A0A3Q0KKR7_SCHMA Loading...

NRF domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KKR7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 775 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.2	Very low	34.3	Very low	196 Å²	196	133.8 Å²	133.8	97%	0.966	62%	0.617	S	S	*	*				0	-53.9	0	-67.2	-166.1	-160	0	0	113.6	W3 F4 F5	M1-W3 VanDerWaalsContact C-N 3.26Å; M1-W3 PolarHBondContact O-N 3.16Å; M1-F4 WeakPolarHBondContact O-CB 3.28Å; M1-F4 PolarHBondContact O-N 2.91Å; M1-F5 PolarHBondContact O-N 3.36Å; M1-F5 VanDerWaalsContact O-N 3.11Å
2	R	29.2	Very low	34.2	Very low	206 Å²	206	127.7 Å²	127.7	78%	0.777	62%	0.617	S	S	*	*	H	α-helix	trans	-48.7	-44	172.2	-101	-178	174.2	-179.8	-1.9	113.9	F4 L6	R2-F4 VanDerWaalsContact C-N 3.33Å; R2-F4 PolarHBondContact O-N 2.97Å; R2-L6 WeakPolarHBondContact O-CB 2.89Å; R2-L6 PolarHBondContact O-N 3.3Å
3	W	32.9	Very low	34.1	Very low	203 Å²	203	124.2 Å²	124.2	77%	0.769	61%	0.614	S	S	*	*	H	α-helix	trans	-62.3	-34.8	175	-92.2	83.9	0	0	0	114	M1 I7	M1-W3 VanDerWaalsContact C-N 3.26Å; M1-W3 PolarHBondContact O-N 3.16Å; W3-I7 HydrophobicContact CE3-CD1 4.16Å; W3-I7 WeakPolarHBondContact O-CB 3.4Å; W3-I7 WeakPolarHBondContact O-CD1 3.38Å; W3-I7 WeakPolarHBondContact O-CG1 3.41Å; W3-I7 PolarHBondContact O-N 2.76Å
4	F	34.4	Very low	33.6	Very low	148 Å²	148	127.2 Å²	127.2	65%	0.649	62%	0.623	S	S	*	*	H	α-helix	trans	-76	-38.7	-177.1	-142	-88.2	0	0	0	111.5	M1 R2 F8	M1-F4 WeakPolarHBondContact O-CB 3.28Å; M1-F4 PolarHBondContact O-N 2.91Å; R2-F4 VanDerWaalsContact C-N 3.33Å; R2-F4 PolarHBondContact O-N 2.97Å; F4-F8 HydrophobicContact CD1-CD2 4.38Å; F4-F8 HydrophobicContact CE1-CD2 4.32Å; F4-F8 HydrophobicContact CE1-CE2 4.2Å; F4-F8 PolarHBondContact O-N 3.16Å; F4-F8 VanDerWaalsContact O-N 3.12Å
5	F	34.2	Very low	33.3	Very low	144 Å²	144	127.2 Å²	127.2	63%	0.632	63%	0.625	S	S	*	*	H	α-helix	trans	-67.1	-44.1	172.6	-117.9	-84.4	0	0	0	111.5	M1 I7 F8 T9	M1-F5 PolarHBondContact O-N 3.36Å; M1-F5 VanDerWaalsContact O-N 3.11Å; F5-I7 VanDerWaalsContact C-N 3.35Å; F5-I7 PolarHBondContact O-N 2.9Å; F5-F8 PolarHBondContact O-N 2.96Å; F5-T9 PolarHBondContact O-N 3.05Å; F5-T9 PolarHBondContact O-OG1 2.79Å
6	L	32.9	Very low	33.1	Very low	101 Å²	101	125.4 Å²	125.4	53%	0.529	63%	0.626	S	S	.	*	H	α-helix	trans	-57.7	-47.2	174.5	-87.6	159.1	0	0	0	111	R2 F8 T9 T10	R2-L6 WeakPolarHBondContact O-CB 2.89Å; R2-L6 PolarHBondContact O-N 3.3Å; L6-F8 PolarHBondContact O-N 3.17Å; L6-T9 WeakPolarHBondContact CA-OG1 3.29Å; L6-T9 PolarHBondContact O-N 3.37Å; L6-T9 PolarHBondContact O-OG1 2.96Å; L6-T10 VanDerWaalsContact O-CB 3.31Å; L6-T10 WeakPolarHBondContact O-CB 3.42Å; L6-T10 WeakPolarHBondContact O-CG2 3.46Å; L6-T10 PolarHBondContact O-N 3.32Å; L6-T10 PolarHBondContact O-OG1 2.84Å
7	I	36.5	Very low	33	Very low	72 Å²	72	125.1 Å²	125.1	37%	0.369	64%	0.639	S	S	.	*	H	α-helix	trans	-60.6	-41.4	178.4	-74.4	168.9	0	0	0	111.9	W3 F5 T10 L11	W3-I7 HydrophobicContact CE3-CD1 4.16Å; W3-I7 WeakPolarHBondContact O-CB 3.4Å; W3-I7 WeakPolarHBondContact O-CD1 3.38Å; W3-I7 WeakPolarHBondContact O-CG1 3.41Å; W3-I7 PolarHBondContact O-N 2.76Å; F5-I7 VanDerWaalsContact C-N 3.35Å; F5-I7 PolarHBondContact O-N 2.9Å; I7-T10 VanDerWaalsContact CA-OG1 3.3Å; I7-T10 WeakPolarHBondContact CA-OG1 3.43Å; I7-T10 PolarHBondContact O-N 3.28Å; I7-T10 PolarHBondContact O-OG1 2.98Å; I7-T10 VanDerWaalsContact O-OG1 3.13Å; I7-L11 HydrophobicContact CG2-CD1 3.53Å; I7-L11 VanDerWaalsContact O-CB 3.26Å; I7-L11 WeakPolarHBondContact O-CB 3.36Å; I7-L11 WeakPolarHBondContact O-CD1 3.44Å; I7-L11 PolarHBondContact O-N 3.07Å
8	F	36.6	Very low	32.7	Very low	152 Å²	152	129.6 Å²	129.6	67%	0.667	65%	0.648	S	S	*	*	H	α-helix	trans	-70.6	-39.5	178	-108.7	-88.8	0	0	0	112.8	F4 F5 L6 G12	F4-F8 HydrophobicContact CD1-CD2 4.38Å; F4-F8 HydrophobicContact CE1-CD2 4.32Å; F4-F8 HydrophobicContact CE1-CE2 4.2Å; F4-F8 PolarHBondContact O-N 3.16Å; F4-F8 VanDerWaalsContact O-N 3.12Å; F5-F8 PolarHBondContact O-N 2.96Å; L6-F8 PolarHBondContact O-N 3.17Å; F8-G12 PolarHBondContact O-N 3.48Å; F8-G12 VanDerWaalsContact O-N 3.13Å
9	T	39.4	Very low	32.3	Very low	84 Å²	84	127.8 Å²	127.8	52%	0.515	65%	0.645	S	S	.	*	H	α-helix	trans	-68.2	-36.4	173.4	51	0	0	0	0	112.1	F5 L6 S13	F5-T9 PolarHBondContact O-N 3.05Å; F5-T9 PolarHBondContact O-OG1 2.79Å; L6-T9 WeakPolarHBondContact CA-OG1 3.29Å; L6-T9 PolarHBondContact O-N 3.37Å; L6-T9 PolarHBondContact O-OG1 2.96Å; T9-S13 PolarHBondContact O-N 3.24Å; T9-S13 PolarHBondContact O-OG 2.94Å
10	T	34.6	Very low	32.2	Very low	52 Å²	52	132.3 Å²	132.3	32%	0.319	66%	0.66	S	S	.	*	H	α-helix	trans	-75.4	-42	179.8	56.2	0	0	0	0	111.5	L6 I7 G12 S13 F14	L6-T10 VanDerWaalsContact O-CB 3.31Å; L6-T10 WeakPolarHBondContact O-CB 3.42Å; L6-T10 WeakPolarHBondContact O-CG2 3.46Å; L6-T10 PolarHBondContact O-N 3.32Å; L6-T10 PolarHBondContact O-OG1 2.84Å; I7-T10 VanDerWaalsContact CA-OG1 3.3Å; I7-T10 WeakPolarHBondContact CA-OG1 3.43Å; I7-T10 PolarHBondContact O-N 3.28Å; I7-T10 PolarHBondContact O-OG1 2.98Å; I7-T10 VanDerWaalsContact O-OG1 3.13Å; T10-G12 VanDerWaalsContact C-N 3.27Å; T10-G12 PolarHBondContact O-N 2.88Å; T10-S13 VanDerWaalsContact CA-OG 3.3Å; T10-S13 WeakPolarHBondContact CA-OG 3.47Å; T10-S13 CarbonylContact O-C 3.53Å; T10-S13 PolarHBondContact O-N 2.98Å; T10-S13 PolarHBondContact O-OG 3Å; T10-F14 WeakPolarHBondContact O-CD2 3.42Å; T10-F14 PolarHBondContact O-N 3.13Å
11	L	31.5	Very low	31.9	Very low	114 Å²	114	131.1 Å²	131.1	60%	0.597	66%	0.66	S	S	*	*	H	α-helix	trans	-61.2	-35.4	173.1	-93	145.4	0	0	0	112.4	I7 S13 F14	I7-L11 HydrophobicContact CG2-CD1 3.53Å; I7-L11 VanDerWaalsContact O-CB 3.26Å; I7-L11 WeakPolarHBondContact O-CB 3.36Å; I7-L11 WeakPolarHBondContact O-CD1 3.44Å; I7-L11 PolarHBondContact O-N 3.07Å; L11-S13 VanDerWaalsContact C-N 3.3Å; L11-S13 PolarHBondContact O-N 3.19Å; L11-F14 PolarHBondContact O-N 3.34Å
12	G	32.3	Very low	31.6	Very low	60 Å²	60	130.4 Å²	130.4	62%	0.619	65%	0.652	S	S	*	*	H	α-helix	trans	-64.1	-33.6	172	0	0	0	0	0	113.3	F8 T10	F8-G12 PolarHBondContact O-N 3.48Å; F8-G12 VanDerWaalsContact O-N 3.13Å; T10-G12 VanDerWaalsContact C-N 3.27Å; T10-G12 PolarHBondContact O-N 2.88Å
13	S	33.6	Very low	31.7	Very low	83 Å²	83	128.5 Å²	128.5	58%	0.58	65%	0.651	S	S	*	*	H	α-helix	trans	-86.4	-13.9	179.3	59.9	0	0	0	0	115.4	T9 T10 L11	T9-S13 PolarHBondContact O-N 3.24Å; T9-S13 PolarHBondContact O-OG 2.94Å; T10-S13 VanDerWaalsContact CA-OG 3.3Å; T10-S13 WeakPolarHBondContact CA-OG 3.47Å; T10-S13 CarbonylContact O-C 3.53Å; T10-S13 PolarHBondContact O-N 2.98Å; T10-S13 PolarHBondContact O-OG 3Å; L11-S13 VanDerWaalsContact C-N 3.3Å; L11-S13 PolarHBondContact O-N 3.19Å
14	F	27	Very low	31.6	Very low	166 Å²	166	124 Å²	124	73%	0.728	65%	0.648	S	S	*	*			trans	-93.6	4.8	-178.2	-84.3	-67.6	0	0	0	114.8	T10 L11 P16	T10-F14 WeakPolarHBondContact O-CD2 3.42Å; T10-F14 PolarHBondContact O-N 3.13Å; L11-F14 PolarHBondContact O-N 3.34Å; F14-P16 WeakPolarHBondContact O-CD 3.29Å
15	L	28.8	Very low	31.2	Very low	127 Å²	127	123.1 Å²	123.1	67%	0.665	66%	0.657	S	S	*	*	S	Bend	trans	-82.6	110.4	165.4	-87.8	154.2	0	0	0	108.8	S17	L15-S17 PolarHBondContact O-N 3.45Å; L15-S17 VanDerWaalsContact O-N 3.16Å
16	P	30	Very low	30.7	Very low	98 Å²	98	122.7 Å²	122.7	64%	0.636	66%	0.661	S	S	*	*			trans	-78.9	107	-161.4	30.7	-33.4	0	0	0	111.4	F14 Y18	F14-P16 WeakPolarHBondContact O-CD 3.29Å; P16-Y18 VanDerWaalsContact C-N 3.27Å; P16-Y18 HydrophobicContact CB-CD2 4.12Å; P16-Y18 PolarHBondContact O-N 2.9Å; P16-Y18 VanDerWaalsContact O-N 3.09Å
17	S	32	Very low	30.3	Very low	121 Å²	121	127.1 Å²	127.1	85%	0.846	67%	0.672	S	S	*	*			trans	-77.2	83.4	158.6	53.9	0	0	0	0	108.8	L15 V19	L15-S17 PolarHBondContact O-N 3.45Å; L15-S17 VanDerWaalsContact O-N 3.16Å; S17-V19 PolarHBondContact O-N 3.18Å
18	Y	26.8	Very low	30	Very low	205 Å²	205	129 Å²	129	80%	0.804	69%	0.691	S	S	*	*			trans	-61	126.9	166.1	-105.7	-102.9	0	0	0	109.8	P16	P16-Y18 VanDerWaalsContact C-N 3.27Å; P16-Y18 HydrophobicContact CB-CD2 4.12Å; P16-Y18 PolarHBondContact O-N 2.9Å; P16-Y18 VanDerWaalsContact O-N 3.09Å
19	V	26	Very low	29.5	Very low	97 Å²	97	131.9 Å²	131.9	59%	0.588	70%	0.699	S	S	*	*			trans	74.2	96.5	148.9	-169.7	0	0	0	0	117.4	S17	S17-V19 PolarHBondContact O-N 3.18Å
20	F	29.5	Very low	29	Very low	217 Å²	217	133.9 Å²	133.9	95%	0.952	71%	0.707	S	S	*	*				-135.6	104.1	117.7	-108.2	-82.7	0	0	0	109.6
21	T	26.6	Very low	28.6	Very low	108 Å²	108	138.4 Å²	138.4	66%	0.663	73%	0.729	S	S	*	*			trans	-80.3	133.4	165.9	43.1	0	0	0	0	109
22	K	29.8	Very low	28.5	Very low	180 Å²	180	138.1 Å²	138.1	78%	0.783	74%	0.737	S	S	*	*				167.6	103.6	125.9	-91.7	-178.7	177	-179.5	0	111.9
23	H	31.2	Very low	28.3	Very low	166 Å²	166	142 Å²	142	77%	0.769	74%	0.74	S	S	*	*			trans	67.6	119.9	144.4	-57.6	-63.3	0	0	0	121.1
24	P	29.3	Very low	27.9	Very low	109 Å²	109	145.2 Å²	145.2	71%	0.708	75%	0.75	S	S	*	*			trans	-87.1	155.2	163.9	36.5	-29.8	0	0	0	110.9
25	P	27	Very low	27.9	Very low	129 Å²	129	143.1 Å²	143.1	84%	0.838	75%	0.751	S	S	*	*			trans	-116	124.1	138.8	25.3	-11	0	0	0	109.9
26	L	24.3	Very low	27.9	Very low	136 Å²	136	141.8 Å²	141.8	71%	0.712	74%	0.744	S	S	*	*			trans	-62.2	140.1	167.5	-119	74.9	0	0	0	110.2
27	Y	23.8	Very low	27.7	Very low	193 Å²	193	140.9 Å²	140.9	76%	0.757	73%	0.733	S	S	*	*			trans	70.1	105.1	158.5	-66.4	-76.8	0	0	0	119.8	Y29	Y27-Y29 HydrophobicContact CD1-CD2 4.35Å; Y27-Y29 HydrophobicContact CE1-CE2 4.45Å
28	S	29.3	Very low	27.7	Very low	111 Å²	111	143.3 Å²	143.3	78%	0.776	73%	0.731	S	S	*	*			trans	-144	101.4	139.9	-179.6	0	0	0	0	108.2	D30	S28-D30 PolarHBondContact O-N 3.25Å
29	Y	27.9	Very low	28	Very low	213 Å²	213	137.3 Å²	137.3	84%	0.835	72%	0.717	S	S	*	*			trans	-71.4	95.6	165.3	-103.3	-98.5	0	0	0	107.2	Y27	Y27-Y29 HydrophobicContact CD1-CD2 4.35Å; Y27-Y29 HydrophobicContact CE1-CE2 4.45Å
30	D	27	Very low	28.5	Very low	127 Å²	127	135 Å²	135	68%	0.679	70%	0.7	S	S	*	*			trans	-157.6	108.1	158.6	-99.9	-38.9	0	0	0	111.1	S28	S28-D30 PolarHBondContact O-N 3.25Å
31	N	26.3	Very low	29.1	Very low	146 Å²	146	128.1 Å²	128.1	78%	0.781	67%	0.673	S	S	*	*	S	Bend	trans	38.8	103.3	138.8	-64.3	-44.9	0	0	0	118.2
32	S	30.6	Very low	29.7	Very low	108 Å²	108	127.5 Å²	127.5	76%	0.755	67%	0.67	S	S	*	*			trans	169.8	1.7	135.2	43.1	0	0	0	0	116.3
33	M	26.7	Very low	30.2	Very low	141 Å²	141	126.1 Å²	126.1	70%	0.695	66%	0.664	S	S	*	*	G	3₁₀ helix	trans	-90.7	-2.3	-180	-101.7	-92.4	160.8	0	0	115.6	V35 L36	M33-V35 PolarHBondContact O-N 2.81Å; M33-L36 HydrophobicContact CE-CD1 3.33Å; M33-L36 HydrophobicContact SD-CD1 3.71Å
34	L	26.3	Very low	30.5	Very low	151 Å²	151	119.2 Å²	119.2	79%	0.791	63%	0.633	S	S	*	*	G	3₁₀ helix	trans	-72.5	-11.9	174.3	-125.5	97.8	0	0	0	113.4	L36	L34-L36 VanDerWaalsContact C-N 3.32Å; L34-L36 PolarHBondContact O-N 3.15Å
35	V	27	Very low	31	Very low	122 Å²	122	116.1 Å²	116.1	74%	0.739	61%	0.61	S	S	*	*	G	3₁₀ helix	trans	-78.5	-14.4	-177.4	178.5	0	0	0	0	112.7	M33 L37	M33-V35 PolarHBondContact O-N 2.81Å; V35-L37 VanDerWaalsContact C-N 3.33Å; V35-L37 PolarHBondContact O-N 2.87Å
36	L	28	Very low	31.7	Very low	100 Å²	100	117.4 Å²	117.4	52%	0.524	60%	0.603	S	S	.	*	G	3₁₀ helix	trans	-84.7	-0.7	178.3	-76.4	167.7	0	0	0	114.7	M33 L34	M33-L36 HydrophobicContact CE-CD1 3.33Å; M33-L36 HydrophobicContact SD-CD1 3.71Å; L34-L36 VanDerWaalsContact C-N 3.32Å; L34-L36 PolarHBondContact O-N 3.15Å
37	L	27.4	Very low	32.5	Very low	78 Å²	78	111.1 Å²	111.1	41%	0.408	57%	0.57	S	S	.	*	G	3₁₀ helix	trans	-88.9	2.2	178.1	-69.2	169.2	0	0	0	114.1	V35 F40 L45	V35-L37 VanDerWaalsContact C-N 3.33Å; V35-L37 PolarHBondContact O-N 2.87Å; L37-F40 HydrophobicContact CD2-CE2 4.38Å; L37-L45 HydrophobicContact CD2-CD1 4.39Å
38	H	30.8	Very low	33.2	Very low	173 Å²	173	103.6 Å²	103.6	80%	0.801	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.1	23.7	-166.4	-147.8	-71.8	0	0	0	117.7
39	P	33.2	Very low	33.8	Very low	78 Å²	78	102 Å²	102	51%	0.506	53%	0.525	S	S	.	.	T	Hydrogen-bonded Turn	trans	-130.7	37	155	41	-27.7	0	0	0	112	Y77	P39-Y77 PolarHBondContact O-OH 3.38Å
40	F	36	Very low	34.5	Very low	50 Å²	50	94.6 Å²	94.6	22%	0.219	51%	0.508	C	S	.	.	S	Bend	trans	-92.5	129.9	165.1	-66.7	-74.5	0	0	0	109.2	L37 L44 L45 L63 Y77	L37-F40 HydrophobicContact CD2-CE2 4.38Å; F40-L44 HydrophobicContact CD1-CD2 4.18Å; F40-L45 HydrophobicContact CB-CB 4.2Å; F40-L45 HydrophobicContact CB-CD1 3.73Å; F40-L45 HydrophobicContact CD2-CD1 3.76Å; F40-L45 HydrophobicContact CG-CD1 3.84Å; F40-L63 HydrophobicContact CZ-CD2 4.09Å; F40-Y77 HydrophobicContact CD1-CE2 4.35Å
41	D	42.6	Very low	35.1	Very low	72 Å²	72	89.8 Å²	89.8	39%	0.385	48%	0.483	S	S	.	.			trans	-50.9	126.8	163.7	-179.1	-25	0	0	0	107.6	K43 L44 L45	D41-K43 PolarHBondContact O-N 2.7Å; D41-K43 WeakPolarHBondContact OD1-CB 3.29Å; D41-K43 PolarHBondContact OD1-N 3.28Å; D41-L44 HydrophobicContact CB-CB 4.48Å; D41-L44 WeakPolarHBondContact O-CB 3.42Å; D41-L44 PolarHBondContact O-N 3.16Å; D41-L45 PolarHBondContact O-N 3.34Å
42	P	39.6	Very low	35.8	Very low	94 Å²	94	83.4 Å²	83.4	61%	0.61	45%	0.45	S	S	*	.	H	α-helix	trans	-54.7	-20.2	179.1	19	-31.4	0	0	0	113.9	K46	P42-K46 WeakPolarHBondContact O-CB 3.32Å; P42-K46 VanDerWaalsContact O-CG 3.31Å; P42-K46 WeakPolarHBondContact O-CG 3.31Å; P42-K46 PolarHBondContact O-N 3.35Å; P42-K46 VanDerWaalsContact O-N 3.15Å
43	K	39.5	Very low	36.4	Very low	152 Å²	152	85.7 Å²	85.7	66%	0.661	45%	0.454	S	S	*	.	H	α-helix	trans	-70.4	-41.3	170.4	-69.5	-179.3	179.4	177	0	113	D41 S47	D41-K43 PolarHBondContact O-N 2.7Å; D41-K43 WeakPolarHBondContact OD1-CB 3.29Å; D41-K43 PolarHBondContact OD1-N 3.28Å; K43-S47 PolarHBondContact O-N 2.94Å
44	L	37.4	Very low	37.2	Very low	20 Å²	20	85.9 Å²	85.9	11%	0.105	45%	0.448	C	S	.	.	H	α-helix	trans	-72	-40.8	179.2	-162.1	79.7	0	0	0	110.9	F40 D41 K46 S47 L48 Y77 V83	F40-L44 HydrophobicContact CD1-CD2 4.18Å; D41-L44 HydrophobicContact CB-CB 4.48Å; D41-L44 WeakPolarHBondContact O-CB 3.42Å; D41-L44 PolarHBondContact O-N 3.16Å; L44-K46 VanDerWaalsContact C-N 3.33Å; L44-K46 PolarHBondContact O-N 3.13Å; L44-S47 WeakPolarHBondContact CA-OG 3.31Å; L44-S47 PolarHBondContact O-N 2.95Å; L44-S47 PolarHBondContact O-OG 3.49Å; L44-L48 HydrophobicContact CD2-CD1 4.47Å; L44-L48 HydrophobicContact CG-CD1 4.3Å; L44-L48 PolarHBondContact O-N 2.78Å; L44-Y77 HydrophobicContact CD2-CD2 4.19Å; L44-Y77 HydrophobicContact CD2-CE2 4.09Å; L44-V83 HydrophobicContact CD1-CB 4.15Å; L44-V83 HydrophobicContact CD1-CG1 3.85Å; L44-V83 HydrophobicContact CD1-CG2 4.4Å
45	L	39.7	Very low	38	Very low	45 Å²	45	80.6 Å²	80.6	24%	0.236	42%	0.423	C	S	.	.	H	α-helix	trans	-62.4	-41.7	175.1	-154.8	82.7	0	0	0	110.7	L37 F40 D41 S47 L48 D49	L37-L45 HydrophobicContact CD2-CD1 4.39Å; F40-L45 HydrophobicContact CB-CB 4.2Å; F40-L45 HydrophobicContact CB-CD1 3.73Å; F40-L45 HydrophobicContact CD2-CD1 3.76Å; F40-L45 HydrophobicContact CG-CD1 3.84Å; D41-L45 PolarHBondContact O-N 3.34Å; L45-S47 VanDerWaalsContact C-N 3.33Å; L45-S47 PolarHBondContact O-N 3.11Å; L45-L48 PolarHBondContact O-N 2.96Å; L45-D49 VanDerWaalsContact O-CB 3.26Å; L45-D49 WeakPolarHBondContact O-CB 3.35Å; L45-D49 PolarHBondContact O-N 3.15Å
46	K	41.6	Very low	38.8	Very low	156 Å²	156	86.3 Å²	86.3	68%	0.678	43%	0.432	S	S	*	.	H	α-helix	trans	-60	-38.8	172.9	-83.2	-180	179	-177.1	0	113.4	P42 L44 A50	P42-K46 WeakPolarHBondContact O-CB 3.32Å; P42-K46 VanDerWaalsContact O-CG 3.31Å; P42-K46 WeakPolarHBondContact O-CG 3.31Å; P42-K46 PolarHBondContact O-N 3.35Å; P42-K46 VanDerWaalsContact O-N 3.15Å; L44-K46 VanDerWaalsContact C-N 3.33Å; L44-K46 PolarHBondContact O-N 3.13Å; K46-A50 WeakPolarHBondContact O-CB 3.49Å; K46-A50 PolarHBondContact O-N 3.41Å
47	S	42.1	Very low	39.4	Very low	3 Å²	3	85.3 Å²	85.3	2%	0.021	43%	0.426	C	S	.	.	H	α-helix	trans	-67.7	-41.6	175.5	54.1	0	0	0	0	112.3	K43 L44 L45 L51	K43-S47 PolarHBondContact O-N 2.94Å; L44-S47 WeakPolarHBondContact CA-OG 3.31Å; L44-S47 PolarHBondContact O-N 2.95Å; L44-S47 PolarHBondContact O-OG 3.49Å; L45-S47 VanDerWaalsContact C-N 3.33Å; L45-S47 PolarHBondContact O-N 3.11Å; S47-L51 VanDerWaalsContact O-CD1 3.25Å; S47-L51 WeakPolarHBondContact O-CD1 3.39Å; S47-L51 PolarHBondContact O-N 3.48Å
48	L	38.8	Very low	40	Very low	36 Å²	36	83.9 Å²	83.9	19%	0.188	42%	0.422	C	S	.	.	H	α-helix	trans	-73	-40.2	179.7	-75.8	165.4	0	0	0	113	L44 L45 L51 A52	L44-L48 HydrophobicContact CD2-CD1 4.47Å; L44-L48 HydrophobicContact CG-CD1 4.3Å; L44-L48 PolarHBondContact O-N 2.78Å; L45-L48 PolarHBondContact O-N 2.96Å; L48-L51 HydrophobicContact CD2-CD1 4.46Å; L48-L51 WeakPolarHBondContact O-CB 3.14Å; L48-L51 PolarHBondContact O-N 3.27Å; L48-A52 WeakPolarHBondContact O-CB 3.38Å; L48-A52 PolarHBondContact O-N 3.17Å
49	D	40.8	Very low	40.4	Very low	76 Å²	76	77.3 Å²	77.3	41%	0.406	39%	0.394	S	S	.	.	H	α-helix	trans	-64.6	-44.2	172.4	-77.6	-19.7	0	0	0	110.1	L45 L51 A52 D53	L45-D49 VanDerWaalsContact O-CB 3.26Å; L45-D49 WeakPolarHBondContact O-CB 3.35Å; L45-D49 PolarHBondContact O-N 3.15Å; D49-L51 VanDerWaalsContact C-N 3.29Å; D49-L51 PolarHBondContact O-N 2.95Å; D49-A52 PolarHBondContact O-N 3.13Å; D49-D53 VanDerWaalsContact O-CB 3.23Å; D49-D53 WeakPolarHBondContact O-CB 3.45Å; D49-D53 PolarHBondContact O-N 2.95Å
50	A	43.7	Very low	40.7	Very low	59 Å²	59	81 Å²	81	49%	0.488	40%	0.4	S	S	.	.	H	α-helix	trans	-61.9	-34.6	174	0	0	0	0	0	112.6	K46 Y54	K46-A50 WeakPolarHBondContact O-CB 3.49Å; K46-A50 PolarHBondContact O-N 3.41Å; A50-Y54 WeakPolarHBondContact O-CB 3.21Å; A50-Y54 PolarHBondContact O-N 2.77Å
51	L	39	Very low	41	Very low	26 Å²	26	83.3 Å²	83.3	14%	0.136	41%	0.411	C	S	.	.	H	α-helix	trans	-66.8	-47.1	171.4	-93.7	137.1	0	0	0	111.9	S47 L48 D49 Y54 S55 T87	S47-L51 VanDerWaalsContact O-CD1 3.25Å; S47-L51 WeakPolarHBondContact O-CD1 3.39Å; S47-L51 PolarHBondContact O-N 3.48Å; L48-L51 HydrophobicContact CD2-CD1 4.46Å; L48-L51 WeakPolarHBondContact O-CB 3.14Å; L48-L51 PolarHBondContact O-N 3.27Å; D49-L51 VanDerWaalsContact C-N 3.29Å; D49-L51 PolarHBondContact O-N 2.95Å; L51-Y54 PolarHBondContact O-N 3.39Å; L51-S55 WeakPolarHBondContact O-CB 3.36Å; L51-S55 PolarHBondContact O-N 3.01Å; L51-S55 PolarHBondContact O-OG 3.14Å; L51-T87 HydrophobicContact CD1-CG2 3.15Å; L51-T87 HydrophobicContact CD2-CG2 4.2Å; L51-T87 HydrophobicContact CG-CG2 3.83Å
52	A	41.6	Very low	40.7	Very low	12 Å²	12	82.8 Å²	82.8	10%	0.099	41%	0.407	C	S	.	.	H	α-helix	trans	-75	-42	-172.2	0	0	0	0	0	112.8	L48 D49 Y54 R56 V59	L48-A52 WeakPolarHBondContact O-CB 3.38Å; L48-A52 PolarHBondContact O-N 3.17Å; D49-A52 PolarHBondContact O-N 3.13Å; A52-Y54 PolarHBondContact O-N 2.79Å; A52-R56 PolarHBondContact O-N 3.2Å; A52-V59 HydrophobicContact CB-CB 3.97Å; A52-V59 HydrophobicContact CB-CG2 3.06Å
53	D	42.5	Very low	40.7	Very low	155 Å²	155	80.8 Å²	80.8	83%	0.829	39%	0.391	S	S	*	.	H	α-helix	trans	-63.3	-26.1	176.9	-143.8	21.4	0	0	0	110.6	D49	D49-D53 VanDerWaalsContact O-CB 3.23Å; D49-D53 WeakPolarHBondContact O-CB 3.45Å; D49-D53 PolarHBondContact O-N 2.95Å
54	Y	44	Very low	40.6	Very low	145 Å²	145	79.7 Å²	79.7	57%	0.569	39%	0.389	S	S	*	.	H	α-helix	trans	-103.7	-21.5	-176	-138.2	-95.9	0	0	0	115.6	A50 L51 A52 Y91 R95	A50-Y54 WeakPolarHBondContact O-CB 3.21Å; A50-Y54 PolarHBondContact O-N 2.77Å; L51-Y54 PolarHBondContact O-N 3.39Å; A52-Y54 PolarHBondContact O-N 2.79Å; Y54-Y91 AromaticContact CD1-CE2 4Å; Y54-Y91 HydrophobicContact CD1-CE2 4Å; Y54-Y91 AromaticContact CD1-CZ 3.77Å; Y54-Y91 WeakPolarHBondContact CD1-OH 3.39Å; Y54-Y91 WeakPolarHBondContact CE1-OH 3.05Å; Y54-R95 VanDerWaalsContact CD1-NH2 3.28Å
55	S	41.7	Very low	41	Very low	40 Å²	40	84.1 Å²	84.1	28%	0.28	41%	0.406	S	S	.	.	H	α-helix	trans	-92.6	-11.3	179.6	64.7	0	0	0	0	114.3	L51 I57	L51-S55 WeakPolarHBondContact O-CB 3.36Å; L51-S55 PolarHBondContact O-N 3.01Å; L51-S55 PolarHBondContact O-OG 3.14Å; S55-I57 PolarHBondContact O-N 2.87Å; S55-I57 PolarHBondContact OG-N 3.43Å
56	R	45.1	Very low	41.1	Very low	242 Å²	242	84 Å²	84	91%	0.913	41%	0.405	S	S	*	.	S	Bend	trans	55.1	12.3	-169.8	-60.1	-175.1	177.1	-173.3	-1.7	114.1	A52	A52-R56 PolarHBondContact O-N 3.2Å
57	I	41	Very low	41.4	Very low	80 Å²	80	80.7 Å²	80.7	41%	0.41	39%	0.394	S	S	.	.	S	Bend	trans	-90.8	124.4	164.9	-60.9	168.7	0	0	0	104.9	S55 V59 E61 M62	S55-I57 PolarHBondContact O-N 2.87Å; S55-I57 PolarHBondContact OG-N 3.43Å; I57-V59 PolarHBondContact O-N 3.47Å; I57-E61 HydrophobicContact CG2-CB 4.26Å; I57-M62 HydrophobicContact CB-CE 3.97Å; I57-M62 HydrophobicContact CD1-CE 4.45Å; I57-M62 HydrophobicContact CG2-CE 3.79Å
58	S	38.5	Very low	41.4	Very low	47 Å²	47	85.3 Å²	85.3	33%	0.329	42%	0.416	S	S	.	.			trans	-62.5	138.1	-178.9	64.2	0	0	0	0	109.6	Y60 E61 M62	S58-Y60 PolarHBondContact O-N 3Å; S58-E61 PolarHBondContact N-OE2 3.36Å; S58-E61 PolarHBondContact O-N 3.48Å; S58-E61 WeakPolarHBondContact OG-CB 3.15Å; S58-E61 VanDerWaalsContact OG-CG 3.23Å; S58-E61 WeakPolarHBondContact OG-CG 3.32Å; S58-E61 PolarHBondContact OG-N 2.81Å; S58-E61 PolarHBondContact OG-OE2 2.88Å; S58-M62 PolarHBondContact O-N 3.5Å
59	V	39.2	Very low	41.7	Very low	35 Å²	35	92 Å²	92	21%	0.212	44%	0.443	C	S	.	.	H	α-helix	trans	-50.2	-34.7	168.5	-161.2	0	0	0	0	108.6	A52 I57 M62 L63	A52-V59 HydrophobicContact CB-CB 3.97Å; A52-V59 HydrophobicContact CB-CG2 3.06Å; I57-V59 PolarHBondContact O-N 3.47Å; V59-M62 CarbonylContact O-C 3.54Å; V59-M62 PolarHBondContact O-N 3.43Å; V59-L63 HydrophobicContact CB-CD1 4.2Å; V59-L63 HydrophobicContact CG1-CD1 3.42Å; V59-L63 VanDerWaalsContact CG1-CD1 3.42Å; V59-L63 HydrophobicContact CG1-CG 3.91Å; V59-L63 WeakPolarHBondContact O-CB 3.36Å; V59-L63 WeakPolarHBondContact O-CG 3.15Å; V59-L63 PolarHBondContact O-N 2.89Å
60	Y	40.2	Very low	42.1	Very low	157 Å²	157	94.6 Å²	94.6	62%	0.616	45%	0.451	S	S	*	.	H	α-helix	trans	-58.2	-45.4	175.9	-173.8	-96.2	0	0	0	113.9	S58 L63 M64	S58-Y60 PolarHBondContact O-N 3Å; Y60-L63 PolarHBondContact O-N 3.47Å; Y60-M64 HydrophobicContact CD1-CG 3.92Å; Y60-M64 HydrophobicContact CE1-CE 4.34Å; Y60-M64 HydrophobicContact CE1-CG 3.61Å; Y60-M64 HydrophobicContact CE1-SD 3.71Å; Y60-M64 HydrophobicContact CE2-CG 4.39Å; Y60-M64 HydrophobicContact CG-CG 4.43Å; Y60-M64 VanDerWaalsContact O-CB 3.29Å; Y60-M64 WeakPolarHBondContact O-CB 2.98Å; Y60-M64 WeakPolarHBondContact O-CG 3.37Å; Y60-M64 PolarHBondContact O-N 3.33Å
61	E	41.7	Very low	42.2	Very low	98 Å²	98	93.8 Å²	93.8	46%	0.458	44%	0.438	S	S	.	.	H	α-helix	trans	-65.1	-45.2	174.5	-79.6	160.4	145.5	0	0	110.7	I57 S58 L63 M64 Y65	I57-E61 HydrophobicContact CG2-CB 4.26Å; S58-E61 PolarHBondContact N-OE2 3.36Å; S58-E61 PolarHBondContact O-N 3.48Å; S58-E61 WeakPolarHBondContact OG-CB 3.15Å; S58-E61 VanDerWaalsContact OG-CG 3.23Å; S58-E61 WeakPolarHBondContact OG-CG 3.32Å; S58-E61 PolarHBondContact OG-N 2.81Å; S58-E61 PolarHBondContact OG-OE2 2.88Å; E61-L63 VanDerWaalsContact C-N 3.33Å; E61-L63 PolarHBondContact O-N 2.88Å; E61-M64 PolarHBondContact O-N 3.46Å; E61-Y65 WeakPolarHBondContact O-CD2 3.5Å; E61-Y65 VanDerWaalsContact O-CE2 3.28Å; E61-Y65 WeakPolarHBondContact O-CE2 3.26Å
62	M	37.7	Very low	42.5	Very low	61 Å²	61	100.7 Å²	100.7	30%	0.3	47%	0.467	S	S	.	.	H	α-helix	trans	-61	-40	175.3	-104.9	-178.1	-105.5	0	0	112.5	I57 S58 V59 L66	I57-M62 HydrophobicContact CB-CE 3.97Å; I57-M62 HydrophobicContact CD1-CE 4.45Å; I57-M62 HydrophobicContact CG2-CE 3.79Å; S58-M62 PolarHBondContact O-N 3.5Å; V59-M62 CarbonylContact O-C 3.54Å; V59-M62 PolarHBondContact O-N 3.43Å; M62-L66 WeakPolarHBondContact O-CG 3.35Å
63	L	38.3	Very low	42.9	Very low	52 Å²	52	107.2 Å²	107.2	27%	0.272	50%	0.5	S	S	.	.	H	α-helix	trans	-75.9	-29.1	179.4	-76.4	167	0	0	0	113	F40 V59 Y60 E61 Y65 L66	F40-L63 HydrophobicContact CZ-CD2 4.09Å; V59-L63 HydrophobicContact CB-CD1 4.2Å; V59-L63 HydrophobicContact CG1-CD1 3.42Å; V59-L63 VanDerWaalsContact CG1-CD1 3.42Å; V59-L63 HydrophobicContact CG1-CG 3.91Å; V59-L63 WeakPolarHBondContact O-CB 3.36Å; V59-L63 WeakPolarHBondContact O-CG 3.15Å; V59-L63 PolarHBondContact O-N 2.89Å; Y60-L63 PolarHBondContact O-N 3.47Å; E61-L63 VanDerWaalsContact C-N 3.33Å; E61-L63 PolarHBondContact O-N 2.88Å; L63-Y65 PolarHBondContact O-N 2.98Å; L63-L66 HydrophobicContact CD2-CD1 4.04Å; L63-L66 WeakPolarHBondContact O-CB 3.45Å; L63-L66 PolarHBondContact O-N 3.42Å; L63-L66 VanDerWaalsContact O-N 3.1Å
64	M	38.1	Very low	43.4	Very low	128 Å²	128	100.5 Å²	100.5	63%	0.631	46%	0.464	S	S	*	.	H	α-helix	trans	-64.6	-29.6	174.3	-79.9	-110.1	-60.4	0	0	112.3	Y60 E61 L66	Y60-M64 HydrophobicContact CD1-CG 3.92Å; Y60-M64 HydrophobicContact CE1-CE 4.34Å; Y60-M64 HydrophobicContact CE1-CG 3.61Å; Y60-M64 HydrophobicContact CE1-SD 3.71Å; Y60-M64 HydrophobicContact CE2-CG 4.39Å; Y60-M64 HydrophobicContact CG-CG 4.43Å; Y60-M64 VanDerWaalsContact O-CB 3.29Å; Y60-M64 WeakPolarHBondContact O-CB 2.98Å; Y60-M64 WeakPolarHBondContact O-CG 3.37Å; Y60-M64 PolarHBondContact O-N 3.33Å; E61-M64 PolarHBondContact O-N 3.46Å; M64-L66 VanDerWaalsContact C-N 3.29Å
65	Y	45.6	Very low	43.8	Very low	114 Å²	114	96.1 Å²	96.1	45%	0.447	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-12.7	174.6	-65	-69	0	0	0	113.4	E61 L63 D67 Y195	E61-Y65 WeakPolarHBondContact O-CD2 3.5Å; E61-Y65 VanDerWaalsContact O-CE2 3.28Å; E61-Y65 WeakPolarHBondContact O-CE2 3.26Å; L63-Y65 PolarHBondContact O-N 2.98Å; Y65-D67 PolarHBondContact O-N 3.01Å; Y65-Y195 HydrophobicContact CE1-CD1 4.37Å
66	L	42.2	Very low	44.2	Very low	41 Å²	41	94.8 Å²	94.8	22%	0.215	44%	0.443	C	S	.	.	S	Bend	trans	-95.6	84.4	-176.1	-84.8	178.1	0	0	0	108.6	M62 L63 M64 H68 L71 M188	M62-L66 WeakPolarHBondContact O-CG 3.35Å; L63-L66 HydrophobicContact CD2-CD1 4.04Å; L63-L66 WeakPolarHBondContact O-CB 3.45Å; L63-L66 PolarHBondContact O-N 3.42Å; L63-L66 VanDerWaalsContact O-N 3.1Å; M64-L66 VanDerWaalsContact C-N 3.29Å; L66-H68 PolarHBondContact O-N 3.29Å; L66-L71 HydrophobicContact CB-CD1 3.56Å; L66-L71 HydrophobicContact CD2-CD1 3.9Å; L66-L71 HydrophobicContact CD2-CD2 4.13Å; L66-L71 HydrophobicContact CD2-CG 4.3Å; L66-L71 HydrophobicContact CG-CD1 4.19Å; L66-M188 HydrophobicContact CD2-CE 3.4Å; L66-M188 HydrophobicContact CD2-SD 4.47Å; L66-M188 HydrophobicContact CG-CE 4.21Å
67	D	46.7	Very low	44.6	Very low	87 Å²	87	87.5 Å²	87.5	47%	0.465	42%	0.417	S	S	.	.			trans	-56	113.6	172.7	177.9	6.3	0	0	0	110	Y65 K69 K70 L71	Y65-D67 PolarHBondContact O-N 3.01Å; D67-K69 PolarHBondContact O-N 3.26Å; D67-K69 VanDerWaalsContact O-N 3.1Å; D67-K69 WeakPolarHBondContact OD1-CB 3.28Å; D67-K69 PolarHBondContact OD1-N 3.5Å; D67-K70 HydrophobicContact CB-CB 4.23Å; D67-K70 HydrophobicContact CB-CD 4.46Å; D67-K70 HydrophobicContact CB-CG 4.28Å; D67-K70 PolarHBondContact O-N 2.92Å; D67-L71 PolarHBondContact O-N 3.42Å; D67-L71 VanDerWaalsContact O-N 3.08Å
68	H	43.5	Very low	45.6	Very low	101 Å²	101	90.4 Å²	90.4	47%	0.468	43%	0.433	S	S	.	.	H	α-helix	trans	-58	-24.7	-179.6	-162.2	-54.5	0	0	0	112.5	L66	L66-H68 PolarHBondContact O-N 3.29Å
69	K	45.5	Very low	47.1	Very low	176 Å²	176	89.9 Å²	89.9	77%	0.765	43%	0.426	S	S	*	.	H	α-helix	trans	-72.9	-38.5	172.2	-89.2	-177.4	174.3	178.3	0	112.5	D67 L71	D67-K69 PolarHBondContact O-N 3.26Å; D67-K69 VanDerWaalsContact O-N 3.1Å; D67-K69 WeakPolarHBondContact OD1-CB 3.28Å; D67-K69 PolarHBondContact OD1-N 3.5Å; K69-L71 VanDerWaalsContact C-N 3.3Å
70	K	47.9	Very low	48.8	Very low	131 Å²	131	90.9 Å²	90.9	57%	0.57	44%	0.435	S	S	*	.	H	α-helix	trans	-71.7	-23.6	174.7	-74.5	-172.9	174.2	-171.3	0	113	D67	D67-K70 HydrophobicContact CB-CB 4.23Å; D67-K70 HydrophobicContact CB-CD 4.46Å; D67-K70 HydrophobicContact CB-CG 4.28Å; D67-K70 PolarHBondContact O-N 2.92Å
71	L	46.6	Very low	51	Low	41 Å²	41	85.3 Å²	85.3	22%	0.215	42%	0.421	C	S	.	.	H	α-helix	trans	-80.4	-19	178.7	-82.9	147.4	0	0	0	115.4	L66 D67 K69 N74	L66-L71 HydrophobicContact CB-CD1 3.56Å; L66-L71 HydrophobicContact CD2-CD1 3.9Å; L66-L71 HydrophobicContact CD2-CD2 4.13Å; L66-L71 HydrophobicContact CD2-CG 4.3Å; L66-L71 HydrophobicContact CG-CD1 4.19Å; D67-L71 PolarHBondContact O-N 3.42Å; D67-L71 VanDerWaalsContact O-N 3.08Å; K69-L71 VanDerWaalsContact C-N 3.3Å; L71-N74 WeakPolarHBondContact O-CB 3.24Å; L71-N74 PolarHBondContact O-N 3.17Å
72	K	44.1	Very low	53.2	Low	172 Å²	172	80.6 Å²	80.6	75%	0.748	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-29.2	-177.1	-114.3	-177.8	177.4	-177.1	0	113.2	N74	K72-N74 VanDerWaalsContact C-N 3.25Å; K72-N74 PolarHBondContact O-N 3.25Å
73	D	51.3	Low	55.3	Low	148 Å²	148	78.8 Å²	78.8	79%	0.791	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.6	21.4	178	-60.8	-33.8	0	0	0	112.3	P75	D73-P75 VanDerWaalsContact O-CD 3.3Å; D73-P75 WeakPolarHBondContact O-CD 3.4Å
74	N	52.8	Low	57.6	Low	14 Å²	14	77.7 Å²	77.7	8%	0.075	39%	0.387	C	S	.	.			trans	-81.6	116	-165.4	-174.2	2.1	0	0	0	113.7	L71 K72 L76 Y77	L71-N74 WeakPolarHBondContact O-CB 3.24Å; L71-N74 PolarHBondContact O-N 3.17Å; K72-N74 VanDerWaalsContact C-N 3.25Å; K72-N74 PolarHBondContact O-N 3.25Å; N74-L76 VanDerWaalsContact OD1-CA 3.31Å; N74-L76 WeakPolarHBondContact OD1-CA 3.37Å; N74-L76 WeakPolarHBondContact OD1-CB 3.5Å; N74-L76 PolarHBondContact OD1-N 2.88Å; N74-Y77 VanDerWaalsContact CG-N 3.29Å; N74-Y77 PolarHBondContact ND2-N 3.44Å; N74-Y77 PolarHBondContact OD1-N 2.86Å
75	P	52.2	Low	60	Low	54 Å²	54	72.2 Å²	72.2	35%	0.351	36%	0.36	S	S	.	.	H	α-helix	trans	-68.8	-33.5	169.5	26.2	-31.2	0	0	0	112.8	D73 Y77 N78	D73-P75 VanDerWaalsContact O-CD 3.3Å; D73-P75 WeakPolarHBondContact O-CD 3.4Å; P75-Y77 VanDerWaalsContact C-N 3.31Å; P75-Y77 PolarHBondContact O-N 2.88Å; P75-N78 WeakPolarHBondContact O-CB 3.4Å; P75-N78 PolarHBondContact O-N 3.31Å
76	L	50.6	Low	62	Low	12 Å²	12	68.3 Å²	68.3	6%	0.063	35%	0.348	C	S	.	.	H	α-helix	trans	-66.6	-31.2	-180	-158.4	94.5	0	0	0	112.4	N74 N78 N79 V83 D181 W184 L185	N74-L76 VanDerWaalsContact OD1-CA 3.31Å; N74-L76 WeakPolarHBondContact OD1-CA 3.37Å; N74-L76 WeakPolarHBondContact OD1-CB 3.5Å; N74-L76 PolarHBondContact OD1-N 2.88Å; L76-N78 PolarHBondContact O-N 3.07Å; L76-N79 CarbonylContact O-C 3.54Å; L76-N79 PolarHBondContact O-N 3.49Å; L76-V83 HydrophobicContact CD1-CG2 4.44Å; L76-V83 HydrophobicContact CD2-CG2 3.45Å; L76-V83 VanDerWaalsContact CD2-CG2 3.45Å; L76-V83 HydrophobicContact CG-CG2 3.54Å; L76-D181 HydrophobicContact CD1-CB 3.65Å; L76-W184 HydrophobicContact CB-CD2 4.38Å; L76-W184 HydrophobicContact CB-CE3 4.22Å; L76-W184 HydrophobicContact CB-CZ3 4.49Å; L76-W184 HydrophobicContact CD1-CE3 4.26Å; L76-W184 HydrophobicContact CD2-CE3 3.78Å; L76-W184 HydrophobicContact CD2-CH2 3.86Å; L76-W184 HydrophobicContact CD2-CZ3 3.38Å; L76-W184 HydrophobicContact CG-CE3 4.32Å; L76-W184 HydrophobicContact CG-CZ3 4.37Å; L76-L185 HydrophobicContact CD1-CG 4.43Å
77	Y	52.8	Low	64	Low	89 Å²	89	67.7 Å²	67.7	35%	0.349	35%	0.346	S	S	.	.	H	α-helix	trans	-61.2	-29.4	176.1	-174.1	-89.8	0	0	0	111.6	P39 F40 L44 N74 P75	P39-Y77 PolarHBondContact O-OH 3.38Å; F40-Y77 HydrophobicContact CD1-CE2 4.35Å; L44-Y77 HydrophobicContact CD2-CD2 4.19Å; L44-Y77 HydrophobicContact CD2-CE2 4.09Å; N74-Y77 VanDerWaalsContact CG-N 3.29Å; N74-Y77 PolarHBondContact ND2-N 3.44Å; N74-Y77 PolarHBondContact OD1-N 2.86Å; P75-Y77 VanDerWaalsContact C-N 3.31Å; P75-Y77 PolarHBondContact O-N 2.88Å
78	N	61.6	Low	65.9	Low	141 Å²	141	63.8 Å²	63.8	75%	0.754	33%	0.326	S	S	*	.	H	α-helix	trans	-80.3	-21.7	176.3	-66.6	-21.4	0	0	0	112.9	P75 L76	P75-N78 WeakPolarHBondContact O-CB 3.4Å; P75-N78 PolarHBondContact O-N 3.31Å; L76-N78 PolarHBondContact O-N 3.07Å
79	N	71.1	Confident	67.9	Low	36 Å²	36	59.5 Å²	59.5	19%	0.193	31%	0.306	C	S	.	.			trans	-105.7	75	-177.4	-169.4	-1.3	0	0	0	111.6	L76 A81 C82 V83 T176 D181	L76-N79 CarbonylContact O-C 3.54Å; L76-N79 PolarHBondContact O-N 3.49Å; N79-A81 PolarHBondContact O-N 3.45Å; N79-A81 VanDerWaalsContact O-N 3.12Å; N79-C82 HydrophobicContact CB-CB 4.37Å; N79-C82 WeakPolarHBondContact ND2-CB 3.32Å; N79-C82 PolarHBondContact O-N 3.28Å; N79-C82 PolarHBondContact OD1-N 2.92Å; N79-V83 PolarHBondContact O-N 2.87Å; N79-T176 PolarHBondContact ND2-O 3.25Å; N79-D181 PolarHBondContact ND2-OD2 3.25Å; N79-D181 VanDerWaalsContact ND2-OD2 3.16Å
80	S	74.5	Confident	69.9	Low	55 Å²	55	54.5 Å²	54.5	39%	0.385	29%	0.29	S	S	.	.	H	α-helix	trans	-57.1	-29.8	-179.4	65.5	0	0	0	0	113.3	V84	S80-V84 WeakPolarHBondContact O-CG2 3.49Å; S80-V84 PolarHBondContact O-N 3.45Å; S80-V84 VanDerWaalsContact O-N 3.14Å
81	A	86.1	Confident	71.5	Confident	40 Å²	40	50.5 Å²	50.5	33%	0.331	27%	0.272	S	S	.	.	H	α-helix	trans	-68.1	-48.3	-179	0	0	0	0	0	111.9	N79 V83 V84 D85 T176	N79-A81 PolarHBondContact O-N 3.45Å; N79-A81 VanDerWaalsContact O-N 3.12Å; A81-V83 VanDerWaalsContact C-N 3.3Å; A81-V83 PolarHBondContact O-N 3.28Å; A81-V84 PolarHBondContact O-N 3.35Å; A81-D85 VanDerWaalsContact O-CG 3.31Å; A81-D85 PolarHBondContact O-N 3.47Å; A81-T176 HydrophobicContact CB-CG2 4.15Å
