-R321 IonicContact OE2-NH1 3.34Å; E277-R321 PolarHBondContact OE2-NH1 3.18Å
278	R	95.2	Very high	96.6	Very high	56 Å²	56	20.4 Å²	20.4	21%	0.211	10%	0.098	C	C	.	.			trans	-88.8	57.5	-179.9	-66.4	171.5	67	-174.4	-0.4	111.2	F273 L276 S280 E281 A282	F273-R278 HydrophobicContact CB-CB 4.11Å; F273-R278 HydrophobicContact CD1-CB 4.23Å; F273-R278 VanDerWaalsContact CE1-CZ 3.49Å; F273-R278 HydrophobicContact CG-CB 4.47Å; F273-R278 PolarHBondContact O-N 3.49Å; L276-R278 HydrophobicContact CB-CG 4.02Å; L276-R278 PolarHBondContact O-N 2.95Å; R278-S280 PolarHBondContact O-N 2.77Å; R278-E281 IonicContact CZ-OE1 2.94Å; R278-E281 IonicContact CZ-OE2 2.78Å; R278-E281 IonicContact NE-OE2 3.26Å; R278-E281 PolarHBondContact NE-OE2 3.44Å; R278-E281 IonicContact NH2-OE1 2.61Å; R278-E281 PolarHBondContact NH2-OE1 3.38Å; R278-E281 IonicContact NH2-OE2 2.71Å; R278-E281 PolarHBondContact NH2-OE2 3.42Å; R278-E281 PolarHBondContact O-N 2.88Å; R278-E281 VanDerWaalsContact O-N 3.11Å; R278-A282 PolarHBondContact O-N 3.3Å
279	Y	95.9	Very high	96.5	Very high	21 Å²	21	20.4 Å²	20.4	8%	0.082	10%	0.098	C	C	.	.	H	α-helix	trans	-60.8	-39.9	-165.1	-62.5	-78.8	0	0	0	115.2	R274 E277 E281 A282 A283 M314 E317 R321	R274-Y279 HydrophobicContact CG-CD1 4.48Å; R274-Y279 HydrophobicContact CG-CE1 4.08Å; E277-Y279 VanDerWaalsContact C-N 3.28Å; E277-Y279 HydrophobicContact CB-CD2 4.37Å; E277-Y279 HydrophobicContact CB-CE2 3.69Å; E277-Y279 HydrophobicContact CG-CE2 4.18Å; E277-Y279 WeakPolarHBondContact O-CD2 3.38Å; E277-Y279 PolarHBondContact O-N 3.14Å; E277-Y279 VanDerWaalsContact O-N 3.11Å; Y279-E281 VanDerWaalsContact C-N 3.25Å; Y279-E281 PolarHBondContact O-N 3.44Å; Y279-A282 WeakPolarHBondContact O-CB 3.45Å; Y279-A282 PolarHBondContact O-N 2.7Å; Y279-A283 WeakPolarHBondContact O-CB 3.27Å; Y279-A283 PolarHBondContact O-N 3.37Å; Y279-M314 HydrophobicContact CD1-SD 4.13Å; Y279-E317 HydrophobicContact CD1-CB 3.33Å; Y279-E317 HydrophobicContact CD1-CG 4.08Å; Y279-E317 HydrophobicContact CD2-CB 4.22Å; Y279-E317 HydrophobicContact CE1-CB 3.54Å; Y279-E317 HydrophobicContact CE1-CG 3.8Å; Y279-E317 HydrophobicContact CE2-CB 4.42Å; Y279-E317 HydrophobicContact CG-CB 3.68Å; Y279-R321 HydrophobicContact CD2-CG 4.01Å; Y279-R321 HydrophobicContact CE2-CG 3.88Å; Y279-R321 PolarHBondContact OH-NH2 3.23Å
280	S	94.6	Very high	96.2	Very high	14 Å²	14	19.9 Å²	19.9	10%	0.098	10%	0.095	C	C	.	.	H	α-helix	trans	-58	-39	175.4	-55.5	0	0	0	0	112.5	R278 R284 P437	R278-S280 PolarHBondContact O-N 2.77Å; S280-R284 PolarHBondContact O-N 2.82Å; S280-R284 VanDerWaalsContact O-N 3.08Å; S280-P437 PolarHBondContact OG-O 3.43Å
281	E	95.3	Very high	95.8	Very high	24 Å²	24	21.9 Å²	21.9	11%	0.112	10%	0.103	C	C	.	.	H	α-helix	trans	-77.4	-38.3	-179.6	-61.5	178.2	96.3	0	0	110.5	F273 R278 Y279 A283 R284 S285 D440 K460 Q482	F273-E281 HydrophobicContact CB-CB 4.49Å; F273-E281 HydrophobicContact CD1-CB 4.23Å; F273-E281 VanDerWaalsContact CD2-C 3.47Å; F273-E281 HydrophobicContact CD2-CB 3.66Å; F273-E281 HydrophobicContact CE1-CB 4.31Å; F273-E281 HydrophobicContact CE2-CB 3.73Å; F273-E281 HydrophobicContact CG-CB 3.92Å; F273-E281 HydrophobicContact CZ-CB 4.06Å; R278-E281 IonicContact CZ-OE1 2.94Å; R278-E281 IonicContact CZ-OE2 2.78Å; R278-E281 IonicContact NE-OE2 3.26Å; R278-E281 PolarHBondContact NE-OE2 3.44Å; R278-E281 IonicContact NH2-OE1 2.61Å; R278-E281 PolarHBondContact NH2-OE1 3.38Å; R278-E281 IonicContact NH2-OE2 2.71Å; R278-E281 PolarHBondContact NH2-OE2 3.42Å; R278-E281 PolarHBondContact O-N 2.88Å; R278-E281 VanDerWaalsContact O-N 3.11Å; Y279-E281 VanDerWaalsContact C-N 3.25Å; Y279-E281 PolarHBondContact O-N 3.44Å; E281-A283 VanDerWaalsContact C-N 3.3Å; E281-A283 PolarHBondContact O-N 2.92Å; E281-R284 PolarHBondContact O-N 3.39Å; E281-S285 PolarHBondContact O-N 3.35Å; E281-S285 PolarHBondContact O-OG 2.94Å; E281-S285 VanDerWaalsContact O-OG 3.13Å; E281-D440 HydrophobicContact CG-CB 3.74Å; E281-D440 WeakPolarHBondContact CG-OD2 3.5Å; E281-K460 IonicContact OE1-NZ 3.64Å; E281-K460 PolarHBondContact OE1-NZ 2.68Å; E281-Q482 PolarHBondContact OE1-NE2 2.85Å; E281-Q482 PolarHBondContact OE1-OE1 2.62Å
282	A	97.5	Very high	95.5	Very high	0 Å²	0	22 Å²	22	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-58.7	-40.6	169.9	0	0	0	0	0	112.3	A270 F273 R274 R278 Y279 A286 M314	A270-A282 WeakPolarHBondContact CB-O 3.36Å; A270-A282 WeakPolarHBondContact O-CB 3.49Å; F273-A282 HydrophobicContact CB-CB 3.73Å; R274-A282 HydrophobicContact CB-CB 4.4Å; R278-A282 PolarHBondContact O-N 3.3Å; Y279-A282 WeakPolarHBondContact O-CB 3.45Å; Y279-A282 PolarHBondContact O-N 2.7Å; A282-A286 VanDerWaalsContact O-CB 3.28Å; A282-A286 WeakPolarHBondContact O-CB 3.46Å; A282-A286 PolarHBondContact O-N 3.41Å; A282-M314 HydrophobicContact CB-CB 4.19Å; A282-M314 HydrophobicContact CB-CG 3.79Å; A282-M314 HydrophobicContact CB-SD 3.68Å
283	A	96.6	Very high	95.1	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-64.8	-44.3	175.8	0	0	0	0	0	111.6	Y279 E281 A286 M287 W311 M314 I315	Y279-A283 WeakPolarHBondContact O-CB 3.27Å; Y279-A283 PolarHBondContact O-N 3.37Å; E281-A283 VanDerWaalsContact C-N 3.3Å; E281-A283 PolarHBondContact O-N 2.92Å; A283-A286 PolarHBondContact O-N 3.01Å; A283-M287 PolarHBondContact O-N 2.91Å; A283-W311 VanDerWaalsContact O-CD1 3.24Å; A283-M314 HydrophobicContact CB-CB 3.69Å; A283-I315 HydrophobicContact CB-CG1 4.01Å
284	R	94.7	Very high	94.6	Very high	27 Å²	27	25 Å²	25	10%	0.102	12%	0.115	C	C	.	.	H	α-helix	trans	-62.9	-45.2	176	178.6	164.1	173.1	66.4	1.9	112.3	S280 E281 A286 M287 I288 R443	S280-R284 PolarHBondContact O-N 2.82Å; S280-R284 VanDerWaalsContact O-N 3.08Å; E281-R284 PolarHBondContact O-N 3.39Å; R284-A286 VanDerWaalsContact C-N 3.31Å; R284-A286 PolarHBondContact O-N 3.25Å; R284-M287 PolarHBondContact O-N 3.31Å; R284-I288 HydrophobicContact CG-CD1 3.9Å; R284-I288 VanDerWaalsContact O-CG1 3.27Å; R284-I288 WeakPolarHBondContact O-CG1 3.22Å; R284-I288 PolarHBondContact O-N 2.87Å; R284-R443 WeakPolarHBondContact CD-O 3.1Å; R284-R443 WeakPolarHBondContact CG-O 3.36Å; R284-R443 PolarHBondContact NH1-O 2.86Å
285	S	96.7	Very high	93.9	Very high	4 Å²	4	25.7 Å²	25.7	3%	0.028	12%	0.122	C	C	.	.	H	α-helix	trans	-66.6	-31.8	176.8	-54.2	0	0	0	0	112.5	H266 Q269 F273 E281 A289	H266-S285 WeakPolarHBondContact O-CB 3.27Å; Q269-S285 PolarHBondContact OE1-OG 2.9Å; F273-S285 WeakPolarHBondContact CE2-OG 3.28Å; E281-S285 PolarHBondContact O-N 3.35Å; E281-S285 PolarHBondContact O-OG 2.94Å; E281-S285 VanDerWaalsContact O-OG 3.13Å; S285-A289 WeakPolarHBondContact O-CB 3.33Å; S285-A289 PolarHBondContact O-N 3.43Å
286	A	96.8	Very high	93.2	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-72.2	-39.1	174.5	0	0	0	0	0	113.1	A270 A282 A283 R284 I288 A289 D290 I307 Y310 W311	A270-A286 HydrophobicContact CB-CB 4.27Å; A282-A286 VanDerWaalsContact O-CB 3.28Å; A282-A286 WeakPolarHBondContact O-CB 3.46Å; A282-A286 PolarHBondContact O-N 3.41Å; A283-A286 PolarHBondContact O-N 3.01Å; R284-A286 VanDerWaalsContact C-N 3.31Å; R284-A286 PolarHBondContact O-N 3.25Å; A286-I288 VanDerWaalsContact C-N 3.35Å; A286-A289 PolarHBondContact O-N 2.96Å; A286-D290 PolarHBondContact O-N 3.44Å; A286-I307 WeakPolarHBondContact O-CG2 3.39Å; A286-Y310 HydrophobicContact CB-CD1 3.92Å; A286-W311 HydrophobicContact CB-CB 3.71Å; A286-W311 HydrophobicContact CB-CG 4.28Å
287	M	94.9	Very high	92.3	Very high	2 Å²	2	26.6 Å²	26.6	1%	0.01	14%	0.141	C	C	.	.	H	α-helix	trans	-57.7	-48.1	169.9	-178	-172.3	66.7	0	0	111.1	A283 R284 A289 D290 Y291 W311 R443 S444 Q446 L447	A283-M287 PolarHBondContact O-N 2.91Å; R284-M287 PolarHBondContact O-N 3.31Å; M287-A289 VanDerWaalsContact C-N 3.33Å; M287-A289 PolarHBondContact O-N 3.13Å; M287-D290 PolarHBondContact O-N 2.69Å; M287-Y291 PolarHBondContact O-N 3.21Å; M287-W311 HydrophobicContact CB-CD2 3.93Å; M287-W311 HydrophobicContact CB-CE3 4.41Å; M287-W311 HydrophobicContact CB-CG 4.39Å; M287-W311 HydrophobicContact CB-CH2 4.37Å; M287-W311 HydrophobicContact CB-CZ2 3.83Å; M287-W311 HydrophobicContact CG-CD2 4.38Å; M287-W311 HydrophobicContact CG-CH2 3.76Å; M287-W311 HydrophobicContact CG-CZ2 3.51Å; M287-W311 HydrophobicContact CG-CZ3 4.24Å; M287-W311 HydrophobicContact SD-CH2 4.5Å; M287-W311 HydrophobicContact SD-CZ2 4Å; M287-R443 WeakPolarHBondContact CE-O 3.45Å; M287-S444 VanDerWaalsContact SD-C 3.59Å; M287-Q446 PolarHBondContact SD-N 3.44Å; M287-L447 HydrophobicContact CE-CD2 3.76Å; M287-L447 HydrophobicContact CE-CG 4.39Å; M287-L447 HydrophobicContact CG-CD2 4.37Å; M287-L447 HydrophobicContact SD-CD2 4.17Å; M287-L447 HydrophobicContact SD-CG 4.31Å
288	I	94.1	Very high	91.5	Very high	9 Å²	9	21.5 Å²	21.5	5%	0.046	12%	0.122	C	C	.	.	H	α-helix	trans	-63	-40.4	178.3	-68.4	168.1	0	0	0	110.3	H266 R284 A286 D290 Y291 M292 T489 L493	H266-I288 HydrophobicContact CB-CG2 4.24Å; H266-I288 WeakPolarHBondContact ND1-CG2 3.14Å; R284-I288 HydrophobicContact CG-CD1 3.9Å; R284-I288 VanDerWaalsContact O-CG1 3.27Å; R284-I288 WeakPolarHBondContact O-CG1 3.22Å; R284-I288 PolarHBondContact O-N 2.87Å; A286-I288 VanDerWaalsContact C-N 3.35Å; I288-D290 PolarHBondContact O-N 2.92Å; I288-Y291 PolarHBondContact O-N 3.45Å; I288-M292 HydrophobicContact CG2-CE 4.16Å; I288-M292 HydrophobicContact CG2-CG 4.05Å; I288-M292 WeakPolarHBondContact O-CB 3.28Å; I288-M292 VanDerWaalsContact O-CG 3.24Å; I288-M292 WeakPolarHBondContact O-CG 3.2Å; I288-M292 PolarHBondContact O-N 3.15Å; I288-T489 HydrophobicContact CG2-CG2 3.79Å; I288-L493 HydrophobicContact CD1-CD1 4.16Å; I288-L493 HydrophobicContact CG1-CD1 4.23Å; I288-L493 HydrophobicContact CG1-CD2 4.28Å; I288-L493 HydrophobicContact CG2-CD2 4.43Å
289	A	95.1	Very high	90.5	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-60.6	-44.6	175.9	0	0	0	0	0	112.9	F263 H266 L267 S285 A286 M287 F293 I307	F263-A289 WeakPolarHBondContact CB-O 3.47Å; F263-A289 WeakPolarHBondContact O-CB 3.3Å; H266-A289 HydrophobicContact CB-CB 3.86Å; L267-A289 HydrophobicContact CB-CB 4Å; L267-A289 HydrophobicContact CD1-CB 4.38Å; S285-A289 WeakPolarHBondContact O-CB 3.33Å; S285-A289 PolarHBondContact O-N 3.43Å; A286-A289 PolarHBondContact O-N 2.96Å; M287-A289 VanDerWaalsContact C-N 3.33Å; M287-A289 PolarHBondContact O-N 3.13Å; A289-F293 WeakPolarHBondContact O-CB 3.38Å; A289-F293 PolarHBondContact O-N 2.91Å; A289-I307 HydrophobicContact CB-CG2 4.07Å
290	D	93.1	Very high	89.9	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-65.1	-44.8	177.4	-175.2	59.4	0	0	0	110.8	A286 M287 I288 F293 W294 S304 I307 K308 W375	A286-D290 PolarHBondContact O-N 3.44Å; M287-D290 PolarHBondContact O-N 2.69Å; I288-D290 PolarHBondContact O-N 2.92Å; D290-F293 WeakPolarHBondContact O-CB 3.42Å; D290-F293 PolarHBondContact O-N 3.25Å; D290-W294 VanDerWaalsContact O-CD1 3.27Å; D290-W294 PolarHBondContact O-N 3.45Å; D290-S304 WeakPolarHBondContact OD1-CB 3.39Å; D290-S304 PolarHBondContact OD1-OG 3.34Å; D290-I307 HydrophobicContact CB-CB 4.22Å; D290-I307 HydrophobicContact CB-CG2 3.7Å; D290-K308 VanDerWaalsContact CG-CE 3.5Å; D290-K308 WeakPolarHBondContact OD1-CE 3.45Å; D290-K308 WeakPolarHBondContact OD2-CE 3.44Å; D290-K308 IonicContact OD2-NZ 2.82Å; D290-W375 PolarHBondContact OD2-NE1 3.32Å
291	Y	90.3	Very high	89.4	Confident	43 Å²	43	32.1 Å²	32.1	17%	0.169	18%	0.183	C	C	.	.	H	α-helix	trans	-63.5	-43.9	178.6	-175	-110.9	0	0	0	113.1	M287 I288 F293 W294 L295 W375 L447 L493	M287-Y291 PolarHBondContact O-N 3.21Å; I288-Y291 PolarHBondContact O-N 3.45Å; Y291-F293 VanDerWaalsContact C-N 3.34Å; Y291-F293 PolarHBondContact O-N 3.01Å; Y291-W294 PolarHBondContact O-N 2.8Å; Y291-L295 HydrophobicContact CD1-CD1 3.88Å; Y291-L295 HydrophobicContact CD1-CG 4.31Å; Y291-L295 HydrophobicContact CE1-CD1 3.34Å; Y291-L295 HydrophobicContact CE1-CG 3.93Å; Y291-L295 HydrophobicContact CE2-CG 4.4Å; Y291-L295 PolarHBondContact O-N 3.37Å; Y291-W375 HydrophobicContact CD2-CD2 4.15Å; Y291-W375 HydrophobicContact CD2-CE3 4.18Å; Y291-W375 HydrophobicContact CD2-CH2 4.39Å; Y291-W375 HydrophobicContact CD2-CZ2 4.33Å; Y291-W375 HydrophobicContact CD2-CZ3 4.3Å; Y291-W375 HydrophobicContact CE2-CE3 4.42Å; Y291-L447 HydrophobicContact CD1-CD1 4.25Å; Y291-L447 HydrophobicContact CD1-CD2 4.04Å; Y291-L447 HydrophobicContact CD2-CD1 3.46Å; Y291-L447 VanDerWaalsContact CD2-CD1 3.46Å; Y291-L447 HydrophobicContact CE1-CD1 4.41Å; Y291-L447 HydrophobicContact CE2-CD1 3.69Å; Y291-L447 HydrophobicContact CG-CD1 3.77Å; Y291-L447 HydrophobicContact CG-CD2 4.04Å; Y291-L493 HydrophobicContact CD1-CD2 3.65Å; Y291-L493 HydrophobicContact CE1-CD2 3.97Å
292	M	91.1	Very high	89	Confident	1 Å²	1	34.7 Å²	34.7	1%	0.005	20%	0.203	C	C	.	.	H	α-helix	trans	-64.5	-36.8	175.9	-70.4	-53.7	169.8	0	0	112.8	F263 I288 W294 L295 C296 T489 Y492 L493	F263-M292 HydrophobicContact CB-CB 4Å; I288-M292 HydrophobicContact CG2-CE 4.16Å; I288-M292 HydrophobicContact CG2-CG 4.05Å; I288-M292 WeakPolarHBondContact O-CB 3.28Å; I288-M292 VanDerWaalsContact O-CG 3.24Å; I288-M292 WeakPolarHBondContact O-CG 3.2Å; I288-M292 PolarHBondContact O-N 3.15Å; M292-W294 VanDerWaalsContact C-N 3.31Å; M292-W294 PolarHBondContact O-N 2.89Å; M292-L295 PolarHBondContact O-N 3.38Å; M292-L295 HydrophobicContact SD-CD1 4.24Å; M292-C296 WeakPolarHBondContact O-CB 3.42Å; M292-C296 PolarHBondContact O-N 3.3Å; M292-C296 PolarHBondContact O-SG 3.07Å; M292-T489 HydrophobicContact CE-CG2 3.5Å; M292-Y492 HydrophobicContact CE-CG 4.19Å; M292-L493 HydrophobicContact CE-CD2 3.59Å; M292-L493 HydrophobicContact CE-CG 4.12Å
293	F	90.4	Very high	88.7	Confident	13 Å²	13	35.1 Å²	35.1	6%	0.057	21%	0.205	C	C	.	.	H	α-helix	trans	-57.7	-44.9	175.2	170.8	-96.4	0	0	0	111.1	F263 A289 D290 Y291 G298 E300 V303 I307	F263-F293 HydrophobicContact CB-CB 4.03Å; F263-F293 HydrophobicContact CD1-CB 4.33Å; F263-F293 HydrophobicContact CD1-CD2 4.04Å; F263-F293 HydrophobicContact CD2-CB 4.09Å; F263-F293 HydrophobicContact CD2-CD2 4.26Å; F263-F293 AromaticContact CE1-CD2 3.79Å; F263-F293 HydrophobicContact CE1-CD2 3.79Å; F263-F293 HydrophobicContact CE1-CE2 4.48Å; F263-F293 HydrophobicContact CE2-CD2 4.02Å; F263-F293 HydrophobicContact CG-CB 3.91Å; F263-F293 HydrophobicContact CG-CD2 4.26Å; F263-F293 AromaticContact CZ-CD2 3.76Å; F263-F293 HydrophobicContact CZ-CD2 3.76Å; F263-F293 HydrophobicContact CZ-CE2 4.31Å; A289-F293 WeakPolarHBondContact O-CB 3.38Å; A289-F293 PolarHBondContact O-N 2.91Å; D290-F293 WeakPolarHBondContact O-CB 3.42Å; D290-F293 PolarHBondContact O-N 3.25Å; Y291-F293 VanDerWaalsContact C-N 3.34Å; Y291-F293 PolarHBondContact O-N 3.01Å; F293-G298 WeakPolarHBondContact CE1-O 3.15Å; F293-G298 VanDerWaalsContact O-CA 3.23Å; F293-G298 WeakPolarHBondContact O-CA 3.36Å; F293-G298 PolarHBondContact O-N 2.62Å; F293-E300 HydrophobicContact CZ-CB 3.98Å; F293-E300 WeakPolarHBondContact CZ-O 3.28Å; F293-V303 HydrophobicContact CD2-CG1 3.78Å; F293-V303 HydrophobicContact CE1-CB 4.44Å; F293-V303 HydrophobicContact CE2-CB 3.81Å; F293-V303 HydrophobicContact CE2-CG1 3.54Å; F293-V303 HydrophobicContact CE2-CG2 4.44Å; F293-V303 HydrophobicContact CG-CG1 4.36Å; F293-V303 HydrophobicContact CZ-CB 3.77Å; F293-V303 HydrophobicContact CZ-CG1 3.95Å; F293-I307 HydrophobicContact CB-CD1 4.23Å; F293-I307 HydrophobicContact CG-CD1 4.43Å
294	W	86.6	Confident	88.4	Confident	52 Å²	52	35.3 Å²	35.3	20%	0.197	21%	0.206	C	C	.	.	H	α-helix	trans	-72.2	-41.4	176.7	-75.2	93.7	0	0	0	113.4	D290 Y291 M292 C296 G297 H301 S304 W375	D290-W294 VanDerWaalsContact O-CD1 3.27Å; D290-W294 PolarHBondContact O-N 3.45Å; Y291-W294 PolarHBondContact O-N 2.8Å; M292-W294 VanDerWaalsContact C-N 3.31Å; M292-W294 PolarHBondContact O-N 2.89Å; W294-C296 VanDerWaalsContact C-N 3.25Å; W294-C296 PolarHBondContact O-N 3.12Å; W294-G297 PolarHBondContact O-N 3.32Å; W294-H301 AromaticContact CH2-CE1 4Å; W294-H301 AromaticContact CH2-ND1 3.87Å; W294-S304 PolarHBondContact NE1-OG 2.9Å; W294-W375 HydrophobicContact CB-CB 4.17Å; W294-W375 HydrophobicContact CB-CG 4.49Å; W294-W375 AromaticContact CD1-CD1 3.32Å; W294-W375 HydrophobicContact CD2-CB 4.21Å; W294-W375 HydrophobicContact CG-CB 3.92Å; W294-W375 AromaticContact CG-CD1 3.87Å; W294-W375 HydrophobicContact CG-CG 4.22Å; W294-W375 AromaticContact NE1-CD1 3.75Å
295	L	84.6	Confident	88.3	Confident	57 Å²	57	41.1 Å²	41.1	30%	0.298	23%	0.232	S	C	.	.	H	α-helix	trans	-60	-34.7	176.4	-79.4	-173.8	0	0	0	113.1	Y291 M292 G297 Y492	Y291-L295 HydrophobicContact CD1-CD1 3.88Å; Y291-L295 HydrophobicContact CD1-CG 4.31Å; Y291-L295 HydrophobicContact CE1-CD1 3.34Å; Y291-L295 HydrophobicContact CE1-CG 3.93Å; Y291-L295 HydrophobicContact CE2-CG 4.4Å; Y291-L295 PolarHBondContact O-N 3.37Å; M292-L295 PolarHBondContact O-N 3.38Å; M292-L295 HydrophobicContact SD-CD1 4.24Å; L295-G297 PolarHBondContact O-N 2.75Å; L295-Y492 WeakPolarHBondContact CD1-O 3.47Å
296	C	82.1	Confident	88.2	Confident	51 Å²	51	42.8 Å²	42.8	35%	0.345	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.4	13	177.4	-58	0	0	0	0	113.5	A261 M292 W294	A261-C296 PolarHBondContact O-SG 3.04Å; M292-C296 WeakPolarHBondContact O-CB 3.42Å; M292-C296 PolarHBondContact O-N 3.3Å; M292-C296 PolarHBondContact O-SG 3.07Å; W294-C296 VanDerWaalsContact C-N 3.25Å; W294-C296 PolarHBondContact O-N 3.12Å
297	G	77.1	Confident	88.1	Confident	62 Å²	62	42.8 Å²	42.8	64%	0.639	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	82.8	14.4	177.6	0	0	0	0	0	115.2	W294 L295 S299	W294-G297 PolarHBondContact O-N 3.32Å; L295-G297 PolarHBondContact O-N 2.75Å; G297-S299 PolarHBondContact O-N 3.31Å
298	G	79.3	Confident	88.1	Confident	15 Å²	15	44 Å²	44	16%	0.155	25%	0.246	C	C	.	.			trans	-63.2	105.1	179.3	0	0	0	0	0	113	F293	F293-G298 WeakPolarHBondContact CE1-O 3.15Å; F293-G298 VanDerWaalsContact O-CA 3.23Å; F293-G298 WeakPolarHBondContact O-CA 3.36Å; F293-G298 PolarHBondContact O-N 2.62Å
299	S	74.1	Confident	88.1	Confident	91 Å²	91	46.3 Å²	46.3	64%	0.636	26%	0.258	S	S	*	.			trans	-93.4	-10	-178.8	58.2	0	0	0	0	114.3	G297 H301	G297-S299 PolarHBondContact O-N 3.31Å; S299-H301 PolarHBondContact O-N 3.26Å
300	E	83.9	Confident	88.2	Confident	115 Å²	115	46.3 Å²	46.3	54%	0.537	26%	0.258	S	S	.	.			trans	-70	91.3	-179.8	-65.1	-168.4	166.8	0	0	112.1	F293 C302 V303 S304	F293-E300 HydrophobicContact CZ-CB 3.98Å; F293-E300 WeakPolarHBondContact CZ-O 3.28Å; E300-C302 PolarHBondContact O-N 3.49Å; E300-V303 HydrophobicContact CB-CB 4.24Å; E300-V303 HydrophobicContact CB-CG2 3.98Å; E300-V303 PolarHBondContact O-N 3.49Å; E300-V303 WeakPolarHBondContact OE2-CG2 3.42Å; E300-S304 PolarHBondContact O-N 2.94Å
301	H	82.9	Confident	88.4	Confident	109 Å²	109	46.4 Å²	46.4	51%	0.505	26%	0.258	S	S	.	.	H	α-helix	trans	-53.1	-25.1	175.9	-64.9	-72.4	0	0	0	113.9	W294 S299 K305	W294-H301 AromaticContact CH2-CE1 4Å; W294-H301 AromaticContact CH2-ND1 3.87Å; S299-H301 PolarHBondContact O-N 3.26Å; H301-K305 VanDerWaalsContact O-CB 3.3Å; H301-K305 WeakPolarHBondContact O-CB 3.49Å; H301-K305 WeakPolarHBondContact O-CD 3.19Å; H301-K305 WeakPolarHBondContact O-CG 3.27Å; H301-K305 PolarHBondContact O-N 3.48Å; H301-K305 VanDerWaalsContact O-N 3.08Å
302	C	88.1	Confident	88.6	Confident	78 Å²	78	45.1 Å²	45.1	53%	0.527	25%	0.254	S	S	.	.	H	α-helix	trans	-68.7	-40.4	174.9	55.3	0	0	0	0	112.4	E300 L306	E300-C302 PolarHBondContact O-N 3.49Å; C302-L306 VanDerWaalsContact O-CG 3.29Å; C302-L306 WeakPolarHBondContact O-CG 3.16Å; C302-L306 PolarHBondContact O-N 3.34Å; C302-L306 VanDerWaalsContact O-N 3.1Å
303	V	91.1	Very high	88.8	Confident	9 Å²	9	45.1 Å²	45.1	6%	0.055	25%	0.254	C	S	.	.	H	α-helix	trans	-66.1	-51.8	176.8	173.5	0	0	0	0	110.2	L128 F263 F293 E300 K305 L306 I307	L128-V303 HydrophobicContact CD1-CG1 4.36Å; L128-V303 HydrophobicContact CD2-CB 4.48Å; L128-V303 HydrophobicContact CD2-CG1 3.99Å; L128-V303 HydrophobicContact CD2-CG2 4.11Å; F263-V303 HydrophobicContact CE2-CG1 3.83Å; F263-V303 HydrophobicContact CZ-CG1 4.04Å; F293-V303 HydrophobicContact CD2-CG1 3.78Å; F293-V303 HydrophobicContact CE1-CB 4.44Å; F293-V303 HydrophobicContact CE2-CB 3.81Å; F293-V303 HydrophobicContact CE2-CG1 3.54Å; F293-V303 HydrophobicContact CE2-CG2 4.44Å; F293-V303 HydrophobicContact CG-CG1 4.36Å; F293-V303 HydrophobicContact CZ-CB 3.77Å; F293-V303 HydrophobicContact CZ-CG1 3.95Å; E300-V303 HydrophobicContact CB-CB 4.24Å; E300-V303 HydrophobicContact CB-CG2 3.98Å; E300-V303 PolarHBondContact O-N 3.49Å; E300-V303 WeakPolarHBondContact OE2-CG2 3.42Å; V303-K305 VanDerWaalsContact C-N 3.32Å; V303-K305 PolarHBondContact O-N 2.87Å; V303-L306 PolarHBondContact O-N 3.23Å; V303-I307 HydrophobicContact CG1-CD1 3.83Å; V303-I307 HydrophobicContact CG1-CG1 4.34Å; V303-I307 WeakPolarHBondContact O-CG1 2.9Å; V303-I307 PolarHBondContact O-N 2.73Å
304	S	90.3	Very high	89.1	Confident	3 Å²	3	44.5 Å²	44.5	2%	0.021	25%	0.252	C	S	.	.	H	α-helix	trans	-59	-40.4	177.8	177.5	0	0	0	0	112.4	D290 W294 E300 L306 I307 K308	D290-S304 WeakPolarHBondContact OD1-CB 3.39Å; D290-S304 PolarHBondContact OD1-OG 3.34Å; W294-S304 PolarHBondContact NE1-OG 2.9Å; E300-S304 PolarHBondContact O-N 2.94Å; S304-L306 VanDerWaalsContact C-N 3.34Å; S304-L306 PolarHBondContact O-N 2.62Å; S304-I307 PolarHBondContact O-N 3.02Å; S304-K308 WeakPolarHBondContact O-CB 3.02Å; S304-K308 VanDerWaalsContact O-CG 3.3Å; S304-K308 WeakPolarHBondContact O-CG 3.38Å; S304-K308 PolarHBondContact O-N 2.8Å; S304-K308 WeakPolarHBondContact OG-CE 3.39Å; S304-K308 PolarHBondContact OG-NZ 3.5Å
305	K	92	Very high	89.5	Confident	149 Å²	149	42 Å²	42	65%	0.648	24%	0.242	S	C	*	.	H	α-helix	trans	-60.6	-40.1	174.2	-77.6	170.3	-176.3	176.9	0	112.7	H301 V303 L309	H301-K305 VanDerWaalsContact O-CB 3.3Å; H301-K305 WeakPolarHBondContact O-CB 3.49Å; H301-K305 WeakPolarHBondContact O-CD 3.19Å; H301-K305 WeakPolarHBondContact O-CG 3.27Å; H301-K305 PolarHBondContact O-N 3.48Å; H301-K305 VanDerWaalsContact O-N 3.08Å; V303-K305 VanDerWaalsContact C-N 3.32Å; V303-K305 PolarHBondContact O-N 2.87Å; K305-L309 WeakPolarHBondContact O-CB 3.46Å; K305-L309 PolarHBondContact O-N 2.74Å
306	L	95	Very high	89.9	Confident	39 Å²	39	40.5 Å²	40.5	20%	0.204	23%	0.234	C	C	.	.	H	α-helix	trans	-69.1	-41	176.3	-70.7	168.4	0	0	0	111.9	V124 K127 L128 C302 V303 S304 L309 Y310	V124-L306 HydrophobicContact CG1-CB 4.18Å; V124-L306 HydrophobicContact CG2-CB 4.24Å; V124-L306 HydrophobicContact CG2-CD2 3.79Å; K127-L306 HydrophobicContact CB-CD1 4.29Å; K127-L306 HydrophobicContact CD-CD1 4.19Å; K127-L306 HydrophobicContact CD-CD2 4.47Å; L128-L306 HydrophobicContact CD1-CB 3.74Å; L128-L306 HydrophobicContact CG-CB 4.46Å; L128-L306 HydrophobicContact CG-CD1 4.46Å; C302-L306 VanDerWaalsContact O-CG 3.29Å; C302-L306 WeakPolarHBondContact O-CG 3.16Å; C302-L306 PolarHBondContact O-N 3.34Å; C302-L306 VanDerWaalsContact O-N 3.1Å; V303-L306 PolarHBondContact O-N 3.23Å; S304-L306 VanDerWaalsContact C-N 3.34Å; S304-L306 PolarHBondContact O-N 2.62Å; L306-L309 PolarHBondContact O-N 3.33Å; L306-Y310 PolarHBondContact O-N 3.3Å
307	I	95	Very high	90.5	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-65	-44.2	176	-56.4	166.5	0	0	0	110.7	L128 F263 L267 A286 A289 D290 F293 V303 S304 L309 Y310 W311	L128-I307 HydrophobicContact CD1-CG1 3.66Å; F263-I307 HydrophobicContact CD2-CD1 3.79Å; F263-I307 HydrophobicContact CE2-CD1 3.92Å; L267-I307 HydrophobicContact CD1-CG2 4.18Å; L267-I307 HydrophobicContact CD2-CG1 4.38Å; A286-I307 WeakPolarHBondContact O-CG2 3.39Å; A289-I307 HydrophobicContact CB-CG2 4.07Å; D290-I307 HydrophobicContact CB-CB 4.22Å; D290-I307 HydrophobicContact CB-CG2 3.7Å; F293-I307 HydrophobicContact CB-CD1 4.23Å; F293-I307 HydrophobicContact CG-CD1 4.43Å; V303-I307 HydrophobicContact CG1-CD1 3.83Å; V303-I307 HydrophobicContact CG1-CG1 4.34Å; V303-I307 WeakPolarHBondContact O-CG1 2.9Å; V303-I307 PolarHBondContact O-N 2.73Å; S304-I307 PolarHBondContact O-N 3.02Å; I307-L309 VanDerWaalsContact C-N 3.33Å; I307-L309 PolarHBondContact O-N 2.98Å; I307-Y310 WeakPolarHBondContact O-CB 3.14Å; I307-Y310 PolarHBondContact O-N 3.28Å; I307-Y310 VanDerWaalsContact O-N 3.11Å; I307-W311 WeakPolarHBondContact O-CB 3.41Å; I307-W311 PolarHBondContact O-N 3.47Å
308	K	93.6	Very high	91.3	Very high	27 Å²	27	37.8 Å²	37.8	12%	0.117	20%	0.2	C	C	.	.	H	α-helix	trans	-60.4	-39.7	176.1	-73.8	164.9	-178.8	167.8	0	112.6	D290 S304 Y310 W311 Q312 P370 A373	D290-K308 VanDerWaalsContact CG-CE 3.5Å; D290-K308 WeakPolarHBondContact OD1-CE 3.45Å; D290-K308 WeakPolarHBondContact OD2-CE 3.44Å; D290-K308 IonicContact OD2-NZ 2.82Å; S304-K308 WeakPolarHBondContact O-CB 3.02Å; S304-K308 VanDerWaalsContact O-CG 3.3Å; S304-K308 WeakPolarHBondContact O-CG 3.38Å; S304-K308 PolarHBondContact O-N 2.8Å; S304-K308 WeakPolarHBondContact OG-CE 3.39Å; S304-K308 PolarHBondContact OG-NZ 3.5Å; K308-Y310 VanDerWaalsContact C-N 3.34Å; K308-W311 PolarHBondContact O-N 2.77Å; K308-Q312 WeakPolarHBondContact O-CB 3.39Å; K308-Q312 PolarHBondContact O-N 2.86Å; K308-P370 HydrophobicContact CB-CB 4.11Å; K308-P370 HydrophobicContact CG-CB 4.44Å; K308-P370 WeakPolarHBondContact O-CB 3.42Å; K308-A373 WeakPolarHBondContact CE-O 3.37Å; K308-A373 PolarHBondContact NZ-O 2.97Å
309	L	94.8	Very high	91.9	Very high	59 Å²	59	39.5 Å²	39.5	31%	0.309	21%	0.205	S	C	.	.	H	α-helix	trans	-61.3	-43	173.3	-169.8	74.2	0	0	0	111.3	I116 N120 V124 K305 L306 I307 A313	I116-L309 HydrophobicContact CD1-CD1 3.56Å; I116-L309 HydrophobicContact CD1-CG 4.03Å; I116-L309 WeakPolarHBondContact CD1-O 3.48Å; I116-L309 HydrophobicContact CG1-CD1 4.16Å; I116-L309 HydrophobicContact CG2-CD1 4.37Å; I116-L309 HydrophobicContact CG2-CG 4.33Å; N120-L309 HydrophobicContact CB-CD2 4.36Å; V124-L309 HydrophobicContact CG2-CD2 4Å; K305-L309 WeakPolarHBondContact O-CB 3.46Å; K305-L309 PolarHBondContact O-N 2.74Å; L306-L309 PolarHBondContact O-N 3.33Å; I307-L309 VanDerWaalsContact C-N 3.33Å; I307-L309 PolarHBondContact O-N 2.98Å; L309-A313 PolarHBondContact O-N 3.13Å; L309-A313 VanDerWaalsContact O-N 3.16Å
310	Y	96.8	Very high	92.7	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-66.1	-46.9	176.2	-167.6	-84.6	0	0	0	112	I121 V124 E125 L267 A270 A271 R274 A286 L306 I307 K308 Q312 A313 M314	I121-Y310 HydrophobicContact CG2-CD2 3.78Å; I121-Y310 HydrophobicContact CG2-CE2 3.53Å; V124-Y310 HydrophobicContact CB-CD2 4.33Å; V124-Y310 HydrophobicContact CG1-CD2 4.11Å; V124-Y310 HydrophobicContact CG1-CG 4.42Å; E125-Y310 HydrophobicContact CG-CD2 4.44Å; E125-Y310 HydrophobicContact CG-CE2 3.73Å; E125-Y310 PolarHBondContact OE1-OH 3.02Å; L267-Y310 HydrophobicContact CD1-CD1 4.19Å; L267-Y310 HydrophobicContact CD1-CG 4.46Å; A270-Y310 HydrophobicContact CB-CE1 3.84Å; A270-Y310 PolarHBondContact O-OH 2.97Å; A271-Y310 WeakPolarHBondContact CA-OH 3.45Å; R274-Y310 WeakPolarHBondContact CB-OH 3.35Å; R274-Y310 WeakPolarHBondContact CD-OH 3.45Å; R274-Y310 PolarHBondContact NE-OH 2.84Å; A286-Y310 HydrophobicContact CB-CD1 3.92Å; L306-Y310 PolarHBondContact O-N 3.3Å; I307-Y310 WeakPolarHBondContact O-CB 3.14Å; I307-Y310 PolarHBondContact O-N 3.28Å; I307-Y310 VanDerWaalsContact O-N 3.11Å; K308-Y310 VanDerWaalsContact C-N 3.34Å; Y310-Q312 VanDerWaalsContact C-N 3.35Å; Y310-Q312 PolarHBondContact O-N 3.49Å; Y310-A313 PolarHBondContact O-N 3.25Å; Y310-M314 HydrophobicContact CD1-CG 3.88Å; Y310-M314 HydrophobicContact CE1-CG 3.58Å; Y310-M314 HydrophobicContact CE1-SD 3.96Å; Y310-M314 WeakPolarHBondContact O-CG 3.49Å; Y310-M314 PolarHBondContact O-N 3.09Å
311	W	96.4	Very high	93.1	Very high	1 Å²	1	40.3 Å²	40.3	0%	0.004	20%	0.201	C	C	.	.	H	α-helix	trans	-57.2	-45.4	176.4	176.2	21.6	0	0	0	111.7	A283 A286 M287 I307 K308 A313 M314 I315 P370 A373 S444	A283-W311 VanDerWaalsContact O-CD1 3.24Å; A286-W311 HydrophobicContact CB-CB 3.71Å; A286-W311 HydrophobicContact CB-CG 4.28Å; M287-W311 HydrophobicContact CB-CD2 3.93Å; M287-W311 HydrophobicContact CB-CE3 4.41Å; M287-W311 HydrophobicContact CB-CG 4.39Å; M287-W311 HydrophobicContact CB-CH2 4.37Å; M287-W311 HydrophobicContact CB-CZ2 3.83Å; M287-W311 HydrophobicContact CG-CD2 4.38Å; M287-W311 HydrophobicContact CG-CH2 3.76Å; M287-W311 HydrophobicContact CG-CZ2 3.51Å; M287-W311 HydrophobicContact CG-CZ3 4.24Å; M287-W311 HydrophobicContact SD-CH2 4.5Å; M287-W311 HydrophobicContact SD-CZ2 4Å; I307-W311 WeakPolarHBondContact O-CB 3.41Å; I307-W311 PolarHBondContact O-N 3.47Å; K308-W311 PolarHBondContact O-N 2.77Å; W311-A313 PolarHBondContact O-N 2.9Å; W311-M314 PolarHBondContact O-N 3.43Å; W311-I315 PolarHBondContact O-N 3.16Å; W311-P370 HydrophobicContact CB-CB 4.31Å; W311-P370 HydrophobicContact CB-CG 4.47Å; W311-P370 HydrophobicContact CD2-CB 3.73Å; W311-P370 HydrophobicContact CD2-CG 3.85Å; W311-P370 HydrophobicContact CE3-CB 3.53Å; W311-P370 HydrophobicContact CE3-CG 4.16Å; W311-P370 HydrophobicContact CG-CB 4.13Å; W311-P370 HydrophobicContact CG-CG 4.05Å; W311-P370 HydrophobicContact CZ3-CB 4.01Å; W311-A373 HydrophobicContact CH2-CB 3.97Å; W311-A373 HydrophobicContact CZ3-CB 3.58Å; W311-S444 PolarHBondContact NE1-O 3.15Å
312	Q	95.1	Very high	93.4	Very high	16 Å²	16	35.9 Å²	35.9	8%	0.075	18%	0.183	C	C	.	.	H	α-helix	trans	-57.5	-47.8	175.1	178.4	172.5	-38	0	0	111.9	L113 P114 I116 K308 Y310 M314 I315 E316 P370	L113-Q312 HydrophobicContact CD2-CG 4.11Å; P114-Q312 PolarHBondContact O-NE2 3.35Å; P114-Q312 VanDerWaalsContact O-NE2 3.07Å; I116-Q312 HydrophobicContact CD1-CB 3.66Å; I116-Q312 HydrophobicContact CD1-CG 3.58Å; K308-Q312 WeakPolarHBondContact O-CB 3.39Å; K308-Q312 PolarHBondContact O-N 2.86Å; Y310-Q312 VanDerWaalsContact C-N 3.35Å; Y310-Q312 PolarHBondContact O-N 3.49Å; Q312-M314 VanDerWaalsContact C-N 3.25Å; Q312-M314 PolarHBondContact O-N 3.33Å; Q312-I315 PolarHBondContact O-N 2.96Å; Q312-E316 WeakPolarHBondContact O-CB 3.41Å; Q312-E316 PolarHBondContact O-N 2.98Å; Q312-P370 HydrophobicContact CB-CB 4.16Å; Q312-P370 HydrophobicContact CB-CG 3.66Å; Q312-P370 HydrophobicContact CG-CG 4.45Å
313	A	95.4	Very high	93.3	Very high	1 Å²	1	39.8 Å²	39.8	1%	0.008	19%	0.194	C	C	.	.	H	α-helix	trans	-63.1	-33.3	-179.8	0	0	0	0	0	112.1	I116 I121 L309 Y310 W311 E316 E317	I116-A313 HydrophobicContact CB-CB 3.93Å; I116-A313 HydrophobicContact CD1-CB 4.02Å; I116-A313 HydrophobicContact CG2-CB 4.04Å; I121-A313 HydrophobicContact CD1-CB 3.67Å; I121-A313 HydrophobicContact CG1-CB 3.87Å; L309-A313 PolarHBondContact O-N 3.13Å; L309-A313 VanDerWaalsContact O-N 3.16Å; Y310-A313 PolarHBondContact O-N 3.25Å; W311-A313 PolarHBondContact O-N 2.9Å; A313-E316 PolarHBondContact O-N 3.15Å; A313-E317 PolarHBondContact O-N 2.97Å
314	M	96.9	Very high	93.1	Very high	1 Å²	1	41.7 Å²	41.7	1%	0.005	21%	0.206	C	C	.	.	H	α-helix	trans	-74.7	-35.3	176.9	-61.8	-56.2	89.9	0	0	112.6	I121 R274 Y279 A282 A283 Y310 W311 Q312 E316 A318	I121-M314 HydrophobicContact CD1-CE 4.23Å; I121-M314 HydrophobicContact CG2-CE 4.35Å; R274-M314 HydrophobicContact CB-SD 3.74Å; R274-M314 HydrophobicContact CG-CE 3.88Å; R274-M314 HydrophobicContact CG-SD 3.54Å; R274-M314 VanDerWaalsContact CG-SD 3.54Å; Y279-M314 HydrophobicContact CD1-SD 4.13Å; A282-M314 HydrophobicContact CB-CB 4.19Å; A282-M314 HydrophobicContact CB-CG 3.79Å; A282-M314 HydrophobicContact CB-SD 3.68Å; A283-M314 HydrophobicContact CB-CB 3.69Å; Y310-M314 HydrophobicContact CD1-CG 3.88Å; Y310-M314 HydrophobicContact CE1-CG 3.58Å; Y310-M314 HydrophobicContact CE1-SD 3.96Å; Y310-M314 WeakPolarHBondContact O-CG 3.49Å; Y310-M314 PolarHBondContact O-N 3.09Å; W311-M314 PolarHBondContact O-N 3.43Å; Q312-M314 VanDerWaalsContact C-N 3.25Å; Q312-M314 PolarHBondContact O-N 3.33Å; M314-E316 VanDerWaalsContact C-N 3.32Å; M314-A318 WeakPolarHBondContact O-CB 3.42Å; M314-A318 PolarHBondContact O-N 3.02Å
315	I	95.2	Very high	93.2	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-62.1	-44.7	168.6	-63.7	172.8	0	0	0	109.6	L113 A283 W311 Q312 A318 I319 L369 P370 F441 T445	L113-I315 HydrophobicContact CD1-CB 4.42Å; L113-I315 HydrophobicContact CD1-CG2 3.6Å; A283-I315 HydrophobicContact CB-CG1 4.01Å; W311-I315 PolarHBondContact O-N 3.16Å; Q312-I315 PolarHBondContact O-N 2.96Å; I315-A318 WeakPolarHBondContact O-CB 3.46Å; I315-A318 PolarHBondContact O-N 3.33Å; I315-I319 HydrophobicContact CG2-CD1 3.79Å; I315-I319 HydrophobicContact CG2-CG1 4.36Å; I315-I319 WeakPolarHBondContact O-CG1 3.39Å; I315-I319 PolarHBondContact O-N 2.91Å; I315-L369 HydrophobicContact CD1-CD2 4.4Å; I315-P370 HydrophobicContact CD1-CG 3.95Å; I315-F441 HydrophobicContact CG2-CE2 4.15Å; I315-F441 HydrophobicContact CG2-CZ 4.28Å; I315-T445 HydrophobicContact CD1-CG2 3.62Å; I315-T445 HydrophobicContact CG1-CG2 4.44Å
316	E	93.3	Very high	93.2	Very high	25 Å²	25	35.6 Å²	35.6	12%	0.117	18%	0.18	C	C	.	.	H	α-helix	trans	-62.4	-49.9	-176.6	-165	-156.7	154.5	0	0	112.5	H115 I116 Q312 A313 M314 A318 I319 T320	H115-E316 WeakPolarHBondContact CA-OE1 3.5Å; H115-E316 WeakPolarHBondContact CA-OE2 3.44Å; H115-E316 IonicContact CE1-OE1 3.64Å; H115-E316 IonicContact CG-OE1 2.6Å; H115-E316 IonicContact ND1-OE1 3.92Å; H115-E316 PolarHBondContact ND1-OE1 3.47Å; H115-E316 IonicContact ND1-OE2 3.46Å; I116-E316 PolarHBondContact N-OE2 3.09Å; Q312-E316 WeakPolarHBondContact O-CB 3.41Å; Q312-E316 PolarHBondContact O-N 2.98Å; A313-E316 PolarHBondContact O-N 3.15Å; M314-E316 VanDerWaalsContact C-N 3.32Å; E316-A318 VanDerWaalsContact C-N 3.33Å; E316-A318 PolarHBondContact O-N 3.34Å; E316-I319 PolarHBondContact O-N 2.96Å; E316-T320 WeakPolarHBondContact O-CB 3.45Å; E316-T320 PolarHBondContact O-N 3.06Å; E316-T320 PolarHBondContact O-OG1 2.77Å
317	E	94.2	Very high	93.1	Very high	49 Å²	49	34.3 Å²	34.3	23%	0.229	17%	0.174	C	C	.	.	H	α-helix	trans	-63.8	-37.7	173.3	-77.1	-97.6	-154	0	0	111.2	Y279 A313 I319 T320 R321	Y279-E317 HydrophobicContact CD1-CB 3.33Å; Y279-E317 HydrophobicContact CD1-CG 4.08Å; Y279-E317 HydrophobicContact CD2-CB 4.22Å; Y279-E317 HydrophobicContact CE1-CB 3.54Å; Y279-E317 HydrophobicContact CE1-CG 3.8Å; Y279-E317 HydrophobicContact CE2-CB 4.42Å; Y279-E317 HydrophobicContact CG-CB 3.68Å; A313-E317 PolarHBondContact O-N 2.97Å; E317-I319 VanDerWaalsContact C-N 3.31Å; E317-I319 PolarHBondContact O-N 3.42Å; E317-T320 PolarHBondContact O-N 3.27Å; E317-R321 VanDerWaalsContact O-CB 3.31Å; E317-R321 WeakPolarHBondContact O-CB 3.12Å; E317-R321 WeakPolarHBondContact O-CG 3.42Å; E317-R321 PolarHBondContact O-N 2.87Å; E317-R321 IonicContact OE1-NH2 3.26Å; E317-R321 IonicContact OE2-CZ 3.59Å; E317-R321 IonicContact OE2-NE 3.01Å; E317-R321 PolarHBondContact OE2-NE 3.34Å; E317-R321 IonicContact OE2-NH2 2.69Å; E317-R321 PolarHBondContact OE2-NH2 3.31Å; E317-R321 VanDerWaalsContact OE2-NH2 3.13Å
318	A	94.1	Very high	92.9	Very high	6 Å²	6	34.8 Å²	34.8	5%	0.05	18%	0.177	C	C	.	.	H	α-helix	trans	-61.2	-37.7	176	0	0	0	0	0	112.8	M314 I315 E316 A322 F441	M314-A318 WeakPolarHBondContact O-CB 3.42Å; M314-A318 PolarHBondContact O-N 3.02Å; I315-A318 WeakPolarHBondContact O-CB 3.46Å; I315-A318 PolarHBondContact O-N 3.33Å; E316-A318 VanDerWaalsContact C-N 3.33Å; E316-A318 PolarHBondContact O-N 3.34Å; A318-A322 WeakPolarHBondContact O-CB 3.49Å; A318-A322 PolarHBondContact O-N 3.23Å; A318-F441 HydrophobicContact CB-CD2 3.87Å; A318-F441 HydrophobicContact CB-CE2 4.02Å
319	I	92.4	Very high	92.8	Very high	52 Å²	52	34.6 Å²	34.6	27%	0.267	18%	0.175	S	C	.	.	H	α-helix	trans	-71.8	-46.3	173.7	-65.2	170.2	0	0	0	110.6	L113 I315 E316 E317 R321 A322 V327 Y329 F441	L113-I319 HydrophobicContact CD1-CD1 4Å; I315-I319 HydrophobicContact CG2-CD1 3.79Å; I315-I319 HydrophobicContact CG2-CG1 4.36Å; I315-I319 WeakPolarHBondContact O-CG1 3.39Å; I315-I319 PolarHBondContact O-N 2.91Å; E316-I319 PolarHBondContact O-N 2.96Å; E317-I319 VanDerWaalsContact C-N 3.31Å; E317-I319 PolarHBondContact O-N 3.42Å; I319-R321 VanDerWaalsContact C-N 3.29Å; I319-R321 PolarHBondContact O-N 3.3Å; I319-A322 WeakPolarHBondContact O-CB 3.38Å; I319-A322 PolarHBondContact O-N 3.09Å; I319-A322 VanDerWaalsContact O-N 3.16Å; I319-V327 HydrophobicContact CD1-CB 4.23Å; I319-V327 HydrophobicContact CD1-CG1 4.32Å; I319-V327 HydrophobicContact CG1-CB 4.22Å; I319-V327 HydrophobicContact CG1-CG2 4.01Å; I319-Y329 HydrophobicContact CD1-CE2 4.45Å; I319-F441 HydrophobicContact CD1-CE2 4.44Å; I319-F441 HydrophobicContact CD1-CZ 4.08Å; I319-F441 HydrophobicContact CG1-CE2 3.76Å; I319-F441 HydrophobicContact CG1-CZ 3.71Å
320	T	90.8	Very high	92.5	Very high	102 Å²	102	32.3 Å²	32.3	63%	0.626	16%	0.164	S	C	*	.	H	α-helix	trans	-64.7	-31.2	-176.9	-58.8	0	0	0	0	112.8	E316 E317	E316-T320 WeakPolarHBondContact O-CB 3.45Å; E316-T320 PolarHBondContact O-N 3.06Å; E316-T320 PolarHBondContact O-OG1 2.77Å; E317-T320 PolarHBondContact O-N 3.27Å
321	R	90.6	Very high	92	Very high	120 Å²	120	34.9 Å²	34.9	45%	0.453	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.3	-3.2	176.5	-56.3	-61.4	-172.8	102.8	12.6	113.7	E277 Y279 E317 I319 E323	E277-R321 IonicContact OE2-CZ 3.8Å; E277-R321 IonicContact OE2-NH1 3.34Å; E277-R321 PolarHBondContact OE2-NH1 3.18Å; Y279-R321 HydrophobicContact CD2-CG 4.01Å; Y279-R321 HydrophobicContact CE2-CG 3.88Å; Y279-R321 PolarHBondContact OH-NH2 3.23Å; E317-R321 VanDerWaalsContact O-CB 3.31Å; E317-R321 WeakPolarHBondContact O-CB 3.12Å; E317-R321 WeakPolarHBondContact O-CG 3.42Å; E317-R321 PolarHBondContact O-N 2.87Å; E317-R321 IonicContact OE1-NH2 3.26Å; E317-R321 IonicContact OE2-CZ 3.59Å; E317-R321 IonicContact OE2-NE 3.01Å; E317-R321 PolarHBondContact OE2-NE 3.34Å; E317-R321 IonicContact OE2-NH2 2.69Å; E317-R321 PolarHBondContact OE2-NH2 3.31Å; E317-R321 VanDerWaalsContact OE2-NH2 3.13Å; I319-R321 VanDerWaalsContact C-N 3.29Å; I319-R321 PolarHBondContact O-N 3.3Å; R321-E323 PolarHBondContact O-N 3.3Å; R321-E323 VanDerWaalsContact O-N 3.12Å
322	A	89.3	Confident	91.2	Very high	16 Å²	16	36.7 Å²	36.7	13%	0.132	19%	0.188	C	C	.	.			trans	-74.2	102.9	-178.2	0	0	0	0	0	111.9	A318 I319 F325	A318-A322 WeakPolarHBondContact O-CB 3.49Å; A318-A322 PolarHBondContact O-N 3.23Å; I319-A322 WeakPolarHBondContact O-CB 3.38Å; I319-A322 PolarHBondContact O-N 3.09Å; I319-A322 VanDerWaalsContact O-N 3.16Å; A322-F325 HydrophobicContact CB-CD1 4.21Å; A322-F325 HydrophobicContact CB-CD2 4.32Å; A322-F325 HydrophobicContact CB-CE1 3.98Å; A322-F325 HydrophobicContact CB-CE2 4.09Å; A322-F325 HydrophobicContact CB-CG 4.38Å; A322-F325 HydrophobicContact CB-CZ 3.91Å; A322-F325 WeakPolarHBondContact CB-O 3.45Å
323	E	87.2	Confident	89.9	Confident	160 Å²	160	40.4 Å²	40.4	75%	0.748	22%	0.222	S	C	*	.	S	Bend	trans	-78	-31.2	175.2	-65.1	-170.4	169.2	0	0	113.4	R321 K390	R321-E323 PolarHBondContact O-N 3.3Å; R321-E323 VanDerWaalsContact O-N 3.12Å; E323-K390 WeakPolarHBondContact O-CD 3.43Å; E323-K390 WeakPolarHBondContact O-CE 3.49Å; E323-K390 PolarHBondContact O-NZ 3.32Å
324	T	86.6	Confident	88.6	Confident	50 Å²	50	45.4 Å²	45.4	31%	0.307	25%	0.252	S	S	.	.	S	Bend	trans	-93.3	-25.3	-167.9	50.6	0	0	0	0	114.1	K390	T324-K390 PolarHBondContact O-N 2.96Å; T324-K390 VanDerWaalsContact O-N 3.1Å
325	F	91.7	Very high	87.3	Confident	8 Å²	8	55.2 Å²	55.2	4%	0.035	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	162.5	-177.1	69.4	-90.3	0	0	0	112.6	A322 V327 Y355 L387 G388 F389 I438 F441	A322-F325 HydrophobicContact CB-CD1 4.21Å; A322-F325 HydrophobicContact CB-CD2 4.32Å; A322-F325 HydrophobicContact CB-CE1 3.98Å; A322-F325 HydrophobicContact CB-CE2 4.09Å; A322-F325 HydrophobicContact CB-CG 4.38Å; A322-F325 HydrophobicContact CB-CZ 3.91Å; A322-F325 WeakPolarHBondContact CB-O 3.45Å; F325-V327 HydrophobicContact CD2-CG2 3.68Å; F325-V327 HydrophobicContact CE2-CG2 3.56Å; F325-Y355 VanDerWaalsContact C-CE1 3.48Å; F325-L387 HydrophobicContact CD2-CD2 4.08Å; F325-L387 HydrophobicContact CE2-CD2 4.43Å; F325-G388 CarbonylContact C-O 3.48Å; F325-G388 WeakPolarHBondContact CA-O 3.07Å; F325-G388 WeakPolarHBondContact CB-O 3.47Å; F325-F389 HydrophobicContact CB-CD1 3.6Å; F325-F389 HydrophobicContact CB-CE1 3.48Å; F325-F389 VanDerWaalsContact CB-CE1 3.48Å; F325-F389 HydrophobicContact CB-CZ 4.38Å; F325-F389 HydrophobicContact CG-CE1 4.27Å; F325-I438 HydrophobicContact CD1-CD1 4.49Å; F325-I438 HydrophobicContact CD1-CG1 3.72Å; F325-I438 HydrophobicContact CE1-CG1 3.88Å; F325-F441 HydrophobicContact CE2-CB 4.49Å; F325-F441 AromaticContact CE2-CD1 3.85Å; F325-F441 HydrophobicContact CE2-CD1 3.85Å; F325-F441 HydrophobicContact CE2-CD2 4.4Å; F325-F441 HydrophobicContact CE2-CE1 4.26Å; F325-F441 AromaticContact CE2-CG 3.95Å; F325-F441 HydrophobicContact CE2-CG 3.95Å; F325-F441 HydrophobicContact CZ-CB 4.01Å; F325-F441 HydrophobicContact CZ-CD1 4.23Å; F325-F441 HydrophobicContact CZ-CD2 4.28Å; F325-F441 AromaticContact CZ-CG 3.88Å; F325-F441 HydrophobicContact CZ-CG 3.88Å
326	S	92.6	Very high	86.2	Confident	15 Å²	15	57.7 Å²	57.7	11%	0.105	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	158.4	171.2	179.9	0	0	0	0	110.2	H352 Y355 L387 G388	S326-H352 PolarHBondContact OG-CD2 3.48Å; S326-H352 PolarHBondContact OG-ND1 3.42Å; S326-Y355 VanDerWaalsContact CB-CG 3.47Å; S326-L387 WeakPolarHBondContact O-CA 3.3Å; S326-G388 PolarHBondContact N-O 3.47Å; S326-G388 PolarHBondContact O-N 3.45Å
327	V	93.2	Very high	85.6	Confident	13 Å²	13	64 Å²	64	8%	0.079	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	140.3	-159.6	-174.4	0	0	0	0	110.9	I319 F325 Y329 H352 L385 L387 F441	I319-V327 HydrophobicContact CD1-CB 4.23Å; I319-V327 HydrophobicContact CD1-CG1 4.32Å; I319-V327 HydrophobicContact CG1-CB 4.22Å; I319-V327 HydrophobicContact CG1-CG2 4.01Å; F325-V327 HydrophobicContact CD2-CG2 3.68Å; F325-V327 HydrophobicContact CE2-CG2 3.56Å; V327-Y329 HydrophobicContact CG1-CD2 4.01Å; V327-Y329 HydrophobicContact CG1-CE2 3.54Å; V327-H352 PolarHBondContact O-CE1 3.48Å; V327-H352 VanDerWaalsContact O-CE1 3.3Å; V327-L385 HydrophobicContact CG1-CD1 3.71Å; V327-L387 HydrophobicContact CB-CD2 4.32Å; V327-L387 HydrophobicContact CG1-CD2 4.22Å; V327-L387 HydrophobicContact CG2-CD2 3.77Å; V327-F441 HydrophobicContact CB-CE1 4.33Å; V327-F441 HydrophobicContact CB-CZ 4.38Å; V327-F441 HydrophobicContact CG1-CE1 3.73Å; V327-F441 HydrophobicContact CG1-CZ 3.89Å; V327-F441 HydrophobicContact CG2-CD1 4.38Å; V327-F441 HydrophobicContact CG2-CE1 3.6Å; V327-F441 HydrophobicContact CG2-CZ 3.76Å
328	M	91.6	Very high	84.9	Confident	9 Å²	9	65.5 Å²	65.5	4%	0.044	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	129.1	167.6	-164.9	172.5	77.2	0	0	110.1	T110 V344 V347 F348 T386	T110-M328 HydrophobicContact CG2-CG 3.76Å; T110-M328 HydrophobicContact CG2-SD 3.74Å; M328-V344 HydrophobicContact CE-CG1 3.69Å; M328-V344 WeakPolarHBondContact CE-O 3.41Å; M328-V347 HydrophobicContact CE-CG1 4.39Å; M328-V347 HydrophobicContact SD-CG1 4.24Å; M328-F348 HydrophobicContact CB-CD2 3.6Å; M328-F348 HydrophobicContact CB-CE2 3.91Å; M328-F348 HydrophobicContact CE-CB 3.97Å; M328-F348 HydrophobicContact CE-CD2 4.29Å; M328-F348 HydrophobicContact SD-CB 4.43Å; M328-F348 HydrophobicContact SD-CD2 4.25Å; M328-T386 PolarHBondContact N-O 3.25Å; M328-T386 PolarHBondContact O-N 2.93Å
329	Y	90.4	Very high	84.4	Confident	24 Å²	24	68.7 Å²	68.7	9%	0.094	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	121.2	172.5	-67.1	-82.7	0	0	0	109	I319 V327 H367 L369 L384 L385 F441 T445	I319-Y329 HydrophobicContact CD1-CE2 4.45Å; V327-Y329 HydrophobicContact CG1-CD2 4.01Å; V327-Y329 HydrophobicContact CG1-CE2 3.54Å; Y329-H367 HydrophobicContact CE1-CB 4.45Å; Y329-L369 HydrophobicContact CD1-CD2 3.96Å; Y329-L369 HydrophobicContact CD1-CG 4.49Å; Y329-L369 HydrophobicContact CD2-CD1 4.43Å; Y329-L369 HydrophobicContact CD2-CD2 4.06Å; Y329-L369 HydrophobicContact CE1-CD2 3.87Å; Y329-L369 HydrophobicContact CE2-CD2 3.99Å; Y329-L369 HydrophobicContact CG-CD1 4.17Å; Y329-L369 HydrophobicContact CG-CD2 4.06Å; Y329-L384 WeakPolarHBondContact CA-O 3.48Å; Y329-L385 HydrophobicContact CD1-CD1 4.21Å; Y329-L385 HydrophobicContact CE1-CB 4.46Å; Y329-L385 HydrophobicContact CE1-CD1 3.75Å; Y329-F441 HydrophobicContact CE2-CZ 4.42Å; Y329-F441 WeakPolarHBondContact OH-CE1 3.35Å; Y329-F441 VanDerWaalsContact OH-CZ 3.32Å; Y329-F441 WeakPolarHBondContact OH-CZ 3.36Å; Y329-T445 HydrophobicContact CE1-CG2 4.12Å; Y329-T445 WeakPolarHBondContact OH-CG2 3.43Å; Y329-T445 PolarHBondContact OH-OG1 3.3Å
330	T	88.7	Confident	83.9	Confident	10 Å²	10	70 Å²	70	6%	0.061	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	121	176.3	-52.8	0	0	0	0	110.1	V344 Y383 L384	T330-V344 HydrophobicContact CG2-CG2 3.96Å; T330-Y383 CarbonylContact O-C 3.58Å; T330-Y383 WeakPolarHBondContact O-CA 3.31Å; T330-L384 PolarHBondContact N-O 3.38Å; T330-L384 PolarHBondContact O-N 3.03Å
331	P	87.1	Confident	83.6	Confident	54 Å²	54	66.4 Å²	66.4	35%	0.351	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	144	-179.5	27.8	-34.3	0	0	0	111.3	Y383	P331-Y383 HydrophobicContact CB-CD1 4.07Å; P331-Y383 HydrophobicContact CB-CE1 3.81Å; P331-Y383 HydrophobicContact CG-CE1 4.38Å
332	F	78.8	Confident	83.5	Confident	39 Å²	39	65.9 Å²	65.9	17%	0.171	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	154.8	171.7	71.6	-91.2	0	0	0	112.2	T334 I336 L366 Q381 Q382 Y383 L384	F332-T334 WeakPolarHBondContact CD2-O 3.4Å; F332-I336 HydrophobicContact CB-CD1 4.06Å; F332-I336 HydrophobicContact CB-CG1 4.15Å; F332-I336 HydrophobicContact CD1-CD1 3.63Å; F332-I336 HydrophobicContact CD1-CG1 4.33Å; F332-I336 HydrophobicContact CD2-CD1 4.21Å; F332-I336 HydrophobicContact CD2-CG1 4.02Å; F332-I336 HydrophobicContact CE1-CD1 4.04Å; F332-I336 HydrophobicContact CG-CD1 3.71Å; F332-I336 HydrophobicContact CG-CG1 3.92Å; F332-L366 HydrophobicContact CZ-CD2 4.11Å; F332-Q381 PolarHBondContact O-NE2 3.12Å; F332-Q382 HydrophobicContact CD1-CB 4.42Å; F332-Q382 HydrophobicContact CE1-CB 3.87Å; F332-Q382 HydrophobicContact CE2-CB 4.08Å; F332-Q382 HydrophobicContact CZ-CB 3.67Å; F332-Q382 PolarHBondContact N-O 3.26Å; F332-Q382 VanDerWaalsContact N-O 3.09Å; F332-Y383 VanDerWaalsContact CE1-C 3.44Å; F332-L384 HydrophobicContact CD1-CB 4.13Å; F332-L384 HydrophobicContact CE1-CB 4.48Å
333	A	67.8	Low	83.5	Confident	95 Å²	95	69.6 Å²	69.6	79%	0.785	36%	0.364	S	S	*	.	S	Bend	trans	-119.7	-11.7	-178.4	0	0	0	0	0	113.9
334	T	67.9	Low	83.5	Confident	105 Å²	105	62.5 Å²	62.5	64%	0.644	33%	0.331	S	S	*	.	S	Bend	trans	-148.5	164.8	-178.9	49.4	0	0	0	0	110.5	F332 I336	F332-T334 WeakPolarHBondContact CD2-O 3.4Å; T334-I336 PolarHBondContact O-N 2.75Å
335	K	70.2	Confident	83.7	Confident	208 Å²	208	62.8 Å²	62.8	90%	0.904	33%	0.328	S	S	*	.	P	Polyproline II helix	trans	-50.4	123.2	-179.8	-73.6	-171.3	176.3	-176.7	0	111.5
336	I	71.9	Confident	83.7	Confident	51 Å²	51	67.2 Å²	67.2	26%	0.262	35%	0.349	S	S	.	.	P	Polyproline II helix	trans	-75.4	130.3	-170	-43.9	-176.7	0	0	0	110	F332 T334 K340 I341 L384	F332-I336 HydrophobicContact CB-CD1 4.06Å; F332-I336 HydrophobicContact CB-CG1 4.15Å; F332-I336 HydrophobicContact CD1-CD1 3.63Å; F332-I336 HydrophobicContact CD1-CG1 4.33Å; F332-I336 HydrophobicContact CD2-CD1 4.21Å; F332-I336 HydrophobicContact CD2-CG1 4.02Å; F332-I336 HydrophobicContact CE1-CD1 4.04Å; F332-I336 HydrophobicContact CG-CD1 3.71Å; F332-I336 HydrophobicContact CG-CG1 3.92Å; T334-I336 PolarHBondContact O-N 2.75Å; I336-K340 HydrophobicContact CG2-CB 3.92Å; I336-I341 HydrophobicContact CG2-CD1 4.46Å; I336-I341 HydrophobicContact CG2-CG1 3.82Å; I336-L384 HydrophobicContact CD1-CB 3.8Å; I336-L384 HydrophobicContact CD1-CD1 3.75Å; I336-L384 HydrophobicContact CD1-CD2 3.77Å; I336-L384 HydrophobicContact CD1-CG 3.97Å
337	R	79.7	Confident	83.6	Confident	159 Å²	159	68.4 Å²	68.4	60%	0.6	36%	0.355	S	S	*	.	P	Polyproline II helix	trans	-84.5	152.6	175.5	-68	170.1	42.3	151.8	-1.4	111.1	D339 K340 I341	R337-D339 VanDerWaalsContact C-N 3.28Å; R337-D339 VanDerWaalsContact CB-OD1 3.3Å; R337-D339 WeakPolarHBondContact CB-OD1 3.48Å; R337-D339 IonicContact CZ-OD1 3.33Å; R337-D339 VanDerWaalsContact CZ-OD1 3.23Å; R337-D339 IonicContact CZ-OD2 2.8Å; R337-D339 IonicContact NE-OD1 3.89Å; R337-D339 PolarHBondContact NE-OD1 2.87Å; R337-D339 IonicContact NE-OD2 3.1Å; R337-D339 PolarHBondContact NE-OD2 3.21Å; R337-D339 VanDerWaalsContact NH2-CG 3.33Å; R337-D339 IonicContact NH2-OD1 2.74Å; R337-D339 PolarHBondContact NH2-OD1 3.04Å; R337-D339 IonicContact NH2-OD2 2.77Å; R337-D339 PolarHBondContact NH2-OD2 2.8Å; R337-D339 PolarHBondContact O-N 3.16Å; R337-K340 WeakPolarHBondContact O-CB 3.24Å; R337-K340 PolarHBondContact O-N 3.17Å; R337-I341 PolarHBondContact O-N 3.12Å
338	A	81.6	Confident	83.5	Confident	79 Å²	79	67.8 Å²	67.8	65%	0.653	35%	0.352	S	S	*	.	H	α-helix	trans	-55.3	-39.6	178.3	0	0	0	0	0	113.3	K340 I341 E342	A338-K340 VanDerWaalsContact C-N 3.26Å; A338-K340 PolarHBondContact O-N 3.48Å; A338-I341 PolarHBondContact O-N 2.96Å; A338-I341 VanDerWaalsContact O-N 3.16Å; A338-E342 PolarHBondContact O-N 2.97Å; A338-E342 VanDerWaalsContact O-N 3.14Å
339	D	81.6	Confident	83.6	Confident	73 Å²	73	70.4 Å²	70.4	39%	0.39	37%	0.368	S	S	.	.	H	α-helix	trans	-61.7	-29.2	175	50.3	-86.6	0	0	0	113.9	R337 K343	R337-D339 VanDerWaalsContact C-N 3.28Å; R337-D339 VanDerWaalsContact CB-OD1 3.3Å; R337-D339 WeakPolarHBondContact CB-OD1 3.48Å; R337-D339 IonicContact CZ-OD1 3.33Å; R337-D339 VanDerWaalsContact CZ-OD1 3.23Å; R337-D339 IonicContact CZ-OD2 2.8Å; R337-D339 IonicContact NE-OD1 3.89Å; R337-D339 PolarHBondContact NE-OD1 2.87Å; R337-D339 IonicContact NE-OD2 3.1Å; R337-D339 PolarHBondContact NE-OD2 3.21Å; R337-D339 VanDerWaalsContact NH2-CG 3.33Å; R337-D339 IonicContact NH2-OD1 2.74Å; R337-D339 PolarHBondContact NH2-OD1 3.04Å; R337-D339 IonicContact NH2-OD2 2.77Å; R337-D339 PolarHBondContact NH2-OD2 2.8Å; R337-D339 PolarHBondContact O-N 3.16Å; D339-K343 WeakPolarHBondContact O-CG 3.4Å; D339-K343 PolarHBondContact O-N 3.16Å
340	K	83.1	Confident	83.7	Confident	79 Å²	79	76.1 Å²	76.1	34%	0.343	39%	0.394	S	S	.	.	H	α-helix	trans	-78.5	-35	174	-64.8	-164.8	173.8	-164.6	0	112.2	I336 R337 A338 E342 K343 V344	I336-K340 HydrophobicContact CG2-CB 3.92Å; R337-K340 WeakPolarHBondContact O-CB 3.24Å; R337-K340 PolarHBondContact O-N 3.17Å; A338-K340 VanDerWaalsContact C-N 3.26Å; A338-K340 PolarHBondContact O-N 3.48Å; K340-E342 VanDerWaalsContact C-N 3.33Å; K340-E342 PolarHBondContact O-N 2.86Å; K340-K343 PolarHBondContact O-N 3.3Å; K340-V344 WeakPolarHBondContact O-CG2 3.35Å; K340-V344 PolarHBondContact O-N 3.32Å
341	I	84.7	Confident	83.7	Confident	28 Å²	28	79 Å²	79	14%	0.144	41%	0.411	C	S	.	.	H	α-helix	trans	-62.3	-42.5	176.4	-66.1	164.8	0	0	0	110.3	I336 R337 A338 V344 K345 T361 T363	I336-I341 HydrophobicContact CG2-CD1 4.46Å; I336-I341 HydrophobicContact CG2-CG1 3.82Å; R337-I341 PolarHBondContact O-N 3.12Å; A338-I341 PolarHBondContact O-N 2.96Å; A338-I341 VanDerWaalsContact O-N 3.16Å; I341-V344 PolarHBondContact O-N 3.03Å; I341-K345 WeakPolarHBondContact O-CG 3.48Å; I341-K345 PolarHBondContact O-N 2.85Å; I341-T361 HydrophobicContact CG2-CG2 4.29Å; I341-T363 HydrophobicContact CD1-CG2 3.66Å
342	E	88.3	Confident	83.9	Confident	108 Å²	108	78.6 Å²	78.6	51%	0.505	41%	0.405	S	S	.	.	H	α-helix	trans	-70	-39.6	-179.8	-149.9	62.5	-162.7	0	0	112	A338 K340 V344 K345 E346	A338-E342 PolarHBondContact O-N 2.97Å; A338-E342 VanDerWaalsContact O-N 3.14Å; K340-E342 VanDerWaalsContact C-N 3.33Å; K340-E342 PolarHBondContact O-N 2.86Å; E342-V344 VanDerWaalsContact C-N 3.29Å; E342-V344 PolarHBondContact O-N 3.32Å; E342-K345 PolarHBondContact O-N 2.78Å; E342-K345 VanDerWaalsContact O-N 3.12Å; E342-K345 IonicContact OE2-NZ 3.15Å; E342-E346 PolarHBondContact O-N 3.28Å