82	C	87.2	Confident	73.3	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-58.8	-42.3	177.1	173.8	0	0	0	0	111.8	N79 V84 D85 V86 C177	N79-C82 HydrophobicContact CB-CB 4.37Å; N79-C82 WeakPolarHBondContact ND2-CB 3.32Å; N79-C82 PolarHBondContact O-N 3.28Å; N79-C82 PolarHBondContact OD1-N 2.92Å; C82-V84 PolarHBondContact O-N 2.93Å; C82-D85 PolarHBondContact O-N 3.25Å; C82-V86 WeakPolarHBondContact O-CB 3.22Å; C82-V86 VanDerWaalsContact O-CG2 3.27Å; C82-V86 WeakPolarHBondContact O-CG2 3.47Å; C82-V86 PolarHBondContact O-N 3.47Å; C82-C177 VanDerWaalsContact CA-SG 3.58Å; C82-C177 HydrophobicContact CB-CB 3.98Å; C82-C177 WeakPolarHBondContact CB-SG 3.39Å; C82-C177 VanDerWaalsContact SG-CA 3.55Å; C82-C177 WeakPolarHBondContact SG-CB 3.33Å; C82-C177 CovalentContact SG-SG 2.04Å; C82-C177 PolarHBondContact SG-SG 2.92Å
83	V	83.6	Confident	75.2	Confident	23 Å²	23	42.2 Å²	42.2	14%	0.139	24%	0.236	C	C	.	.	H	α-helix	trans	-61.8	-45.7	178.1	-175.9	0	0	0	0	111.7	L44 L76 N79 A81 D85 T87	L44-V83 HydrophobicContact CD1-CB 4.15Å; L44-V83 HydrophobicContact CD1-CG1 3.85Å; L44-V83 HydrophobicContact CD1-CG2 4.4Å; L76-V83 HydrophobicContact CD1-CG2 4.44Å; L76-V83 HydrophobicContact CD2-CG2 3.45Å; L76-V83 VanDerWaalsContact CD2-CG2 3.45Å; L76-V83 HydrophobicContact CG-CG2 3.54Å; N79-V83 PolarHBondContact O-N 2.87Å; A81-V83 VanDerWaalsContact C-N 3.3Å; A81-V83 PolarHBondContact O-N 3.28Å; V83-D85 VanDerWaalsContact C-N 3.35Å; V83-T87 WeakPolarHBondContact O-CB 3.44Å; V83-T87 PolarHBondContact O-N 3Å; V83-T87 PolarHBondContact O-OG1 3.47Å
84	V	85.5	Confident	76.9	Confident	28 Å²	28	40.6 Å²	40.6	17%	0.17	23%	0.226	C	C	.	.	H	α-helix	trans	-62	-43.5	179.7	167.8	0	0	0	0	111.1	S80 A81 C82 S88 L138 S139	S80-V84 WeakPolarHBondContact O-CG2 3.49Å; S80-V84 PolarHBondContact O-N 3.45Å; S80-V84 VanDerWaalsContact O-N 3.14Å; A81-V84 PolarHBondContact O-N 3.35Å; C82-V84 PolarHBondContact O-N 2.93Å; V84-S88 WeakPolarHBondContact O-CB 3.17Å; V84-S88 PolarHBondContact O-N 3.36Å; V84-S88 PolarHBondContact O-OG 3.01Å; V84-L138 HydrophobicContact CG1-CB 3.68Å; V84-S139 PolarHBondContact O-OG 3.28Å
85	D	88.6	Confident	78.6	Confident	13 Å²	13	46.2 Å²	46.2	7%	0.07	25%	0.246	C	C	.	.	H	α-helix	trans	-67.5	-51.1	-179.3	-67.3	-14.2	0	0	0	111.6	A81 C82 V83 T87 S88 I89 S139 V142 P174 T176	A81-D85 VanDerWaalsContact O-CG 3.31Å; A81-D85 PolarHBondContact O-N 3.47Å; C82-D85 PolarHBondContact O-N 3.25Å; V83-D85 VanDerWaalsContact C-N 3.35Å; D85-T87 VanDerWaalsContact C-N 3.29Å; D85-T87 PolarHBondContact O-N 3.16Å; D85-S88 PolarHBondContact O-N 2.86Å; D85-S88 VanDerWaalsContact O-N 3.15Å; D85-I89 WeakPolarHBondContact O-CD1 3.44Å; D85-I89 VanDerWaalsContact O-CG1 3.28Å; D85-I89 WeakPolarHBondContact O-CG1 3.29Å; D85-I89 PolarHBondContact O-N 2.89Å; D85-S139 WeakPolarHBondContact CA-OG 3.41Å; D85-S139 WeakPolarHBondContact OD1-CB 3.27Å; D85-S139 PolarHBondContact OD1-OG 3.41Å; D85-V142 HydrophobicContact CB-CG1 4.25Å; D85-V142 HydrophobicContact CB-CG2 4.31Å; D85-V142 WeakPolarHBondContact OD1-CG2 3.46Å; D85-P174 HydrophobicContact CB-CB 3.8Å; D85-P174 HydrophobicContact CB-CG 3.62Å; D85-T176 WeakPolarHBondContact OD2-CB 3.48Å; D85-T176 WeakPolarHBondContact OD2-CG2 3.13Å; D85-T176 PolarHBondContact OD2-OG1 3.45Å
86	V	87.1	Confident	80.2	Confident	33 Å²	33	47.7 Å²	47.7	20%	0.2	26%	0.257	C	S	.	.	H	α-helix	trans	-58.4	-44.3	177.4	171.5	0	0	0	0	110.8	C82 S88 I89 V90 P174 L185	C82-V86 WeakPolarHBondContact O-CB 3.22Å; C82-V86 VanDerWaalsContact O-CG2 3.27Å; C82-V86 WeakPolarHBondContact O-CG2 3.47Å; C82-V86 PolarHBondContact O-N 3.47Å; V86-S88 PolarHBondContact O-N 3.49Å; V86-I89 PolarHBondContact O-N 3.38Å; V86-V90 HydrophobicContact CG1-CG2 4.45Å; V86-V90 WeakPolarHBondContact O-CG2 3.36Å; V86-V90 PolarHBondContact O-N 3.46Å; V86-P174 HydrophobicContact CG2-CG 4.04Å; V86-L185 HydrophobicContact CG1-CD1 4.42Å; V86-L185 HydrophobicContact CG1-CD2 4.45Å; V86-L185 HydrophobicContact CG2-CD1 4.1Å
87	T	84	Confident	82	Confident	28 Å²	28	49.4 Å²	49.4	17%	0.172	27%	0.266	C	S	.	.	H	α-helix	trans	-57.9	-47.6	175.5	-72.6	0	0	0	0	112	L51 V83 D85 I89 V90 Y91	L51-T87 HydrophobicContact CD1-CG2 3.15Å; L51-T87 HydrophobicContact CD2-CG2 4.2Å; L51-T87 HydrophobicContact CG-CG2 3.83Å; V83-T87 WeakPolarHBondContact O-CB 3.44Å; V83-T87 PolarHBondContact O-N 3Å; V83-T87 PolarHBondContact O-OG1 3.47Å; D85-T87 VanDerWaalsContact C-N 3.29Å; D85-T87 PolarHBondContact O-N 3.16Å; T87-I89 VanDerWaalsContact C-N 3.31Å; T87-I89 PolarHBondContact O-N 3.29Å; T87-V90 PolarHBondContact O-N 3.37Å; T87-Y91 VanDerWaalsContact O-CB 3.25Å; T87-Y91 WeakPolarHBondContact O-CB 3.29Å; T87-Y91 PolarHBondContact O-N 3.47Å
88	S	87.4	Confident	83.7	Confident	5 Å²	5	52.6 Å²	52.6	4%	0.035	29%	0.285	C	S	.	.	H	α-helix	trans	-65.9	-37.1	-178.4	-61.1	0	0	0	0	111.4	V84 D85 V86 G92 Y136 S139	V84-S88 WeakPolarHBondContact O-CB 3.17Å; V84-S88 PolarHBondContact O-N 3.36Å; V84-S88 PolarHBondContact O-OG 3.01Å; D85-S88 PolarHBondContact O-N 2.86Å; D85-S88 VanDerWaalsContact O-N 3.15Å; V86-S88 PolarHBondContact O-N 3.49Å; S88-G92 PolarHBondContact O-N 3.02Å; S88-Y136 VanDerWaalsContact CB-O 3.28Å; S88-Y136 WeakPolarHBondContact CB-O 3.49Å; S88-Y136 WeakPolarHBondContact O-CD1 3.35Å; S88-Y136 PolarHBondContact OG-O 3Å; S88-S139 WeakPolarHBondContact CB-OG 3.37Å; S88-S139 PolarHBondContact OG-OG 2.85Å
89	I	86.4	Confident	85.1	Confident	11 Å²	11	49.3 Å²	49.3	6%	0.056	27%	0.265	C	S	.	.	H	α-helix	trans	-63.3	-53	173.7	-67.6	160.6	0	0	0	110.9	D85 V86 T87 Y91 G92 I93 W103 F134 P174	D85-I89 WeakPolarHBondContact O-CD1 3.44Å; D85-I89 VanDerWaalsContact O-CG1 3.28Å; D85-I89 WeakPolarHBondContact O-CG1 3.29Å; D85-I89 PolarHBondContact O-N 2.89Å; V86-I89 PolarHBondContact O-N 3.38Å; T87-I89 VanDerWaalsContact C-N 3.31Å; T87-I89 PolarHBondContact O-N 3.29Å; I89-Y91 VanDerWaalsContact C-N 3.28Å; I89-Y91 PolarHBondContact O-N 3.47Å; I89-G92 PolarHBondContact O-N 3.42Å; I89-G92 VanDerWaalsContact O-N 3.13Å; I89-I93 HydrophobicContact CG2-CD1 3.83Å; I89-I93 WeakPolarHBondContact O-CG1 3.29Å; I89-I93 PolarHBondContact O-N 3.14Å; I89-W103 HydrophobicContact CD1-CD2 3.53Å; I89-W103 HydrophobicContact CD1-CE3 3.6Å; I89-W103 HydrophobicContact CD1-CG 4.23Å; I89-W103 HydrophobicContact CD1-CH2 3.77Å; I89-W103 HydrophobicContact CD1-CZ2 3.68Å; I89-W103 HydrophobicContact CD1-CZ3 3.73Å; I89-W103 HydrophobicContact CG1-CD2 3.93Å; I89-W103 HydrophobicContact CG1-CE3 4.48Å; I89-W103 HydrophobicContact CG1-CG 4.18Å; I89-W103 HydrophobicContact CG1-CZ2 4.21Å; I89-W103 HydrophobicContact CG2-CB 3.63Å; I89-W103 HydrophobicContact CG2-CD2 4.08Å; I89-W103 HydrophobicContact CG2-CG 3.6Å; I89-F134 HydrophobicContact CB-CE1 4.46Å; I89-F134 HydrophobicContact CB-CZ 4.49Å; I89-F134 HydrophobicContact CG1-CD1 4Å; I89-F134 HydrophobicContact CG1-CE1 3.47Å; I89-F134 VanDerWaalsContact CG1-CE1 3.47Å; I89-F134 HydrophobicContact CG1-CZ 3.87Å; I89-P174 HydrophobicContact CD1-CG 3.58Å
90	V	86.1	Confident	85.9	Confident	71 Å²	71	47.6 Å²	47.6	43%	0.43	26%	0.256	S	S	.	.	H	α-helix	trans	-57.7	-44.2	179.2	171.2	0	0	0	0	110.7	V86 T87 I93 I94	V86-V90 HydrophobicContact CG1-CG2 4.45Å; V86-V90 WeakPolarHBondContact O-CG2 3.36Å; V86-V90 PolarHBondContact O-N 3.46Å; T87-V90 PolarHBondContact O-N 3.37Å; V90-I93 PolarHBondContact O-N 3.35Å; V90-I94 HydrophobicContact CG1-CD1 4.05Å; V90-I94 WeakPolarHBondContact O-CG1 3.39Å; V90-I94 PolarHBondContact O-N 2.9Å
91	Y	83	Confident	86.7	Confident	46 Å²	46	47.2 Å²	47.2	18%	0.18	25%	0.251	C	S	.	.	H	α-helix	trans	-63	-42.8	177.3	-179.9	-114.8	0	0	0	112.2	Y54 T87 I89 I93 I94 R95 Y136	Y54-Y91 AromaticContact CD1-CE2 4Å; Y54-Y91 HydrophobicContact CD1-CE2 4Å; Y54-Y91 AromaticContact CD1-CZ 3.77Å; Y54-Y91 WeakPolarHBondContact CD1-OH 3.39Å; Y54-Y91 WeakPolarHBondContact CE1-OH 3.05Å; T87-Y91 VanDerWaalsContact O-CB 3.25Å; T87-Y91 WeakPolarHBondContact O-CB 3.29Å; T87-Y91 PolarHBondContact O-N 3.47Å; I89-Y91 VanDerWaalsContact C-N 3.28Å; I89-Y91 PolarHBondContact O-N 3.47Å; Y91-I93 VanDerWaalsContact C-N 3.35Å; Y91-I93 PolarHBondContact O-N 2.77Å; Y91-I94 PolarHBondContact O-N 3.21Å; Y91-R95 HydrophobicContact CE1-CG 4.34Å; Y91-R95 HydrophobicContact CE2-CG 4.02Å; Y91-R95 PolarHBondContact O-N 2.93Å; Y91-R95 VanDerWaalsContact O-N 3.07Å; Y91-R95 PolarHBondContact OH-NE 2.84Å; Y91-R95 VanDerWaalsContact OH-NE 3.14Å; Y91-Y136 HydrophobicContact CD1-CD1 4.14Å; Y91-Y136 AromaticContact CD1-CE1 3.34Å; Y91-Y136 HydrophobicContact CD1-CE1 3.34Å; Y91-Y136 AromaticContact CE1-CE1 3.65Å; Y91-Y136 HydrophobicContact CE1-CE1 3.65Å; Y91-Y136 HydrophobicContact CG-CE1 4.3Å
92	G	83.2	Confident	87	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-60.7	-41.4	174.1	0	0	0	0	0	112.8	S88 I89 R95 S96 N97 A100	S88-G92 PolarHBondContact O-N 3.02Å; I89-G92 PolarHBondContact O-N 3.42Å; I89-G92 VanDerWaalsContact O-N 3.13Å; G92-R95 CarbonylContact O-C 3.54Å; G92-R95 PolarHBondContact O-N 3.4Å; G92-S96 PolarHBondContact O-N 3.47Å; G92-S96 VanDerWaalsContact O-N 3.07Å; G92-N97 WeakPolarHBondContact O-CB 3.17Å; G92-N97 PolarHBondContact O-N 2.58Å; G92-A100 VanDerWaalsContact CA-CB 3.49Å
93	I	84.7	Confident	87.2	Confident	40 Å²	40	48.8 Å²	48.8	21%	0.205	25%	0.25	C	C	.	.	H	α-helix	trans	-61.2	-46	176.2	-69.3	162.6	0	0	0	110.5	I89 V90 Y91 R95 S96 A100 L104	I89-I93 HydrophobicContact CG2-CD1 3.83Å; I89-I93 WeakPolarHBondContact O-CG1 3.29Å; I89-I93 PolarHBondContact O-N 3.14Å; V90-I93 PolarHBondContact O-N 3.35Å; Y91-I93 VanDerWaalsContact C-N 3.35Å; Y91-I93 PolarHBondContact O-N 2.77Å; I93-R95 VanDerWaalsContact C-N 3.25Å; I93-R95 PolarHBondContact O-N 3.17Å; I93-S96 WeakPolarHBondContact O-CA 3.49Å; I93-S96 PolarHBondContact O-N 3.05Å; I93-A100 HydrophobicContact CG1-CB 4.1Å; I93-A100 VanDerWaalsContact CG1-O 3.27Å; I93-A100 WeakPolarHBondContact CG1-O 3.28Å; I93-L104 HydrophobicContact CD1-CB 3.95Å; I93-L104 HydrophobicContact CG1-CB 4.37Å; I93-L104 HydrophobicContact CG2-CD2 3.99Å
94	I	86	Confident	87.4	Confident	113 Å²	113	51.5 Å²	51.5	58%	0.579	26%	0.263	S	S	*	.	H	α-helix	trans	-59.7	-39.2	178.1	-68.2	165.7	0	0	0	110.9	V90 Y91 S96	V90-I94 HydrophobicContact CG1-CD1 4.05Å; V90-I94 WeakPolarHBondContact O-CG1 3.39Å; V90-I94 PolarHBondContact O-N 2.9Å; Y91-I94 PolarHBondContact O-N 3.21Å; I94-S96 PolarHBondContact O-N 3.48Å
95	R	88.1	Confident	87.7	Confident	133 Å²	133	54 Å²	54	50%	0.502	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	1.9	175.7	-70.8	-72.2	-176.7	-178.8	-8	113.9	Y54 Y91 G92 I93 N97	Y54-R95 VanDerWaalsContact CD1-NH2 3.28Å; Y91-R95 HydrophobicContact CE1-CG 4.34Å; Y91-R95 HydrophobicContact CE2-CG 4.02Å; Y91-R95 PolarHBondContact O-N 2.93Å; Y91-R95 VanDerWaalsContact O-N 3.07Å; Y91-R95 PolarHBondContact OH-NE 2.84Å; Y91-R95 VanDerWaalsContact OH-NE 3.14Å; G92-R95 CarbonylContact O-C 3.54Å; G92-R95 PolarHBondContact O-N 3.4Å; I93-R95 VanDerWaalsContact C-N 3.25Å; I93-R95 PolarHBondContact O-N 3.17Å; R95-N97 PolarHBondContact O-N 2.9Å
96	S	86.3	Confident	87.9	Confident	84 Å²	84	53.4 Å²	53.4	59%	0.587	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.1	34.9	-176.7	-52	0	0	0	0	112.8	G92 I93 I94 E98	G92-S96 PolarHBondContact O-N 3.47Å; G92-S96 VanDerWaalsContact O-N 3.07Å; I93-S96 WeakPolarHBondContact O-CA 3.49Å; I93-S96 PolarHBondContact O-N 3.05Å; I94-S96 PolarHBondContact O-N 3.48Å; S96-E98 PolarHBondContact O-N 3.41Å
97	N	89	Confident	88	Confident	48 Å²	48	52.4 Å²	52.4	26%	0.257	27%	0.268	S	S	.	.			trans	-65.9	129.4	171.2	174.6	-86.2	0	0	0	109.3	G92 R95 E99 A100 V101 Y136	G92-N97 WeakPolarHBondContact O-CB 3.17Å; G92-N97 PolarHBondContact O-N 2.58Å; R95-N97 PolarHBondContact O-N 2.9Å; N97-E99 PolarHBondContact O-N 3.07Å; N97-E99 WeakPolarHBondContact OD1-CB 3.48Å; N97-E99 PolarHBondContact OD1-N 3.08Å; N97-E99 VanDerWaalsContact OD1-N 3.14Å; N97-A100 HydrophobicContact CB-CB 3.93Å; N97-A100 PolarHBondContact O-N 3.12Å; N97-A100 PolarHBondContact OD1-N 3.25Å; N97-V101 WeakPolarHBondContact O-CG2 3.38Å; N97-V101 PolarHBondContact O-N 3.45Å; N97-Y136 HydrophobicContact CB-CE2 4.22Å
98	E	89	Confident	88.3	Confident	157 Å²	157	51.4 Å²	51.4	73%	0.734	26%	0.263	S	S	*	.	H	α-helix	trans	-59.1	-45.5	-173.9	-174	176.3	174.8	0	0	112.8	S96 V101 K102	S96-E98 PolarHBondContact O-N 3.41Å; E98-V101 PolarHBondContact O-N 3.1Å; E98-K102 PolarHBondContact O-N 2.87Å
99	E	89.1	Confident	88.3	Confident	72 Å²	72	56.6 Å²	56.6	34%	0.336	29%	0.285	S	S	.	.	H	α-helix	trans	-65.3	-40.1	177.6	-66.7	-61.1	144.7	0	0	111.9	N97 V101 K102 F134	N97-E99 PolarHBondContact O-N 3.07Å; N97-E99 WeakPolarHBondContact OD1-CB 3.48Å; N97-E99 PolarHBondContact OD1-N 3.08Å; N97-E99 VanDerWaalsContact OD1-N 3.14Å; E99-V101 VanDerWaalsContact C-N 3.34Å; E99-V101 PolarHBondContact O-N 2.85Å; E99-K102 WeakPolarHBondContact O-CB 3.39Å; E99-K102 PolarHBondContact O-N 3.29Å; E99-K102 IonicContact OE1-NZ 2.66Å; E99-K102 PolarHBondContact OE1-NZ 3.03Å; E99-K102 WeakPolarHBondContact OE2-CD 3.16Å; E99-K102 WeakPolarHBondContact OE2-CE 3.45Å; E99-K102 IonicContact OE2-NZ 2.67Å; E99-K102 PolarHBondContact OE2-NZ 3Å; E99-F134 HydrophobicContact CB-CD2 3.95Å; E99-F134 HydrophobicContact CB-CE2 4.24Å
100	A	88.5	Confident	88.3	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-66	-35.7	177.7	0	0	0	0	0	112.3	G92 I93 N97 K102 W103 F134	G92-A100 VanDerWaalsContact CA-CB 3.49Å; I93-A100 HydrophobicContact CG1-CB 4.1Å; I93-A100 VanDerWaalsContact CG1-O 3.27Å; I93-A100 WeakPolarHBondContact CG1-O 3.28Å; N97-A100 HydrophobicContact CB-CB 3.93Å; N97-A100 PolarHBondContact O-N 3.12Å; N97-A100 PolarHBondContact OD1-N 3.25Å; A100-K102 PolarHBondContact O-N 3.18Å; A100-W103 WeakPolarHBondContact O-CB 3.18Å; A100-W103 PolarHBondContact O-N 3.16Å; A100-F134 HydrophobicContact CB-CE2 3.91Å; A100-F134 HydrophobicContact CB-CZ 4.25Å
101	V	90.7	Very high	88.3	Confident	47 Å²	47	60.7 Å²	60.7	29%	0.285	30%	0.304	S	S	.	.	H	α-helix	trans	-64.9	-27.5	177.4	171.4	0	0	0	0	111.9	N97 E98 E99 W103 L104 D105	N97-V101 WeakPolarHBondContact O-CG2 3.38Å; N97-V101 PolarHBondContact O-N 3.45Å; E98-V101 PolarHBondContact O-N 3.1Å; E99-V101 VanDerWaalsContact C-N 3.34Å; E99-V101 PolarHBondContact O-N 2.85Å; V101-W103 PolarHBondContact O-N 3.3Å; V101-L104 PolarHBondContact O-N 3.08Å; V101-L104 VanDerWaalsContact O-N 3.15Å; V101-D105 PolarHBondContact O-N 3.33Å
102	K	93	Very high	88.5	Confident	65 Å²	65	64.3 Å²	64.3	28%	0.283	33%	0.334	S	S	.	.	H	α-helix	trans	-58.4	-35.2	174.8	-62.1	179	-173.7	169.1	0	112.4	E98 E99 A100 D105 A106 I131	E98-K102 PolarHBondContact O-N 2.87Å; E99-K102 WeakPolarHBondContact O-CB 3.39Å; E99-K102 PolarHBondContact O-N 3.29Å; E99-K102 IonicContact OE1-NZ 2.66Å; E99-K102 PolarHBondContact OE1-NZ 3.03Å; E99-K102 WeakPolarHBondContact OE2-CD 3.16Å; E99-K102 WeakPolarHBondContact OE2-CE 3.45Å; E99-K102 IonicContact OE2-NZ 2.67Å; E99-K102 PolarHBondContact OE2-NZ 3Å; A100-K102 PolarHBondContact O-N 3.18Å; K102-D105 PolarHBondContact O-N 3.23Å; K102-A106 VanDerWaalsContact O-CB 3.25Å; K102-A106 WeakPolarHBondContact O-CB 3.35Å; K102-A106 PolarHBondContact O-N 2.94Å; K102-I131 HydrophobicContact CB-CD1 4.03Å; K102-I131 HydrophobicContact CB-CG1 4.31Å
103	W	92.2	Very high	88.7	Confident	7 Å²	7	66.3 Å²	66.3	3%	0.027	35%	0.354	C	S	.	.	H	α-helix	trans	-64.7	-44	176.5	-63.7	81.7	0	0	0	112.1	I89 A100 V101 D105 A106 A107 I131 F134 V142 C172 P174	I89-W103 HydrophobicContact CD1-CD2 3.53Å; I89-W103 HydrophobicContact CD1-CE3 3.6Å; I89-W103 HydrophobicContact CD1-CG 4.23Å; I89-W103 HydrophobicContact CD1-CH2 3.77Å; I89-W103 HydrophobicContact CD1-CZ2 3.68Å; I89-W103 HydrophobicContact CD1-CZ3 3.73Å; I89-W103 HydrophobicContact CG1-CD2 3.93Å; I89-W103 HydrophobicContact CG1-CE3 4.48Å; I89-W103 HydrophobicContact CG1-CG 4.18Å; I89-W103 HydrophobicContact CG1-CZ2 4.21Å; I89-W103 HydrophobicContact CG2-CB 3.63Å; I89-W103 HydrophobicContact CG2-CD2 4.08Å; I89-W103 HydrophobicContact CG2-CG 3.6Å; A100-W103 WeakPolarHBondContact O-CB 3.18Å; A100-W103 PolarHBondContact O-N 3.16Å; V101-W103 PolarHBondContact O-N 3.3Å; W103-D105 VanDerWaalsContact C-N 3.34Å; W103-A106 PolarHBondContact O-N 3.11Å; W103-A107 PolarHBondContact O-N 3.31Å; W103-I131 HydrophobicContact CD2-CD1 3.91Å; W103-I131 HydrophobicContact CE3-CD1 4.37Å; W103-I131 HydrophobicContact CG-CD1 4Å; W103-I131 HydrophobicContact CH2-CG2 4.26Å; W103-I131 HydrophobicContact CZ2-CG2 3.52Å; W103-F134 HydrophobicContact CZ2-CB 3.84Å; W103-F134 HydrophobicContact CZ2-CD1 4.16Å; W103-F134 HydrophobicContact CZ2-CG 4.03Å; W103-F134 AromaticContact NE1-CD1 4Å; W103-F134 AromaticContact NE1-CD2 3.42Å; W103-F134 AromaticContact NE1-CE2 3.89Å; W103-F134 AromaticContact NE1-CG 3.47Å; W103-V142 HydrophobicContact CH2-CG1 3.83Å; W103-V142 HydrophobicContact CZ2-CB 4.48Å; W103-V142 HydrophobicContact CZ2-CG1 4Å; W103-C172 HydrophobicContact CE3-CB 4.44Å; W103-P174 HydrophobicContact CH2-CG 4.29Å; W103-P174 HydrophobicContact CZ3-CG 4.22Å
104	L	88	Confident	88.8	Confident	81 Å²	81	67.8 Å²	67.8	42%	0.424	37%	0.365	S	S	.	.	H	α-helix	trans	-66.9	-37.2	176.2	-179.6	63	0	0	0	111.6	I93 V101	I93-L104 HydrophobicContact CD1-CB 3.95Å; I93-L104 HydrophobicContact CG1-CB 4.37Å; I93-L104 HydrophobicContact CG2-CD2 3.99Å; V101-L104 PolarHBondContact O-N 3.08Å; V101-L104 VanDerWaalsContact O-N 3.15Å
105	D	90.3	Very high	88.6	Confident	80 Å²	80	71.4 Å²	71.4	43%	0.428	37%	0.373	S	S	.	.	H	α-helix	trans	-72.4	-34	179.1	-164	45.8	0	0	0	112.7	V101 K102 W103 A107 K109 L127	V101-D105 PolarHBondContact O-N 3.33Å; K102-D105 PolarHBondContact O-N 3.23Å; W103-D105 VanDerWaalsContact C-N 3.34Å; D105-A107 VanDerWaalsContact C-N 3.31Å; D105-A107 PolarHBondContact O-N 3.36Å; D105-K109 IonicContact OD1-NZ 2.96Å; D105-K109 PolarHBondContact OD1-NZ 3.37Å; D105-L127 HydrophobicContact CB-CD2 3.96Å
106	A	92.9	Very high	88.5	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-70.4	-24.8	175.5	0	0	0	0	0	113.4	K102 W103 G123 S124 L127 C128 C172	K102-A106 VanDerWaalsContact O-CB 3.25Å; K102-A106 WeakPolarHBondContact O-CB 3.35Å; K102-A106 PolarHBondContact O-N 2.94Å; W103-A106 PolarHBondContact O-N 3.11Å; A106-G123 CarbonylContact O-C 3.58Å; A106-G123 WeakPolarHBondContact O-CA 3.4Å; A106-S124 PolarHBondContact O-N 3.22Å; A106-L127 HydrophobicContact CB-CB 4.18Å; A106-L127 HydrophobicContact CB-CD2 4.09Å; A106-L127 HydrophobicContact CB-CG 4.09Å; A106-C128 HydrophobicContact CB-CB 3.93Å; A106-C172 HydrophobicContact CB-CB 3.92Å
107	A	90.9	Very high	88.5	Confident	12 Å²	12	61.2 Å²	61.2	10%	0.099	32%	0.323	C	S	.	.	S	Bend	trans	-70.5	154	177.4	0	0	0	0	0	112.5	W103 D105	W103-A107 PolarHBondContact O-N 3.31Å; D105-A107 VanDerWaalsContact C-N 3.31Å; D105-A107 PolarHBondContact O-N 3.36Å
108	G	89.6	Confident	88.6	Confident	7 Å²	7	59 Å²	59	7%	0.072	31%	0.31	C	S	.	.			trans	-56.5	142.8	174.5	0	0	0	0	0	112	W121 Y169 G170	G108-W121 VanDerWaalsContact CA-O 3.3Å; G108-W121 WeakPolarHBondContact CA-O 3.31Å; G108-Y169 VanDerWaalsContact O-CE2 3.29Å; G108-Y169 WeakPolarHBondContact O-CE2 3.44Å; G108-G170 WeakPolarHBondContact CA-O 3.31Å; G108-G170 PolarHBondContact N-O 2.89Å
109	K	87.5	Confident	88.6	Confident	115 Å²	115	52.5 Å²	52.5	50%	0.5	28%	0.281	S	S	.	.			trans	-123.1	150	175.2	-63.8	175	-173.4	171.9	0	108.8	D105 V111 W121	D105-K109 IonicContact OD1-NZ 2.96Å; D105-K109 PolarHBondContact OD1-NZ 3.37Å; K109-V111 PolarHBondContact O-N 3.44Å; K109-W121 WeakPolarHBondContact O-CB 3.25Å
110	I	85.8	Confident	88.7	Confident	126 Å²	126	49.7 Å²	49.7	65%	0.646	27%	0.268	S	S	*	.	P	Polyproline II helix	trans	-60.3	122.3	172.6	-55.6	-179.3	0	0	0	108.1	V114 W121	I110-V114 HydrophobicContact CG2-CG2 4.09Å; I110-W121 HydrophobicContact CB-CH2 4.35Å; I110-W121 HydrophobicContact CB-CZ2 4.21Å; I110-W121 HydrophobicContact CD1-CH2 4.2Å; I110-W121 HydrophobicContact CD1-CZ3 4.43Å; I110-W121 HydrophobicContact CG1-CD2 4.47Å; I110-W121 HydrophobicContact CG1-CE3 4.11Å; I110-W121 HydrophobicContact CG1-CH2 3.69Å; I110-W121 HydrophobicContact CG1-CZ2 4.06Å; I110-W121 HydrophobicContact CG1-CZ3 3.71Å; I110-W121 HydrophobicContact CG2-CH2 4.2Å; I110-W121 HydrophobicContact CG2-CZ2 3.79Å
111	V	85.8	Confident	88.9	Confident	41 Å²	41	51.5 Å²	51.5	25%	0.248	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-90.9	153.9	177.5	-56.4	0	0	0	0	110.8	K109 V114	K109-V111 PolarHBondContact O-N 3.44Å; V111-V114 WeakPolarHBondContact O-CG2 3.3Å
112	P	87.5	Confident	89	Confident	123 Å²	123	49.6 Å²	49.6	80%	0.799	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	155.1	170.2	27.9	-35.7	0	0	0	111.1
113	G	87.4	Confident	88.9	Confident	42 Å²	42	47.9 Å²	47.9	43%	0.433	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.2	22.9	175	0	0	0	0	0	115.3	Y115 G116 G117 G118	G113-Y115 PolarHBondContact O-N 3.26Å; G113-G116 CarbonylContact O-C 3.58Å; G113-G116 VanDerWaalsContact O-CA 3.31Å; G113-G116 WeakPolarHBondContact O-CA 3.21Å; G113-G116 PolarHBondContact O-N 3.05Å; G113-G117 PolarHBondContact O-N 3.13Å; G113-G118 PolarHBondContact O-N 2.63Å
114	V	86.4	Confident	88.9	Confident	70 Å²	70	49.6 Å²	49.6	42%	0.424	28%	0.277	S	S	.	.	G	3₁₀ helix	trans	-50.7	-43.2	174.6	-178.7	0	0	0	0	111.9	I110 V111 G116 G117 W121	I110-V114 HydrophobicContact CG2-CG2 4.09Å; V111-V114 WeakPolarHBondContact O-CG2 3.3Å; V114-G116 PolarHBondContact O-N 2.87Å; V114-G117 PolarHBondContact O-N 3Å; V114-W121 HydrophobicContact CG2-CZ2 4.14Å
115	Y	82.7	Confident	89.2	Confident	189 Å²	189	46.1 Å²	46.1	74%	0.741	26%	0.259	S	S	*	.	G	3₁₀ helix	trans	-56.3	-35.1	174.1	179	-97	0	0	0	113	G113 G117	G113-Y115 PolarHBondContact O-N 3.26Å; Y115-G117 VanDerWaalsContact C-N 3.31Å; Y115-G117 PolarHBondContact O-N 3.04Å
116	G	86	Confident	89.3	Confident	2 Å²	2	49.7 Å²	49.7	2%	0.021	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-83.2	1.2	178	0	0	0	0	0	115.1	G113 V114 N390 M391 L392 L393	G113-G116 CarbonylContact O-C 3.58Å; G113-G116 VanDerWaalsContact O-CA 3.31Å; G113-G116 WeakPolarHBondContact O-CA 3.21Å; G113-G116 PolarHBondContact O-N 3.05Å; V114-G116 PolarHBondContact O-N 2.87Å; G116-N390 CarbonylContact O-C 3.6Å; G116-N390 VanDerWaalsContact O-CA 3.27Å; G116-N390 WeakPolarHBondContact O-CA 3.37Å; G116-M391 PolarHBondContact O-N 3.35Å; G116-L392 PolarHBondContact O-N 2.94Å; G116-L393 PolarHBondContact O-N 3.36Å
117	G	86.9	Confident	89.3	Confident	2 Å²	2	51.8 Å²	51.8	2%	0.021	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	103.2	20.3	-175.7	0	0	0	0	0	115.1	G113 V114 Y115 I119 N389	G113-G117 PolarHBondContact O-N 3.13Å; V114-G117 PolarHBondContact O-N 3Å; Y115-G117 VanDerWaalsContact C-N 3.31Å; Y115-G117 PolarHBondContact O-N 3.04Å; G117-I119 PolarHBondContact O-N 3.44Å; G117-N389 CarbonylContact C-O 3.46Å; G117-N389 VanDerWaalsContact C-O 3.32Å; G117-N389 CarbonylContact O-C 3.59Å; G117-N389 WeakPolarHBondContact O-CA 3.48Å
118	G	90.3	Very high	89.5	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	28%	0.279	C	S	.	.			trans	-72	65.6	174.6	0	0	0	0	0	113.2	G113 W121 N389	G113-G118 PolarHBondContact O-N 2.63Å; G118-W121 PolarHBondContact O-NE1 2.75Å; G118-N389 WeakPolarHBondContact CA-O 3.26Å; G118-N389 PolarHBondContact N-O 3.06Å; G118-N389 VanDerWaalsContact N-O 3.08Å
119	I	88.4	Confident	89.6	Confident	22 Å²	22	54.2 Å²	54.2	11%	0.113	29%	0.288	C	S	.	.			trans	-107.7	-0.4	-172	63.8	175.7	0	0	0	114.4	G117 L153 F165 L167 N168 N389	G117-I119 PolarHBondContact O-N 3.44Å; I119-L153 HydrophobicContact CG2-CD1 4.13Å; I119-F165 HydrophobicContact CD1-CB 4.07Å; I119-F165 HydrophobicContact CD1-CD1 3.96Å; I119-F165 HydrophobicContact CD1-CG 4.46Å; I119-L167 HydrophobicContact CB-CD1 4.18Å; I119-L167 VanDerWaalsContact O-CD1 3.28Å; I119-L167 WeakPolarHBondContact O-CD1 3.47Å; I119-N168 PolarHBondContact O-N 3.29Å; I119-N389 PolarHBondContact N-OD1 3.35Å
120	N	92	Very high	89.8	Confident	12 Å²	12	54.6 Å²	54.6	6%	0.064	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	104.4	173.7	-58.3	-74.6	0	0	0	109.7	L122 N168 N389 M480 P722	N120-L122 HydrophobicContact CB-CD2 4.28Å; N120-N168 WeakPolarHBondContact OD1-CB 2.88Å; N120-N389 WeakPolarHBondContact CA-OD1 3.11Å; N120-N389 VanDerWaalsContact CB-OD1 3.26Å; N120-N389 WeakPolarHBondContact CB-OD1 3.38Å; N120-N389 PolarHBondContact N-OD1 3.42Å; N120-N389 PolarHBondContact ND2-OD1 3.09Å; N120-N389 PolarHBondContact O-ND2 3.04Å; N120-M480 HydrophobicContact CB-CE 4.46Å; N120-M480 HydrophobicContact CB-SD 4.38Å; N120-M480 WeakPolarHBondContact OD1-CE 3.43Å; N120-P722 HydrophobicContact CB-CB 3.92Å; N120-P722 HydrophobicContact CB-CG 3.51Å; N120-P722 WeakPolarHBondContact O-CG 3.38Å
121	W	92.4	Very high	90.1	Very high	39 Å²	39	49 Å²	49	15%	0.148	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	74.6	-178.1	-59.9	-8.4	0	0	0	109.6	G108 K109 I110 V114 G118 L167 N168 Y169 G170	G108-W121 VanDerWaalsContact CA-O 3.3Å; G108-W121 WeakPolarHBondContact CA-O 3.31Å; K109-W121 WeakPolarHBondContact O-CB 3.25Å; I110-W121 HydrophobicContact CB-CH2 4.35Å; I110-W121 HydrophobicContact CB-CZ2 4.21Å; I110-W121 HydrophobicContact CD1-CH2 4.2Å; I110-W121 HydrophobicContact CD1-CZ3 4.43Å; I110-W121 HydrophobicContact CG1-CD2 4.47Å; I110-W121 HydrophobicContact CG1-CE3 4.11Å; I110-W121 HydrophobicContact CG1-CH2 3.69Å; I110-W121 HydrophobicContact CG1-CZ2 4.06Å; I110-W121 HydrophobicContact CG1-CZ3 3.71Å; I110-W121 HydrophobicContact CG2-CH2 4.2Å; I110-W121 HydrophobicContact CG2-CZ2 3.79Å; V114-W121 HydrophobicContact CG2-CZ2 4.14Å; G118-W121 PolarHBondContact O-NE1 2.75Å; W121-L167 HydrophobicContact CD2-CD1 3.8Å; W121-L167 HydrophobicContact CE3-CD1 3.99Å; W121-L167 HydrophobicContact CE3-CD2 4.1Å; W121-L167 HydrophobicContact CE3-CG 4.44Å; W121-L167 HydrophobicContact CG-CD1 4.4Å; W121-L167 HydrophobicContact CH2-CD1 3.92Å; W121-L167 HydrophobicContact CH2-CD2 4.11Å; W121-L167 HydrophobicContact CZ2-CD1 3.73Å; W121-L167 HydrophobicContact CZ3-CD1 4.05Å; W121-L167 HydrophobicContact CZ3-CD2 3.76Å; W121-L167 HydrophobicContact CZ3-CG 4.47Å; W121-N168 PolarHBondContact N-O 3.43Å; W121-Y169 HydrophobicContact CB-CD2 4.16Å; W121-Y169 HydrophobicContact CE3-CD2 4.12Å; W121-G170 PolarHBondContact O-N 2.95Å
122	L	92.2	Very high	90.4	Very high	6 Å²	6	51 Å²	51	3%	0.031	28%	0.279	C	S	.	.			trans	-76.9	-29.2	-167.3	-51.9	-176.5	0	0	0	114.2	N120 Y146 N168 G170 P479 M480 P722	N120-L122 HydrophobicContact CB-CD2 4.28Å; L122-Y146 VanDerWaalsContact O-CE2 3.22Å; L122-Y146 WeakPolarHBondContact O-CE2 3.37Å; L122-Y146 VanDerWaalsContact O-CZ 3.31Å; L122-Y146 PolarHBondContact O-OH 3.32Å; L122-N168 WeakPolarHBondContact CD2-ND2 3.33Å; L122-G170 WeakPolarHBondContact O-CA 3.31Å; L122-P479 HydrophobicContact CB-CB 4.18Å; L122-P479 HydrophobicContact CD1-CB 3.99Å; L122-P479 HydrophobicContact CD1-CG 3.87Å; L122-P479 HydrophobicContact CG-CB 4.48Å; L122-M480 HydrophobicContact CD1-CG 3.46Å; L122-M480 VanDerWaalsContact CD1-CG 3.46Å; L122-M480 HydrophobicContact CD1-SD 3.6Å; L122-M480 HydrophobicContact CD2-CG 4.34Å; L122-M480 HydrophobicContact CD2-SD 3.41Å; L122-M480 WeakPolarHBondContact CD2-SD 3.41Å; L122-M480 HydrophobicContact CG-SD 4.06Å; L122-P722 HydrophobicContact CD1-CG 3.75Å; L122-P722 HydrophobicContact CG-CG 3.91Å
123	G	91.2	Very high	90.4	Very high	30 Å²	30	49.4 Å²	49.4	31%	0.309	26%	0.264	S	S	.	.			trans	65.7	-155.2	-169.1	0	0	0	0	0	111.3	A106	A106-G123 CarbonylContact O-C 3.58Å; A106-G123 WeakPolarHBondContact O-CA 3.4Å
124	S	93.6	Very high	90.6	Very high	42 Å²	42	47.4 Å²	47.4	29%	0.294	24%	0.244	S	C	.	.			trans	-114.5	98.7	-179.6	-176.9	0	0	0	0	111.3	A106 E126 L127 C128	A106-S124 PolarHBondContact O-N 3.22Å; S124-E126 VanDerWaalsContact C-N 3.3Å; S124-E126 PolarHBondContact O-N 3.44Å; S124-L127 PolarHBondContact O-N 3.06Å; S124-L127 VanDerWaalsContact OG-CB 3.23Å; S124-L127 WeakPolarHBondContact OG-CB 3.47Å; S124-L127 PolarHBondContact OG-N 2.9Å; S124-L127 VanDerWaalsContact OG-N 3.16Å; S124-C128 PolarHBondContact O-N 3.05Å
125	M	93.1	Very high	90.8	Very high	9 Å²	9	47.2 Å²	47.2	4%	0.044	25%	0.245	C	C	.	.	H	α-helix	trans	-62.5	-38.3	173.9	177.6	174	-179.9	0	0	112.2	C128 R129 Y146 H215 V477 P479	M125-C128 PolarHBondContact O-N 3.13Å; M125-R129 WeakPolarHBondContact O-CG 3.24Å; M125-R129 PolarHBondContact O-N 2.55Å; M125-R129 VanDerWaalsContact O-N 3.08Å; M125-Y146 HydrophobicContact CB-CD1 3.9Å; M125-Y146 HydrophobicContact CB-CD2 3.86Å; M125-Y146 HydrophobicContact CB-CE1 4.04Å; M125-Y146 HydrophobicContact CB-CE2 3.96Å; M125-Y146 HydrophobicContact CB-CG 3.82Å; M125-Y146 HydrophobicContact CE-CD1 4.34Å; M125-Y146 HydrophobicContact CG-CD1 3.6Å; M125-Y146 HydrophobicContact CG-CD2 4.2Å; M125-Y146 HydrophobicContact CG-CE1 4.13Å; M125-Y146 HydrophobicContact CG-CG 3.64Å; M125-Y146 HydrophobicContact SD-CD1 3.74Å; M125-Y146 HydrophobicContact SD-CE1 4.03Å; M125-Y146 HydrophobicContact SD-CG 4.4Å; M125-H215 HydrophobicContact CE-CB 3.6Å; M125-V477 HydrophobicContact CE-CG1 3.62Å; M125-P479 HydrophobicContact CB-CB 4.26Å; M125-P479 HydrophobicContact SD-CB 4.04Å; M125-P479 HydrophobicContact SD-CG 4.45Å; M125-P479 VanDerWaalsContact SD-N 3.39Å
126	E	92.7	Very high	90.9	Very high	154 Å²	154	40.8 Å²	40.8	72%	0.72	22%	0.22	S	C	*	.	H	α-helix	trans	-64.9	-46.6	178	-173.7	176	-173.3	0	0	111.4	S124 C128 R129 N130	S124-E126 VanDerWaalsContact C-N 3.3Å; S124-E126 PolarHBondContact O-N 3.44Å; E126-C128 VanDerWaalsContact C-N 3.34Å; E126-C128 PolarHBondContact O-N 2.89Å; E126-R129 PolarHBondContact O-N 3.43Å; E126-N130 PolarHBondContact O-N 2.86Å; E126-N130 VanDerWaalsContact O-N 3.08Å
127	L	93.6	Very high	90.8	Very high	45 Å²	45	43.7 Å²	43.7	24%	0.236	25%	0.25	C	S	.	.	H	α-helix	trans	-61.5	-44.1	176	-178.5	61.4	0	0	0	111.1	D105 A106 S124 R129 N130 I131	D105-L127 HydrophobicContact CB-CD2 3.96Å; A106-L127 HydrophobicContact CB-CB 4.18Å; A106-L127 HydrophobicContact CB-CD2 4.09Å; A106-L127 HydrophobicContact CB-CG 4.09Å; S124-L127 PolarHBondContact O-N 3.06Å; S124-L127 VanDerWaalsContact OG-CB 3.23Å; S124-L127 WeakPolarHBondContact OG-CB 3.47Å; S124-L127 PolarHBondContact OG-N 2.9Å; S124-L127 VanDerWaalsContact OG-N 3.16Å; L127-R129 VanDerWaalsContact C-N 3.31Å; L127-R129 PolarHBondContact O-N 3.23Å; L127-N130 PolarHBondContact O-N 3.18Å; L127-I131 WeakPolarHBondContact O-CG1 3.32Å; L127-I131 PolarHBondContact O-N 3.42Å
128	C	94	Very high	90.6	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-56.9	-45.1	178.1	-176.3	0	0	0	0	112.2	A106 S124 M125 E126 N130 I131 G144 Y146 C172	A106-C128 HydrophobicContact CB-CB 3.93Å; S124-C128 PolarHBondContact O-N 3.05Å; M125-C128 PolarHBondContact O-N 3.13Å; E126-C128 VanDerWaalsContact C-N 3.34Å; E126-C128 PolarHBondContact O-N 2.89Å; C128-N130 VanDerWaalsContact C-N 3.3Å; C128-N130 PolarHBondContact O-N 3.42Å; C128-I131 PolarHBondContact O-N 3.31Å; C128-G144 WeakPolarHBondContact O-CA 3.38Å; C128-Y146 HydrophobicContact CB-CD2 4.28Å; C128-C172 WeakPolarHBondContact CA-SG 3.39Å; C128-C172 HydrophobicContact CB-CB 3.7Å; C128-C172 WeakPolarHBondContact CB-SG 3.5Å; C128-C172 WeakPolarHBondContact SG-CA 3.35Å; C128-C172 WeakPolarHBondContact SG-CB 3.23Å; C128-C172 CovalentContact SG-SG 2.04Å; C128-C172 PolarHBondContact SG-SG 3.02Å
129	R	91.6	Very high	90.4	Very high	69 Å²	69	49.3 Å²	49.3	26%	0.26	28%	0.28	S	S	.	.	H	α-helix	trans	-70.8	-25.5	-179.5	-75.2	-178.9	166.9	-169.7	-5.5	113.7	M125 E126 L127 I131 H215 A216	M125-R129 WeakPolarHBondContact O-CG 3.24Å; M125-R129 PolarHBondContact O-N 2.55Å; M125-R129 VanDerWaalsContact O-N 3.08Å; E126-R129 PolarHBondContact O-N 3.43Å; L127-R129 VanDerWaalsContact C-N 3.31Å; L127-R129 PolarHBondContact O-N 3.23Å; R129-I131 PolarHBondContact O-N 3.47Å; R129-H215 PolarHBondContact NH2-O 3.16Å; R129-A216 VanDerWaalsContact NH2-C 3.29Å; R129-A216 PolarHBondContact NH2-O 3.19Å
130	N	92.7	Very high	90.3	Very high	124 Å²	124	55.9 Å²	55.9	66%	0.663	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-4.6	177.8	-158.4	36.4	0	0	0	113.1	E126 L127 C128 T132	E126-N130 PolarHBondContact O-N 2.86Å; E126-N130 VanDerWaalsContact O-N 3.08Å; L127-N130 PolarHBondContact O-N 3.18Å; C128-N130 VanDerWaalsContact C-N 3.3Å; C128-N130 PolarHBondContact O-N 3.42Å; N130-T132 PolarHBondContact O-N 3.08Å; N130-T132 VanDerWaalsContact O-N 3.13Å
131	I	92.9	Very high	90.1	Very high	7 Å²	7	61.6 Å²	61.6	4%	0.036	34%	0.336	C	S	.	.			trans	-79.8	91.5	170.9	-57.5	167.2	0	0	0	107.8	K102 W103 L127 C128 R129 F134 Q143 G144	K102-I131 HydrophobicContact CB-CD1 4.03Å; K102-I131 HydrophobicContact CB-CG1 4.31Å; W103-I131 HydrophobicContact CD2-CD1 3.91Å; W103-I131 HydrophobicContact CE3-CD1 4.37Å; W103-I131 HydrophobicContact CG-CD1 4Å; W103-I131 HydrophobicContact CH2-CG2 4.26Å; W103-I131 HydrophobicContact CZ2-CG2 3.52Å; L127-I131 WeakPolarHBondContact O-CG1 3.32Å; L127-I131 PolarHBondContact O-N 3.42Å; C128-I131 PolarHBondContact O-N 3.31Å; R129-I131 PolarHBondContact O-N 3.47Å; I131-F134 HydrophobicContact CG2-CB 3.94Å; I131-Q143 CarbonylContact O-C 3.32Å; I131-Q143 VanDerWaalsContact O-CA 3.31Å; I131-Q143 WeakPolarHBondContact O-CA 3.4Å; I131-G144 PolarHBondContact O-N 3.43Å
132	T	90.2	Very high	90	Very high	83 Å²	83	60 Å²	60	51%	0.509	33%	0.331	S	S	.	.			trans	-104.7	-21.7	-175.2	53.5	0	0	0	0	114.2	N130 Q143	N130-T132 PolarHBondContact O-N 3.08Å; N130-T132 VanDerWaalsContact O-N 3.13Å; T132-Q143 WeakPolarHBondContact O-CG 3.32Å
133	D	89.3	Confident	90	Very high	90 Å²	90	64.7 Å²	64.7	48%	0.481	35%	0.352	S	S	.	.			trans	-142.2	62.8	-175.8	-168.3	8.4	0	0	0	112.1	S135 H141	D133-S135 PolarHBondContact O-N 2.95Å; D133-S135 PolarHBondContact OD1-OG 3.33Å; D133-H141 WeakPolarHBondContact OD1-CA 3.2Å; D133-H141 IonicContact OD1-CE1 3.89Å; D133-H141 IonicContact OD1-CG 3.11Å; D133-H141 IonicContact OD1-ND1 2.88Å; D133-H141 PolarHBondContact OD1-ND1 3.48Å; D133-H141 IonicContact OD2-CE1 3.38Å; D133-H141 IonicContact OD2-ND1 2.78Å
134	F	90.8	Very high	90.1	Very high	1 Å²	1	63.9 Å²	63.9	0%	0.004	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	118.3	171.7	175.6	-100.5	0	0	0	110.3	I89 E99 A100 W103 I131 Y136 H141 V142	I89-F134 HydrophobicContact CB-CE1 4.46Å; I89-F134 HydrophobicContact CB-CZ 4.49Å; I89-F134 HydrophobicContact CG1-CD1 4Å; I89-F134 HydrophobicContact CG1-CE1 3.47Å; I89-F134 VanDerWaalsContact CG1-CE1 3.47Å; I89-F134 HydrophobicContact CG1-CZ 3.87Å; E99-F134 HydrophobicContact CB-CD2 3.95Å; E99-F134 HydrophobicContact CB-CE2 4.24Å; A100-F134 HydrophobicContact CB-CE2 3.91Å; A100-F134 HydrophobicContact CB-CZ 4.25Å; W103-F134 HydrophobicContact CZ2-CB 3.84Å; W103-F134 HydrophobicContact CZ2-CD1 4.16Å; W103-F134 HydrophobicContact CZ2-CG 4.03Å; W103-F134 AromaticContact NE1-CD1 4Å; W103-F134 AromaticContact NE1-CD2 3.42Å; W103-F134 AromaticContact NE1-CE2 3.89Å; W103-F134 AromaticContact NE1-CG 3.47Å; I131-F134 HydrophobicContact CG2-CB 3.94Å; F134-Y136 VanDerWaalsContact CZ-CB 3.44Å; F134-Y136 HydrophobicContact CZ-CG 4.32Å; F134-H141 PolarHBondContact O-N 3.02Å; F134-V142 HydrophobicContact CB-CB 4.16Å; F134-V142 HydrophobicContact CD1-CB 4.08Å; F134-V142 HydrophobicContact CD1-CG2 4.26Å; F134-V142 PolarHBondContact N-O 2.99Å; F134-V142 PolarHBondContact O-N 3.32Å
135	S	89.6	Confident	90.1	Very high	65 Å²	65	64.5 Å²	64.5	46%	0.455	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	108.7	176.4	-66	0	0	0	0	109.9	D133 S139 H141	D133-S135 PolarHBondContact O-N 2.95Å; D133-S135 PolarHBondContact OD1-OG 3.33Å; S135-S139 WeakPolarHBondContact CA-O 3.29Å; S135-H141 PolarHBondContact OG-N 2.95Å
136	Y	86.6	Confident	90.1	Very high	54 Å²	54	64.1 Å²	64.1	21%	0.212	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	143.7	178.8	-167.7	-104.2	0	0	0	110.5	S88 Y91 N97 F134 L138 S139	S88-Y136 VanDerWaalsContact CB-O 3.28Å; S88-Y136 WeakPolarHBondContact CB-O 3.49Å; S88-Y136 WeakPolarHBondContact O-CD1 3.35Å; S88-Y136 PolarHBondContact OG-O 3Å; Y91-Y136 HydrophobicContact CD1-CD1 4.14Å; Y91-Y136 AromaticContact CD1-CE1 3.34Å; Y91-Y136 HydrophobicContact CD1-CE1 3.34Å; Y91-Y136 AromaticContact CE1-CE1 3.65Å; Y91-Y136 HydrophobicContact CE1-CE1 3.65Å; Y91-Y136 HydrophobicContact CG-CE1 4.3Å; N97-Y136 HydrophobicContact CB-CE2 4.22Å; F134-Y136 VanDerWaalsContact CZ-CB 3.44Å; F134-Y136 HydrophobicContact CZ-CG 4.32Å; Y136-L138 PolarHBondContact O-N 3.5Å; Y136-S139 PolarHBondContact N-O 3.36Å; Y136-S139 VanDerWaalsContact N-O 3.15Å; Y136-S139 PolarHBondContact O-N 2.56Å; Y136-S139 VanDerWaalsContact O-N 3.08Å
137	G	82.5	Confident	90.2	Very high	64 Å²	64	56.8 Å²	56.8	66%	0.66	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.4	-119.9	-178.7	0	0	0	0	0	112.1
138	L	83.4	Confident	90.2	Very high	116 Å²	116	54.6 Å²	54.6	61%	0.607	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91	-7.9	178.7	-71.5	168.7	0	0	0	113.2	V84 Y136	V84-L138 HydrophobicContact CG1-CB 3.68Å; Y136-L138 PolarHBondContact O-N 3.5Å
139	S	85	Confident	90.1	Very high	4 Å²	4	54.6 Å²	54.6	3%	0.028	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	138.4	-173.8	-47.2	0	0	0	0	110.9	V84 D85 S88 S135 Y136	V84-S139 PolarHBondContact O-OG 3.28Å; D85-S139 WeakPolarHBondContact CA-OG 3.41Å; D85-S139 WeakPolarHBondContact OD1-CB 3.27Å; D85-S139 PolarHBondContact OD1-OG 3.41Å; S88-S139 WeakPolarHBondContact CB-OG 3.37Å; S88-S139 PolarHBondContact OG-OG 2.85Å; S135-S139 WeakPolarHBondContact CA-O 3.29Å; Y136-S139 PolarHBondContact N-O 3.36Å; Y136-S139 VanDerWaalsContact N-O 3.15Å; Y136-S139 PolarHBondContact O-N 2.56Å; Y136-S139 VanDerWaalsContact O-N 3.08Å
140	Q	86.5	Confident	90	Very high	160 Å²	160	53 Å²	53	75%	0.748	29%	0.288	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.7	132.9	178.8	-66.2	-174.7	-19.2	0	0	109.5	V142	Q140-V142 PolarHBondContact O-N 2.81Å
141	H	88	Confident	89.7	Confident	131 Å²	131	47.1 Å²	47.1	61%	0.606	26%	0.257	S	S	*	.	E	Extended strand (participates in β ladder)	trans	54.4	47	175	-56.6	-61	0	0	0	114.3	D133 F134 S135	D133-H141 WeakPolarHBondContact OD1-CA 3.2Å; D133-H141 IonicContact OD1-CE1 3.89Å; D133-H141 IonicContact OD1-CG 3.11Å; D133-H141 IonicContact OD1-ND1 2.88Å; D133-H141 PolarHBondContact OD1-ND1 3.48Å; D133-H141 IonicContact OD2-CE1 3.38Å; D133-H141 IonicContact OD2-ND1 2.78Å; F134-H141 PolarHBondContact O-N 3.02Å; S135-H141 PolarHBondContact OG-N 2.95Å
142	V	90.5	Very high	89.2	Confident	7 Å²	7	51.3 Å²	51.3	4%	0.042	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	131.3	179.6	-173.8	0	0	0	0	110.7	D85 W103 F134 Q140 P174	D85-V142 HydrophobicContact CB-CG1 4.25Å; D85-V142 HydrophobicContact CB-CG2 4.31Å; D85-V142 WeakPolarHBondContact OD1-CG2 3.46Å; W103-V142 HydrophobicContact CH2-CG1 3.83Å; W103-V142 HydrophobicContact CZ2-CB 4.48Å; W103-V142 HydrophobicContact CZ2-CG1 4Å; F134-V142 HydrophobicContact CB-CB 4.16Å; F134-V142 HydrophobicContact CD1-CB 4.08Å; F134-V142 HydrophobicContact CD1-CG2 4.26Å; F134-V142 PolarHBondContact N-O 2.99Å; F134-V142 PolarHBondContact O-N 3.32Å; Q140-V142 PolarHBondContact O-N 2.81Å; V142-P174 HydrophobicContact CG1-CB 3.75Å; V142-P174 HydrophobicContact CG1-CG 4.26Å
143	Q	92.2	Very high	88.4	Confident	104 Å²	104	50.1 Å²	50.1	49%	0.486	27%	0.265	S	S	.	.	P	Polyproline II helix	trans	-101.6	143.4	175.8	-64.9	-177.9	-7.8	0	0	111.8	I131 T132 P174 H175	I131-Q143 CarbonylContact O-C 3.32Å; I131-Q143 VanDerWaalsContact O-CA 3.31Å; I131-Q143 WeakPolarHBondContact O-CA 3.4Å; T132-Q143 WeakPolarHBondContact O-CG 3.32Å; Q143-P174 CarbonylContact O-C 3.43Å; Q143-H175 HydrophobicContact CB-CB 4.25Å; Q143-H175 PolarHBondContact O-N 3.4Å
144	G	93.2	Very high	87.3	Confident	13 Å²	13	49.7 Å²	49.7	13%	0.134	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	141	175.8	0	0	0	0	0	113	C128 I131	C128-G144 WeakPolarHBondContact O-CA 3.38Å; I131-G144 PolarHBondContact O-N 3.43Å
145	K	92.9	Very high	85.7	Confident	54 Å²	54	52.5 Å²	52.5	24%	0.235	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	123.5	177.2	179.1	177.8	177.5	179.1	0	108.9	I173	K145-I173 WeakPolarHBondContact CA-O 3.27Å; K145-I173 HydrophobicContact CB-CG1 4.26Å; K145-I173 WeakPolarHBondContact CB-O 3.27Å; K145-I173 PolarHBondContact N-O 3.14Å; K145-I173 WeakPolarHBondContact O-CG1 3.29Å; K145-I173 PolarHBondContact O-N 3.4Å
146	Y	94.5	Very high	83.8	Confident	1 Å²	1	52.3 Å²	52.3	0%	0.004	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	134	-177.4	-177.4	-96.3	0	0	0	111.3	L122 M125 C128 G170 H215 P479	L122-Y146 VanDerWaalsContact O-CE2 3.22Å; L122-Y146 WeakPolarHBondContact O-CE2 3.37Å; L122-Y146 VanDerWaalsContact O-CZ 3.31Å; L122-Y146 PolarHBondContact O-OH 3.32Å; M125-Y146 HydrophobicContact CB-CD1 3.9Å; M125-Y146 HydrophobicContact CB-CD2 3.86Å; M125-Y146 HydrophobicContact CB-CE1 4.04Å; M125-Y146 HydrophobicContact CB-CE2 3.96Å; M125-Y146 HydrophobicContact CB-CG 3.82Å; M125-Y146 HydrophobicContact CE-CD1 4.34Å; M125-Y146 HydrophobicContact CG-CD1 3.6Å; M125-Y146 HydrophobicContact CG-CD2 4.2Å; M125-Y146 HydrophobicContact CG-CE1 4.13Å; M125-Y146 HydrophobicContact CG-CG 3.64Å; M125-Y146 HydrophobicContact SD-CD1 3.74Å; M125-Y146 HydrophobicContact SD-CE1 4.03Å; M125-Y146 HydrophobicContact SD-CG 4.4Å; C128-Y146 HydrophobicContact CB-CD2 4.28Å; Y146-G170 WeakPolarHBondContact OH-CA 3.41Å; Y146-H215 HydrophobicContact CD1-CB 4.24Å; Y146-H215 AromaticContact CD1-CD2 3.39Å; Y146-H215 WeakPolarHBondContact CD1-CD2 3.15Å; Y146-H215 AromaticContact CD1-CG 3.88Å; Y146-H215 AromaticContact CD1-NE2 3.94Å; Y146-H215 AromaticContact CE1-CD2 3.66Å; Y146-H215 AromaticContact CE1-NE2 3.71Å; Y146-H215 PolarHBondContact O-N 3.2Å; Y146-P479 HydrophobicContact CE1-CB 3.8Å; Y146-P479 WeakPolarHBondContact OH-CB 3.23Å
147	C	94	Very high	81.7	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	147.5	178.1	-52.3	0	0	0	0	111.5	G170 V171 I173 L182 F213 C214	C147-G170 CarbonylContact O-C 3.47Å; C147-G170 WeakPolarHBondContact O-CA 3.34Å; C147-V171 PolarHBondContact N-O 2.89Å; C147-V171 PolarHBondContact O-N 2.95Å; C147-I173 WeakPolarHBondContact SG-CD1 3.22Å; C147-L182 HydrophobicContact CB-CD2 3.36Å; C147-F213 CarbonylContact C-O 3.35Å; C147-F213 WeakPolarHBondContact CA-O 3.39Å; C147-F213 WeakPolarHBondContact CB-O 3.48Å; C147-C214 HydrophobicContact CB-CB 3.96Å; C147-C214 WeakPolarHBondContact CB-SG 3.18Å; C147-C214 VanDerWaalsContact SG-CA 3.59Å; C147-C214 WeakPolarHBondContact SG-CB 3.45Å; C147-C214 CovalentContact SG-SG 2.04Å; C147-C214 PolarHBondContact SG-SG 2.94Å
148	S	93.5	Very high	79.9	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	117	173.4	-63.4	0	0	0	0	108.9	S212 F213 H215 P479	S148-S212 WeakPolarHBondContact O-CA 3.45Å; S148-F213 PolarHBondContact N-O 3.04Å; S148-F213 PolarHBondContact O-N 3.19Å; S148-H215 PolarHBondContact OG-NE2 3.08Å; S148-P479 PolarHBondContact OG-O 3.06Å
149	A	92	Very high	78.1	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	126	175.8	0	0	0	0	0	109.8	Y169 L186 I207 S212	A149-Y169 PolarHBondContact N-O 3.41Å; A149-Y169 PolarHBondContact O-N 3.23Å; A149-L186 HydrophobicContact CB-CD1 3.41Å; A149-L186 VanDerWaalsContact CB-CD1 3.41Å; A149-I207 HydrophobicContact CB-CG2 4.35Å; A149-S212 WeakPolarHBondContact CA-OG 3.22Å
150	Y	90.3	Very high	75.9	Confident	34 Å²	34	62.2 Å²	62.2	13%	0.133	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	128.6	179.4	-69.2	-93.6	0	0	0	109.7	E166 L167 N168 I207 D208 T211 S212 F213	Y150-E166 HydrophobicContact CD1-CB 4.08Å; Y150-L167 CarbonylContact C-O 3.55Å; Y150-L167 VanDerWaalsContact CA-O 3.27Å; Y150-L167 WeakPolarHBondContact CA-O 3.22Å; Y150-N168 HydrophobicContact CD1-CB 3.99Å; Y150-N168 HydrophobicContact CE1-CB 3.64Å; Y150-I207 CarbonylContact O-C 3.07Å; Y150-I207 WeakPolarHBondContact O-CA 3.26Å; Y150-D208 PolarHBondContact O-N 3.49Å; Y150-T211 VanDerWaalsContact CB-OG1 3.25Å; Y150-T211 WeakPolarHBondContact CB-OG1 3.26Å; Y150-T211 VanDerWaalsContact CD2-O 3.22Å; Y150-T211 WeakPolarHBondContact CD2-O 3.23Å; Y150-T211 WeakPolarHBondContact CE2-O 3.38Å; Y150-S212 PolarHBondContact N-OG 3.23Å; Y150-F213 HydrophobicContact CE2-CD1 4.21Å; Y150-F213 AromaticContact CE2-CE1 3.97Å; Y150-F213 HydrophobicContact CE2-CE1 3.97Å
151	A	86.6	Confident	73.5	Confident	2 Å²	2	63.7 Å²	63.7	2%	0.017	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	129.6	177	0	0	0	0	0	110.4	L153 E166 L167 L205 S206 I207	A151-L153 PolarHBondContact O-N 3.16Å; A151-E166 CarbonylContact O-C 3.53Å; A151-E166 WeakPolarHBondContact O-CA 3.24Å; A151-L167 HydrophobicContact CB-CB 4.24Å; A151-L167 HydrophobicContact CB-CD2 4.49Å; A151-L167 PolarHBondContact N-O 3.33Å; A151-L167 PolarHBondContact O-N 2.99Å; A151-L205 HydrophobicContact CB-CD2 3.63Å; A151-L205 HydrophobicContact CB-CG 3.97Å; A151-S206 WeakPolarHBondContact CA-O 3.33Å; A151-I207 HydrophobicContact CB-CD1 3.79Å
152	K	81.1	Confident	71.1	Confident	94 Å²	94	63 Å²	63	41%	0.409	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	122.7	176.2	-75.3	-179.7	174	155.6	0	109.9	E166 S206 D208	K152-E166 HydrophobicContact CG-CG 4.48Å; K152-S206 PolarHBondContact N-O 2.96Å; K152-S206 VanDerWaalsContact N-O 3.16Å; K152-D208 WeakPolarHBondContact CE-OD2 3.37Å; K152-D208 HydrophobicContact CG-CB 4.47Å; K152-D208 IonicContact NZ-OD2 2.67Å; K152-D208 PolarHBondContact NZ-OD2 3.17Å
153	L	74.5	Confident	68.9	Low	58 Å²	58	68.2 Å²	68.2	30%	0.304	38%	0.384	S	S	.	.	P	Polyproline II helix	trans	-83.1	137	170.5	-64.7	166.6	0	0	0	109.1	I119 A151 S155 F165 L167 L205	I119-L153 HydrophobicContact CG2-CD1 4.13Å; A151-L153 PolarHBondContact O-N 3.16Å; L153-S155 PolarHBondContact O-N 3.5Å; L153-F165 VanDerWaalsContact CB-O 3.3Å; L153-F165 WeakPolarHBondContact CB-O 3.43Å; L153-F165 HydrophobicContact CD1-CB 3.85Å; L153-F165 PolarHBondContact N-O 3.22Å; L153-F165 VanDerWaalsContact N-O 3.15Å; L153-L167 HydrophobicContact CD1-CB 4.47Å; L153-L167 HydrophobicContact CD2-CB 4.47Å; L153-L167 HydrophobicContact CG-CB 4.4Å; L153-L205 HydrophobicContact CD2-CD1 3.85Å
154	P	65.4	Low	66.9	Low	81 Å²	81	67.4 Å²	67.4	53%	0.526	39%	0.39	S	S	.	.	P	Polyproline II helix	trans	-62.7	125.2	173.3	23.9	-30.3	0	0	0	109.4	A156 V203	P154-A156 PolarHBondContact O-N 2.99Å; P154-V203 HydrophobicContact CG-CG1 4.06Å
155	S	56.6	Low	65.7	Low	60 Å²	60	69 Å²	69	42%	0.42	39%	0.393	S	S	.	.	P	Polyproline II helix	trans	-64.2	130.6	168.2	-154.4	0	0	0	0	108.1	L153 G157	L153-S155 PolarHBondContact O-N 3.5Å; S155-G157 PolarHBondContact O-N 3.3Å
156	A	51.3	Low	65.2	Low	62 Å²	62	68.6 Å²	68.6	51%	0.512	39%	0.392	S	S	.	.	P	Polyproline II helix	trans	-57.5	134.2	165	0	0	0	0	0	107.6	P154 D158 L159	P154-A156 PolarHBondContact O-N 2.99Å; A156-D158 PolarHBondContact O-N 2.94Å; A156-L159 HydrophobicContact CB-CD1 4.24Å; A156-L159 PolarHBondContact O-N 2.93Å
157	G	42.4	Very low	64.8	Low	85 Å²	85	69.3 Å²	69.3	88%	0.876	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-12.5	-171.6	0	0	0	0	0	115.9	S155	S155-G157 PolarHBondContact O-N 3.3Å
158	D	45.1	Very low	64.6	Low	164 Å²	164	69.3 Å²	69.3	88%	0.877	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.6	-0.9	178.4	-62.1	-36.8	0	0	0	114.3	A156	A156-D158 PolarHBondContact O-N 2.94Å
159	L	44.7	Very low	64.6	Low	96 Å²	96	72.3 Å²	72.3	50%	0.503	41%	0.407	S	S	.	.	S	Bend	trans	-89.8	126.8	176.1	-75.3	166.3	0	0	0	110.3	A156 E161	A156-L159 HydrophobicContact CB-CD1 4.24Å; A156-L159 PolarHBondContact O-N 2.93Å; L159-E161 PolarHBondContact O-N 2.83Å
160	P	38.3	Very low	64.6	Low	100 Å²	100	72.3 Å²	72.3	65%	0.649	41%	0.407	S	S	*	.			trans	-54.4	129.1	178.7	19.9	-30	0	0	0	110	K162	P160-K162 PolarHBondContact O-N 3.19Å
161	E	36.2	Very low	64.7	Low	191 Å²	191	71.4 Å²	71.4	89%	0.893	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	26.9	-155.8	-131.6	174.9	-168.2	0	0	118.1	L159	L159-E161 PolarHBondContact O-N 2.83Å
162	K	38.1	Very low	65.1	Low	118 Å²	118	72 Å²	72	51%	0.513	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-139.4	8.4	-173	-85.5	-170.7	177.7	-172.4	0	116.7	P160 D509 L575	P160-K162 PolarHBondContact O-N 3.19Å; K162-D509 IonicContact NZ-OD1 3.35Å; K162-L575 HydrophobicContact CB-CB 4.45Å; K162-L575 HydrophobicContact CB-CD2 4.11Å; K162-L575 HydrophobicContact CD-CD2 4.19Å
163	M	44.5	Very low	65.6	Low	115 Å²	115	67.8 Å²	67.8	57%	0.567	39%	0.391	S	S	*	.			trans	-105.7	72.5	166.9	-152.9	173.4	-70	0	0	109.1	F165	M163-F165 HydrophobicContact CB-CE2 4.43Å; M163-F165 HydrophobicContact CG-CE1 4.19Å; M163-F165 HydrophobicContact CG-CE2 4.04Å; M163-F165 HydrophobicContact CG-CZ 3.77Å; M163-F165 PolarHBondContact O-N 2.94Å; M163-F165 VanDerWaalsContact O-N 3.14Å; M163-F165 HydrophobicContact SD-CE1 4.13Å; M163-F165 HydrophobicContact SD-CE2 4.17Å; M163-F165 HydrophobicContact SD-CZ 3.51Å; M163-F165 VanDerWaalsContact SD-CZ 3.51Å
164	S	50.9	Low	66.5	Low	88 Å²	88	65.1 Å²	65.1	62%	0.615	38%	0.377	S	S	*	.			trans	-71.3	104.9	171.6	52.9	0	0	0	0	108.5	E166	S164-E166 PolarHBondContact O-N 3.01Å
165	F	68	Low	67.8	Low	46 Å²	46	66.3 Å²	66.3	20%	0.202	38%	0.376	C	S	.	.	P	Polyproline II helix	trans	-74.6	121.6	168.2	-64.1	-77.3	0	0	0	108.4	I119 L153 M163 M391 L392	I119-F165 HydrophobicContact CD1-CB 4.07Å; I119-F165 HydrophobicContact CD1-CD1 3.96Å; I119-F165 HydrophobicContact CD1-CG 4.46Å; L153-F165 VanDerWaalsContact CB-O 3.3Å; L153-F165 WeakPolarHBondContact CB-O 3.43Å; L153-F165 HydrophobicContact CD1-CB 3.85Å; L153-F165 PolarHBondContact N-O 3.22Å; L153-F165 VanDerWaalsContact N-O 3.15Å; M163-F165 HydrophobicContact CB-CE2 4.43Å; M163-F165 HydrophobicContact CG-CE1 4.19Å; M163-F165 HydrophobicContact CG-CE2 4.04Å; M163-F165 HydrophobicContact CG-CZ 3.77Å; M163-F165 PolarHBondContact O-N 2.94Å; M163-F165 VanDerWaalsContact O-N 3.14Å; M163-F165 HydrophobicContact SD-CE1 4.13Å; M163-F165 HydrophobicContact SD-CE2 4.17Å; M163-F165 HydrophobicContact SD-CZ 3.51Å; M163-F165 VanDerWaalsContact SD-CZ 3.51Å; F165-M391 HydrophobicContact CD1-CE 4.35Å; F165-M391 HydrophobicContact CE1-CE 3.69Å; F165-L392 HydrophobicContact CE1-CD1 4.07Å; F165-L392 HydrophobicContact CZ-CD1 4.22Å; F165-L392 HydrophobicContact CZ-CD2 4.17Å; F165-L392 HydrophobicContact CZ-CG 4.4Å
166	E	80.5	Confident	69.4	Low	45 Å²	45	66 Å²	66	21%	0.21	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	125.9	170.9	-63.6	-169	165.5	0	0	108.9	Y150 A151 K152 S164 N168 T211	Y150-E166 HydrophobicContact CD1-CB 4.08Å; A151-E166 CarbonylContact O-C 3.53Å; A151-E166 WeakPolarHBondContact O-CA 3.24Å; K152-E166 HydrophobicContact CG-CG 4.48Å; S164-E166 PolarHBondContact O-N 3.01Å; E166-N168 PolarHBondContact O-N 2.92Å; E166-T211 PolarHBondContact OE2-OG1 3.37Å
167	L	87.1	Confident	71.2	Confident	17 Å²	17	63.1 Å²	63.1	9%	0.089	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	117.9	171	177	78.3	0	0	0	108.1	I119 W121 Y150 A151 L153	I119-L167 HydrophobicContact CB-CD1 4.18Å; I119-L167 VanDerWaalsContact O-CD1 3.28Å; I119-L167 WeakPolarHBondContact O-CD1 3.47Å; W121-L167 HydrophobicContact CD2-CD1 3.8Å; W121-L167 HydrophobicContact CE3-CD1 3.99Å; W121-L167 HydrophobicContact CE3-CD2 4.1Å; W121-L167 HydrophobicContact CE3-CG 4.44Å; W121-L167 HydrophobicContact CG-CD1 4.4Å; W121-L167 HydrophobicContact CH2-CD1 3.92Å; W121-L167 HydrophobicContact CH2-CD2 4.11Å; W121-L167 HydrophobicContact CZ2-CD1 3.73Å; W121-L167 HydrophobicContact CZ3-CD1 4.05Å; W121-L167 HydrophobicContact CZ3-CD2 3.76Å; W121-L167 HydrophobicContact CZ3-CG 4.47Å; Y150-L167 CarbonylContact C-O 3.55Å; Y150-L167 VanDerWaalsContact CA-O 3.27Å; Y150-L167 WeakPolarHBondContact CA-O 3.22Å; A151-L167 HydrophobicContact CB-CB 4.24Å; A151-L167 HydrophobicContact CB-CD2 4.49Å; A151-L167 PolarHBondContact N-O 3.33Å; A151-L167 PolarHBondContact O-N 2.99Å; L153-L167 HydrophobicContact CD1-CB 4.47Å; L153-L167 HydrophobicContact CD2-CB 4.47Å; L153-L167 HydrophobicContact CG-CB 4.4Å
168	N	90.3	Very high	73.5	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	110.5	175.2	-179.9	5.2	0	0	0	109.7	I119 N120 W121 L122 Y150 E166 M480	I119-N168 PolarHBondContact O-N 3.29Å; N120-N168 WeakPolarHBondContact OD1-CB 2.88Å; W121-N168 PolarHBondContact N-O 3.43Å; L122-N168 WeakPolarHBondContact CD2-ND2 3.33Å; Y150-N168 HydrophobicContact CD1-CB 3.99Å; Y150-N168 HydrophobicContact CE1-CB 3.64Å; E166-N168 PolarHBondContact O-N 2.92Å; N168-M480 PolarHBondContact ND2-SD 3.19Å
169	Y	91.8	Very high	75.6	Confident	62 Å²	62	57.5 Å²	57.5	24%	0.243	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	112.4	-178.5	-175.4	-125.4	0	0	0	111.1	G108 W121 A149 V171 L186	G108-Y169 VanDerWaalsContact O-CE2 3.29Å; G108-Y169 WeakPolarHBondContact O-CE2 3.44Å; W121-Y169 HydrophobicContact CB-CD2 4.16Å; W121-Y169 HydrophobicContact CE3-CD2 4.12Å; A149-Y169 PolarHBondContact N-O 3.41Å; A149-Y169 PolarHBondContact O-N 3.23Å; Y169-V171 HydrophobicContact CD1-CG2 3.29Å; Y169-V171 HydrophobicContact CE1-CG2 3.22Å; Y169-V171 HydrophobicContact CG-CG2 4.18Å; Y169-L186 HydrophobicContact CD1-CD1 4.4Å; Y169-L186 HydrophobicContact CD1-CD2 4.15Å; Y169-L186 HydrophobicContact CE1-CD2 3.88Å
170	G	93.8	Very high	77.7	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	131	174.6	0	0	0	0	0	111.7	G108 W121 L122 Y146 C147	G108-G170 WeakPolarHBondContact CA-O 3.31Å; G108-G170 PolarHBondContact N-O 2.89Å; W121-G170 PolarHBondContact O-N 2.95Å; L122-G170 WeakPolarHBondContact O-CA 3.31Å; Y146-G170 WeakPolarHBondContact OH-CA 3.41Å; C147-G170 CarbonylContact O-C 3.47Å; C147-G170 WeakPolarHBondContact O-CA 3.34Å
171	V	92	Very high	80.1	Confident	16 Å²	16	51 Å²	51	10%	0.097	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	136.5	-178.1	-169.7	0	0	0	0	109.9	C147 Y169 I173 L182 L186	C147-V171 PolarHBondContact N-O 2.89Å; C147-V171 PolarHBondContact O-N 2.95Å; Y169-V171 HydrophobicContact CD1-CG2 3.29Å; Y169-V171 HydrophobicContact CE1-CG2 3.22Å; Y169-V171 HydrophobicContact CG-CG2 4.18Å; V171-I173 HydrophobicContact CG1-CG2 3.91Å; V171-L182 HydrophobicContact CB-CD1 3.94Å; V171-L182 HydrophobicContact CG1-CD1 3.82Å; V171-L182 HydrophobicContact CG2-CD1 4.16Å; V171-L186 HydrophobicContact CG2-CD1 4.42Å; V171-L186 HydrophobicContact CG2-CD2 4.45Å
172	C	94.1	Very high	82.5	Confident	13 Å²	13	42.1 Å²	42.1	9%	0.088	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	116.1	169.8	-167	0	0	0	0	109.8	W103 A106 C128	W103-C172 HydrophobicContact CE3-CB 4.44Å; A106-C172 HydrophobicContact CB-CB 3.92Å; C128-C172 WeakPolarHBondContact CA-SG 3.39Å; C128-C172 HydrophobicContact CB-CB 3.7Å; C128-C172 WeakPolarHBondContact CB-SG 3.5Å; C128-C172 WeakPolarHBondContact SG-CA 3.35Å; C128-C172 WeakPolarHBondContact SG-CB 3.23Å; C128-C172 CovalentContact SG-SG 2.04Å; C128-C172 PolarHBondContact SG-SG 3.02Å
173	I	92.8	Very high	84.9	Confident	6 Å²	6	37.5 Å²	37.5	3%	0.031	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	156.8	178.1	63.6	174.9	0	0	0	111	K145 C147 V171 C177 L182	K145-I173 WeakPolarHBondContact CA-O 3.27Å; K145-I173 HydrophobicContact CB-CG1 4.26Å; K145-I173 WeakPolarHBondContact CB-O 3.27Å; K145-I173 PolarHBondContact N-O 3.14Å; K145-I173 WeakPolarHBondContact O-CG1 3.29Å; K145-I173 PolarHBondContact O-N 3.4Å; C147-I173 WeakPolarHBondContact SG-CD1 3.22Å; V171-I173 HydrophobicContact CG1-CG2 3.91Å; I173-C177 HydrophobicContact CB-CB 4.29Å; I173-C177 HydrophobicContact CD1-CB 3.89Å; I173-C177 HydrophobicContact CG1-CB 4.34Å; I173-L182 HydrophobicContact CD1-CB 4.06Å; I173-L182 HydrophobicContact CD1-CD2 4.48Å; I173-L182 HydrophobicContact CG2-CB 4.41Å; I173-L182 HydrophobicContact CG2-CD1 3.75Å; I173-L182 HydrophobicContact CG2-CG 4.49Å
174	P	93.5	Very high	86.7	Confident	2 Å²	2	34.7 Å²	34.7	1%	0.013	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.8	147.6	169.9	-28.4	36.9	0	0	0	112.8	D85 V86 I89 W103 V142 Q143 T176 C177	D85-P174 HydrophobicContact CB-CB 3.8Å; D85-P174 HydrophobicContact CB-CG 3.62Å; V86-P174 HydrophobicContact CG2-CG 4.04Å; I89-P174 HydrophobicContact CD1-CG 3.58Å; W103-P174 HydrophobicContact CH2-CG 4.29Å; W103-P174 HydrophobicContact CZ3-CG 4.22Å; V142-P174 HydrophobicContact CG1-CB 3.75Å; V142-P174 HydrophobicContact CG1-CG 4.26Å; Q143-P174 CarbonylContact O-C 3.43Å; P174-T176 WeakPolarHBondContact CB-OG1 3.48Å; P174-T176 PolarHBondContact O-N 3.2Å; P174-C177 WeakPolarHBondContact O-CB 3.25Å; P174-C177 PolarHBondContact O-N 2.88Å
175	H	91.7	Very high	88.2	Confident	107 Å²	107	32.8 Å²	32.8	50%	0.495	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-23.8	174	-164.8	-71.9	0	0	0	112.8	Q143 C177	Q143-H175 HydrophobicContact CB-CB 4.25Å; Q143-H175 PolarHBondContact O-N 3.4Å; H175-C177 PolarHBondContact O-N 3.29Å
176	T	89.5	Confident	89	Confident	53 Å²	53	32.1 Å²	32.1	33%	0.325	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-18.8	172.3	54.1	0	0	0	0	112.9	N79 A81 D85 P174	N79-T176 PolarHBondContact ND2-O 3.25Å; A81-T176 HydrophobicContact CB-CG2 4.15Å; D85-T176 WeakPolarHBondContact OD2-CB 3.48Å; D85-T176 WeakPolarHBondContact OD2-CG2 3.13Å; D85-T176 PolarHBondContact OD2-OG1 3.45Å; P174-T176 WeakPolarHBondContact CB-OG1 3.48Å; P174-T176 PolarHBondContact O-N 3.2Å
177	C	90.2	Very high	89.1	Confident	1 Å²	1	33.2 Å²	33.2	1%	0.007	17%	0.168	C	C	.	.			trans	-88.5	140.9	177.9	-60.9	0	0	0	0	112.6	C82 I173 P174 H175 D181	C82-C177 VanDerWaalsContact CA-SG 3.58Å; C82-C177 HydrophobicContact CB-CB 3.98Å; C82-C177 WeakPolarHBondContact CB-SG 3.39Å; C82-C177 VanDerWaalsContact SG-CA 3.55Å; C82-C177 WeakPolarHBondContact SG-CB 3.33Å; C82-C177 CovalentContact SG-SG 2.04Å; C82-C177 PolarHBondContact SG-SG 2.92Å; I173-C177 HydrophobicContact CB-CB 4.29Å; I173-C177 HydrophobicContact CD1-CB 3.89Å; I173-C177 HydrophobicContact CG1-CB 4.34Å; P174-C177 WeakPolarHBondContact O-CB 3.25Å; P174-C177 PolarHBondContact O-N 2.88Å; H175-C177 PolarHBondContact O-N 3.29Å; C177-D181 HydrophobicContact CB-CB 4.3Å
178	T	90.1	Very high	88.4	Confident	64 Å²	64	35 Å²	35	39%	0.393	18%	0.176	S	C	.	.			trans	-91.7	170.8	174	70	0	0	0	0	111.6	D180 D181 L182	T178-D180 PolarHBondContact O-N 2.88Å; T178-D180 PolarHBondContact OG1-N 3.48Å; T178-D181 WeakPolarHBondContact CB-OD2 2.97Å; T178-D181 PolarHBondContact N-OD2 2.94Å; T178-D181 PolarHBondContact O-N 3.33Å; T178-D181 PolarHBondContact OG1-N 3.43Å; T178-D181 PolarHBondContact OG1-OD2 3.39Å; T178-L182 PolarHBondContact O-N 2.91Å; T178-L182 VanDerWaalsContact O-N 3.16Å
179	K	89.3	Confident	87.6	Confident	67 Å²	67	36.3 Å²	36.3	29%	0.291	19%	0.189	S	C	.	.	H	α-helix	trans	-57.3	-41.1	171.8	-174.8	-171.4	73.4	161.7	0	111.6	L182 I183 K209 S212	K179-L182 WeakPolarHBondContact O-CB 3.45Å; K179-L182 PolarHBondContact O-N 2.86Å; K179-I183 HydrophobicContact CD-CD1 4.24Å; K179-I183 HydrophobicContact CG-CD1 3.96Å; K179-I183 WeakPolarHBondContact O-CG1 3.28Å; K179-I183 PolarHBondContact O-N 3.45Å; K179-K209 PolarHBondContact NZ-O 3.03Å; K179-S212 VanDerWaalsContact CD-O 3.22Å; K179-S212 WeakPolarHBondContact CD-O 3.44Å
180	D	89.6	Confident	86.9	Confident	58 Å²	58	35.9 Å²	35.9	31%	0.31	19%	0.191	S	C	.	.	H	α-helix	trans	-70.9	-35.7	-176.1	-71.7	-15	0	0	0	111.1	T178 L182 I183 W184 K209	T178-D180 PolarHBondContact O-N 2.88Å; T178-D180 PolarHBondContact OG1-N 3.48Å; D180-L182 VanDerWaalsContact C-N 3.35Å; D180-L182 PolarHBondContact O-N 3.24Å; D180-I183 PolarHBondContact O-N 2.85Å; D180-W184 WeakPolarHBondContact O-CB 3.37Å; D180-W184 PolarHBondContact O-N 2.96Å; D180-K209 WeakPolarHBondContact OD1-CE 3.39Å; D180-K209 IonicContact OD1-NZ 2.78Å; D180-K209 PolarHBondContact OD1-NZ 3.18Å; D180-K209 IonicContact OD2-NZ 2.72Å; D180-K209 PolarHBondContact OD2-NZ 3.48Å
181	D	87.3	Confident	85.8	Confident	3 Å²	3	37.7 Å²	37.7	2%	0.016	20%	0.204	C	C	.	.	H	α-helix	trans	-59.7	-44.3	171.1	-61.7	-37.3	0	0	0	111.3	L76 N79 C177 T178 W184 L185	L76-D181 HydrophobicContact CD1-CB 3.65Å; N79-D181 PolarHBondContact ND2-OD2 3.25Å; N79-D181 VanDerWaalsContact ND2-OD2 3.16Å; C177-D181 HydrophobicContact CB-CB 4.3Å; T178-D181 WeakPolarHBondContact CB-OD2 2.97Å; T178-D181 PolarHBondContact N-OD2 2.94Å; T178-D181 PolarHBondContact O-N 3.33Å; T178-D181 PolarHBondContact OG1-N 3.43Å; T178-D181 PolarHBondContact OG1-OD2 3.39Å; D181-W184 PolarHBondContact O-N 2.86Å; D181-L185 VanDerWaalsContact O-CG 3.3Å; D181-L185 WeakPolarHBondContact O-CG 3.41Å; D181-L185 PolarHBondContact O-N 3.35Å
182	L	87.8	Confident	84.7	Confident	3 Å²	3	39.4 Å²	39.4	2%	0.016	21%	0.212	C	C	.	.	H	α-helix	trans	-61.7	-49.7	175.9	167.7	65.6	0	0	0	112.4	C147 V171 I173 T178 K179 D180 W184 L185 L186	C147-L182 HydrophobicContact CB-CD2 3.36Å; V171-L182 HydrophobicContact CB-CD1 3.94Å; V171-L182 HydrophobicContact CG1-CD1 3.82Å; V171-L182 HydrophobicContact CG2-CD1 4.16Å; I173-L182 HydrophobicContact CD1-CB 4.06Å; I173-L182 HydrophobicContact CD1-CD2 4.48Å; I173-L182 HydrophobicContact CG2-CB 4.41Å; I173-L182 HydrophobicContact CG2-CD1 3.75Å; I173-L182 HydrophobicContact CG2-CG 4.49Å; T178-L182 PolarHBondContact O-N 2.91Å; T178-L182 VanDerWaalsContact O-N 3.16Å; K179-L182 WeakPolarHBondContact O-CB 3.45Å; K179-L182 PolarHBondContact O-N 2.86Å; D180-L182 VanDerWaalsContact C-N 3.35Å; D180-L182 PolarHBondContact O-N 3.24Å; L182-W184 PolarHBondContact O-N 2.96Å; L182-L185 PolarHBondContact O-N 2.69Å; L182-L185 VanDerWaalsContact O-N 3.16Å; L182-L186 HydrophobicContact CD1-CD1 3.83Å; L182-L186 HydrophobicContact CD1-CG 3.93Å; L182-L186 HydrophobicContact CG-CD1 4.16Å; L182-L186 WeakPolarHBondContact O-CG 3.45Å; L182-L186 PolarHBondContact O-N 3.46Å
183	I	87.8	Confident	83.4	Confident	22 Å²	22	46 Å²	46	11%	0.113	24%	0.239	C	C	.	.	H	α-helix	trans	-58.5	-42.6	-179.3	-69	163.8	0	0	0	109.8	K179 D180 L186 D187 I207 K209	K179-I183 HydrophobicContact CD-CD1 4.24Å; K179-I183 HydrophobicContact CG-CD1 3.96Å; K179-I183 WeakPolarHBondContact O-CG1 3.28Å; K179-I183 PolarHBondContact O-N 3.45Å; D180-I183 PolarHBondContact O-N 2.85Å; I183-L186 PolarHBondContact O-N 3.22Å; I183-D187 WeakPolarHBondContact O-CB 3.35Å; I183-D187 PolarHBondContact O-N 3.44Å; I183-I207 HydrophobicContact CG1-CG2 4.06Å; I183-I207 HydrophobicContact CG2-CB 4.29Å; I183-I207 HydrophobicContact CG2-CG2 4.21Å; I183-K209 HydrophobicContact CD1-CB 3.82Å; I183-K209 HydrophobicContact CD1-CD 4.24Å; I183-K209 HydrophobicContact CD1-CG 3.66Å
184	W	82.6	Confident	82.1	Confident	56 Å²	56	51.3 Å²	51.3	21%	0.212	26%	0.259	C	S	.	.	H	α-helix	trans	-62.4	-46.9	176.1	-178.4	91.2	0	0	0	112.2	L76 D180 D181 L182 L186 D187 M188	L76-W184 HydrophobicContact CB-CD2 4.38Å; L76-W184 HydrophobicContact CB-CE3 4.22Å; L76-W184 HydrophobicContact CB-CZ3 4.49Å; L76-W184 HydrophobicContact CD1-CE3 4.26Å; L76-W184 HydrophobicContact CD2-CE3 3.78Å; L76-W184 HydrophobicContact CD2-CH2 3.86Å; L76-W184 HydrophobicContact CD2-CZ3 3.38Å; L76-W184 HydrophobicContact CG-CE3 4.32Å; L76-W184 HydrophobicContact CG-CZ3 4.37Å; D180-W184 WeakPolarHBondContact O-CB 3.37Å; D180-W184 PolarHBondContact O-N 2.96Å; D181-W184 PolarHBondContact O-N 2.86Å; L182-W184 PolarHBondContact O-N 2.96Å; W184-L186 VanDerWaalsContact C-N 3.28Å; W184-L186 PolarHBondContact O-N 2.84Å; W184-D187 PolarHBondContact O-N 3.23Å; W184-M188 HydrophobicContact CE3-SD 4.48Å; W184-M188 HydrophobicContact CH2-CE 4.42Å; W184-M188 HydrophobicContact CH2-CG 4.47Å; W184-M188 HydrophobicContact CH2-SD 3.24Å; W184-M188 WeakPolarHBondContact CH2-SD 3.36Å; W184-M188 HydrophobicContact CZ2-SD 3.93Å; W184-M188 HydrophobicContact CZ3-SD 3.54Å; W184-M188 VanDerWaalsContact CZ3-SD 3.54Å; W184-M188 VanDerWaalsContact O-CB 3.28Å; W184-M188 WeakPolarHBondContact O-CB 3.28Å; W184-M188 PolarHBondContact O-N 3.22Å
185	L	82.7	Confident	80.8	Confident	47 Å²	47	60.3 Å²	60.3	25%	0.246	29%	0.294	C	S	.	.	H	α-helix	trans	-58.6	-41.3	178.6	-76.6	167.3	0	0	0	111.6	L76 V86 D181 L182 G189	L76-L185 HydrophobicContact CD1-CG 4.43Å; V86-L185 HydrophobicContact CG1-CD1 4.42Å; V86-L185 HydrophobicContact CG1-CD2 4.45Å; V86-L185 HydrophobicContact CG2-CD1 4.1Å; D181-L185 VanDerWaalsContact O-CG 3.3Å; D181-L185 WeakPolarHBondContact O-CG 3.41Å; D181-L185 PolarHBondContact O-N 3.35Å; L182-L185 PolarHBondContact O-N 2.69Å; L182-L185 VanDerWaalsContact O-N 3.16Å; L185-G189 PolarHBondContact O-N 3.44Å
186	L	84.4	Confident	79.4	Confident	32 Å²	32	59.8 Å²	59.8	17%	0.168	30%	0.295	C	S	.	.	H	α-helix	trans	-70.1	-45.5	177.7	-67.9	177.8	0	0	0	112.3	A149 Y169 V171 L182 I183 W184 M188 G189 L190 I207	A149-L186 HydrophobicContact CB-CD1 3.41Å; A149-L186 VanDerWaalsContact CB-CD1 3.41Å; Y169-L186 HydrophobicContact CD1-CD1 4.4Å; Y169-L186 HydrophobicContact CD1-CD2 4.15Å; Y169-L186 HydrophobicContact CE1-CD2 3.88Å; V171-L186 HydrophobicContact CG2-CD1 4.42Å; V171-L186 HydrophobicContact CG2-CD2 4.45Å; L182-L186 HydrophobicContact CD1-CD1 3.83Å; L182-L186 HydrophobicContact CD1-CG 3.93Å; L182-L186 HydrophobicContact CG-CD1 4.16Å; L182-L186 WeakPolarHBondContact O-CG 3.45Å; L182-L186 PolarHBondContact O-N 3.46Å; I183-L186 PolarHBondContact O-N 3.22Å; W184-L186 VanDerWaalsContact C-N 3.28Å; W184-L186 PolarHBondContact O-N 2.84Å; L186-M188 VanDerWaalsContact C-N 3.32Å; L186-M188 PolarHBondContact O-N 2.71Å; L186-G189 PolarHBondContact O-N 3.14Å; L186-L190 WeakPolarHBondContact O-CB 3.16Å; L186-L190 VanDerWaalsContact O-CG 3.29Å; L186-L190 WeakPolarHBondContact O-CG 3.41Å; L186-L190 PolarHBondContact O-N 2.93Å; L186-I207 HydrophobicContact CB-CD1 4.26Å; L186-I207 HydrophobicContact CB-CG1 3.82Å; L186-I207 HydrophobicContact CD1-CD1 4.16Å; L186-I207 HydrophobicContact CD1-CG1 4.24Å
187	D	81.8	Confident	77.9	Confident	69 Å²	69	59.1 Å²	59.1	37%	0.369	29%	0.292	S	S	.	.	H	α-helix	trans	-65.6	-36.6	179.4	-168.7	63.5	0	0	0	112.2	I183 W184 L190 S191	I183-D187 WeakPolarHBondContact O-CB 3.35Å; I183-D187 PolarHBondContact O-N 3.44Å; W184-D187 PolarHBondContact O-N 3.23Å; D187-L190 PolarHBondContact O-N 2.89Å; D187-S191 VanDerWaalsContact O-CB 3.28Å; D187-S191 WeakPolarHBondContact O-CB 3.39Å; D187-S191 PolarHBondContact O-N 3.17Å; D187-S191 PolarHBondContact O-OG 2.94Å