343	K	88.2	Confident	84.5	Confident	94 Å²	94	81 Å²	81	41%	0.409	42%	0.424	S	S	.	.	H	α-helix	trans	-55.2	-42.5	169	-76.8	-177.2	177	-177.4	0	112.5	D104 D339 K340 E346 V347	D104-K343 IonicContact OD1-NZ 3.83Å; D104-K343 IonicContact OD2-NZ 3.84Å; D104-K343 PolarHBondContact OD2-NZ 3.46Å; D339-K343 WeakPolarHBondContact O-CG 3.4Å; D339-K343 PolarHBondContact O-N 3.16Å; K340-K343 PolarHBondContact O-N 3.3Å; K343-E346 PolarHBondContact O-N 3.47Å; K343-V347 WeakPolarHBondContact O-CG2 3.3Å; K343-V347 PolarHBondContact O-N 3.42Å
344	V	88.7	Confident	85.6	Confident	11 Å²	11	79.7 Å²	79.7	7%	0.067	41%	0.413	C	S	.	.	H	α-helix	trans	-64.1	-40.4	177	167.5	0	0	0	0	111.3	M328 T330 K340 I341 E342 V347 F348 L384 T386	M328-V344 HydrophobicContact CE-CG1 3.69Å; M328-V344 WeakPolarHBondContact CE-O 3.41Å; T330-V344 HydrophobicContact CG2-CG2 3.96Å; K340-V344 WeakPolarHBondContact O-CG2 3.35Å; K340-V344 PolarHBondContact O-N 3.32Å; I341-V344 PolarHBondContact O-N 3.03Å; E342-V344 VanDerWaalsContact C-N 3.29Å; E342-V344 PolarHBondContact O-N 3.32Å; V344-V347 PolarHBondContact O-N 2.86Å; V344-F348 PolarHBondContact O-N 2.71Å; V344-L384 HydrophobicContact CG1-CD2 4.2Å; V344-L384 HydrophobicContact CG2-CD2 4.36Å; V344-T386 WeakPolarHBondContact CG1-OG1 3.37Å
345	K	90.3	Very high	86.7	Confident	56 Å²	56	76.6 Å²	76.6	24%	0.243	39%	0.39	C	S	.	.	H	α-helix	trans	-66.2	-41.3	174.2	-69.6	178.8	178.9	177.3	0	112.7	I341 E342 V347 F348 V349 I359	I341-K345 WeakPolarHBondContact O-CG 3.48Å; I341-K345 PolarHBondContact O-N 2.85Å; E342-K345 PolarHBondContact O-N 2.78Å; E342-K345 VanDerWaalsContact O-N 3.12Å; E342-K345 IonicContact OE2-NZ 3.15Å; K345-V347 VanDerWaalsContact C-N 3.3Å; K345-V347 PolarHBondContact O-N 2.91Å; K345-F348 WeakPolarHBondContact O-CB 3.45Å; K345-F348 PolarHBondContact O-N 2.91Å; K345-V349 WeakPolarHBondContact O-CG2 3.45Å; K345-V349 PolarHBondContact O-N 2.87Å; K345-I359 HydrophobicContact CG-CG2 4.03Å
346	E	91.1	Very high	87.7	Confident	102 Å²	102	69.6 Å²	69.6	48%	0.477	36%	0.364	S	S	.	.	H	α-helix	trans	-59.1	-40.6	174.4	-77.6	-172.6	-145.6	0	0	112.6	E342 K343 K350	E342-E346 PolarHBondContact O-N 3.28Å; K343-E346 PolarHBondContact O-N 3.47Å; E346-K350 VanDerWaalsContact O-CD 3.28Å; E346-K350 WeakPolarHBondContact O-CD 3.49Å; E346-K350 WeakPolarHBondContact O-CE 3.07Å; E346-K350 VanDerWaalsContact O-CG 3.28Å; E346-K350 WeakPolarHBondContact O-CG 3.34Å; E346-K350 PolarHBondContact O-N 2.88Å; E346-K350 IonicContact OE2-NZ 3.29Å; E346-K350 PolarHBondContact OE2-NZ 3.2Å
347	V	91	Very high	88.5	Confident	39 Å²	39	71.5 Å²	71.5	24%	0.236	38%	0.375	C	S	.	.	H	α-helix	trans	-68.1	-43.2	174.7	173.4	0	0	0	0	110.4	V108 M328 K343 V344 K345 V349 K350 T351	V108-V347 HydrophobicContact CG1-CB 4.36Å; V108-V347 HydrophobicContact CG1-CG1 3.95Å; V108-V347 HydrophobicContact CG1-CG2 4.22Å; M328-V347 HydrophobicContact CE-CG1 4.39Å; M328-V347 HydrophobicContact SD-CG1 4.24Å; K343-V347 WeakPolarHBondContact O-CG2 3.3Å; K343-V347 PolarHBondContact O-N 3.42Å; V344-V347 PolarHBondContact O-N 2.86Å; K345-V347 VanDerWaalsContact C-N 3.3Å; K345-V347 PolarHBondContact O-N 2.91Å; V347-V349 VanDerWaalsContact C-N 3.32Å; V347-V349 PolarHBondContact O-N 3.49Å; V347-K350 PolarHBondContact O-N 3.26Å; V347-K350 VanDerWaalsContact O-N 3.08Å; V347-T351 PolarHBondContact O-N 2.71Å; V347-T351 PolarHBondContact O-OG1 3.02Å; V347-T351 VanDerWaalsContact O-OG1 3.11Å
348	F	91.9	Very high	89	Confident	0 Å²	0	64.6 Å²	64.6	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-56.5	-44.5	175.6	-169.9	-79.2	0	0	0	112.3	M328 V344 K345 K350 T351 H352 I359 T386 G388	M328-F348 HydrophobicContact CB-CD2 3.6Å; M328-F348 HydrophobicContact CB-CE2 3.91Å; M328-F348 HydrophobicContact CE-CB 3.97Å; M328-F348 HydrophobicContact CE-CD2 4.29Å; M328-F348 HydrophobicContact SD-CB 4.43Å; M328-F348 HydrophobicContact SD-CD2 4.25Å; V344-F348 PolarHBondContact O-N 2.71Å; K345-F348 WeakPolarHBondContact O-CB 3.45Å; K345-F348 PolarHBondContact O-N 2.91Å; F348-K350 VanDerWaalsContact C-N 3.28Å; F348-K350 PolarHBondContact O-N 2.8Å; F348-T351 PolarHBondContact O-N 3.03Å; F348-H352 HydrophobicContact CD1-CB 4.17Å; F348-H352 AromaticContact CD2-ND1 3.66Å; F348-H352 HydrophobicContact CE1-CB 3.64Å; F348-H352 HydrophobicContact CE2-CB 4.48Å; F348-H352 AromaticContact CE2-ND1 3.27Å; F348-H352 VanDerWaalsContact CE2-ND1 3.27Å; F348-H352 WeakPolarHBondContact CE2-ND1 3.43Å; F348-H352 HydrophobicContact CZ-CB 3.81Å; F348-H352 AromaticContact CZ-CG 3.97Å; F348-H352 AromaticContact CZ-ND1 3.44Å; F348-H352 WeakPolarHBondContact CZ-ND1 3.35Å; F348-H352 PolarHBondContact O-N 3.4Å; F348-I359 HydrophobicContact CD1-CD1 3.9Å; F348-I359 HydrophobicContact CD1-CG1 4.21Å; F348-I359 HydrophobicContact CD1-CG2 4.33Å; F348-I359 HydrophobicContact CG-CG2 4.5Å; F348-T386 HydrophobicContact CB-CG2 4.13Å; F348-T386 HydrophobicContact CD2-CG2 3.53Å; F348-T386 HydrophobicContact CE2-CG2 4.15Å; F348-T386 HydrophobicContact CG-CG2 3.86Å; F348-G388 VanDerWaalsContact CZ-N 3.26Å
349	V	92.9	Very high	89.4	Confident	65 Å²	65	62 Å²	62	39%	0.394	33%	0.326	S	S	.	.	H	α-helix	trans	-59.2	-38.5	176.6	168.4	0	0	0	0	111.9	K345 V347 P353 V356 I359	K345-V349 WeakPolarHBondContact O-CG2 3.45Å; K345-V349 PolarHBondContact O-N 2.87Å; V347-V349 VanDerWaalsContact C-N 3.32Å; V347-V349 PolarHBondContact O-N 3.49Å; V349-P353 WeakPolarHBondContact O-CA 3.47Å; V349-V356 HydrophobicContact CB-CG1 4.35Å; V349-V356 HydrophobicContact CG1-CG1 4.31Å; V349-V356 HydrophobicContact CG2-CG1 4.02Å; V349-I359 HydrophobicContact CG2-CD1 3.46Å; V349-I359 VanDerWaalsContact CG2-CD1 3.46Å
350	K	91.9	Very high	89.8	Confident	144 Å²	144	59.1 Å²	59.1	63%	0.626	31%	0.309	S	S	*	.	H	α-helix	trans	-72.4	-39	179.4	-67.1	159.6	-166.9	161.8	0	111.7	E346 V347 F348	E346-K350 VanDerWaalsContact O-CD 3.28Å; E346-K350 WeakPolarHBondContact O-CD 3.49Å; E346-K350 WeakPolarHBondContact O-CE 3.07Å; E346-K350 VanDerWaalsContact O-CG 3.28Å; E346-K350 WeakPolarHBondContact O-CG 3.34Å; E346-K350 PolarHBondContact O-N 2.88Å; E346-K350 IonicContact OE2-NZ 3.29Å; E346-K350 PolarHBondContact OE2-NZ 3.2Å; V347-K350 PolarHBondContact O-N 3.26Å; V347-K350 VanDerWaalsContact O-N 3.08Å; F348-K350 VanDerWaalsContact C-N 3.28Å; F348-K350 PolarHBondContact O-N 2.8Å
351	T	89.5	Confident	90	Very high	70 Å²	70	56 Å²	56	43%	0.429	30%	0.297	S	S	.	.	H	α-helix	trans	-80.4	-35.8	-178.9	-49.5	0	0	0	0	113	V347 F348 P353	V347-T351 PolarHBondContact O-N 2.71Å; V347-T351 PolarHBondContact O-OG1 3.02Å; V347-T351 VanDerWaalsContact O-OG1 3.11Å; F348-T351 PolarHBondContact O-N 3.03Å; T351-P353 VanDerWaalsContact C-CD 3.43Å; T351-P353 WeakPolarHBondContact O-CD 3.23Å
352	H	90.6	Very high	90.1	Very high	46 Å²	46	54.8 Å²	54.8	21%	0.213	29%	0.291	C	S	.	.			trans	-128.6	56.7	-172.3	-55.8	133.8	0	0	0	113	S326 V327 F348 A354 Y355	S326-H352 PolarHBondContact OG-CD2 3.48Å; S326-H352 PolarHBondContact OG-ND1 3.42Å; V327-H352 PolarHBondContact O-CE1 3.48Å; V327-H352 VanDerWaalsContact O-CE1 3.3Å; F348-H352 HydrophobicContact CD1-CB 4.17Å; F348-H352 AromaticContact CD2-ND1 3.66Å; F348-H352 HydrophobicContact CE1-CB 3.64Å; F348-H352 HydrophobicContact CE2-CB 4.48Å; F348-H352 AromaticContact CE2-ND1 3.27Å; F348-H352 VanDerWaalsContact CE2-ND1 3.27Å; F348-H352 WeakPolarHBondContact CE2-ND1 3.43Å; F348-H352 HydrophobicContact CZ-CB 3.81Å; F348-H352 AromaticContact CZ-CG 3.97Å; F348-H352 AromaticContact CZ-ND1 3.44Å; F348-H352 WeakPolarHBondContact CZ-ND1 3.35Å; F348-H352 PolarHBondContact O-N 3.4Å; H352-A354 PolarHBondContact O-N 2.84Å; H352-Y355 HydrophobicContact CB-CD2 4.42Å; H352-Y355 PolarHBondContact O-N 3.02Å
353	P	91.5	Very high	89.5	Confident	90 Å²	90	53.3 Å²	53.3	58%	0.584	29%	0.289	S	S	*	.	G	3₁₀ helix	trans	-61.8	-17.9	-173.1	25.2	-35.8	0	0	0	114.7	V349 T351 Y355 V356	V349-P353 WeakPolarHBondContact O-CA 3.47Å; T351-P353 VanDerWaalsContact C-CD 3.43Å; T351-P353 WeakPolarHBondContact O-CD 3.23Å; P353-Y355 VanDerWaalsContact C-N 3.28Å; P353-Y355 PolarHBondContact O-N 2.9Å; P353-V356 WeakPolarHBondContact O-CG2 3.37Å
354	A	91.1	Very high	88.6	Confident	66 Å²	66	53.6 Å²	53.6	55%	0.545	29%	0.292	S	S	.	.	G	3₁₀ helix	trans	-80	-1.3	175.8	0	0	0	0	0	114.7	H352 K390	H352-A354 PolarHBondContact O-N 2.84Å; A354-K390 WeakPolarHBondContact O-CG 3.39Å
355	Y	91.2	Very high	87.7	Confident	40 Å²	40	53.2 Å²	53.2	16%	0.157	29%	0.291	C	S	.	.	G	3₁₀ helix	trans	-130.5	36.9	-171.6	-66.6	-84.8	0	0	0	112.4	F325 S326 H352 P353 G388 F389 K390	F325-Y355 VanDerWaalsContact C-CE1 3.48Å; S326-Y355 VanDerWaalsContact CB-CG 3.47Å; H352-Y355 HydrophobicContact CB-CD2 4.42Å; H352-Y355 PolarHBondContact O-N 3.02Å; P353-Y355 VanDerWaalsContact C-N 3.28Å; P353-Y355 PolarHBondContact O-N 2.9Å; Y355-G388 CarbonylContact O-C 3.26Å; Y355-G388 VanDerWaalsContact O-C 3.26Å; Y355-G388 WeakPolarHBondContact O-CA 3.44Å; Y355-F389 CarbonylContact C-O 3.35Å; Y355-F389 PolarHBondContact O-N 3.46Å; Y355-F389 VanDerWaalsContact O-N 3.09Å; Y355-K390 HydrophobicContact CD1-CD 4.37Å; Y355-K390 HydrophobicContact CD1-CG 3.78Å; Y355-K390 HydrophobicContact CE1-CD 3.87Å; Y355-K390 HydrophobicContact CE1-CG 3.8Å; Y355-K390 VanDerWaalsContact CZ-CE 3.42Å; Y355-K390 WeakPolarHBondContact OH-CE 3.44Å; Y355-K390 PolarHBondContact OH-NZ 3.43Å
356	V	91.5	Very high	87.1	Confident	61 Å²	61	54.5 Å²	54.5	37%	0.37	30%	0.3	S	S	.	.	B	Isolated β-bridge	trans	-104.6	-1.4	-169.6	-58	0	0	0	0	115.2	V349 P353 C358 I359	V349-V356 HydrophobicContact CB-CG1 4.35Å; V349-V356 HydrophobicContact CG1-CG1 4.31Å; V349-V356 HydrophobicContact CG2-CG1 4.02Å; P353-V356 WeakPolarHBondContact O-CG2 3.37Å; V356-C358 PolarHBondContact O-N 3.18Å; V356-I359 HydrophobicContact CB-CD1 4.45Å; V356-I359 HydrophobicContact CG1-CD1 4.37Å
357	D	88.3	Confident	87	Confident	92 Å²	92	49.7 Å²	49.7	49%	0.492	28%	0.277	S	S	.	.	S	Bend	trans	-61.1	-32.4	-177	-106	42.3	0	0	0	113	F389 K392	D357-F389 WeakPolarHBondContact CB-O 3.5Å; D357-F389 PolarHBondContact N-O 2.97Å; D357-K392 WeakPolarHBondContact O-CG 3.41Å; D357-K392 PolarHBondContact O-NZ 2.99Å
358	C	89.4	Confident	86.8	Confident	13 Å²	13	48.5 Å²	48.5	9%	0.088	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	138.8	161.6	-176.6	0	0	0	0	108.7	V356 F389 K392 G395	V356-C358 PolarHBondContact O-N 3.18Å; C358-F389 PolarHBondContact O-N 2.94Å; C358-K392 HydrophobicContact CB-CG 4.29Å; C358-G395 VanDerWaalsContact SG-CA 3.6Å
359	I	91.4	Very high	86.8	Confident	26 Å²	26	49 Å²	49	13%	0.133	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	104.1	174.7	-58.6	173.9	0	0	0	108.2	K345 F348 V349 V356 T386 L387	K345-I359 HydrophobicContact CG-CG2 4.03Å; F348-I359 HydrophobicContact CD1-CD1 3.9Å; F348-I359 HydrophobicContact CD1-CG1 4.21Å; F348-I359 HydrophobicContact CD1-CG2 4.33Å; F348-I359 HydrophobicContact CG-CG2 4.5Å; V349-I359 HydrophobicContact CG2-CD1 3.46Å; V349-I359 VanDerWaalsContact CG2-CD1 3.46Å; V356-I359 HydrophobicContact CB-CD1 4.45Å; V356-I359 HydrophobicContact CG1-CD1 4.37Å; I359-T386 HydrophobicContact CG2-CG2 3.56Å; I359-L387 CarbonylContact C-O 3.54Å; I359-L387 WeakPolarHBondContact CA-O 3.21Å
360	Y	89.7	Confident	86.6	Confident	11 Å²	11	46.1 Å²	46.1	4%	0.043	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	151.4	172.3	177.2	-100.8	0	0	0	110	D362 T386 L387 L398 E399 S402	Y360-D362 HydrophobicContact CE1-CB 3.85Å; Y360-T386 WeakPolarHBondContact O-CA 3.32Å; Y360-L387 HydrophobicContact CD1-CD1 4.33Å; Y360-L387 PolarHBondContact N-O 3.29Å; Y360-L387 PolarHBondContact O-N 3.45Å; Y360-L398 HydrophobicContact CD1-CB 4.25Å; Y360-L398 HydrophobicContact CD1-CD1 3.68Å; Y360-L398 HydrophobicContact CD2-CB 3.74Å; Y360-L398 HydrophobicContact CE1-CB 4.38Å; Y360-L398 HydrophobicContact CE1-CD1 4.14Å; Y360-L398 HydrophobicContact CE2-CB 3.9Å; Y360-L398 HydrophobicContact CG-CB 3.94Å; Y360-L398 HydrophobicContact CG-CD1 3.92Å; Y360-E399 HydrophobicContact CD2-CG 4.17Å; Y360-S402 WeakPolarHBondContact OH-CB 3.46Å
361	T	88	Confident	86.1	Confident	13 Å²	13	44.3 Å²	44.3	8%	0.08	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	118.9	175.9	-60.1	0	0	0	0	107.8	I341 T363 L384 L385 T386	I341-T361 HydrophobicContact CG2-CG2 4.29Å; T361-T363 VanDerWaalsContact C-N 3.34Å; T361-T363 HydrophobicContact CG2-CG2 4.34Å; T361-T363 PolarHBondContact O-N 2.84Å; T361-L384 HydrophobicContact CG2-CD1 3.52Å; T361-L384 HydrophobicContact CG2-CD2 3.83Å; T361-L384 HydrophobicContact CG2-CG 3.75Å; T361-L385 CarbonylContact C-O 3.58Å; T361-L385 WeakPolarHBondContact CA-O 3.48Å; T361-T386 PolarHBondContact OG1-OG1 3.09Å
362	D	85.1	Confident	85.4	Confident	3 Å²	3	42.5 Å²	42.5	2%	0.016	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	88.9	-180	-163.3	-14.5	0	0	0	110.1	Y360 Q364 G365 H367 L384 L385 Q446	Y360-D362 HydrophobicContact CE1-CB 3.85Å; D362-Q364 PolarHBondContact O-N 2.99Å; D362-Q364 PolarHBondContact OD1-N 3.39Å; D362-G365 VanDerWaalsContact CG-N 3.31Å; D362-G365 PolarHBondContact OD1-N 3.43Å; D362-H367 IonicContact OD2-NE2 2.88Å; D362-H367 PolarHBondContact OD2-NE2 3.32Å; D362-L384 VanDerWaalsContact O-CD1 3.28Å; D362-L384 WeakPolarHBondContact O-CD1 3.22Å; D362-L385 HydrophobicContact CB-CB 4.4Å; D362-L385 PolarHBondContact N-O 3.31Å; D362-Q446 PolarHBondContact OD2-NE2 3.23Å
363	T	76.1	Confident	84.4	Confident	77 Å²	77	40.3 Å²	40.3	47%	0.472	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	-6.6	178.1	64.2	0	0	0	0	113.8	I341 T361	I341-T363 HydrophobicContact CD1-CG2 3.66Å; T361-T363 VanDerWaalsContact C-N 3.34Å; T361-T363 HydrophobicContact CG2-CG2 4.34Å; T361-T363 PolarHBondContact O-N 2.84Å
364	Q	69.9	Low	83.6	Confident	101 Å²	101	39 Å²	39	47%	0.472	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	-25.8	-175.8	-57.1	-53.6	-58	0	0	112.2	D362 N450	D362-Q364 PolarHBondContact O-N 2.99Å; D362-Q364 PolarHBondContact OD1-N 3.39Å; Q364-N450 HydrophobicContact CB-CB 4.19Å; Q364-N450 PolarHBondContact OE1-ND2 2.92Å
365	G	69.3	Low	82.7	Confident	3 Å²	3	37.3 Å²	37.3	3%	0.031	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	126	178.6	0	0	0	0	0	113.5	D362 H367	D362-G365 VanDerWaalsContact CG-N 3.31Å; D362-G365 PolarHBondContact OD1-N 3.43Å; G365-H367 PolarHBondContact O-CD2 3.05Å; G365-H367 PolarHBondContact O-N 2.87Å
366	L	78.9	Confident	81.4	Confident	83 Å²	83	39 Å²	39	44%	0.435	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	89.7	168.4	-55	-177.1	0	0	0	108.4	F332	F332-L366 HydrophobicContact CZ-CD2 4.11Å
367	H	87.4	Confident	80.1	Confident	0 Å²	0	39 Å²	39	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	140.1	-179.2	-60.3	-95	0	0	0	111.8	Y329 D362 G365 Q382 Y383 L385 T445 Q446	Y329-H367 HydrophobicContact CE1-CB 4.45Å; D362-H367 IonicContact OD2-NE2 2.88Å; D362-H367 PolarHBondContact OD2-NE2 3.32Å; G365-H367 PolarHBondContact O-CD2 3.05Å; G365-H367 PolarHBondContact O-N 2.87Å; H367-Q382 CarbonylContact O-C 3.52Å; H367-Q382 WeakPolarHBondContact O-CA 3.5Å; H367-Y383 WeakPolarHBondContact CB-O 3.08Å; H367-Y383 PolarHBondContact N-O 3.19Å; H367-Y383 PolarHBondContact O-N 2.96Å; H367-L385 VanDerWaalsContact CE1-CD2 3.41Å; H367-L385 WeakPolarHBondContact CE1-CD2 3.44Å; H367-T445 CarbonylContact C-O 3.45Å; H367-T445 WeakPolarHBondContact CA-O 2.98Å; H367-T445 PolarHBondContact ND1-OG1 2.68Å; H367-Q446 PolarHBondContact CE1-NE2 3.13Å; H367-Q446 PolarHBondContact NE2-NE2 2.68Å; H367-Q446 VanDerWaalsContact NE2-NE2 3.16Å
368	V	88.3	Confident	78.9	Confident	15 Å²	15	41.8 Å²	41.8	9%	0.091	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	140.3	175.3	-173.5	0	0	0	0	108.4	A373 P380 T445	V368-A373 HydrophobicContact CG1-CB 3.8Å; V368-P380 HydrophobicContact CG1-CB 4.03Å; V368-P380 HydrophobicContact CG1-CG 4.24Å; V368-P380 HydrophobicContact CG2-CG 4.09Å; V368-T445 PolarHBondContact N-O 3.4Å; V368-T445 WeakPolarHBondContact O-CB 3.27Å
369	L	90.2	Very high	77.9	Confident	9 Å²	9	46.1 Å²	46.1	5%	0.047	25%	0.252	C	S	.	.			trans	-102.6	150.6	177.3	-66.6	179.9	0	0	0	110.6	I315 Y329 Q371 T372 A373 Y383 T445	I315-L369 HydrophobicContact CD1-CD2 4.4Å; Y329-L369 HydrophobicContact CD1-CD2 3.96Å; Y329-L369 HydrophobicContact CD1-CG 4.49Å; Y329-L369 HydrophobicContact CD2-CD1 4.43Å; Y329-L369 HydrophobicContact CD2-CD2 4.06Å; Y329-L369 HydrophobicContact CE1-CD2 3.87Å; Y329-L369 HydrophobicContact CE2-CD2 3.99Å; Y329-L369 HydrophobicContact CG-CD1 4.17Å; Y329-L369 HydrophobicContact CG-CD2 4.06Å; L369-Q371 PolarHBondContact O-N 3.21Å; L369-T372 CarbonylContact O-C 3.59Å; L369-T372 PolarHBondContact O-N 3.28Å; L369-T372 PolarHBondContact O-OG1 3.39Å; L369-A373 WeakPolarHBondContact O-CB 3.46Å; L369-A373 PolarHBondContact O-N 3.46Å; L369-Y383 HydrophobicContact CB-CD2 4.41Å; L369-Y383 HydrophobicContact CB-CE2 4.12Å; L369-Y383 HydrophobicContact CD1-CD1 4.11Å; L369-Y383 HydrophobicContact CD1-CD2 4.03Å; L369-Y383 HydrophobicContact CD1-CE1 3.93Å; L369-Y383 HydrophobicContact CD1-CE2 3.85Å; L369-Y383 HydrophobicContact CD1-CG 4.16Å; L369-Y383 HydrophobicContact CG-CD2 3.85Å; L369-Y383 HydrophobicContact CG-CE2 3.92Å; L369-Y383 HydrophobicContact CG-CG 4.27Å; L369-T445 HydrophobicContact CD2-CG2 3.92Å
370	P	88.9	Confident	77.2	Confident	5 Å²	5	45.4 Å²	45.4	3%	0.032	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-30.6	-179.6	7.6	-20.7	0	0	0	114.6	K308 W311 Q312 I315 T372	K308-P370 HydrophobicContact CB-CB 4.11Å; K308-P370 HydrophobicContact CG-CB 4.44Å; K308-P370 WeakPolarHBondContact O-CB 3.42Å; W311-P370 HydrophobicContact CB-CB 4.31Å; W311-P370 HydrophobicContact CB-CG 4.47Å; W311-P370 HydrophobicContact CD2-CB 3.73Å; W311-P370 HydrophobicContact CD2-CG 3.85Å; W311-P370 HydrophobicContact CE3-CB 3.53Å; W311-P370 HydrophobicContact CE3-CG 4.16Å; W311-P370 HydrophobicContact CG-CB 4.13Å; W311-P370 HydrophobicContact CG-CG 4.05Å; W311-P370 HydrophobicContact CZ3-CB 4.01Å; Q312-P370 HydrophobicContact CB-CB 4.16Å; Q312-P370 HydrophobicContact CB-CG 3.66Å; Q312-P370 HydrophobicContact CG-CG 4.45Å; I315-P370 HydrophobicContact CD1-CG 3.95Å; P370-T372 VanDerWaalsContact C-N 3.29Å; P370-T372 PolarHBondContact O-N 3.07Å
371	Q	81.3	Confident	76.9	Confident	107 Å²	107	48.7 Å²	48.7	50%	0.5	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-20.9	176.6	-63.5	-174.8	84.4	0	0	113.9	L369	L369-Q371 PolarHBondContact O-N 3.21Å
372	T	75.8	Confident	76.8	Confident	31 Å²	31	50.6 Å²	50.6	19%	0.19	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.9	-2.5	-178.2	65.6	0	0	0	0	113.8	L369 P370 D374 P380 Q381 Y383	L369-T372 CarbonylContact O-C 3.59Å; L369-T372 PolarHBondContact O-N 3.28Å; L369-T372 PolarHBondContact O-OG1 3.39Å; P370-T372 VanDerWaalsContact C-N 3.29Å; P370-T372 PolarHBondContact O-N 3.07Å; T372-D374 PolarHBondContact O-N 2.97Å; T372-P380 VanDerWaalsContact O-CB 3.23Å; T372-P380 WeakPolarHBondContact O-CB 3.36Å; T372-Q381 HydrophobicContact CG2-CB 3.92Å; T372-Q381 HydrophobicContact CG2-CG 4.31Å; T372-Q381 PolarHBondContact OG1-O 2.93Å; T372-Y383 HydrophobicContact CG2-CE2 3.97Å; T372-Y383 WeakPolarHBondContact CG2-OH 3.21Å
373	A	69.1	Low	76.9	Confident	1 Å²	1	52.2 Å²	52.2	1%	0.008	28%	0.279	C	S	.	.			trans	-75.8	46	-178.4	0	0	0	0	0	113.4	K308 W311 V368 L369 W375	K308-A373 WeakPolarHBondContact CE-O 3.37Å; K308-A373 PolarHBondContact NZ-O 2.97Å; W311-A373 HydrophobicContact CH2-CB 3.97Å; W311-A373 HydrophobicContact CZ3-CB 3.58Å; V368-A373 HydrophobicContact CG1-CB 3.8Å; L369-A373 WeakPolarHBondContact O-CB 3.46Å; L369-A373 PolarHBondContact O-N 3.46Å; A373-W375 HydrophobicContact CB-CZ2 3.85Å; A373-W375 VanDerWaalsContact O-CD1 3.27Å; A373-W375 PolarHBondContact O-N 2.94Å; A373-W375 VanDerWaalsContact O-N 3.09Å; A373-W375 PolarHBondContact O-NE1 3.12Å
374	D	74.9	Confident	77.5	Confident	63 Å²	63	48.8 Å²	48.8	34%	0.337	26%	0.257	S	S	.	.			trans	-79.1	92.1	171.9	-162.7	-21.8	0	0	0	110.4	T372 S376 S377	T372-D374 PolarHBondContact O-N 2.97Å; D374-S376 PolarHBondContact O-N 3.2Å; D374-S376 VanDerWaalsContact O-N 3.11Å; D374-S376 WeakPolarHBondContact OD1-CB 3.48Å; D374-S376 PolarHBondContact OD1-N 3.19Å; D374-S376 PolarHBondContact OD1-OG 3.08Å; D374-S377 CarbonylContact O-C 3.56Å; D374-S377 PolarHBondContact O-N 2.9Å; D374-S377 PolarHBondContact O-OG 3.24Å
375	W	71.7	Confident	78.5	Confident	30 Å²	30	44 Å²	44	11%	0.114	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-11	178.4	-49.4	107.2	0	0	0	114	D290 Y291 W294 A373 F378 P380 L447	D290-W375 PolarHBondContact OD2-NE1 3.32Å; Y291-W375 HydrophobicContact CD2-CD2 4.15Å; Y291-W375 HydrophobicContact CD2-CE3 4.18Å; Y291-W375 HydrophobicContact CD2-CH2 4.39Å; Y291-W375 HydrophobicContact CD2-CZ2 4.33Å; Y291-W375 HydrophobicContact CD2-CZ3 4.3Å; Y291-W375 HydrophobicContact CE2-CE3 4.42Å; W294-W375 HydrophobicContact CB-CB 4.17Å; W294-W375 HydrophobicContact CB-CG 4.49Å; W294-W375 AromaticContact CD1-CD1 3.32Å; W294-W375 HydrophobicContact CD2-CB 4.21Å; W294-W375 HydrophobicContact CG-CB 3.92Å; W294-W375 AromaticContact CG-CD1 3.87Å; W294-W375 HydrophobicContact CG-CG 4.22Å; W294-W375 AromaticContact NE1-CD1 3.75Å; A373-W375 HydrophobicContact CB-CZ2 3.85Å; A373-W375 VanDerWaalsContact O-CD1 3.27Å; A373-W375 PolarHBondContact O-N 2.94Å; A373-W375 VanDerWaalsContact O-N 3.09Å; A373-W375 PolarHBondContact O-NE1 3.12Å; W375-F378 HydrophobicContact CE3-CE2 4.29Å; W375-F378 HydrophobicContact CE3-CZ 4.08Å; W375-F378 WeakPolarHBondContact O-CD2 3.19Å; W375-F378 WeakPolarHBondContact O-CE2 3.37Å; W375-P380 HydrophobicContact CZ3-CG 4.44Å; W375-L447 HydrophobicContact CH2-CD1 3.35Å; W375-L447 HydrophobicContact CH2-CG 4.45Å; W375-L447 HydrophobicContact CZ2-CD1 4.04Å; W375-L447 HydrophobicContact CZ3-CD1 3.77Å
376	S	65	Low	79.6	Confident	74 Å²	74	43.8 Å²	43.8	52%	0.517	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-15.5	169.9	74.5	0	0	0	0	113.4	D374	D374-S376 PolarHBondContact O-N 3.2Å; D374-S376 VanDerWaalsContact O-N 3.11Å; D374-S376 WeakPolarHBondContact OD1-CB 3.48Å; D374-S376 PolarHBondContact OD1-N 3.19Å; D374-S376 PolarHBondContact OD1-OG 3.08Å
377	S	62.9	Low	80.2	Confident	62 Å²	62	39.9 Å²	39.9	43%	0.434	21%	0.213	S	C	.	.	S	Bend	trans	-121.7	110.2	178.4	66.2	0	0	0	0	111.7	D374	D374-S377 CarbonylContact O-C 3.56Å; D374-S377 PolarHBondContact O-N 2.9Å; D374-S377 PolarHBondContact O-OG 3.24Å
378	F	64.1	Low	80.5	Confident	151 Å²	151	39.9 Å²	39.9	66%	0.662	21%	0.213	S	C	*	.	S	Bend	trans	-107.7	140.9	-177.9	-98.8	-97.4	0	0	0	113.4	W375	W375-F378 HydrophobicContact CE3-CE2 4.29Å; W375-F378 HydrophobicContact CE3-CZ 4.08Å; W375-F378 WeakPolarHBondContact O-CD2 3.19Å; W375-F378 WeakPolarHBondContact O-CE2 3.37Å
379	P	68.1	Low	80.7	Confident	103 Å²	103	39.1 Å²	39.1	67%	0.669	21%	0.208	S	C	*	.	S	Bend	cis	-80.6	144.2	-8.3	33	-33.6	0	0	0	112.3
380	P	76.2	Confident	80.7	Confident	12 Å²	12	43.6 Å²	43.6	8%	0.078	23%	0.227	C	C	.	.	P	Polyproline II helix	trans	-65.4	154.6	170.1	28.5	-35.3	0	0	0	111.5	V368 T372 W375 Q382	V368-P380 HydrophobicContact CG1-CB 4.03Å; V368-P380 HydrophobicContact CG1-CG 4.24Å; V368-P380 HydrophobicContact CG2-CG 4.09Å; T372-P380 VanDerWaalsContact O-CB 3.23Å; T372-P380 WeakPolarHBondContact O-CB 3.36Å; W375-P380 HydrophobicContact CZ3-CG 4.44Å; P380-Q382 PolarHBondContact O-N 3.32Å
381	Q	84	Confident	80.5	Confident	80 Å²	80	46.6 Å²	46.6	37%	0.374	24%	0.243	S	C	.	.	P	Polyproline II helix	trans	-61.2	122.4	-179.7	173.6	60.9	68.3	0	0	111.2	F332 T372 Y383	F332-Q381 PolarHBondContact O-NE2 3.12Å; T372-Q381 HydrophobicContact CG2-CB 3.92Å; T372-Q381 HydrophobicContact CG2-CG 4.31Å; T372-Q381 PolarHBondContact OG1-O 2.93Å; Q381-Y383 HydrophobicContact CG-CE2 3.93Å; Q381-Y383 WeakPolarHBondContact O-CD2 3.44Å; Q381-Y383 WeakPolarHBondContact O-CE2 3.31Å
382	Q	85.1	Confident	80.8	Confident	52 Å²	52	46.4 Å²	46.4	24%	0.243	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	148.7	-175.9	-61.8	179	-11.1	0	0	112.3	F332 H367 P380	F332-Q382 HydrophobicContact CD1-CB 4.42Å; F332-Q382 HydrophobicContact CE1-CB 3.87Å; F332-Q382 HydrophobicContact CE2-CB 4.08Å; F332-Q382 HydrophobicContact CZ-CB 3.67Å; F332-Q382 PolarHBondContact N-O 3.26Å; F332-Q382 VanDerWaalsContact N-O 3.09Å; H367-Q382 CarbonylContact O-C 3.52Å; H367-Q382 WeakPolarHBondContact O-CA 3.5Å; P380-Q382 PolarHBondContact O-N 3.32Å
383	Y	87.8	Confident	81.1	Confident	37 Å²	37	49.7 Å²	49.7	15%	0.145	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	139.7	-178.9	-67.7	-94.1	0	0	0	111.6	T330 P331 F332 H367 L369 T372 Q381	T330-Y383 CarbonylContact O-C 3.58Å; T330-Y383 WeakPolarHBondContact O-CA 3.31Å; P331-Y383 HydrophobicContact CB-CD1 4.07Å; P331-Y383 HydrophobicContact CB-CE1 3.81Å; P331-Y383 HydrophobicContact CG-CE1 4.38Å; F332-Y383 VanDerWaalsContact CE1-C 3.44Å; H367-Y383 WeakPolarHBondContact CB-O 3.08Å; H367-Y383 PolarHBondContact N-O 3.19Å; H367-Y383 PolarHBondContact O-N 2.96Å; L369-Y383 HydrophobicContact CB-CD2 4.41Å; L369-Y383 HydrophobicContact CB-CE2 4.12Å; L369-Y383 HydrophobicContact CD1-CD1 4.11Å; L369-Y383 HydrophobicContact CD1-CD2 4.03Å; L369-Y383 HydrophobicContact CD1-CE1 3.93Å; L369-Y383 HydrophobicContact CD1-CE2 3.85Å; L369-Y383 HydrophobicContact CD1-CG 4.16Å; L369-Y383 HydrophobicContact CG-CD2 3.85Å; L369-Y383 HydrophobicContact CG-CE2 3.92Å; L369-Y383 HydrophobicContact CG-CG 4.27Å; T372-Y383 HydrophobicContact CG2-CE2 3.97Å; T372-Y383 WeakPolarHBondContact CG2-OH 3.21Å; Q381-Y383 HydrophobicContact CG-CE2 3.93Å; Q381-Y383 WeakPolarHBondContact O-CD2 3.44Å; Q381-Y383 WeakPolarHBondContact O-CE2 3.31Å