188	M	74.2	Confident	76.5	Confident	54 Å²	54	65.1 Å²	65.1	27%	0.266	33%	0.328	S	S	.	.	H	α-helix	trans	-61.4	-49	170.4	-177.9	-172.9	178.9	0	0	110.8	L66 W184 L186 L190 S191 I192	L66-M188 HydrophobicContact CD2-CE 3.4Å; L66-M188 HydrophobicContact CD2-SD 4.47Å; L66-M188 HydrophobicContact CG-CE 4.21Å; W184-M188 HydrophobicContact CE3-SD 4.48Å; W184-M188 HydrophobicContact CH2-CE 4.42Å; W184-M188 HydrophobicContact CH2-CG 4.47Å; W184-M188 HydrophobicContact CH2-SD 3.24Å; W184-M188 WeakPolarHBondContact CH2-SD 3.36Å; W184-M188 HydrophobicContact CZ2-SD 3.93Å; W184-M188 HydrophobicContact CZ3-SD 3.54Å; W184-M188 VanDerWaalsContact CZ3-SD 3.54Å; W184-M188 VanDerWaalsContact O-CB 3.28Å; W184-M188 WeakPolarHBondContact O-CB 3.28Å; W184-M188 PolarHBondContact O-N 3.22Å; L186-M188 VanDerWaalsContact C-N 3.32Å; L186-M188 PolarHBondContact O-N 2.71Å; M188-L190 PolarHBondContact O-N 2.83Å; M188-S191 WeakPolarHBondContact O-CB 3.38Å; M188-S191 PolarHBondContact O-N 3.23Å; M188-I192 HydrophobicContact CE-CD1 3.89Å; M188-I192 HydrophobicContact CG-CD1 3.95Å; M188-I192 WeakPolarHBondContact O-CG1 3.12Å; M188-I192 PolarHBondContact O-N 2.8Å
189	G	73.3	Confident	74.8	Confident	27 Å²	27	66.8 Å²	66.8	28%	0.278	34%	0.338	S	S	.	.	H	α-helix	trans	-56.8	-49.7	176.2	0	0	0	0	0	112	L185 L186 S191 I192 F193	L185-G189 PolarHBondContact O-N 3.44Å; L186-G189 PolarHBondContact O-N 3.14Å; G189-S191 VanDerWaalsContact C-N 3.31Å; G189-S191 PolarHBondContact O-N 3.04Å; G189-I192 PolarHBondContact O-N 3.34Å; G189-F193 WeakPolarHBondContact O-CB 3.09Å; G189-F193 WeakPolarHBondContact O-CD2 3.23Å; G189-F193 PolarHBondContact O-N 2.88Å
190	L	75.4	Confident	73.2	Confident	54 Å²	54	69.6 Å²	69.6	28%	0.283	35%	0.351	S	S	.	.	H	α-helix	trans	-59.9	-40.4	176.8	-69.5	170.6	0	0	0	112	L186 D187 M188 F193 R194 L205 I207	L186-L190 WeakPolarHBondContact O-CB 3.16Å; L186-L190 VanDerWaalsContact O-CG 3.29Å; L186-L190 WeakPolarHBondContact O-CG 3.41Å; L186-L190 PolarHBondContact O-N 2.93Å; D187-L190 PolarHBondContact O-N 2.89Å; M188-L190 PolarHBondContact O-N 2.83Å; L190-F193 PolarHBondContact O-N 3.19Å; L190-R194 VanDerWaalsContact O-CB 3.24Å; L190-R194 WeakPolarHBondContact O-CB 3.3Å; L190-R194 PolarHBondContact O-N 3.25Å; L190-L205 HydrophobicContact CD1-CD2 3.87Å; L190-L205 HydrophobicContact CD2-CD2 3.73Å; L190-L205 HydrophobicContact CG-CD2 4.48Å; L190-I207 HydrophobicContact CD1-CD1 4.03Å; L190-I207 HydrophobicContact CD1-CG1 4.13Å
191	S	71.8	Confident	71.7	Confident	38 Å²	38	69.1 Å²	69.1	27%	0.266	35%	0.352	S	S	.	.	H	α-helix	trans	-62.9	-43.7	175.9	-69.2	0	0	0	0	112.4	D187 M188 G189 R194 Y195	D187-S191 VanDerWaalsContact O-CB 3.28Å; D187-S191 WeakPolarHBondContact O-CB 3.39Å; D187-S191 PolarHBondContact O-N 3.17Å; D187-S191 PolarHBondContact O-OG 2.94Å; M188-S191 WeakPolarHBondContact O-CB 3.38Å; M188-S191 PolarHBondContact O-N 3.23Å; G189-S191 VanDerWaalsContact C-N 3.31Å; G189-S191 PolarHBondContact O-N 3.04Å; S191-R194 WeakPolarHBondContact O-CB 3.39Å; S191-R194 PolarHBondContact O-N 3.37Å; S191-Y195 PolarHBondContact O-N 3.43Å
192	I	68.3	Low	70.3	Confident	52 Å²	52	78.2 Å²	78.2	27%	0.267	39%	0.391	S	S	.	.	H	α-helix	trans	-66	-46.5	177.5	-67	165.4	0	0	0	110.4	M188 G189 R194 Y195 N196	M188-I192 HydrophobicContact CE-CD1 3.89Å; M188-I192 HydrophobicContact CG-CD1 3.95Å; M188-I192 WeakPolarHBondContact O-CG1 3.12Å; M188-I192 PolarHBondContact O-N 2.8Å; G189-I192 PolarHBondContact O-N 3.34Å; I192-R194 VanDerWaalsContact C-N 3.26Å; I192-R194 PolarHBondContact O-N 2.8Å; I192-Y195 PolarHBondContact O-N 2.83Å; I192-N196 PolarHBondContact O-N 3.46Å
193	F	67	Low	69.2	Low	151 Å²	151	80.5 Å²	80.5	66%	0.662	41%	0.405	S	S	*	.	H	α-helix	trans	-59.3	-38	175.4	-93	-80.8	0	0	0	112	G189 L190 C197	G189-F193 WeakPolarHBondContact O-CB 3.09Å; G189-F193 WeakPolarHBondContact O-CD2 3.23Å; G189-F193 PolarHBondContact O-N 2.88Å; L190-F193 PolarHBondContact O-N 3.19Å; F193-C197 WeakPolarHBondContact O-CB 3.36Å; F193-C197 PolarHBondContact O-N 3.3Å
194	R	66.6	Low	68.3	Low	117 Å²	117	84.6 Å²	84.6	44%	0.442	43%	0.428	S	S	.	.	H	α-helix	trans	-65.5	-40.9	176.1	-171.1	-173.5	179.6	169.3	1.3	112.6	L190 S191 I192 S201 N204	L190-R194 VanDerWaalsContact O-CB 3.24Å; L190-R194 WeakPolarHBondContact O-CB 3.3Å; L190-R194 PolarHBondContact O-N 3.25Å; S191-R194 WeakPolarHBondContact O-CB 3.39Å; S191-R194 PolarHBondContact O-N 3.37Å; I192-R194 VanDerWaalsContact C-N 3.26Å; I192-R194 PolarHBondContact O-N 2.8Å; R194-S201 PolarHBondContact NE-O 3.16Å; R194-S201 PolarHBondContact NH2-O 3.24Å; R194-N204 PolarHBondContact NH1-OD1 3.3Å; R194-N204 VanDerWaalsContact NH1-OD1 3.11Å
195	Y	65	Low	67.8	Low	191 Å²	191	84 Å²	84	75%	0.749	43%	0.428	S	S	*	.	H	α-helix	trans	-67.8	-40.8	179	-170.1	-95.9	0	0	0	111.6	Y65 S191 I192	Y65-Y195 HydrophobicContact CE1-CD1 4.37Å; S191-Y195 PolarHBondContact O-N 3.43Å; I192-Y195 PolarHBondContact O-N 2.83Å
196	N	62.4	Low	67.7	Low	97 Å²	97	84.1 Å²	84.1	52%	0.519	43%	0.433	S	S	.	.	H	α-helix	trans	-86.2	-20.9	-176.3	-71	-21.7	0	0	0	114.3	I192	I192-N196 PolarHBondContact O-N 3.46Å
197	C	59.1	Low	67.8	Low	39 Å²	39	83.8 Å²	83.8	26%	0.264	43%	0.431	S	S	.	.			trans	-114.9	104.3	-177.7	-164.5	0	0	0	0	112.6	F193 V199 F200 S201	F193-C197 WeakPolarHBondContact O-CB 3.36Å; F193-C197 PolarHBondContact O-N 3.3Å; C197-V199 PolarHBondContact O-N 3.49Å; C197-V199 VanDerWaalsContact O-N 3.15Å; C197-F200 HydrophobicContact CB-CB 4.46Å; C197-F200 HydrophobicContact CB-CD2 4.25Å; C197-F200 PolarHBondContact O-N 2.8Å; C197-F200 VanDerWaalsContact O-N 3.15Å; C197-S201 PolarHBondContact O-N 3.02Å; C197-S201 VanDerWaalsContact O-N 3.13Å
198	V	59.9	Low	68	Low	126 Å²	126	81.5 Å²	81.5	76%	0.764	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	-36.2	178.1	179.2	0	0	0	0	112.3	S201	V198-S201 WeakPolarHBondContact O-CB 3.3Å; V198-S201 PolarHBondContact O-N 2.66Å; V198-S201 PolarHBondContact O-OG 3.06Å
199	V	55.8	Low	68.6	Low	100 Å²	100	83.9 Å²	83.9	61%	0.606	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-41.9	-178.2	-178.6	0	0	0	0	111.9	C197	C197-V199 PolarHBondContact O-N 3.49Å; C197-V199 VanDerWaalsContact O-N 3.15Å
200	F	55.4	Low	69.2	Low	125 Å²	125	86.5 Å²	86.5	55%	0.548	44%	0.442	S	S	.	.	G	3₁₀ helix	trans	-86.2	-8.4	179.5	-72.8	-76.4	0	0	0	113.7	C197 K202 V203	C197-F200 HydrophobicContact CB-CB 4.46Å; C197-F200 HydrophobicContact CB-CD2 4.25Å; C197-F200 PolarHBondContact O-N 2.8Å; C197-F200 VanDerWaalsContact O-N 3.15Å; F200-K202 PolarHBondContact O-N 3.35Å; F200-V203 HydrophobicContact CD1-CG2 4.3Å; F200-V203 PolarHBondContact O-N 3.45Å
201	S	57.8	Low	69.8	Low	48 Å²	48	85 Å²	85	34%	0.336	44%	0.435	S	S	.	.	G	3₁₀ helix	trans	-52.1	-27.2	175.2	72.6	0	0	0	0	114	R194 C197 V198	R194-S201 PolarHBondContact NE-O 3.16Å; R194-S201 PolarHBondContact NH2-O 3.24Å; C197-S201 PolarHBondContact O-N 3.02Å; C197-S201 VanDerWaalsContact O-N 3.13Å; V198-S201 WeakPolarHBondContact O-CB 3.3Å; V198-S201 PolarHBondContact O-N 2.66Å; V198-S201 PolarHBondContact O-OG 3.06Å
202	K	56.6	Low	70.7	Confident	194 Å²	194	83.4 Å²	83.4	84%	0.843	42%	0.424	S	S	*	.	G	3₁₀ helix	trans	-84	-18.8	178.5	-69.4	-172.6	176.1	-177.5	0	114.8	F200 N204	F200-K202 PolarHBondContact O-N 3.35Å; K202-N204 PolarHBondContact O-N 2.92Å
203	V	64.9	Low	71.8	Confident	52 Å²	52	81.8 Å²	81.8	32%	0.315	42%	0.415	S	S	.	.			trans	-93.7	103.3	-178.2	-176.1	0	0	0	0	108.1	P154 F200 L205	P154-V203 HydrophobicContact CG-CG1 4.06Å; F200-V203 HydrophobicContact CD1-CG2 4.3Å; F200-V203 PolarHBondContact O-N 3.45Å; V203-L205 HydrophobicContact CG1-CB 4.35Å; V203-L205 HydrophobicContact CG1-CD1 4.24Å; V203-L205 PolarHBondContact O-N 2.95Å
204	N	68.9	Low	73	Confident	108 Å²	108	76 Å²	76	58%	0.578	39%	0.392	S	S	*	.			trans	-79.8	67.4	176.8	-159.5	42.4	0	0	0	110.4	R194 K202 S206	R194-N204 PolarHBondContact NH1-OD1 3.3Å; R194-N204 VanDerWaalsContact NH1-OD1 3.11Å; K202-N204 PolarHBondContact O-N 2.92Å; N204-S206 PolarHBondContact O-N 2.76Å
205	L	73.2	Confident	74.2	Confident	42 Å²	42	70.7 Å²	70.7	22%	0.22	37%	0.373	C	S	.	.			trans	-74.9	123.9	176.3	-150.4	102.9	0	0	0	108.7	A151 L153 L190 V203	A151-L205 HydrophobicContact CB-CD2 3.63Å; A151-L205 HydrophobicContact CB-CG 3.97Å; L153-L205 HydrophobicContact CD2-CD1 3.85Å; L190-L205 HydrophobicContact CD1-CD2 3.87Å; L190-L205 HydrophobicContact CD2-CD2 3.73Å; L190-L205 HydrophobicContact CG-CD2 4.48Å; V203-L205 HydrophobicContact CG1-CB 4.35Å; V203-L205 HydrophobicContact CG1-CD1 4.24Å; V203-L205 PolarHBondContact O-N 2.95Å
206	S	81	Confident	75.2	Confident	50 Å²	50	63 Å²	63	35%	0.35	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	143.5	174.2	55.1	0	0	0	0	109.2	A151 K152 N204	A151-S206 WeakPolarHBondContact CA-O 3.33Å; K152-S206 PolarHBondContact N-O 2.96Å; K152-S206 VanDerWaalsContact N-O 3.16Å; N204-S206 PolarHBondContact O-N 2.76Å
207	I	85.2	Confident	76	Confident	25 Å²	25	61.5 Å²	61.5	13%	0.128	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	125.4	175.2	-56.8	-55.8	0	0	0	108.4	A149 Y150 A151 I183 L186 L190 K209 S212	A149-I207 HydrophobicContact CB-CG2 4.35Å; Y150-I207 CarbonylContact O-C 3.07Å; Y150-I207 WeakPolarHBondContact O-CA 3.26Å; A151-I207 HydrophobicContact CB-CD1 3.79Å; I183-I207 HydrophobicContact CG1-CG2 4.06Å; I183-I207 HydrophobicContact CG2-CB 4.29Å; I183-I207 HydrophobicContact CG2-CG2 4.21Å; L186-I207 HydrophobicContact CB-CD1 4.26Å; L186-I207 HydrophobicContact CB-CG1 3.82Å; L186-I207 HydrophobicContact CD1-CD1 4.16Å; L186-I207 HydrophobicContact CD1-CG1 4.24Å; L190-I207 HydrophobicContact CD1-CD1 4.03Å; L190-I207 HydrophobicContact CD1-CG1 4.13Å; I207-K209 PolarHBondContact O-N 2.97Å; I207-S212 WeakPolarHBondContact CG2-OG 3.43Å
208	D	86.5	Confident	76.7	Confident	21 Å²	21	67.2 Å²	67.2	11%	0.112	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	109	174.1	-168.4	-25.9	0	0	0	109.8	Y150 K152 S210 T211 S212	Y150-D208 PolarHBondContact O-N 3.49Å; K152-D208 WeakPolarHBondContact CE-OD2 3.37Å; K152-D208 HydrophobicContact CG-CB 4.47Å; K152-D208 IonicContact NZ-OD2 2.67Å; K152-D208 PolarHBondContact NZ-OD2 3.17Å; D208-S210 VanDerWaalsContact CG-OG 3.29Å; D208-S210 PolarHBondContact O-N 3.48Å; D208-S210 WeakPolarHBondContact OD1-CA 3.48Å; D208-S210 VanDerWaalsContact OD1-CB 3.29Å; D208-S210 WeakPolarHBondContact OD1-CB 3.5Å; D208-S210 PolarHBondContact OD1-N 2.88Å; D208-S210 PolarHBondContact OD1-OG 3.11Å; D208-S210 PolarHBondContact OD2-OG 2.7Å; D208-T211 WeakPolarHBondContact CB-OG1 3.28Å; D208-S212 VanDerWaalsContact O-CB 3.27Å; D208-S212 WeakPolarHBondContact O-CB 3.47Å; D208-S212 PolarHBondContact O-N 3.13Å; D208-S212 PolarHBondContact O-OG 2.85Å
209	K	87.6	Confident	77.5	Confident	104 Å²	104	63.7 Å²	63.7	45%	0.452	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	-27	177.9	177	164.3	-179.8	162.4	0	113.2	K179 D180 I183 I207	K179-K209 PolarHBondContact NZ-O 3.03Å; D180-K209 WeakPolarHBondContact OD1-CE 3.39Å; D180-K209 IonicContact OD1-NZ 2.78Å; D180-K209 PolarHBondContact OD1-NZ 3.18Å; D180-K209 IonicContact OD2-NZ 2.72Å; D180-K209 PolarHBondContact OD2-NZ 3.48Å; I183-K209 HydrophobicContact CD1-CB 3.82Å; I183-K209 HydrophobicContact CD1-CD 4.24Å; I183-K209 HydrophobicContact CD1-CG 3.66Å; I207-K209 PolarHBondContact O-N 2.97Å
210	S	85.6	Confident	78.7	Confident	82 Å²	82	64.8 Å²	64.8	57%	0.573	35%	0.349	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.6	-36.2	-176.3	72.1	0	0	0	0	112.4	D208	D208-S210 VanDerWaalsContact CG-OG 3.29Å; D208-S210 PolarHBondContact O-N 3.48Å; D208-S210 WeakPolarHBondContact OD1-CA 3.48Å; D208-S210 VanDerWaalsContact OD1-CB 3.29Å; D208-S210 WeakPolarHBondContact OD1-CB 3.5Å; D208-S210 PolarHBondContact OD1-N 2.88Å; D208-S210 PolarHBondContact OD1-OG 3.11Å; D208-S210 PolarHBondContact OD2-OG 2.7Å
211	T	87	Confident	80.1	Confident	23 Å²	23	59.6 Å²	59.6	14%	0.141	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	-23	-179.7	54.9	0	0	0	0	113.1	Y150 E166 D208 L487	Y150-T211 VanDerWaalsContact CB-OG1 3.25Å; Y150-T211 WeakPolarHBondContact CB-OG1 3.26Å; Y150-T211 VanDerWaalsContact CD2-O 3.22Å; Y150-T211 WeakPolarHBondContact CD2-O 3.23Å; Y150-T211 WeakPolarHBondContact CE2-O 3.38Å; E166-T211 PolarHBondContact OE2-OG1 3.37Å; D208-T211 WeakPolarHBondContact CB-OG1 3.28Å; T211-L487 HydrophobicContact CG2-CD2 3.78Å; T211-L487 WeakPolarHBondContact O-CD1 3.26Å; T211-L487 WeakPolarHBondContact O-CD2 3.42Å
212	S	90.8	Very high	81.5	Confident	4 Å²	4	62.4 Å²	62.4	3%	0.028	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	140.8	174.9	-57.3	0	0	0	0	112.9	S148 A149 Y150 K179 I207 D208	S148-S212 WeakPolarHBondContact O-CA 3.45Å; A149-S212 WeakPolarHBondContact CA-OG 3.22Å; Y150-S212 PolarHBondContact N-OG 3.23Å; K179-S212 VanDerWaalsContact CD-O 3.22Å; K179-S212 WeakPolarHBondContact CD-O 3.44Å; I207-S212 WeakPolarHBondContact CG2-OG 3.43Å; D208-S212 VanDerWaalsContact O-CB 3.27Å; D208-S212 WeakPolarHBondContact O-CB 3.47Å; D208-S212 PolarHBondContact O-N 3.13Å; D208-S212 PolarHBondContact O-OG 2.85Å
213	F	91.8	Very high	83.2	Confident	18 Å²	18	58.5 Å²	58.5	8%	0.079	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156	163.3	179.7	72	-76.3	0	0	0	113.2	C147 S148 Y150 H215 Q483 T484 L487	C147-F213 CarbonylContact C-O 3.35Å; C147-F213 WeakPolarHBondContact CA-O 3.39Å; C147-F213 WeakPolarHBondContact CB-O 3.48Å; S148-F213 PolarHBondContact N-O 3.04Å; S148-F213 PolarHBondContact O-N 3.19Å; Y150-F213 HydrophobicContact CE2-CD1 4.21Å; Y150-F213 AromaticContact CE2-CE1 3.97Å; Y150-F213 HydrophobicContact CE2-CE1 3.97Å; F213-H215 AromaticContact CE2-CD2 3.74Å; F213-H215 AromaticContact CE2-CE1 3.4Å; F213-H215 VanDerWaalsContact CE2-CE1 3.4Å; F213-H215 WeakPolarHBondContact CE2-CE1 3.37Å; F213-H215 AromaticContact CE2-CG 3.91Å; F213-H215 AromaticContact CE2-ND1 3.71Å; F213-H215 AromaticContact CE2-NE2 3.42Å; F213-H215 WeakPolarHBondContact CE2-NE2 3.27Å; F213-H215 AromaticContact CZ-CE1 3.45Å; F213-H215 VanDerWaalsContact CZ-CE1 3.45Å; F213-H215 WeakPolarHBondContact CZ-CE1 3.48Å; F213-H215 AromaticContact CZ-NE2 3.43Å; F213-H215 WeakPolarHBondContact CZ-NE2 3.48Å; F213-Q483 HydrophobicContact CE2-CB 4.37Å; F213-T484 HydrophobicContact CG-CG2 4.38Å; F213-L487 HydrophobicContact CD1-CD1 3.28Å; F213-L487 HydrophobicContact CE1-CD1 3.24Å; F213-L487 HydrophobicContact CG-CD1 4.2Å; F213-L487 HydrophobicContact CZ-CD1 4.16Å
214	C	92.3	Very high	84.5	Confident	29 Å²	29	58.3 Å²	58.3	20%	0.196	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	139.6	174	-67.6	0	0	0	0	111	C147	C147-C214 HydrophobicContact CB-CB 3.96Å; C147-C214 WeakPolarHBondContact CB-SG 3.18Å; C147-C214 VanDerWaalsContact SG-CA 3.59Å; C147-C214 WeakPolarHBondContact SG-CB 3.45Å; C147-C214 CovalentContact SG-SG 2.04Å; C147-C214 PolarHBondContact SG-SG 2.94Å
215	H	91.8	Very high	85.7	Confident	6 Å²	6	57.6 Å²	57.6	3%	0.028	33%	0.328	C	S	.	.			trans	-85.2	115.6	-172.8	-70.3	-106	0	0	0	111.8	M125 R129 Y146 S148 F213 G478	M125-H215 HydrophobicContact CE-CB 3.6Å; R129-H215 PolarHBondContact NH2-O 3.16Å; Y146-H215 HydrophobicContact CD1-CB 4.24Å; Y146-H215 AromaticContact CD1-CD2 3.39Å; Y146-H215 WeakPolarHBondContact CD1-CD2 3.15Å; Y146-H215 AromaticContact CD1-CG 3.88Å; Y146-H215 AromaticContact CD1-NE2 3.94Å; Y146-H215 AromaticContact CE1-CD2 3.66Å; Y146-H215 AromaticContact CE1-NE2 3.71Å; Y146-H215 PolarHBondContact O-N 3.2Å; S148-H215 PolarHBondContact OG-NE2 3.08Å; F213-H215 AromaticContact CE2-CD2 3.74Å; F213-H215 AromaticContact CE2-CE1 3.4Å; F213-H215 VanDerWaalsContact CE2-CE1 3.4Å; F213-H215 WeakPolarHBondContact CE2-CE1 3.37Å; F213-H215 AromaticContact CE2-CG 3.91Å; F213-H215 AromaticContact CE2-ND1 3.71Å; F213-H215 AromaticContact CE2-NE2 3.42Å; F213-H215 WeakPolarHBondContact CE2-NE2 3.27Å; F213-H215 AromaticContact CZ-CE1 3.45Å; F213-H215 VanDerWaalsContact CZ-CE1 3.45Å; F213-H215 WeakPolarHBondContact CZ-CE1 3.48Å; F213-H215 AromaticContact CZ-NE2 3.43Å; F213-H215 WeakPolarHBondContact CZ-NE2 3.48Å; H215-G478 PolarHBondContact CE1-O 3.28Å; H215-G478 PolarHBondContact ND1-O 3.19Å
216	A	85.5	Confident	86.8	Confident	29 Å²	29	58.3 Å²	58.3	24%	0.24	33%	0.328	C	S	.	.	P	Polyproline II helix	trans	-70.8	153.4	172.9	0	0	0	0	0	112.1	R129 L221 Q483	R129-A216 VanDerWaalsContact NH2-C 3.29Å; R129-A216 PolarHBondContact NH2-O 3.19Å; A216-L221 HydrophobicContact CB-CD1 4.03Å; A216-L221 HydrophobicContact CB-CG 4.32Å; A216-Q483 PolarHBondContact O-NE2 3.44Å
217	N	80.1	Confident	87.5	Confident	67 Å²	67	57.3 Å²	57.3	36%	0.358	32%	0.317	S	S	.	.	P	Polyproline II helix	trans	-69.1	163.8	175.1	-61.3	-42.9	0	0	0	111.4	G219 E220 L221	N217-G219 PolarHBondContact O-N 3.41Å; N217-E220 HydrophobicContact CB-CG 4.19Å; N217-E220 WeakPolarHBondContact CB-OE2 3.39Å; N217-E220 PolarHBondContact N-OE2 2.94Å; N217-E220 PolarHBondContact ND2-OE1 2.7Å; N217-E220 PolarHBondContact ND2-OE2 3.41Å; N217-E220 PolarHBondContact O-N 3.21Å; N217-E220 VanDerWaalsContact O-N 3.16Å; N217-L221 WeakPolarHBondContact O-CD1 3.44Å
218	F	73.1	Confident	88.1	Confident	159 Å²	159	62.8 Å²	62.8	70%	0.697	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	126.6	178.5	-170.5	-96.1	0	0	0	110.6	E220 V477	F218-E220 VanDerWaalsContact C-N 3.31Å; F218-E220 PolarHBondContact O-N 3.16Å; F218-V477 HydrophobicContact CB-CG2 4.47Å; F218-V477 HydrophobicContact CD2-CG2 3.97Å
219	G	76.1	Confident	88.6	Confident	52 Å²	52	64.9 Å²	64.9	54%	0.536	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	87	-15.1	-178.7	0	0	0	0	0	115.7	N217	N217-G219 PolarHBondContact O-N 3.41Å
220	E	81.8	Confident	89.1	Confident	123 Å²	123	60 Å²	60	58%	0.575	33%	0.328	S	S	*	.			trans	-85.1	-7.7	176.8	-69.9	176.3	-172.7	0	0	113.4	N217 F218	N217-E220 HydrophobicContact CB-CG 4.19Å; N217-E220 WeakPolarHBondContact CB-OE2 3.39Å; N217-E220 PolarHBondContact N-OE2 2.94Å; N217-E220 PolarHBondContact ND2-OE1 2.7Å; N217-E220 PolarHBondContact ND2-OE2 3.41Å; N217-E220 PolarHBondContact O-N 3.21Å; N217-E220 VanDerWaalsContact O-N 3.16Å; F218-E220 VanDerWaalsContact C-N 3.31Å; F218-E220 PolarHBondContact O-N 3.16Å
221	L	85.7	Confident	89.6	Confident	15 Å²	15	59.2 Å²	59.2	8%	0.079	32%	0.316	C	S	.	.	S	Bend	trans	-60.5	134.5	177.9	-80.9	79.1	0	0	0	110.3	A216 N217 K223 I473 H474 V477 Q483	A216-L221 HydrophobicContact CB-CD1 4.03Å; A216-L221 HydrophobicContact CB-CG 4.32Å; N217-L221 WeakPolarHBondContact O-CD1 3.44Å; L221-K223 PolarHBondContact O-N 2.9Å; L221-I473 VanDerWaalsContact CD2-O 3.28Å; L221-I473 WeakPolarHBondContact CD2-O 3.45Å; L221-H474 WeakPolarHBondContact CB-ND1 3.44Å; L221-V477 HydrophobicContact CD1-CG2 4.37Å; L221-Q483 HydrophobicContact CD2-CB 3.8Å; L221-Q483 HydrophobicContact CD2-CG 4.03Å; L221-Q483 HydrophobicContact CG-CB 4.43Å
222	P	86.4	Confident	90.2	Very high	108 Å²	108	61.2 Å²	61.2	70%	0.701	33%	0.331	S	S	*	.			trans	-63.1	124.8	179.6	25.9	-33.5	0	0	0	110.5	D224 H474	P222-D224 PolarHBondContact O-N 3.21Å; P222-H474 PolarHBondContact O-CE1 3.5Å; P222-H474 VanDerWaalsContact O-CE1 3.32Å
223	K	91.7	Very high	90.5	Very high	112 Å²	112	62.8 Å²	62.8	49%	0.487	34%	0.341	S	S	.	.			trans	-86.3	103.3	178	-65.7	166.4	-173	156.4	0	109.2	L221 F227 W228	L221-K223 PolarHBondContact O-N 2.9Å; K223-F227 HydrophobicContact CB-CB 4.46Å; K223-F227 HydrophobicContact CB-CD1 3.67Å; K223-F227 HydrophobicContact CB-CE1 4.17Å; K223-F227 HydrophobicContact CB-CG 4.13Å; K223-F227 HydrophobicContact CD-CD1 4.07Å; K223-F227 HydrophobicContact CD-CE1 3.67Å; K223-F227 HydrophobicContact CD-CZ 4.19Å; K223-F227 HydrophobicContact CG-CD1 3.72Å; K223-F227 HydrophobicContact CG-CE1 3.76Å; K223-F227 HydrophobicContact CG-CG 4.15Å; K223-F227 HydrophobicContact CG-CZ 4.22Å; K223-W228 HydrophobicContact CB-CZ2 4.2Å; K223-W228 HydrophobicContact CD-CH2 4.25Å; K223-W228 HydrophobicContact CD-CZ2 3.77Å
224	D	92.3	Very high	90.7	Very high	47 Å²	47	64.6 Å²	64.6	25%	0.251	35%	0.351	S	S	.	.			trans	-82.8	-178.2	178.2	63.5	27.1	0	0	0	112.8	P222 W226 F227 W228 R494	P222-D224 PolarHBondContact O-N 3.21Å; D224-W226 VanDerWaalsContact C-N 3.26Å; D224-W226 PolarHBondContact O-N 3.19Å; D224-W226 WeakPolarHBondContact OD1-CA 3.41Å; D224-W226 WeakPolarHBondContact OD1-CB 3.27Å; D224-W226 PolarHBondContact OD1-N 3.35Å; D224-F227 WeakPolarHBondContact O-CB 3.29Å; D224-F227 PolarHBondContact O-N 2.67Å; D224-F227 PolarHBondContact OD1-N 2.95Å; D224-W228 PolarHBondContact O-N 2.92Å; D224-R494 IonicContact OD1-NH2 3.59Å; D224-R494 IonicContact OD2-CZ 3.67Å; D224-R494 IonicContact OD2-NH1 3.82Å; D224-R494 PolarHBondContact OD2-NH1 2.88Å; D224-R494 IonicContact OD2-NH2 3.69Å; D224-R494 PolarHBondContact OD2-NH2 3.31Å
225	S	95.4	Very high	91	Very high	94 Å²	94	67.6 Å²	67.6	66%	0.657	37%	0.368	S	S	*	.	H	α-helix	trans	-60.1	-35.3	177.8	-52.1	0	0	0	0	112.8	W228 V229	S225-W228 PolarHBondContact O-N 3.47Å; S225-V229 VanDerWaalsContact O-CG2 3.25Å; S225-V229 WeakPolarHBondContact O-CG2 3.45Å; S225-V229 PolarHBondContact O-N 3.35Å
226	W	95.2	Very high	91.2	Very high	56 Å²	56	71.9 Å²	71.9	21%	0.212	39%	0.39	C	S	.	.	H	α-helix	trans	-68.8	-38.3	-179.4	-78.5	102.3	0	0	0	111.9	D224 V229 A230 T469 G470 R494 W497	D224-W226 VanDerWaalsContact C-N 3.26Å; D224-W226 PolarHBondContact O-N 3.19Å; D224-W226 WeakPolarHBondContact OD1-CA 3.41Å; D224-W226 WeakPolarHBondContact OD1-CB 3.27Å; D224-W226 PolarHBondContact OD1-N 3.35Å; W226-V229 PolarHBondContact O-N 2.92Å; W226-A230 WeakPolarHBondContact O-CB 3.19Å; W226-A230 PolarHBondContact O-N 3.02Å; W226-T469 HydrophobicContact CD2-CG2 3.75Å; W226-T469 HydrophobicContact CE3-CG2 3.75Å; W226-T469 HydrophobicContact CG-CG2 4.12Å; W226-T469 HydrophobicContact CZ3-CG2 4.2Å; W226-G470 WeakPolarHBondContact O-CA 3.47Å; W226-R494 HydrophobicContact CD2-CG 4.39Å; W226-R494 HydrophobicContact CG-CG 4.26Å; W226-W497 AromaticContact CH2-CD1 3.75Å; W226-W497 HydrophobicContact CH2-CG 4.05Å; W226-W497 AromaticContact CZ2-CD1 3.85Å
227	F	95.8	Very high	91.7	Very high	29 Å²	29	71.6 Å²	71.6	13%	0.127	39%	0.386	C	S	.	.	H	α-helix	trans	-56.2	-50.6	171.3	175.1	-91.9	0	0	0	111.2	K223 D224 V229 A230 M231 G470 L471 H474	K223-F227 HydrophobicContact CB-CB 4.46Å; K223-F227 HydrophobicContact CB-CD1 3.67Å; K223-F227 HydrophobicContact CB-CE1 4.17Å; K223-F227 HydrophobicContact CB-CG 4.13Å; K223-F227 HydrophobicContact CD-CD1 4.07Å; K223-F227 HydrophobicContact CD-CE1 3.67Å; K223-F227 HydrophobicContact CD-CZ 4.19Å; K223-F227 HydrophobicContact CG-CD1 3.72Å; K223-F227 HydrophobicContact CG-CE1 3.76Å; K223-F227 HydrophobicContact CG-CG 4.15Å; K223-F227 HydrophobicContact CG-CZ 4.22Å; D224-F227 WeakPolarHBondContact O-CB 3.29Å; D224-F227 PolarHBondContact O-N 2.67Å; D224-F227 PolarHBondContact OD1-N 2.95Å; F227-V229 PolarHBondContact O-N 3.02Å; F227-A230 PolarHBondContact O-N 3.46Å; F227-M231 HydrophobicContact CD1-CG 4.2Å; F227-M231 HydrophobicContact CE1-CG 3.73Å; F227-M231 HydrophobicContact CE2-CG 4.13Å; F227-M231 HydrophobicContact CE2-SD 4.49Å; F227-M231 HydrophobicContact CZ-CG 3.7Å; F227-M231 HydrophobicContact CZ-SD 4.25Å; F227-M231 WeakPolarHBondContact O-CG 3.48Å; F227-M231 PolarHBondContact O-N 3.35Å; F227-G470 WeakPolarHBondContact CA-O 3.48Å; F227-L471 HydrophobicContact CD2-CD2 3.78Å; F227-L471 HydrophobicContact CE2-CD2 3.86Å; F227-H474 AromaticContact CD2-CD2 3.5Å; F227-H474 VanDerWaalsContact CD2-CD2 3.5Å; F227-H474 WeakPolarHBondContact CD2-CD2 3.22Å; F227-H474 AromaticContact CD2-NE2 3.89Å
228	W	97.5	Very high	92.5	Very high	141 Å²	141	72.1 Å²	72.1	53%	0.534	39%	0.388	S	S	.	.	H	α-helix	trans	-67.6	-35.9	-179	-67.5	115	0	0	0	113.2	K223 D224 S225 S232	K223-W228 HydrophobicContact CB-CZ2 4.2Å; K223-W228 HydrophobicContact CD-CH2 4.25Å; K223-W228 HydrophobicContact CD-CZ2 3.77Å; D224-W228 PolarHBondContact O-N 2.92Å; S225-W228 PolarHBondContact O-N 3.47Å; W228-S232 VanDerWaalsContact O-CB 3.3Å; W228-S232 WeakPolarHBondContact O-CB 3.41Å; W228-S232 PolarHBondContact O-N 2.9Å; W228-S232 PolarHBondContact O-OG 3.3Å
229	V	97.5	Very high	93.6	Very high	65 Å²	65	67.4 Å²	67.4	39%	0.394	37%	0.374	S	S	.	.	H	α-helix	trans	-61.1	-47.9	172	169.6	0	0	0	0	110.4	S225 W226 F227 S232 V233 I466	S225-V229 VanDerWaalsContact O-CG2 3.25Å; S225-V229 WeakPolarHBondContact O-CG2 3.45Å; S225-V229 PolarHBondContact O-N 3.35Å; W226-V229 PolarHBondContact O-N 2.92Å; F227-V229 PolarHBondContact O-N 3.02Å; V229-S232 PolarHBondContact O-N 3.24Å; V229-V233 WeakPolarHBondContact O-CG2 3.42Å; V229-V233 PolarHBondContact O-N 3.01Å; V229-I466 HydrophobicContact CG1-CG2 4.06Å
230	A	97.5	Very high	94.5	Very high	0 Å²	0	67 Å²	67	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-64.6	-43.1	-179.7	0	0	0	0	0	112.6	W226 F227 S232 V233 L234 I466 L467 L471	W226-A230 WeakPolarHBondContact O-CB 3.19Å; W226-A230 PolarHBondContact O-N 3.02Å; F227-A230 PolarHBondContact O-N 3.46Å; A230-S232 VanDerWaalsContact C-N 3.34Å; A230-S232 PolarHBondContact O-N 3.46Å; A230-V233 PolarHBondContact O-N 2.88Å; A230-L234 WeakPolarHBondContact O-CB 3.41Å; A230-L234 PolarHBondContact O-N 3.47Å; A230-I466 HydrophobicContact CB-CG2 3.95Å; A230-L467 HydrophobicContact CB-CD2 4.42Å; A230-L471 HydrophobicContact CB-CD1 4.26Å; A230-L471 HydrophobicContact CB-CD2 3.97Å; A230-L471 HydrophobicContact CB-CG 3.73Å
231	M	97.5	Very high	95.2	Very high	66 Å²	66	62.7 Å²	62.7	33%	0.325	34%	0.34	S	S	.	.	H	α-helix	trans	-61.2	-42.4	174.3	-72.6	-56	-61.3	0	0	112	F227 L234 V235 L471	F227-M231 HydrophobicContact CD1-CG 4.2Å; F227-M231 HydrophobicContact CE1-CG 3.73Å; F227-M231 HydrophobicContact CE2-CG 4.13Å; F227-M231 HydrophobicContact CE2-SD 4.49Å; F227-M231 HydrophobicContact CZ-CG 3.7Å; F227-M231 HydrophobicContact CZ-SD 4.25Å; F227-M231 WeakPolarHBondContact O-CG 3.48Å; F227-M231 PolarHBondContact O-N 3.35Å; M231-L234 PolarHBondContact O-N 2.92Å; M231-V235 VanDerWaalsContact O-CG2 3.3Å; M231-V235 WeakPolarHBondContact O-CG2 3.4Å; M231-V235 PolarHBondContact O-N 3.46Å; M231-L471 HydrophobicContact CG-CD2 4.05Å; M231-L471 HydrophobicContact SD-CD2 3.78Å
232	S	97.9	Very high	95.7	Very high	65 Å²	65	66.8 Å²	66.8	46%	0.455	36%	0.361	S	S	.	.	H	α-helix	trans	-63.9	-46.3	178.5	-58.5	0	0	0	0	111.5	W228 V229 A230 L234 V235 I236	W228-S232 VanDerWaalsContact O-CB 3.3Å; W228-S232 WeakPolarHBondContact O-CB 3.41Å; W228-S232 PolarHBondContact O-N 2.9Å; W228-S232 PolarHBondContact O-OG 3.3Å; V229-S232 PolarHBondContact O-N 3.24Å; A230-S232 VanDerWaalsContact C-N 3.34Å; A230-S232 PolarHBondContact O-N 3.46Å; S232-L234 VanDerWaalsContact C-N 3.33Å; S232-L234 PolarHBondContact O-N 2.7Å; S232-V235 PolarHBondContact O-N 2.98Å; S232-I236 WeakPolarHBondContact O-CD1 3.03Å; S232-I236 VanDerWaalsContact O-CG1 3.24Å; S232-I236 WeakPolarHBondContact O-CG1 3.44Å; S232-I236 PolarHBondContact O-N 3.18Å
233	V	97.2	Very high	96.2	Very high	38 Å²	38	63.5 Å²	63.5	23%	0.23	34%	0.341	C	S	.	.	H	α-helix	trans	-61.7	-42.4	176.4	170.3	0	0	0	0	111.1	V229 A230 I236 V237 L463 I466	V229-V233 WeakPolarHBondContact O-CG2 3.42Å; V229-V233 PolarHBondContact O-N 3.01Å; A230-V233 PolarHBondContact O-N 2.88Å; V233-I236 PolarHBondContact O-N 2.97Å; V233-V237 HydrophobicContact CG1-CG2 4.38Å; V233-V237 WeakPolarHBondContact O-CG2 3.33Å; V233-V237 PolarHBondContact O-N 3.13Å; V233-L463 HydrophobicContact CG1-CD1 3.66Å; V233-I466 HydrophobicContact CB-CG2 4.37Å; V233-I466 HydrophobicContact CG2-CD1 4.39Å; V233-I466 HydrophobicContact CG2-CG2 4.26Å
234	L	96.7	Very high	96.3	Very high	56 Å²	56	58.1 Å²	58.1	29%	0.293	32%	0.318	S	S	.	.	H	α-helix	trans	-61.6	-46.2	177.8	-175.2	64.1	0	0	0	111.6	A230 M231 S232 I236 V237 I238 L467	A230-L234 WeakPolarHBondContact O-CB 3.41Å; A230-L234 PolarHBondContact O-N 3.47Å; M231-L234 PolarHBondContact O-N 2.92Å; S232-L234 VanDerWaalsContact C-N 3.33Å; S232-L234 PolarHBondContact O-N 2.7Å; L234-I236 PolarHBondContact O-N 3.38Å; L234-V237 PolarHBondContact O-N 2.9Å; L234-I238 HydrophobicContact CD1-CD1 4.03Å; L234-I238 HydrophobicContact CD1-CG1 4.41Å; L234-I238 HydrophobicContact CG-CD1 3.84Å; L234-I238 WeakPolarHBondContact O-CB 3.48Å; L234-I238 VanDerWaalsContact O-CG1 3.26Å; L234-I238 WeakPolarHBondContact O-CG1 3.38Å; L234-I238 PolarHBondContact O-N 2.95Å; L234-L467 HydrophobicContact CB-CD2 4.18Å; L234-L467 HydrophobicContact CD1-CD2 4.38Å
235	V	97.7	Very high	96.4	Very high	91 Å²	91	57.9 Å²	57.9	55%	0.552	32%	0.318	S	S	*	.	H	α-helix	trans	-61.6	-43.4	176.9	170.4	0	0	0	0	111	M231 S232 I238 S239	M231-V235 VanDerWaalsContact O-CG2 3.3Å; M231-V235 WeakPolarHBondContact O-CG2 3.4Å; M231-V235 PolarHBondContact O-N 3.46Å; S232-V235 PolarHBondContact O-N 2.98Å; V235-I238 PolarHBondContact O-N 3.3Å; V235-S239 VanDerWaalsContact O-CB 3.32Å; V235-S239 WeakPolarHBondContact O-CB 3.21Å; V235-S239 PolarHBondContact O-N 2.67Å; V235-S239 PolarHBondContact O-OG 3.48Å
236	I	96.7	Very high	96.4	Very high	96 Å²	96	57 Å²	57	49%	0.492	31%	0.308	S	S	.	.	H	α-helix	trans	-60.5	-50.3	176.7	-69.3	164.7	0	0	0	110.4	S232 V233 L234 I238 S239 L240	S232-I236 WeakPolarHBondContact O-CD1 3.03Å; S232-I236 VanDerWaalsContact O-CG1 3.24Å; S232-I236 WeakPolarHBondContact O-CG1 3.44Å; S232-I236 PolarHBondContact O-N 3.18Å; V233-I236 PolarHBondContact O-N 2.97Å; L234-I236 PolarHBondContact O-N 3.38Å; I236-I238 PolarHBondContact O-N 3.3Å; I236-S239 PolarHBondContact O-N 3.44Å; I236-S239 PolarHBondContact O-OG 3.39Å; I236-L240 HydrophobicContact CG2-CD1 4.06Å; I236-L240 WeakPolarHBondContact O-CG 3.25Å; I236-L240 PolarHBondContact O-N 3.4Å
237	V	95.8	Very high	96.3	Very high	23 Å²	23	55.9 Å²	55.9	14%	0.139	31%	0.308	C	S	.	.	H	α-helix	trans	-60	-46.2	179.4	168.5	0	0	0	0	111.3	V233 L234 S239 L240 L241 L463 A751	V233-V237 HydrophobicContact CG1-CG2 4.38Å; V233-V237 WeakPolarHBondContact O-CG2 3.33Å; V233-V237 PolarHBondContact O-N 3.13Å; L234-V237 PolarHBondContact O-N 2.9Å; V237-S239 VanDerWaalsContact C-N 3.34Å; V237-S239 PolarHBondContact O-N 3.5Å; V237-L240 PolarHBondContact O-N 2.89Å; V237-L241 HydrophobicContact CG1-CD1 4.11Å; V237-L241 HydrophobicContact CG1-CG 4.5Å; V237-L241 WeakPolarHBondContact O-CG 3.25Å; V237-L241 PolarHBondContact O-N 3.19Å; V237-L463 HydrophobicContact CG2-CD1 4.22Å; V237-A751 HydrophobicContact CG1-CB 3.5Å
238	I	96.3	Very high	96	Very high	79 Å²	79	54.8 Å²	54.8	41%	0.405	30%	0.303	S	S	.	.	H	α-helix	trans	-61.9	-43.9	177.8	-69.8	170.4	0	0	0	110.4	L234 V235 I236 L240 L241 I242	L234-I238 HydrophobicContact CD1-CD1 4.03Å; L234-I238 HydrophobicContact CD1-CG1 4.41Å; L234-I238 HydrophobicContact CG-CD1 3.84Å; L234-I238 WeakPolarHBondContact O-CB 3.48Å; L234-I238 VanDerWaalsContact O-CG1 3.26Å; L234-I238 WeakPolarHBondContact O-CG1 3.38Å; L234-I238 PolarHBondContact O-N 2.95Å; V235-I238 PolarHBondContact O-N 3.3Å; I236-I238 PolarHBondContact O-N 3.3Å; I238-L240 VanDerWaalsContact C-N 3.31Å; I238-L240 PolarHBondContact O-N 3.01Å; I238-L241 PolarHBondContact O-N 2.98Å; I238-I242 HydrophobicContact CG2-CD1 3.67Å; I238-I242 HydrophobicContact CG2-CG1 4.28Å; I238-I242 VanDerWaalsContact O-CG1 3.31Å; I238-I242 WeakPolarHBondContact O-CG1 3.27Å; I238-I242 PolarHBondContact O-N 3.33Å
239	S	96.8	Very high	95.8	Very high	59 Å²	59	53 Å²	53	41%	0.413	30%	0.303	S	S	.	.	H	α-helix	trans	-62.3	-36.8	177.8	75.5	0	0	0	0	112.6	V235 I236 V237 S243	V235-S239 VanDerWaalsContact O-CB 3.32Å; V235-S239 WeakPolarHBondContact O-CB 3.21Å; V235-S239 PolarHBondContact O-N 2.67Å; V235-S239 PolarHBondContact O-OG 3.48Å; I236-S239 PolarHBondContact O-N 3.44Å; I236-S239 PolarHBondContact O-OG 3.39Å; V237-S239 VanDerWaalsContact C-N 3.34Å; V237-S239 PolarHBondContact O-N 3.5Å; S239-S243 VanDerWaalsContact O-CB 3.28Å; S239-S243 WeakPolarHBondContact O-CB 3.36Å; S239-S243 PolarHBondContact O-N 3.38Å; S239-S243 PolarHBondContact O-OG 2.9Å
240	L	95.9	Very high	95.5	Very high	45 Å²	45	54.4 Å²	54.4	24%	0.236	31%	0.312	C	S	.	.	H	α-helix	trans	-67.2	-42.9	174.4	-72.2	172.9	0	0	0	111.7	I236 V237 I238 S243 G244 Y332	I236-L240 HydrophobicContact CG2-CD1 4.06Å; I236-L240 WeakPolarHBondContact O-CG 3.25Å; I236-L240 PolarHBondContact O-N 3.4Å; V237-L240 PolarHBondContact O-N 2.89Å; I238-L240 VanDerWaalsContact C-N 3.31Å; I238-L240 PolarHBondContact O-N 3.01Å; L240-S243 WeakPolarHBondContact CA-OG 3.47Å; L240-S243 PolarHBondContact O-OG 2.69Å; L240-S243 VanDerWaalsContact O-OG 3.06Å; L240-G244 PolarHBondContact O-N 3.12Å; L240-Y332 HydrophobicContact CB-CD1 3.82Å; L240-Y332 HydrophobicContact CB-CD2 4.26Å; L240-Y332 HydrophobicContact CB-CE1 4.13Å; L240-Y332 HydrophobicContact CB-CG 3.89Å; L240-Y332 HydrophobicContact CD1-CE1 4.02Å; L240-Y332 HydrophobicContact CD1-CE2 4.23Å; L240-Y332 VanDerWaalsContact O-CB 3.24Å; L240-Y332 WeakPolarHBondContact O-CB 3.18Å
241	L	96	Very high	95.1	Very high	31 Å²	31	55.1 Å²	55.1	16%	0.162	32%	0.315	C	S	.	.	H	α-helix	trans	-64.1	-42.9	176.2	-68.8	173.9	0	0	0	112	V237 I238 T245 Y332 V334	V237-L241 HydrophobicContact CG1-CD1 4.11Å; V237-L241 HydrophobicContact CG1-CG 4.5Å; V237-L241 WeakPolarHBondContact O-CG 3.25Å; V237-L241 PolarHBondContact O-N 3.19Å; I238-L241 PolarHBondContact O-N 2.98Å; L241-T245 VanDerWaalsContact O-CB 3.31Å; L241-T245 WeakPolarHBondContact O-CB 3.49Å; L241-T245 PolarHBondContact O-N 3.12Å; L241-T245 PolarHBondContact O-OG1 2.87Å; L241-Y332 HydrophobicContact CD2-CD1 4.24Å; L241-Y332 WeakPolarHBondContact CD2-O 3.22Å; L241-V334 HydrophobicContact CB-CG2 4.3Å; L241-V334 HydrophobicContact CD2-CG2 4.05Å
242	I	96.4	Very high	94.7	Very high	101 Å²	101	57.6 Å²	57.6	52%	0.518	32%	0.321	S	S	.	.	H	α-helix	trans	-64.6	-52.1	176.8	-67.9	170.8	0	0	0	109.8	I238 G244 T245 V246	I238-I242 HydrophobicContact CG2-CD1 3.67Å; I238-I242 HydrophobicContact CG2-CG1 4.28Å; I238-I242 VanDerWaalsContact O-CG1 3.31Å; I238-I242 WeakPolarHBondContact O-CG1 3.27Å; I238-I242 PolarHBondContact O-N 3.33Å; I242-G244 PolarHBondContact O-N 3.31Å; I242-T245 PolarHBondContact O-N 2.66Å; I242-T245 VanDerWaalsContact O-N 3.13Å; I242-V246 HydrophobicContact CG2-CG2 4.32Å; I242-V246 WeakPolarHBondContact O-CG2 3.42Å; I242-V246 PolarHBondContact O-N 3.42Å
243	S	95.8	Very high	94.4	Very high	39 Å²	39	57.9 Å²	57.9	27%	0.273	32%	0.322	S	S	.	.	H	α-helix	trans	-62	-41.7	-178.5	55.8	0	0	0	0	112.5	S239 L240 T245 V246 V247 I329	S239-S243 VanDerWaalsContact O-CB 3.28Å; S239-S243 WeakPolarHBondContact O-CB 3.36Å; S239-S243 PolarHBondContact O-N 3.38Å; S239-S243 PolarHBondContact O-OG 2.9Å; L240-S243 WeakPolarHBondContact CA-OG 3.47Å; L240-S243 PolarHBondContact O-OG 2.69Å; L240-S243 VanDerWaalsContact O-OG 3.06Å; S243-T245 VanDerWaalsContact C-N 3.32Å; S243-T245 PolarHBondContact O-N 3Å; S243-V246 PolarHBondContact O-N 2.92Å; S243-V247 WeakPolarHBondContact O-CG2 3.33Å; S243-V247 PolarHBondContact O-N 2.73Å; S243-I329 WeakPolarHBondContact OG-CG2 3.46Å
244	G	94.3	Very high	93.9	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-61	-40	173.5	0	0	0	0	0	112.9	L240 I242 V247 D248 I329 S333	L240-G244 PolarHBondContact O-N 3.12Å; I242-G244 PolarHBondContact O-N 3.31Å; G244-V247 PolarHBondContact O-N 2.83Å; G244-D248 PolarHBondContact O-N 3.45Å; G244-I329 WeakPolarHBondContact CA-O 3.11Å; G244-S333 WeakPolarHBondContact O-CB 3.44Å
245	T	95.3	Very high	93.5	Very high	41 Å²	41	55.5 Å²	55.5	25%	0.252	32%	0.316	S	S	.	.	H	α-helix	trans	-69.1	-38.6	177.1	-57.7	0	0	0	0	111.9	L241 I242 S243 D248 L249 V334 P335	L241-T245 VanDerWaalsContact O-CB 3.31Å; L241-T245 WeakPolarHBondContact O-CB 3.49Å; L241-T245 PolarHBondContact O-N 3.12Å; L241-T245 PolarHBondContact O-OG1 2.87Å; I242-T245 PolarHBondContact O-N 2.66Å; I242-T245 VanDerWaalsContact O-N 3.13Å; S243-T245 VanDerWaalsContact C-N 3.32Å; S243-T245 PolarHBondContact O-N 3Å; T245-D248 PolarHBondContact O-N 3.25Å; T245-L249 WeakPolarHBondContact O-CB 3.39Å; T245-L249 PolarHBondContact O-N 2.86Å; T245-V334 PolarHBondContact OG1-N 3.46Å; T245-P335 HydrophobicContact CG2-CG 4.07Å
246	V	95.3	Very high	92.9	Very high	76 Å²	76	53.9 Å²	53.9	46%	0.461	31%	0.305	S	S	.	.	H	α-helix	trans	-63.1	-42.5	175	169.9	0	0	0	0	111.1	I242 S243 D248 L249 V250	I242-V246 HydrophobicContact CG2-CG2 4.32Å; I242-V246 WeakPolarHBondContact O-CG2 3.42Å; I242-V246 PolarHBondContact O-N 3.42Å; S243-V246 PolarHBondContact O-N 2.92Å; V246-D248 PolarHBondContact O-N 3.45Å; V246-L249 WeakPolarHBondContact O-CB 3.44Å; V246-L249 PolarHBondContact O-N 3.34Å; V246-V250 WeakPolarHBondContact O-CG2 3.26Å; V246-V250 PolarHBondContact O-N 3.44Å
247	V	92.7	Very high	92.5	Very high	33 Å²	33	57 Å²	57	20%	0.2	31%	0.311	C	S	.	.	H	α-helix	trans	-59	-48.1	176.2	172.1	0	0	0	0	110.9	S243 G244 L249 V250 L251 I326 I329 A330	S243-V247 WeakPolarHBondContact O-CG2 3.33Å; S243-V247 PolarHBondContact O-N 2.73Å; G244-V247 PolarHBondContact O-N 2.83Å; V247-L249 VanDerWaalsContact C-N 3.34Å; V247-L249 PolarHBondContact O-N 2.95Å; V247-V250 PolarHBondContact O-N 3.25Å; V247-L251 HydrophobicContact CG1-CD1 4.32Å; V247-L251 WeakPolarHBondContact O-CG 3.41Å; V247-L251 PolarHBondContact O-N 3.42Å; V247-I326 HydrophobicContact CG1-CG2 4.05Å; V247-I326 HydrophobicContact CG2-CG2 4.23Å; V247-I329 HydrophobicContact CG2-CG2 4.21Å; V247-A330 HydrophobicContact CG1-CB 3.96Å
248	D	90.2	Very high	91.9	Very high	5 Å²	5	63.6 Å²	63.6	3%	0.027	33%	0.334	C	S	.	.	H	α-helix	trans	-66.6	-34.7	178.3	-96.5	17	0	0	0	112.5	G244 T245 V246 L251 W252 Y311 R315 S333 Y336	G244-D248 PolarHBondContact O-N 3.45Å; T245-D248 PolarHBondContact O-N 3.25Å; V246-D248 PolarHBondContact O-N 3.45Å; D248-L251 PolarHBondContact O-N 3.12Å; D248-W252 VanDerWaalsContact O-CB 3.32Å; D248-W252 WeakPolarHBondContact O-CB 3.47Å; D248-W252 PolarHBondContact O-N 2.98Å; D248-Y311 PolarHBondContact O-OH 3.42Å; D248-R315 IonicContact OD1-CZ 3.55Å; D248-R315 IonicContact OD1-NE 3.91Å; D248-R315 PolarHBondContact OD1-NE 3.39Å; D248-R315 IonicContact OD1-NH2 2.86Å; D248-R315 IonicContact OD2-NE 3.83Å; D248-S333 WeakPolarHBondContact CB-OG 3.49Å; D248-S333 WeakPolarHBondContact OD2-CB 2.99Å; D248-S333 PolarHBondContact OD2-OG 3.34Å; D248-Y336 WeakPolarHBondContact OD2-CB 3.38Å
249	L	92.2	Very high	91.3	Very high	103 Å²	103	62.1 Å²	62.1	54%	0.539	33%	0.326	S	S	.	.	H	α-helix	trans	-62.2	-43.6	173.3	-176.9	66.4	0	0	0	111.3	T245 V246 V247 W252 C253	T245-L249 WeakPolarHBondContact O-CB 3.39Å; T245-L249 PolarHBondContact O-N 2.86Å; V246-L249 WeakPolarHBondContact O-CB 3.44Å; V246-L249 PolarHBondContact O-N 3.34Å; V247-L249 VanDerWaalsContact C-N 3.34Å; V247-L249 PolarHBondContact O-N 2.95Å; L249-W252 WeakPolarHBondContact O-CB 3.21Å; L249-W252 PolarHBondContact O-N 3.49Å; L249-C253 WeakPolarHBondContact O-CB 3.47Å; L249-C253 PolarHBondContact O-N 3.06Å; L249-C253 PolarHBondContact O-SG 2.69Å; L249-C253 VanDerWaalsContact O-SG 3.36Å
250	V	92.3	Very high	90.7	Very high	95 Å²	95	63.3 Å²	63.3	58%	0.576	33%	0.333	S	S	*	.	H	α-helix	trans	-63.1	-43.1	175.9	171.1	0	0	0	0	111.1	V246 V247 W252 C253 G254	V246-V250 WeakPolarHBondContact O-CG2 3.26Å; V246-V250 PolarHBondContact O-N 3.44Å; V247-V250 PolarHBondContact O-N 3.25Å; V250-W252 VanDerWaalsContact C-N 3.32Å; V250-W252 PolarHBondContact O-N 3.23Å; V250-C253 PolarHBondContact O-N 3.05Å; V250-G254 PolarHBondContact O-N 3.35Å
251	L	89.2	Confident	90.1	Very high	15 Å²	15	65.2 Å²	65.2	8%	0.079	34%	0.341	C	S	.	.	H	α-helix	trans	-61.9	-41.1	175.2	-67	176	0	0	0	111.8	V247 D248 G254 L255 Y311 R315 I318 L319	V247-L251 HydrophobicContact CG1-CD1 4.32Å; V247-L251 WeakPolarHBondContact O-CG 3.41Å; V247-L251 PolarHBondContact O-N 3.42Å; D248-L251 PolarHBondContact O-N 3.12Å; L251-G254 PolarHBondContact O-N 3.02Å; L251-L255 WeakPolarHBondContact O-CB 3.38Å; L251-L255 PolarHBondContact O-N 3.49Å; L251-Y311 HydrophobicContact CB-CE2 4.41Å; L251-R315 HydrophobicContact CD1-CG 4.09Å; L251-I318 HydrophobicContact CD2-CB 4.01Å; L251-I318 HydrophobicContact CD2-CD1 3.83Å; L251-I318 HydrophobicContact CD2-CG2 3.51Å; L251-L319 HydrophobicContact CD1-CD2 4.34Å; L251-L319 HydrophobicContact CD1-CG 4.31Å
252	W	88.9	Confident	89.4	Confident	119 Å²	119	69.4 Å²	69.4	45%	0.451	36%	0.358	S	S	.	.	H	α-helix	trans	-65	-47.6	177.1	-177.3	-82.9	0	0	0	111.9	D248 L249 V250 G254 L255 N256 Y311	D248-W252 VanDerWaalsContact O-CB 3.32Å; D248-W252 WeakPolarHBondContact O-CB 3.47Å; D248-W252 PolarHBondContact O-N 2.98Å; L249-W252 WeakPolarHBondContact O-CB 3.21Å; L249-W252 PolarHBondContact O-N 3.49Å; V250-W252 VanDerWaalsContact C-N 3.32Å; V250-W252 PolarHBondContact O-N 3.23Å; W252-G254 VanDerWaalsContact C-N 3.35Å; W252-G254 PolarHBondContact O-N 2.91Å; W252-L255 PolarHBondContact O-N 3.49Å; W252-N256 VanDerWaalsContact CD1-ND2 3.34Å; W252-N256 PolarHBondContact NE1-ND2 3.37Å; W252-N256 PolarHBondContact O-N 2.99Å; W252-Y311 HydrophobicContact CB-CE2 4.06Å; W252-Y311 HydrophobicContact CE3-CD1 4.33Å; W252-Y311 AromaticContact CE3-CD2 3.69Å; W252-Y311 HydrophobicContact CE3-CD2 3.69Å; W252-Y311 HydrophobicContact CE3-CE1 4.37Å; W252-Y311 AromaticContact CE3-CE2 3.75Å; W252-Y311 HydrophobicContact CE3-CE2 3.75Å; W252-Y311 HydrophobicContact CE3-CG 4Å; W252-Y311 HydrophobicContact CZ3-CD1 4.35Å; W252-Y311 HydrophobicContact CZ3-CD2 4.25Å; W252-Y311 HydrophobicContact CZ3-CG 4.11Å
253	C	91	Very high	88.7	Confident	70 Å²	70	67.2 Å²	67.2	47%	0.473	35%	0.352	S	S	.	.	H	α-helix	trans	-60.6	-43	175.3	-72.8	0	0	0	0	111.7	L249 V250 L255 N256 Y257	L249-C253 WeakPolarHBondContact O-CB 3.47Å; L249-C253 PolarHBondContact O-N 3.06Å; L249-C253 PolarHBondContact O-SG 2.69Å; L249-C253 VanDerWaalsContact O-SG 3.36Å; V250-C253 PolarHBondContact O-N 3.05Å; C253-L255 VanDerWaalsContact C-N 3.34Å; C253-L255 PolarHBondContact O-N 3.49Å; C253-N256 PolarHBondContact O-N 2.7Å; C253-Y257 WeakPolarHBondContact O-CB 3.25Å; C253-Y257 PolarHBondContact O-N 3.44Å
254	G	87	Confident	87.9	Confident	32 Å²	32	72 Å²	72	33%	0.33	37%	0.365	S	S	.	.	H	α-helix	trans	-63.3	-36.9	176.9	0	0	0	0	0	113.3	V250 L251 W252 R258	V250-G254 PolarHBondContact O-N 3.35Å; L251-G254 PolarHBondContact O-N 3.02Å; W252-G254 VanDerWaalsContact C-N 3.35Å; W252-G254 PolarHBondContact O-N 2.91Å; G254-R258 PolarHBondContact O-N 3.18Å
255	L	87.3	Confident	87.1	Confident	13 Å²	13	75.9 Å²	75.9	7%	0.068	39%	0.386	C	S	.	.	H	α-helix	trans	-66.5	-48.3	173.4	-179.8	62.4	0	0	0	111.6	L251 W252 C253 Y257 R258 I259 Y307 Y311 H314	L251-L255 WeakPolarHBondContact O-CB 3.38Å; L251-L255 PolarHBondContact O-N 3.49Å; W252-L255 PolarHBondContact O-N 3.49Å; C253-L255 VanDerWaalsContact C-N 3.34Å; C253-L255 PolarHBondContact O-N 3.49Å; L255-Y257 VanDerWaalsContact C-N 3.3Å; L255-Y257 PolarHBondContact O-N 2.97Å; L255-R258 PolarHBondContact O-N 2.93Å; L255-I259 HydrophobicContact CD1-CD1 3.73Å; L255-I259 HydrophobicContact CD1-CG1 4.34Å; L255-I259 HydrophobicContact CG-CD1 3.82Å; L255-I259 WeakPolarHBondContact O-CG1 3.34Å; L255-I259 PolarHBondContact O-N 2.91Å; L255-Y307 HydrophobicContact CD2-CE1 4.41Å; L255-Y311 HydrophobicContact CD2-CD2 3.78Å; L255-Y311 HydrophobicContact CD2-CG 4.33Å; L255-H314 HydrophobicContact CD1-CB 4.25Å; L255-H314 HydrophobicContact CD2-CB 4.5Å
256	N	86.2	Confident	86.2	Confident	57 Å²	57	80.8 Å²	80.8	31%	0.305	40%	0.399	S	S	.	.	H	α-helix	trans	-63.3	-37.8	179.8	-73.9	-9.8	0	0	0	112	W252 C253 I259 C260 Y307	W252-N256 VanDerWaalsContact CD1-ND2 3.34Å; W252-N256 PolarHBondContact NE1-ND2 3.37Å; W252-N256 PolarHBondContact O-N 2.99Å; C253-N256 PolarHBondContact O-N 2.7Å; N256-I259 PolarHBondContact O-N 3.23Å; N256-C260 VanDerWaalsContact O-CB 3.29Å; N256-C260 WeakPolarHBondContact O-CB 3.42Å; N256-C260 PolarHBondContact O-N 2.91Å; N256-Y307 PolarHBondContact OD1-OH 2.95Å
257	Y	87.7	Confident	85.3	Confident	160 Å²	160	82.9 Å²	82.9	63%	0.627	41%	0.408	S	S	*	.	H	α-helix	trans	-59.7	-50.9	173.7	179	-97.6	0	0	0	111.2	C253 L255 I259 C260 E261	C253-Y257 WeakPolarHBondContact O-CB 3.25Å; C253-Y257 PolarHBondContact O-N 3.44Å; L255-Y257 VanDerWaalsContact C-N 3.3Å; L255-Y257 PolarHBondContact O-N 2.97Å; Y257-I259 VanDerWaalsContact C-N 3.27Å; Y257-I259 PolarHBondContact O-N 3.4Å; Y257-C260 WeakPolarHBondContact O-CB 3.24Å; Y257-C260 PolarHBondContact O-N 3.41Å; Y257-C260 VanDerWaalsContact O-N 3.15Å; Y257-E261 WeakPolarHBondContact O-CB 3.34Å; Y257-E261 PolarHBondContact O-N 3.31Å
258	R	83.7	Confident	84.4	Confident	163 Å²	163	83.9 Å²	83.9	62%	0.615	41%	0.411	S	S	*	.	H	α-helix	trans	-59.4	-35.9	177.3	-77.4	-178.2	-178	-97.1	-2	113.3	G254 L255 F262	G254-R258 PolarHBondContact O-N 3.18Å; L255-R258 PolarHBondContact O-N 2.93Å; R258-F262 VanDerWaalsContact O-CB 3.32Å; R258-F262 WeakPolarHBondContact O-CB 3.37Å; R258-F262 PolarHBondContact O-N 3.36Å
259	I	82.6	Confident	83.5	Confident	47 Å²	47	89.9 Å²	89.9	24%	0.241	44%	0.443	C	S	.	.	H	α-helix	trans	-76.1	-34.9	179.8	-67.4	171	0	0	0	110.8	L255 N256 Y257 S263 Y307	L255-I259 HydrophobicContact CD1-CD1 3.73Å; L255-I259 HydrophobicContact CD1-CG1 4.34Å; L255-I259 HydrophobicContact CG-CD1 3.82Å; L255-I259 WeakPolarHBondContact O-CG1 3.34Å; L255-I259 PolarHBondContact O-N 2.91Å; N256-I259 PolarHBondContact O-N 3.23Å; Y257-I259 VanDerWaalsContact C-N 3.27Å; Y257-I259 PolarHBondContact O-N 3.4Å; I259-S263 VanDerWaalsContact O-CB 3.31Å; I259-S263 WeakPolarHBondContact O-CB 3.36Å; I259-S263 PolarHBondContact O-N 2.65Å; I259-S263 PolarHBondContact O-OG 3.49Å; I259-Y307 VanDerWaalsContact CB-OH 3.26Å; I259-Y307 WeakPolarHBondContact CB-OH 3.14Å; I259-Y307 HydrophobicContact CD1-CD1 4.41Å; I259-Y307 HydrophobicContact CD1-CD2 4.46Å; I259-Y307 HydrophobicContact CD1-CE1 3.55Å; I259-Y307 HydrophobicContact CD1-CE2 3.62Å; I259-Y307 WeakPolarHBondContact CD1-OH 3.14Å; I259-Y307 HydrophobicContact CG2-CE2 3.88Å; I259-Y307 WeakPolarHBondContact CG2-OH 3.43Å
260	C	84.7	Confident	82.4	Confident	84 Å²	84	91.1 Å²	91.1	57%	0.568	46%	0.455	S	S	*	.	H	α-helix	trans	-65.4	-47	172	-172	0	0	0	0	110.9	N256 Y257 F262 S263 Y264	N256-C260 VanDerWaalsContact O-CB 3.29Å; N256-C260 WeakPolarHBondContact O-CB 3.42Å; N256-C260 PolarHBondContact O-N 2.91Å; Y257-C260 WeakPolarHBondContact O-CB 3.24Å; Y257-C260 PolarHBondContact O-N 3.41Å; Y257-C260 VanDerWaalsContact O-N 3.15Å; C260-F262 PolarHBondContact O-N 3.03Å; C260-S263 CarbonylContact O-C 3.59Å; C260-S263 PolarHBondContact O-N 3.49Å; C260-S263 VanDerWaalsContact O-N 3.16Å; C260-Y264 VanDerWaalsContact O-CB 3.28Å; C260-Y264 WeakPolarHBondContact O-CB 3.28Å; C260-Y264 PolarHBondContact O-N 2.88Å
261	E	82.9	Confident	80.7	Confident	86 Å²	86	90.3 Å²	90.3	40%	0.402	45%	0.454	S	S	.	.	H	α-helix	trans	-54.9	-52	173.3	-175.1	-178.7	-163.9	0	0	111	Y257 S263 Y264 D265	Y257-E261 WeakPolarHBondContact O-CB 3.34Å; Y257-E261 PolarHBondContact O-N 3.31Å; E261-S263 VanDerWaalsContact C-N 3.29Å; E261-S263 PolarHBondContact O-N 3.47Å; E261-Y264 PolarHBondContact O-N 2.87Å; E261-Y264 VanDerWaalsContact O-N 3.13Å; E261-D265 PolarHBondContact O-N 3.19Å
262	F	80.7	Confident	78.6	Confident	118 Å²	118	96.5 Å²	96.5	52%	0.518	48%	0.484	S	S	.	.	H	α-helix	trans	-62.1	-34	177.2	-177.4	-107.4	0	0	0	113.7	R258 C260 R266	R258-F262 VanDerWaalsContact O-CB 3.32Å; R258-F262 WeakPolarHBondContact O-CB 3.37Å; R258-F262 PolarHBondContact O-N 3.36Å; C260-F262 PolarHBondContact O-N 3.03Å; F262-R266 VanDerWaalsContact CE1-NH2 3.26Å; F262-R266 PolarHBondContact O-N 3.38Å
263	S	81.8	Confident	76.4	Confident	55 Å²	55	96.2 Å²	96.2	39%	0.385	50%	0.497	S	S	.	.	H	α-helix	trans	-73.9	-36.2	176	-56.6	0	0	0	0	111.6	I259 C260 E261 L267	I259-S263 VanDerWaalsContact O-CB 3.31Å; I259-S263 WeakPolarHBondContact O-CB 3.36Å; I259-S263 PolarHBondContact O-N 2.65Å; I259-S263 PolarHBondContact O-OG 3.49Å; C260-S263 CarbonylContact O-C 3.59Å; C260-S263 PolarHBondContact O-N 3.49Å; C260-S263 VanDerWaalsContact O-N 3.16Å; E261-S263 VanDerWaalsContact C-N 3.29Å; E261-S263 PolarHBondContact O-N 3.47Å; S263-L267 PolarHBondContact O-N 3.41Å; S263-L267 VanDerWaalsContact O-N 3.07Å
264	Y	79.9	Confident	74.1	Confident	141 Å²	141	97 Å²	97	55%	0.553	51%	0.508	S	S	*	.	H	α-helix	trans	-69.1	-45.3	176.6	-178	-104.5	0	0	0	112	C260 E261 R266 L267 I268	C260-Y264 VanDerWaalsContact O-CB 3.28Å; C260-Y264 WeakPolarHBondContact O-CB 3.28Å; C260-Y264 PolarHBondContact O-N 2.88Å; E261-Y264 PolarHBondContact O-N 2.87Å; E261-Y264 VanDerWaalsContact O-N 3.13Å; Y264-R266 VanDerWaalsContact C-N 3.27Å; Y264-R266 PolarHBondContact O-N 3.48Å; Y264-L267 CarbonylContact O-C 3.6Å; Y264-L267 WeakPolarHBondContact O-CA 3.24Å; Y264-L267 WeakPolarHBondContact O-CB 3.42Å; Y264-L267 PolarHBondContact O-N 2.93Å; Y264-I268 HydrophobicContact CD1-CD1 3.78Å; Y264-I268 HydrophobicContact CD1-CG1 4.4Å; Y264-I268 HydrophobicContact CE1-CD1 3.15Å; Y264-I268 HydrophobicContact CE1-CG1 4.05Å; Y264-I268 HydrophobicContact CE2-CD1 4.29Å; Y264-I268 HydrophobicContact CE2-CG1 4.46Å; Y264-I268 VanDerWaalsContact CZ-CD1 3.45Å; Y264-I268 PolarHBondContact O-N 3.4Å
265	D	77.1	Confident	71.5	Confident	81 Å²	81	105 Å²	105	43%	0.433	54%	0.538	S	S	.	.	H	α-helix	trans	-58.4	-39.6	174.3	-77	-17.4	0	0	0	111.8	E261 L267 I268 N269	E261-D265 PolarHBondContact O-N 3.19Å; D265-L267 VanDerWaalsContact C-N 3.35Å; D265-I268 PolarHBondContact O-N 2.79Å; D265-N269 WeakPolarHBondContact O-CB 3.5Å; D265-N269 VanDerWaalsContact O-CG 3.26Å; D265-N269 PolarHBondContact O-N 2.91Å; D265-N269 PolarHBondContact O-ND2 3.26Å
266	R	76.3	Confident	69.1	Low	143 Å²	143	108.3 Å²	108.3	54%	0.54	57%	0.566	S	S	.	*	H	α-helix	trans	-65	-38.6	172.4	-85.1	-165.1	-69.9	-166.5	2.9	112.5	F262 Y264 V270	F262-R266 VanDerWaalsContact CE1-NH2 3.26Å; F262-R266 PolarHBondContact O-N 3.38Å; Y264-R266 VanDerWaalsContact C-N 3.27Å; Y264-R266 PolarHBondContact O-N 3.48Å; R266-V270 VanDerWaalsContact O-CG2 3.29Å; R266-V270 WeakPolarHBondContact O-CG2 3.34Å; R266-V270 PolarHBondContact O-N 2.93Å
267	L	76.1	Confident	66.3	Low	121 Å²	121	110.4 Å²	110.4	63%	0.634	59%	0.585	S	S	*	*	H	α-helix	trans	-66.4	-41.7	177.8	-149.7	95.2	0	0	0	111.5	S263 Y264 D265 V270 S271	S263-L267 PolarHBondContact O-N 3.41Å; S263-L267 VanDerWaalsContact O-N 3.07Å; Y264-L267 CarbonylContact O-C 3.6Å; Y264-L267 WeakPolarHBondContact O-CA 3.24Å; Y264-L267 WeakPolarHBondContact O-CB 3.42Å; Y264-L267 PolarHBondContact O-N 2.93Å; D265-L267 VanDerWaalsContact C-N 3.35Å; L267-V270 PolarHBondContact O-N 2.93Å; L267-S271 WeakPolarHBondContact O-CB 3.47Å; L267-S271 PolarHBondContact O-N 3.28Å; L267-S271 PolarHBondContact O-OG 3.01Å
268	I	74.1	Confident	63.4	Low	53 Å²	53	109 Å²	109	27%	0.272	59%	0.594	S	S	.	*	H	α-helix	trans	-65	-45.8	175.9	-71.5	-178.7	0	0	0	111.5	Y264 D265 V270 S271 M272	Y264-I268 HydrophobicContact CD1-CD1 3.78Å; Y264-I268 HydrophobicContact CD1-CG1 4.4Å; Y264-I268 HydrophobicContact CE1-CD1 3.15Å; Y264-I268 HydrophobicContact CE1-CG1 4.05Å; Y264-I268 HydrophobicContact CE2-CD1 4.29Å; Y264-I268 HydrophobicContact CE2-CG1 4.46Å; Y264-I268 VanDerWaalsContact CZ-CD1 3.45Å; Y264-I268 PolarHBondContact O-N 3.4Å; D265-I268 PolarHBondContact O-N 2.79Å; I268-V270 PolarHBondContact O-N 3.34Å; I268-S271 WeakPolarHBondContact CA-OG 3.49Å; I268-S271 CarbonylContact O-C 3.56Å; I268-S271 PolarHBondContact O-N 3.33Å; I268-S271 PolarHBondContact O-OG 3.42Å; I268-M272 HydrophobicContact CG2-CG 4.11Å; I268-M272 HydrophobicContact CG2-SD 4.44Å; I268-M272 PolarHBondContact O-N 3.04Å
269	N	71.1	Confident	60.7	Low	132 Å²	132	106.5 Å²	106.5	71%	0.706	60%	0.601	S	S	*	*	H	α-helix	trans	-64.5	-21.4	179.9	-73.3	-19.3	0	0	0	112.7	D265	D265-N269 WeakPolarHBondContact O-CB 3.5Å; D265-N269 VanDerWaalsContact O-CG 3.26Å; D265-N269 PolarHBondContact O-N 2.91Å; D265-N269 PolarHBondContact O-ND2 3.26Å
270	V	70.6	Confident	58	Low	129 Å²	129	110 Å²	110	78%	0.782	63%	0.63	S	S	*	*	H	α-helix	trans	-84.8	-29.7	170.9	174.8	0	0	0	0	111.8	R266 L267 I268	R266-V270 VanDerWaalsContact O-CG2 3.29Å; R266-V270 WeakPolarHBondContact O-CG2 3.34Å; R266-V270 PolarHBondContact O-N 2.93Å; L267-V270 PolarHBondContact O-N 2.93Å; I268-V270 PolarHBondContact O-N 3.34Å
271	S	56.9	Low	55.3	Low	78 Å²	78	109.6 Å²	109.6	55%	0.545	64%	0.64	S	S	.	*	H	α-helix	trans	-97	-6.4	-174.4	70.3	0	0	0	0	115.8	L267 I268 P273	L267-S271 WeakPolarHBondContact O-CB 3.47Å; L267-S271 PolarHBondContact O-N 3.28Å; L267-S271 PolarHBondContact O-OG 3.01Å; I268-S271 WeakPolarHBondContact CA-OG 3.49Å; I268-S271 CarbonylContact O-C 3.56Å; I268-S271 PolarHBondContact O-N 3.33Å; I268-S271 PolarHBondContact O-OG 3.42Å; S271-P273 VanDerWaalsContact C-CD 3.48Å; S271-P273 WeakPolarHBondContact O-CD 3.41Å
272	M	43.9	Very low	52.6	Low	144 Å²	144	110 Å²	110	71%	0.709	66%	0.658	S	S	*	*			trans	-87.7	95.6	164.4	-69.7	-156.4	114.2	0	0	110	I268 A274	I268-M272 HydrophobicContact CG2-CG 4.11Å; I268-M272 HydrophobicContact CG2-SD 4.44Å; I268-M272 PolarHBondContact O-N 3.04Å; M272-A274 VanDerWaalsContact C-N 3.26Å; M272-A274 PolarHBondContact O-N 3.24Å
273	P	42.8	Very low	50	Low	114 Å²	114	112.3 Å²	112.3	74%	0.74	67%	0.674	S	S	*	*			trans	-68.2	93.9	161.3	29.6	-32.5	0	0	0	106.9	S271 E275	S271-P273 VanDerWaalsContact C-CD 3.48Å; S271-P273 WeakPolarHBondContact O-CD 3.41Å; P273-E275 PolarHBondContact O-N 3.36Å; P273-E275 VanDerWaalsContact O-N 3.16Å
274	A	43.3	Very low	47.5	Very low	85 Å²	85	115.6 Å²	115.6	70%	0.702	69%	0.692	S	S	*	*			trans	-54.1	122.2	152.3	0	0	0	0	0	106	M272 A276	M272-A274 VanDerWaalsContact C-N 3.26Å; M272-A274 PolarHBondContact O-N 3.24Å; A274-A276 VanDerWaalsContact C-N 3.32Å; A274-A276 PolarHBondContact O-N 3.31Å
275	E	32.5	Very low	44.9	Very low	202 Å²	202	115.8 Å²	115.8	94%	0.944	70%	0.702	S	S	*	*			trans	-45.3	93.5	177.9	-65.1	168.5	154.8	0	0	110.4	P273	P273-E275 PolarHBondContact O-N 3.36Å; P273-E275 VanDerWaalsContact O-N 3.16Å
276	A	36.4	Very low	42.3	Very low	81 Å²	81	118 Å²	118	67%	0.669	72%	0.722	S	S	*	*			trans	-136.6	78	173.7	0	0	0	0	0	107	A274	A274-A276 VanDerWaalsContact C-N 3.32Å; A274-A276 PolarHBondContact O-N 3.31Å
277	S	28.2	Very low	40	Very low	101 Å²	101	116.2 Å²	116.2	71%	0.706	73%	0.732	S	S	*	*			trans	36.1	108.3	133.4	58.2	0	0	0	0	117.1
278	T	25.6	Very low	37.7	Very low	132 Å²	132	118.7 Å²	118.7	81%	0.81	74%	0.74	S	S	*	*			trans	49.8	106.2	132.6	53	0	0	0	0	117.7
279	S	27.7	Very low	35.9	Very low	109 Å²	109	122.2 Å²	122.2	76%	0.762	77%	0.765	S	S	*	*				170.4	114.4	103	59.1	0	0	0	0	111.5
280	S	25.3	Very low	34.3	Very low	121 Å²	121	120.8 Å²	120.8	85%	0.846	76%	0.761	S	S	*	*			trans	39	121.6	136.2	60.6	0	0	0	0	120.1
281	G	27.4	Very low	32.6	Very low	75 Å²	75	121.9 Å²	121.9	77%	0.773	76%	0.758	S	S	*	*			trans	170	70.8	156.7	0	0	0	0	0	117.3
282	A	27.2	Very low	31.4	Very low	95 Å²	95	125.2 Å²	125.2	79%	0.785	77%	0.765	S	S	*	*			trans	58.4	108.6	147.3	0	0	0	0	0	120.5
283	I	26.3	Very low	30.9	Very low	167 Å²	167	125.6 Å²	125.6	86%	0.856	76%	0.764	S	S	*	*			trans	-62.2	125.9	155.1	-64.4	159.1	0	0	0	109.1
284	T	28.2	Very low	30.4	Very low	124 Å²	124	125.5 Å²	125.5	76%	0.761	76%	0.758	S	S	*	*			trans	-140.4	103.9	156	-18.9	0	0	0	0	110.9
285	N	25.5	Very low	29.8	Very low	145 Å²	145	127.1 Å²	127.1	78%	0.775	75%	0.752	S	S	*	*			trans	46.7	117.4	145	-67.4	-7.3	0	0	0	122.5
286	C	23.9	Very low	29.9	Very low	126 Å²	126	123.2 Å²	123.2	85%	0.851	74%	0.737	S	S	*	*			trans	-43.7	135.1	144.9	-53.2	0	0	0	0	113.3
287	S	26.3	Very low	29.7	Very low	107 Å²	107	126 Å²	126	75%	0.748	74%	0.737	S	S	*	*				160.7	111.1	125.3	59.4	0	0	0	0	109.2
288	E	29.8	Very low	29.9	Very low	172 Å²	172	127.7 Å²	127.7	80%	0.804	73%	0.733	S	S	*	*			trans	178.9	81.8	141.5	-99.7	169.7	-165.4	0	0	108.8	T290	E288-T290 PolarHBondContact O-N 3.24Å; E288-T290 VanDerWaalsContact O-N 3.07Å
289	T	35.5	Very low	30.4	Very low	127 Å²	127	124.1 Å²	124.1	78%	0.779	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.6	91.7	164.8	43.9	0	0	0	0	109
290	T	37.7	Very low	30.9	Very low	102 Å²	102	122.8 Å²	122.8	63%	0.626	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-164.9	-20.1	154.2	35.1	0	0	0	0	112.9	E288	E288-T290 PolarHBondContact O-N 3.24Å; E288-T290 VanDerWaalsContact O-N 3.07Å
291	E	34.5	Very low	31.6	Very low	153 Å²	153	120.1 Å²	120.1	72%	0.715	68%	0.68	S	S	*	*	H	α-helix	trans	-84.3	-23.3	175.3	-69.2	-168.2	155.5	0	0	113.7	E293 N294 M295	E291-E293 VanDerWaalsContact C-N 3.33Å; E291-E293 PolarHBondContact O-N 3.33Å; E291-N294 PolarHBondContact O-N 3.25Å; E291-M295 WeakPolarHBondContact O-CB 3.34Å; E291-M295 PolarHBondContact O-N 2.88Å
292	E	32.6	Very low	32	Very low	148 Å²	148	121.5 Å²	121.5	69%	0.692	67%	0.67	S	S	*	*	H	α-helix	trans	-65.6	-31.6	178.1	-75.4	-173.3	154.4	0	0	112.8	L296	E292-L296 WeakPolarHBondContact O-CB 3.25Å; E292-L296 PolarHBondContact O-N 3.26Å
293	E	32.1	Very low	32.7	Very low	151 Å²	151	122.7 Å²	122.7	71%	0.706	66%	0.659	S	S	*	*	H	α-helix	trans	-71.2	-41.5	177.7	-72	-174.1	157.9	0	0	112.3	E291 L296 E297	E291-E293 VanDerWaalsContact C-N 3.33Å; E291-E293 PolarHBondContact O-N 3.33Å; E293-L296 PolarHBondContact O-N 3.48Å; E293-E297 PolarHBondContact O-N 2.91Å
294	N	31.8	Very low	33.7	Very low	112 Å²	112	119.1 Å²	119.1	60%	0.599	64%	0.641	S	S	*	*	H	α-helix	trans	-71.8	-36.5	177.5	-78.4	-28.7	0	0	0	112.3	E291 E297 Q298	E291-N294 PolarHBondContact O-N 3.25Å; N294-E297 PolarHBondContact O-N 3.46Å; N294-Q298 PolarHBondContact O-N 2.8Å
295	M	31.2	Very low	34.5	Very low	119 Å²	119	116.4 Å²	116.4	59%	0.586	63%	0.627	S	S	*	*	H	α-helix	trans	-69.2	-35.6	171.2	-88.8	-140.2	44.5	0	0	111.8	E291 T299	E291-M295 WeakPolarHBondContact O-CB 3.34Å; E291-M295 PolarHBondContact O-N 2.88Å; M295-T299 WeakPolarHBondContact O-CB 3.29Å; M295-T299 PolarHBondContact O-N 3.16Å; M295-T299 PolarHBondContact O-OG1 2.86Å
296	L	34.4	Very low	35.8	Very low	120 Å²	120	114.1 Å²	114.1	63%	0.628	62%	0.619	S	S	*	*	H	α-helix	trans	-63.6	-43.6	173.3	-162.3	76.2	0	0	0	110.3	E292 E293 T300	E292-L296 WeakPolarHBondContact O-CB 3.25Å; E292-L296 PolarHBondContact O-N 3.26Å; E293-L296 PolarHBondContact O-N 3.48Å; L296-T300 VanDerWaalsContact O-CB 3.26Å; L296-T300 WeakPolarHBondContact O-CB 3.47Å; L296-T300 PolarHBondContact O-N 3.25Å; L296-T300 PolarHBondContact O-OG1 3.08Å
297	E	32.3	Very low	37.2	Very low	141 Å²	141	111.4 Å²	111.4	66%	0.659	59%	0.591	S	S	*	*	H	α-helix	trans	-64	-45.6	176.5	-76.9	-166.1	158.6	0	0	113.3	E293 N294 T300 S301	E293-E297 PolarHBondContact O-N 2.91Å; N294-E297 PolarHBondContact O-N 3.46Å; E297-T300 PolarHBondContact O-N 3.17Å; E297-S301 PolarHBondContact O-N 3.31Å
298	Q	32.9	Very low	38.8	Very low	135 Å²	135	113 Å²	113	63%	0.631	58%	0.581	S	S	*	*	H	α-helix	trans	-66.1	-42	177.5	-85.7	-172.3	-10.2	0	0	112.3	N294 T300 S301 N302	N294-Q298 PolarHBondContact O-N 2.8Å; Q298-T300 VanDerWaalsContact C-N 3.33Å; Q298-T300 PolarHBondContact O-N 3.04Å; Q298-S301 PolarHBondContact O-N 3.27Å; Q298-S301 PolarHBondContact O-OG 3.08Å; Q298-N302 PolarHBondContact O-N 2.74Å; Q298-N302 VanDerWaalsContact O-N 3.08Å
299	T	36.9	Very low	40.3	Very low	57 Å²	57	110.4 Å²	110.4	35%	0.35	57%	0.571	S	S	.	*	H	α-helix	trans	-65.1	-39.3	176.7	-49.1	0	0	0	0	110.2	M295 S301 N302 H303	M295-T299 WeakPolarHBondContact O-CB 3.29Å; M295-T299 PolarHBondContact O-N 3.16Å; M295-T299 PolarHBondContact O-OG1 2.86Å; T299-S301 PolarHBondContact O-N 3.37Å; T299-N302 PolarHBondContact O-N 2.89Å; T299-H303 VanDerWaalsContact CG2-CD2 3.47Å; T299-H303 WeakPolarHBondContact CG2-CD2 3.38Å; T299-H303 WeakPolarHBondContact O-CB 3.46Å; T299-H303 PolarHBondContact O-CD2 3.12Å; T299-H303 PolarHBondContact O-N 3.13Å
300	T	36.7	Very low	42.3	Very low	81 Å²	81	106.3 Å²	106.3	50%	0.497	55%	0.548	S	S	.	.	H	α-helix	trans	-63.6	-41.7	175.8	-52.6	0	0	0	0	111.8	L296 E297 Q298 L304	L296-T300 VanDerWaalsContact O-CB 3.26Å; L296-T300 WeakPolarHBondContact O-CB 3.47Å; L296-T300 PolarHBondContact O-N 3.25Å; L296-T300 PolarHBondContact O-OG1 3.08Å; E297-T300 PolarHBondContact O-N 3.17Å; Q298-T300 VanDerWaalsContact C-N 3.33Å; Q298-T300 PolarHBondContact O-N 3.04Å; T300-L304 WeakPolarHBondContact O-CB 3.14Å; T300-L304 PolarHBondContact O-N 3.39Å
301	S	39.8	Very low	44.4	Very low	66 Å²	66	102.5 Å²	102.5	46%	0.462	52%	0.522	S	S	.	.	H	α-helix	trans	-68	-40.7	179.1	80.8	0	0	0	0	113.4	E297 Q298 T299 S305	E297-S301 PolarHBondContact O-N 3.31Å; Q298-S301 PolarHBondContact O-N 3.27Å; Q298-S301 PolarHBondContact O-OG 3.08Å; T299-S301 PolarHBondContact O-N 3.37Å; S301-S305 PolarHBondContact O-N 3.24Å; S301-S305 PolarHBondContact O-OG 2.92Å
302	N	35.4	Very low	46.7	Very low	103 Å²	103	97.5 Å²	97.5	55%	0.551	50%	0.5	S	S	*	.	H	α-helix	trans	-73.3	-38.9	177.4	-78.2	-21.5	0	0	0	111.6	Q298 T299 S305 T306	Q298-N302 PolarHBondContact O-N 2.74Å; Q298-N302 VanDerWaalsContact O-N 3.08Å; T299-N302 PolarHBondContact O-N 2.89Å; N302-S305 PolarHBondContact O-OG 3.17Å; N302-S305 VanDerWaalsContact O-OG 3.05Å; N302-T306 PolarHBondContact O-N 3.16Å; N302-T306 VanDerWaalsContact O-N 3.17Å; N302-T306 PolarHBondContact O-OG1 2.93Å
303	H	43.7	Very low	49	Very low	120 Å²	120	95.9 Å²	95.9	56%	0.556	49%	0.492	S	S	*	.	H	α-helix	trans	-63.5	-44.2	172.2	-89.3	-100.6	0	0	0	111.7	T299 S305 T306 Y307	T299-H303 VanDerWaalsContact CG2-CD2 3.47Å; T299-H303 WeakPolarHBondContact CG2-CD2 3.38Å; T299-H303 WeakPolarHBondContact O-CB 3.46Å; T299-H303 PolarHBondContact O-CD2 3.12Å; T299-H303 PolarHBondContact O-N 3.13Å; H303-S305 PolarHBondContact O-N 3.29Å; H303-T306 PolarHBondContact O-N 2.99Å; H303-Y307 WeakPolarHBondContact O-CB 3.38Å; H303-Y307 PolarHBondContact O-N 3.4Å
304	L	45.5	Very low	51.4	Low	93 Å²	93	90.3 Å²	90.3	49%	0.487	47%	0.466	S	S	.	.	H	α-helix	trans	-64.3	-37.4	-178.8	-165	73.6	0	0	0	112.5	T300 R308	T300-L304 WeakPolarHBondContact O-CB 3.14Å; T300-L304 PolarHBondContact O-N 3.39Å; L304-R308 VanDerWaalsContact O-CG 3.3Å; L304-R308 WeakPolarHBondContact O-CG 3.31Å; L304-R308 PolarHBondContact O-N 3.35Å; L304-R308 VanDerWaalsContact O-N 3.14Å
305	S	46.9	Very low	54	Low	67 Å²	67	86 Å²	86	47%	0.469	44%	0.442	S	S	.	.	H	α-helix	trans	-71.5	-39.1	177.8	67	0	0	0	0	112.8	S301 N302 H303 R308 L309	S301-S305 PolarHBondContact O-N 3.24Å; S301-S305 PolarHBondContact O-OG 2.92Å; N302-S305 PolarHBondContact O-OG 3.17Å; N302-S305 VanDerWaalsContact O-OG 3.05Å; H303-S305 PolarHBondContact O-N 3.29Å; S305-R308 PolarHBondContact O-N 2.93Å; S305-L309 PolarHBondContact O-N 3.38Å
306	T	50.8	Low	56.5	Low	97 Å²	97	82.3 Å²	82.3	60%	0.595	43%	0.427	S	S	*	.	H	α-helix	trans	-65.7	-41.3	175	-48.3	0	0	0	0	111.2	N302 H303 R308 L309 S310	N302-T306 PolarHBondContact O-N 3.16Å; N302-T306 VanDerWaalsContact O-N 3.17Å; N302-T306 PolarHBondContact O-OG1 2.93Å; H303-T306 PolarHBondContact O-N 2.99Å; T306-R308 PolarHBondContact O-N 2.88Å; T306-L309 PolarHBondContact O-N 3.49Å; T306-S310 PolarHBondContact O-N 3.38Å; T306-S310 VanDerWaalsContact O-N 3.16Å
307	Y	55.3	Low	58.9	Low	69 Å²	69	80.4 Å²	80.4	27%	0.271	42%	0.418	S	S	.	.	H	α-helix	trans	-64.9	-35.4	176.4	-128.6	-88.5	0	0	0	113.6	L255 N256 I259 H303 L309 S310 Y311	L255-Y307 HydrophobicContact CD2-CE1 4.41Å; N256-Y307 PolarHBondContact OD1-OH 2.95Å; I259-Y307 VanDerWaalsContact CB-OH 3.26Å; I259-Y307 WeakPolarHBondContact CB-OH 3.14Å; I259-Y307 HydrophobicContact CD1-CD1 4.41Å; I259-Y307 HydrophobicContact CD1-CD2 4.46Å; I259-Y307 HydrophobicContact CD1-CE1 3.55Å; I259-Y307 HydrophobicContact CD1-CE2 3.62Å; I259-Y307 WeakPolarHBondContact CD1-OH 3.14Å; I259-Y307 HydrophobicContact CG2-CE2 3.88Å; I259-Y307 WeakPolarHBondContact CG2-OH 3.43Å; H303-Y307 WeakPolarHBondContact O-CB 3.38Å; H303-Y307 PolarHBondContact O-N 3.4Å; Y307-L309 VanDerWaalsContact C-N 3.34Å; Y307-L309 PolarHBondContact O-N 2.93Å; Y307-S310 WeakPolarHBondContact CA-OG 3.41Å; Y307-S310 PolarHBondContact O-N 3.49Å; Y307-S310 PolarHBondContact O-OG 3Å; Y307-Y311 PolarHBondContact O-N 3.2Å
308	R	58.9	Low	61.4	Low	141 Å²	141	76 Å²	76	53%	0.532	40%	0.398	S	S	.	.	H	α-helix	trans	-64.5	-38.3	177.6	-78.3	172.7	-175.7	-173.9	3.5	112.2	L304 S305 T306	L304-R308 VanDerWaalsContact O-CG 3.3Å; L304-R308 WeakPolarHBondContact O-CG 3.31Å; L304-R308 PolarHBondContact O-N 3.35Å; L304-R308 VanDerWaalsContact O-N 3.14Å; S305-R308 PolarHBondContact O-N 2.93Å; T306-R308 PolarHBondContact O-N 2.88Å
309	L	60.7	Low	63.9	Low	116 Å²	116	70.2 Å²	70.2	61%	0.607	37%	0.372	S	S	*	.	H	α-helix	trans	-69.5	-39.8	175.6	-152.8	92.7	0	0	0	110.5	S305 T306 Y307 L312 E313	S305-L309 PolarHBondContact O-N 3.38Å; T306-L309 PolarHBondContact O-N 3.49Å; Y307-L309 VanDerWaalsContact C-N 3.34Å; Y307-L309 PolarHBondContact O-N 2.93Å; L309-L312 PolarHBondContact O-N 3.16Å; L309-E313 PolarHBondContact O-N 3.05Å
310	S	77.6	Confident	66.1	Low	41 Å²	41	71.5 Å²	71.5	29%	0.287	38%	0.383	S	S	.	.	H	α-helix	trans	-65	-39.8	-179.6	74.8	0	0	0	0	112.9	T306 Y307 L312 E313 H314	T306-S310 PolarHBondContact O-N 3.38Å; T306-S310 VanDerWaalsContact O-N 3.16Å; Y307-S310 WeakPolarHBondContact CA-OG 3.41Å; Y307-S310 PolarHBondContact O-N 3.49Å; Y307-S310 PolarHBondContact O-OG 3Å; S310-L312 PolarHBondContact O-N 3.28Å; S310-E313 PolarHBondContact O-N 3.37Å; S310-H314 WeakPolarHBondContact O-CB 3.37Å; S310-H314 PolarHBondContact O-N 3.27Å
311	Y	82.3	Confident	68.3	Low	22 Å²	22	76.5 Å²	76.5	9%	0.086	40%	0.398	C	S	.	.	H	α-helix	trans	-62.8	-44.1	177.6	175.3	-102.1	0	0	0	112.9	D248 L251 W252 L255 Y307 E313 H314 R315	D248-Y311 PolarHBondContact O-OH 3.42Å; L251-Y311 HydrophobicContact CB-CE2 4.41Å; W252-Y311 HydrophobicContact CB-CE2 4.06Å; W252-Y311 HydrophobicContact CE3-CD1 4.33Å; W252-Y311 AromaticContact CE3-CD2 3.69Å; W252-Y311 HydrophobicContact CE3-CD2 3.69Å; W252-Y311 HydrophobicContact CE3-CE1 4.37Å; W252-Y311 AromaticContact CE3-CE2 3.75Å; W252-Y311 HydrophobicContact CE3-CE2 3.75Å; W252-Y311 HydrophobicContact CE3-CG 4Å; W252-Y311 HydrophobicContact CZ3-CD1 4.35Å; W252-Y311 HydrophobicContact CZ3-CD2 4.25Å; W252-Y311 HydrophobicContact CZ3-CG 4.11Å; L255-Y311 HydrophobicContact CD2-CD2 3.78Å; L255-Y311 HydrophobicContact CD2-CG 4.33Å; Y307-Y311 PolarHBondContact O-N 3.2Å; Y311-E313 VanDerWaalsContact C-N 3.33Å; Y311-E313 PolarHBondContact O-N 2.88Å; Y311-H314 PolarHBondContact O-N 3.2Å; Y311-R315 HydrophobicContact CE1-CB 4.46Å; Y311-R315 VanDerWaalsContact O-CB 3.24Å; Y311-R315 WeakPolarHBondContact O-CB 3.46Å; Y311-R315 PolarHBondContact O-N 2.87Å