384	L	88.4	Confident	81.8	Confident	5 Å²	5	49.9 Å²	49.9	3%	0.026	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	119.4	166.7	-179.6	61.7	0	0	0	107.8	Y329 T330 F332 I336 V344 T361 D362	Y329-L384 WeakPolarHBondContact CA-O 3.48Å; T330-L384 PolarHBondContact N-O 3.38Å; T330-L384 PolarHBondContact O-N 3.03Å; F332-L384 HydrophobicContact CD1-CB 4.13Å; F332-L384 HydrophobicContact CE1-CB 4.48Å; I336-L384 HydrophobicContact CD1-CB 3.8Å; I336-L384 HydrophobicContact CD1-CD1 3.75Å; I336-L384 HydrophobicContact CD1-CD2 3.77Å; I336-L384 HydrophobicContact CD1-CG 3.97Å; V344-L384 HydrophobicContact CG1-CD2 4.2Å; V344-L384 HydrophobicContact CG2-CD2 4.36Å; T361-L384 HydrophobicContact CG2-CD1 3.52Å; T361-L384 HydrophobicContact CG2-CD2 3.83Å; T361-L384 HydrophobicContact CG2-CG 3.75Å; D362-L384 VanDerWaalsContact O-CD1 3.28Å; D362-L384 WeakPolarHBondContact O-CD1 3.22Å
385	L	90.9	Very high	82.1	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	119.6	174.4	175.6	58.7	0	0	0	110	V327 Y329 T361 D362 H367 L387 F441 I442	V327-L385 HydrophobicContact CG1-CD1 3.71Å; Y329-L385 HydrophobicContact CD1-CD1 4.21Å; Y329-L385 HydrophobicContact CE1-CB 4.46Å; Y329-L385 HydrophobicContact CE1-CD1 3.75Å; T361-L385 CarbonylContact C-O 3.58Å; T361-L385 WeakPolarHBondContact CA-O 3.48Å; D362-L385 HydrophobicContact CB-CB 4.4Å; D362-L385 PolarHBondContact N-O 3.31Å; H367-L385 VanDerWaalsContact CE1-CD2 3.41Å; H367-L385 WeakPolarHBondContact CE1-CD2 3.44Å; L385-L387 HydrophobicContact CD1-CD2 3.83Å; L385-L387 HydrophobicContact CD1-CG 4.17Å; L385-L387 HydrophobicContact CD2-CD1 4.38Å; L385-L387 HydrophobicContact CD2-CG 4.37Å; L385-L387 HydrophobicContact CG-CD2 4.29Å; L385-L387 HydrophobicContact CG-CG 4.1Å; L385-F441 HydrophobicContact CD1-CE1 4.47Å; L385-I442 HydrophobicContact CD2-CB 4.36Å; L385-I442 HydrophobicContact CD2-CG1 3.95Å; L385-I442 HydrophobicContact CD2-CG2 4.34Å
386	T	91.9	Very high	82.6	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	130	168.3	-61.9	0	0	0	0	109.5	M328 V344 F348 I359 Y360 T361	M328-T386 PolarHBondContact N-O 3.25Å; M328-T386 PolarHBondContact O-N 2.93Å; V344-T386 WeakPolarHBondContact CG1-OG1 3.37Å; F348-T386 HydrophobicContact CB-CG2 4.13Å; F348-T386 HydrophobicContact CD2-CG2 3.53Å; F348-T386 HydrophobicContact CE2-CG2 4.15Å; F348-T386 HydrophobicContact CG-CG2 3.86Å; I359-T386 HydrophobicContact CG2-CG2 3.56Å; Y360-T386 WeakPolarHBondContact O-CA 3.32Å; T361-T386 PolarHBondContact OG1-OG1 3.09Å
387	L	92.8	Very high	83.4	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	125	179	-64.3	178	0	0	0	109.8	F325 S326 V327 I359 Y360 L385 F389 L398 I438 F441 I442	F325-L387 HydrophobicContact CD2-CD2 4.08Å; F325-L387 HydrophobicContact CE2-CD2 4.43Å; S326-L387 WeakPolarHBondContact O-CA 3.3Å; V327-L387 HydrophobicContact CB-CD2 4.32Å; V327-L387 HydrophobicContact CG1-CD2 4.22Å; V327-L387 HydrophobicContact CG2-CD2 3.77Å; I359-L387 CarbonylContact C-O 3.54Å; I359-L387 WeakPolarHBondContact CA-O 3.21Å; Y360-L387 HydrophobicContact CD1-CD1 4.33Å; Y360-L387 PolarHBondContact N-O 3.29Å; Y360-L387 PolarHBondContact O-N 3.45Å; L385-L387 HydrophobicContact CD1-CD2 3.83Å; L385-L387 HydrophobicContact CD1-CG 4.17Å; L385-L387 HydrophobicContact CD2-CD1 4.38Å; L385-L387 HydrophobicContact CD2-CG 4.37Å; L385-L387 HydrophobicContact CG-CD2 4.29Å; L385-L387 HydrophobicContact CG-CG 4.1Å; L387-F389 HydrophobicContact CB-CE2 3.74Å; L387-F389 HydrophobicContact CB-CZ 3.66Å; L387-F389 HydrophobicContact CD1-CZ 4.03Å; L387-F389 HydrophobicContact CG-CZ 4.48Å; L387-L398 HydrophobicContact CD1-CD1 3.82Å; L387-I438 HydrophobicContact CD1-CG2 4.24Å; L387-F441 HydrophobicContact CD2-CD1 4.4Å; L387-F441 HydrophobicContact CD2-CE1 4.32Å; L387-I442 HydrophobicContact CD1-CD1 3.84Å; L387-I442 HydrophobicContact CD1-CG1 3.75Å
388	G	93.4	Very high	84.3	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	144.7	170.8	0	0	0	0	0	111.3	F325 S326 F348 Y355	F325-G388 CarbonylContact C-O 3.48Å; F325-G388 WeakPolarHBondContact CA-O 3.07Å; F325-G388 WeakPolarHBondContact CB-O 3.47Å; S326-G388 PolarHBondContact N-O 3.47Å; S326-G388 PolarHBondContact O-N 3.45Å; F348-G388 VanDerWaalsContact CZ-N 3.26Å; Y355-G388 CarbonylContact O-C 3.26Å; Y355-G388 VanDerWaalsContact O-C 3.26Å; Y355-G388 WeakPolarHBondContact O-CA 3.44Å
389	F	92.3	Very high	85.1	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	146.1	-176.5	-61.6	-80.1	0	0	0	112.5	F325 Y355 D357 C358 L387 N391 D394 L398 I438	F325-F389 HydrophobicContact CB-CD1 3.6Å; F325-F389 HydrophobicContact CB-CE1 3.48Å; F325-F389 VanDerWaalsContact CB-CE1 3.48Å; F325-F389 HydrophobicContact CB-CZ 4.38Å; F325-F389 HydrophobicContact CG-CE1 4.27Å; Y355-F389 CarbonylContact C-O 3.35Å; Y355-F389 PolarHBondContact O-N 3.46Å; Y355-F389 VanDerWaalsContact O-N 3.09Å; D357-F389 WeakPolarHBondContact CB-O 3.5Å; D357-F389 PolarHBondContact N-O 2.97Å; C358-F389 PolarHBondContact O-N 2.94Å; L387-F389 HydrophobicContact CB-CE2 3.74Å; L387-F389 HydrophobicContact CB-CZ 3.66Å; L387-F389 HydrophobicContact CD1-CZ 4.03Å; L387-F389 HydrophobicContact CG-CZ 4.48Å; F389-N391 VanDerWaalsContact C-N 3.27Å; F389-D394 HydrophobicContact CD1-CB 3.89Å; F389-D394 HydrophobicContact CE1-CB 4.36Å; F389-D394 HydrophobicContact CG-CB 4.3Å; F389-L398 HydrophobicContact CE2-CD1 3.97Å; F389-L398 HydrophobicContact CZ-CD1 3.53Å; F389-L398 HydrophobicContact CZ-CG 4.48Å; F389-I438 HydrophobicContact CD1-CD1 4.36Å; F389-I438 HydrophobicContact CE1-CD1 3.7Å; F389-I438 HydrophobicContact CE1-CG1 4.28Å; F389-I438 HydrophobicContact CE1-CG2 4.3Å; F389-I438 HydrophobicContact CZ-CG2 4.33Å
390	K	89.6	Confident	85.6	Confident	103 Å²	103	38.5 Å²	38.5	45%	0.448	18%	0.177	S	C	.	.	S	Bend	trans	-77.5	-10.8	164.9	-78.7	174.3	-171.2	151.9	0	113.5	E323 T324 A354 Y355	E323-K390 WeakPolarHBondContact O-CD 3.43Å; E323-K390 WeakPolarHBondContact O-CE 3.49Å; E323-K390 PolarHBondContact O-NZ 3.32Å; T324-K390 PolarHBondContact O-N 2.96Å; T324-K390 VanDerWaalsContact O-N 3.1Å; A354-K390 WeakPolarHBondContact O-CG 3.39Å; Y355-K390 HydrophobicContact CD1-CD 4.37Å; Y355-K390 HydrophobicContact CD1-CG 3.78Å; Y355-K390 HydrophobicContact CE1-CD 3.87Å; Y355-K390 HydrophobicContact CE1-CG 3.8Å; Y355-K390 VanDerWaalsContact CZ-CE 3.42Å; Y355-K390 WeakPolarHBondContact OH-CE 3.44Å; Y355-K390 PolarHBondContact OH-NZ 3.43Å
391	N	85.9	Confident	85.6	Confident	67 Å²	67	38.3 Å²	38.3	36%	0.358	18%	0.175	S	C	.	.	S	Bend	trans	-133.5	120.3	-180	-171	-53.9	0	0	0	110.4	F389 E393 D394 R434	F389-N391 VanDerWaalsContact C-N 3.27Å; N391-E393 PolarHBondContact O-N 2.91Å; N391-E393 VanDerWaalsContact O-N 3.17Å; N391-E393 PolarHBondContact OD1-N 3.37Å; N391-D394 WeakPolarHBondContact CB-OD2 3.5Å; N391-D394 PolarHBondContact O-N 2.87Å; N391-R434 PolarHBondContact ND2-NH2 3.03Å; N391-R434 PolarHBondContact OD1-NH2 3.29Å; N391-R434 VanDerWaalsContact OD1-NH2 3.17Å
392	K	86.1	Confident	85.1	Confident	104 Å²	104	36.7 Å²	36.7	45%	0.452	17%	0.173	S	C	.	.	H	α-helix	trans	-59.1	-28	-175.8	-162.4	176.6	-157.8	81	0	114.1	D357 C358 K396	D357-K392 WeakPolarHBondContact O-CG 3.41Å; D357-K392 PolarHBondContact O-NZ 2.99Å; C358-K392 HydrophobicContact CB-CG 4.29Å; K392-K396 HydrophobicContact CG-CD 4.35Å; K392-K396 WeakPolarHBondContact O-CB 3.34Å; K392-K396 WeakPolarHBondContact O-CD 3.24Å; K392-K396 VanDerWaalsContact O-CG 3.26Å; K392-K396 WeakPolarHBondContact O-CG 3.35Å; K392-K396 PolarHBondContact O-N 3.42Å
393	E	83.4	Confident	84.3	Confident	99 Å²	99	38.2 Å²	38.2	46%	0.463	19%	0.189	S	C	.	.	H	α-helix	trans	-76.3	-23.9	-178.1	-52.7	-45.5	122.7	0	0	113.4	N391 K396 F397	N391-E393 PolarHBondContact O-N 2.91Å; N391-E393 VanDerWaalsContact O-N 3.17Å; N391-E393 PolarHBondContact OD1-N 3.37Å; E393-K396 IonicContact OE1-NZ 2.77Å; E393-K396 PolarHBondContact OE1-NZ 3.09Å; E393-K396 WeakPolarHBondContact OE2-CD 3.31Å; E393-K396 IonicContact OE2-NZ 2.74Å; E393-K396 PolarHBondContact OE2-NZ 3.13Å; E393-F397 WeakPolarHBondContact O-CB 3.37Å; E393-F397 PolarHBondContact O-N 3.07Å
394	D	82.8	Confident	83.5	Confident	6 Å²	6	38.5 Å²	38.5	3%	0.032	19%	0.19	C	C	.	.	H	α-helix	trans	-71.7	-46.9	175.3	-65.9	-49.3	0	0	0	111	F389 N391 K396 F397 L398 R434 I438	F389-D394 HydrophobicContact CD1-CB 3.89Å; F389-D394 HydrophobicContact CE1-CB 4.36Å; F389-D394 HydrophobicContact CG-CB 4.3Å; N391-D394 WeakPolarHBondContact CB-OD2 3.5Å; N391-D394 PolarHBondContact O-N 2.87Å; D394-K396 PolarHBondContact O-N 2.92Å; D394-F397 WeakPolarHBondContact O-CB 3.23Å; D394-F397 PolarHBondContact O-N 3.41Å; D394-L398 PolarHBondContact O-N 2.89Å; D394-L398 VanDerWaalsContact O-N 3.16Å; D394-R434 IonicContact OD1-CZ 3.72Å; D394-R434 VanDerWaalsContact OD1-CZ 3.26Å; D394-R434 IonicContact OD1-NE 2.81Å; D394-R434 PolarHBondContact OD1-NE 3.28Å; D394-R434 IonicContact OD1-NH2 3.33Å; D394-R434 PolarHBondContact OD1-NH2 3Å; D394-R434 IonicContact OD2-CZ 3.46Å; D394-R434 IonicContact OD2-NE 3.23Å; D394-R434 PolarHBondContact OD2-NE 3.48Å; D394-R434 VanDerWaalsContact OD2-NE 3.08Å; D394-R434 IonicContact OD2-NH2 2.77Å; D394-R434 PolarHBondContact OD2-NH2 3.18Å; D394-I438 HydrophobicContact CB-CD1 4.24Å
395	G	82.4	Confident	82.5	Confident	0 Å²	0	43 Å²	43	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-62.9	-42.1	175.3	0	0	0	0	0	112.6	C358 F397 L398 E399	C358-G395 VanDerWaalsContact SG-CA 3.6Å; G395-F397 PolarHBondContact O-N 3.09Å; G395-L398 PolarHBondContact O-N 3Å; G395-L398 VanDerWaalsContact O-N 3.15Å; G395-E399 WeakPolarHBondContact O-CG 3.35Å; G395-E399 PolarHBondContact O-N 2.86Å
396	K	82.4	Confident	81.4	Confident	69 Å²	69	43.5 Å²	43.5	30%	0.3	21%	0.212	S	C	.	.	H	α-helix	trans	-60	-29.3	170.6	-78	166.8	166.9	176.8	0	113.7	K392 E393 D394 K400	K392-K396 HydrophobicContact CG-CD 4.35Å; K392-K396 WeakPolarHBondContact O-CB 3.34Å; K392-K396 WeakPolarHBondContact O-CD 3.24Å; K392-K396 VanDerWaalsContact O-CG 3.26Å; K392-K396 WeakPolarHBondContact O-CG 3.35Å; K392-K396 PolarHBondContact O-N 3.42Å; E393-K396 IonicContact OE1-NZ 2.77Å; E393-K396 PolarHBondContact OE1-NZ 3.09Å; E393-K396 WeakPolarHBondContact OE2-CD 3.31Å; E393-K396 IonicContact OE2-NZ 2.74Å; E393-K396 PolarHBondContact OE2-NZ 3.13Å; D394-K396 PolarHBondContact O-N 2.92Å; K396-K400 WeakPolarHBondContact O-CD 3.21Å; K396-K400 VanDerWaalsContact O-CG 3.26Å; K396-K400 WeakPolarHBondContact O-CG 3.47Å; K396-K400 PolarHBondContact O-N 3.22Å
397	F	81.1	Confident	80.1	Confident	7 Å²	7	44.1 Å²	44.1	3%	0.031	22%	0.216	C	C	.	.	H	α-helix	trans	-68.9	-45.2	174.7	174.3	-89.8	0	0	0	110.2	E393 D394 G395 K400 L401 T408 T410 I435 L439 E459	E393-F397 WeakPolarHBondContact O-CB 3.37Å; E393-F397 PolarHBondContact O-N 3.07Å; D394-F397 WeakPolarHBondContact O-CB 3.23Å; D394-F397 PolarHBondContact O-N 3.41Å; G395-F397 PolarHBondContact O-N 3.09Å; F397-K400 WeakPolarHBondContact O-CB 3.42Å; F397-K400 PolarHBondContact O-N 3.42Å; F397-L401 HydrophobicContact CE1-CB 4.42Å; F397-L401 HydrophobicContact CE1-CD2 4.12Å; F397-L401 PolarHBondContact O-N 2.89Å; F397-T408 WeakPolarHBondContact CE2-OG1 3.49Å; F397-T408 WeakPolarHBondContact CZ-OG1 3.47Å; F397-T410 HydrophobicContact CD2-CG2 3.64Å; F397-T410 HydrophobicContact CE2-CG2 4.3Å; F397-T410 HydrophobicContact CG-CG2 4.43Å; F397-I435 HydrophobicContact CD1-CD1 4.1Å; F397-I435 HydrophobicContact CD1-CG1 3.91Å; F397-I435 HydrophobicContact CD1-CG2 3.96Å; F397-I435 HydrophobicContact CD2-CD1 3.78Å; F397-I435 HydrophobicContact CD2-CG1 4.45Å; F397-I435 HydrophobicContact CE1-CB 4.3Å; F397-I435 HydrophobicContact CE1-CD1 4.12Å; F397-I435 HydrophobicContact CE1-CG1 4.07Å; F397-I435 HydrophobicContact CE1-CG2 3.31Å; F397-I435 HydrophobicContact CE2-CD1 3.76Å; F397-I435 HydrophobicContact CG-CD1 3.95Å; F397-I435 HydrophobicContact CG-CG1 4.13Å; F397-I435 HydrophobicContact CZ-CD1 3.95Å; F397-I435 HydrophobicContact CZ-CG1 4.39Å; F397-I435 HydrophobicContact CZ-CG2 3.67Å; F397-L439 HydrophobicContact CE1-CD1 4.42Å; F397-E459 HydrophobicContact CZ-CG 4.46Å
398	L	81.1	Confident	78.8	Confident	3 Å²	3	44.4 Å²	44.4	2%	0.016	22%	0.217	C	C	.	.	H	α-helix	trans	-61.2	-45	173.9	-63	-173.4	0	0	0	112.6	Y360 L387 F389 D394 G395 K400 L401 S402 I438 L439 I442	Y360-L398 HydrophobicContact CD1-CB 4.25Å; Y360-L398 HydrophobicContact CD1-CD1 3.68Å; Y360-L398 HydrophobicContact CD2-CB 3.74Å; Y360-L398 HydrophobicContact CE1-CB 4.38Å; Y360-L398 HydrophobicContact CE1-CD1 4.14Å; Y360-L398 HydrophobicContact CE2-CB 3.9Å; Y360-L398 HydrophobicContact CG-CB 3.94Å; Y360-L398 HydrophobicContact CG-CD1 3.92Å; L387-L398 HydrophobicContact CD1-CD1 3.82Å; F389-L398 HydrophobicContact CE2-CD1 3.97Å; F389-L398 HydrophobicContact CZ-CD1 3.53Å; F389-L398 HydrophobicContact CZ-CG 4.48Å; D394-L398 PolarHBondContact O-N 2.89Å; D394-L398 VanDerWaalsContact O-N 3.16Å; G395-L398 PolarHBondContact O-N 3Å; G395-L398 VanDerWaalsContact O-N 3.15Å; L398-K400 PolarHBondContact O-N 2.86Å; L398-L401 PolarHBondContact O-N 3.37Å; L398-L401 VanDerWaalsContact O-N 3.08Å; L398-S402 WeakPolarHBondContact O-CB 3.29Å; L398-S402 PolarHBondContact O-N 2.82Å; L398-S402 PolarHBondContact O-OG 3.47Å; L398-I438 HydrophobicContact CD1-CG2 3.87Å; L398-I438 HydrophobicContact CD2-CG2 4.03Å; L398-I438 HydrophobicContact CG-CG2 4.36Å; L398-L439 HydrophobicContact CD2-CD2 3.71Å; L398-I442 HydrophobicContact CD1-CD1 3.83Å; L398-I442 HydrophobicContact CD2-CD1 3.8Å; L398-I442 HydrophobicContact CG-CD1 4.48Å
399	E	80.7	Confident	77.5	Confident	96 Å²	96	45.2 Å²	45.2	45%	0.449	22%	0.221	S	C	.	.	H	α-helix	trans	-55.2	-35.9	176.2	-71.7	177.2	157.9	0	0	112.6	Y360 G395 S402 S403	Y360-E399 HydrophobicContact CD2-CG 4.17Å; G395-E399 WeakPolarHBondContact O-CG 3.35Å; G395-E399 PolarHBondContact O-N 2.86Å; E399-S402 PolarHBondContact O-OG 3.29Å; E399-S403 WeakPolarHBondContact O-CB 3.39Å; E399-S403 PolarHBondContact O-OG 3.41Å
400	K	79	Confident	75.7	Confident	68 Å²	68	45.9 Å²	45.9	30%	0.296	23%	0.225	S	C	.	.	H	α-helix	trans	-73.3	-47.2	173.7	-70.1	166.1	-175.8	176.7	0	111.7	K396 F397 L398 S402 S403 R404 T408	K396-K400 WeakPolarHBondContact O-CD 3.21Å; K396-K400 VanDerWaalsContact O-CG 3.26Å; K396-K400 WeakPolarHBondContact O-CG 3.47Å; K396-K400 PolarHBondContact O-N 3.22Å; F397-K400 WeakPolarHBondContact O-CB 3.42Å; F397-K400 PolarHBondContact O-N 3.42Å; L398-K400 PolarHBondContact O-N 2.86Å; K400-S402 VanDerWaalsContact C-N 3.32Å; K400-S402 PolarHBondContact O-N 3.01Å; K400-S403 PolarHBondContact O-N 3.33Å; K400-S403 PolarHBondContact O-OG 3.43Å; K400-S403 VanDerWaalsContact O-OG 3.13Å; K400-R404 WeakPolarHBondContact O-CB 3.35Å; K400-R404 WeakPolarHBondContact O-CD 3.49Å; K400-R404 VanDerWaalsContact O-CG 3.28Å; K400-R404 WeakPolarHBondContact O-CG 3.46Å; K400-R404 PolarHBondContact O-N 3.48Å; K400-T408 HydrophobicContact CB-CG2 4.1Å
401	L	76.9	Confident	74.1	Confident	9 Å²	9	46.1 Å²	46.1	5%	0.047	23%	0.228	C	C	.	.	H	α-helix	trans	-63.2	-40	-176.7	-171.2	71	0	0	0	111.5	F397 L398 S403 T408 L439 F451	F397-L401 HydrophobicContact CE1-CB 4.42Å; F397-L401 HydrophobicContact CE1-CD2 4.12Å; F397-L401 PolarHBondContact O-N 2.89Å; L398-L401 PolarHBondContact O-N 3.37Å; L398-L401 VanDerWaalsContact O-N 3.08Å; L401-S403 PolarHBondContact O-N 2.89Å; L401-T408 HydrophobicContact CD1-CG2 4.38Å; L401-L439 HydrophobicContact CD2-CD1 4Å; L401-L439 HydrophobicContact CD2-CD2 3.43Å; L401-L439 VanDerWaalsContact CD2-CD2 3.43Å; L401-L439 HydrophobicContact CD2-CG 4.38Å; L401-F451 HydrophobicContact CD2-CD1 4.48Å; L401-F451 HydrophobicContact CD2-CE1 4.06Å; L401-F451 HydrophobicContact CG-CD1 4.3Å; L401-F451 HydrophobicContact CG-CE1 3.99Å
402	S	72.6	Confident	72.7	Confident	46 Å²	46	44.6 Å²	44.6	32%	0.322	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-7.5	179	72.8	0	0	0	0	114.4	Y360 L398 E399 K400	Y360-S402 WeakPolarHBondContact OH-CB 3.46Å; L398-S402 WeakPolarHBondContact O-CB 3.29Å; L398-S402 PolarHBondContact O-N 2.82Å; L398-S402 PolarHBondContact O-OG 3.47Å; E399-S402 PolarHBondContact O-OG 3.29Å; K400-S402 VanDerWaalsContact C-N 3.32Å; K400-S402 PolarHBondContact O-N 3.01Å
403	S	69.4	Low	71.3	Confident	83 Å²	83	48 Å²	48	58%	0.58	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-115.3	3.6	-178.2	58.1	0	0	0	0	114	E399 K400 L401	E399-S403 WeakPolarHBondContact O-CB 3.39Å; E399-S403 PolarHBondContact O-OG 3.41Å; K400-S403 PolarHBondContact O-N 3.33Å; K400-S403 PolarHBondContact O-OG 3.43Å; K400-S403 VanDerWaalsContact O-OG 3.13Å; L401-S403 PolarHBondContact O-N 2.89Å
404	R	71.4	Confident	70.2	Confident	44 Å²	44	46.7 Å²	46.7	17%	0.166	23%	0.232	C	C	.	.			trans	-130.3	156.5	-173.3	-68.7	172	179.5	176	-11.4	111.9	K400 T408 D537 Y540	K400-R404 WeakPolarHBondContact O-CB 3.35Å; K400-R404 WeakPolarHBondContact O-CD 3.49Å; K400-R404 VanDerWaalsContact O-CG 3.28Å; K400-R404 WeakPolarHBondContact O-CG 3.46Å; K400-R404 PolarHBondContact O-N 3.48Å; R404-T408 HydrophobicContact CB-CG2 4.21Å; R404-T408 VanDerWaalsContact CD-CG2 3.48Å; R404-T408 HydrophobicContact CG-CG2 4.46Å; R404-D537 IonicContact CZ-OD1 2.86Å; R404-D537 VanDerWaalsContact CZ-OD1 3.28Å; R404-D537 IonicContact NE-OD1 3.5Å; R404-D537 VanDerWaalsContact NH1-CG 3.33Å; R404-D537 IonicContact NH1-OD1 3.29Å; R404-D537 PolarHBondContact NH1-OD1 3.4Å; R404-D537 IonicContact NH1-OD2 2.87Å; R404-D537 IonicContact NH2-OD1 2.69Å; R404-Y540 HydrophobicContact CG-CD2 4.42Å; R404-Y540 HydrophobicContact CG-CE2 3.73Å; R404-Y540 VanDerWaalsContact NE-CD2 3.26Å
405	K	66.9	Low	69.1	Low	100 Å²	100	47.2 Å²	47.2	44%	0.435	24%	0.236	S	C	.	.	S	Bend	trans	-88.9	-32.5	177.2	-67.2	-167.5	-178.2	178.9	0	113.3	L20 H452	L20-K405 PolarHBondContact O-NZ 2.81Å; K405-H452 WeakPolarHBondContact CB-NE2 3.18Å; K405-H452 WeakPolarHBondContact CG-NE2 3.42Å; K405-H452 PolarHBondContact O-CD2 2.86Å
406	L	67.3	Low	68.3	Low	10 Å²	10	55.1 Å²	55.1	5%	0.052	27%	0.271	C	S	.	.	S	Bend	trans	-97.5	157.5	-175.9	-70.8	158.6	0	0	0	111.1	L20 F21 T408 I529 V532 E536	L20-L406 HydrophobicContact CD1-CD2 4.29Å; F21-L406 HydrophobicContact CE1-CD1 4.25Å; L406-T408 PolarHBondContact O-N 3.41Å; L406-I529 HydrophobicContact CD2-CG2 4.17Å; L406-V532 HydrophobicContact CD1-CG1 3.42Å; L406-V532 VanDerWaalsContact CD1-CG1 3.42Å; L406-V532 HydrophobicContact CD2-CG1 3.83Å; L406-V532 HydrophobicContact CG-CG1 4.26Å; L406-E536 HydrophobicContact CD1-CB 4.25Å
407	P	64.6	Low	67.5	Low	13 Å²	13	54.5 Å²	54.5	8%	0.084	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-57.5	138.6	176.1	-23.7	35.3	0	0	0	110.9	F409 M458 I529	P407-F409 HydrophobicContact CB-CE2 4.26Å; P407-F409 HydrophobicContact CB-CZ 4.05Å; P407-F409 WeakPolarHBondContact O-CD2 3.31Å; P407-F409 WeakPolarHBondContact O-CE2 2.94Å; P407-M458 HydrophobicContact CB-CB 4.08Å; P407-M458 HydrophobicContact CG-CB 3.5Å; P407-M458 HydrophobicContact CG-CE 4.14Å; P407-M458 HydrophobicContact CG-CG 3.76Å; P407-I529 HydrophobicContact CG-CG2 3.92Å
408	T	64.9	Low	66.8	Low	6 Å²	6	62.2 Å²	62.2	4%	0.037	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-99.4	148	-176.2	57.8	0	0	0	0	111.5	F397 K400 L401 R404 L406	F397-T408 WeakPolarHBondContact CE2-OG1 3.49Å; F397-T408 WeakPolarHBondContact CZ-OG1 3.47Å; K400-T408 HydrophobicContact CB-CG2 4.1Å; L401-T408 HydrophobicContact CD1-CG2 4.38Å; R404-T408 HydrophobicContact CB-CG2 4.21Å; R404-T408 VanDerWaalsContact CD-CG2 3.48Å; R404-T408 HydrophobicContact CG-CG2 4.46Å; L406-T408 PolarHBondContact O-N 3.41Å
409	F	65.9	Low	66.5	Low	17 Å²	17	63 Å²	63	8%	0.075	32%	0.32	C	S	.	.			trans	-124.9	132.1	-173.9	-60.7	-79.6	0	0	0	110.9	P407 H462 Q530 R534 D537	P407-F409 HydrophobicContact CB-CE2 4.26Å; P407-F409 HydrophobicContact CB-CZ 4.05Å; P407-F409 WeakPolarHBondContact O-CD2 3.31Å; P407-F409 WeakPolarHBondContact O-CE2 2.94Å; F409-H462 AromaticContact CD1-CD2 3.84Å; F409-H462 AromaticContact CD1-NE2 3.71Å; F409-H462 HydrophobicContact CE1-CB 4.42Å; F409-H462 AromaticContact CE1-CD2 3.68Å; F409-H462 AromaticContact CE1-CE1 3.93Å; F409-H462 AromaticContact CE1-CG 3.72Å; F409-H462 AromaticContact CE1-ND1 3.86Å; F409-H462 AromaticContact CE1-NE2 3.8Å; F409-Q530 HydrophobicContact CE1-CB 4.44Å; F409-Q530 HydrophobicContact CE1-CG 4.2Å; F409-Q530 HydrophobicContact CZ-CB 3.94Å; F409-Q530 HydrophobicContact CZ-CG 3.86Å; F409-R534 HydrophobicContact CB-CG 4.47Å; F409-R534 HydrophobicContact CD1-CG 4.45Å; F409-R534 HydrophobicContact CD2-CB 4.45Å; F409-R534 HydrophobicContact CD2-CG 3.64Å; F409-R534 HydrophobicContact CE2-CG 4Å; F409-R534 HydrophobicContact CG-CG 3.9Å; F409-D537 PolarHBondContact N-OD2 2.83Å
410	T	55.1	Low	66.6	Low	14 Å²	14	61.4 Å²	61.4	9%	0.086	32%	0.317	C	S	.	.	S	Bend	trans	-78	154.3	176.6	60.3	0	0	0	0	112.1	F397 H412 L427 T430 I435	F397-T410 HydrophobicContact CD2-CG2 3.64Å; F397-T410 HydrophobicContact CE2-CG2 4.3Å; F397-T410 HydrophobicContact CG-CG2 4.43Å; T410-H412 VanDerWaalsContact C-N 3.29Å; T410-H412 PolarHBondContact O-N 3.36Å; T410-L427 WeakPolarHBondContact OG1-CD1 3.47Å; T410-T430 HydrophobicContact CG2-CG2 4.34Å; T410-I435 HydrophobicContact CG2-CD1 3.89Å
411	E	56.1	Low	66.9	Low	107 Å²	107	66.9 Å²	66.9	50%	0.5	34%	0.335	S	S	.	.	S	Bend	trans	67.4	-12.3	156.9	-64.9	153.3	-110.8	0	0	119.7	K413 R426	E411-K413 PolarHBondContact O-N 3.36Å; E411-R426 VanDerWaalsContact OE2-CD 3.31Å; E411-R426 WeakPolarHBondContact OE2-CD 3.45Å
412	H	56.8	Low	67.4	Low	36 Å²	36	72.1 Å²	72.1	17%	0.167	36%	0.359	C	S	.	.			trans	-84.2	117.9	-177.7	-77.2	34.9	0	0	0	114.4	T410 L419 Q541	T410-H412 VanDerWaalsContact C-N 3.29Å; T410-H412 PolarHBondContact O-N 3.36Å; H412-L419 WeakPolarHBondContact NE2-CD2 3.41Å; H412-L419 WeakPolarHBondContact NE2-CG 3.29Å; H412-Q541 PolarHBondContact O-NE2 2.81Å
413	K	55.6	Low	68	Low	175 Å²	175	72.8 Å²	72.8	76%	0.761	36%	0.359	S	S	*	.	S	Bend	trans	-79.9	-19.7	176	-66	178.8	-179.4	173.3	0	114	E411 F538	E411-K413 PolarHBondContact O-N 3.36Å; K413-F538 WeakPolarHBondContact O-CE2 3.43Å
414	T	61.5	Low	68.8	Low	72 Å²	72	69.1 Å²	69.1	44%	0.442	33%	0.334	S	S	.	.	S	Bend	trans	-139.2	131.4	179.5	40.9	0	0	0	0	109	F416 S417	T414-F416 VanDerWaalsContact C-N 3.28Å; T414-F416 PolarHBondContact O-N 3.47Å; T414-S417 PolarHBondContact O-OG 3.15Å; T414-S417 WeakPolarHBondContact OG1-CB 3.49Å; T414-S417 PolarHBondContact OG1-OG 3.24Å
415	P	59.5	Low	69.6	Low	17 Å²	17	69.6 Å²	69.6	11%	0.11	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-18	-170.8	27.2	-33.7	0	0	0	113.7	R534 I535 F538	P415-R534 HydrophobicContact CB-CB 4.38Å; P415-I535 HydrophobicContact CB-CG1 4.48Å; P415-F538 HydrophobicContact CB-CB 4.28Å; P415-F538 HydrophobicContact CG-CB 4.04Å; P415-F538 HydrophobicContact CG-CD1 3.89Å; P415-F538 HydrophobicContact CG-CD2 4.48Å; P415-F538 HydrophobicContact CG-CE1 4.45Å; P415-F538 HydrophobicContact CG-CG 3.9Å
416	F	66	Low	70.6	Confident	166 Å²	166	71.7 Å²	71.7	73%	0.728	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.5	4.8	-171.8	-50.2	-54.4	0	0	0	114.7	T414 I535	T414-F416 VanDerWaalsContact C-N 3.28Å; T414-F416 PolarHBondContact O-N 3.47Å; F416-I535 HydrophobicContact CE1-CD1 4.12Å; F416-I535 HydrophobicContact CE1-CG1 4.13Å; F416-I535 HydrophobicContact CZ-CD1 4.04Å; F416-I535 HydrophobicContact CZ-CG1 3.98Å
417	S	65.2	Low	71.4	Confident	56 Å²	56	71.5 Å²	71.5	39%	0.392	35%	0.345	S	S	.	.	P	Polyproline II helix	trans	-64.7	136.1	175.1	50.8	0	0	0	0	111	T414 L419	T414-S417 PolarHBondContact O-OG 3.15Å; T414-S417 WeakPolarHBondContact OG1-CB 3.49Å; T414-S417 PolarHBondContact OG1-OG 3.24Å; S417-L419 PolarHBondContact O-N 3.06Å
418	L	66.9	Low	72.6	Confident	168 Å²	168	71.4 Å²	71.4	88%	0.88	34%	0.344	S	S	*	.	P	Polyproline II helix	trans	-62.9	123.1	171.5	-172.3	68.6	0	0	0	109.1	T420	L418-T420 PolarHBondContact O-N 3.38Å
419	L	73.7	Confident	73.7	Confident	21 Å²	21	75 Å²	75	11%	0.11	36%	0.36	C	S	.	.	P	Polyproline II helix	trans	-66.4	126.7	175.3	-101	164.6	0	0	0	109.8	H412 S417 D423	H412-L419 WeakPolarHBondContact NE2-CD2 3.41Å; H412-L419 WeakPolarHBondContact NE2-CG 3.29Å; S417-L419 PolarHBondContact O-N 3.06Å; L419-D423 HydrophobicContact CD2-CB 3.44Å; L419-D423 VanDerWaalsContact CD2-CB 3.44Å
420	T	83.8	Confident	74.7	Confident	62 Å²	62	74.7 Å²	74.7	38%	0.38	36%	0.36	S	S	.	.	P	Polyproline II helix	trans	-68.5	166.5	166.9	70.2	0	0	0	0	110.2	L418 E422 D423 T424	L418-T420 PolarHBondContact O-N 3.38Å; T420-E422 VanDerWaalsContact C-N 3.25Å; T420-E422 PolarHBondContact O-N 3.44Å; T420-E422 PolarHBondContact OG1-N 3.38Å; T420-D423 WeakPolarHBondContact CB-OD2 3.48Å; T420-D423 WeakPolarHBondContact CG2-OD2 3.4Å; T420-D423 WeakPolarHBondContact OG1-CB 3.22Å; T420-D423 PolarHBondContact OG1-N 2.89Å; T420-D423 PolarHBondContact OG1-OD2 3.19Å; T420-T424 WeakPolarHBondContact O-CB 3.48Å; T420-T424 PolarHBondContact O-N 3.46Å; T420-T424 PolarHBondContact O-OG1 3.38Å
421	R	85.8	Confident	76.1	Confident	183 Å²	183	74.4 Å²	74.4	69%	0.691	36%	0.358	S	S	*	.	H	α-helix	trans	-66	-36.8	175.1	-175.8	-174.9	-174.9	-150.4	2.6	110.2	T424 V425 L470	R421-T424 WeakPolarHBondContact O-CB 3.37Å; R421-T424 PolarHBondContact O-N 2.98Å; R421-V425 WeakPolarHBondContact O-CG2 3.24Å; R421-V425 PolarHBondContact O-N 3.41Å; R421-L470 HydrophobicContact CG-CD2 4.18Å
422	E	86.8	Confident	77.6	Confident	118 Å²	118	70.1 Å²	70.1	55%	0.551	34%	0.343	S	S	*	.	H	α-helix	trans	-69	-43.5	-177.5	-64.4	58.7	-129.9	0	0	110.8	T420 T424 V425 R426	T420-E422 VanDerWaalsContact C-N 3.25Å; T420-E422 PolarHBondContact O-N 3.44Å; T420-E422 PolarHBondContact OG1-N 3.38Å; E422-T424 VanDerWaalsContact C-N 3.33Å; E422-V425 PolarHBondContact O-N 3.49Å; E422-R426 PolarHBondContact O-N 2.92Å
423	D	84.8	Confident	79	Confident	60 Å²	60	75 Å²	75	32%	0.321	36%	0.363	S	S	.	.	H	α-helix	trans	-65.8	-36.5	171	-62.3	-44.6	0	0	0	111.6	L419 T420 R426 L427	L419-D423 HydrophobicContact CD2-CB 3.44Å; L419-D423 VanDerWaalsContact CD2-CB 3.44Å; T420-D423 WeakPolarHBondContact CB-OD2 3.48Å; T420-D423 WeakPolarHBondContact CG2-OD2 3.4Å; T420-D423 WeakPolarHBondContact OG1-CB 3.22Å; T420-D423 PolarHBondContact OG1-N 2.89Å; T420-D423 PolarHBondContact OG1-OD2 3.19Å; D423-R426 PolarHBondContact O-N 3.02Å; D423-L427 VanDerWaalsContact O-CB 3.27Å; D423-L427 WeakPolarHBondContact O-CB 3.19Å; D423-L427 PolarHBondContact O-N 3.21Å
424	T	86.2	Confident	80.4	Confident	6 Å²	6	69.5 Å²	69.5	4%	0.037	34%	0.338	C	S	.	.	H	α-helix	trans	-66.1	-39.1	176.3	-56.7	0	0	0	0	111.3	T420 R421 E422 M428 L466 R469 L470	T420-T424 WeakPolarHBondContact O-CB 3.48Å; T420-T424 PolarHBondContact O-N 3.46Å; T420-T424 PolarHBondContact O-OG1 3.38Å; R421-T424 WeakPolarHBondContact O-CB 3.37Å; R421-T424 PolarHBondContact O-N 2.98Å; E422-T424 VanDerWaalsContact C-N 3.33Å; T424-M428 WeakPolarHBondContact O-CB 3.39Å; T424-M428 PolarHBondContact O-N 3.18Å; T424-L466 HydrophobicContact CG2-CB 4.49Å; T424-L466 HydrophobicContact CG2-CD2 4.03Å; T424-R469 HydrophobicContact CG2-CB 4.02Å; T424-L470 HydrophobicContact CG2-CD1 4.25Å; T424-L470 HydrophobicContact CG2-CD2 3.88Å; T424-L470 HydrophobicContact CG2-CG 3.84Å
425	V	89.3	Confident	81.6	Confident	55 Å²	55	66.3 Å²	66.3	33%	0.333	32%	0.318	S	S	.	.	H	α-helix	trans	-63.8	-50.7	172.1	171.8	0	0	0	0	110.6	R421 E422 L427 M428 E429 L470	R421-V425 WeakPolarHBondContact O-CG2 3.24Å; R421-V425 PolarHBondContact O-N 3.41Å; E422-V425 PolarHBondContact O-N 3.49Å; V425-L427 PolarHBondContact O-N 3.28Å; V425-M428 HydrophobicContact CG1-CE 4.29Å; V425-M428 WeakPolarHBondContact O-CB 3.49Å; V425-M428 PolarHBondContact O-N 3.11Å; V425-E429 PolarHBondContact O-N 3.03Å; V425-L470 HydrophobicContact CG2-CD1 4.01Å; V425-L470 HydrophobicContact CG2-CD2 3.7Å
426	R	86.5	Confident	82.9	Confident	143 Å²	143	66 Å²	66	54%	0.54	32%	0.316	S	S	.	.	H	α-helix	trans	-56.1	-48.5	179.1	-172.9	-163.3	-50.9	-122.6	-0.5	112.1	E411 E422 D423 M428 E429 T430	E411-R426 VanDerWaalsContact OE2-CD 3.31Å; E411-R426 WeakPolarHBondContact OE2-CD 3.45Å; E422-R426 PolarHBondContact O-N 2.92Å; D423-R426 PolarHBondContact O-N 3.02Å; R426-M428 VanDerWaalsContact C-N 3.34Å; R426-E429 PolarHBondContact O-N 2.94Å; R426-T430 PolarHBondContact O-N 3.48Å; R426-T430 PolarHBondContact O-OG1 3.46Å
427	L	84.5	Confident	84	Confident	6 Å²	6	60.3 Å²	60.3	3%	0.031	30%	0.295	C	S	.	.	H	α-helix	trans	-67	-36.7	179.8	-174.2	61.6	0	0	0	111.6	T410 D423 V425 E429 T430 V431 L466	T410-L427 WeakPolarHBondContact OG1-CD1 3.47Å; D423-L427 VanDerWaalsContact O-CB 3.27Å; D423-L427 WeakPolarHBondContact O-CB 3.19Å; D423-L427 PolarHBondContact O-N 3.21Å; V425-L427 PolarHBondContact O-N 3.28Å; L427-E429 VanDerWaalsContact C-N 3.35Å; L427-T430 PolarHBondContact O-N 3.22Å; L427-V431 HydrophobicContact CD1-CG2 4.07Å; L427-V431 HydrophobicContact CG-CG2 4.36Å; L427-V431 WeakPolarHBondContact O-CB 3.48Å; L427-V431 VanDerWaalsContact O-CG2 3.28Å; L427-V431 WeakPolarHBondContact O-CG2 3.41Å; L427-V431 PolarHBondContact O-N 2.88Å; L427-L466 HydrophobicContact CB-CD1 4.31Å; L427-L466 HydrophobicContact CD2-CD1 4.14Å; L427-L466 HydrophobicContact CD2-CD2 3.99Å; L427-L466 HydrophobicContact CG-CD1 3.8Å; L427-L466 HydrophobicContact CG-CD2 4.43Å
428	M	89.8	Confident	85.2	Confident	12 Å²	12	57.8 Å²	57.8	6%	0.059	28%	0.277	C	S	.	.	H	α-helix	trans	-61.6	-41.6	173	178.6	-79.3	-54.2	0	0	111.2	T424 V425 R426 G432 Y463 L466 L467 L470 R472	T424-M428 WeakPolarHBondContact O-CB 3.39Å; T424-M428 PolarHBondContact O-N 3.18Å; V425-M428 HydrophobicContact CG1-CE 4.29Å; V425-M428 WeakPolarHBondContact O-CB 3.49Å; V425-M428 PolarHBondContact O-N 3.11Å; R426-M428 VanDerWaalsContact C-N 3.34Å; M428-G432 WeakPolarHBondContact O-CA 3.23Å; M428-G432 PolarHBondContact O-N 3.03Å; M428-Y463 HydrophobicContact CG-CD2 4.19Å; M428-Y463 HydrophobicContact CG-CE2 3.64Å; M428-Y463 VanDerWaalsContact O-CE2 3.28Å; M428-Y463 WeakPolarHBondContact O-CE2 3.41Å; M428-Y463 HydrophobicContact SD-CE2 3.84Å; M428-L466 HydrophobicContact CB-CB 4.09Å; M428-L466 HydrophobicContact CB-CD1 4.4Å; M428-L466 HydrophobicContact CG-CB 4.45Å; M428-L467 HydrophobicContact CG-CD2 3.95Å; M428-L467 HydrophobicContact SD-CD2 4.17Å; M428-L470 HydrophobicContact CB-CD1 3.97Å; M428-L470 HydrophobicContact CE-CD1 4.03Å; M428-L470 HydrophobicContact CG-CD1 3.91Å; M428-R472 PolarHBondContact SD-NH1 3.39Å
429	E	88.8	Confident	86.2	Confident	80 Å²	80	50 Å²	50	37%	0.374	24%	0.237	S	C	.	.	H	α-helix	trans	-69.8	-43.7	174.8	-65.6	-161.7	111.4	0	0	113.2	V425 R426 L427 K433	V425-E429 PolarHBondContact O-N 3.03Å; R426-E429 PolarHBondContact O-N 2.94Å; L427-E429 VanDerWaalsContact C-N 3.35Å; E429-K433 HydrophobicContact CB-CD 4.36Å; E429-K433 VanDerWaalsContact O-CB 3.28Å; E429-K433 WeakPolarHBondContact O-CB 3.43Å; E429-K433 PolarHBondContact O-N 3.21Å; E429-K433 WeakPolarHBondContact OE1-CE 3.48Å; E429-K433 IonicContact OE1-NZ 3.89Å; E429-K433 PolarHBondContact OE1-NZ 3.48Å
430	T	85.8	Confident	87	Confident	12 Å²	12	49.2 Å²	49.2	7%	0.074	23%	0.232	C	C	.	.	I	π-helix	trans	-60.5	-47.5	176.3	-67	0	0	0	0	111.4	T410 R426 L427 R434 I435	T410-T430 HydrophobicContact CG2-CG2 4.34Å; R426-T430 PolarHBondContact O-N 3.48Å; R426-T430 PolarHBondContact O-OG1 3.46Å; L427-T430 PolarHBondContact O-N 3.22Å; T430-R434 WeakPolarHBondContact O-CB 3.43Å; T430-R434 PolarHBondContact O-N 3.47Å; T430-I435 HydrophobicContact CG2-CD1 3.99Å; T430-I435 PolarHBondContact O-N 3.27Å
431	V	85.8	Confident	87.4	Confident	8 Å²	8	46.2 Å²	46.2	5%	0.048	21%	0.214	C	C	.	.	I	π-helix	trans	-67.5	-51.3	178.5	178.3	0	0	0	0	110.7	L427 I435 L436 Y463 L466	L427-V431 HydrophobicContact CD1-CG2 4.07Å; L427-V431 HydrophobicContact CG-CG2 4.36Å; L427-V431 WeakPolarHBondContact O-CB 3.48Å; L427-V431 VanDerWaalsContact O-CG2 3.28Å; L427-V431 WeakPolarHBondContact O-CG2 3.41Å; L427-V431 PolarHBondContact O-N 2.88Å; V431-I435 HydrophobicContact CG2-CD1 4.29Å; V431-I435 PolarHBondContact O-N 2.94Å; V431-L436 HydrophobicContact CG1-CD1 4.38Å; V431-L436 HydrophobicContact CG1-CG 4.19Å; V431-L436 WeakPolarHBondContact O-CG 3.5Å; V431-L436 PolarHBondContact O-N 3.15Å; V431-Y463 HydrophobicContact CB-CD2 4.47Å; V431-Y463 HydrophobicContact CG1-CD2 4.37Å; V431-Y463 HydrophobicContact CG1-CG 4.45Å; V431-L466 HydrophobicContact CG2-CD1 4.42Å
432	G	87.2	Confident	87.6	Confident	17 Å²	17	37.6 Å²	37.6	18%	0.175	18%	0.182	C	C	.	.	I	π-helix	trans	-71.1	-41.8	-172.4	0	0	0	0	0	115.3	M428 Y463	M428-G432 WeakPolarHBondContact O-CA 3.23Å; M428-G432 PolarHBondContact O-N 3.03Å; G432-Y463 VanDerWaalsContact CA-CE2 3.5Å
433	K	86	Confident	87.7	Confident	137 Å²	137	32.9 Å²	32.9	60%	0.596	16%	0.159	S	C	*	.	I	π-helix	trans	-97.2	-24.8	-173	-60.8	179	172.7	177.9	0	114.2	E429	E429-K433 HydrophobicContact CB-CD 4.36Å; E429-K433 VanDerWaalsContact O-CB 3.28Å; E429-K433 WeakPolarHBondContact O-CB 3.43Å; E429-K433 PolarHBondContact O-N 3.21Å; E429-K433 WeakPolarHBondContact OE1-CE 3.48Å; E429-K433 IonicContact OE1-NZ 3.89Å; E429-K433 PolarHBondContact OE1-NZ 3.48Å
434	R	84.7	Confident	88	Confident	60 Å²	60	30 Å²	30	23%	0.226	14%	0.144	C	C	.	.	I	π-helix	trans	-109.5	-60.2	-177	-62.1	163.7	61.2	-175.7	4.5	111.3	N391 D394 T430 I438	N391-R434 PolarHBondContact ND2-NH2 3.03Å; N391-R434 PolarHBondContact OD1-NH2 3.29Å; N391-R434 VanDerWaalsContact OD1-NH2 3.17Å; D394-R434 IonicContact OD1-CZ 3.72Å; D394-R434 VanDerWaalsContact OD1-CZ 3.26Å; D394-R434 IonicContact OD1-NE 2.81Å; D394-R434 PolarHBondContact OD1-NE 3.28Å; D394-R434 IonicContact OD1-NH2 3.33Å; D394-R434 PolarHBondContact OD1-NH2 3Å; D394-R434 IonicContact OD2-CZ 3.46Å; D394-R434 IonicContact OD2-NE 3.23Å; D394-R434 PolarHBondContact OD2-NE 3.48Å; D394-R434 VanDerWaalsContact OD2-NE 3.08Å; D394-R434 IonicContact OD2-NH2 2.77Å; D394-R434 PolarHBondContact OD2-NH2 3.18Å; T430-R434 WeakPolarHBondContact O-CB 3.43Å; T430-R434 PolarHBondContact O-N 3.47Å; R434-I438 WeakPolarHBondContact O-CD1 3.22Å; R434-I438 VanDerWaalsContact O-CG1 3.23Å; R434-I438 WeakPolarHBondContact O-CG1 3.43Å
435	I	86.1	Confident	88.2	Confident	6 Å²	6	29.8 Å²	29.8	3%	0.031	14%	0.142	C	C	.	.	I	π-helix	trans	-67.2	-55.7	-172.5	-67.7	167.6	0	0	0	112.1	F397 T410 T430 V431 I438 L439	F397-I435 HydrophobicContact CD1-CD1 4.1Å; F397-I435 HydrophobicContact CD1-CG1 3.91Å; F397-I435 HydrophobicContact CD1-CG2 3.96Å; F397-I435 HydrophobicContact CD2-CD1 3.78Å; F397-I435 HydrophobicContact CD2-CG1 4.45Å; F397-I435 HydrophobicContact CE1-CB 4.3Å; F397-I435 HydrophobicContact CE1-CD1 4.12Å; F397-I435 HydrophobicContact CE1-CG1 4.07Å; F397-I435 HydrophobicContact CE1-CG2 3.31Å; F397-I435 HydrophobicContact CE2-CD1 3.76Å; F397-I435 HydrophobicContact CG-CD1 3.95Å; F397-I435 HydrophobicContact CG-CG1 4.13Å; F397-I435 HydrophobicContact CZ-CD1 3.95Å; F397-I435 HydrophobicContact CZ-CG1 4.39Å; F397-I435 HydrophobicContact CZ-CG2 3.67Å; T410-I435 HydrophobicContact CG2-CD1 3.89Å; T430-I435 HydrophobicContact CG2-CD1 3.99Å; T430-I435 PolarHBondContact O-N 3.27Å; V431-I435 HydrophobicContact CG2-CD1 4.29Å; V431-I435 PolarHBondContact O-N 2.94Å; I435-I438 WeakPolarHBondContact O-CB 3.35Å; I435-I438 PolarHBondContact O-N 3.07Å; I435-I438 VanDerWaalsContact O-N 3.13Å; I435-L439 HydrophobicContact CG2-CD1 3.73Å; I435-L439 HydrophobicContact CG2-CG 4.02Å; I435-L439 WeakPolarHBondContact O-CG 3.34Å; I435-L439 PolarHBondContact O-N 3.29Å
436	L	88.3	Confident	88	Confident	11 Å²	11	27.5 Å²	27.5	6%	0.058	13%	0.128	C	C	.	.	H	α-helix	trans	-58.6	-46.2	-172.6	-71	-179.8	0	0	0	113.8	V431 I438 L439 D440 E459 K460 Y463	V431-L436 HydrophobicContact CG1-CD1 4.38Å; V431-L436 HydrophobicContact CG1-CG 4.19Å; V431-L436 WeakPolarHBondContact O-CG 3.5Å; V431-L436 PolarHBondContact O-N 3.15Å; L436-I438 VanDerWaalsContact C-N 3.26Å; L436-I438 PolarHBondContact O-N 3.43Å; L436-L439 PolarHBondContact O-N 3.47Å; L436-L439 VanDerWaalsContact O-N 3.13Å; L436-D440 PolarHBondContact O-N 3.24Å; L436-E459 HydrophobicContact CD2-CB 3.75Å; L436-K460 HydrophobicContact CD1-CG 3.79Å; L436-K460 HydrophobicContact CD2-CD 4.49Å; L436-K460 HydrophobicContact CD2-CG 3.53Å; L436-K460 HydrophobicContact CG-CG 4.29Å; L436-Y463 HydrophobicContact CD1-CD1 3.87Å; L436-Y463 HydrophobicContact CD1-CG 3.99Å
437	P	88.9	Confident	87.3	Confident	45 Å²	45	21.8 Å²	21.8	29%	0.292	11%	0.108	S	C	.	.	H	α-helix	trans	-61.1	-30.7	177.2	-25.9	36.5	0	0	0	114.4	S280 F441	S280-P437 PolarHBondContact OG-O 3.43Å; P437-F441 VanDerWaalsContact O-CB 3.31Å; P437-F441 WeakPolarHBondContact O-CB 3.35Å; P437-F441 PolarHBondContact O-N 3.41Å
438	I	89.5	Confident	86.2	Confident	4 Å²	4	25.4 Å²	25.4	2%	0.021	13%	0.127	C	C	.	.	H	α-helix	trans	-72	-45	174.5	-62.2	163.3	0	0	0	110.1	F325 L387 F389 D394 L398 R434 I435 L436 F441 I442	F325-I438 HydrophobicContact CD1-CD1 4.49Å; F325-I438 HydrophobicContact CD1-CG1 3.72Å; F325-I438 HydrophobicContact CE1-CG1 3.88Å; L387-I438 HydrophobicContact CD1-CG2 4.24Å; F389-I438 HydrophobicContact CD1-CD1 4.36Å; F389-I438 HydrophobicContact CE1-CD1 3.7Å; F389-I438 HydrophobicContact CE1-CG1 4.28Å; F389-I438 HydrophobicContact CE1-CG2 4.3Å; F389-I438 HydrophobicContact CZ-CG2 4.33Å; D394-I438 HydrophobicContact CB-CD1 4.24Å; L398-I438 HydrophobicContact CD1-CG2 3.87Å; L398-I438 HydrophobicContact CD2-CG2 4.03Å; L398-I438 HydrophobicContact CG-CG2 4.36Å; R434-I438 WeakPolarHBondContact O-CD1 3.22Å; R434-I438 VanDerWaalsContact O-CG1 3.23Å; R434-I438 WeakPolarHBondContact O-CG1 3.43Å; I435-I438 WeakPolarHBondContact O-CB 3.35Å; I435-I438 PolarHBondContact O-N 3.07Å; I435-I438 VanDerWaalsContact O-N 3.13Å; L436-I438 VanDerWaalsContact C-N 3.26Å; L436-I438 PolarHBondContact O-N 3.43Å; I438-F441 WeakPolarHBondContact O-CB 3.41Å; I438-F441 PolarHBondContact O-N 2.83Å; I438-I442 HydrophobicContact CG2-CD1 3.93Å; I438-I442 HydrophobicContact CG2-CG1 4.49Å; I438-I442 WeakPolarHBondContact O-CG1 3.3Å; I438-I442 PolarHBondContact O-N 2.86Å
439	L	88.6	Confident	84.5	Confident	5 Å²	5	25.3 Å²	25.3	3%	0.026	13%	0.13	C	C	.	.	H	α-helix	trans	-65.4	-39.2	177.9	-62.1	-173.9	0	0	0	111.9	F397 L398 L401 I435 L436 F441 I442 R443 E459	F397-L439 HydrophobicContact CE1-CD1 4.42Å; L398-L439 HydrophobicContact CD2-CD2 3.71Å; L401-L439 HydrophobicContact CD2-CD1 4Å; L401-L439 HydrophobicContact CD2-CD2 3.43Å; L401-L439 VanDerWaalsContact CD2-CD2 3.43Å; L401-L439 HydrophobicContact CD2-CG 4.38Å; I435-L439 HydrophobicContact CG2-CD1 3.73Å; I435-L439 HydrophobicContact CG2-CG 4.02Å; I435-L439 WeakPolarHBondContact O-CG 3.34Å; I435-L439 PolarHBondContact O-N 3.29Å; L436-L439 PolarHBondContact O-N 3.47Å; L436-L439 VanDerWaalsContact O-N 3.13Å; L439-F441 VanDerWaalsContact C-N 3.33Å; L439-I442 HydrophobicContact CD2-CD1 4.48Å; L439-R443 WeakPolarHBondContact O-CB 3.5Å; L439-R443 WeakPolarHBondContact O-CG 3.41Å; L439-R443 PolarHBondContact O-N 2.93Å; L439-R443 PolarHBondContact O-NE 2.69Å; L439-E459 HydrophobicContact CD1-CB 4.17Å; L439-E459 HydrophobicContact CD1-CG 3.87Å
440	D	89.1	Confident	82.6	Confident	3 Å²	3	27.4 Å²	27.4	2%	0.016	14%	0.143	C	C	.	.	H	α-helix	trans	-66	-35.7	173.2	-73	-45.9	0	0	0	112.1	E281 L436 R443 S444 K460	E281-D440 HydrophobicContact CG-CB 3.74Å; E281-D440 WeakPolarHBondContact CG-OD2 3.5Å; L436-D440 PolarHBondContact O-N 3.24Å; D440-R443 CarbonylContact O-C 3.59Å; D440-R443 IonicContact OD1-CZ 2.72Å; D440-R443 IonicContact OD1-NH2 3.23Å; D440-R443 PolarHBondContact OD1-NH2 2.87Å; D440-S444 WeakPolarHBondContact O-CB 3.32Å; D440-S444 PolarHBondContact O-N 2.7Å; D440-K460 IonicContact OD1-NZ 3.77Å; D440-K460 PolarHBondContact OD1-NZ 2.87Å; D440-K460 WeakPolarHBondContact OD2-CE 3.17Å; D440-K460 IonicContact OD2-NZ 2.71Å; D440-K460 PolarHBondContact OD2-NZ 3.27Å
441	F	92.3	Very high	81	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-66.2	-49.3	174.6	-175.5	-92.4	0	0	0	112.5	I315 A318 I319 F325 V327 Y329 L385 L387 P437 I438 L439 R443 S444	I315-F441 HydrophobicContact CG2-CE2 4.15Å; I315-F441 HydrophobicContact CG2-CZ 4.28Å; A318-F441 HydrophobicContact CB-CD2 3.87Å; A318-F441 HydrophobicContact CB-CE2 4.02Å; I319-F441 HydrophobicContact CD1-CE2 4.44Å; I319-F441 HydrophobicContact CD1-CZ 4.08Å; I319-F441 HydrophobicContact CG1-CE2 3.76Å; I319-F441 HydrophobicContact CG1-CZ 3.71Å; F325-F441 HydrophobicContact CE2-CB 4.49Å; F325-F441 AromaticContact CE2-CD1 3.85Å; F325-F441 HydrophobicContact CE2-CD1 3.85Å; F325-F441 HydrophobicContact CE2-CD2 4.4Å; F325-F441 HydrophobicContact CE2-CE1 4.26Å; F325-F441 AromaticContact CE2-CG 3.95Å; F325-F441 HydrophobicContact CE2-CG 3.95Å; F325-F441 HydrophobicContact CZ-CB 4.01Å; F325-F441 HydrophobicContact CZ-CD1 4.23Å; F325-F441 HydrophobicContact CZ-CD2 4.28Å; F325-F441 AromaticContact CZ-CG 3.88Å; F325-F441 HydrophobicContact CZ-CG 3.88Å; V327-F441 HydrophobicContact CB-CE1 4.33Å; V327-F441 HydrophobicContact CB-CZ 4.38Å; V327-F441 HydrophobicContact CG1-CE1 3.73Å; V327-F441 HydrophobicContact CG1-CZ 3.89Å; V327-F441 HydrophobicContact CG2-CD1 4.38Å; V327-F441 HydrophobicContact CG2-CE1 3.6Å; V327-F441 HydrophobicContact CG2-CZ 3.76Å; Y329-F441 HydrophobicContact CE2-CZ 4.42Å; Y329-F441 WeakPolarHBondContact OH-CE1 3.35Å; Y329-F441 VanDerWaalsContact OH-CZ 3.32Å; Y329-F441 WeakPolarHBondContact OH-CZ 3.36Å; L385-F441 HydrophobicContact CD1-CE1 4.47Å; L387-F441 HydrophobicContact CD2-CD1 4.4Å; L387-F441 HydrophobicContact CD2-CE1 4.32Å; P437-F441 VanDerWaalsContact O-CB 3.31Å; P437-F441 WeakPolarHBondContact O-CB 3.35Å; P437-F441 PolarHBondContact O-N 3.41Å; I438-F441 WeakPolarHBondContact O-CB 3.41Å; I438-F441 PolarHBondContact O-N 2.83Å; L439-F441 VanDerWaalsContact C-N 3.33Å; F441-R443 VanDerWaalsContact C-N 3.31Å; F441-R443 PolarHBondContact O-N 2.72Å; F441-S444 WeakPolarHBondContact O-CB 3.46Å; F441-S444 PolarHBondContact O-N 2.82Å; F441-S444 PolarHBondContact O-OG 2.99Å
442	I	90.3	Very high	79.7	Confident	1 Å²	1	31.4 Å²	31.4	1%	0.005	16%	0.16	C	C	.	.	H	α-helix	trans	-55.4	-49.8	175.1	-67.3	165.3	0	0	0	109.8	L385 L387 L398 I438 L439 S444 T445 Q446 F451	L385-I442 HydrophobicContact CD2-CB 4.36Å; L385-I442 HydrophobicContact CD2-CG1 3.95Å; L385-I442 HydrophobicContact CD2-CG2 4.34Å; L387-I442 HydrophobicContact CD1-CD1 3.84Å; L387-I442 HydrophobicContact CD1-CG1 3.75Å; L398-I442 HydrophobicContact CD1-CD1 3.83Å; L398-I442 HydrophobicContact CD2-CD1 3.8Å; L398-I442 HydrophobicContact CG-CD1 4.48Å; I438-I442 HydrophobicContact CG2-CD1 3.93Å; I438-I442 HydrophobicContact CG2-CG1 4.49Å; I438-I442 WeakPolarHBondContact O-CG1 3.3Å; I438-I442 PolarHBondContact O-N 2.86Å; L439-I442 HydrophobicContact CD2-CD1 4.48Å; I442-S444 PolarHBondContact O-N 3.46Å; I442-S444 VanDerWaalsContact O-N 3.17Å; I442-T445 PolarHBondContact O-N 2.71Å; I442-T445 PolarHBondContact O-OG1 3.26Å; I442-Q446 WeakPolarHBondContact O-CB 3.49Å; I442-F451 HydrophobicContact CG2-CE2 4.21Å
443	R	88.8	Confident	77.9	Confident	19 Å²	19	31.3 Å²	31.3	7%	0.072	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73	3.2	178	-62.7	-174.4	-48.2	148.5	13.6	114	R284 M287 L439 D440 F441 S455 E486	R284-R443 WeakPolarHBondContact CD-O 3.1Å; R284-R443 WeakPolarHBondContact CG-O 3.36Å; R284-R443 PolarHBondContact NH1-O 2.86Å; M287-R443 WeakPolarHBondContact CE-O 3.45Å; L439-R443 WeakPolarHBondContact O-CB 3.5Å; L439-R443 WeakPolarHBondContact O-CG 3.41Å; L439-R443 PolarHBondContact O-N 2.93Å; L439-R443 PolarHBondContact O-NE 2.69Å; D440-R443 CarbonylContact O-C 3.59Å; D440-R443 IonicContact OD1-CZ 2.72Å; D440-R443 IonicContact OD1-NH2 3.23Å; D440-R443 PolarHBondContact OD1-NH2 2.87Å; F441-R443 VanDerWaalsContact C-N 3.31Å; F441-R443 PolarHBondContact O-N 2.72Å; R443-S455 PolarHBondContact NH1-O 2.99Å; R443-E486 IonicContact CZ-OE2 2.68Å; R443-E486 VanDerWaalsContact CZ-OE2 3.26Å; R443-E486 IonicContact NH1-OE2 2.67Å; R443-E486 PolarHBondContact NH1-OE2 2.92Å; R443-E486 IonicContact NH2-OE1 3.38Å; R443-E486 IonicContact NH2-OE2 2.73Å; R443-E486 PolarHBondContact NH2-OE2 2.97Å
444	S	91.6	Very high	76.4	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-5	172.8	78.5	0	0	0	0	114	M287 W311 D440 F441 I442	M287-S444 VanDerWaalsContact SD-C 3.59Å; W311-S444 PolarHBondContact NE1-O 3.15Å; D440-S444 WeakPolarHBondContact O-CB 3.32Å; D440-S444 PolarHBondContact O-N 2.7Å; F441-S444 WeakPolarHBondContact O-CB 3.46Å; F441-S444 PolarHBondContact O-N 2.82Å; F441-S444 PolarHBondContact O-OG 2.99Å; I442-S444 PolarHBondContact O-N 3.46Å; I442-S444 VanDerWaalsContact O-N 3.17Å
445	T	90.2	Very high	75.5	Confident	2 Å²	2	23.6 Å²	23.6	1%	0.012	13%	0.13	C	C	.	.	S	Bend	trans	-131.1	12.2	176.3	50.2	0	0	0	0	112.6	I315 Y329 H367 V368 L369 I442	I315-T445 HydrophobicContact CD1-CG2 3.62Å; I315-T445 HydrophobicContact CG1-CG2 4.44Å; Y329-T445 HydrophobicContact CE1-CG2 4.12Å; Y329-T445 WeakPolarHBondContact OH-CG2 3.43Å; Y329-T445 PolarHBondContact OH-OG1 3.3Å; H367-T445 CarbonylContact C-O 3.45Å; H367-T445 WeakPolarHBondContact CA-O 2.98Å; H367-T445 PolarHBondContact ND1-OG1 2.68Å; V368-T445 PolarHBondContact N-O 3.4Å; V368-T445 WeakPolarHBondContact O-CB 3.27Å; L369-T445 HydrophobicContact CD2-CG2 3.92Å; I442-T445 PolarHBondContact O-N 2.71Å; I442-T445 PolarHBondContact O-OG1 3.26Å
446	Q	86.3	Confident	75	Confident	6 Å²	6	23.3 Å²	23.3	3%	0.028	13%	0.129	C	C	.	.			trans	-140.4	114.8	-168.4	-173	-175.5	85.1	0	0	109.9	M287 D362 H367 I442 F451	M287-Q446 PolarHBondContact SD-N 3.44Å; D362-Q446 PolarHBondContact OD2-NE2 3.23Å; H367-Q446 PolarHBondContact CE1-NE2 3.13Å; H367-Q446 PolarHBondContact NE2-NE2 2.68Å; H367-Q446 VanDerWaalsContact NE2-NE2 3.16Å; I442-Q446 WeakPolarHBondContact O-CB 3.49Å; Q446-F451 VanDerWaalsContact OE1-CD2 3.32Å
447	L	71.8	Confident	74.9	Confident	23 Å²	23	23 Å²	23	12%	0.12	13%	0.127	C	C	.	.	S	Bend	trans	-87.2	-62.3	173.2	-65.6	169.8	0	0	0	110.1	M287 Y291 W375 G449 L493 Q494	M287-L447 HydrophobicContact CE-CD2 3.76Å; M287-L447 HydrophobicContact CE-CG 4.39Å; M287-L447 HydrophobicContact CG-CD2 4.37Å; M287-L447 HydrophobicContact SD-CD2 4.17Å; M287-L447 HydrophobicContact SD-CG 4.31Å; Y291-L447 HydrophobicContact CD1-CD1 4.25Å; Y291-L447 HydrophobicContact CD1-CD2 4.04Å; Y291-L447 HydrophobicContact CD2-CD1 3.46Å; Y291-L447 VanDerWaalsContact CD2-CD1 3.46Å; Y291-L447 HydrophobicContact CE1-CD1 4.41Å; Y291-L447 HydrophobicContact CE2-CD1 3.69Å; Y291-L447 HydrophobicContact CG-CD1 3.77Å; Y291-L447 HydrophobicContact CG-CD2 4.04Å; W375-L447 HydrophobicContact CH2-CD1 3.35Å; W375-L447 HydrophobicContact CH2-CG 4.45Å; W375-L447 HydrophobicContact CZ2-CD1 4.04Å; W375-L447 HydrophobicContact CZ3-CD1 3.77Å; L447-G449 PolarHBondContact O-N 2.69Å; L447-L493 HydrophobicContact CD2-CD2 4.02Å; L447-Q494 PolarHBondContact O-NE2 3.25Å
448	N	60.9	Low	74.6	Confident	82 Å²	82	21.3 Å²	21.3	44%	0.439	12%	0.116	S	C	.	.	S	Bend	trans	-102.4	80.1	-179.7	-63.5	14.5	0	0	0	109.2	L493	N448-L493 PolarHBondContact OD1-O 2.95Å
449	G	53.2	Low	74.4	Confident	11 Å²	11	21.6 Å²	21.6	11%	0.113	12%	0.117	C	C	.	.			trans	-78.9	152.8	164.4	0	0	0	0	0	110.6	L447 F451	L447-G449 PolarHBondContact O-N 2.69Å; G449-F451 PolarHBondContact O-N 3.29Å; G449-F451 VanDerWaalsContact O-N 3.12Å
450	N	48.8	Very low	74.5	Confident	123 Å²	123	21.5 Å²	21.5	66%	0.658	12%	0.116	S	C	*	.	S	Bend	trans	-69.1	-0.3	169	-79.1	-16.7	0	0	0	113.1	Q364	Q364-N450 HydrophobicContact CB-CB 4.19Å; Q364-N450 PolarHBondContact OE1-ND2 2.92Å
451	F	52.4	Low	74.5	Confident	31 Å²	31	21.4 Å²	21.4	14%	0.136	12%	0.115	C	C	.	.	S	Bend	trans	-64.2	130.8	164.2	-60.5	-72.4	0	0	0	110	L401 I442 Q446 G449	L401-F451 HydrophobicContact CD2-CD1 4.48Å; L401-F451 HydrophobicContact CD2-CE1 4.06Å; L401-F451 HydrophobicContact CG-CD1 4.3Å; L401-F451 HydrophobicContact CG-CE1 3.99Å; I442-F451 HydrophobicContact CG2-CE2 4.21Å; Q446-F451 VanDerWaalsContact OE1-CD2 3.32Å; G449-F451 PolarHBondContact O-N 3.29Å; G449-F451 VanDerWaalsContact O-N 3.12Å
452	H	58.5	Low	74.2	Confident	74 Å²	74	21.7 Å²	21.7	34%	0.343	12%	0.117	S	C	.	.			trans	-51	151.1	176	-77.9	-75.7	0	0	0	112.6	K405 C454 S455 E500	K405-H452 WeakPolarHBondContact CB-NE2 3.18Å; K405-H452 WeakPolarHBondContact CG-NE2 3.42Å; K405-H452 PolarHBondContact O-CD2 2.86Å; H452-C454 PolarHBondContact O-N 3.11Å; H452-S455 WeakPolarHBondContact O-CB 3.49Å; H452-S455 PolarHBondContact O-N 2.92Å; H452-E500 IonicContact ND1-OE1 3.8Å
453	A	50	Low	74.2	Confident	15 Å²	15	23.3 Å²	23.3	12%	0.124	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.2	-17.9	-169.1	0	0	0	0	0	116.5	V490 I496	A453-V490 HydrophobicContact CB-CG1 3.85Å; A453-V490 VanDerWaalsContact O-CG2 3.32Å; A453-V490 WeakPolarHBondContact O-CG2 3.41Å; A453-I496 HydrophobicContact CB-CG2 4.1Å
454	C	54.6	Low	74.4	Confident	14 Å²	14	22.4 Å²	22.4	10%	0.095	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.6	12.1	175.8	-64.3	0	0	0	0	114.4	H452 V457 M458 L507	H452-C454 PolarHBondContact O-N 3.11Å; C454-V457 CarbonylContact O-C 3.29Å; C454-V457 WeakPolarHBondContact O-CA 3.41Å; C454-V457 VanDerWaalsContact O-CB 3.3Å; C454-V457 WeakPolarHBondContact O-CB 3.28Å; C454-V457 PolarHBondContact O-N 2.77Å; C454-M458 HydrophobicContact CB-CG 4.11Å; C454-M458 WeakPolarHBondContact O-CG 3.34Å; C454-M458 PolarHBondContact O-N 2.93Å; C454-L507 HydrophobicContact CB-CD1 4.22Å
455	S	64.3	Low	74.2	Confident	21 Å²	21	23 Å²	23	15%	0.147	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.7	143.3	-178	-173.7	0	0	0	0	112.9	R443 H452 V457	R443-S455 PolarHBondContact NH1-O 2.99Å; H452-S455 WeakPolarHBondContact O-CB 3.49Å; H452-S455 PolarHBondContact O-N 2.92Å; S455-V457 PolarHBondContact O-N 3.46Å
456	G	77.2	Confident	74.2	Confident	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.2	-35	-164.2	0	0	0	0	0	112.1	E459 K460	G456-E459 WeakPolarHBondContact CA-OE2 3.05Å; G456-E459 PolarHBondContact N-OE2 3.1Å; G456-K460 WeakPolarHBondContact O-CG 3.47Å; G456-K460 PolarHBondContact O-N 3.42Å; G456-K460 VanDerWaalsContact O-N 3.16Å
457	V	84.8	Confident	74.5	Confident	3 Å²	3	22.6 Å²	22.6	2%	0.018	12%	0.122	C	C	.	.	H	α-helix	trans	-69.7	-48.6	171.6	-169.3	0	0	0	0	110.2	C454 S455 E459 K460 L461 A483 E486 L487	C454-V457 CarbonylContact O-C 3.29Å; C454-V457 WeakPolarHBondContact O-CA 3.41Å; C454-V457 VanDerWaalsContact O-CB 3.3Å; C454-V457 WeakPolarHBondContact O-CB 3.28Å; C454-V457 PolarHBondContact O-N 2.77Å; S455-V457 PolarHBondContact O-N 3.46Å; V457-E459 PolarHBondContact O-N 3.04Å; V457-K460 CarbonylContact O-C 3.57Å; V457-K460 WeakPolarHBondContact O-CA 3.28Å; V457-K460 WeakPolarHBondContact O-CB 3.11Å; V457-K460 PolarHBondContact O-N 3.1Å; V457-L461 HydrophobicContact CG1-CD1 4.43Å; V457-L461 HydrophobicContact CG1-CD2 4.36Å; V457-L461 HydrophobicContact CG1-CG 4.19Å; V457-L461 WeakPolarHBondContact O-CG 3.36Å; V457-L461 PolarHBondContact O-N 3.26Å; V457-A483 HydrophobicContact CG1-CB 3.9Å; V457-E486 HydrophobicContact CG2-CB 3.83Å; V457-L487 HydrophobicContact CB-CD2 4.46Å; V457-L487 HydrophobicContact CG1-CD1 4.38Å; V457-L487 HydrophobicContact CG1-CD2 3.89Å; V457-L487 HydrophobicContact CG1-CG 3.91Å
458	M	83.6	Confident	75.3	Confident	11 Å²	11	24 Å²	24	5%	0.054	13%	0.133	C	C	.	.	H	α-helix	trans	-55.6	-35.8	178	-73.6	-55.7	-48.7	0	0	112.9	P407 C454 L461 H462 L507 W526 I529	P407-M458 HydrophobicContact CB-CB 4.08Å; P407-M458 HydrophobicContact CG-CB 3.5Å; P407-M458 HydrophobicContact CG-CE 4.14Å; P407-M458 HydrophobicContact CG-CG 3.76Å; C454-M458 HydrophobicContact CB-CG 4.11Å; C454-M458 WeakPolarHBondContact O-CG 3.34Å; C454-M458 PolarHBondContact O-N 2.93Å; M458-L461 HydrophobicContact CE-CD1 4.43Å; M458-L461 PolarHBondContact O-N 3.31Å; M458-L461 HydrophobicContact SD-CD1 3.9Å; M458-H462 WeakPolarHBondContact O-CB 3.43Å; M458-H462 PolarHBondContact O-N 3.39Å; M458-L507 HydrophobicContact SD-CD1 4.09Å; M458-L507 HydrophobicContact SD-CD2 4.21Å; M458-W526 HydrophobicContact CE-CB 4.46Å; M458-I529 HydrophobicContact CE-CB 3.99Å; M458-I529 HydrophobicContact CE-CD1 4.43Å; M458-I529 HydrophobicContact CE-CG2 3.72Å