312	L	82	Confident	70.5	Confident	48 Å²	48	76.3 Å²	76.3	25%	0.251	39%	0.391	S	S	.	.	H	α-helix	trans	-65.1	-39.9	-178.8	-67.5	167.1	0	0	0	111.9	L309 S310 S316 Y336 W339	L309-L312 PolarHBondContact O-N 3.16Å; S310-L312 PolarHBondContact O-N 3.28Å; L312-S316 WeakPolarHBondContact O-CB 3.37Å; L312-S316 PolarHBondContact O-N 3.2Å; L312-S316 PolarHBondContact O-OG 2.97Å; L312-Y336 HydrophobicContact CD2-CD2 4.16Å; L312-Y336 HydrophobicContact CD2-CE2 3.77Å; L312-W339 HydrophobicContact CD1-CH2 3.24Å; L312-W339 HydrophobicContact CD1-CZ2 3.56Å; L312-W339 HydrophobicContact CD1-CZ3 3.9Å; L312-W339 HydrophobicContact CD2-CE3 4.12Å; L312-W339 HydrophobicContact CD2-CH2 3.96Å; L312-W339 HydrophobicContact CD2-CZ3 3.69Å; L312-W339 HydrophobicContact CG-CH2 4.22Å; L312-W339 HydrophobicContact CG-CZ3 4.45Å
313	E	80.9	Confident	73	Confident	114 Å²	114	75.9 Å²	75.9	53%	0.533	39%	0.389	S	S	.	.	H	α-helix	trans	-65.9	-48.7	175.1	-175.5	166	-167.5	0	0	110.9	L309 S310 Y311 R315 S316 N317	L309-E313 PolarHBondContact O-N 3.05Å; S310-E313 PolarHBondContact O-N 3.37Å; Y311-E313 VanDerWaalsContact C-N 3.33Å; Y311-E313 PolarHBondContact O-N 2.88Å; E313-R315 PolarHBondContact O-N 2.83Å; E313-S316 PolarHBondContact O-N 2.85Å; E313-S316 VanDerWaalsContact O-N 3.14Å; E313-S316 PolarHBondContact O-OG 3.41Å; E313-N317 WeakPolarHBondContact O-CB 3.5Å; E313-N317 VanDerWaalsContact O-CG 3.27Å; E313-N317 PolarHBondContact O-N 3.4Å; E313-N317 PolarHBondContact O-ND2 2.89Å
314	H	82.9	Confident	74.9	Confident	34 Å²	34	73.7 Å²	73.7	16%	0.157	39%	0.385	C	S	.	.	H	α-helix	trans	-54.7	-50.4	174.6	-177.7	79.1	0	0	0	112.4	L255 S310 Y311 S316 N317 I318	L255-H314 HydrophobicContact CD1-CB 4.25Å; L255-H314 HydrophobicContact CD2-CB 4.5Å; S310-H314 WeakPolarHBondContact O-CB 3.37Å; S310-H314 PolarHBondContact O-N 3.27Å; Y311-H314 PolarHBondContact O-N 3.2Å; H314-S316 VanDerWaalsContact C-N 3.33Å; H314-S316 PolarHBondContact O-N 3.21Å; H314-N317 PolarHBondContact O-N 3.14Å; H314-I318 WeakPolarHBondContact CE1-CD1 3.38Å; H314-I318 WeakPolarHBondContact NE2-CD1 3.22Å; H314-I318 PolarHBondContact O-N 2.97Å
315	R	86.3	Confident	76.9	Confident	22 Å²	22	73 Å²	73	8%	0.083	39%	0.387	C	S	.	.	H	α-helix	trans	-55.9	-46.5	175.5	177.4	174.9	-177.4	-85.2	2.1	111.3	D248 L251 Y311 E313 I318 L319 A330 Y336	D248-R315 IonicContact OD1-CZ 3.55Å; D248-R315 IonicContact OD1-NE 3.91Å; D248-R315 PolarHBondContact OD1-NE 3.39Å; D248-R315 IonicContact OD1-NH2 2.86Å; D248-R315 IonicContact OD2-NE 3.83Å; L251-R315 HydrophobicContact CD1-CG 4.09Å; Y311-R315 HydrophobicContact CE1-CB 4.46Å; Y311-R315 VanDerWaalsContact O-CB 3.24Å; Y311-R315 WeakPolarHBondContact O-CB 3.46Å; Y311-R315 PolarHBondContact O-N 2.87Å; E313-R315 PolarHBondContact O-N 2.83Å; R315-I318 PolarHBondContact O-N 3.22Å; R315-L319 HydrophobicContact CG-CD1 3.64Å; R315-L319 HydrophobicContact CG-CG 4.32Å; R315-L319 VanDerWaalsContact O-CB 3.31Å; R315-L319 WeakPolarHBondContact O-CB 3.31Å; R315-L319 VanDerWaalsContact O-CG 3.28Å; R315-L319 WeakPolarHBondContact O-CG 3.09Å; R315-L319 PolarHBondContact O-N 2.88Å; R315-A330 PolarHBondContact NH2-O 3.24Å; R315-Y336 VanDerWaalsContact NH1-CE2 3.32Å; R315-Y336 VanDerWaalsContact NH1-CZ 3.29Å
316	S	83.9	Confident	78.9	Confident	41 Å²	41	73 Å²	73	29%	0.287	38%	0.382	S	S	.	.	H	α-helix	trans	-66.6	-36.3	179.3	74.5	0	0	0	0	113.2	L312 E313 H314 S320	L312-S316 WeakPolarHBondContact O-CB 3.37Å; L312-S316 PolarHBondContact O-N 3.2Å; L312-S316 PolarHBondContact O-OG 2.97Å; E313-S316 PolarHBondContact O-N 2.85Å; E313-S316 VanDerWaalsContact O-N 3.14Å; E313-S316 PolarHBondContact O-OG 3.41Å; H314-S316 VanDerWaalsContact C-N 3.33Å; H314-S316 PolarHBondContact O-N 3.21Å; S316-S320 VanDerWaalsContact O-CB 3.29Å; S316-S320 WeakPolarHBondContact O-CB 3.44Å; S316-S320 PolarHBondContact O-N 3.42Å; S316-S320 VanDerWaalsContact O-N 3.13Å; S316-S320 PolarHBondContact O-OG 3.04Å
317	N	84.6	Confident	80.6	Confident	80 Å²	80	70.7 Å²	70.7	43%	0.428	36%	0.363	S	S	.	.	H	α-helix	trans	-70.8	-36.1	178.8	-73.7	-18	0	0	0	112.1	E313 H314 S320 K321	E313-N317 WeakPolarHBondContact O-CB 3.5Å; E313-N317 VanDerWaalsContact O-CG 3.27Å; E313-N317 PolarHBondContact O-N 3.4Å; E313-N317 PolarHBondContact O-ND2 2.89Å; H314-N317 PolarHBondContact O-N 3.14Å; N317-S320 PolarHBondContact O-OG 3.49Å; N317-K321 WeakPolarHBondContact O-CG 3.13Å
318	I	85	Confident	82.3	Confident	48 Å²	48	72.4 Å²	72.4	25%	0.246	37%	0.37	C	S	.	.	H	α-helix	trans	-76.4	-50.5	176.4	-68	-177.8	0	0	0	110.9	L251 H314 R315 S320 K321 I322	L251-I318 HydrophobicContact CD2-CB 4.01Å; L251-I318 HydrophobicContact CD2-CD1 3.83Å; L251-I318 HydrophobicContact CD2-CG2 3.51Å; H314-I318 WeakPolarHBondContact CE1-CD1 3.38Å; H314-I318 WeakPolarHBondContact NE2-CD1 3.22Å; H314-I318 PolarHBondContact O-N 2.97Å; R315-I318 PolarHBondContact O-N 3.22Å; I318-S320 PolarHBondContact O-N 3.44Å; I318-S320 VanDerWaalsContact O-N 3.15Å; I318-K321 PolarHBondContact O-N 2.96Å; I318-I322 HydrophobicContact CG2-CD1 3.31Å; I318-I322 HydrophobicContact CG2-CG1 4Å; I318-I322 WeakPolarHBondContact O-CG1 3.33Å; I318-I322 PolarHBondContact O-N 3.33Å
319	L	85.1	Confident	83.8	Confident	14 Å²	14	68.3 Å²	68.3	7%	0.073	36%	0.358	C	S	.	.	H	α-helix	trans	-63.4	-22.9	-178.1	-70.2	175.7	0	0	0	113.5	L251 R315 K321 A330	L251-L319 HydrophobicContact CD1-CD2 4.34Å; L251-L319 HydrophobicContact CD1-CG 4.31Å; R315-L319 HydrophobicContact CG-CD1 3.64Å; R315-L319 HydrophobicContact CG-CG 4.32Å; R315-L319 VanDerWaalsContact O-CB 3.31Å; R315-L319 WeakPolarHBondContact O-CB 3.31Å; R315-L319 VanDerWaalsContact O-CG 3.28Å; R315-L319 WeakPolarHBondContact O-CG 3.09Å; R315-L319 PolarHBondContact O-N 2.88Å; L319-K321 VanDerWaalsContact C-N 3.33Å; L319-A330 HydrophobicContact CD1-CB 4.05Å; L319-A330 HydrophobicContact CD2-CB 3.72Å
320	S	82.9	Confident	85.3	Confident	84 Å²	84	62.8 Å²	62.8	59%	0.587	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	-18.8	173.6	57.1	0	0	0	0	113.9	S316 N317 I318	S316-S320 VanDerWaalsContact O-CB 3.29Å; S316-S320 WeakPolarHBondContact O-CB 3.44Å; S316-S320 PolarHBondContact O-N 3.42Å; S316-S320 VanDerWaalsContact O-N 3.13Å; S316-S320 PolarHBondContact O-OG 3.04Å; N317-S320 PolarHBondContact O-OG 3.49Å; I318-S320 PolarHBondContact O-N 3.44Å; I318-S320 VanDerWaalsContact O-N 3.15Å
321	K	84.6	Confident	85.9	Confident	187 Å²	187	61.4 Å²	61.4	81%	0.813	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.2	-16.1	179.4	-65.4	179	-177.6	-177.2	0	113.6	N317 I318 L319	N317-K321 WeakPolarHBondContact O-CG 3.13Å; I318-K321 PolarHBondContact O-N 2.96Å; L319-K321 VanDerWaalsContact C-N 3.33Å
322	I	85.1	Confident	86.5	Confident	62 Å²	62	62.8 Å²	62.8	32%	0.318	32%	0.324	S	S	.	.	S	Bend	trans	-87.2	159.5	-176.6	-71.3	-177.6	0	0	0	111.8	I318 I326	I318-I322 HydrophobicContact CG2-CD1 3.31Å; I318-I322 HydrophobicContact CG2-CG1 4Å; I318-I322 WeakPolarHBondContact O-CG1 3.33Å; I318-I322 PolarHBondContact O-N 3.33Å; I322-I326 HydrophobicContact CG2-CB 3.6Å; I322-I326 HydrophobicContact CG2-CD1 3.7Å; I322-I326 HydrophobicContact CG2-CG1 4.19Å; I322-I326 HydrophobicContact CG2-CG2 3.81Å
323	N	87.1	Confident	87	Confident	93 Å²	93	60.5 Å²	60.5	50%	0.497	31%	0.312	S	S	.	.			trans	-46.9	135.8	172.2	-177.2	-28.4	0	0	0	112.4	C325 I326 K327	N323-C325 PolarHBondContact O-N 3.48Å; N323-C325 VanDerWaalsContact O-N 3.13Å; N323-C325 PolarHBondContact OD1-N 3.13Å; N323-I326 PolarHBondContact O-N 2.89Å; N323-K327 PolarHBondContact O-N 3.49Å
324	P	85.2	Confident	87.7	Confident	75 Å²	75	57.2 Å²	57.2	49%	0.487	30%	0.3	S	S	.	.	H	α-helix	trans	-49.7	-36.1	176.5	19.2	-34	0	0	0	114.7	I326 K327 Y328	P324-I326 PolarHBondContact O-N 3.44Å; P324-K327 WeakPolarHBondContact O-CB 3.41Å; P324-K327 PolarHBondContact O-N 2.9Å; P324-Y328 HydrophobicContact CB-CD2 4.48Å; P324-Y328 HydrophobicContact CB-CE2 4.11Å; P324-Y328 WeakPolarHBondContact O-CD2 3.47Å; P324-Y328 PolarHBondContact O-N 3.32Å
325	C	87.5	Confident	88.1	Confident	77 Å²	77	59.2 Å²	59.2	52%	0.52	32%	0.316	S	S	.	.	H	α-helix	trans	-59.4	-46.4	179.8	-65.2	0	0	0	0	112.8	N323 K327 Y328 I329	N323-C325 PolarHBondContact O-N 3.48Å; N323-C325 VanDerWaalsContact O-N 3.13Å; N323-C325 PolarHBondContact OD1-N 3.13Å; C325-K327 VanDerWaalsContact C-N 3.31Å; C325-K327 PolarHBondContact O-N 3.37Å; C325-Y328 PolarHBondContact O-N 3.38Å; C325-I329 WeakPolarHBondContact O-CG1 3.48Å; C325-I329 PolarHBondContact O-N 2.69Å; C325-I329 VanDerWaalsContact O-N 3.07Å
326	I	88	Confident	88.2	Confident	69 Å²	69	60.4 Å²	60.4	35%	0.354	32%	0.321	S	S	.	.	H	α-helix	trans	-68.1	-36.3	177.9	-63.6	168.9	0	0	0	110	V247 I322 N323 P324 Y328 I329 A330	V247-I326 HydrophobicContact CG1-CG2 4.05Å; V247-I326 HydrophobicContact CG2-CG2 4.23Å; I322-I326 HydrophobicContact CG2-CB 3.6Å; I322-I326 HydrophobicContact CG2-CD1 3.7Å; I322-I326 HydrophobicContact CG2-CG1 4.19Å; I322-I326 HydrophobicContact CG2-CG2 3.81Å; N323-I326 PolarHBondContact O-N 2.89Å; P324-I326 PolarHBondContact O-N 3.44Å; I326-Y328 VanDerWaalsContact C-N 3.31Å; I326-Y328 PolarHBondContact O-N 2.93Å; I326-I329 PolarHBondContact O-N 3.17Å; I326-A330 WeakPolarHBondContact O-CB 3.2Å; I326-A330 PolarHBondContact O-N 3.44Å
327	K	87.5	Confident	88.6	Confident	48 Å²	48	58.6 Å²	58.6	21%	0.209	31%	0.307	C	S	.	.	H	α-helix	trans	-59.3	-41.4	173.6	-175.2	-176.7	178.4	-174.9	0	111.7	N323 P324 C325 T331 G762	N323-K327 PolarHBondContact O-N 3.49Å; P324-K327 WeakPolarHBondContact O-CB 3.41Å; P324-K327 PolarHBondContact O-N 2.9Å; C325-K327 VanDerWaalsContact C-N 3.31Å; C325-K327 PolarHBondContact O-N 3.37Å; K327-T331 WeakPolarHBondContact O-CG2 3.49Å; K327-G762 PolarHBondContact NZ-O 2.85Å
328	Y	89.4	Confident	89	Confident	105 Å²	105	56.7 Å²	56.7	41%	0.412	30%	0.299	S	S	.	.	H	α-helix	trans	-65.1	-47.2	175.5	-72.8	-63.9	0	0	0	111.9	P324 C325 I326 A330 T331 M759 F763	P324-Y328 HydrophobicContact CB-CD2 4.48Å; P324-Y328 HydrophobicContact CB-CE2 4.11Å; P324-Y328 WeakPolarHBondContact O-CD2 3.47Å; P324-Y328 PolarHBondContact O-N 3.32Å; C325-Y328 PolarHBondContact O-N 3.38Å; I326-Y328 VanDerWaalsContact C-N 3.31Å; I326-Y328 PolarHBondContact O-N 2.93Å; Y328-A330 VanDerWaalsContact C-N 3.31Å; Y328-A330 PolarHBondContact O-N 2.92Å; Y328-T331 WeakPolarHBondContact O-CB 3.38Å; Y328-T331 PolarHBondContact O-N 3.46Å; Y328-T331 PolarHBondContact O-OG1 2.97Å; Y328-M759 HydrophobicContact CD1-CG 4.34Å; Y328-M759 HydrophobicContact CD1-SD 3.85Å; Y328-M759 HydrophobicContact CE1-SD 4.02Å; Y328-F763 AromaticContact CE1-CE2 3.68Å; Y328-F763 HydrophobicContact CE1-CE2 3.68Å; Y328-F763 AromaticContact CE1-CZ 3.69Å; Y328-F763 HydrophobicContact CE1-CZ 3.69Å; Y328-F763 AromaticContact CZ-CZ 3.63Å; Y328-F763 WeakPolarHBondContact OH-CZ 3.36Å
329	I	91.6	Very high	89.2	Confident	55 Å²	55	58.4 Å²	58.4	28%	0.282	30%	0.302	S	S	.	.	H	α-helix	trans	-59.6	-42.4	177.8	-68.5	167.7	0	0	0	111	S243 G244 V247 C325 I326 T331 Y332	S243-I329 WeakPolarHBondContact OG-CG2 3.46Å; G244-I329 WeakPolarHBondContact CA-O 3.11Å; V247-I329 HydrophobicContact CG2-CG2 4.21Å; C325-I329 WeakPolarHBondContact O-CG1 3.48Å; C325-I329 PolarHBondContact O-N 2.69Å; C325-I329 VanDerWaalsContact O-N 3.07Å; I326-I329 PolarHBondContact O-N 3.17Å; I329-T331 PolarHBondContact O-N 3.29Å; I329-Y332 WeakPolarHBondContact O-CB 3.39Å; I329-Y332 PolarHBondContact O-N 2.49Å
330	A	91	Very high	89.3	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-61.1	-16.9	177.7	0	0	0	0	0	114	V247 R315 L319 I326 Y328 Y332 S333	V247-A330 HydrophobicContact CG1-CB 3.96Å; R315-A330 PolarHBondContact NH2-O 3.24Å; L319-A330 HydrophobicContact CD1-CB 4.05Å; L319-A330 HydrophobicContact CD2-CB 3.72Å; I326-A330 WeakPolarHBondContact O-CB 3.2Å; I326-A330 PolarHBondContact O-N 3.44Å; Y328-A330 VanDerWaalsContact C-N 3.31Å; Y328-A330 PolarHBondContact O-N 2.92Å; A330-Y332 PolarHBondContact O-N 3.34Å; A330-S333 WeakPolarHBondContact O-CB 3.34Å; A330-S333 PolarHBondContact O-N 2.9Å
331	T	91.4	Very high	89.5	Confident	11 Å²	11	57 Å²	57	7%	0.067	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-72.6	-17	174.8	71.3	0	0	0	0	113.2	K327 Y328 I329 N337 A758 M759	K327-T331 WeakPolarHBondContact O-CG2 3.49Å; Y328-T331 WeakPolarHBondContact O-CB 3.38Å; Y328-T331 PolarHBondContact O-N 3.46Å; Y328-T331 PolarHBondContact O-OG1 2.97Å; I329-T331 PolarHBondContact O-N 3.29Å; T331-N337 PolarHBondContact O-ND2 3.28Å; T331-A758 HydrophobicContact CG2-CB 4.14Å; T331-M759 HydrophobicContact CG2-CG 3.92Å
332	Y	94.2	Very high	89.7	Confident	52 Å²	52	56.1 Å²	56.1	20%	0.204	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-90.2	3.7	175.9	-72.7	-92.9	0	0	0	113.8	L240 L241 I329 A330 V334 A751 P755	L240-Y332 HydrophobicContact CB-CD1 3.82Å; L240-Y332 HydrophobicContact CB-CD2 4.26Å; L240-Y332 HydrophobicContact CB-CE1 4.13Å; L240-Y332 HydrophobicContact CB-CG 3.89Å; L240-Y332 HydrophobicContact CD1-CE1 4.02Å; L240-Y332 HydrophobicContact CD1-CE2 4.23Å; L240-Y332 VanDerWaalsContact O-CB 3.24Å; L240-Y332 WeakPolarHBondContact O-CB 3.18Å; L241-Y332 HydrophobicContact CD2-CD1 4.24Å; L241-Y332 WeakPolarHBondContact CD2-O 3.22Å; I329-Y332 WeakPolarHBondContact O-CB 3.39Å; I329-Y332 PolarHBondContact O-N 2.49Å; A330-Y332 PolarHBondContact O-N 3.34Å; Y332-V334 PolarHBondContact O-N 2.96Å; Y332-V334 VanDerWaalsContact O-N 3.17Å; Y332-A751 WeakPolarHBondContact CE1-O 3.46Å; Y332-P755 HydrophobicContact CD1-CB 4.23Å; Y332-P755 HydrophobicContact CD1-CG 3.47Å; Y332-P755 VanDerWaalsContact CD1-CG 3.47Å; Y332-P755 HydrophobicContact CD2-CB 4.23Å; Y332-P755 HydrophobicContact CD2-CG 4.27Å; Y332-P755 HydrophobicContact CE1-CB 3.98Å; Y332-P755 HydrophobicContact CE1-CG 3.47Å; Y332-P755 VanDerWaalsContact CE1-CG 3.47Å; Y332-P755 HydrophobicContact CE2-CB 3.97Å; Y332-P755 HydrophobicContact CE2-CG 4.26Å; Y332-P755 HydrophobicContact CG-CB 4.35Å; Y332-P755 HydrophobicContact CG-CG 3.89Å
333	S	93.8	Very high	89.6	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	28%	0.28	C	S	.	.			trans	-57.3	119.3	177.5	170	0	0	0	0	112.2	G244 D248 A330 Y336 N337	G244-S333 WeakPolarHBondContact O-CB 3.44Å; D248-S333 WeakPolarHBondContact CB-OG 3.49Å; D248-S333 WeakPolarHBondContact OD2-CB 2.99Å; D248-S333 PolarHBondContact OD2-OG 3.34Å; A330-S333 WeakPolarHBondContact O-CB 3.34Å; A330-S333 PolarHBondContact O-N 2.9Å; S333-Y336 PolarHBondContact OG-N 3.24Å; S333-N337 VanDerWaalsContact O-CB 3.23Å; S333-N337 WeakPolarHBondContact O-CB 3.45Å; S333-N337 PolarHBondContact O-N 3.02Å; S333-N337 PolarHBondContact O-ND2 2.87Å; S333-N337 VanDerWaalsContact O-ND2 3.14Å
334	V	94.3	Very high	89	Confident	45 Å²	45	53.3 Å²	53.3	27%	0.273	27%	0.266	S	S	.	.	H	α-helix	trans	-64.4	-53.5	178.4	172.5	0	0	0	0	111.1	L241 T245 Y332 Y336 N337 T338 L750	L241-V334 HydrophobicContact CB-CG2 4.3Å; L241-V334 HydrophobicContact CD2-CG2 4.05Å; T245-V334 PolarHBondContact OG1-N 3.46Å; Y332-V334 PolarHBondContact O-N 2.96Å; Y332-V334 VanDerWaalsContact O-N 3.17Å; V334-Y336 VanDerWaalsContact C-N 3.32Å; V334-Y336 PolarHBondContact O-N 2.99Å; V334-N337 PolarHBondContact O-N 3.35Å; V334-T338 WeakPolarHBondContact O-CB 3.34Å; V334-T338 PolarHBondContact O-N 2.71Å; V334-T338 PolarHBondContact O-OG1 3.45Å; V334-L750 HydrophobicContact CG1-CD1 3.99Å
335	P	91.7	Very high	88	Confident	75 Å²	75	57.9 Å²	57.9	49%	0.487	28%	0.278	S	S	.	.	H	α-helix	trans	-56.9	-42.8	-177.8	-25.5	34.7	0	0	0	113.4	T245 W339	T245-P335 HydrophobicContact CG2-CG 4.07Å; P335-W339 VanDerWaalsContact O-CB 3.22Å; P335-W339 WeakPolarHBondContact O-CB 3.28Å; P335-W339 PolarHBondContact O-N 2.96Å
336	Y	89.4	Confident	86.9	Confident	48 Å²	48	58.3 Å²	58.3	19%	0.188	27%	0.269	C	S	.	.	H	α-helix	trans	-67.2	-45.8	178.5	174	-97.4	0	0	0	112	D248 L312 R315 S333 V334 W339 H340	D248-Y336 WeakPolarHBondContact OD2-CB 3.38Å; L312-Y336 HydrophobicContact CD2-CD2 4.16Å; L312-Y336 HydrophobicContact CD2-CE2 3.77Å; R315-Y336 VanDerWaalsContact NH1-CE2 3.32Å; R315-Y336 VanDerWaalsContact NH1-CZ 3.29Å; S333-Y336 PolarHBondContact OG-N 3.24Å; V334-Y336 VanDerWaalsContact C-N 3.32Å; V334-Y336 PolarHBondContact O-N 2.99Å; Y336-W339 PolarHBondContact O-N 3.42Å; Y336-H340 VanDerWaalsContact O-CB 3.27Å; Y336-H340 WeakPolarHBondContact O-CB 3.39Å; Y336-H340 PolarHBondContact O-N 2.88Å
337	N	92.4	Very high	85.5	Confident	2 Å²	2	60.8 Å²	60.8	1%	0.011	28%	0.283	C	S	.	.	H	α-helix	trans	-68	-39.4	-179.3	-73.9	-25.4	0	0	0	111.8	T331 S333 V334 H340 L341 L750 S754	T331-N337 PolarHBondContact O-ND2 3.28Å; S333-N337 VanDerWaalsContact O-CB 3.23Å; S333-N337 WeakPolarHBondContact O-CB 3.45Å; S333-N337 PolarHBondContact O-N 3.02Å; S333-N337 PolarHBondContact O-ND2 2.87Å; S333-N337 VanDerWaalsContact O-ND2 3.14Å; V334-N337 PolarHBondContact O-N 3.35Å; N337-H340 PolarHBondContact O-N 3.21Å; N337-L341 VanDerWaalsContact O-CB 3.27Å; N337-L341 WeakPolarHBondContact O-CB 3.12Å; N337-L341 PolarHBondContact O-N 3.48Å; N337-L750 HydrophobicContact CB-CD2 3.49Å; N337-L750 VanDerWaalsContact CB-CD2 3.49Å; N337-S754 VanDerWaalsContact CG-CB 3.49Å
338	T	92.6	Very high	83.8	Confident	40 Å²	40	66.6 Å²	66.6	25%	0.245	30%	0.304	C	S	.	.	H	α-helix	trans	-61.8	-47.4	172.8	-56.8	0	0	0	0	111.1	V334 H340 L341 W342 Y746	V334-T338 WeakPolarHBondContact O-CB 3.34Å; V334-T338 PolarHBondContact O-N 2.71Å; V334-T338 PolarHBondContact O-OG1 3.45Å; T338-H340 VanDerWaalsContact C-N 3.34Å; T338-H340 PolarHBondContact O-N 3.01Å; T338-L341 PolarHBondContact O-N 2.97Å; T338-W342 WeakPolarHBondContact O-CB 3.29Å; T338-W342 PolarHBondContact O-N 3.14Å; T338-Y746 HydrophobicContact CG2-CE2 4.23Å; T338-Y746 VanDerWaalsContact CG2-OH 3.23Å; T338-Y746 WeakPolarHBondContact CG2-OH 3.37Å; T338-Y746 PolarHBondContact OG1-OH 3.05Å
339	W	88.9	Confident	82.4	Confident	84 Å²	84	64.6 Å²	64.6	32%	0.318	30%	0.302	S	S	.	.	H	α-helix	trans	-59.9	-45.7	175.5	172.9	91.4	0	0	0	111.3	L312 P335 Y336 L341 W342 N343	L312-W339 HydrophobicContact CD1-CH2 3.24Å; L312-W339 HydrophobicContact CD1-CZ2 3.56Å; L312-W339 HydrophobicContact CD1-CZ3 3.9Å; L312-W339 HydrophobicContact CD2-CE3 4.12Å; L312-W339 HydrophobicContact CD2-CH2 3.96Å; L312-W339 HydrophobicContact CD2-CZ3 3.69Å; L312-W339 HydrophobicContact CG-CH2 4.22Å; L312-W339 HydrophobicContact CG-CZ3 4.45Å; P335-W339 VanDerWaalsContact O-CB 3.22Å; P335-W339 WeakPolarHBondContact O-CB 3.28Å; P335-W339 PolarHBondContact O-N 2.96Å; Y336-W339 PolarHBondContact O-N 3.42Å; W339-L341 VanDerWaalsContact C-N 3.35Å; W339-L341 PolarHBondContact O-N 3.46Å; W339-W342 PolarHBondContact O-N 3.15Å; W339-N343 HydrophobicContact CD2-CB 4.41Å; W339-N343 HydrophobicContact CZ2-CB 4.14Å; W339-N343 PolarHBondContact NE1-ND2 2.75Å; W339-N343 VanDerWaalsContact O-CB 3.29Å; W339-N343 WeakPolarHBondContact O-CB 3.43Å; W339-N343 PolarHBondContact O-N 3.36Å
340	H	86.4	Confident	80.6	Confident	53 Å²	53	67.5 Å²	67.5	25%	0.245	32%	0.318	C	S	.	.	H	α-helix	trans	-62.9	-42.8	178.8	179.7	-98.7	0	0	0	110.7	Y336 N337 T338 W342 S344	Y336-H340 VanDerWaalsContact O-CB 3.27Å; Y336-H340 WeakPolarHBondContact O-CB 3.39Å; Y336-H340 PolarHBondContact O-N 2.88Å; N337-H340 PolarHBondContact O-N 3.21Å; T338-H340 VanDerWaalsContact C-N 3.34Å; T338-H340 PolarHBondContact O-N 3.01Å; H340-W342 VanDerWaalsContact C-N 3.34Å; H340-W342 PolarHBondContact O-N 3.35Å; H340-S344 WeakPolarHBondContact O-CA 3.33Å; H340-S344 WeakPolarHBondContact O-CB 3.22Å; H340-S344 PolarHBondContact O-N 3.36Å
341	L	87.9	Confident	78.9	Confident	16 Å²	16	70.3 Å²	70.3	8%	0.084	33%	0.333	C	S	.	.	H	α-helix	trans	-61.4	-40.9	176.7	-177.7	66.8	0	0	0	112.1	N337 T338 W339 V696 R699 L700 Y746	N337-L341 VanDerWaalsContact O-CB 3.27Å; N337-L341 WeakPolarHBondContact O-CB 3.12Å; N337-L341 PolarHBondContact O-N 3.48Å; T338-L341 PolarHBondContact O-N 2.97Å; W339-L341 VanDerWaalsContact C-N 3.35Å; W339-L341 PolarHBondContact O-N 3.46Å; L341-V696 HydrophobicContact CD2-CG1 4.29Å; L341-V696 HydrophobicContact CG-CG1 4.32Å; L341-R699 HydrophobicContact CD1-CB 3.85Å; L341-R699 PolarHBondContact O-NH1 3.13Å; L341-L700 HydrophobicContact CD2-CD2 3.97Å; L341-Y746 HydrophobicContact CD2-CD2 3.76Å; L341-Y746 HydrophobicContact CD2-CE2 4.02Å
342	W	87.8	Confident	77.1	Confident	169 Å²	169	76 Å²	76	64%	0.64	37%	0.367	S	S	*	.	H	α-helix	trans	-78.3	-44.7	-178.7	-158.9	-93.2	0	0	0	113	T338 W339 H340 V696	T338-W342 WeakPolarHBondContact O-CB 3.29Å; T338-W342 PolarHBondContact O-N 3.14Å; W339-W342 PolarHBondContact O-N 3.15Å; H340-W342 VanDerWaalsContact C-N 3.34Å; H340-W342 PolarHBondContact O-N 3.35Å; W342-V696 HydrophobicContact CD2-CG2 4.11Å; W342-V696 HydrophobicContact CE3-CB 4.43Å; W342-V696 HydrophobicContact CE3-CG1 4.26Å; W342-V696 HydrophobicContact CE3-CG2 3.68Å; W342-V696 HydrophobicContact CZ3-CB 4.4Å; W342-V696 HydrophobicContact CZ3-CG1 4.26Å; W342-V696 HydrophobicContact CZ3-CG2 4.03Å
343	N	83.6	Confident	75.2	Confident	66 Å²	66	77.9 Å²	77.9	35%	0.353	39%	0.388	S	S	.	.	H	α-helix	trans	-102.1	-6.4	-169.1	-67	-45.3	0	0	0	114.5	W339 K345	W339-N343 HydrophobicContact CD2-CB 4.41Å; W339-N343 HydrophobicContact CZ2-CB 4.14Å; W339-N343 PolarHBondContact NE1-ND2 2.75Å; W339-N343 VanDerWaalsContact O-CB 3.29Å; W339-N343 WeakPolarHBondContact O-CB 3.43Å; W339-N343 PolarHBondContact O-N 3.36Å; N343-K345 PolarHBondContact O-N 3.4Å
344	S	74.2	Confident	73.3	Confident	30 Å²	30	80.2 Å²	80.2	21%	0.21	41%	0.413	C	S	.	.	P	Polyproline II helix	trans	-52.9	116.4	178.9	164.3	0	0	0	0	109.3	H340 R346 R699	H340-S344 WeakPolarHBondContact O-CA 3.33Å; H340-S344 WeakPolarHBondContact O-CB 3.22Å; H340-S344 PolarHBondContact O-N 3.36Å; S344-R346 PolarHBondContact O-N 3.14Å; S344-R699 PolarHBondContact O-NH2 3.34Å; S344-R699 PolarHBondContact OG-NH2 3.35Å
345	K	65.5	Low	71.3	Confident	170 Å²	170	84.1 Å²	84.1	74%	0.739	43%	0.428	S	S	*	.	P	Polyproline II helix	trans	-57.2	137.9	-170.6	-69.3	-179.6	-179.5	176.2	0	108.2	N343 N347	N343-K345 PolarHBondContact O-N 3.4Å; K345-N347 PolarHBondContact O-N 3.43Å
346	R	63.9	Low	69.5	Low	86 Å²	86	89.4 Å²	89.4	33%	0.325	44%	0.438	S	S	.	.	P	Polyproline II helix	trans	-48.3	129.3	167.7	-82	179.2	172	171.6	-1.9	108.2	S344 R348 M362 T690	S344-R346 PolarHBondContact O-N 3.14Å; R346-R348 WeakPolarHBondContact O-CG 3.17Å; R346-R348 PolarHBondContact O-N 2.89Å; R346-M362 HydrophobicContact CB-CE 3.67Å; R346-M362 HydrophobicContact CG-CE 4Å; R346-T690 PolarHBondContact NH2-O 3.15Å
347	N	59.1	Low	68.1	Low	121 Å²	121	88.9 Å²	88.9	65%	0.647	44%	0.441	S	S	*	.			trans	-52	110	175.7	-74.6	-15.5	0	0	0	107.8	K345 H359	K345-N347 PolarHBondContact O-N 3.43Å; N347-H359 HydrophobicContact CB-CB 4.35Å; N347-H359 WeakPolarHBondContact O-CB 3.26Å; N347-H359 PolarHBondContact O-N 2.86Å
348	R	51.9	Low	66.8	Low	171 Å²	171	92.4 Å²	92.4	65%	0.645	47%	0.466	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.7	123.5	174.1	-65.7	-169.5	-173.4	-178.4	0.7	106.8	R346 R356 C357	R346-R348 WeakPolarHBondContact O-CG 3.17Å; R346-R348 PolarHBondContact O-N 2.89Å; R348-R356 HydrophobicContact CB-CB 4.1Å; R348-C357 CarbonylContact C-O 3.49Å; R348-C357 WeakPolarHBondContact CA-O 3.37Å
349	V	59.6	Low	66.1	Low	62 Å²	62	91.6 Å²	91.6	38%	0.376	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	143.7	176.9	-173.9	0	0	0	0	107.6	N351 C357 H359	V349-N351 PolarHBondContact O-N 2.93Å; V349-C357 PolarHBondContact N-O 3.2Å; V349-C357 PolarHBondContact O-N 3.38Å; V349-H359 HydrophobicContact CG2-CB 4.3Å
350	L	54	Low	65.7	Low	117 Å²	117	88.5 Å²	88.5	61%	0.613	45%	0.45	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.4	121.1	170	-65.6	167.1	0	0	0	108	G354 R356	L350-G354 VanDerWaalsContact CD2-O 3.29Å; L350-G354 WeakPolarHBondContact CD2-O 3.32Å; L350-R356 HydrophobicContact CD2-CG 3.9Å
351	N	54.7	Low	65.7	Low	59 Å²	59	86.3 Å²	86.3	32%	0.316	44%	0.44	S	S	.	.	P	Polyproline II helix	trans	-69.8	170.4	167.4	-80.8	4.9	0	0	0	110.4	V349 S353 G354 Q355 C357	V349-N351 PolarHBondContact O-N 2.93Å; N351-S353 PolarHBondContact O-N 3.43Å; N351-S353 VanDerWaalsContact O-N 3.14Å; N351-G354 PolarHBondContact O-N 2.83Å; N351-Q355 PolarHBondContact N-O 3.16Å; N351-C357 VanDerWaalsContact CG-SG 3.52Å; N351-C357 PolarHBondContact ND2-SG 3.1Å; N351-C357 WeakPolarHBondContact OD1-CB 3.48Å
352	T	53.8	Low	65.7	Low	130 Å²	130	86.9 Å²	86.9	80%	0.798	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.5	-30	173.1	45.3	0	0	0	0	113.2	G354	T352-G354 VanDerWaalsContact C-N 3.25Å; T352-G354 PolarHBondContact O-N 3.43Å
353	S	54.8	Low	66	Low	91 Å²	91	78.9 Å²	78.9	64%	0.636	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	8.2	175.1	-33.9	0	0	0	0	114.5	N351 Q355	N351-S353 PolarHBondContact O-N 3.43Å; N351-S353 VanDerWaalsContact O-N 3.14Å; S353-Q355 PolarHBondContact O-N 3.49Å; S353-Q355 VanDerWaalsContact O-N 3.13Å
354	G	53.8	Low	66.5	Low	50 Å²	50	76 Å²	76	52%	0.515	40%	0.397	S	S	.	.	S	Bend	trans	71.8	-1.4	-174.8	0	0	0	0	0	115	L350 N351 T352	L350-G354 VanDerWaalsContact CD2-O 3.29Å; L350-G354 WeakPolarHBondContact CD2-O 3.32Å; N351-G354 PolarHBondContact O-N 2.83Å; T352-G354 VanDerWaalsContact C-N 3.25Å; T352-G354 PolarHBondContact O-N 3.43Å
355	Q	52.4	Low	67.4	Low	127 Å²	127	76.4 Å²	76.4	59%	0.593	40%	0.397	S	S	*	.			trans	-77.5	137.9	179.9	-67.5	179.8	-10	0	0	111.6	N351 S353 C357	N351-Q355 PolarHBondContact N-O 3.16Å; S353-Q355 PolarHBondContact O-N 3.49Å; S353-Q355 VanDerWaalsContact O-N 3.13Å; Q355-C357 PolarHBondContact O-N 3.34Å
356	R	53.2	Low	68.9	Low	186 Å²	186	68.3 Å²	68.3	70%	0.702	36%	0.361	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.8	103.7	175.8	-74.6	-176.2	177.5	172.8	0.3	110.5	R348 L350	R348-R356 HydrophobicContact CB-CB 4.1Å; L350-R356 HydrophobicContact CD2-CG 3.9Å
357	C	60.7	Low	70.5	Confident	37 Å²	37	64.8 Å²	64.8	25%	0.25	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	162.8	176.3	-69.4	0	0	0	0	112.4	R348 V349 N351 Q355 H359	R348-C357 CarbonylContact C-O 3.49Å; R348-C357 WeakPolarHBondContact CA-O 3.37Å; V349-C357 PolarHBondContact N-O 3.2Å; V349-C357 PolarHBondContact O-N 3.38Å; N351-C357 VanDerWaalsContact CG-SG 3.52Å; N351-C357 PolarHBondContact ND2-SG 3.1Å; N351-C357 WeakPolarHBondContact OD1-CB 3.48Å; Q355-C357 PolarHBondContact O-N 3.34Å; C357-H359 PolarHBondContact O-N 3.41Å
358	S	64.5	Low	72.2	Confident	76 Å²	76	62 Å²	62	53%	0.531	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.5	135.9	170.3	31.9	0	0	0	0	110.7	M362	S358-M362 WeakPolarHBondContact CB-SD 3.22Å
359	H	77.6	Confident	74.4	Confident	23 Å²	23	55.8 Å²	55.8	11%	0.106	31%	0.307	C	S	.	.			trans	-49.5	131	165.9	-166	-83.1	0	0	0	110.6	N347 V349 C357 L361 M362 Y427	N347-H359 HydrophobicContact CB-CB 4.35Å; N347-H359 WeakPolarHBondContact O-CB 3.26Å; N347-H359 PolarHBondContact O-N 2.86Å; V349-H359 HydrophobicContact CG2-CB 4.3Å; C357-H359 PolarHBondContact O-N 3.41Å; H359-L361 PolarHBondContact ND1-N 3.47Å; H359-L361 VanDerWaalsContact ND1-N 3.16Å; H359-L361 PolarHBondContact O-N 3.15Å; H359-M362 HydrophobicContact CB-CE 4.33Å; H359-M362 HydrophobicContact CB-CG 4.43Å; H359-M362 VanDerWaalsContact O-CG 3.24Å; H359-M362 WeakPolarHBondContact O-CG 3.47Å; H359-M362 PolarHBondContact O-N 3.46Å; H359-Y427 AromaticContact CE1-CE1 3.76Å; H359-Y427 AromaticContact NE2-CE1 3.8Å
360	P	79.7	Confident	76.1	Confident	19 Å²	19	56.9 Å²	56.9	12%	0.123	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-29.6	-174.4	21.5	-30.7	0	0	0	113.3	M362 Y427 I606 A678	P360-M362 VanDerWaalsContact C-N 3.26Å; P360-M362 PolarHBondContact O-N 3.17Å; P360-Y427 HydrophobicContact CG-CE1 4.3Å; P360-Y427 WeakPolarHBondContact CG-OH 3.19Å; P360-I606 HydrophobicContact CB-CD1 3.55Å; P360-I606 HydrophobicContact CG-CD1 3.62Å; P360-A678 HydrophobicContact CB-CB 4.34Å; P360-A678 WeakPolarHBondContact O-CA 3.43Å
361	L	87.6	Confident	78.2	Confident	7 Å²	7	51.8 Å²	51.8	4%	0.037	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	31	179.8	-54.1	178.2	0	0	0	113.9	H359 C363 L364 L423 L424 Y427 L602 V674 A678	H359-L361 PolarHBondContact ND1-N 3.47Å; H359-L361 VanDerWaalsContact ND1-N 3.16Å; H359-L361 PolarHBondContact O-N 3.15Å; L361-C363 VanDerWaalsContact C-N 3.25Å; L361-C363 PolarHBondContact O-N 2.88Å; L361-L364 HydrophobicContact CB-CD1 3.8Å; L361-L364 HydrophobicContact CB-CG 4.08Å; L361-L364 HydrophobicContact CD1-CD1 4.33Å; L361-L364 WeakPolarHBondContact O-CB 3.49Å; L361-L364 WeakPolarHBondContact O-CG 3.48Å; L361-L364 PolarHBondContact O-N 3.16Å; L361-L423 HydrophobicContact CD1-CD2 4.33Å; L361-L423 HydrophobicContact CD1-CG 4.27Å; L361-L423 HydrophobicContact CD2-CD2 4.42Å; L361-L424 HydrophobicContact CD1-CD2 4Å; L361-Y427 HydrophobicContact CD1-CD1 3.6Å; L361-Y427 HydrophobicContact CD1-CE1 4.07Å; L361-Y427 HydrophobicContact CD1-CG 3.92Å; L361-Y427 HydrophobicContact CG-CD1 4.44Å; L361-Y427 HydrophobicContact CG-CE1 4.44Å; L361-L602 HydrophobicContact CD2-CD1 3.97Å; L361-V674 HydrophobicContact CD2-CG1 3.89Å; L361-A678 HydrophobicContact CD2-CB 4.02Å
362	M	87.3	Confident	80.3	Confident	27 Å²	27	49 Å²	49	13%	0.133	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-26.1	179.2	-88.3	-177.5	-174.8	0	0	114	R346 S358 H359 P360 L364 D365 T690	R346-M362 HydrophobicContact CB-CE 3.67Å; R346-M362 HydrophobicContact CG-CE 4Å; S358-M362 WeakPolarHBondContact CB-SD 3.22Å; H359-M362 HydrophobicContact CB-CE 4.33Å; H359-M362 HydrophobicContact CB-CG 4.43Å; H359-M362 VanDerWaalsContact O-CG 3.24Å; H359-M362 WeakPolarHBondContact O-CG 3.47Å; H359-M362 PolarHBondContact O-N 3.46Å; P360-M362 VanDerWaalsContact C-N 3.26Å; P360-M362 PolarHBondContact O-N 3.17Å; M362-L364 PolarHBondContact O-N 2.93Å; M362-L364 VanDerWaalsContact O-N 3.12Å; M362-D365 PolarHBondContact O-N 3.21Å; M362-T690 HydrophobicContact CB-CG2 3.92Å
363	C	93.4	Very high	82.3	Confident	1 Å²	1	43.6 Å²	43.6	1%	0.007	24%	0.235	C	C	.	.	H	α-helix	trans	-61.2	-19.5	177.4	61	0	0	0	0	113.2	L361 D365 G366 I367 C677 L689 T690	L361-C363 VanDerWaalsContact C-N 3.25Å; L361-C363 PolarHBondContact O-N 2.88Å; C363-D365 PolarHBondContact O-N 3.12Å; C363-G366 PolarHBondContact O-N 3.48Å; C363-I367 WeakPolarHBondContact O-CG1 3.3Å; C363-I367 PolarHBondContact O-N 2.96Å; C363-C677 HydrophobicContact CB-CB 3.61Å; C363-C677 WeakPolarHBondContact SG-CB 3.23Å; C363-L689 HydrophobicContact CB-CB 3.78Å; C363-L689 HydrophobicContact CB-CD1 4.13Å; C363-T690 HydrophobicContact CB-CG2 4.39Å
364	L	94.9	Very high	84.4	Confident	5 Å²	5	41.5 Å²	41.5	3%	0.026	21%	0.214	C	C	.	.	H	α-helix	trans	-62.8	-26.4	178.2	-61.5	-174.6	0	0	0	112.4	L361 M362 I367 R368 M420 L423 L424 V674	L361-L364 HydrophobicContact CB-CD1 3.8Å; L361-L364 HydrophobicContact CB-CG 4.08Å; L361-L364 HydrophobicContact CD1-CD1 4.33Å; L361-L364 WeakPolarHBondContact O-CB 3.49Å; L361-L364 WeakPolarHBondContact O-CG 3.48Å; L361-L364 PolarHBondContact O-N 3.16Å; M362-L364 PolarHBondContact O-N 2.93Å; M362-L364 VanDerWaalsContact O-N 3.12Å; L364-I367 HydrophobicContact CD2-CD1 4.24Å; L364-I367 PolarHBondContact O-N 3.49Å; L364-R368 WeakPolarHBondContact O-CB 3.43Å; L364-R368 WeakPolarHBondContact O-CG 3.46Å; L364-R368 PolarHBondContact O-N 3.26Å; L364-M420 HydrophobicContact CB-SD 4.38Å; L364-M420 HydrophobicContact CD2-CG 3.94Å; L364-M420 HydrophobicContact CD2-SD 4.02Å; L364-L423 HydrophobicContact CD1-CD2 4.16Å; L364-L423 HydrophobicContact CD2-CD2 4.2Å; L364-L424 HydrophobicContact CD1-CD1 4.05Å; L364-L424 HydrophobicContact CD1-CD2 3.79Å; L364-L424 HydrophobicContact CD1-CG 3.92Å; L364-V674 HydrophobicContact CD2-CG1 4.2Å; L364-V674 HydrophobicContact CD2-CG2 3.81Å
365	D	93.2	Very high	86.4	Confident	39 Å²	39	39.4 Å²	39.4	21%	0.209	19%	0.19	C	C	.	.	H	α-helix	trans	-62.7	-49.2	174.6	-76	-29.2	0	0	0	110.9	M362 C363 R368 F369 F694 S698	M362-D365 PolarHBondContact O-N 3.21Å; C363-D365 PolarHBondContact O-N 3.12Å; D365-R368 PolarHBondContact O-N 3.19Å; D365-F369 PolarHBondContact O-N 3.03Å; D365-F694 HydrophobicContact CB-CB 4.49Å; D365-S698 VanDerWaalsContact CG-OG 3.3Å; D365-S698 WeakPolarHBondContact O-CB 3.19Å; D365-S698 WeakPolarHBondContact OD1-CB 3.39Å; D365-S698 PolarHBondContact OD1-OG 3.21Å
366	G	96.2	Very high	88.6	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-65.2	-41.7	175.7	0	0	0	0	0	112.9	C363 R368 F369 L370 L689	C363-G366 PolarHBondContact O-N 3.48Å; G366-R368 PolarHBondContact O-N 3.48Å; G366-F369 PolarHBondContact O-N 3.13Å; G366-L370 WeakPolarHBondContact O-CG 3.26Å; G366-L370 PolarHBondContact O-N 3.07Å; G366-L689 WeakPolarHBondContact CA-O 3.46Å; G366-L689 PolarHBondContact N-O 2.75Å
367	I	97.6	Very high	90.6	Very high	13 Å²	13	27.1 Å²	27.1	7%	0.067	14%	0.139	C	C	.	.	H	α-helix	trans	-61.3	-45.1	178.2	-67.8	170.5	0	0	0	110.8	C363 L364 F369 L370 T371 T416 M420 V674 L689	C363-I367 WeakPolarHBondContact O-CG1 3.3Å; C363-I367 PolarHBondContact O-N 2.96Å; L364-I367 HydrophobicContact CD2-CD1 4.24Å; L364-I367 PolarHBondContact O-N 3.49Å; I367-F369 PolarHBondContact O-N 3.21Å; I367-L370 PolarHBondContact O-N 3.2Å; I367-T371 WeakPolarHBondContact O-CB 3.48Å; I367-T371 PolarHBondContact O-N 3.26Å; I367-T371 PolarHBondContact O-OG1 3.15Å; I367-T416 HydrophobicContact CG2-CG2 3.44Å; I367-T416 VanDerWaalsContact CG2-CG2 3.44Å; I367-M420 HydrophobicContact CB-SD 4.41Å; I367-M420 HydrophobicContact CG2-CE 4.4Å; I367-M420 HydrophobicContact CG2-SD 3.91Å; I367-V674 HydrophobicContact CD1-CG2 3.47Å; I367-V674 VanDerWaalsContact CD1-CG2 3.47Å; I367-L689 HydrophobicContact CD1-CD1 4.18Å; I367-L689 HydrophobicContact CG1-CD1 3.92Å; I367-L689 HydrophobicContact CG1-CD2 4.02Å
368	R	96.4	Very high	92.2	Very high	62 Å²	62	25.8 Å²	25.8	23%	0.234	13%	0.132	C	C	.	.	H	α-helix	trans	-58.2	-48.6	176.8	-77.3	172	179.7	-171.6	0.5	111.9	L364 D365 G366 M372 F417 M420	L364-R368 WeakPolarHBondContact O-CB 3.43Å; L364-R368 WeakPolarHBondContact O-CG 3.46Å; L364-R368 PolarHBondContact O-N 3.26Å; D365-R368 PolarHBondContact O-N 3.19Å; G366-R368 PolarHBondContact O-N 3.48Å; R368-M372 VanDerWaalsContact O-CB 3.25Å; R368-M372 WeakPolarHBondContact O-CB 3.18Å; R368-M372 PolarHBondContact O-N 2.9Å; R368-F417 HydrophobicContact CB-CE1 4.36Å; R368-F417 HydrophobicContact CG-CE1 4.07Å; R368-M420 HydrophobicContact CG-CE 3.55Å; R368-M420 HydrophobicContact CG-SD 3.66Å
369	F	96.5	Very high	93.7	Very high	40 Å²	40	24.5 Å²	24.5	18%	0.175	12%	0.117	C	C	.	.	H	α-helix	trans	-61.1	-55	179.6	176.3	-104.5	0	0	0	111.1	D365 G366 I367 T371 M372 N373 F694 P697 Y742	D365-F369 PolarHBondContact O-N 3.03Å; G366-F369 PolarHBondContact O-N 3.13Å; I367-F369 PolarHBondContact O-N 3.21Å; F369-T371 VanDerWaalsContact C-N 3.31Å; F369-T371 PolarHBondContact O-N 2.82Å; F369-M372 PolarHBondContact O-N 3.44Å; F369-N373 WeakPolarHBondContact CD1-ND2 3.38Å; F369-N373 VanDerWaalsContact CD2-ND2 3.3Å; F369-N373 WeakPolarHBondContact CD2-ND2 3.18Å; F369-N373 VanDerWaalsContact CE1-ND2 3.28Å; F369-N373 WeakPolarHBondContact CE1-ND2 3.37Å; F369-N373 WeakPolarHBondContact CE2-ND2 3.43Å; F369-N373 WeakPolarHBondContact CG-ND2 3.36Å; F369-N373 WeakPolarHBondContact CZ-ND2 3.39Å; F369-N373 PolarHBondContact O-N 2.94Å; F369-N373 PolarHBondContact O-ND2 3.23Å; F369-F694 HydrophobicContact CB-CB 4.37Å; F369-F694 HydrophobicContact CB-CD1 4.01Å; F369-F694 HydrophobicContact CB-CG 4.33Å; F369-F694 AromaticContact CD1-CD1 3.25Å; F369-F694 HydrophobicContact CD1-CD1 3.25Å; F369-F694 AromaticContact CD1-CE1 3.22Å; F369-F694 HydrophobicContact CD1-CE1 3.22Å; F369-F694 HydrophobicContact CD1-CG 4.28Å; F369-F694 HydrophobicContact CD1-CZ 4.18Å; F369-F694 AromaticContact CE1-CD1 3.79Å; F369-F694 HydrophobicContact CE1-CD1 3.79Å; F369-F694 AromaticContact CE1-CE1 3.48Å; F369-F694 HydrophobicContact CE1-CE1 3.48Å; F369-F694 VanDerWaalsContact CE1-CE1 3.48Å; F369-F694 AromaticContact CG-CD1 3.69Å; F369-F694 HydrophobicContact CG-CD1 3.69Å; F369-F694 HydrophobicContact CG-CE1 4.14Å; F369-F694 HydrophobicContact CG-CG 4.48Å; F369-P697 HydrophobicContact CD2-CB 3.36Å; F369-P697 HydrophobicContact CD2-CG 4.15Å; F369-P697 HydrophobicContact CE2-CB 3.75Å; F369-P697 HydrophobicContact CE2-CG 4.16Å; F369-P697 HydrophobicContact CG-CB 4.34Å; F369-Y742 WeakPolarHBondContact CD2-OH 3.2Å; F369-Y742 HydrophobicContact CE2-CE2 4.2Å
370	L	97.1	Very high	94.5	Very high	85 Å²	85	23.4 Å²	23.4	45%	0.445	11%	0.112	S	C	.	.	H	α-helix	trans	-59.3	-43.1	-178.5	-67.3	174.4	0	0	0	112	G366 I367 N373 W374 L689	G366-L370 WeakPolarHBondContact O-CG 3.26Å; G366-L370 PolarHBondContact O-N 3.07Å; I367-L370 PolarHBondContact O-N 3.2Å; L370-N373 PolarHBondContact O-N 3.19Å; L370-W374 PolarHBondContact O-N 2.68Å; L370-L689 HydrophobicContact CD1-CD2 3.75Å
371	T	97.8	Very high	95.1	Very high	11 Å²	11	22.6 Å²	22.6	7%	0.067	11%	0.107	C	C	.	.	H	α-helix	trans	-64.5	-42.2	178	-53.7	0	0	0	0	111.4	I367 F369 N373 W374 I375 S413 T416 F417	I367-T371 WeakPolarHBondContact O-CB 3.48Å; I367-T371 PolarHBondContact O-N 3.26Å; I367-T371 PolarHBondContact O-OG1 3.15Å; F369-T371 VanDerWaalsContact C-N 3.31Å; F369-T371 PolarHBondContact O-N 2.82Å; T371-N373 VanDerWaalsContact C-N 3.34Å; T371-N373 PolarHBondContact O-N 3.49Å; T371-W374 WeakPolarHBondContact O-CB 3.49Å; T371-W374 PolarHBondContact O-N 2.85Å; T371-I375 WeakPolarHBondContact O-CG1 3.17Å; T371-I375 PolarHBondContact O-N 3.1Å; T371-S413 WeakPolarHBondContact CG2-O 3.49Å; T371-T416 HydrophobicContact CG2-CG2 4.26Å; T371-F417 HydrophobicContact CG2-CD2 3.79Å; T371-F417 HydrophobicContact CG2-CE2 3.38Å; T371-F417 HydrophobicContact CG2-CZ 4.22Å
372	M	97.7	Very high	95.2	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-62.6	-41.6	177	-173.6	60	-151.7	0	0	111.9	R368 F369 W374 I375 I376 F417 T701 A704 Y705 H708	R368-M372 VanDerWaalsContact O-CB 3.25Å; R368-M372 WeakPolarHBondContact O-CB 3.18Å; R368-M372 PolarHBondContact O-N 2.9Å; F369-M372 PolarHBondContact O-N 3.44Å; M372-W374 VanDerWaalsContact C-N 3.3Å; M372-W374 PolarHBondContact O-N 3.35Å; M372-I375 WeakPolarHBondContact O-CB 3.5Å; M372-I375 PolarHBondContact O-N 3.48Å; M372-I375 HydrophobicContact SD-CD1 4.42Å; M372-I376 HydrophobicContact CE-CD1 3.88Å; M372-I376 HydrophobicContact CE-CG1 3.7Å; M372-I376 HydrophobicContact CG-CD1 4.34Å; M372-I376 WeakPolarHBondContact O-CG1 3.4Å; M372-I376 PolarHBondContact O-N 3.39Å; M372-F417 HydrophobicContact CB-CZ 4.33Å; M372-T701 HydrophobicContact CB-CG2 3.82Å; M372-T701 HydrophobicContact CG-CG2 3.91Å; M372-T701 HydrophobicContact SD-CG2 4.01Å; M372-A704 HydrophobicContact CE-CB 4.15Å; M372-Y705 VanDerWaalsContact CE-CA 3.49Å; M372-Y705 HydrophobicContact CE-CD2 4.34Å; M372-Y705 HydrophobicContact SD-CD2 4.23Å; M372-H708 HydrophobicContact CE-CB 4.43Å; M372-H708 WeakPolarHBondContact CE-ND1 3.19Å
373	N	97	Very high	95.3	Very high	16 Å²	16	24.6 Å²	24.6	9%	0.086	12%	0.123	C	C	.	.	H	α-helix	trans	-64.8	-36.7	175.7	-71.4	-70.4	0	0	0	111.9	F369 L370 T371 I376 Y377 F734 L738	F369-N373 WeakPolarHBondContact CD1-ND2 3.38Å; F369-N373 VanDerWaalsContact CD2-ND2 3.3Å; F369-N373 WeakPolarHBondContact CD2-ND2 3.18Å; F369-N373 VanDerWaalsContact CE1-ND2 3.28Å; F369-N373 WeakPolarHBondContact CE1-ND2 3.37Å; F369-N373 WeakPolarHBondContact CE2-ND2 3.43Å; F369-N373 WeakPolarHBondContact CG-ND2 3.36Å; F369-N373 WeakPolarHBondContact CZ-ND2 3.39Å; F369-N373 PolarHBondContact O-N 2.94Å; F369-N373 PolarHBondContact O-ND2 3.23Å; L370-N373 PolarHBondContact O-N 3.19Å; T371-N373 VanDerWaalsContact C-N 3.34Å; T371-N373 PolarHBondContact O-N 3.49Å; N373-I376 PolarHBondContact O-N 2.96Å; N373-Y377 WeakPolarHBondContact O-CB 3.38Å; N373-Y377 PolarHBondContact O-N 2.92Å; N373-F734 HydrophobicContact CB-CZ 4.23Å; N373-F734 WeakPolarHBondContact O-CE2 3.31Å; N373-L738 WeakPolarHBondContact OD1-CD1 3.44Å
374	W	97.4	Very high	95.2	Very high	48 Å²	48	24.6 Å²	24.6	18%	0.182	12%	0.122	C	C	.	.	H	α-helix	trans	-63.4	-40.7	173.9	-170.9	18.9	0	0	0	112.3	L370 T371 M372 Y377 G378 V406 S409 L412 S413 V636 F666	L370-W374 PolarHBondContact O-N 2.68Å; T371-W374 WeakPolarHBondContact O-CB 3.49Å; T371-W374 PolarHBondContact O-N 2.85Å; M372-W374 VanDerWaalsContact C-N 3.3Å; M372-W374 PolarHBondContact O-N 3.35Å; W374-Y377 PolarHBondContact O-N 3.08Å; W374-G378 PolarHBondContact O-N 3.48Å; W374-V406 PolarHBondContact NE1-O 3.36Å; W374-S409 WeakPolarHBondContact CH2-O 3.24Å; W374-S409 VanDerWaalsContact CZ2-C 3.47Å; W374-S409 WeakPolarHBondContact CZ2-O 3.24Å; W374-L412 HydrophobicContact CH2-CB 4.03Å; W374-L412 HydrophobicContact CZ3-CB 4.45Å; W374-S413 VanDerWaalsContact CE3-CB 3.44Å; W374-V636 HydrophobicContact CH2-CG2 4.2Å; W374-F666 HydrophobicContact CH2-CE2 4.32Å; W374-F666 HydrophobicContact CH2-CZ 4.09Å; W374-F666 HydrophobicContact CZ3-CE1 4.39Å; W374-F666 HydrophobicContact CZ3-CE2 4.34Å; W374-F666 AromaticContact CZ3-CZ 3.71Å; W374-F666 HydrophobicContact CZ3-CZ 3.71Å
375	I	97.1	Very high	94.9	Very high	5 Å²	5	25.8 Å²	25.8	3%	0.026	13%	0.128	C	C	.	.	H	α-helix	trans	-58.8	-52	172.3	-67.7	168.4	0	0	0	110.6	T371 M372 Y377 G378 H379 S413 V414 F417 Y705	T371-I375 WeakPolarHBondContact O-CG1 3.17Å; T371-I375 PolarHBondContact O-N 3.1Å; M372-I375 WeakPolarHBondContact O-CB 3.5Å; M372-I375 PolarHBondContact O-N 3.48Å; M372-I375 HydrophobicContact SD-CD1 4.42Å; I375-Y377 VanDerWaalsContact C-N 3.29Å; I375-Y377 PolarHBondContact O-N 3.2Å; I375-G378 PolarHBondContact O-N 3.02Å; I375-H379 WeakPolarHBondContact O-CB 3.13Å; I375-H379 PolarHBondContact O-N 3.48Å; I375-S413 WeakPolarHBondContact CG1-OG 3.38Å; I375-V414 HydrophobicContact CD1-CG1 4.12Å; I375-F417 HydrophobicContact CD1-CD2 4.06Å; I375-F417 HydrophobicContact CD1-CE2 3.58Å; I375-Y705 HydrophobicContact CD1-CD2 4.33Å; I375-Y705 HydrophobicContact CD1-CE2 4.31Å; I375-Y705 HydrophobicContact CG2-CD2 4.41Å; I375-Y705 HydrophobicContact CG2-CE2 4.23Å
376	I	97.6	Very high	94.4	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-57.2	-46.4	-178.5	-66.3	169.5	0	0	0	109.9	M372 N373 G378 H379 C380 H708 F734 V737 T741	M372-I376 HydrophobicContact CE-CD1 3.88Å; M372-I376 HydrophobicContact CE-CG1 3.7Å; M372-I376 HydrophobicContact CG-CD1 4.34Å; M372-I376 WeakPolarHBondContact O-CG1 3.4Å; M372-I376 PolarHBondContact O-N 3.39Å; N373-I376 PolarHBondContact O-N 2.96Å; I376-G378 PolarHBondContact O-N 3.07Å; I376-H379 PolarHBondContact O-N 3.31Å; I376-C380 PolarHBondContact O-N 3.46Å; I376-C380 PolarHBondContact O-SG 3.28Å; I376-H708 HydrophobicContact CD1-CB 4.49Å; I376-H708 HydrophobicContact CG1-CB 4.08Å; I376-F734 HydrophobicContact CB-CE2 4.18Å; I376-F734 HydrophobicContact CG2-CD2 3.95Å; I376-F734 HydrophobicContact CG2-CE2 4Å; I376-V737 HydrophobicContact CG2-CG1 3.72Å; I376-T741 HydrophobicContact CD1-CG2 4.25Å
377	Y	95.6	Very high	94.1	Very high	55 Å²	55	31.4 Å²	31.4	22%	0.216	15%	0.152	C	C	.	.	H	α-helix	trans	-61.2	-46.1	179.9	-171.9	-116.7	0	0	0	112.6	N373 W374 I375 H379 C380 I381 I407 F734	N373-Y377 WeakPolarHBondContact O-CB 3.38Å; N373-Y377 PolarHBondContact O-N 2.92Å; W374-Y377 PolarHBondContact O-N 3.08Å; I375-Y377 VanDerWaalsContact C-N 3.29Å; I375-Y377 PolarHBondContact O-N 3.2Å; Y377-H379 VanDerWaalsContact C-N 3.34Å; Y377-H379 PolarHBondContact O-N 3.22Å; Y377-C380 PolarHBondContact O-N 3.41Å; Y377-I381 HydrophobicContact CE1-CD1 4.46Å; Y377-I407 HydrophobicContact CD1-CG1 3.93Å; Y377-I407 HydrophobicContact CE1-CD1 3.7Å; Y377-I407 HydrophobicContact CE1-CG1 3.46Å; Y377-I407 VanDerWaalsContact CE1-CG1 3.46Å; Y377-F734 HydrophobicContact CD2-CB 3.86Å; Y377-F734 HydrophobicContact CD2-CD1 4.32Å; Y377-F734 AromaticContact CD2-CD2 3.79Å; Y377-F734 HydrophobicContact CD2-CD2 3.79Å; Y377-F734 HydrophobicContact CD2-CE2 4.43Å; Y377-F734 AromaticContact CD2-CG 3.72Å; Y377-F734 HydrophobicContact CD2-CG 3.72Å; Y377-F734 HydrophobicContact CE2-CB 4.31Å; Y377-F734 HydrophobicContact CE2-CG 4.48Å; Y377-F734 HydrophobicContact CG-CD2 4.31Å
378	G	94.2	Very high	93.8	Very high	9 Å²	9	30.9 Å²	30.9	9%	0.093	15%	0.149	C	C	.	.	H	α-helix	trans	-61.6	-40.7	175.7	0	0	0	0	0	112.8	W374 I375 I376 I381 A382	W374-G378 PolarHBondContact O-N 3.48Å; I375-G378 PolarHBondContact O-N 3.02Å; I376-G378 PolarHBondContact O-N 3.07Å; G378-I381 PolarHBondContact O-N 3.38Å; G378-A382 PolarHBondContact O-N 3.39Å
379	H	95.1	Very high	93.7	Very high	50 Å²	50	28.8 Å²	28.8	23%	0.231	14%	0.142	C	C	.	.	H	α-helix	trans	-72.3	-31.4	178	-78.7	175.9	0	0	0	113.7	I375 I376 Y377 I381 A382 F383 H708 I712	I375-H379 WeakPolarHBondContact O-CB 3.13Å; I375-H379 PolarHBondContact O-N 3.48Å; I376-H379 PolarHBondContact O-N 3.31Å; Y377-H379 VanDerWaalsContact C-N 3.34Å; Y377-H379 PolarHBondContact O-N 3.22Å; H379-I381 PolarHBondContact O-N 3.44Å; H379-A382 PolarHBondContact O-N 3.34Å; H379-F383 HydrophobicContact CB-CD2 3.78Å; H379-F383 HydrophobicContact CB-CE2 3.77Å; H379-F383 AromaticContact CG-CE2 3.69Å; H379-F383 AromaticContact ND1-CE2 3.9Å; H379-F383 WeakPolarHBondContact O-CB 3.43Å; H379-F383 VanDerWaalsContact O-CD2 3.24Å; H379-F383 WeakPolarHBondContact O-CD2 3.2Å; H379-F383 PolarHBondContact O-N 3.46Å; H379-H708 AromaticContact CE1-NE2 3.69Å; H379-H708 AromaticContact CG-NE2 3.87Å; H379-H708 AromaticContact ND1-CD2 3.73Å; H379-H708 AromaticContact ND1-CE1 3.87Å; H379-H708 AromaticContact ND1-NE2 2.84Å; H379-H708 PolarHBondContact ND1-NE2 3.1Å; H379-I712 HydrophobicContact CB-CD1 3.89Å
380	C	95.3	Very high	93.5	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-54.9	-37.9	171.5	-74.7	0	0	0	0	110.8	I376 Y377 S384 M733	I376-C380 PolarHBondContact O-N 3.46Å; I376-C380 PolarHBondContact O-SG 3.28Å; Y377-C380 PolarHBondContact O-N 3.41Å; C380-S384 WeakPolarHBondContact O-CB 3.36Å; C380-S384 PolarHBondContact O-N 2.9Å; C380-S384 PolarHBondContact O-OG 3.47Å; C380-M733 HydrophobicContact CB-CG 4.19Å
381	I	91.6	Very high	93.1	Very high	2 Å²	2	26 Å²	26	1%	0.01	13%	0.129	C	C	.	.	H	α-helix	trans	-76.7	-53	177.8	-63.2	165	0	0	0	110.4	Y377 G378 H379 F383 S384 M385 F394 I407 L730	Y377-I381 HydrophobicContact CE1-CD1 4.46Å; G378-I381 PolarHBondContact O-N 3.38Å; H379-I381 PolarHBondContact O-N 3.44Å; I381-F383 VanDerWaalsContact C-N 3.32Å; I381-F383 PolarHBondContact O-N 3.18Å; I381-S384 PolarHBondContact O-N 2.84Å; I381-M385 HydrophobicContact CG2-CE 3.79Å; I381-M385 HydrophobicContact CG2-SD 4.31Å; I381-M385 WeakPolarHBondContact O-CG 3.46Å; I381-M385 PolarHBondContact O-N 2.86Å; I381-F394 HydrophobicContact CG2-CE1 4.31Å; I381-I407 HydrophobicContact CB-CG2 4.4Å; I381-I407 HydrophobicContact CD1-CB 4.04Å; I381-I407 HydrophobicContact CD1-CD1 3.27Å; I381-I407 HydrophobicContact CD1-CG1 3.49Å; I381-I407 VanDerWaalsContact CD1-CG1 3.49Å; I381-I407 HydrophobicContact CD1-CG2 3.38Å; I381-I407 HydrophobicContact CG1-CG2 4.46Å; I381-I407 HydrophobicContact CG2-CG2 4.41Å; I381-L730 HydrophobicContact CB-CD2 4.31Å; I381-L730 HydrophobicContact CD1-CD1 3.76Å; I381-L730 HydrophobicContact CD1-CD2 4.37Å; I381-L730 HydrophobicContact CG1-CD1 3.6Å; I381-L730 HydrophobicContact CG1-CD2 3.37Å; I381-L730 HydrophobicContact CG1-CG 4.02Å
382	A	89.4	Confident	92.7	Very high	44 Å²	44	28.3 Å²	28.3	36%	0.364	14%	0.141	S	C	.	.	H	α-helix	trans	-58.4	-41.3	-175.1	0	0	0	0	0	112.8	G378 H379	G378-A382 PolarHBondContact O-N 3.39Å; H379-A382 PolarHBondContact O-N 3.34Å
383	F	90.6	Very high	92.3	Very high	32 Å²	32	31.6 Å²	31.6	14%	0.14	16%	0.158	C	C	.	.	H	α-helix	trans	-79.9	-33.4	178.4	-69.5	-65.3	0	0	0	113.1	H379 I381 M385 F386 W515 P709 I712 L713	H379-F383 HydrophobicContact CB-CD2 3.78Å; H379-F383 HydrophobicContact CB-CE2 3.77Å; H379-F383 AromaticContact CG-CE2 3.69Å; H379-F383 AromaticContact ND1-CE2 3.9Å; H379-F383 WeakPolarHBondContact O-CB 3.43Å; H379-F383 VanDerWaalsContact O-CD2 3.24Å; H379-F383 WeakPolarHBondContact O-CD2 3.2Å; H379-F383 PolarHBondContact O-N 3.46Å; I381-F383 VanDerWaalsContact C-N 3.32Å; I381-F383 PolarHBondContact O-N 3.18Å; F383-M385 VanDerWaalsContact C-N 3.26Å; F383-M385 PolarHBondContact O-N 2.84Å; F383-F386 HydrophobicContact CD1-CD2 4.4Å; F383-F386 HydrophobicContact CD1-CE2 4.21Å; F383-F386 PolarHBondContact O-N 2.95Å; F383-W515 HydrophobicContact CZ-CE3 4.15Å; F383-P709 HydrophobicContact CD2-CB 4.36Å; F383-P709 HydrophobicContact CE2-CB 3.65Å; F383-P709 HydrophobicContact CE2-CG 4.2Å; F383-P709 HydrophobicContact CZ-CB 3.86Å; F383-I712 HydrophobicContact CB-CG2 3.59Å; F383-I712 HydrophobicContact CD2-CD1 4.39Å; F383-I712 HydrophobicContact CD2-CG2 4.22Å; F383-I712 HydrophobicContact CG-CG2 4.3Å; F383-L713 HydrophobicContact CB-CD2 4.3Å; F383-L713 HydrophobicContact CD1-CD2 3.87Å; F383-L713 HydrophobicContact CD1-CG 4.27Å; F383-L713 HydrophobicContact CG-CD2 4.31Å
384	S	91.6	Very high	92	Very high	0 Å²	0	31 Å²	31	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-70	-25.7	177.4	-58.2	0	0	0	0	112.4	C380 I381 F386 V387 A388	C380-S384 WeakPolarHBondContact O-CB 3.36Å; C380-S384 PolarHBondContact O-N 2.9Å; C380-S384 PolarHBondContact O-OG 3.47Å; I381-S384 PolarHBondContact O-N 2.84Å; S384-F386 PolarHBondContact O-N 2.97Å; S384-V387 VanDerWaalsContact O-CG2 3.28Å; S384-V387 WeakPolarHBondContact O-CG2 3.2Å; S384-V387 PolarHBondContact O-N 2.84Å; S384-V387 VanDerWaalsContact O-N 3.08Å; S384-A388 WeakPolarHBondContact O-CB 3.32Å; S384-A388 PolarHBondContact O-N 3.11Å
385	M	88.2	Confident	91.6	Very high	31 Å²	31	30 Å²	30	15%	0.153	16%	0.155	C	C	.	.	G	3₁₀ helix	trans	-55.7	-33	173.5	-85.7	179.7	172.8	0	0	113.3	I381 F383 V387 A388 M391 F394 Y404 L725	I381-M385 HydrophobicContact CG2-CE 3.79Å; I381-M385 HydrophobicContact CG2-SD 4.31Å; I381-M385 WeakPolarHBondContact O-CG 3.46Å; I381-M385 PolarHBondContact O-N 2.86Å; F383-M385 VanDerWaalsContact C-N 3.26Å; F383-M385 PolarHBondContact O-N 2.84Å; M385-V387 PolarHBondContact O-N 3.46Å; M385-A388 PolarHBondContact O-N 2.94Å; M385-M391 HydrophobicContact CB-CG 4.08Å; M385-M391 HydrophobicContact CB-SD 3.63Å; M385-M391 HydrophobicContact CG-CG 3.93Å; M385-M391 HydrophobicContact CG-SD 4.1Å; M385-M391 VanDerWaalsContact O-SD 3.39Å; M385-M391 HydrophobicContact SD-CG 4.4Å; M385-F394 HydrophobicContact CE-CD1 3.92Å; M385-F394 HydrophobicContact CE-CE1 4.14Å; M385-Y404 WeakPolarHBondContact CE-OH 3.5Å; M385-L725 HydrophobicContact CG-CD1 3.7Å
386	F	82.5	Confident	91.1	Very high	153 Å²	153	34.3 Å²	34.3	67%	0.671	18%	0.175	S	C	*	.	G	3₁₀ helix	trans	-66.2	-19.5	177.8	-66.5	-67.3	0	0	0	114.1	F383 S384	F383-F386 HydrophobicContact CD1-CD2 4.4Å; F383-F386 HydrophobicContact CD1-CE2 4.21Å; F383-F386 PolarHBondContact O-N 2.95Å; S384-F386 PolarHBondContact O-N 2.97Å
387	V	89.2	Confident	90.7	Very high	4 Å²	4	38.5 Å²	38.5	2%	0.024	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	-118.7	9.5	-177.5	-57.6	0	0	0	0	112.9	S384 M385 M480 A716 L717 P722 I723	S384-V387 VanDerWaalsContact O-CG2 3.28Å; S384-V387 WeakPolarHBondContact O-CG2 3.2Å; S384-V387 PolarHBondContact O-N 2.84Å; S384-V387 VanDerWaalsContact O-N 3.08Å; M385-V387 PolarHBondContact O-N 3.46Å; V387-M480 HydrophobicContact CB-CE 3.76Å; V387-M480 HydrophobicContact CG1-CE 3.74Å; V387-A716 HydrophobicContact CG2-CB 3.94Å; V387-L717 HydrophobicContact CG1-CD2 3.61Å; V387-L717 HydrophobicContact CG1-CG 4.44Å; V387-P722 WeakPolarHBondContact O-CA 3.32Å; V387-I723 HydrophobicContact CG2-CB 4.34Å; V387-I723 HydrophobicContact CG2-CD1 3.65Å; V387-I723 HydrophobicContact CG2-CG1 4.04Å; V387-I723 PolarHBondContact O-N 3.38Å
388	A	92.6	Very high	90.4	Very high	2 Å²	2	36.6 Å²	36.6	2%	0.017	19%	0.189	C	C	.	.	B	Isolated β-bridge	trans	-92.4	140.2	-173.3	0	0	0	0	0	112.7	S384 M385 M391 I723 L725	S384-A388 WeakPolarHBondContact O-CB 3.32Å; S384-A388 PolarHBondContact O-N 3.11Å; M385-A388 PolarHBondContact O-N 2.94Å; A388-M391 HydrophobicContact CB-CB 4.31Å; A388-I723 CarbonylContact C-O 3.5Å; A388-I723 WeakPolarHBondContact CA-O 3.47Å; A388-L725 HydrophobicContact CB-CD1 3.57Å; A388-L725 HydrophobicContact CB-CD2 4.46Å; A388-L725 HydrophobicContact CB-CG 3.63Å
389	N	93.1	Very high	90	Very high	17 Å²	17	38.3 Å²	38.3	9%	0.091	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.8	9.4	176.1	-95.1	-5	0	0	0	114.4	G117 G118 I119 N120 P722 I723 L724	G117-N389 CarbonylContact C-O 3.46Å; G117-N389 VanDerWaalsContact C-O 3.32Å; G117-N389 CarbonylContact O-C 3.59Å; G117-N389 WeakPolarHBondContact O-CA 3.48Å; G118-N389 WeakPolarHBondContact CA-O 3.26Å; G118-N389 PolarHBondContact N-O 3.06Å; G118-N389 VanDerWaalsContact N-O 3.08Å; I119-N389 PolarHBondContact N-OD1 3.35Å; N120-N389 WeakPolarHBondContact CA-OD1 3.11Å; N120-N389 VanDerWaalsContact CB-OD1 3.26Å; N120-N389 WeakPolarHBondContact CB-OD1 3.38Å; N120-N389 PolarHBondContact N-OD1 3.42Å; N120-N389 PolarHBondContact ND2-OD1 3.09Å; N120-N389 PolarHBondContact O-ND2 3.04Å; N389-P722 HydrophobicContact CB-CB 4.02Å; N389-P722 VanDerWaalsContact CG-CB 3.46Å; N389-P722 VanDerWaalsContact ND2-CB 3.32Å; N389-P722 WeakPolarHBondContact ND2-CB 3.27Å; N389-P722 WeakPolarHBondContact ND2-CG 3.32Å; N389-I723 PolarHBondContact N-O 2.99Å; N389-L724 HydrophobicContact CB-CD2 4.23Å
390	N	92.9	Very high	89.7	Confident	27 Å²	27	38.3 Å²	38.3	14%	0.144	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-140.4	23.3	176.6	69.5	-25.3	0	0	0	112.1	G116 L392 L393 F394 L724 L725	G116-N390 CarbonylContact O-C 3.6Å; G116-N390 VanDerWaalsContact O-CA 3.27Å; G116-N390 WeakPolarHBondContact O-CA 3.37Å; N390-L392 PolarHBondContact O-N 3.23Å; N390-L393 PolarHBondContact O-N 3.09Å; N390-F394 WeakPolarHBondContact O-CB 3.5Å; N390-F394 PolarHBondContact O-N 2.59Å; N390-L724 HydrophobicContact CB-CD2 4.3Å; N390-L725 PolarHBondContact ND2-N 3.29Å; N390-L725 PolarHBondContact ND2-O 3.22Å; N390-L725 PolarHBondContact OD1-N 2.9Å
391	M	89.1	Confident	89.5	Confident	40 Å²	40	41.7 Å²	41.7	20%	0.197	21%	0.214	C	C	.	.	H	α-helix	trans	-54	-47.6	-175.1	169.9	176	49	0	0	113.2	G116 F165 M385 A388 S395	G116-M391 PolarHBondContact O-N 3.35Å; F165-M391 HydrophobicContact CD1-CE 4.35Å; F165-M391 HydrophobicContact CE1-CE 3.69Å; M385-M391 HydrophobicContact CB-CG 4.08Å; M385-M391 HydrophobicContact CB-SD 3.63Å; M385-M391 HydrophobicContact CG-CG 3.93Å; M385-M391 HydrophobicContact CG-SD 4.1Å; M385-M391 VanDerWaalsContact O-SD 3.39Å; M385-M391 HydrophobicContact SD-CG 4.4Å; A388-M391 HydrophobicContact CB-CB 4.31Å; M391-S395 VanDerWaalsContact O-CB 3.29Å; M391-S395 WeakPolarHBondContact O-CB 3.45Å; M391-S395 PolarHBondContact O-N 3.47Å
392	L	88.3	Confident	89.5	Confident	59 Å²	59	48.8 Å²	48.8	31%	0.309	24%	0.241	S	C	.	.	H	α-helix	trans	-68.4	-44.4	-178.3	-67.5	98	0	0	0	110.9	G116 F165 N390 S395 Q396	G116-L392 PolarHBondContact O-N 2.94Å; F165-L392 HydrophobicContact CE1-CD1 4.07Å; F165-L392 HydrophobicContact CZ-CD1 4.22Å; F165-L392 HydrophobicContact CZ-CD2 4.17Å; F165-L392 HydrophobicContact CZ-CG 4.4Å; N390-L392 PolarHBondContact O-N 3.23Å; L392-S395 WeakPolarHBondContact O-CB 3.43Å; L392-S395 PolarHBondContact O-N 2.71Å; L392-Q396 WeakPolarHBondContact O-CB 3.27Å; L392-Q396 VanDerWaalsContact O-CG 3.27Å; L392-Q396 WeakPolarHBondContact O-CG 3.42Å; L392-Q396 PolarHBondContact O-N 3.18Å
393	L	89.8	Confident	89.5	Confident	69 Å²	69	49.8 Å²	49.8	36%	0.361	24%	0.243	S	C	.	.	H	α-helix	trans	-64.2	-42.7	178	178.8	62.6	0	0	0	111.7	G116 N390 S395 Q396 I397	G116-L393 PolarHBondContact O-N 3.36Å; N390-L393 PolarHBondContact O-N 3.09Å; L393-S395 VanDerWaalsContact C-N 3.34Å; L393-Q396 PolarHBondContact O-N 3.4Å; L393-I397 HydrophobicContact CD1-CD1 3.59Å; L393-I397 HydrophobicContact CD1-CG1 4.15Å; L393-I397 HydrophobicContact CG-CD1 3.81Å; L393-I397 WeakPolarHBondContact O-CB 3.49Å; L393-I397 WeakPolarHBondContact O-CG1 3.41Å; L393-I397 PolarHBondContact O-N 3.38Å
394	F	90.9	Very high	89.5	Confident	3 Å²	3	48.9 Å²	48.9	1%	0.013	24%	0.238	C	C	.	.	H	α-helix	trans	-59.6	-47.5	175.4	178.6	-95.2	0	0	0	110.4	I381 M385 N390 Q396 I397 H398 Y404 L725 L730	I381-F394 HydrophobicContact CG2-CE1 4.31Å; M385-F394 HydrophobicContact CE-CD1 3.92Å; M385-F394 HydrophobicContact CE-CE1 4.14Å; N390-F394 WeakPolarHBondContact O-CB 3.5Å; N390-F394 PolarHBondContact O-N 2.59Å; F394-Q396 PolarHBondContact O-N 3.16Å; F394-I397 PolarHBondContact O-N 3.04Å; F394-H398 AromaticContact CD2-CD2 3.47Å; F394-H398 VanDerWaalsContact CD2-CD2 3.47Å; F394-H398 WeakPolarHBondContact CD2-CD2 3.48Å; F394-H398 AromaticContact CD2-NE2 3.72Å; F394-H398 HydrophobicContact CE1-CB 4.38Å; F394-H398 HydrophobicContact CE2-CB 4.42Å; F394-H398 AromaticContact CE2-CD2 3.49Å; F394-H398 VanDerWaalsContact CE2-CD2 3.49Å; F394-H398 WeakPolarHBondContact CE2-CD2 3.41Å; F394-H398 AromaticContact CE2-CE1 3.63Å; F394-H398 AromaticContact CE2-CG 3.64Å; F394-H398 AromaticContact CE2-ND1 3.73Å; F394-H398 AromaticContact CE2-NE2 3.57Å; F394-H398 HydrophobicContact CZ-CB 4.2Å; F394-H398 AromaticContact CZ-CG 3.85Å; F394-H398 AromaticContact CZ-ND1 3.98Å; F394-H398 VanDerWaalsContact O-CB 3.3Å; F394-H398 WeakPolarHBondContact O-CB 3.44Å; F394-H398 PolarHBondContact O-CD2 3.39Å; F394-H398 PolarHBondContact O-N 2.83Å; F394-Y404 AromaticContact CE1-CE2 3.64Å; F394-Y404 HydrophobicContact CE1-CE2 3.64Å; F394-Y404 AromaticContact CZ-CE2 3.95Å; F394-Y404 HydrophobicContact CZ-CE2 3.95Å; F394-L725 HydrophobicContact CB-CB 4.12Å; F394-L725 HydrophobicContact CB-CD1 4.43Å; F394-L725 HydrophobicContact CD1-CB 4.17Å; F394-L725 HydrophobicContact CD1-CD1 4.02Å; F394-L725 HydrophobicContact CD2-CB 3.59Å; F394-L725 VanDerWaalsContact CD2-O 3.27Å; F394-L725 WeakPolarHBondContact CD2-O 3.24Å; F394-L725 HydrophobicContact CE2-CB 4.03Å; F394-L725 HydrophobicContact CG-CB 3.67Å; F394-L725 HydrophobicContact CG-CD1 4.18Å; F394-L730 HydrophobicContact CE1-CD1 4.43Å; F394-L730 HydrophobicContact CE2-CD1 4.16Å; F394-L730 HydrophobicContact CZ-CD1 3.57Å
395	S	88	Confident	89.5	Confident	27 Å²	27	48.9 Å²	48.9	19%	0.189	24%	0.238	C	C	.	.	H	α-helix	trans	-57.5	-48.4	174.8	-174.9	0	0	0	0	111.7	M391 L392 L393 I397 Q399	M391-S395 VanDerWaalsContact O-CB 3.29Å; M391-S395 WeakPolarHBondContact O-CB 3.45Å; M391-S395 PolarHBondContact O-N 3.47Å; L392-S395 WeakPolarHBondContact O-CB 3.43Å; L392-S395 PolarHBondContact O-N 2.71Å; L393-S395 VanDerWaalsContact C-N 3.34Å; S395-I397 PolarHBondContact O-N 3.27Å; S395-Q399 WeakPolarHBondContact O-CB 3.17Å; S395-Q399 WeakPolarHBondContact O-CG 3.35Å; S395-Q399 PolarHBondContact O-N 3.07Å; S395-Q399 VanDerWaalsContact OG-CD 3.24Å; S395-Q399 PolarHBondContact OG-NE2 2.9Å
396	Q	87.3	Confident	89.7	Confident	97 Å²	97	49.6 Å²	49.6	45%	0.453	24%	0.244	S	C	.	.	H	α-helix	trans	-62.2	-40.7	179.7	-73.6	170.6	-4.4	0	0	113.1	L392 L393 F394 P400	L392-Q396 WeakPolarHBondContact O-CB 3.27Å; L392-Q396 VanDerWaalsContact O-CG 3.27Å; L392-Q396 WeakPolarHBondContact O-CG 3.42Å; L392-Q396 PolarHBondContact O-N 3.18Å; L393-Q396 PolarHBondContact O-N 3.4Å; F394-Q396 PolarHBondContact O-N 3.16Å; Q396-P400 WeakPolarHBondContact O-CD 3.41Å; Q396-P400 WeakPolarHBondContact O-CG 3.36Å
397	I	89.4	Confident	90	Very high	87 Å²	87	43.2 Å²	43.2	45%	0.446	22%	0.217	S	C	.	.	H	α-helix	trans	-79.6	-37.8	-178.3	-71.3	168.9	0	0	0	112.1	L393 F394 S395	L393-I397 HydrophobicContact CD1-CD1 3.59Å; L393-I397 HydrophobicContact CD1-CG1 4.15Å; L393-I397 HydrophobicContact CG-CD1 3.81Å; L393-I397 WeakPolarHBondContact O-CB 3.49Å; L393-I397 WeakPolarHBondContact O-CG1 3.41Å; L393-I397 PolarHBondContact O-N 3.38Å; F394-I397 PolarHBondContact O-N 3.04Å; S395-I397 PolarHBondContact O-N 3.27Å
398	H	89.2	Confident	90	Very high	15 Å²	15	44 Å²	44	7%	0.069	22%	0.221	C	C	.	.	H	α-helix	trans	-92.4	-32.2	-171.5	-71.8	-108.2	0	0	0	113.5	F394 P400 K401 Y404 D727	F394-H398 AromaticContact CD2-CD2 3.47Å; F394-H398 VanDerWaalsContact CD2-CD2 3.47Å; F394-H398 WeakPolarHBondContact CD2-CD2 3.48Å; F394-H398 AromaticContact CD2-NE2 3.72Å; F394-H398 HydrophobicContact CE1-CB 4.38Å; F394-H398 HydrophobicContact CE2-CB 4.42Å; F394-H398 AromaticContact CE2-CD2 3.49Å; F394-H398 VanDerWaalsContact CE2-CD2 3.49Å; F394-H398 WeakPolarHBondContact CE2-CD2 3.41Å; F394-H398 AromaticContact CE2-CE1 3.63Å; F394-H398 AromaticContact CE2-CG 3.64Å; F394-H398 AromaticContact CE2-ND1 3.73Å; F394-H398 AromaticContact CE2-NE2 3.57Å; F394-H398 HydrophobicContact CZ-CB 4.2Å; F394-H398 AromaticContact CZ-CG 3.85Å; F394-H398 AromaticContact CZ-ND1 3.98Å; F394-H398 VanDerWaalsContact O-CB 3.3Å; F394-H398 WeakPolarHBondContact O-CB 3.44Å; F394-H398 PolarHBondContact O-CD2 3.39Å; F394-H398 PolarHBondContact O-N 2.83Å; H398-P400 VanDerWaalsContact C-N 3.3Å; H398-K401 PolarHBondContact CE1-NZ 3.28Å; H398-K401 PolarHBondContact NE2-NZ 3.43Å; H398-K401 VanDerWaalsContact O-CB 3.3Å; H398-K401 WeakPolarHBondContact O-CB 3.47Å; H398-K401 PolarHBondContact O-N 2.78Å; H398-Y404 HydrophobicContact CB-CD1 4.49Å; H398-Y404 HydrophobicContact CB-CD2 3.71Å; H398-Y404 HydrophobicContact CB-CE2 4.1Å; H398-Y404 HydrophobicContact CB-CG 3.94Å; H398-Y404 WeakPolarHBondContact O-CB 3.28Å; H398-D727 IonicContact CE1-OD1 3.9Å; H398-D727 PolarHBondContact CE1-OD1 3.38Å; H398-D727 IonicContact CE1-OD2 2.86Å; H398-D727 IonicContact ND1-OD1 3.87Å; H398-D727 PolarHBondContact ND1-OD1 2.9Å
399	Q	86	Confident	90	Very high	45 Å²	45	44.2 Å²	44.2	21%	0.21	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-39.1	177.2	-73.8	-178	-2.2	0	0	113.8	S395 K401 Y404 Q405 I408	S395-Q399 WeakPolarHBondContact O-CB 3.17Å; S395-Q399 WeakPolarHBondContact O-CG 3.35Å; S395-Q399 PolarHBondContact O-N 3.07Å; S395-Q399 VanDerWaalsContact OG-CD 3.24Å; S395-Q399 PolarHBondContact OG-NE2 2.9Å; Q399-K401 PolarHBondContact O-N 2.84Å; Q399-Y404 HydrophobicContact CG-CD1 4.2Å; Q399-Y404 HydrophobicContact CG-CE1 3.85Å; Q399-Q405 PolarHBondContact O-NE2 3.36Å; Q399-I408 HydrophobicContact CG-CD1 4.16Å
400	P	89	Confident	90	Very high	50 Å²	50	44 Å²	44	33%	0.325	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-11.8	174.4	-26.4	38.3	0	0	0	115.2	Q396 H398 Y640 S644	Q396-P400 WeakPolarHBondContact O-CD 3.41Å; Q396-P400 WeakPolarHBondContact O-CG 3.36Å; H398-P400 VanDerWaalsContact C-N 3.3Å; P400-Y640 WeakPolarHBondContact O-CE2 3.43Å; P400-S644 PolarHBondContact O-OG 3.28Å
401	K	91.5	Very high	89.9	Confident	71 Å²	71	44.3 Å²	44.3	31%	0.309	23%	0.225	S	C	.	.	S	Bend	trans	-82.7	141.1	-177.9	-61.9	178.4	-177.8	171.1	0	110.5	H398 Q399 T403 Y404	H398-K401 PolarHBondContact CE1-NZ 3.28Å; H398-K401 PolarHBondContact NE2-NZ 3.43Å; H398-K401 VanDerWaalsContact O-CB 3.3Å; H398-K401 WeakPolarHBondContact O-CB 3.47Å; H398-K401 PolarHBondContact O-N 2.78Å; Q399-K401 PolarHBondContact O-N 2.84Å; K401-T403 VanDerWaalsContact C-N 3.32Å; K401-T403 PolarHBondContact O-N 2.98Å; K401-Y404 PolarHBondContact O-N 2.98Å
402	W	90.8	Very high	90.2	Very high	151 Å²	151	42.5 Å²	42.5	57%	0.572	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-36.8	177.7	70.5	-90.8	0	0	0	112	Y404 Q405 Y637 Y640	W402-Y404 PolarHBondContact O-N 3Å; W402-Q405 VanDerWaalsContact O-CB 3.31Å; W402-Q405 WeakPolarHBondContact O-CB 3.37Å; W402-Q405 WeakPolarHBondContact O-CG 3.44Å; W402-Q405 PolarHBondContact O-N 3.23Å; W402-Q405 VanDerWaalsContact O-N 3.16Å; W402-Y637 HydrophobicContact CE3-CE1 4.07Å; W402-Y637 WeakPolarHBondContact O-CE1 3.37Å; W402-Y640 HydrophobicContact CB-CD2 4.05Å; W402-Y640 HydrophobicContact CB-CE2 3.67Å
403	T	89.9	Confident	90.6	Very high	65 Å²	65	39.8 Å²	39.8	40%	0.399	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-33.2	178.8	49.8	0	0	0	0	112.5	K401 Q405	K401-T403 VanDerWaalsContact C-N 3.32Å; K401-T403 PolarHBondContact O-N 2.98Å; T403-Q405 VanDerWaalsContact C-N 3.28Å; T403-Q405 PolarHBondContact O-N 2.99Å
404	Y	90.1	Very high	90.9	Very high	14 Å²	14	36.8 Å²	36.8	6%	0.055	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-16.4	-178.9	-164.1	-100.9	0	0	0	113.1	M385 F394 H398 Q399 K401 W402 V406 I407 I408	M385-Y404 WeakPolarHBondContact CE-OH 3.5Å; F394-Y404 AromaticContact CE1-CE2 3.64Å; F394-Y404 HydrophobicContact CE1-CE2 3.64Å; F394-Y404 AromaticContact CZ-CE2 3.95Å; F394-Y404 HydrophobicContact CZ-CE2 3.95Å; H398-Y404 HydrophobicContact CB-CD1 4.49Å; H398-Y404 HydrophobicContact CB-CD2 3.71Å; H398-Y404 HydrophobicContact CB-CE2 4.1Å; H398-Y404 HydrophobicContact CB-CG 3.94Å; H398-Y404 WeakPolarHBondContact O-CB 3.28Å; Q399-Y404 HydrophobicContact CG-CD1 4.2Å; Q399-Y404 HydrophobicContact CG-CE1 3.85Å; K401-Y404 PolarHBondContact O-N 2.98Å; W402-Y404 PolarHBondContact O-N 3Å; Y404-V406 PolarHBondContact O-N 3.31Å; Y404-I407 HydrophobicContact CD2-CB 4.27Å; Y404-I407 HydrophobicContact CD2-CD1 3.5Å; Y404-I407 HydrophobicContact CD2-CG1 4.49Å; Y404-I407 HydrophobicContact CE2-CB 4.24Å; Y404-I407 HydrophobicContact CE2-CD1 3.82Å; Y404-I407 HydrophobicContact CE2-CG2 4Å; Y404-I407 HydrophobicContact CG-CD1 4.33Å; Y404-I407 WeakPolarHBondContact O-CA 3.27Å; Y404-I407 WeakPolarHBondContact O-CB 3.06Å; Y404-I407 PolarHBondContact O-N 2.81Å; Y404-I408 HydrophobicContact CD1-CD1 3.62Å; Y404-I408 HydrophobicContact CD1-CG1 3.6Å; Y404-I408 HydrophobicContact CE1-CD1 3.78Å; Y404-I408 HydrophobicContact CE1-CG1 3.51Å; Y404-I408 PolarHBondContact O-N 2.81Å; Y404-I408 VanDerWaalsContact O-N 3.09Å
405	Q	92.3	Very high	91.2	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-61.7	-32.3	177	-59.6	-59.9	-48.9	0	0	112.1	Q399 W402 T403 I407 I408 S409 Y637 Y640	Q399-Q405 PolarHBondContact O-NE2 3.36Å; W402-Q405 VanDerWaalsContact O-CB 3.31Å; W402-Q405 WeakPolarHBondContact O-CB 3.37Å; W402-Q405 WeakPolarHBondContact O-CG 3.44Å; W402-Q405 PolarHBondContact O-N 3.23Å; W402-Q405 VanDerWaalsContact O-N 3.16Å; T403-Q405 VanDerWaalsContact C-N 3.28Å; T403-Q405 PolarHBondContact O-N 2.99Å; Q405-I407 PolarHBondContact O-N 2.75Å; Q405-I408 PolarHBondContact O-N 3.37Å; Q405-S409 WeakPolarHBondContact O-CB 3.34Å; Q405-S409 PolarHBondContact O-N 2.92Å; Q405-S409 PolarHBondContact O-OG 3.26Å; Q405-S409 VanDerWaalsContact O-OG 3.09Å; Q405-Y637 HydrophobicContact CB-CD1 3.77Å; Q405-Y637 HydrophobicContact CB-CE1 4.11Å; Q405-Y637 HydrophobicContact CG-CD1 4.21Å; Q405-Y640 HydrophobicContact CG-CD2 4.06Å; Q405-Y640 HydrophobicContact CG-CG 4.45Å