459	E	86	Confident	76.6	Confident	9 Å²	9	26.7 Å²	26.7	4%	0.042	14%	0.137	C	C	.	.	H	α-helix	trans	-68.3	-37.4	173.5	-69.1	67.1	-150.6	0	0	111.8	F397 L436 L439 G456 V457 H462 Y463	F397-E459 HydrophobicContact CZ-CG 4.46Å; L436-E459 HydrophobicContact CD2-CB 3.75Å; L439-E459 HydrophobicContact CD1-CB 4.17Å; L439-E459 HydrophobicContact CD1-CG 3.87Å; G456-E459 WeakPolarHBondContact CA-OE2 3.05Å; G456-E459 PolarHBondContact N-OE2 3.1Å; V457-E459 PolarHBondContact O-N 3.04Å; E459-H462 PolarHBondContact O-N 3.1Å; E459-Y463 WeakPolarHBondContact O-CB 3.24Å; E459-Y463 PolarHBondContact O-N 3.36Å
460	K	90.4	Very high	78.4	Confident	4 Å²	4	27.7 Å²	27.7	2%	0.017	14%	0.14	C	C	.	.	H	α-helix	trans	-67.3	-39.6	170.7	-69.7	179.5	-171.9	-168	0	112.3	E281 L436 D440 G456 V457 H462 Y463 A464 V479 E486	E281-K460 IonicContact OE1-NZ 3.64Å; E281-K460 PolarHBondContact OE1-NZ 2.68Å; L436-K460 HydrophobicContact CD1-CG 3.79Å; L436-K460 HydrophobicContact CD2-CD 4.49Å; L436-K460 HydrophobicContact CD2-CG 3.53Å; L436-K460 HydrophobicContact CG-CG 4.29Å; D440-K460 IonicContact OD1-NZ 3.77Å; D440-K460 PolarHBondContact OD1-NZ 2.87Å; D440-K460 WeakPolarHBondContact OD2-CE 3.17Å; D440-K460 IonicContact OD2-NZ 2.71Å; D440-K460 PolarHBondContact OD2-NZ 3.27Å; G456-K460 WeakPolarHBondContact O-CG 3.47Å; G456-K460 PolarHBondContact O-N 3.42Å; G456-K460 VanDerWaalsContact O-N 3.16Å; V457-K460 CarbonylContact O-C 3.57Å; V457-K460 WeakPolarHBondContact O-CA 3.28Å; V457-K460 WeakPolarHBondContact O-CB 3.11Å; V457-K460 PolarHBondContact O-N 3.1Å; K460-H462 VanDerWaalsContact C-N 3.3Å; K460-H462 PolarHBondContact O-N 3.41Å; K460-Y463 PolarHBondContact O-N 2.6Å; K460-A464 WeakPolarHBondContact O-CB 3.47Å; K460-A464 PolarHBondContact O-N 3.05Å; K460-V479 HydrophobicContact CB-CG1 4.15Å; K460-V479 VanDerWaalsContact O-CG1 3.29Å; K460-V479 WeakPolarHBondContact O-CG1 3.39Å; K460-E486 WeakPolarHBondContact CD-OE1 3.43Å; K460-E486 IonicContact NZ-OE1 3.49Å; K460-E486 PolarHBondContact NZ-OE1 2.89Å
461	L	89.4	Confident	80.5	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-64.9	-35.5	172.7	-55.1	-178.3	0	0	0	111.2	V457 M458 S465 A483 L507 W526	V457-L461 HydrophobicContact CG1-CD1 4.43Å; V457-L461 HydrophobicContact CG1-CD2 4.36Å; V457-L461 HydrophobicContact CG1-CG 4.19Å; V457-L461 WeakPolarHBondContact O-CG 3.36Å; V457-L461 PolarHBondContact O-N 3.26Å; M458-L461 HydrophobicContact CE-CD1 4.43Å; M458-L461 PolarHBondContact O-N 3.31Å; M458-L461 HydrophobicContact SD-CD1 3.9Å; L461-S465 PolarHBondContact O-N 2.62Å; L461-A483 HydrophobicContact CD2-CB 3.48Å; L461-A483 VanDerWaalsContact CD2-CB 3.48Å; L461-L507 HydrophobicContact CD1-CD2 4.06Å; L461-W526 HydrophobicContact CB-CD2 4.24Å; L461-W526 HydrophobicContact CB-CE3 3.98Å; L461-W526 HydrophobicContact CB-CZ3 4.38Å; L461-W526 HydrophobicContact CD1-CB 4.1Å; L461-W526 HydrophobicContact CD1-CD2 4.48Å; L461-W526 HydrophobicContact CD1-CE3 3.87Å; L461-W526 HydrophobicContact CD2-CE3 3.68Å; L461-W526 HydrophobicContact CD2-CZ3 3.61Å; L461-W526 HydrophobicContact CG-CE3 4.02Å; L461-W526 HydrophobicContact CG-CZ3 4.39Å
462	H	85.8	Confident	82.4	Confident	7 Å²	7	32.8 Å²	32.8	3%	0.032	16%	0.156	C	C	.	.	H	α-helix	trans	-67.1	-45.9	172.3	-172.2	48.1	0	0	0	111.8	F409 M458 E459 K460 A464 S465 L466 Q530	F409-H462 AromaticContact CD1-CD2 3.84Å; F409-H462 AromaticContact CD1-NE2 3.71Å; F409-H462 HydrophobicContact CE1-CB 4.42Å; F409-H462 AromaticContact CE1-CD2 3.68Å; F409-H462 AromaticContact CE1-CE1 3.93Å; F409-H462 AromaticContact CE1-CG 3.72Å; F409-H462 AromaticContact CE1-ND1 3.86Å; F409-H462 AromaticContact CE1-NE2 3.8Å; M458-H462 WeakPolarHBondContact O-CB 3.43Å; M458-H462 PolarHBondContact O-N 3.39Å; E459-H462 PolarHBondContact O-N 3.1Å; K460-H462 VanDerWaalsContact C-N 3.3Å; K460-H462 PolarHBondContact O-N 3.41Å; H462-A464 VanDerWaalsContact C-N 3.33Å; H462-A464 PolarHBondContact O-N 2.95Å; H462-S465 WeakPolarHBondContact O-CA 3.49Å; H462-S465 WeakPolarHBondContact O-CB 3.33Å; H462-S465 PolarHBondContact O-N 3.05Å; H462-S465 VanDerWaalsContact O-N 3.09Å; H462-L466 WeakPolarHBondContact O-CG 3.3Å; H462-L466 PolarHBondContact O-N 2.82Å; H462-Q530 PolarHBondContact ND1-OE1 3.45Å
463	Y	90.6	Very high	84	Confident	35 Å²	35	33.9 Å²	33.9	14%	0.137	17%	0.168	C	C	.	.	H	α-helix	trans	-56.8	-44.5	174.4	-177.2	-123	0	0	0	111.8	M428 V431 G432 L436 E459 K460 S465 L466 L467 V479	M428-Y463 HydrophobicContact CG-CD2 4.19Å; M428-Y463 HydrophobicContact CG-CE2 3.64Å; M428-Y463 VanDerWaalsContact O-CE2 3.28Å; M428-Y463 WeakPolarHBondContact O-CE2 3.41Å; M428-Y463 HydrophobicContact SD-CE2 3.84Å; V431-Y463 HydrophobicContact CB-CD2 4.47Å; V431-Y463 HydrophobicContact CG1-CD2 4.37Å; V431-Y463 HydrophobicContact CG1-CG 4.45Å; G432-Y463 VanDerWaalsContact CA-CE2 3.5Å; L436-Y463 HydrophobicContact CD1-CD1 3.87Å; L436-Y463 HydrophobicContact CD1-CG 3.99Å; E459-Y463 WeakPolarHBondContact O-CB 3.24Å; E459-Y463 PolarHBondContact O-N 3.36Å; K460-Y463 PolarHBondContact O-N 2.6Å; Y463-S465 PolarHBondContact O-N 3.49Å; Y463-L466 WeakPolarHBondContact O-CB 3.39Å; Y463-L466 PolarHBondContact O-N 3.24Å; Y463-L466 VanDerWaalsContact O-N 3.09Å; Y463-L467 HydrophobicContact CD1-CD1 3.99Å; Y463-L467 HydrophobicContact CE1-CD1 3.66Å; Y463-L467 HydrophobicContact CE1-CG 4.32Å; Y463-L467 HydrophobicContact CE2-CD1 4.5Å; Y463-L467 HydrophobicContact CE2-CD2 4.3Å; Y463-L467 HydrophobicContact CE2-CG 4.29Å; Y463-L467 WeakPolarHBondContact O-CG 3.49Å; Y463-L467 PolarHBondContact O-N 3.03Å; Y463-V479 HydrophobicContact CD1-CG1 4.04Å; Y463-V479 HydrophobicContact CD1-CG2 3.75Å; Y463-V479 HydrophobicContact CE1-CG2 3.74Å
464	A	91.8	Very high	86	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-59.1	-42.1	173.1	0	0	0	0	0	112.8	K460 H462 L466 L467 S468 Q476 V479 I480	K460-A464 WeakPolarHBondContact O-CB 3.47Å; K460-A464 PolarHBondContact O-N 3.05Å; H462-A464 VanDerWaalsContact C-N 3.33Å; H462-A464 PolarHBondContact O-N 2.95Å; A464-L466 VanDerWaalsContact C-N 3.3Å; A464-L466 PolarHBondContact O-N 3.3Å; A464-L467 PolarHBondContact O-N 3.22Å; A464-S468 WeakPolarHBondContact O-CB 3.42Å; A464-S468 PolarHBondContact O-N 3.47Å; A464-Q476 HydrophobicContact CB-CG 4.33Å; A464-V479 HydrophobicContact CB-CB 4.38Å; A464-V479 HydrophobicContact CB-CG1 3.96Å; A464-I480 HydrophobicContact CB-CD1 4.18Å; A464-I480 HydrophobicContact CB-CG1 3.71Å
465	S	88.1	Confident	87.8	Confident	12 Å²	12	44.5 Å²	44.5	8%	0.084	21%	0.211	C	C	.	.	H	α-helix	trans	-63.5	-31.2	173.6	-85.1	0	0	0	0	113.4	L461 H462 Y463 R469	L461-S465 PolarHBondContact O-N 2.62Å; H462-S465 WeakPolarHBondContact O-CA 3.49Å; H462-S465 WeakPolarHBondContact O-CB 3.33Å; H462-S465 PolarHBondContact O-N 3.05Å; H462-S465 VanDerWaalsContact O-N 3.09Å; Y463-S465 PolarHBondContact O-N 3.49Å; S465-R469 WeakPolarHBondContact O-CG 3.27Å; S465-R469 PolarHBondContact O-N 3.02Å
466	L	88.9	Confident	89.2	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-74.3	-45.1	173.4	-61.8	169.6	0	0	0	111.5	T424 L427 M428 V431 H462 Y463 A464 S468 R469 L470	T424-L466 HydrophobicContact CG2-CB 4.49Å; T424-L466 HydrophobicContact CG2-CD2 4.03Å; L427-L466 HydrophobicContact CB-CD1 4.31Å; L427-L466 HydrophobicContact CD2-CD1 4.14Å; L427-L466 HydrophobicContact CD2-CD2 3.99Å; L427-L466 HydrophobicContact CG-CD1 3.8Å; L427-L466 HydrophobicContact CG-CD2 4.43Å; M428-L466 HydrophobicContact CB-CB 4.09Å; M428-L466 HydrophobicContact CB-CD1 4.4Å; M428-L466 HydrophobicContact CG-CB 4.45Å; V431-L466 HydrophobicContact CG2-CD1 4.42Å; H462-L466 WeakPolarHBondContact O-CG 3.3Å; H462-L466 PolarHBondContact O-N 2.82Å; Y463-L466 WeakPolarHBondContact O-CB 3.39Å; Y463-L466 PolarHBondContact O-N 3.24Å; Y463-L466 VanDerWaalsContact O-N 3.09Å; A464-L466 VanDerWaalsContact C-N 3.3Å; A464-L466 PolarHBondContact O-N 3.3Å; L466-S468 PolarHBondContact O-N 2.99Å; L466-R469 PolarHBondContact O-N 2.82Å; L466-L470 WeakPolarHBondContact O-CG 3.37Å; L466-L470 PolarHBondContact O-N 2.9Å; L466-L470 VanDerWaalsContact O-N 3.12Å
467	L	92.4	Very high	90	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-56.7	-38.7	173.7	-69.1	174.1	0	0	0	111.8	M428 Y463 A464 L470 Q471 R472 E475 Q476 V479	M428-L467 HydrophobicContact CG-CD2 3.95Å; M428-L467 HydrophobicContact SD-CD2 4.17Å; Y463-L467 HydrophobicContact CD1-CD1 3.99Å; Y463-L467 HydrophobicContact CE1-CD1 3.66Å; Y463-L467 HydrophobicContact CE1-CG 4.32Å; Y463-L467 HydrophobicContact CE2-CD1 4.5Å; Y463-L467 HydrophobicContact CE2-CD2 4.3Å; Y463-L467 HydrophobicContact CE2-CG 4.29Å; Y463-L467 WeakPolarHBondContact O-CG 3.49Å; Y463-L467 PolarHBondContact O-N 3.03Å; A464-L467 PolarHBondContact O-N 3.22Å; L467-L470 CarbonylContact O-C 3.59Å; L467-L470 PolarHBondContact O-N 3.11Å; L467-Q471 PolarHBondContact O-N 2.86Å; L467-Q471 VanDerWaalsContact O-N 3.12Å; L467-R472 HydrophobicContact CB-CB 4.24Å; L467-R472 HydrophobicContact CD2-CB 4Å; L467-R472 HydrophobicContact CD2-CG 4.45Å; L467-R472 PolarHBondContact O-N 3.22Å; L467-E475 HydrophobicContact CD1-CB 3.93Å; L467-E475 HydrophobicContact CD2-CB 4.43Å; L467-Q476 HydrophobicContact CB-CB 4.1Å; L467-V479 HydrophobicContact CD1-CG2 3.91Å
468	S	90	Very high	90.5	Very high	51 Å²	51	48.6 Å²	48.6	36%	0.357	23%	0.233	S	C	.	.	H	α-helix	trans	-61.4	-46.1	176.2	-152.8	0	0	0	0	112.8	A464 L466 L470 Q471 Q476	A464-S468 WeakPolarHBondContact O-CB 3.42Å; A464-S468 PolarHBondContact O-N 3.47Å; L466-S468 PolarHBondContact O-N 2.99Å; S468-L470 PolarHBondContact O-N 2.75Å; S468-Q471 WeakPolarHBondContact O-CA 3.47Å; S468-Q471 PolarHBondContact O-N 2.9Å; S468-Q476 VanDerWaalsContact CA-OE1 3.25Å; S468-Q476 VanDerWaalsContact CB-CD 3.4Å; S468-Q476 VanDerWaalsContact OG-CD 3.24Å; S468-Q476 PolarHBondContact OG-NE2 3.1Å; S468-Q476 VanDerWaalsContact OG-NE2 3.11Å; S468-Q476 PolarHBondContact OG-OE1 2.89Å
469	R	88.3	Confident	91	Very high	139 Å²	139	48.9 Å²	48.9	53%	0.525	24%	0.235	S	C	.	.	H	α-helix	trans	-63.2	-30.2	176.2	-67.7	167.7	-172.8	-143.2	-0.8	112.6	T424 S465 L466 Q471	T424-R469 HydrophobicContact CG2-CB 4.02Å; S465-R469 WeakPolarHBondContact O-CG 3.27Å; S465-R469 PolarHBondContact O-N 3.02Å; L466-R469 PolarHBondContact O-N 2.82Å; R469-Q471 VanDerWaalsContact C-N 3.29Å
470	L	91.6	Very high	91.5	Very high	33 Å²	33	48.5 Å²	48.5	17%	0.173	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.6	7	174.5	-60.4	175.5	0	0	0	113.3	R421 T424 V425 M428 L466 L467 S468 R472	R421-L470 HydrophobicContact CG-CD2 4.18Å; T424-L470 HydrophobicContact CG2-CD1 4.25Å; T424-L470 HydrophobicContact CG2-CD2 3.88Å; T424-L470 HydrophobicContact CG2-CG 3.84Å; V425-L470 HydrophobicContact CG2-CD1 4.01Å; V425-L470 HydrophobicContact CG2-CD2 3.7Å; M428-L470 HydrophobicContact CB-CD1 3.97Å; M428-L470 HydrophobicContact CE-CD1 4.03Å; M428-L470 HydrophobicContact CG-CD1 3.91Å; L466-L470 WeakPolarHBondContact O-CG 3.37Å; L466-L470 PolarHBondContact O-N 2.9Å; L466-L470 VanDerWaalsContact O-N 3.12Å; L467-L470 CarbonylContact O-C 3.59Å; L467-L470 PolarHBondContact O-N 3.11Å; S468-L470 PolarHBondContact O-N 2.75Å; L470-R472 HydrophobicContact CB-CG 4.17Å; L470-R472 PolarHBondContact O-N 3.17Å
471	Q	91.4	Very high	91.7	Very high	169 Å²	169	49.6 Å²	49.6	79%	0.79	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.2	21.9	-179.5	-56.2	-179.9	-6	0	0	114.7	L467 S468 R469 V473	L467-Q471 PolarHBondContact O-N 2.86Å; L467-Q471 VanDerWaalsContact O-N 3.12Å; S468-Q471 WeakPolarHBondContact O-CA 3.47Å; S468-Q471 PolarHBondContact O-N 2.9Å; R469-Q471 VanDerWaalsContact C-N 3.29Å; Q471-V473 PolarHBondContact O-N 3.39Å
472	R	93.3	Very high	92	Very high	92 Å²	92	49.9 Å²	49.9	35%	0.347	24%	0.241	S	C	.	.			trans	-82	54.7	178.7	-61.7	179.3	73	176.1	9.8	111.3	M428 L467 L470 K474 E475 Q476	M428-R472 PolarHBondContact SD-NH1 3.39Å; L467-R472 HydrophobicContact CB-CB 4.24Å; L467-R472 HydrophobicContact CD2-CB 4Å; L467-R472 HydrophobicContact CD2-CG 4.45Å; L467-R472 PolarHBondContact O-N 3.22Å; L470-R472 HydrophobicContact CB-CG 4.17Å; L470-R472 PolarHBondContact O-N 3.17Å; R472-K474 VanDerWaalsContact C-N 3.32Å; R472-K474 PolarHBondContact O-N 3.02Å; R472-E475 HydrophobicContact CB-CB 4.48Å; R472-E475 IonicContact CZ-OE1 3.46Å; R472-E475 IonicContact CZ-OE2 2.69Å; R472-E475 IonicContact NE-OE1 3.11Å; R472-E475 PolarHBondContact NE-OE1 3.22Å; R472-E475 IonicContact NE-OE2 2.69Å; R472-E475 PolarHBondContact NE-OE2 3.15Å; R472-E475 IonicContact NH1-OE2 3.77Å; R472-E475 IonicContact NH2-OE1 2.68Å; R472-E475 PolarHBondContact NH2-OE1 3.35Å; R472-E475 IonicContact NH2-OE2 3.96Å; R472-E475 PolarHBondContact NH2-OE2 2.69Å; R472-E475 PolarHBondContact O-N 3.5Å; R472-E475 VanDerWaalsContact O-N 3.08Å; R472-Q476 PolarHBondContact O-N 2.93Å
473	V	90.9	Very high	92.4	Very high	96 Å²	96	49.6 Å²	49.6	58%	0.582	24%	0.24	S	C	*	.	H	α-helix	trans	-55.7	-38.9	-167	-177.5	0	0	0	0	113.6	Q471 Q476 A477	Q471-V473 PolarHBondContact O-N 3.39Å; V473-Q476 PolarHBondContact O-N 2.9Å; V473-A477 WeakPolarHBondContact O-CB 3.28Å; V473-A477 PolarHBondContact O-N 3.29Å
474	K	92.1	Very high	92.6	Very high	188 Å²	188	48.5 Å²	48.5	82%	0.817	24%	0.236	S	C	*	.	H	α-helix	trans	-62.3	-44.9	178.4	-67	-176.8	178.8	179.6	0	112.2	R472 A477 Q478	R472-K474 VanDerWaalsContact C-N 3.32Å; R472-K474 PolarHBondContact O-N 3.02Å; K474-A477 PolarHBondContact O-N 3.41Å; K474-Q478 PolarHBondContact O-N 3.02Å; K474-Q478 VanDerWaalsContact O-N 3.09Å
475	E	93.5	Very high	92.8	Very high	64 Å²	64	48.6 Å²	48.6	30%	0.299	24%	0.237	S	C	.	.	H	α-helix	trans	-73.5	-37.3	179.6	-62.4	172.4	-116.7	0	0	111.1	L467 R472 A477 Q478 V479	L467-E475 HydrophobicContact CD1-CB 3.93Å; L467-E475 HydrophobicContact CD2-CB 4.43Å; R472-E475 HydrophobicContact CB-CB 4.48Å; R472-E475 IonicContact CZ-OE1 3.46Å; R472-E475 IonicContact CZ-OE2 2.69Å; R472-E475 IonicContact NE-OE1 3.11Å; R472-E475 PolarHBondContact NE-OE1 3.22Å; R472-E475 IonicContact NE-OE2 2.69Å; R472-E475 PolarHBondContact NE-OE2 3.15Å; R472-E475 IonicContact NH1-OE2 3.77Å; R472-E475 IonicContact NH2-OE1 2.68Å; R472-E475 PolarHBondContact NH2-OE1 3.35Å; R472-E475 IonicContact NH2-OE2 3.96Å; R472-E475 PolarHBondContact NH2-OE2 2.69Å; R472-E475 PolarHBondContact O-N 3.5Å; R472-E475 VanDerWaalsContact O-N 3.08Å; E475-A477 VanDerWaalsContact C-N 3.34Å; E475-A477 PolarHBondContact O-N 3.28Å; E475-Q478 PolarHBondContact O-N 3.47Å; E475-V479 VanDerWaalsContact O-CG2 3.31Å; E475-V479 WeakPolarHBondContact O-CG2 3.41Å; E475-V479 PolarHBondContact O-N 2.83Å
476	Q	94.1	Very high	93	Very high	16 Å²	16	49 Å²	49	8%	0.075	24%	0.237	C	C	.	.	H	α-helix	trans	-55.3	-50.4	170.7	177.3	-174.5	-1.9	0	0	110.7	A464 L467 S468 R472 V473 Q478 V479 I480	A464-Q476 HydrophobicContact CB-CG 4.33Å; L467-Q476 HydrophobicContact CB-CB 4.1Å; S468-Q476 VanDerWaalsContact CA-OE1 3.25Å; S468-Q476 VanDerWaalsContact CB-CD 3.4Å; S468-Q476 VanDerWaalsContact OG-CD 3.24Å; S468-Q476 PolarHBondContact OG-NE2 3.1Å; S468-Q476 VanDerWaalsContact OG-NE2 3.11Å; S468-Q476 PolarHBondContact OG-OE1 2.89Å; R472-Q476 PolarHBondContact O-N 2.93Å; V473-Q476 PolarHBondContact O-N 2.9Å; Q476-Q478 VanDerWaalsContact C-N 3.35Å; Q476-Q478 PolarHBondContact O-N 3.23Å; Q476-V479 PolarHBondContact O-N 3.11Å; Q476-I480 HydrophobicContact CG-CD1 3.62Å; Q476-I480 HydrophobicContact CG-CG1 4.46Å; Q476-I480 WeakPolarHBondContact O-CD1 3.44Å; Q476-I480 WeakPolarHBondContact O-CG1 3.27Å; Q476-I480 PolarHBondContact O-N 3.22Å
477	A	93.8	Very high	93.1	Very high	34 Å²	34	49 Å²	49	28%	0.281	24%	0.237	S	C	.	.	H	α-helix	trans	-61.7	-41.4	179	0	0	0	0	0	112.2	V473 K474 E475 I480 N481 L515	V473-A477 WeakPolarHBondContact O-CB 3.28Å; V473-A477 PolarHBondContact O-N 3.29Å; K474-A477 PolarHBondContact O-N 3.41Å; E475-A477 VanDerWaalsContact C-N 3.34Å; E475-A477 PolarHBondContact O-N 3.28Å; A477-I480 PolarHBondContact O-N 3.45Å; A477-N481 WeakPolarHBondContact O-CB 3.44Å; A477-N481 VanDerWaalsContact O-CG 3.29Å; A477-N481 PolarHBondContact O-N 3.03Å; A477-N481 PolarHBondContact O-ND2 3.19Å; A477-L515 HydrophobicContact CB-CD2 3.99Å; A477-L515 WeakPolarHBondContact O-CD2 3.37Å
478	Q	94.6	Very high	93.1	Very high	61 Å²	61	49.4 Å²	49.4	29%	0.285	24%	0.241	S	C	.	.	H	α-helix	trans	-60	-47	174.9	-179.4	-178.7	-53.1	0	0	112.6	L249 K474 E475 Q476 I480 N481 Q482	L249-Q478 VanDerWaalsContact CD2-CD 3.41Å; L249-Q478 HydrophobicContact CD2-CG 3.67Å; L249-Q478 HydrophobicContact CG-CG 4.49Å; K474-Q478 PolarHBondContact O-N 3.02Å; K474-Q478 VanDerWaalsContact O-N 3.09Å; E475-Q478 PolarHBondContact O-N 3.47Å; Q476-Q478 VanDerWaalsContact C-N 3.35Å; Q476-Q478 PolarHBondContact O-N 3.23Å; Q478-I480 VanDerWaalsContact C-N 3.33Å; Q478-I480 PolarHBondContact O-N 2.94Å; Q478-N481 PolarHBondContact O-N 3.42Å; Q478-Q482 PolarHBondContact O-N 3.4Å
479	V	94.9	Very high	93.2	Very high	16 Å²	16	47.2 Å²	47.2	10%	0.097	23%	0.225	C	C	.	.	H	α-helix	trans	-65.3	-36.4	178.1	173.7	0	0	0	0	111.5	K460 Y463 A464 L467 E475 Q476 Q482 A483	K460-V479 HydrophobicContact CB-CG1 4.15Å; K460-V479 VanDerWaalsContact O-CG1 3.29Å; K460-V479 WeakPolarHBondContact O-CG1 3.39Å; Y463-V479 HydrophobicContact CD1-CG1 4.04Å; Y463-V479 HydrophobicContact CD1-CG2 3.75Å; Y463-V479 HydrophobicContact CE1-CG2 3.74Å; A464-V479 HydrophobicContact CB-CB 4.38Å; A464-V479 HydrophobicContact CB-CG1 3.96Å; L467-V479 HydrophobicContact CD1-CG2 3.91Å; E475-V479 VanDerWaalsContact O-CG2 3.31Å; E475-V479 WeakPolarHBondContact O-CG2 3.41Å; E475-V479 PolarHBondContact O-N 2.83Å; Q476-V479 PolarHBondContact O-N 3.11Å; V479-Q482 PolarHBondContact O-N 2.88Å; V479-A483 WeakPolarHBondContact O-CB 3.41Å; V479-A483 PolarHBondContact O-N 2.93Å
480	I	95.1	Very high	93.2	Very high	1 Å²	1	41.1 Å²	41.1	1%	0.005	20%	0.203	C	C	.	.	H	α-helix	trans	-73.2	-39.4	177.8	-62.6	165.3	0	0	0	111.3	A464 Q476 A477 Q478 Q482 A483 M484 A511 T514 L515 W526	A464-I480 HydrophobicContact CB-CD1 4.18Å; A464-I480 HydrophobicContact CB-CG1 3.71Å; Q476-I480 HydrophobicContact CG-CD1 3.62Å; Q476-I480 HydrophobicContact CG-CG1 4.46Å; Q476-I480 WeakPolarHBondContact O-CD1 3.44Å; Q476-I480 WeakPolarHBondContact O-CG1 3.27Å; Q476-I480 PolarHBondContact O-N 3.22Å; A477-I480 PolarHBondContact O-N 3.45Å; Q478-I480 VanDerWaalsContact C-N 3.33Å; Q478-I480 PolarHBondContact O-N 2.94Å; I480-Q482 VanDerWaalsContact C-N 3.28Å; I480-Q482 PolarHBondContact O-N 3.35Å; I480-A483 PolarHBondContact O-N 3.03Å; I480-M484 WeakPolarHBondContact O-CB 3.46Å; I480-M484 WeakPolarHBondContact O-CG 3.29Å; I480-M484 PolarHBondContact O-N 3.3Å; I480-A511 HydrophobicContact CG2-CB 3.65Å; I480-T514 HydrophobicContact CD1-CG2 3.39Å; I480-L515 HydrophobicContact CB-CD2 4.07Å; I480-L515 HydrophobicContact CB-CG 4.26Å; I480-L515 HydrophobicContact CG2-CD1 3.92Å; I480-L515 HydrophobicContact CG2-CD2 4.09Å; I480-L515 HydrophobicContact CG2-CG 3.72Å; I480-W526 HydrophobicContact CD1-CH2 3.76Å; I480-W526 HydrophobicContact CG1-CH2 3.91Å; I480-W526 HydrophobicContact CG1-CZ3 4.38Å
481	N	95.5	Very high	93.1	Very high	27 Å²	27	41 Å²	41	14%	0.144	21%	0.205	C	C	.	.	H	α-helix	trans	-57	-44.2	170.7	-76.3	-30.4	0	0	0	110.9	N250 H253 A477 Q478 M484 A485 L515	N250-N481 PolarHBondContact OD1-ND2 2.81Å; H253-N481 HydrophobicContact CB-CB 3.95Å; A477-N481 WeakPolarHBondContact O-CB 3.44Å; A477-N481 VanDerWaalsContact O-CG 3.29Å; A477-N481 PolarHBondContact O-N 3.03Å; A477-N481 PolarHBondContact O-ND2 3.19Å; Q478-N481 PolarHBondContact O-N 3.42Å; N481-M484 PolarHBondContact O-N 2.98Å; N481-A485 PolarHBondContact O-N 3.36Å; N481-A485 VanDerWaalsContact O-N 3.07Å; N481-L515 VanDerWaalsContact OD1-CD1 3.24Å; N481-L515 WeakPolarHBondContact OD1-CD1 3.29Å; N481-L515 WeakPolarHBondContact OD1-CD2 3.28Å
482	Q	95.4	Very high	92.8	Very high	7 Å²	7	34.8 Å²	34.8	3%	0.033	17%	0.174	C	C	.	.	H	α-helix	trans	-63.6	-45.9	175.2	-176.7	169.6	-14.2	0	0	112.6	H253 E281 Q478 V479 I480 M484 A485 E486	H253-Q482 VanDerWaalsContact CE1-CB 3.5Å; H253-Q482 WeakPolarHBondContact CE1-CB 3.36Å; E281-Q482 PolarHBondContact OE1-NE2 2.85Å; E281-Q482 PolarHBondContact OE1-OE1 2.62Å; Q478-Q482 PolarHBondContact O-N 3.4Å; V479-Q482 PolarHBondContact O-N 2.88Å; I480-Q482 VanDerWaalsContact C-N 3.28Å; I480-Q482 PolarHBondContact O-N 3.35Å; Q482-M484 VanDerWaalsContact C-N 3.3Å; Q482-M484 PolarHBondContact O-N 3.46Å; Q482-A485 WeakPolarHBondContact O-CB 3.2Å; Q482-A485 PolarHBondContact O-N 3.38Å; Q482-A485 VanDerWaalsContact O-N 3.15Å; Q482-E486 PolarHBondContact NE2-OE1 2.73Å; Q482-E486 PolarHBondContact O-N 2.68Å
483	A	94.3	Very high	92.4	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-62.2	-39.1	178.1	0	0	0	0	0	111.6	V457 L461 V479 I480 A485 E486 L487	V457-A483 HydrophobicContact CG1-CB 3.9Å; L461-A483 HydrophobicContact CD2-CB 3.48Å; L461-A483 VanDerWaalsContact CD2-CB 3.48Å; V479-A483 WeakPolarHBondContact O-CB 3.41Å; V479-A483 PolarHBondContact O-N 2.93Å; I480-A483 PolarHBondContact O-N 3.03Å; A483-A485 VanDerWaalsContact C-N 3.35Å; A483-A485 PolarHBondContact O-N 3.11Å; A483-E486 PolarHBondContact O-N 3.04Å; A483-L487 WeakPolarHBondContact O-CB 3.45Å; A483-L487 VanDerWaalsContact O-CG 3.22Å; A483-L487 WeakPolarHBondContact O-CG 3.15Å; A483-L487 PolarHBondContact O-N 3.19Å
484	M	94.4	Very high	91.9	Very high	12 Å²	12	28.6 Å²	28.6	6%	0.059	14%	0.143	C	C	.	.	H	α-helix	trans	-58.7	-43.3	171.8	-78.8	-69	-74.8	0	0	112.3	V257 I480 N481 Q482 L487 A488 M508 A511 M512 L515	V257-M484 HydrophobicContact CG1-CE 4.27Å; V257-M484 HydrophobicContact CG2-CB 3.73Å; I480-M484 WeakPolarHBondContact O-CB 3.46Å; I480-M484 WeakPolarHBondContact O-CG 3.29Å; I480-M484 PolarHBondContact O-N 3.3Å; N481-M484 PolarHBondContact O-N 2.98Å; Q482-M484 VanDerWaalsContact C-N 3.3Å; Q482-M484 PolarHBondContact O-N 3.46Å; M484-L487 PolarHBondContact O-N 3.35Å; M484-A488 WeakPolarHBondContact O-CB 3.31Å; M484-A488 PolarHBondContact O-N 3.08Å; M484-M508 HydrophobicContact CE-CB 4.18Å; M484-M508 HydrophobicContact CE-CE 4.07Å; M484-M508 VanDerWaalsContact SD-CA 3.6Å; M484-M508 HydrophobicContact SD-CB 3.87Å; M484-M508 HydrophobicContact SD-CG 4.01Å; M484-M508 VanDerWaalsContact SD-O 3.4Å; M484-A511 HydrophobicContact CG-CB 3.77Å; M484-A511 HydrophobicContact SD-CB 3.5Å; M484-A511 VanDerWaalsContact SD-CB 3.5Å; M484-M512 HydrophobicContact CE-CB 4.42Å; M484-M512 HydrophobicContact CE-SD 4.41Å; M484-L515 HydrophobicContact CG-CD1 4.37Å
485	A	95.4	Very high	91.3	Very high	2 Å²	2	24.7 Å²	24.7	2%	0.017	13%	0.131	C	C	.	.	H	α-helix	trans	-65	-42.4	176.2	0	0	0	0	0	111.9	H253 I256 V257 N481 Q482 A483 T489	H253-A485 HydrophobicContact CB-CB 4.22Å; I256-A485 HydrophobicContact CB-CB 4.05Å; I256-A485 HydrophobicContact CG2-CB 3.86Å; V257-A485 HydrophobicContact CG2-CB 4.19Å; N481-A485 PolarHBondContact O-N 3.36Å; N481-A485 VanDerWaalsContact O-N 3.07Å; Q482-A485 WeakPolarHBondContact O-CB 3.2Å; Q482-A485 PolarHBondContact O-N 3.38Å; Q482-A485 VanDerWaalsContact O-N 3.15Å; A483-A485 VanDerWaalsContact C-N 3.35Å; A483-A485 PolarHBondContact O-N 3.11Å; A485-T489 PolarHBondContact O-N 3.41Å; A485-T489 PolarHBondContact O-OG1 3.48Å
486	E	92.9	Very high	90.7	Very high	20 Å²	20	23.8 Å²	23.8	9%	0.093	13%	0.128	C	C	.	.	H	α-helix	trans	-62.4	-46.8	174.3	-71.8	-174.5	-137.8	0	0	111.5	R443 V457 K460 Q482 A483 T489 V490	R443-E486 IonicContact CZ-OE2 2.68Å; R443-E486 VanDerWaalsContact CZ-OE2 3.26Å; R443-E486 IonicContact NH1-OE2 2.67Å; R443-E486 PolarHBondContact NH1-OE2 2.92Å; R443-E486 IonicContact NH2-OE1 3.38Å; R443-E486 IonicContact NH2-OE2 2.73Å; R443-E486 PolarHBondContact NH2-OE2 2.97Å; V457-E486 HydrophobicContact CG2-CB 3.83Å; K460-E486 WeakPolarHBondContact CD-OE1 3.43Å; K460-E486 IonicContact NZ-OE1 3.49Å; K460-E486 PolarHBondContact NZ-OE1 2.89Å; Q482-E486 PolarHBondContact NE2-OE1 2.73Å; Q482-E486 PolarHBondContact O-N 2.68Å; A483-E486 PolarHBondContact O-N 3.04Å; E486-T489 WeakPolarHBondContact O-CB 3.2Å; E486-T489 PolarHBondContact O-N 2.88Å; E486-T489 VanDerWaalsContact O-N 3.13Å; E486-V490 WeakPolarHBondContact O-CG2 3.25Å; E486-V490 PolarHBondContact O-N 3.4Å
487	L	92.3	Very high	90.2	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-59.2	-47.5	176.5	-69.7	170	0	0	0	112.1	V457 A483 M484 T489 V490 L504 L507 M508	V457-L487 HydrophobicContact CB-CD2 4.46Å; V457-L487 HydrophobicContact CG1-CD1 4.38Å; V457-L487 HydrophobicContact CG1-CD2 3.89Å; V457-L487 HydrophobicContact CG1-CG 3.91Å; A483-L487 WeakPolarHBondContact O-CB 3.45Å; A483-L487 VanDerWaalsContact O-CG 3.22Å; A483-L487 WeakPolarHBondContact O-CG 3.15Å; A483-L487 PolarHBondContact O-N 3.19Å; M484-L487 PolarHBondContact O-N 3.35Å; L487-T489 PolarHBondContact O-N 3.39Å; L487-T489 VanDerWaalsContact O-N 3.1Å; L487-V490 WeakPolarHBondContact O-CB 3.38Å; L487-V490 PolarHBondContact O-N 2.82Å; L487-V490 VanDerWaalsContact O-N 3.1Å; L487-L504 HydrophobicContact CB-CD1 3.62Å; L487-L504 HydrophobicContact CD2-CD1 3.45Å; L487-L504 VanDerWaalsContact CD2-CD1 3.45Å; L487-L504 HydrophobicContact CG-CD1 4.05Å; L487-L507 HydrophobicContact CD1-CB 4.05Å; L487-L507 HydrophobicContact CD2-CD1 4.39Å; L487-M508 HydrophobicContact CB-CG 3.68Å; L487-M508 HydrophobicContact CB-SD 4.01Å; L487-M508 HydrophobicContact CD1-CG 3.82Å; L487-M508 HydrophobicContact CG-CG 4.34Å
488	A	92.3	Very high	89.7	Confident	10 Å²	10	30.2 Å²	30.2	8%	0.083	16%	0.158	C	C	.	.	H	α-helix	trans	-59.2	-24.2	177.4	0	0	0	0	0	113.2	P260 M484 M508	P260-A488 HydrophobicContact CB-CB 4.3Å; P260-A488 WeakPolarHBondContact CB-O 3.33Å; P260-A488 WeakPolarHBondContact CG-O 3.36Å; M484-A488 WeakPolarHBondContact O-CB 3.31Å; M484-A488 PolarHBondContact O-N 3.08Å; A488-M508 HydrophobicContact CB-CE 3.88Å
489	T	91.5	Very high	89.1	Confident	4 Å²	4	31.3 Å²	31.3	3%	0.025	16%	0.163	C	C	.	.	H	α-helix	trans	-87	-24.5	179.8	-46.9	0	0	0	0	112.6	H266 I288 M292 A485 E486 L487 P491 Y492 L493	H266-T489 PolarHBondContact CE1-OG1 3.11Å; I288-T489 HydrophobicContact CG2-CG2 3.79Å; M292-T489 HydrophobicContact CE-CG2 3.5Å; A485-T489 PolarHBondContact O-N 3.41Å; A485-T489 PolarHBondContact O-OG1 3.48Å; E486-T489 WeakPolarHBondContact O-CB 3.2Å; E486-T489 PolarHBondContact O-N 2.88Å; E486-T489 VanDerWaalsContact O-N 3.13Å; L487-T489 PolarHBondContact O-N 3.39Å; L487-T489 VanDerWaalsContact O-N 3.1Å; T489-P491 VanDerWaalsContact C-CD 3.48Å; T489-Y492 PolarHBondContact O-N 3.01Å; T489-Y492 VanDerWaalsContact O-N 3.1Å; T489-L493 HydrophobicContact CG2-CD1 3.87Å; T489-L493 HydrophobicContact CG2-CD2 4.34Å; T489-L493 HydrophobicContact CG2-CG 3.97Å; T489-L493 PolarHBondContact O-N 3.24Å
490	V	89.1	Confident	88.5	Confident	11 Å²	11	33.4 Å²	33.4	7%	0.067	17%	0.172	C	C	.	.	H	α-helix	trans	-50.4	-47.8	-176	169	0	0	0	0	114.4	A453 E486 L487 Y492 L493 Q494 I496 L504	A453-V490 HydrophobicContact CB-CG1 3.85Å; A453-V490 VanDerWaalsContact O-CG2 3.32Å; A453-V490 WeakPolarHBondContact O-CG2 3.41Å; E486-V490 WeakPolarHBondContact O-CG2 3.25Å; E486-V490 PolarHBondContact O-N 3.4Å; L487-V490 WeakPolarHBondContact O-CB 3.38Å; L487-V490 PolarHBondContact O-N 2.82Å; L487-V490 VanDerWaalsContact O-N 3.1Å; V490-Y492 PolarHBondContact O-N 3.14Å; V490-L493 PolarHBondContact O-N 2.89Å; V490-Q494 PolarHBondContact O-N 3.42Å; V490-I496 HydrophobicContact CG1-CG2 3.81Å; V490-L504 HydrophobicContact CB-CD2 4.24Å; V490-L504 HydrophobicContact CG1-CD2 4.28Å
491	P	87.6	Confident	88.1	Confident	31 Å²	31	34.3 Å²	34.3	20%	0.201	18%	0.179	C	C	.	.	H	α-helix	trans	-63.4	-16.1	-176.8	-22.1	34.1	0	0	0	114.7	P143 T489 I496 L504	P143-P491 WeakPolarHBondContact CB-O 2.95Å; P143-P491 HydrophobicContact CG-CB 4.34Å; T489-P491 VanDerWaalsContact C-CD 3.48Å; P491-I496 HydrophobicContact CB-CD1 3.96Å; P491-I496 HydrophobicContact CG-CD1 3.98Å; P491-L504 HydrophobicContact CG-CD2 3.55Å
492	Y	86	Confident	87.7	Confident	38 Å²	38	35.5 Å²	35.5	15%	0.149	18%	0.184	C	C	.	.	H	α-helix	trans	-97.1	-17.9	179.7	-60	-97.2	0	0	0	112	A141 P260 A261 M292 L295 T489 V490	A141-Y492 HydrophobicContact CB-CE1 4.45Å; A141-Y492 WeakPolarHBondContact O-CE1 3.16Å; P260-Y492 HydrophobicContact CB-CD2 4.39Å; P260-Y492 HydrophobicContact CB-CE2 4.11Å; P260-Y492 HydrophobicContact CG-CD2 4.19Å; P260-Y492 HydrophobicContact CG-CE2 3.43Å; P260-Y492 VanDerWaalsContact CG-CE2 3.43Å; A261-Y492 HydrophobicContact CB-CD1 4.38Å; A261-Y492 HydrophobicContact CB-CE1 3.92Å; M292-Y492 HydrophobicContact CE-CG 4.19Å; L295-Y492 WeakPolarHBondContact CD1-O 3.47Å; T489-Y492 PolarHBondContact O-N 3.01Å; T489-Y492 VanDerWaalsContact O-N 3.1Å; V490-Y492 PolarHBondContact O-N 3.14Å
493	L	84.4	Confident	87.3	Confident	8 Å²	8	36.5 Å²	36.5	4%	0.042	19%	0.19	C	C	.	.	H	α-helix	trans	-94.3	-26.3	-179.3	-61.5	179.4	0	0	0	112.9	I288 Y291 M292 L447 N448 T489 V490	I288-L493 HydrophobicContact CD1-CD1 4.16Å; I288-L493 HydrophobicContact CG1-CD1 4.23Å; I288-L493 HydrophobicContact CG1-CD2 4.28Å; I288-L493 HydrophobicContact CG2-CD2 4.43Å; Y291-L493 HydrophobicContact CD1-CD2 3.65Å; Y291-L493 HydrophobicContact CE1-CD2 3.97Å; M292-L493 HydrophobicContact CE-CD2 3.59Å; M292-L493 HydrophobicContact CE-CG 4.12Å; L447-L493 HydrophobicContact CD2-CD2 4.02Å; N448-L493 PolarHBondContact OD1-O 2.95Å; T489-L493 HydrophobicContact CG2-CD1 3.87Å; T489-L493 HydrophobicContact CG2-CD2 4.34Å; T489-L493 HydrophobicContact CG2-CG 3.97Å; T489-L493 PolarHBondContact O-N 3.24Å; V490-L493 PolarHBondContact O-N 2.89Å
494	Q	81.4	Confident	87	Confident	50 Å²	50	37 Å²	37	23%	0.234	19%	0.192	C	C	.	.	S	Bend	trans	-145.7	142.1	-168.4	-60.9	-176.7	-10	0	0	111.5	L447 V490 I496	L447-Q494 PolarHBondContact O-NE2 3.25Å; V490-Q494 PolarHBondContact O-N 3.42Å; Q494-I496 PolarHBondContact O-N 2.89Å
495	D	78.6	Confident	86.8	Confident	107 Å²	107	43 Å²	43	57%	0.572	22%	0.22	S	C	*	.			trans	-65.4	93.4	167.6	-68	-70	0	0	0	110	W146	W146-D495 PolarHBondContact N-OD1 3.36Å
496	I	81.3	Confident	86.5	Confident	45 Å²	45	43.9 Å²	43.9	23%	0.231	23%	0.226	C	C	.	.			trans	-84.3	139	179.3	57.3	174.7	0	0	0	112.4	A453 V490 P491 Q494 E500 A501 L504	A453-I496 HydrophobicContact CB-CG2 4.1Å; V490-I496 HydrophobicContact CG1-CG2 3.81Å; P491-I496 HydrophobicContact CB-CD1 3.96Å; P491-I496 HydrophobicContact CG-CD1 3.98Å; Q494-I496 PolarHBondContact O-N 2.89Å; I496-E500 HydrophobicContact CB-CB 4.2Å; I496-A501 HydrophobicContact CD1-CB 4.02Å; I496-L504 HydrophobicContact CD1-CD2 4.09Å
497	S	83.8	Confident	86.4	Confident	51 Å²	51	42.9 Å²	42.9	36%	0.357	22%	0.222	S	C	.	.			trans	-72.1	160.3	170.6	69.6	0	0	0	0	112	Q499 E500 A501	S497-Q499 PolarHBondContact O-N 3.14Å; S497-Q499 VanDerWaalsContact O-N 3.17Å; S497-E500 VanDerWaalsContact CB-OE2 3.28Å; S497-E500 WeakPolarHBondContact CB-OE2 3.47Å; S497-E500 PolarHBondContact N-OE2 3.39Å; S497-E500 PolarHBondContact O-N 3.22Å; S497-E500 PolarHBondContact OG-N 3.47Å; S497-E500 PolarHBondContact OG-OE2 3.31Å; S497-A501 PolarHBondContact O-N 3.06Å
498	Q	84	Confident	86.4	Confident	134 Å²	134	45 Å²	45	63%	0.626	23%	0.232	S	C	*	.	H	α-helix	trans	-53.3	-35.7	173.5	176.7	59.7	32.2	0	0	112.8	A501 E502	Q498-A501 PolarHBondContact O-N 2.89Å; Q498-E502 PolarHBondContact NE2-OE1 3.35Å; Q498-E502 WeakPolarHBondContact O-CG 3.42Å; Q498-E502 PolarHBondContact O-N 2.81Å
499	Q	81.8	Confident	86.3	Confident	84 Å²	84	47.1 Å²	47.1	39%	0.393	25%	0.25	S	C	.	.	H	α-helix	trans	-69.5	-36.7	177.1	-63.6	-166.8	-32.4	0	0	112.2	D19 S497 L503	D19-Q499 PolarHBondContact OD2-NE2 3.02Å; S497-Q499 PolarHBondContact O-N 3.14Å; S497-Q499 VanDerWaalsContact O-N 3.17Å; Q499-L503 WeakPolarHBondContact O-CB 3.43Å; Q499-L503 PolarHBondContact O-N 2.95Å
500	E	81.9	Confident	86.2	Confident	59 Å²	59	47.9 Å²	47.9	28%	0.276	25%	0.253	S	S	.	.	H	α-helix	trans	-73.5	-33.5	175.8	-72.7	159.6	133.2	0	0	111.6	H452 I496 S497 L503 L504	H452-E500 IonicContact ND1-OE1 3.8Å; I496-E500 HydrophobicContact CB-CB 4.2Å; S497-E500 VanDerWaalsContact CB-OE2 3.28Å; S497-E500 WeakPolarHBondContact CB-OE2 3.47Å; S497-E500 PolarHBondContact N-OE2 3.39Å; S497-E500 PolarHBondContact O-N 3.22Å; S497-E500 PolarHBondContact OG-N 3.47Å; S497-E500 PolarHBondContact OG-OE2 3.31Å; E500-L503 PolarHBondContact O-N 3.38Å; E500-L504 WeakPolarHBondContact O-CB 3.41Å; E500-L504 PolarHBondContact O-N 3.45Å
501	A	85.9	Confident	86.3	Confident	20 Å²	20	47.3 Å²	47.3	17%	0.165	25%	0.25	C	S	.	.	H	α-helix	trans	-64.6	-44.2	171.2	0	0	0	0	0	112.5	I496 S497 Q498 L504 Q505	I496-A501 HydrophobicContact CD1-CB 4.02Å; S497-A501 PolarHBondContact O-N 3.06Å; Q498-A501 PolarHBondContact O-N 2.89Å; A501-L504 PolarHBondContact O-N 3.06Å; A501-Q505 VanDerWaalsContact O-CG 3.32Å; A501-Q505 WeakPolarHBondContact O-CG 3.24Å; A501-Q505 PolarHBondContact O-N 3.13Å
502	E	87.8	Confident	86.5	Confident	53 Å²	53	49.3 Å²	49.3	25%	0.248	26%	0.258	C	S	.	.	H	α-helix	trans	-62.9	-40.5	174.3	-77.4	174.4	-142.3	0	0	112.2	T12 Q498 S506	T12-E502 HydrophobicContact CG2-CB 4.42Å; T12-E502 WeakPolarHBondContact CG2-OE2 3.13Å; Q498-E502 PolarHBondContact NE2-OE1 3.35Å; Q498-E502 WeakPolarHBondContact O-CG 3.42Å; Q498-E502 PolarHBondContact O-N 2.81Å; E502-S506 WeakPolarHBondContact O-CB 3.29Å; E502-S506 PolarHBondContact O-N 3.22Å; E502-S506 VanDerWaalsContact O-N 3.14Å; E502-S506 PolarHBondContact O-OG 3.33Å
503	L	86.3	Confident	86.6	Confident	28 Å²	28	49.3 Å²	49.3	15%	0.147	26%	0.26	C	S	.	.	H	α-helix	trans	-64.7	-46.1	174	173.1	58.4	0	0	0	111.5	V16 Q499 E500 S506 L507 V525 I529	V16-L503 HydrophobicContact CG1-CD1 4.49Å; V16-L503 HydrophobicContact CG1-CD2 4.4Å; Q499-L503 WeakPolarHBondContact O-CB 3.43Å; Q499-L503 PolarHBondContact O-N 2.95Å; E500-L503 PolarHBondContact O-N 3.38Å; L503-S506 WeakPolarHBondContact O-CB 3.46Å; L503-S506 PolarHBondContact O-N 3.46Å; L503-S506 VanDerWaalsContact O-N 3.14Å; L503-L507 HydrophobicContact CD1-CD1 3.96Å; L503-L507 HydrophobicContact CD1-CD2 4.44Å; L503-L507 HydrophobicContact CD1-CG 3.94Å; L503-L507 HydrophobicContact CG-CD1 4.01Å; L503-L507 HydrophobicContact CG-CG 4.41Å; L503-L507 WeakPolarHBondContact O-CG 3.24Å; L503-L507 PolarHBondContact O-N 2.89Å; L503-V525 HydrophobicContact CD1-CG1 3.88Å; L503-I529 HydrophobicContact CD1-CD1 3.71Å
504	L	88.4	Confident	86.8	Confident	9 Å²	9	49.9 Å²	49.9	5%	0.047	26%	0.264	C	S	.	.	H	α-helix	trans	-58.2	-50.2	179.7	177	59	0	0	0	111.6	L487 V490 P491 I496 E500 A501 S506 L507 M508	L487-L504 HydrophobicContact CB-CD1 3.62Å; L487-L504 HydrophobicContact CD2-CD1 3.45Å; L487-L504 VanDerWaalsContact CD2-CD1 3.45Å; L487-L504 HydrophobicContact CG-CD1 4.05Å; V490-L504 HydrophobicContact CB-CD2 4.24Å; V490-L504 HydrophobicContact CG1-CD2 4.28Å; P491-L504 HydrophobicContact CG-CD2 3.55Å; I496-L504 HydrophobicContact CD1-CD2 4.09Å; E500-L504 WeakPolarHBondContact O-CB 3.41Å; E500-L504 PolarHBondContact O-N 3.45Å; A501-L504 PolarHBondContact O-N 3.06Å; L504-S506 VanDerWaalsContact C-N 3.28Å; L504-S506 PolarHBondContact O-N 3.29Å; L504-L507 PolarHBondContact O-N 2.85Å; L504-M508 HydrophobicContact CD1-CG 4.42Å; L504-M508 HydrophobicContact CD1-SD 4.22Å; L504-M508 HydrophobicContact CG-SD 4.29Å; L504-M508 WeakPolarHBondContact O-CG 3.33Å; L504-M508 PolarHBondContact O-N 3.17Å
505	Q	89.4	Confident	87.1	Confident	138 Å²	138	49.9 Å²	49.9	65%	0.645	27%	0.265	S	S	*	.	H	α-helix	trans	-58.1	-40.7	175	-71.2	173.3	5.5	0	0	111.8	A501 M508 A509	A501-Q505 VanDerWaalsContact O-CG 3.32Å; A501-Q505 WeakPolarHBondContact O-CG 3.24Å; A501-Q505 PolarHBondContact O-N 3.13Å; Q505-M508 PolarHBondContact O-N 3.01Å; Q505-A509 WeakPolarHBondContact O-CB 3.49Å; Q505-A509 PolarHBondContact O-N 3.4Å
506	S	89.8	Confident	87.5	Confident	21 Å²	21	49.5 Å²	49.5	15%	0.147	26%	0.26	C	S	.	.	H	α-helix	trans	-66.3	-41.5	178.2	-57.2	0	0	0	0	112.6	E502 L503 L504 A509 D510	E502-S506 WeakPolarHBondContact O-CB 3.29Å; E502-S506 PolarHBondContact O-N 3.22Å; E502-S506 VanDerWaalsContact O-N 3.14Å; E502-S506 PolarHBondContact O-OG 3.33Å; L503-S506 WeakPolarHBondContact O-CB 3.46Å; L503-S506 PolarHBondContact O-N 3.46Å; L503-S506 VanDerWaalsContact O-N 3.14Å; L504-S506 VanDerWaalsContact C-N 3.28Å; L504-S506 PolarHBondContact O-N 3.29Å; S506-A509 PolarHBondContact O-N 3.33Å; S506-D510 PolarHBondContact O-N 3.18Å
507	L	90.6	Very high	87.5	Confident	0 Å²	0	50 Å²	50	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-67.1	-37.3	176.1	-69.5	172.9	0	0	0	112	C454 M458 L461 L487 L503 L504 A511 W526 I529	C454-L507 HydrophobicContact CB-CD1 4.22Å; M458-L507 HydrophobicContact SD-CD1 4.09Å; M458-L507 HydrophobicContact SD-CD2 4.21Å; L461-L507 HydrophobicContact CD1-CD2 4.06Å; L487-L507 HydrophobicContact CD1-CB 4.05Å; L487-L507 HydrophobicContact CD2-CD1 4.39Å; L503-L507 HydrophobicContact CD1-CD1 3.96Å; L503-L507 HydrophobicContact CD1-CD2 4.44Å; L503-L507 HydrophobicContact CD1-CG 3.94Å; L503-L507 HydrophobicContact CG-CD1 4.01Å; L503-L507 HydrophobicContact CG-CG 4.41Å; L503-L507 WeakPolarHBondContact O-CG 3.24Å; L503-L507 PolarHBondContact O-N 2.89Å; L504-L507 PolarHBondContact O-N 2.85Å; L507-A511 VanDerWaalsContact O-CB 3.28Å; L507-A511 WeakPolarHBondContact O-CB 3.4Å; L507-A511 PolarHBondContact O-N 2.99Å; L507-W526 HydrophobicContact CD2-CB 3.74Å; L507-I529 HydrophobicContact CD2-CD1 4.49Å
508	M	91.8	Very high	87.4	Confident	44 Å²	44	52.9 Å²	52.9	22%	0.217	28%	0.279	C	S	.	.	H	α-helix	trans	-67.6	-38.5	174.9	-69.5	179.6	76.3	0	0	111.9	M484 L487 A488 L504 Q505 A511 M512	M484-M508 HydrophobicContact CE-CB 4.18Å; M484-M508 HydrophobicContact CE-CE 4.07Å; M484-M508 VanDerWaalsContact SD-CA 3.6Å; M484-M508 HydrophobicContact SD-CB 3.87Å; M484-M508 HydrophobicContact SD-CG 4.01Å; M484-M508 VanDerWaalsContact SD-O 3.4Å; L487-M508 HydrophobicContact CB-CG 3.68Å; L487-M508 HydrophobicContact CB-SD 4.01Å; L487-M508 HydrophobicContact CD1-CG 3.82Å; L487-M508 HydrophobicContact CG-CG 4.34Å; A488-M508 HydrophobicContact CB-CE 3.88Å; L504-M508 HydrophobicContact CD1-CG 4.42Å; L504-M508 HydrophobicContact CD1-SD 4.22Å; L504-M508 HydrophobicContact CG-SD 4.29Å; L504-M508 WeakPolarHBondContact O-CG 3.33Å; L504-M508 PolarHBondContact O-N 3.17Å; Q505-M508 PolarHBondContact O-N 3.01Å; M508-A511 PolarHBondContact O-N 3.47Å; M508-M512 WeakPolarHBondContact O-CB 3.42Å; M508-M512 PolarHBondContact O-N 2.89Å
509	A	90.7	Very high	86.6	Confident	55 Å²	55	56.3 Å²	56.3	46%	0.455	29%	0.292	S	S	.	.	H	α-helix	trans	-63.9	-48	173.3	0	0	0	0	0	112.2	Q505 S506 A511 M512 D513	Q505-A509 WeakPolarHBondContact O-CB 3.49Å; Q505-A509 PolarHBondContact O-N 3.4Å; S506-A509 PolarHBondContact O-N 3.33Å; A509-A511 VanDerWaalsContact C-N 3.28Å; A509-A511 PolarHBondContact O-N 3.2Å; A509-M512 PolarHBondContact O-N 2.67Å; A509-D513 WeakPolarHBondContact O-CB 3.4Å; A509-D513 PolarHBondContact O-N 2.75Å
510	D	89.9	Confident	85.7	Confident	19 Å²	19	55 Å²	55	10%	0.102	29%	0.292	C	S	.	.	H	α-helix	trans	-54.6	-43.5	174.6	-85.2	-21.9	0	0	0	112.3	S506 T514 R524 V525 W526	S506-D510 PolarHBondContact O-N 3.18Å; D510-T514 WeakPolarHBondContact O-CB 3.48Å; D510-T514 PolarHBondContact O-N 3.17Å; D510-T514 PolarHBondContact O-OG1 3.43Å; D510-R524 HydrophobicContact CB-CB 4.27Å; D510-R524 HydrophobicContact CB-CG 4.31Å; D510-R524 VanDerWaalsContact CG-CB 3.47Å; D510-R524 VanDerWaalsContact OD1-CA 3.28Å; D510-R524 WeakPolarHBondContact OD1-CA 3.38Å; D510-R524 VanDerWaalsContact OD1-CB 3.29Å; D510-R524 WeakPolarHBondContact OD1-CB 3.49Å; D510-R524 VanDerWaalsContact OD1-CG 3.31Å; D510-R524 WeakPolarHBondContact OD1-CG 3.37Å; D510-R524 WeakPolarHBondContact OD2-CB 3.35Å; D510-V525 WeakPolarHBondContact OD2-CA 3.32Å; D510-V525 WeakPolarHBondContact OD2-CB 3.5Å; D510-V525 PolarHBondContact OD2-N 3.33Å; D510-W526 HydrophobicContact CB-CE3 4.35Å; D510-W526 PolarHBondContact OD2-N 3.39Å; D510-W526 VanDerWaalsContact OD2-N 3.11Å
511	A	91	Very high	84.6	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-68.5	-44.7	179.9	0	0	0	0	0	111.8	I480 M484 L507 M508 A509 T514 L515 W526	I480-A511 HydrophobicContact CG2-CB 3.65Å; M484-A511 HydrophobicContact CG-CB 3.77Å; M484-A511 HydrophobicContact SD-CB 3.5Å; M484-A511 VanDerWaalsContact SD-CB 3.5Å; L507-A511 VanDerWaalsContact O-CB 3.28Å; L507-A511 WeakPolarHBondContact O-CB 3.4Å; L507-A511 PolarHBondContact O-N 2.99Å; M508-A511 PolarHBondContact O-N 3.47Å; A509-A511 VanDerWaalsContact C-N 3.28Å; A509-A511 PolarHBondContact O-N 3.2Å; A511-T514 WeakPolarHBondContact O-CB 3.31Å; A511-T514 PolarHBondContact O-N 3.1Å; A511-T514 VanDerWaalsContact O-N 3.13Å; A511-L515 WeakPolarHBondContact O-CG 3.47Å; A511-L515 PolarHBondContact O-N 3.16Å; A511-W526 HydrophobicContact CB-CZ3 4.08Å
512	M	90.8	Very high	83.9	Confident	73 Å²	73	65.9 Å²	65.9	36%	0.36	34%	0.343	S	S	.	.	H	α-helix	trans	-62.9	-45.3	176.2	-163.7	66	-115.4	0	0	111.8	M484 M508 A509 T514 L515 E516	M484-M512 HydrophobicContact CE-CB 4.42Å; M484-M512 HydrophobicContact CE-SD 4.41Å; M508-M512 WeakPolarHBondContact O-CB 3.42Å; M508-M512 PolarHBondContact O-N 2.89Å; A509-M512 PolarHBondContact O-N 2.67Å; M512-T514 PolarHBondContact O-N 2.87Å; M512-L515 HydrophobicContact CE-CB 4.05Å; M512-L515 HydrophobicContact CE-CD1 4.37Å; M512-L515 PolarHBondContact O-N 2.9Å; M512-L515 VanDerWaalsContact O-N 3.1Å; M512-E516 HydrophobicContact CE-CG 3.76Å; M512-E516 PolarHBondContact O-N 3.43Å
513	D	89.5	Confident	83.5	Confident	38 Å²	38	67.7 Å²	67.7	20%	0.203	35%	0.352	C	S	.	.	H	α-helix	trans	-57.5	-35.4	172.1	-87.4	13.4	0	0	0	112.3	A509 G517 R518	A509-D513 WeakPolarHBondContact O-CB 3.4Å; A509-D513 PolarHBondContact O-N 2.75Å; D513-G517 PolarHBondContact O-N 3.27Å; D513-R518 HydrophobicContact CB-CB 4.21Å; D513-R518 PolarHBondContact O-N 2.9Å; D513-R518 IonicContact OD1-CZ 3.28Å; D513-R518 IonicContact OD1-NE 3.96Å; D513-R518 PolarHBondContact OD1-NE 2.67Å; D513-R518 IonicContact OD1-NH2 2.59Å; D513-R518 PolarHBondContact OD1-NH2 3.3Å
514	T	88.1	Confident	83.3	Confident	19 Å²	19	69 Å²	69	12%	0.117	35%	0.354	C	S	.	.	H	α-helix	trans	-70.6	-38.3	176.7	-52.3	0	0	0	0	112.2	I480 D510 A511 M512 G517 R524 W526	I480-T514 HydrophobicContact CD1-CG2 3.39Å; D510-T514 WeakPolarHBondContact O-CB 3.48Å; D510-T514 PolarHBondContact O-N 3.17Å; D510-T514 PolarHBondContact O-OG1 3.43Å; A511-T514 WeakPolarHBondContact O-CB 3.31Å; A511-T514 PolarHBondContact O-N 3.1Å; A511-T514 VanDerWaalsContact O-N 3.13Å; M512-T514 PolarHBondContact O-N 2.87Å; T514-G517 PolarHBondContact O-N 3.13Å; T514-R524 PolarHBondContact OG1-NE 2.93Å; T514-R524 PolarHBondContact OG1-NH1 3.28Å; T514-W526 HydrophobicContact CG2-CH2 4.23Å; T514-W526 HydrophobicContact CG2-CZ2 4.45Å
515	L	88	Confident	83.2	Confident	50 Å²	50	69.4 Å²	69.4	26%	0.262	36%	0.357	S	S	.	.	H	α-helix	trans	-69.6	-39	177.2	-71.9	167.1	0	0	0	112.5	A477 I480 N481 M484 A511 M512 G517	A477-L515 HydrophobicContact CB-CD2 3.99Å; A477-L515 WeakPolarHBondContact O-CD2 3.37Å; I480-L515 HydrophobicContact CB-CD2 4.07Å; I480-L515 HydrophobicContact CB-CG 4.26Å; I480-L515 HydrophobicContact CG2-CD1 3.92Å; I480-L515 HydrophobicContact CG2-CD2 4.09Å; I480-L515 HydrophobicContact CG2-CG 3.72Å; N481-L515 VanDerWaalsContact OD1-CD1 3.24Å; N481-L515 WeakPolarHBondContact OD1-CD1 3.29Å; N481-L515 WeakPolarHBondContact OD1-CD2 3.28Å; M484-L515 HydrophobicContact CG-CD1 4.37Å; A511-L515 WeakPolarHBondContact O-CG 3.47Å; A511-L515 PolarHBondContact O-N 3.16Å; M512-L515 HydrophobicContact CE-CB 4.05Å; M512-L515 HydrophobicContact CE-CD1 4.37Å; M512-L515 PolarHBondContact O-N 2.9Å; M512-L515 VanDerWaalsContact O-N 3.1Å; L515-G517 PolarHBondContact O-N 3.14Å
516	E	86.8	Confident	82.9	Confident	100 Å²	100	63 Å²	63	47%	0.467	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-8.6	174.3	-69.1	-175	-121.6	0	0	113.5	M512 R518	M512-E516 HydrophobicContact CE-CG 3.76Å; M512-E516 PolarHBondContact O-N 3.43Å; E516-R518 HydrophobicContact CB-CG 3.98Å; E516-R518 PolarHBondContact O-N 3.29Å; E516-R518 IonicContact OE1-CZ 3.14Å; E516-R518 IonicContact OE1-NE 2.71Å; E516-R518 IonicContact OE1-NH1 2.75Å; E516-R518 PolarHBondContact OE1-NH1 2.95Å; E516-R518 IonicContact OE1-NH2 3.97Å; E516-R518 PolarHBondContact OE1-NH2 3.1Å; E516-R518 IonicContact OE2-CZ 2.8Å; E516-R518 IonicContact OE2-NE 2.91Å; E516-R518 IonicContact OE2-NH1 3.04Å; E516-R518 PolarHBondContact OE2-NH1 2.99Å; E516-R518 IonicContact OE2-NH2 3.77Å
517	G	82.3	Confident	82.5	Confident	54 Å²	54	64 Å²	64	56%	0.557	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.9	14.4	-174.5	0	0	0	0	0	114.1	D513 T514 L515 K519	D513-G517 PolarHBondContact O-N 3.27Å; T514-G517 PolarHBondContact O-N 3.13Å; L515-G517 PolarHBondContact O-N 3.14Å; G517-K519 PolarHBondContact O-N 3.04Å
518	R	80.4	Confident	82.2	Confident	113 Å²	113	65.5 Å²	65.5	43%	0.426	34%	0.34	S	S	.	.			trans	-61.5	123.2	177.8	-70	-160.6	-71.6	-118.9	-3.8	110	D513 E516 R524	D513-R518 HydrophobicContact CB-CB 4.21Å; D513-R518 PolarHBondContact O-N 2.9Å; D513-R518 IonicContact OD1-CZ 3.28Å; D513-R518 IonicContact OD1-NE 3.96Å; D513-R518 PolarHBondContact OD1-NE 2.67Å; D513-R518 IonicContact OD1-NH2 2.59Å; D513-R518 PolarHBondContact OD1-NH2 3.3Å; E516-R518 HydrophobicContact CB-CG 3.98Å; E516-R518 PolarHBondContact O-N 3.29Å; E516-R518 IonicContact OE1-CZ 3.14Å; E516-R518 IonicContact OE1-NE 2.71Å; E516-R518 IonicContact OE1-NH1 2.75Å; E516-R518 PolarHBondContact OE1-NH1 2.95Å; E516-R518 IonicContact OE1-NH2 3.97Å; E516-R518 PolarHBondContact OE1-NH2 3.1Å; E516-R518 IonicContact OE2-CZ 2.8Å; E516-R518 IonicContact OE2-NE 2.91Å; E516-R518 IonicContact OE2-NH1 3.04Å; E516-R518 PolarHBondContact OE2-NH1 2.99Å; E516-R518 IonicContact OE2-NH2 3.77Å; R518-R524 PolarHBondContact O-NH2 3.45Å
519	K	66.4	Low	81.8	Confident	205 Å²	205	64 Å²	64	89%	0.891	33%	0.333	S	S	*	.			trans	-91.5	107.1	173.9	-69	-177.1	-179	177.2	0	108.8	G517	G517-K519 PolarHBondContact O-N 3.04Å
520	S	63.3	Low	81.3	Confident	57 Å²	57	61.8 Å²	61.8	40%	0.399	31%	0.313	S	S	.	.			trans	-92.2	133.4	167.6	158.2	0	0	0	0	109.2	K522	S520-K522 PolarHBondContact O-N 3.21Å; S520-K522 WeakPolarHBondContact OG-CA 3.08Å; S520-K522 WeakPolarHBondContact OG-CB 3.46Å; S520-K522 PolarHBondContact OG-N 3.48Å; S520-K522 PolarHBondContact OG-O 2.93Å
521	D	59.1	Low	80.8	Confident	179 Å²	179	66.1 Å²	66.1	96%	0.957	33%	0.331	S	S	*	.	S	Bend	trans	-68.9	-18.2	169.6	-60	-44.6	0	0	0	112.4
522	K	71.7	Confident	80.5	Confident	128 Å²	128	67.4 Å²	67.4	56%	0.557	34%	0.339	S	S	*	.	S	Bend	trans	-81.8	139	173.1	-55.2	178.1	-175.8	174.3	0	110.3	S520 R524	S520-K522 PolarHBondContact O-N 3.21Å; S520-K522 WeakPolarHBondContact OG-CA 3.08Å; S520-K522 WeakPolarHBondContact OG-CB 3.46Å; S520-K522 PolarHBondContact OG-N 3.48Å; S520-K522 PolarHBondContact OG-O 2.93Å; K522-R524 PolarHBondContact O-N 3.46Å
523	E	78.4	Confident	80	Confident	92 Å²	92	64 Å²	64	43%	0.43	32%	0.322	S	S	.	.	P	Polyproline II helix	trans	-67.2	129.4	173.1	177.7	160.7	-144	0	0	111.7	N527 K531	E523-N527 HydrophobicContact CG-CB 3.82Å; E523-N527 WeakPolarHBondContact OE1-CB 3.39Å; E523-K531 WeakPolarHBondContact OE1-CE 3.36Å; E523-K531 IonicContact OE1-NZ 3.72Å; E523-K531 PolarHBondContact OE1-NZ 2.94Å; E523-K531 IonicContact OE2-NZ 2.82Å; E523-K531 PolarHBondContact OE2-NZ 2.81Å
524	R	83.4	Confident	79.5	Confident	54 Å²	54	63.9 Å²	63.9	20%	0.204	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-56.2	136.8	174.6	-66.5	-170.2	-178.3	133.6	5.2	111.4	D510 T514 R518 K522 W526 N527 T528	D510-R524 HydrophobicContact CB-CB 4.27Å; D510-R524 HydrophobicContact CB-CG 4.31Å; D510-R524 VanDerWaalsContact CG-CB 3.47Å; D510-R524 VanDerWaalsContact OD1-CA 3.28Å; D510-R524 WeakPolarHBondContact OD1-CA 3.38Å; D510-R524 VanDerWaalsContact OD1-CB 3.29Å; D510-R524 WeakPolarHBondContact OD1-CB 3.49Å; D510-R524 VanDerWaalsContact OD1-CG 3.31Å; D510-R524 WeakPolarHBondContact OD1-CG 3.37Å; D510-R524 WeakPolarHBondContact OD2-CB 3.35Å; T514-R524 PolarHBondContact OG1-NE 2.93Å; T514-R524 PolarHBondContact OG1-NH1 3.28Å; R518-R524 PolarHBondContact O-NH2 3.45Å; K522-R524 PolarHBondContact O-N 3.46Å; R524-W526 HydrophobicContact CB-CG 4.39Å; R524-W526 PolarHBondContact O-N 2.95Å; R524-N527 WeakPolarHBondContact O-CB 3.36Å; R524-N527 PolarHBondContact O-N 2.7Å; R524-T528 PolarHBondContact O-N 2.87Å
525	V	85.4	Confident	79.2	Confident	18 Å²	18	66.1 Å²	66.1	11%	0.109	33%	0.33	C	S	.	.	H	α-helix	trans	-53.6	-39.3	177.4	-176.4	0	0	0	0	110.8	V13 L503 D510 N527 T528 I529	V13-V525 HydrophobicContact CG2-CG2 3.79Å; L503-V525 HydrophobicContact CD1-CG1 3.88Å; D510-V525 WeakPolarHBondContact OD2-CA 3.32Å; D510-V525 WeakPolarHBondContact OD2-CB 3.5Å; D510-V525 PolarHBondContact OD2-N 3.33Å; V525-N527 PolarHBondContact O-N 3.08Å; V525-N527 VanDerWaalsContact O-N 3.11Å; V525-T528 PolarHBondContact O-N 2.77Å; V525-I529 HydrophobicContact CG1-CD1 3.97Å; V525-I529 WeakPolarHBondContact O-CG1 3.3Å; V525-I529 PolarHBondContact O-N 2.99Å
526	W	84.4	Confident	78.9	Confident	3 Å²	3	65.5 Å²	65.5	1%	0.011	33%	0.325	C	S	.	.	H	α-helix	trans	-59.2	-25.3	177.5	82.9	19.5	0	0	0	113.7	M458 L461 I480 L507 D510 A511 T514 R524 Q530	M458-W526 HydrophobicContact CE-CB 4.46Å; L461-W526 HydrophobicContact CB-CD2 4.24Å; L461-W526 HydrophobicContact CB-CE3 3.98Å; L461-W526 HydrophobicContact CB-CZ3 4.38Å; L461-W526 HydrophobicContact CD1-CB 4.1Å; L461-W526 HydrophobicContact CD1-CD2 4.48Å; L461-W526 HydrophobicContact CD1-CE3 3.87Å; L461-W526 HydrophobicContact CD2-CE3 3.68Å; L461-W526 HydrophobicContact CD2-CZ3 3.61Å; L461-W526 HydrophobicContact CG-CE3 4.02Å; L461-W526 HydrophobicContact CG-CZ3 4.39Å; I480-W526 HydrophobicContact CD1-CH2 3.76Å; I480-W526 HydrophobicContact CG1-CH2 3.91Å; I480-W526 HydrophobicContact CG1-CZ3 4.38Å; L507-W526 HydrophobicContact CD2-CB 3.74Å; D510-W526 HydrophobicContact CB-CE3 4.35Å; D510-W526 PolarHBondContact OD2-N 3.39Å; D510-W526 VanDerWaalsContact OD2-N 3.11Å; A511-W526 HydrophobicContact CB-CZ3 4.08Å; T514-W526 HydrophobicContact CG2-CH2 4.23Å; T514-W526 HydrophobicContact CG2-CZ2 4.45Å; R524-W526 HydrophobicContact CB-CG 4.39Å; R524-W526 PolarHBondContact O-N 2.95Å; W526-Q530 WeakPolarHBondContact O-CG 3.26Å; W526-Q530 PolarHBondContact O-N 2.97Å; W526-Q530 PolarHBondContact O-NE2 3.46Å
527	N	81.3	Confident	78.5	Confident	42 Å²	42	61 Å²	61	23%	0.225	30%	0.304	C	S	.	.	H	α-helix	trans	-89.3	-39.4	-175.7	-76.4	-25.7	0	0	0	109.4	E523 R524 V525 I529 Q530 K531	E523-N527 HydrophobicContact CG-CB 3.82Å; E523-N527 WeakPolarHBondContact OE1-CB 3.39Å; R524-N527 WeakPolarHBondContact O-CB 3.36Å; R524-N527 PolarHBondContact O-N 2.7Å; V525-N527 PolarHBondContact O-N 3.08Å; V525-N527 VanDerWaalsContact O-N 3.11Å; N527-I529 VanDerWaalsContact C-N 3.29Å; N527-I529 PolarHBondContact O-N 3.13Å; N527-Q530 PolarHBondContact O-N 3.26Å; N527-K531 WeakPolarHBondContact O-CB 3.44Å; N527-K531 WeakPolarHBondContact O-CG 3.44Å; N527-K531 PolarHBondContact O-N 3.14Å
528	T	84.2	Confident	78.4	Confident	33 Å²	33	61.2 Å²	61.2	20%	0.202	29%	0.29	C	S	.	.	H	α-helix	trans	-55.5	-45.9	170.2	-56.9	0	0	0	0	110.5	V13 R524 V525 K531 V532	V13-T528 HydrophobicContact CG1-CG2 4.27Å; R524-T528 PolarHBondContact O-N 2.87Å; V525-T528 PolarHBondContact O-N 2.77Å; T528-K531 PolarHBondContact O-N 2.98Å; T528-V532 WeakPolarHBondContact O-CB 3.16Å; T528-V532 WeakPolarHBondContact O-CG2 3.39Å; T528-V532 PolarHBondContact O-N 3.09Å
529	I	82.8	Confident	78.6	Confident	12 Å²	12	60.7 Å²	60.7	6%	0.062	30%	0.295	C	S	.	.	H	α-helix	trans	-64.5	-43.3	175.7	-63.5	167.5	0	0	0	111.2	L406 P407 M458 L503 L507 V525 N527 K531 V532 G533	L406-I529 HydrophobicContact CD2-CG2 4.17Å; P407-I529 HydrophobicContact CG-CG2 3.92Å; M458-I529 HydrophobicContact CE-CB 3.99Å; M458-I529 HydrophobicContact CE-CD1 4.43Å; M458-I529 HydrophobicContact CE-CG2 3.72Å; L503-I529 HydrophobicContact CD1-CD1 3.71Å; L507-I529 HydrophobicContact CD2-CD1 4.49Å; V525-I529 HydrophobicContact CG1-CD1 3.97Å; V525-I529 WeakPolarHBondContact O-CG1 3.3Å; V525-I529 PolarHBondContact O-N 2.99Å; N527-I529 VanDerWaalsContact C-N 3.29Å; N527-I529 PolarHBondContact O-N 3.13Å; I529-K531 PolarHBondContact O-N 2.74Å; I529-V532 PolarHBondContact O-N 3.31Å; I529-G533 PolarHBondContact O-N 3.4Å
530	Q	79.3	Confident	79.3	Confident	8 Å²	8	54.7 Å²	54.7	4%	0.037	27%	0.268	C	S	.	.	H	α-helix	trans	-63.1	-38.9	176	-73.3	171.1	41.2	0	0	112.8	F409 H462 W526 N527 R534	F409-Q530 HydrophobicContact CE1-CB 4.44Å; F409-Q530 HydrophobicContact CE1-CG 4.2Å; F409-Q530 HydrophobicContact CZ-CB 3.94Å; F409-Q530 HydrophobicContact CZ-CG 3.86Å; H462-Q530 PolarHBondContact ND1-OE1 3.45Å; W526-Q530 WeakPolarHBondContact O-CG 3.26Å; W526-Q530 PolarHBondContact O-N 2.97Å; W526-Q530 PolarHBondContact O-NE2 3.46Å; N527-Q530 PolarHBondContact O-N 3.26Å; Q530-R534 WeakPolarHBondContact O-CB 3.38Å; Q530-R534 WeakPolarHBondContact O-CD 3.3Å; Q530-R534 WeakPolarHBondContact O-CG 3.13Å; Q530-R534 PolarHBondContact O-N 2.97Å; Q530-R534 VanDerWaalsContact O-N 3.15Å
531	K	81.1	Confident	80.1	Confident	111 Å²	111	55.2 Å²	55.2	48%	0.483	26%	0.264	S	S	.	.	H	α-helix	trans	-63.3	-44.6	172.9	-77.1	173.6	170.9	176.7	0	111.6	E523 N527 T528 I529 R534 I535	E523-K531 WeakPolarHBondContact OE1-CE 3.36Å; E523-K531 IonicContact OE1-NZ 3.72Å; E523-K531 PolarHBondContact OE1-NZ 2.94Å; E523-K531 IonicContact OE2-NZ 2.82Å; E523-K531 PolarHBondContact OE2-NZ 2.81Å; N527-K531 WeakPolarHBondContact O-CB 3.44Å; N527-K531 WeakPolarHBondContact O-CG 3.44Å; N527-K531 PolarHBondContact O-N 3.14Å; T528-K531 PolarHBondContact O-N 2.98Å; I529-K531 PolarHBondContact O-N 2.74Å; K531-R534 PolarHBondContact O-N 3.03Å; K531-I535 WeakPolarHBondContact O-CG1 3.41Å; K531-I535 PolarHBondContact O-N 3.44Å
532	V	82.9	Confident	81.3	Confident	27 Å²	27	51 Å²	51	16%	0.164	24%	0.24	C	C	.	.	H	α-helix	trans	-64.2	-49.2	179.6	155.5	0	0	0	0	111.6	F21 L406 T528 I529 R534 I535 E536	F21-V532 HydrophobicContact CE1-CG1 4.15Å; F21-V532 HydrophobicContact CE2-CG1 4.35Å; F21-V532 HydrophobicContact CZ-CG1 3.53Å; F21-V532 HydrophobicContact CZ-CG2 4.34Å; L406-V532 HydrophobicContact CD1-CG1 3.42Å; L406-V532 VanDerWaalsContact CD1-CG1 3.42Å; L406-V532 HydrophobicContact CD2-CG1 3.83Å; L406-V532 HydrophobicContact CG-CG1 4.26Å; T528-V532 WeakPolarHBondContact O-CB 3.16Å; T528-V532 WeakPolarHBondContact O-CG2 3.39Å; T528-V532 PolarHBondContact O-N 3.09Å; I529-V532 PolarHBondContact O-N 3.31Å; V532-R534 VanDerWaalsContact C-N 3.32Å; V532-R534 PolarHBondContact O-N 3.22Å; V532-I535 WeakPolarHBondContact O-CB 3.44Å; V532-I535 PolarHBondContact O-N 3.42Å; V532-E536 PolarHBondContact O-N 2.83Å
533	G	80.8	Confident	82	Confident	0 Å²	0	50 Å²	50	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-62.5	-35.6	177	0	0	0	0	0	113.1	I529 I535 E536 D537	I529-G533 PolarHBondContact O-N 3.4Å; G533-I535 VanDerWaalsContact C-N 3.3Å; G533-I535 PolarHBondContact O-N 3.36Å; G533-E536 PolarHBondContact O-N 3.37Å; G533-D537 WeakPolarHBondContact O-CB 3.35Å; G533-D537 PolarHBondContact O-N 3.12Å
534	R	79.1	Confident	82.2	Confident	37 Å²	37	49 Å²	49	14%	0.14	24%	0.236	C	C	.	.	H	α-helix	trans	-61.2	-34.8	171.8	-75.6	167.6	176.4	-116.3	-13.2	113.4	F409 P415 Q530 K531 V532 F538	F409-R534 HydrophobicContact CB-CG 4.47Å; F409-R534 HydrophobicContact CD1-CG 4.45Å; F409-R534 HydrophobicContact CD2-CB 4.45Å; F409-R534 HydrophobicContact CD2-CG 3.64Å; F409-R534 HydrophobicContact CE2-CG 4Å; F409-R534 HydrophobicContact CG-CG 3.9Å; P415-R534 HydrophobicContact CB-CB 4.38Å; Q530-R534 WeakPolarHBondContact O-CB 3.38Å; Q530-R534 WeakPolarHBondContact O-CD 3.3Å; Q530-R534 WeakPolarHBondContact O-CG 3.13Å; Q530-R534 PolarHBondContact O-N 2.97Å; Q530-R534 VanDerWaalsContact O-N 3.15Å; K531-R534 PolarHBondContact O-N 3.03Å; V532-R534 VanDerWaalsContact C-N 3.32Å; V532-R534 PolarHBondContact O-N 3.22Å; R534-F538 WeakPolarHBondContact O-CB 3.4Å; R534-F538 PolarHBondContact O-N 3.05Å
535	I	82.1	Confident	82.3	Confident	66 Å²	66	50.5 Å²	50.5	34%	0.338	25%	0.248	S	C	.	.	H	α-helix	trans	-73.7	-43.5	176.7	-66.5	164.7	0	0	0	110	P415 F416 K531 V532 G533 F538 L539	P415-I535 HydrophobicContact CB-CG1 4.48Å; F416-I535 HydrophobicContact CE1-CD1 4.12Å; F416-I535 HydrophobicContact CE1-CG1 4.13Å; F416-I535 HydrophobicContact CZ-CD1 4.04Å; F416-I535 HydrophobicContact CZ-CG1 3.98Å; K531-I535 WeakPolarHBondContact O-CG1 3.41Å; K531-I535 PolarHBondContact O-N 3.44Å; V532-I535 WeakPolarHBondContact O-CB 3.44Å; V532-I535 PolarHBondContact O-N 3.42Å; G533-I535 VanDerWaalsContact C-N 3.3Å; G533-I535 PolarHBondContact O-N 3.36Å; I535-F538 PolarHBondContact O-N 3.02Å; I535-L539 HydrophobicContact CG2-CD1 4.24Å; I535-L539 WeakPolarHBondContact O-CG 3.46Å; I535-L539 PolarHBondContact O-N 2.84Å
536	E	81.7	Confident	82.4	Confident	36 Å²	36	55.7 Å²	55.7	17%	0.168	27%	0.269	C	S	.	.	H	α-helix	trans	-60.6	-45.6	175.5	-159.9	-171.6	-138.7	0	0	111.4	L406 V532 G533 F538 L539 Y540	L406-E536 HydrophobicContact CD1-CB 4.25Å; V532-E536 PolarHBondContact O-N 2.83Å; G533-E536 PolarHBondContact O-N 3.37Å; E536-F538 VanDerWaalsContact C-N 3.28Å; E536-F538 PolarHBondContact O-N 2.81Å; E536-L539 PolarHBondContact O-N 2.86Å; E536-L539 VanDerWaalsContact O-N 3.12Å; E536-Y540 HydrophobicContact CG-CD2 3.96Å; E536-Y540 HydrophobicContact CG-CE2 3.54Å; E536-Y540 VanDerWaalsContact O-CD2 3.27Å; E536-Y540 WeakPolarHBondContact O-CD2 3.24Å; E536-Y540 PolarHBondContact O-N 2.87Å
537	D	78.4	Confident	82.6	Confident	5 Å²	5	58.7 Å²	58.7	3%	0.027	29%	0.285	C	S	.	.	H	α-helix	trans	-60.3	-34.4	175.6	-91.3	13.6	0	0	0	113.4	R404 F409 G533 Q541	R404-D537 IonicContact CZ-OD1 2.86Å; R404-D537 VanDerWaalsContact CZ-OD1 3.28Å; R404-D537 IonicContact NE-OD1 3.5Å; R404-D537 VanDerWaalsContact NH1-CG 3.33Å; R404-D537 IonicContact NH1-OD1 3.29Å; R404-D537 PolarHBondContact NH1-OD1 3.4Å; R404-D537 IonicContact NH1-OD2 2.87Å; R404-D537 IonicContact NH2-OD1 2.69Å; F409-D537 PolarHBondContact N-OD2 2.83Å; G533-D537 WeakPolarHBondContact O-CB 3.35Å; G533-D537 PolarHBondContact O-N 3.12Å; D537-Q541 WeakPolarHBondContact O-CB 3.32Å; D537-Q541 VanDerWaalsContact O-CG 3.27Å; D537-Q541 WeakPolarHBondContact O-CG 3.49Å; D537-Q541 PolarHBondContact O-N 2.93Å; D537-Q541 VanDerWaalsContact O-N 3.13Å; D537-Q541 PolarHBondContact O-NE2 3.37Å
538	F	81.1	Confident	82.9	Confident	59 Å²	59	62.1 Å²	62.1	26%	0.259	30%	0.298	S	S	.	.	H	α-helix	trans	-72.1	-41	173.9	178.5	-114.3	0	0	0	111.9	K413 P415 R534 I535 E536 Q541 L542	K413-F538 WeakPolarHBondContact O-CE2 3.43Å; P415-F538 HydrophobicContact CB-CB 4.28Å; P415-F538 HydrophobicContact CG-CB 4.04Å; P415-F538 HydrophobicContact CG-CD1 3.89Å; P415-F538 HydrophobicContact CG-CD2 4.48Å; P415-F538 HydrophobicContact CG-CE1 4.45Å; P415-F538 HydrophobicContact CG-CG 3.9Å; R534-F538 WeakPolarHBondContact O-CB 3.4Å; R534-F538 PolarHBondContact O-N 3.05Å; I535-F538 PolarHBondContact O-N 3.02Å; E536-F538 VanDerWaalsContact C-N 3.28Å; E536-F538 PolarHBondContact O-N 2.81Å; F538-Q541 WeakPolarHBondContact O-CB 3.43Å; F538-Q541 PolarHBondContact O-N 2.74Å; F538-L542 HydrophobicContact CD1-CD1 4.07Å; F538-L542 HydrophobicContact CE1-CD1 3.58Å; F538-L542 HydrophobicContact CE1-CG 4.25Å; F538-L542 HydrophobicContact CE2-CD1 4.44Å; F538-L542 HydrophobicContact CE2-CD2 4.34Å; F538-L542 HydrophobicContact CE2-CG 4.27Å; F538-L542 HydrophobicContact CZ-CD1 3.79Å; F538-L542 HydrophobicContact CZ-CD2 4.2Å; F538-L542 HydrophobicContact CZ-CG 4.09Å; F538-L542 WeakPolarHBondContact O-CG 3.26Å; F538-L542 PolarHBondContact O-N 2.88Å
539	L	83.9	Confident	83.2	Confident	103 Å²	103	63.4 Å²	63.4	54%	0.539	31%	0.306	S	S	.	.	H	α-helix	trans	-62.5	-44.6	175.9	-69.4	171.7	0	0	0	111.6	I535 E536 Q541 L542 E543	I535-L539 HydrophobicContact CG2-CD1 4.24Å; I535-L539 WeakPolarHBondContact O-CG 3.46Å; I535-L539 PolarHBondContact O-N 2.84Å; E536-L539 PolarHBondContact O-N 2.86Å; E536-L539 VanDerWaalsContact O-N 3.12Å; L539-Q541 VanDerWaalsContact C-N 3.34Å; L539-Q541 PolarHBondContact O-N 3.37Å; L539-L542 PolarHBondContact O-N 3.02Å; L539-E543 PolarHBondContact O-N 3.34Å
540	Y	81.2	Confident	83.7	Confident	79 Å²	79	68.6 Å²	68.6	31%	0.31	33%	0.328	S	S	.	.	H	α-helix	trans	-61.5	-39.1	173.3	-75.8	-55.5	0	0	0	112.9	R404 E536 E543 D544	R404-Y540 HydrophobicContact CG-CD2 4.42Å; R404-Y540 HydrophobicContact CG-CE2 3.73Å; R404-Y540 VanDerWaalsContact NE-CD2 3.26Å; E536-Y540 HydrophobicContact CG-CD2 3.96Å; E536-Y540 HydrophobicContact CG-CE2 3.54Å; E536-Y540 VanDerWaalsContact O-CD2 3.27Å; E536-Y540 WeakPolarHBondContact O-CD2 3.24Å; E536-Y540 PolarHBondContact O-N 2.87Å; Y540-E543 PolarHBondContact O-N 3.02Å; Y540-D544 WeakPolarHBondContact O-CB 3.23Å; Y540-D544 PolarHBondContact O-N 3.28Å
541	Q	80.1	Confident	84.2	Confident	67 Å²	67	75.7 Å²	75.7	31%	0.313	36%	0.359	S	S	.	.	H	α-helix	trans	-63.4	-40	174.1	-79	178.7	77.9	0	0	111.9	H412 D537 F538 L539 N545	H412-Q541 PolarHBondContact O-NE2 2.81Å; D537-Q541 WeakPolarHBondContact O-CB 3.32Å; D537-Q541 VanDerWaalsContact O-CG 3.27Å; D537-Q541 WeakPolarHBondContact O-CG 3.49Å; D537-Q541 PolarHBondContact O-N 2.93Å; D537-Q541 VanDerWaalsContact O-N 3.13Å; D537-Q541 PolarHBondContact O-NE2 3.37Å; F538-Q541 WeakPolarHBondContact O-CB 3.43Å; F538-Q541 PolarHBondContact O-N 2.74Å; L539-Q541 VanDerWaalsContact C-N 3.34Å; L539-Q541 PolarHBondContact O-N 3.37Å; Q541-N545 VanDerWaalsContact O-CB 3.29Å; Q541-N545 WeakPolarHBondContact O-CB 3.39Å; Q541-N545 VanDerWaalsContact O-CG 3.26Å; Q541-N545 PolarHBondContact O-N 3.09Å; Q541-N545 VanDerWaalsContact O-N 3.1Å; Q541-N545 PolarHBondContact O-ND2 3.44Å
542	L	83.6	Confident	84.6	Confident	90 Å²	90	74.8 Å²	74.8	47%	0.471	36%	0.358	S	S	.	.	H	α-helix	trans	-66.1	-43.1	175.3	-70.9	178.9	0	0	0	111.9	F538 L539 N545 F546	F538-L542 HydrophobicContact CD1-CD1 4.07Å; F538-L542 HydrophobicContact CE1-CD1 3.58Å; F538-L542 HydrophobicContact CE1-CG 4.25Å; F538-L542 HydrophobicContact CE2-CD1 4.44Å; F538-L542 HydrophobicContact CE2-CD2 4.34Å; F538-L542 HydrophobicContact CE2-CG 4.27Å; F538-L542 HydrophobicContact CZ-CD1 3.79Å; F538-L542 HydrophobicContact CZ-CD2 4.2Å; F538-L542 HydrophobicContact CZ-CG 4.09Å; F538-L542 WeakPolarHBondContact O-CG 3.26Å; F538-L542 PolarHBondContact O-N 2.88Å; L539-L542 PolarHBondContact O-N 3.02Å; L542-N545 PolarHBondContact O-N 3.4Å; L542-F546 VanDerWaalsContact O-CB 3.31Å; L542-F546 WeakPolarHBondContact O-CB 3.42Å; L542-F546 PolarHBondContact O-N 2.99Å
543	E	85.9	Confident	84.9	Confident	108 Å²	108	81.3 Å²	81.3	51%	0.505	38%	0.38	S	S	.	.	H	α-helix	trans	-62.8	-50.2	178.2	-176.5	176.1	-156	0	0	111.9	L539 Y540 N545 F546 L547	L539-E543 PolarHBondContact O-N 3.34Å; Y540-E543 PolarHBondContact O-N 3.02Å; E543-N545 PolarHBondContact O-N 3.32Å; E543-F546 CarbonylContact O-C 3.47Å; E543-F546 WeakPolarHBondContact O-CB 3.15Å; E543-F546 PolarHBondContact O-N 2.63Å; E543-F546 VanDerWaalsContact O-N 3.14Å; E543-L547 HydrophobicContact CG-CD1 3.87Å; E543-L547 HydrophobicContact CG-CG 4.22Å; E543-L547 WeakPolarHBondContact O-CB 3.38Å; E543-L547 VanDerWaalsContact O-CG 3.32Å; E543-L547 WeakPolarHBondContact O-CG 3.31Å; E543-L547 PolarHBondContact O-N 2.87Å
544	D	83.3	Confident	85.4	Confident	71 Å²	71	84.6 Å²	84.6	38%	0.38	40%	0.4	S	S	.	.	H	α-helix	trans	-61.1	-43.1	178.7	173	40.8	0	0	0	111.6	Y540 F546 L547 K548	Y540-D544 WeakPolarHBondContact O-CB 3.23Å; Y540-D544 PolarHBondContact O-N 3.28Å; D544-F546 VanDerWaalsContact C-N 3.35Å; D544-F546 PolarHBondContact O-N 2.8Å; D544-L547 PolarHBondContact O-N 3.39Å; D544-K548 VanDerWaalsContact CG-NZ 3.32Å; D544-K548 WeakPolarHBondContact O-CB 3.44Å; D544-K548 VanDerWaalsContact O-CG 3.29Å; D544-K548 WeakPolarHBondContact O-CG 3.47Å; D544-K548 PolarHBondContact O-N 2.91Å; D544-K548 WeakPolarHBondContact OD1-CD 3.38Å; D544-K548 WeakPolarHBondContact OD1-CE 3.34Å; D544-K548 IonicContact OD1-NZ 3.08Å; D544-K548 PolarHBondContact OD1-NZ 2.75Å; D544-K548 WeakPolarHBondContact OD2-CE 3.4Å; D544-K548 IonicContact OD2-NZ 2.91Å; D544-K548 PolarHBondContact OD2-NZ 2.71Å
545	N	85.1	Confident	85.9	Confident	86 Å²	86	85.2 Å²	85.2	46%	0.46	41%	0.413	S	S	.	.	H	α-helix	trans	-62.5	-39.2	173.9	-77.4	-45	0	0	0	112.6	Q541 L542 E543 T549	Q541-N545 VanDerWaalsContact O-CB 3.29Å; Q541-N545 WeakPolarHBondContact O-CB 3.39Å; Q541-N545 VanDerWaalsContact O-CG 3.26Å; Q541-N545 PolarHBondContact O-N 3.09Å; Q541-N545 VanDerWaalsContact O-N 3.1Å; Q541-N545 PolarHBondContact O-ND2 3.44Å; L542-N545 PolarHBondContact O-N 3.4Å; E543-N545 PolarHBondContact O-N 3.32Å; N545-T549 VanDerWaalsContact O-CB 3.27Å; N545-T549 WeakPolarHBondContact O-CB 3.32Å; N545-T549 PolarHBondContact O-N 2.89Å; N545-T549 PolarHBondContact O-OG1 3.41Å
546	F	88.4	Confident	86.3	Confident	126 Å²	126	90 Å²	90	55%	0.553	43%	0.427	S	S	*	.	H	α-helix	trans	-65.3	-45.2	173.9	174.7	-100.3	0	0	0	111.7	L542 E543 D544 T549 K550	L542-F546 VanDerWaalsContact O-CB 3.31Å; L542-F546 WeakPolarHBondContact O-CB 3.42Å; L542-F546 PolarHBondContact O-N 2.99Å; E543-F546 CarbonylContact O-C 3.47Å; E543-F546 WeakPolarHBondContact O-CB 3.15Å; E543-F546 PolarHBondContact O-N 2.63Å; E543-F546 VanDerWaalsContact O-N 3.14Å; D544-F546 VanDerWaalsContact C-N 3.35Å; D544-F546 PolarHBondContact O-N 2.8Å; F546-T549 PolarHBondContact O-N 2.97Å; F546-K550 HydrophobicContact CE1-CD 4.16Å; F546-K550 VanDerWaalsContact O-CB 3.28Å; F546-K550 WeakPolarHBondContact O-CB 3.38Å; F546-K550 PolarHBondContact O-N 3.5Å
547	L	88.4	Confident	86.7	Confident	67 Å²	67	97.6 Å²	97.6	35%	0.351	45%	0.454	S	S	.	.	H	α-helix	trans	-65.4	-42.3	178.6	-70.8	175	0	0	0	112	E543 D544 K550 K551	E543-L547 HydrophobicContact CG-CD1 3.87Å; E543-L547 HydrophobicContact CG-CG 4.22Å; E543-L547 WeakPolarHBondContact O-CB 3.38Å; E543-L547 VanDerWaalsContact O-CG 3.32Å; E543-L547 WeakPolarHBondContact O-CG 3.31Å; E543-L547 PolarHBondContact O-N 2.87Å; D544-L547 PolarHBondContact O-N 3.39Å; L547-K550 PolarHBondContact O-N 3Å; L547-K551 WeakPolarHBondContact O-CB 3.45Å; L547-K551 VanDerWaalsContact O-CG 3.31Å; L547-K551 WeakPolarHBondContact O-CG 3.36Å; L547-K551 PolarHBondContact O-N 2.94Å
548	K	88.3	Confident	87.1	Confident	113 Å²	113	103 Å²	103	49%	0.491	48%	0.479	S	S	.	.	H	α-helix	trans	-58.8	-47.2	171	-76.6	165.8	172.6	164.5	0	111.4	D544 K550 K551 L552	D544-K548 VanDerWaalsContact CG-NZ 3.32Å; D544-K548 WeakPolarHBondContact O-CB 3.44Å; D544-K548 VanDerWaalsContact O-CG 3.29Å; D544-K548 WeakPolarHBondContact O-CG 3.47Å; D544-K548 PolarHBondContact O-N 2.91Å; D544-K548 WeakPolarHBondContact OD1-CD 3.38Å; D544-K548 WeakPolarHBondContact OD1-CE 3.34Å; D544-K548 IonicContact OD1-NZ 3.08Å; D544-K548 PolarHBondContact OD1-NZ 2.75Å; D544-K548 WeakPolarHBondContact OD2-CE 3.4Å; D544-K548 IonicContact OD2-NZ 2.91Å; D544-K548 PolarHBondContact OD2-NZ 2.71Å; K548-K550 PolarHBondContact O-N 3.17Å; K548-K551 PolarHBondContact O-N 3.48Å; K548-L552 WeakPolarHBondContact O-CB 3.5Å; K548-L552 PolarHBondContact O-N 3.21Å
549	T	90.3	Very high	87.5	Confident	61 Å²	61	107.3 Å²	107.3	37%	0.374	50%	0.498	S	S	.	.	H	α-helix	trans	-63.3	-40.5	177.3	-60.9	0	0	0	0	112	N545 F546 L552 R553	N545-T549 VanDerWaalsContact O-CB 3.27Å; N545-T549 WeakPolarHBondContact O-CB 3.32Å; N545-T549 PolarHBondContact O-N 2.89Å; N545-T549 PolarHBondContact O-OG1 3.41Å; F546-T549 PolarHBondContact O-N 2.97Å; T549-L552 PolarHBondContact O-N 3.02Å; T549-R553 WeakPolarHBondContact O-CB 3.45Å; T549-R553 VanDerWaalsContact O-CG 3.26Å; T549-R553 WeakPolarHBondContact O-CG 3.22Å; T549-R553 PolarHBondContact O-N 3.11Å
550	K	91.7	Very high	87.6	Confident	121 Å²	121	106.2 Å²	106.2	53%	0.526	50%	0.496	S	S	.	.	H	α-helix	trans	-63.7	-48	175.6	-173.8	176.7	179	-179.2	0	111.2	F546 L547 K548 L552 R553 T554	F546-K550 HydrophobicContact CE1-CD 4.16Å; F546-K550 VanDerWaalsContact O-CB 3.28Å; F546-K550 WeakPolarHBondContact O-CB 3.38Å; F546-K550 PolarHBondContact O-N 3.5Å; L547-K550 PolarHBondContact O-N 3Å; K548-K550 PolarHBondContact O-N 3.17Å; K550-L552 PolarHBondContact O-N 2.59Å; K550-R553 PolarHBondContact O-N 2.79Å; K550-T554 PolarHBondContact O-N 3.1Å; K550-T554 PolarHBondContact O-OG1 2.72Å
551	K	90	Very high	87.8	Confident	156 Å²	156	109.8 Å²	109.8	68%	0.678	51%	0.513	S	S	*	.	H	α-helix	trans	-56.2	-48.4	173.9	-74.7	172.3	179.7	177.9	0	111.3	L547 K548 R553 T554 A555	L547-K551 WeakPolarHBondContact O-CB 3.45Å; L547-K551 VanDerWaalsContact O-CG 3.31Å; L547-K551 WeakPolarHBondContact O-CG 3.36Å; L547-K551 PolarHBondContact O-N 2.94Å; K548-K551 PolarHBondContact O-N 3.48Å; K551-R553 PolarHBondContact O-N 3.37Å; K551-T554 PolarHBondContact O-N 2.95Å; K551-A555 WeakPolarHBondContact O-CB 3.31Å; K551-A555 PolarHBondContact O-N 3.41Å
552	L	90.1	Very high	87.9	Confident	92 Å²	92	112.7 Å²	112.7	48%	0.482	53%	0.528	S	S	.	.	H	α-helix	trans	-62.5	-41.4	178.1	-177.9	61.6	0	0	0	112.8	K548 T549 K550 A555 R556	K548-L552 WeakPolarHBondContact O-CB 3.5Å; K548-L552 PolarHBondContact O-N 3.21Å; T549-L552 PolarHBondContact O-N 3.02Å; K550-L552 PolarHBondContact O-N 2.59Å; L552-A555 PolarHBondContact O-N 3.2Å; L552-R556 HydrophobicContact CD1-CG 4.48Å; L552-R556 WeakPolarHBondContact O-CB 3.48Å; L552-R556 VanDerWaalsContact O-CG 3.29Å; L552-R556 WeakPolarHBondContact O-CG 3.44Å; L552-R556 PolarHBondContact O-N 3.31Å
553	R	90	Very high	87.9	Confident	165 Å²	165	114.8 Å²	114.8	62%	0.623	53%	0.533	S	S	*	.	H	α-helix	trans	-63	-41.2	174.8	-73.9	172.2	-177.8	-173.7	2.6	111.7	T549 K550 K551 R557	T549-R553 WeakPolarHBondContact O-CB 3.45Å; T549-R553 VanDerWaalsContact O-CG 3.26Å; T549-R553 WeakPolarHBondContact O-CG 3.22Å; T549-R553 PolarHBondContact O-N 3.11Å; K550-R553 PolarHBondContact O-N 2.79Å; K551-R553 PolarHBondContact O-N 3.37Å; R553-R557 WeakPolarHBondContact O-CG 3.48Å; R553-R557 PolarHBondContact O-N 3.39Å
554	T	91.2	Very high	87.5	Confident	69 Å²	69	118.3 Å²	118.3	42%	0.423	54%	0.542	S	S	.	.	H	α-helix	trans	-65.8	-47.1	175.6	-60.3	0	0	0	0	111.8	K550 K551 R556 R557 Q558	K550-T554 PolarHBondContact O-N 3.1Å; K550-T554 PolarHBondContact O-OG1 2.72Å; K551-T554 PolarHBondContact O-N 2.95Å; T554-R556 VanDerWaalsContact C-N 3.35Å; T554-R556 PolarHBondContact O-N 3.07Å; T554-R557 WeakPolarHBondContact O-CB 3.45Å; T554-R557 PolarHBondContact O-N 3.48Å; T554-R557 VanDerWaalsContact O-N 3.12Å; T554-Q558 PolarHBondContact O-N 3.37Å
555	A	89.6	Confident	87.1	Confident	49 Å²	49	120 Å²	120	41%	0.405	55%	0.55	S	S	.	*	H	α-helix	trans	-61.1	-41.1	178	0	0	0	0	0	112.2	K551 L552 Q558 K559	K551-A555 WeakPolarHBondContact O-CB 3.31Å; K551-A555 PolarHBondContact O-N 3.41Å; L552-A555 PolarHBondContact O-N 3.2Å; A555-Q558 PolarHBondContact O-N 2.81Å; A555-K559 WeakPolarHBondContact O-CB 3.2Å; A555-K559 PolarHBondContact O-N 3.25Å
556	R	90.2	Very high	86.5	Confident	168 Å²	168	121.4 Å²	121.4	63%	0.634	55%	0.554	S	S	*	*	H	α-helix	trans	-60.1	-46.2	172.1	-74	175.7	-178.7	-167.6	0.6	111.5	L552 T554 Q558 K559 T560	L552-R556 HydrophobicContact CD1-CG 4.48Å; L552-R556 WeakPolarHBondContact O-CB 3.48Å; L552-R556 VanDerWaalsContact O-CG 3.29Å; L552-R556 WeakPolarHBondContact O-CG 3.44Å; L552-R556 PolarHBondContact O-N 3.31Å; T554-R556 VanDerWaalsContact C-N 3.35Å; T554-R556 PolarHBondContact O-N 3.07Å; R556-Q558 PolarHBondContact O-N 3.39Å; R556-K559 PolarHBondContact O-N 3.19Å; R556-T560 PolarHBondContact O-N 3.26Å; R556-T560 PolarHBondContact O-OG1 3.3Å
557	R	88.9	Confident	85.8	Confident	194 Å²	194	119.4 Å²	119.4	73%	0.732	55%	0.552	S	S	*	*	H	α-helix	trans	-60.9	-42	176.1	-75.4	174.3	172.8	-171	-3.6	112.5	R553 T554 K561	R553-R557 WeakPolarHBondContact O-CG 3.48Å; R553-R557 PolarHBondContact O-N 3.39Å; T554-R557 WeakPolarHBondContact O-CB 3.45Å; T554-R557 PolarHBondContact O-N 3.48Å; T554-R557 VanDerWaalsContact O-N 3.12Å; R557-K561 PolarHBondContact O-N 3.1Å
558	Q	87.2	Confident	84.8	Confident	120 Å²	120	122 Å²	122	56%	0.561	57%	0.565	S	S	*	*	H	α-helix	trans	-64.4	-46.2	175.5	-75.7	173.3	-45.2	0	0	111.9	T554 A555 R556 T560 K561 M562	T554-Q558 PolarHBondContact O-N 3.37Å; A555-Q558 PolarHBondContact O-N 2.81Å; R556-Q558 PolarHBondContact O-N 3.39Å; Q558-T560 VanDerWaalsContact C-N 3.32Å; Q558-T560 PolarHBondContact O-N 3.13Å; Q558-K561 PolarHBondContact O-N 3.31Å; Q558-K561 VanDerWaalsContact O-N 3.11Å; Q558-M562 PolarHBondContact O-N 3.24Å
559	K	89.1	Confident	83.4	Confident	149 Å²	149	124.2 Å²	124.2	65%	0.648	58%	0.578	S	S	*	*	H	α-helix	trans	-60.9	-38.7	177.6	-168.1	167.1	-174.5	169.8	0	112.2	A555 R556 K563	A555-K559 WeakPolarHBondContact O-CB 3.2Å; A555-K559 PolarHBondContact O-N 3.25Å; R556-K559 PolarHBondContact O-N 3.19Å; K559-K563 PolarHBondContact O-N 3.38Å
560	T	86.4	Confident	81.7	Confident	80 Å²	80	129 Å²	129	49%	0.491	60%	0.596	S	S	.	*	H	α-helix	trans	-68.7	-37.1	173.7	-56.5	0	0	0	0	112.7	R556 Q558 R564	R556-T560 PolarHBondContact O-N 3.26Å; R556-T560 PolarHBondContact O-OG1 3.3Å; Q558-T560 VanDerWaalsContact C-N 3.32Å; Q558-T560 PolarHBondContact O-N 3.13Å; T560-R564 WeakPolarHBondContact O-CG 3.38Å; T560-R564 PolarHBondContact O-N 3.49Å; T560-R564 VanDerWaalsContact O-N 3.13Å
561	K	86.3	Confident	79.7	Confident	154 Å²	154	132.5 Å²	132.5	67%	0.67	62%	0.62	S	S	*	*	H	α-helix	trans	-64.2	-48.1	173.2	-78.7	-169.3	173.1	-164.8	0	111.9	R557 Q558 K563 R564 L565	R557-K561 PolarHBondContact O-N 3.1Å; Q558-K561 PolarHBondContact O-N 3.31Å; Q558-K561 VanDerWaalsContact O-N 3.11Å; K561-K563 PolarHBondContact O-N 3.02Å; K561-R564 PolarHBondContact O-N 2.96Å; K561-L565 WeakPolarHBondContact O-CG 3.43Å; K561-L565 PolarHBondContact O-N 3.08Å
562	M	82.2	Confident	79.2	Confident	128 Å²	128	131.4 Å²	131.4	63%	0.631	62%	0.617	S	S	*	*	H	α-helix	trans	-58.3	-46.7	176.2	-78.2	179.9	165.7	0	0	111.8	Q558 R564 L565 Q566	Q558-M562 PolarHBondContact O-N 3.24Å; M562-R564 VanDerWaalsContact C-N 3.35Å; M562-R564 PolarHBondContact O-N 3.34Å; M562-L565 PolarHBondContact O-N 2.86Å; M562-Q566 WeakPolarHBondContact O-CG 3.36Å; M562-Q566 PolarHBondContact O-N 2.81Å
563	K	83.3	Confident	78.6	Confident	134 Å²	134	133.4 Å²	133.4	58%	0.583	62%	0.624	S	S	*	*	H	α-helix	trans	-55.8	-46.9	175.8	-83.1	-163.2	166.6	-153.8	0	112.5	K559 K561 L565 Q566 T567	K559-K563 PolarHBondContact O-N 3.38Å; K561-K563 PolarHBondContact O-N 3.02Å; K563-L565 PolarHBondContact O-N 3.03Å; K563-Q566 PolarHBondContact O-N 3.11Å; K563-T567 PolarHBondContact O-N 3Å; K563-T567 PolarHBondContact O-OG1 2.66Å
564	R	77.8	Confident	78	Confident	181 Å²	181	131.7 Å²	131.7	68%	0.683	62%	0.624	S	S	*	*	H	α-helix	trans	-61.4	-41.6	177.5	-75	-177.8	176.4	-169.6	-2.9	112.4	T560 K561 M562 T567 I568	T560-R564 WeakPolarHBondContact O-CG 3.38Å; T560-R564 PolarHBondContact O-N 3.49Å; T560-R564 VanDerWaalsContact O-N 3.13Å; K561-R564 PolarHBondContact O-N 2.96Å; M562-R564 VanDerWaalsContact C-N 3.35Å; M562-R564 PolarHBondContact O-N 3.34Å; R564-T567 PolarHBondContact O-N 3.08Å; R564-I568 WeakPolarHBondContact O-CD1 3.12Å; R564-I568 VanDerWaalsContact O-CG1 3.25Å; R564-I568 WeakPolarHBondContact O-CG1 3.48Å; R564-I568 PolarHBondContact O-N 2.75Å; R564-I568 VanDerWaalsContact O-N 3.11Å
565	L	75.4	Confident	77.2	Confident	107 Å²	107	135.4 Å²	135.4	56%	0.56	64%	0.636	S	S	*	*	H	α-helix	trans	-64.9	-39.6	176.8	-69.4	168	0	0	0	111.8	K561 M562 K563 I568 Q569	K561-L565 WeakPolarHBondContact O-CG 3.43Å; K561-L565 PolarHBondContact O-N 3.08Å; M562-L565 PolarHBondContact O-N 2.86Å; K563-L565 PolarHBondContact O-N 3.03Å; L565-I568 PolarHBondContact O-N 3.38Å; L565-I568 VanDerWaalsContact O-N 3.16Å; L565-Q569 WeakPolarHBondContact O-CG 3.39Å; L565-Q569 PolarHBondContact O-N 2.73Å; L565-Q569 VanDerWaalsContact O-N 3.13Å
566	Q	72.6	Confident	76.4	Confident	115 Å²	115	140.8 Å²	140.8	54%	0.537	65%	0.651	S	S	.	*	H	α-helix	trans	-63.2	-41.8	174.5	-71.4	174.1	-46.4	0	0	112	M562 K563 I568 Q569 Q570	M562-Q566 WeakPolarHBondContact O-CG 3.36Å; M562-Q566 PolarHBondContact O-N 2.81Å; K563-Q566 PolarHBondContact O-N 3.11Å; Q566-I568 PolarHBondContact O-N 3.17Å; Q566-Q569 PolarHBondContact O-N 3.26Å; Q566-Q569 VanDerWaalsContact O-N 3.08Å; Q566-Q570 WeakPolarHBondContact O-CG 3.29Å; Q566-Q570 PolarHBondContact O-N 3.09Å
567	T	72.7	Confident	75.5	Confident	84 Å²	84	138.9 Å²	138.9	52%	0.515	65%	0.652	S	S	.	*	H	α-helix	trans	-65.5	-25.9	174.5	-43.1	0	0	0	0	112.9	K563 R564 Q569	K563-T567 PolarHBondContact O-N 3Å; K563-T567 PolarHBondContact O-OG1 2.66Å; R564-T567 PolarHBondContact O-N 3.08Å; T567-Q569 VanDerWaalsContact C-N 3.34Å
568	I	68.1	Low	74.6	Confident	122 Å²	122	135 Å²	135	63%	0.626	65%	0.646	S	S	*	*	H	α-helix	trans	-83	-10.5	175.4	-66.7	163.1	0	0	0	112	R564 L565 Q566	R564-I568 WeakPolarHBondContact O-CD1 3.12Å; R564-I568 VanDerWaalsContact O-CG1 3.25Å; R564-I568 WeakPolarHBondContact O-CG1 3.48Å; R564-I568 PolarHBondContact O-N 2.75Å; R564-I568 VanDerWaalsContact O-N 3.11Å; L565-I568 PolarHBondContact O-N 3.38Å; L565-I568 VanDerWaalsContact O-N 3.16Å; Q566-I568 PolarHBondContact O-N 3.17Å
569	Q	59.3	Low	73.6	Confident	160 Å²	160	136.2 Å²	136.2	75%	0.748	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.2	5.4	174.6	-68.9	-175.6	-57.5	0	0	113.4	L565 Q566 T567	L565-Q569 WeakPolarHBondContact O-CG 3.39Å; L565-Q569 PolarHBondContact O-N 2.73Å; L565-Q569 VanDerWaalsContact O-N 3.13Å; Q566-Q569 PolarHBondContact O-N 3.26Å; Q566-Q569 VanDerWaalsContact O-N 3.08Å; T567-Q569 VanDerWaalsContact C-N 3.34Å
570	Q	54.6	Low	72.3	Confident	162 Å²	162	135.1 Å²	135.1	76%	0.757	65%	0.653	S	S	*	*			trans	-117.8	4.8	176.2	-68.2	-173.6	-54.3	0	0	112.7	Q566	Q566-Q570 WeakPolarHBondContact O-CG 3.29Å; Q566-Q570 PolarHBondContact O-N 3.09Å
571	N	49	Very low	71	Confident	194 Å²	194	140.1 Å²	140.1	100%	1.037	67%	0.668	S	S	*	*			trans	-118.7	0	167.4	-69.1	3.4	0	0	0	108.4

Retrieved 571 of 571 residues in 344.2 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).