406	V	91.9	Very high	91.7	Very high	46 Å²	46	35.4 Å²	35.4	28%	0.279	18%	0.178	S	C	.	.	H	α-helix	trans	-61.2	-34.7	173.8	178.9	0	0	0	0	111.3	W374 Y404 A410 V636 Y637	W374-V406 PolarHBondContact NE1-O 3.36Å; Y404-V406 PolarHBondContact O-N 3.31Å; V406-A410 PolarHBondContact O-N 3.26Å; V406-V636 HydrophobicContact CG2-CG1 4.34Å; V406-Y637 HydrophobicContact CG2-CE1 4.31Å; V406-Y637 VanDerWaalsContact CG2-OH 3.31Å; V406-Y637 WeakPolarHBondContact CG2-OH 3.44Å
407	I	89.6	Confident	92.2	Very high	19 Å²	19	32 Å²	32	10%	0.097	16%	0.161	C	C	.	.	H	α-helix	trans	-75	-48.6	178.9	-68	153.1	0	0	0	110.5	Y377 I381 Y404 Q405 S409 A410	Y377-I407 HydrophobicContact CD1-CG1 3.93Å; Y377-I407 HydrophobicContact CE1-CD1 3.7Å; Y377-I407 HydrophobicContact CE1-CG1 3.46Å; Y377-I407 VanDerWaalsContact CE1-CG1 3.46Å; I381-I407 HydrophobicContact CB-CG2 4.4Å; I381-I407 HydrophobicContact CD1-CB 4.04Å; I381-I407 HydrophobicContact CD1-CD1 3.27Å; I381-I407 HydrophobicContact CD1-CG1 3.49Å; I381-I407 VanDerWaalsContact CD1-CG1 3.49Å; I381-I407 HydrophobicContact CD1-CG2 3.38Å; I381-I407 HydrophobicContact CG1-CG2 4.46Å; I381-I407 HydrophobicContact CG2-CG2 4.41Å; Y404-I407 HydrophobicContact CD2-CB 4.27Å; Y404-I407 HydrophobicContact CD2-CD1 3.5Å; Y404-I407 HydrophobicContact CD2-CG1 4.49Å; Y404-I407 HydrophobicContact CE2-CB 4.24Å; Y404-I407 HydrophobicContact CE2-CD1 3.82Å; Y404-I407 HydrophobicContact CE2-CG2 4Å; Y404-I407 HydrophobicContact CG-CD1 4.33Å; Y404-I407 WeakPolarHBondContact O-CA 3.27Å; Y404-I407 WeakPolarHBondContact O-CB 3.06Å; Y404-I407 PolarHBondContact O-N 2.81Å; Q405-I407 PolarHBondContact O-N 2.75Å; I407-S409 PolarHBondContact O-N 3.14Å; I407-A410 WeakPolarHBondContact O-CB 3.34Å; I407-A410 PolarHBondContact O-N 3.29Å
408	I	88.9	Confident	92.6	Very high	20 Å²	20	27.8 Å²	27.8	10%	0.103	14%	0.14	C	C	.	.	H	α-helix	trans	-58.1	-42.2	177.5	-62.7	179.7	0	0	0	110.2	Q399 Y404 Q405 A410 L643	Q399-I408 HydrophobicContact CG-CD1 4.16Å; Y404-I408 HydrophobicContact CD1-CD1 3.62Å; Y404-I408 HydrophobicContact CD1-CG1 3.6Å; Y404-I408 HydrophobicContact CE1-CD1 3.78Å; Y404-I408 HydrophobicContact CE1-CG1 3.51Å; Y404-I408 PolarHBondContact O-N 2.81Å; Y404-I408 VanDerWaalsContact O-N 3.09Å; Q405-I408 PolarHBondContact O-N 3.37Å; I408-A410 PolarHBondContact O-N 3.11Å; I408-L643 HydrophobicContact CD1-CD1 3.49Å; I408-L643 VanDerWaalsContact CD1-CD1 3.49Å; I408-L643 HydrophobicContact CG2-CD1 4.44Å
409	S	91.9	Very high	93	Very high	7 Å²	7	27.1 Å²	27.1	5%	0.049	14%	0.137	C	C	.	.	G	3₁₀ helix	trans	-76	-2.7	178.7	-65.7	0	0	0	0	113.8	W374 Q405 I407 T411 L412 V636	W374-S409 WeakPolarHBondContact CH2-O 3.24Å; W374-S409 VanDerWaalsContact CZ2-C 3.47Å; W374-S409 WeakPolarHBondContact CZ2-O 3.24Å; Q405-S409 WeakPolarHBondContact O-CB 3.34Å; Q405-S409 PolarHBondContact O-N 2.92Å; Q405-S409 PolarHBondContact O-OG 3.26Å; Q405-S409 VanDerWaalsContact O-OG 3.09Å; I407-S409 PolarHBondContact O-N 3.14Å; S409-T411 PolarHBondContact O-N 3.38Å; S409-L412 VanDerWaalsContact O-CB 3.26Å; S409-L412 WeakPolarHBondContact O-CB 3.4Å; S409-L412 WeakPolarHBondContact O-CG 3.38Å; S409-L412 PolarHBondContact O-N 2.93Å; S409-V636 WeakPolarHBondContact OG-CA 3.45Å; S409-V636 PolarHBondContact OG-O 2.87Å
410	A	92.5	Very high	93.6	Very high	11 Å²	11	25.1 Å²	25.1	9%	0.091	13%	0.128	C	C	.	.	G	3₁₀ helix	trans	-57.9	-20.5	175.8	0	0	0	0	0	112.5	V406 I407 I408 L412 S413	V406-A410 PolarHBondContact O-N 3.26Å; I407-A410 WeakPolarHBondContact O-CB 3.34Å; I407-A410 PolarHBondContact O-N 3.29Å; I408-A410 PolarHBondContact O-N 3.11Å; A410-L412 PolarHBondContact O-N 3.34Å; A410-L412 VanDerWaalsContact O-N 3.14Å; A410-S413 VanDerWaalsContact O-CB 3.26Å; A410-S413 WeakPolarHBondContact O-CB 3.27Å; A410-S413 PolarHBondContact O-N 2.79Å; A410-S413 PolarHBondContact O-OG 3.48Å
411	T	92.5	Very high	93.9	Very high	34 Å²	34	23.4 Å²	23.4	21%	0.209	12%	0.117	C	C	.	.	G	3₁₀ helix	trans	-62.5	-17.1	173.7	75.4	0	0	0	0	114	S409 V414 L573 Y582 R663	S409-T411 PolarHBondContact O-N 3.38Å; T411-V414 WeakPolarHBondContact O-CG2 3.47Å; T411-L573 HydrophobicContact CG2-CD1 3.48Å; T411-L573 VanDerWaalsContact CG2-CD1 3.48Å; T411-L573 HydrophobicContact CG2-CG 4.22Å; T411-Y582 HydrophobicContact CG2-CE2 4.47Å; T411-Y582 PolarHBondContact O-OH 2.72Å; T411-Y582 VanDerWaalsContact O-OH 3.05Å; T411-R663 PolarHBondContact O-NH1 2.55Å; T411-R663 PolarHBondContact OG1-NH2 3.36Å
412	L	95.3	Very high	94.2	Very high	2 Å²	2	20 Å²	20	1%	0.01	10%	0.102	C	C	.	.	G	3₁₀ helix	trans	-78.1	-24.8	174.2	-67.3	175.9	0	0	0	113	W374 S409 A410 V414 D415 V636 R663 F666	W374-L412 HydrophobicContact CH2-CB 4.03Å; W374-L412 HydrophobicContact CZ3-CB 4.45Å; S409-L412 VanDerWaalsContact O-CB 3.26Å; S409-L412 WeakPolarHBondContact O-CB 3.4Å; S409-L412 WeakPolarHBondContact O-CG 3.38Å; S409-L412 PolarHBondContact O-N 2.93Å; A410-L412 PolarHBondContact O-N 3.34Å; A410-L412 VanDerWaalsContact O-N 3.14Å; L412-V414 VanDerWaalsContact C-N 3.33Å; L412-V414 PolarHBondContact O-N 2.73Å; L412-D415 VanDerWaalsContact O-CB 3.29Å; L412-D415 WeakPolarHBondContact O-CB 3.4Å; L412-D415 PolarHBondContact O-N 3.4Å; L412-V636 HydrophobicContact CD1-CG2 4.35Å; L412-R663 HydrophobicContact CD2-CB 4.26Å; L412-R663 HydrophobicContact CD2-CG 3.85Å; L412-F666 HydrophobicContact CB-CD1 3.92Å; L412-F666 HydrophobicContact CB-CE1 4Å; L412-F666 HydrophobicContact CB-CG 4.29Å; L412-F666 HydrophobicContact CB-CZ 4.44Å; L412-F666 HydrophobicContact CD1-CB 4.24Å; L412-F666 HydrophobicContact CD1-CD1 4.42Å; L412-F666 HydrophobicContact CD1-CD2 3.95Å; L412-F666 HydrophobicContact CD1-CE2 4.48Å; L412-F666 HydrophobicContact CD1-CG 3.94Å; L412-F666 HydrophobicContact CD2-CB 4.35Å; L412-F666 HydrophobicContact CD2-CG 4.46Å; L412-F666 HydrophobicContact CG-CG 4.47Å
413	S	95.8	Very high	94.6	Very high	3 Å²	3	12.8 Å²	12.8	2%	0.021	8%	0.075	C	C	.	.	H	α-helix	trans	-57.9	-42	-173.6	62.9	0	0	0	0	113	T371 W374 I375 A410 D415 T416	T371-S413 WeakPolarHBondContact CG2-O 3.49Å; W374-S413 VanDerWaalsContact CE3-CB 3.44Å; I375-S413 WeakPolarHBondContact CG1-OG 3.38Å; A410-S413 VanDerWaalsContact O-CB 3.26Å; A410-S413 WeakPolarHBondContact O-CB 3.27Å; A410-S413 PolarHBondContact O-N 2.79Å; A410-S413 PolarHBondContact O-OG 3.48Å; S413-D415 PolarHBondContact O-N 2.93Å; S413-T416 WeakPolarHBondContact O-CB 3.23Å; S413-T416 PolarHBondContact O-N 3.28Å; S413-T416 VanDerWaalsContact O-N 3.07Å; S413-T416 PolarHBondContact O-OG1 3.29Å
414	V	95.6	Very high	94.8	Very high	6 Å²	6	11.3 Å²	11.3	4%	0.036	6%	0.064	C	C	.	.	H	α-helix	trans	-59.8	-30	175.4	-77.9	0	0	0	0	113.2	I375 T411 L412 T416 F417 F418 W517 Y518 Y582	I375-V414 HydrophobicContact CD1-CG1 4.12Å; T411-V414 WeakPolarHBondContact O-CG2 3.47Å; L412-V414 VanDerWaalsContact C-N 3.33Å; L412-V414 PolarHBondContact O-N 2.73Å; V414-T416 VanDerWaalsContact C-N 3.25Å; V414-T416 PolarHBondContact O-N 2.99Å; V414-F417 PolarHBondContact O-N 3.32Å; V414-F417 VanDerWaalsContact O-N 3.11Å; V414-F418 PolarHBondContact O-N 2.75Å; V414-W517 HydrophobicContact CB-CH2 4.32Å; V414-W517 HydrophobicContact CG1-CH2 4.44Å; V414-W517 HydrophobicContact CG1-CZ2 4.47Å; V414-W517 HydrophobicContact CG2-CH2 4.08Å; V414-Y518 HydrophobicContact CB-CD2 4.16Å; V414-Y518 HydrophobicContact CG1-CD2 4.21Å; V414-Y582 VanDerWaalsContact CG2-OH 3.23Å; V414-Y582 WeakPolarHBondContact CG2-OH 3.25Å
415	D	97.7	Very high	95	Very high	0 Å²	0	11.2 Å²	11.2	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-65.9	-31.2	176.5	-67.5	-56.5	0	0	0	111.6	L412 S413 F417 F418 F419 R588 T591 R663 I667	L412-D415 VanDerWaalsContact O-CB 3.29Å; L412-D415 WeakPolarHBondContact O-CB 3.4Å; L412-D415 PolarHBondContact O-N 3.4Å; S413-D415 PolarHBondContact O-N 2.93Å; D415-F417 PolarHBondContact O-N 2.63Å; D415-F418 PolarHBondContact O-N 3.07Å; D415-F419 WeakPolarHBondContact O-CB 3.21Å; D415-F419 PolarHBondContact O-N 3.4Å; D415-R588 IonicContact OD1-CZ 3.73Å; D415-R588 IonicContact OD1-NE 2.63Å; D415-R588 PolarHBondContact OD1-NE 3Å; D415-R588 VanDerWaalsContact OD1-NE 3.11Å; D415-R588 IonicContact OD1-NH2 3.07Å; D415-R588 PolarHBondContact OD1-NH2 3.24Å; D415-R588 IonicContact OD2-CZ 3.18Å; D415-R588 IonicContact OD2-NH2 2.78Å; D415-R588 PolarHBondContact OD2-NH2 3.41Å; D415-T591 HydrophobicContact CB-CG2 3.82Å; D415-T591 PolarHBondContact OD1-OG1 2.04Å; D415-R663 IonicContact OD2-CZ 3.14Å; D415-R663 IonicContact OD2-NH1 3.54Å; D415-R663 PolarHBondContact OD2-NH1 3.41Å; D415-I667 HydrophobicContact CB-CD1 3.67Å; D415-I667 HydrophobicContact CB-CG1 3.8Å; D415-I667 WeakPolarHBondContact O-CD1 2.98Å
416	T	98.1	Very high	95.2	Very high	1 Å²	1	11.2 Å²	11.2	1%	0.006	7%	0.066	C	C	.	.	H	α-helix	trans	-60.3	-36.7	174	-56.7	0	0	0	0	110.9	I367 T371 S413 V414 M420 I670	I367-T416 HydrophobicContact CG2-CG2 3.44Å; I367-T416 VanDerWaalsContact CG2-CG2 3.44Å; T371-T416 HydrophobicContact CG2-CG2 4.26Å; S413-T416 WeakPolarHBondContact O-CB 3.23Å; S413-T416 PolarHBondContact O-N 3.28Å; S413-T416 VanDerWaalsContact O-N 3.07Å; S413-T416 PolarHBondContact O-OG1 3.29Å; V414-T416 VanDerWaalsContact C-N 3.25Å; V414-T416 PolarHBondContact O-N 2.99Å; T416-M420 HydrophobicContact CG2-CE 4.09Å; T416-M420 WeakPolarHBondContact O-CB 3.29Å; T416-M420 VanDerWaalsContact O-CG 3.26Å; T416-M420 WeakPolarHBondContact O-CG 3.23Å; T416-M420 PolarHBondContact O-N 2.93Å; T416-I670 HydrophobicContact CG2-CG2 4.18Å
417	F	97.9	Very high	95.3	Very high	24 Å²	24	10.7 Å²	10.7	11%	0.105	6%	0.059	C	C	.	.	H	α-helix	trans	-72.2	-41.9	177.1	-73.3	-81.8	0	0	0	113	R368 T371 M372 I375 V414 D415 F419 M420 S421 Y518 T701	R368-F417 HydrophobicContact CB-CE1 4.36Å; R368-F417 HydrophobicContact CG-CE1 4.07Å; T371-F417 HydrophobicContact CG2-CD2 3.79Å; T371-F417 HydrophobicContact CG2-CE2 3.38Å; T371-F417 HydrophobicContact CG2-CZ 4.22Å; M372-F417 HydrophobicContact CB-CZ 4.33Å; I375-F417 HydrophobicContact CD1-CD2 4.06Å; I375-F417 HydrophobicContact CD1-CE2 3.58Å; V414-F417 PolarHBondContact O-N 3.32Å; V414-F417 VanDerWaalsContact O-N 3.11Å; D415-F417 PolarHBondContact O-N 2.63Å; F417-F419 VanDerWaalsContact C-N 3.31Å; F417-F419 PolarHBondContact O-N 2.04Å; F417-M420 HydrophobicContact CB-CE 4.36Å; F417-M420 HydrophobicContact CD1-CE 3.41Å; F417-M420 VanDerWaalsContact CD1-CE 3.41Å; F417-M420 HydrophobicContact CE1-CE 3.75Å; F417-M420 HydrophobicContact CG-CE 3.89Å; F417-M420 HydrophobicContact CZ-CE 4.48Å; F417-M420 PolarHBondContact O-N 2.76Å; F417-S421 WeakPolarHBondContact O-CB 3.41Å; F417-S421 PolarHBondContact O-N 2.73Å; F417-Y518 HydrophobicContact CB-CE2 3.86Å; F417-Y518 WeakPolarHBondContact CB-OH 3.36Å; F417-T701 HydrophobicContact CE1-CG2 3.52Å; F417-T701 HydrophobicContact CZ-CG2 3.52Å
418	F	98.2	Very high	95.3	Very high	0 Å²	0	13.6 Å²	13.6	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-56.7	-47.9	172.1	-66.3	-40.5	0	0	0	111	V414 D415 M420 S421 G422 W517 Y518 N521 E522 F525 Y592	V414-F418 PolarHBondContact O-N 2.75Å; D415-F418 PolarHBondContact O-N 3.07Å; F418-M420 PolarHBondContact O-N 3.21Å; F418-S421 WeakPolarHBondContact O-CB 3.07Å; F418-S421 PolarHBondContact O-N 3.05Å; F418-G422 PolarHBondContact O-N 3.19Å; F418-W517 HydrophobicContact CE2-CZ3 4.35Å; F418-W517 HydrophobicContact CZ-CZ3 4.04Å; F418-Y518 HydrophobicContact CD1-CD2 4.17Å; F418-Y518 AromaticContact CD1-CE2 3.72Å; F418-Y518 HydrophobicContact CD1-CE2 3.72Å; F418-Y518 AromaticContact CE1-CD2 3.39Å; F418-Y518 HydrophobicContact CE1-CD2 3.39Å; F418-Y518 AromaticContact CE1-CE2 3.39Å; F418-Y518 HydrophobicContact CE1-CE2 3.39Å; F418-Y518 HydrophobicContact CE1-CG 4.45Å; F418-Y518 HydrophobicContact CE2-CD2 4.2Å; F418-Y518 HydrophobicContact CG-CE2 4.42Å; F418-Y518 AromaticContact CZ-CD2 3.41Å; F418-Y518 HydrophobicContact CZ-CD2 3.41Å; F418-Y518 VanDerWaalsContact CZ-CD2 3.41Å; F418-Y518 AromaticContact CZ-CE2 3.84Å; F418-Y518 HydrophobicContact CZ-CE2 3.84Å; F418-Y518 HydrophobicContact CZ-CG 4.44Å; F418-N521 HydrophobicContact CE1-CB 3.77Å; F418-N521 HydrophobicContact CZ-CB 3.64Å; F418-E522 HydrophobicContact CD1-CB 4.41Å; F418-E522 WeakPolarHBondContact CD1-OE2 3.3Å; F418-E522 HydrophobicContact CE1-CB 4.04Å; F418-F525 AromaticContact CD1-CD2 3.89Å; F418-F525 HydrophobicContact CD1-CD2 3.89Å; F418-F525 AromaticContact CD1-CE2 3.84Å; F418-F525 HydrophobicContact CD1-CE2 3.84Å; F418-F525 HydrophobicContact CD2-CE2 4.26Å; F418-F525 HydrophobicContact CE1-CD2 4.2Å; F418-F525 AromaticContact CE1-CE2 3.93Å; F418-F525 HydrophobicContact CE1-CE2 3.93Å; F418-F525 HydrophobicContact CE2-CE2 4.35Å; F418-F525 HydrophobicContact CG-CD2 4.33Å; F418-F525 HydrophobicContact CG-CE2 4.03Å; F418-F525 HydrophobicContact CZ-CE2 4.2Å; F418-Y592 HydrophobicContact CB-CD2 4.29Å; F418-Y592 WeakPolarHBondContact O-CD2 3.05Å
419	F	98.6	Very high	95.5	Very high	0 Å²	0	13.2 Å²	13.2	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-55.5	-50.6	174.8	160.8	-101.3	0	0	0	112.3	D415 F417 S421 G422 L423 T591 I594 G595 L598 I667 I670 A671 V674	D415-F419 WeakPolarHBondContact O-CB 3.21Å; D415-F419 PolarHBondContact O-N 3.4Å; F417-F419 VanDerWaalsContact C-N 3.31Å; F417-F419 PolarHBondContact O-N 2.04Å; F419-S421 VanDerWaalsContact C-N 3.27Å; F419-S421 PolarHBondContact O-N 3.35Å; F419-G422 PolarHBondContact O-N 3.18Å; F419-L423 HydrophobicContact CE1-CD2 4.19Å; F419-L423 HydrophobicContact CZ-CD2 3.99Å; F419-L423 VanDerWaalsContact O-CB 3.28Å; F419-L423 WeakPolarHBondContact O-CB 3.48Å; F419-L423 PolarHBondContact O-N 3.38Å; F419-T591 WeakPolarHBondContact CA-O 3.31Å; F419-I594 HydrophobicContact CD2-CG2 4.27Å; F419-I594 HydrophobicContact CE2-CG2 4.43Å; F419-G595 VanDerWaalsContact CD2-CA 3.45Å; F419-G595 WeakPolarHBondContact O-CA 3.41Å; F419-L598 HydrophobicContact CE2-CB 4.39Å; F419-L598 HydrophobicContact CE2-CD2 3.7Å; F419-L598 HydrophobicContact CZ-CD2 3.55Å; F419-I667 HydrophobicContact CB-CD1 4.13Å; F419-I667 HydrophobicContact CB-CG2 3.67Å; F419-I667 HydrophobicContact CD2-CG2 3.68Å; F419-I667 HydrophobicContact CG-CG2 3.81Å; F419-I670 HydrophobicContact CD1-CG2 4Å; F419-I670 HydrophobicContact CE1-CG2 3.85Å; F419-A671 HydrophobicContact CE2-CB 3.75Å; F419-A671 HydrophobicContact CZ-CB 4.02Å; F419-V674 HydrophobicContact CE1-CB 4.5Å; F419-V674 HydrophobicContact CE1-CG2 3.93Å; F419-V674 HydrophobicContact CZ-CB 4.35Å; F419-V674 HydrophobicContact CZ-CG2 4.27Å
420	M	97.4	Very high	95.5	Very high	3 Å²	3	12.9 Å²	12.9	2%	0.015	7%	0.07	C	C	.	.	H	α-helix	trans	-61.9	-36.3	179.7	-76.4	-171.4	-66	0	0	112.6	L364 I367 R368 T416 F417 F418 L424	L364-M420 HydrophobicContact CB-SD 4.38Å; L364-M420 HydrophobicContact CD2-CG 3.94Å; L364-M420 HydrophobicContact CD2-SD 4.02Å; I367-M420 HydrophobicContact CB-SD 4.41Å; I367-M420 HydrophobicContact CG2-CE 4.4Å; I367-M420 HydrophobicContact CG2-SD 3.91Å; R368-M420 HydrophobicContact CG-CE 3.55Å; R368-M420 HydrophobicContact CG-SD 3.66Å; T416-M420 HydrophobicContact CG2-CE 4.09Å; T416-M420 WeakPolarHBondContact O-CB 3.29Å; T416-M420 VanDerWaalsContact O-CG 3.26Å; T416-M420 WeakPolarHBondContact O-CG 3.23Å; T416-M420 PolarHBondContact O-N 2.93Å; F417-M420 HydrophobicContact CB-CE 4.36Å; F417-M420 HydrophobicContact CD1-CE 3.41Å; F417-M420 VanDerWaalsContact CD1-CE 3.41Å; F417-M420 HydrophobicContact CE1-CE 3.75Å; F417-M420 HydrophobicContact CG-CE 3.89Å; F417-M420 HydrophobicContact CZ-CE 4.48Å; F417-M420 PolarHBondContact O-N 2.76Å; F418-M420 PolarHBondContact O-N 3.21Å; M420-L424 WeakPolarHBondContact O-CB 3.39Å; M420-L424 WeakPolarHBondContact O-CG 3.45Å; M420-L424 PolarHBondContact O-N 2.87Å
421	S	96.5	Very high	95.4	Very high	14 Å²	14	14.5 Å²	14.5	10%	0.098	8%	0.08	C	C	.	.	H	α-helix	trans	-66.4	-48	177.9	-173.1	0	0	0	0	111.8	F417 F418 F419 L424 S425 R453 E522	F417-S421 WeakPolarHBondContact O-CB 3.41Å; F417-S421 PolarHBondContact O-N 2.73Å; F418-S421 WeakPolarHBondContact O-CB 3.07Å; F418-S421 PolarHBondContact O-N 3.05Å; F419-S421 VanDerWaalsContact C-N 3.27Å; F419-S421 PolarHBondContact O-N 3.35Å; S421-L424 PolarHBondContact O-N 3.21Å; S421-S425 WeakPolarHBondContact O-CB 3.47Å; S421-S425 PolarHBondContact O-N 2.85Å; S421-S425 PolarHBondContact O-OG 3.26Å; S421-R453 PolarHBondContact OG-NH1 2.87Å; S421-E522 WeakPolarHBondContact CB-OE1 3.41Å; S421-E522 WeakPolarHBondContact CB-OE2 3.25Å; S421-E522 PolarHBondContact OG-OE1 2.92Å
422	G	97.8	Very high	95.3	Very high	0 Å²	0	19 Å²	19	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-59.6	-47.1	173.8	0	0	0	0	0	111.7	F418 F419 L424 S425 T426	F418-G422 PolarHBondContact O-N 3.19Å; F419-G422 PolarHBondContact O-N 3.18Å; G422-L424 PolarHBondContact O-N 2.86Å; G422-S425 PolarHBondContact O-N 3.46Å; G422-T426 PolarHBondContact O-N 3.32Å; G422-T426 PolarHBondContact O-OG1 3.31Å
423	L	97.9	Very high	95.2	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-54.5	-53.3	177.6	171.7	64.2	0	0	0	112.5	L361 L364 F419 T426 Y427 G595 L598 L602 V674	L361-L423 HydrophobicContact CD1-CD2 4.33Å; L361-L423 HydrophobicContact CD1-CG 4.27Å; L361-L423 HydrophobicContact CD2-CD2 4.42Å; L364-L423 HydrophobicContact CD1-CD2 4.16Å; L364-L423 HydrophobicContact CD2-CD2 4.2Å; F419-L423 HydrophobicContact CE1-CD2 4.19Å; F419-L423 HydrophobicContact CZ-CD2 3.99Å; F419-L423 VanDerWaalsContact O-CB 3.28Å; F419-L423 WeakPolarHBondContact O-CB 3.48Å; F419-L423 PolarHBondContact O-N 3.38Å; L423-T426 PolarHBondContact O-N 3.32Å; L423-Y427 WeakPolarHBondContact O-CB 3.5Å; L423-Y427 PolarHBondContact O-N 3.04Å; L423-G595 WeakPolarHBondContact CA-O 3.44Å; L423-G595 PolarHBondContact N-O 2.55Å; L423-L598 HydrophobicContact CD1-CB 4.31Å; L423-L598 HydrophobicContact CD1-CD2 4.08Å; L423-L598 HydrophobicContact CD1-CG 4.15Å; L423-L602 HydrophobicContact CD1-CD1 4.13Å; L423-V674 HydrophobicContact CD2-CG1 3.73Å
424	L	94.9	Very high	94.9	Very high	34 Å²	34	23.4 Å²	23.4	18%	0.178	11%	0.113	C	C	.	.	H	α-helix	trans	-70.5	-37.6	-177.7	-73.2	171.1	0	0	0	112.1	L361 L364 M420 S421 G422 T426 L428	L361-L424 HydrophobicContact CD1-CD2 4Å; L364-L424 HydrophobicContact CD1-CD1 4.05Å; L364-L424 HydrophobicContact CD1-CD2 3.79Å; L364-L424 HydrophobicContact CD1-CG 3.92Å; M420-L424 WeakPolarHBondContact O-CB 3.39Å; M420-L424 WeakPolarHBondContact O-CG 3.45Å; M420-L424 PolarHBondContact O-N 2.87Å; S421-L424 PolarHBondContact O-N 3.21Å; G422-L424 PolarHBondContact O-N 2.86Å; L424-T426 VanDerWaalsContact C-N 3.27Å; L424-T426 PolarHBondContact O-N 2.78Å; L424-L428 HydrophobicContact CD2-CD1 4.2Å; L424-L428 WeakPolarHBondContact O-CB 3.41Å; L424-L428 WeakPolarHBondContact O-CG 3.36Å; L424-L428 PolarHBondContact O-N 3.06Å
425	S	94.3	Very high	94.7	Very high	12 Å²	12	32.8 Å²	32.8	8%	0.084	15%	0.148	C	C	.	.	H	α-helix	trans	-58.1	-45	176.2	-61.6	0	0	0	0	109.9	S421 G422 T429 S530	S421-S425 WeakPolarHBondContact O-CB 3.47Å; S421-S425 PolarHBondContact O-N 2.85Å; S421-S425 PolarHBondContact O-OG 3.26Å; G422-S425 PolarHBondContact O-N 3.46Å; S425-T429 WeakPolarHBondContact O-CB 3.26Å; S425-T429 PolarHBondContact O-N 3.48Å; S425-T429 PolarHBondContact O-OG1 3.09Å; S425-S530 WeakPolarHBondContact CB-OG 3.23Å
426	T	95.7	Very high	94.3	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-74	-54.7	179.3	-58.4	0	0	0	0	113.6	G422 L423 L424 L428 T429 I430 F533 L534 L596 W600	G422-T426 PolarHBondContact O-N 3.32Å; G422-T426 PolarHBondContact O-OG1 3.31Å; L423-T426 PolarHBondContact O-N 3.32Å; L424-T426 VanDerWaalsContact C-N 3.27Å; L424-T426 PolarHBondContact O-N 2.78Å; T426-L428 VanDerWaalsContact C-N 3.25Å; T426-L428 PolarHBondContact O-N 3.11Å; T426-T429 PolarHBondContact O-N 2.84Å; T426-I430 HydrophobicContact CG2-CD1 3.26Å; T426-I430 HydrophobicContact CG2-CG1 3.9Å; T426-I430 WeakPolarHBondContact O-CG1 3.36Å; T426-I430 PolarHBondContact O-N 2.89Å; T426-I430 VanDerWaalsContact O-N 3.13Å; T426-F533 HydrophobicContact CG2-CE1 3.99Å; T426-L534 HydrophobicContact CG2-CD2 3.76Å; T426-L596 WeakPolarHBondContact CG2-O 3.25Å; T426-L596 WeakPolarHBondContact OG1-CA 3.18Å; T426-L596 WeakPolarHBondContact OG1-CD2 3.11Å; T426-L596 PolarHBondContact OG1-O 3.14Å; T426-W600 HydrophobicContact CG2-CB 3.89Å
427	Y	93.9	Very high	93.7	Very high	35 Å²	35	41.5 Å²	41.5	14%	0.137	20%	0.199	C	C	.	.	H	α-helix	trans	-58.5	-36	-173	-177.5	-102.4	0	0	0	113	H359 P360 L361 L423 L602 E603	H359-Y427 AromaticContact CE1-CE1 3.76Å; H359-Y427 AromaticContact NE2-CE1 3.8Å; P360-Y427 HydrophobicContact CG-CE1 4.3Å; P360-Y427 WeakPolarHBondContact CG-OH 3.19Å; L361-Y427 HydrophobicContact CD1-CD1 3.6Å; L361-Y427 HydrophobicContact CD1-CE1 4.07Å; L361-Y427 HydrophobicContact CD1-CG 3.92Å; L361-Y427 HydrophobicContact CG-CD1 4.44Å; L361-Y427 HydrophobicContact CG-CE1 4.44Å; L423-Y427 WeakPolarHBondContact O-CB 3.5Å; L423-Y427 PolarHBondContact O-N 3.04Å; Y427-L602 HydrophobicContact CD2-CB 4.02Å; Y427-L602 HydrophobicContact CE2-CB 4.14Å; Y427-E603 HydrophobicContact CD2-CB 4.2Å
428	L	90.8	Very high	93.3	Very high	79 Å²	79	42.2 Å²	42.2	41%	0.414	21%	0.207	S	C	.	.	H	α-helix	trans	-90.4	-23	-177.6	-60	177	0	0	0	113.9	L424 T426	L424-L428 HydrophobicContact CD2-CD1 4.2Å; L424-L428 WeakPolarHBondContact O-CB 3.41Å; L424-L428 WeakPolarHBondContact O-CG 3.36Å; L424-L428 PolarHBondContact O-N 3.06Å; T426-L428 VanDerWaalsContact C-N 3.25Å; T426-L428 PolarHBondContact O-N 3.11Å
429	T	92.4	Very high	92.9	Very high	12 Å²	12	50.4 Å²	50.4	7%	0.074	24%	0.238	C	C	.	.	H	α-helix	trans	-97.5	-36.4	-170.4	-55.9	0	0	0	0	113	S425 T426 K432 L433 F445 W446 L534	S425-T429 WeakPolarHBondContact O-CB 3.26Å; S425-T429 PolarHBondContact O-N 3.48Å; S425-T429 PolarHBondContact O-OG1 3.09Å; T426-T429 PolarHBondContact O-N 2.84Å; T429-K432 WeakPolarHBondContact O-CB 3.49Å; T429-K432 PolarHBondContact O-N 3.18Å; T429-L433 PolarHBondContact O-N 2.9Å; T429-F445 HydrophobicContact CG2-CE1 3.68Å; T429-F445 HydrophobicContact CG2-CZ 3.49Å; T429-F445 VanDerWaalsContact CG2-CZ 3.49Å; T429-W446 HydrophobicContact CG2-CH2 4.48Å; T429-L534 HydrophobicContact CG2-CD1 4.04Å
430	I	92.5	Very high	92.5	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-49.9	-50.1	-179.3	-73.8	177.3	0	0	0	112.3	T426 K432 L433 R434 L534 I537 W600 E603	T426-I430 HydrophobicContact CG2-CD1 3.26Å; T426-I430 HydrophobicContact CG2-CG1 3.9Å; T426-I430 WeakPolarHBondContact O-CG1 3.36Å; T426-I430 PolarHBondContact O-N 2.89Å; T426-I430 VanDerWaalsContact O-N 3.13Å; I430-K432 PolarHBondContact O-N 2.65Å; I430-L433 PolarHBondContact O-N 3.34Å; I430-R434 HydrophobicContact CG2-CG 4.29Å; I430-R434 PolarHBondContact O-N 3.45Å; I430-L534 HydrophobicContact CD1-CD2 4.32Å; I430-L534 HydrophobicContact CG1-CD2 3.68Å; I430-I537 HydrophobicContact CD1-CG2 3.68Å; I430-I537 HydrophobicContact CG1-CG2 4.24Å; I430-W600 HydrophobicContact CD1-CB 4.09Å; I430-W600 HydrophobicContact CD1-CG 4.5Å; I430-E603 HydrophobicContact CB-CG 4.36Å; I430-E603 HydrophobicContact CG2-CG 4.2Å
431	P	90.2	Very high	92.2	Very high	46 Å²	46	62.5 Å²	62.5	30%	0.299	29%	0.292	S	S	.	.	H	α-helix	trans	-65.1	-27.6	-176.8	-22.6	34.6	0	0	0	113.2	R435 E603	P431-R435 WeakPolarHBondContact O-CG 3.35Å; P431-E603 HydrophobicContact CG-CG 3.96Å
432	K	90.6	Very high	91.9	Very high	127 Å²	127	64.5 Å²	64.5	55%	0.552	30%	0.298	S	S	*	.	H	α-helix	trans	-76.4	-44	176.5	-62.2	179.6	-176.6	178	0	110.5	T429 I430 R435 F445	T429-K432 WeakPolarHBondContact O-CB 3.49Å; T429-K432 PolarHBondContact O-N 3.18Å; I430-K432 PolarHBondContact O-N 2.65Å; K432-R435 PolarHBondContact O-N 3.47Å; K432-F445 HydrophobicContact CB-CE2 4.39Å
433	L	91.7	Very high	91.6	Very high	0 Å²	0	68.6 Å²	68.6	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-65.7	-43.4	-177.5	-171.8	60.3	0	0	0	111.9	T429 I430 R435 I436 W442 F445 W446 L534 A538	T429-L433 PolarHBondContact O-N 2.9Å; I430-L433 PolarHBondContact O-N 3.34Å; L433-R435 PolarHBondContact O-N 3.36Å; L433-R435 VanDerWaalsContact O-N 3.16Å; L433-I436 HydrophobicContact CD1-CD1 4.42Å; L433-I436 WeakPolarHBondContact O-CB 3.3Å; L433-I436 PolarHBondContact O-N 3.01Å; L433-W442 HydrophobicContact CD1-CD2 3.68Å; L433-W442 HydrophobicContact CD1-CE3 3.76Å; L433-W442 HydrophobicContact CD1-CG 4.39Å; L433-W442 HydrophobicContact CD1-CH2 3.95Å; L433-W442 HydrophobicContact CD1-CZ2 3.82Å; L433-W442 HydrophobicContact CD1-CZ3 3.9Å; L433-W442 HydrophobicContact CD2-CH2 3.85Å; L433-W442 HydrophobicContact CD2-CZ2 4.34Å; L433-W442 HydrophobicContact CD2-CZ3 3.99Å; L433-W442 HydrophobicContact CG-CE3 4.47Å; L433-W442 HydrophobicContact CG-CH2 3.77Å; L433-W442 HydrophobicContact CG-CZ2 3.74Å; L433-W442 HydrophobicContact CG-CZ3 4.12Å; L433-F445 HydrophobicContact CD1-CD1 3.97Å; L433-F445 HydrophobicContact CD1-CE1 4.25Å; L433-W446 HydrophobicContact CD1-CZ2 4.42Å; L433-W446 HydrophobicContact CD2-CH2 4.45Å; L433-W446 HydrophobicContact CD2-CZ2 3.77Å; L433-L534 HydrophobicContact CD2-CB 4.13Å; L433-L534 WeakPolarHBondContact CD2-O 3.36Å; L433-A538 HydrophobicContact CD2-CB 3.64Å; L433-A538 HydrophobicContact CG-CB 3.85Å
434	R	90.8	Very high	91.4	Very high	99 Å²	99	76.2 Å²	76.2	37%	0.374	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-21.6	177.2	-74.6	-179.3	174	153.1	-2.9	114	I430 I436 A538 D541 E603	I430-R434 HydrophobicContact CG2-CG 4.29Å; I430-R434 PolarHBondContact O-N 3.45Å; R434-I436 VanDerWaalsContact C-N 3.3Å; R434-A538 HydrophobicContact CG-CB 4.36Å; R434-D541 IonicContact NH2-OD1 2.68Å; R434-D541 PolarHBondContact NH2-OD1 2.72Å; R434-D541 IonicContact NH2-OD2 2.92Å; R434-E603 IonicContact CZ-OE2 3.82Å; R434-E603 IonicContact NH1-OE1 2.85Å; R434-E603 PolarHBondContact NH1-OE1 3.49Å; R434-E603 VanDerWaalsContact NH1-OE1 3.17Å; R434-E603 IonicContact NH1-OE2 3.51Å; R434-E603 PolarHBondContact NH1-OE2 3.49Å
435	R	90.4	Very high	91.3	Very high	203 Å²	203	76.9 Å²	76.9	77%	0.766	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-14.1	175.6	-69	174.7	-170.8	178.2	1.3	113.1	P431 K432 L433	P431-R435 WeakPolarHBondContact O-CG 3.35Å; K432-R435 PolarHBondContact O-N 3.47Å; L433-R435 PolarHBondContact O-N 3.36Å; L433-R435 VanDerWaalsContact O-N 3.16Å
436	I	90.8	Very high	91.3	Very high	37 Å²	37	77.9 Å²	77.9	19%	0.19	36%	0.355	C	S	.	.			trans	-89.9	114.3	-177.7	-51.7	177.9	0	0	0	108.6	L433 R434 H441 W442 F445	L433-I436 HydrophobicContact CD1-CD1 4.42Å; L433-I436 WeakPolarHBondContact O-CB 3.3Å; L433-I436 PolarHBondContact O-N 3.01Å; R434-I436 VanDerWaalsContact C-N 3.3Å; I436-H441 HydrophobicContact CG2-CB 3.36Å; I436-W442 HydrophobicContact CG2-CG 4.31Å; I436-W442 PolarHBondContact O-NE1 3.26Å; I436-F445 HydrophobicContact CD1-CB 3.72Å; I436-F445 HydrophobicContact CD1-CD2 3.75Å; I436-F445 HydrophobicContact CD1-CG 3.76Å
437	T	85.6	Confident	91.2	Very high	146 Å²	146	81.7 Å²	81.7	90%	0.896	38%	0.381	S	S	*	.			trans	-90.5	-27	-178.1	53	0	0	0	0	113.6
438	S	89.6	Confident	91.1	Very high	40 Å²	40	81.8 Å²	81.8	28%	0.28	39%	0.393	S	S	.	.			trans	-101	132	-172.5	169.6	0	0	0	0	112.5	K440 H441 W442	S438-K440 VanDerWaalsContact C-N 3.28Å; S438-K440 PolarHBondContact O-N 3Å; S438-H441 VanDerWaalsContact CB-ND1 3.32Å; S438-H441 WeakPolarHBondContact CB-ND1 3.46Å; S438-H441 WeakPolarHBondContact O-CB 3.14Å; S438-H441 PolarHBondContact O-N 2.71Å; S438-H441 PolarHBondContact OG-ND1 3.1Å; S438-W442 PolarHBondContact O-N 3.13Å; S438-W442 VanDerWaalsContact O-N 3.1Å
439	W	88.3	Confident	91.1	Very high	172 Å²	172	80 Å²	80	65%	0.652	38%	0.382	S	S	*	.	H	α-helix	trans	-58.3	-34.3	179.4	79.6	-87.9	0	0	0	113.7	H441 W442 I443	W439-H441 VanDerWaalsContact C-N 3.29Å; W439-H441 PolarHBondContact O-N 2.91Å; W439-W442 VanDerWaalsContact O-CB 3.29Å; W439-W442 WeakPolarHBondContact O-CB 3.14Å; W439-W442 PolarHBondContact O-N 2.95Å; W439-I443 HydrophobicContact CE3-CD1 3.47Å; W439-I443 VanDerWaalsContact CE3-CD1 3.47Å; W439-I443 HydrophobicContact CE3-CG1 4.28Å; W439-I443 HydrophobicContact CH2-CD1 4.46Å; W439-I443 HydrophobicContact CZ3-CD1 3.27Å; W439-I443 HydrophobicContact CZ3-CG1 4.47Å; W439-I443 PolarHBondContact O-N 3.49Å; W439-I443 VanDerWaalsContact O-N 3.08Å
440	K	91.1	Very high	91.1	Very high	142 Å²	142	81.1 Å²	81.1	62%	0.617	39%	0.389	S	S	*	.	H	α-helix	trans	-62.6	-39.7	176.1	-67.2	-174.2	179.6	179.5	0	111.4	S438 W442 I443 K444	S438-K440 VanDerWaalsContact C-N 3.28Å; S438-K440 PolarHBondContact O-N 3Å; K440-W442 VanDerWaalsContact C-N 3.33Å; K440-I443 PolarHBondContact O-N 3.27Å; K440-K444 PolarHBondContact O-N 3.37Å; K440-K444 VanDerWaalsContact O-N 3.12Å
441	H	91.4	Very high	91.1	Very high	115 Å²	115	87.6 Å²	87.6	53%	0.532	42%	0.417	S	S	.	.	H	α-helix	trans	-72.4	-29.5	177.6	-66.3	86.3	0	0	0	111.8	I436 S438 W439 F445	I436-H441 HydrophobicContact CG2-CB 3.36Å; S438-H441 VanDerWaalsContact CB-ND1 3.32Å; S438-H441 WeakPolarHBondContact CB-ND1 3.46Å; S438-H441 WeakPolarHBondContact O-CB 3.14Å; S438-H441 PolarHBondContact O-N 2.71Å; S438-H441 PolarHBondContact OG-ND1 3.1Å; W439-H441 VanDerWaalsContact C-N 3.29Å; W439-H441 PolarHBondContact O-N 2.91Å; H441-F445 VanDerWaalsContact O-CB 3.27Å; H441-F445 WeakPolarHBondContact O-CB 3.28Å; H441-F445 PolarHBondContact O-N 3.44Å
442	W	90.3	Very high	91.1	Very high	55 Å²	55	89.8 Å²	89.8	21%	0.208	42%	0.423	C	S	.	.	H	α-helix	trans	-62.7	-46.7	170.5	-89.3	66.7	0	0	0	112.5	L433 I436 S438 W439 K440 F445 W446 A538	L433-W442 HydrophobicContact CD1-CD2 3.68Å; L433-W442 HydrophobicContact CD1-CE3 3.76Å; L433-W442 HydrophobicContact CD1-CG 4.39Å; L433-W442 HydrophobicContact CD1-CH2 3.95Å; L433-W442 HydrophobicContact CD1-CZ2 3.82Å; L433-W442 HydrophobicContact CD1-CZ3 3.9Å; L433-W442 HydrophobicContact CD2-CH2 3.85Å; L433-W442 HydrophobicContact CD2-CZ2 4.34Å; L433-W442 HydrophobicContact CD2-CZ3 3.99Å; L433-W442 HydrophobicContact CG-CE3 4.47Å; L433-W442 HydrophobicContact CG-CH2 3.77Å; L433-W442 HydrophobicContact CG-CZ2 3.74Å; L433-W442 HydrophobicContact CG-CZ3 4.12Å; I436-W442 HydrophobicContact CG2-CG 4.31Å; I436-W442 PolarHBondContact O-NE1 3.26Å; S438-W442 PolarHBondContact O-N 3.13Å; S438-W442 VanDerWaalsContact O-N 3.1Å; W439-W442 VanDerWaalsContact O-CB 3.29Å; W439-W442 WeakPolarHBondContact O-CB 3.14Å; W439-W442 PolarHBondContact O-N 2.95Å; K440-W442 VanDerWaalsContact C-N 3.33Å; W442-F445 WeakPolarHBondContact O-CB 3.5Å; W442-F445 PolarHBondContact O-N 2.76Å; W442-W446 AromaticContact CE3-NE1 3.83Å; W442-W446 VanDerWaalsContact O-CD1 3.29Å; W442-W446 PolarHBondContact O-N 2.7Å; W442-A538 HydrophobicContact CH2-CB 3.53Å; W442-A538 HydrophobicContact CZ2-CB 3.89Å
443	I	91.3	Very high	91.1	Very high	87 Å²	87	85.2 Å²	85.2	45%	0.446	40%	0.402	S	S	.	.	H	α-helix	trans	-62.2	-47.4	176.8	-66.6	178.8	0	0	0	110.2	W439 K440 F445 W446 C447	W439-I443 HydrophobicContact CE3-CD1 3.47Å; W439-I443 VanDerWaalsContact CE3-CD1 3.47Å; W439-I443 HydrophobicContact CE3-CG1 4.28Å; W439-I443 HydrophobicContact CH2-CD1 4.46Å; W439-I443 HydrophobicContact CZ3-CD1 3.27Å; W439-I443 HydrophobicContact CZ3-CG1 4.47Å; W439-I443 PolarHBondContact O-N 3.49Å; W439-I443 VanDerWaalsContact O-N 3.08Å; K440-I443 PolarHBondContact O-N 3.27Å; I443-F445 PolarHBondContact O-N 2.98Å; I443-W446 PolarHBondContact O-N 3Å; I443-W446 VanDerWaalsContact O-N 3.16Å; I443-C447 PolarHBondContact O-N 3.49Å; I443-C447 PolarHBondContact O-SG 3.35Å
444	K	93	Very high	91.2	Very high	160 Å²	160	88.6 Å²	88.6	70%	0.696	42%	0.42	S	S	*	.	H	α-helix	trans	-58	-39.3	176.5	-171.8	178.9	-179.9	-179.6	0	111.9	K440 G448	K440-K444 PolarHBondContact O-N 3.37Å; K440-K444 VanDerWaalsContact O-N 3.12Å; K444-G448 PolarHBondContact O-N 3.07Å
445	F	93.8	Very high	91.2	Very high	47 Å²	47	86.5 Å²	86.5	21%	0.206	42%	0.416	C	S	.	.	H	α-helix	trans	-61.2	-49	175.9	177.5	-91.1	0	0	0	111.6	T429 K432 L433 I436 H441 W442 I443 G448 F449	T429-F445 HydrophobicContact CG2-CE1 3.68Å; T429-F445 HydrophobicContact CG2-CZ 3.49Å; T429-F445 VanDerWaalsContact CG2-CZ 3.49Å; K432-F445 HydrophobicContact CB-CE2 4.39Å; L433-F445 HydrophobicContact CD1-CD1 3.97Å; L433-F445 HydrophobicContact CD1-CE1 4.25Å; I436-F445 HydrophobicContact CD1-CB 3.72Å; I436-F445 HydrophobicContact CD1-CD2 3.75Å; I436-F445 HydrophobicContact CD1-CG 3.76Å; H441-F445 VanDerWaalsContact O-CB 3.27Å; H441-F445 WeakPolarHBondContact O-CB 3.28Å; H441-F445 PolarHBondContact O-N 3.44Å; W442-F445 WeakPolarHBondContact O-CB 3.5Å; W442-F445 PolarHBondContact O-N 2.76Å; I443-F445 PolarHBondContact O-N 2.98Å; F445-G448 PolarHBondContact O-N 3.14Å; F445-F449 WeakPolarHBondContact O-CB 3.39Å; F445-F449 PolarHBondContact O-N 2.97Å
446	W	93.3	Very high	91.1	Very high	33 Å²	33	82.5 Å²	82.5	13%	0.125	40%	0.401	C	S	.	.	H	α-helix	trans	-67.1	-42.1	179.4	-74.1	124.1	0	0	0	112.9	T429 L433 W442 I443 G448 F449 V450 P531 L534 S535	T429-W446 HydrophobicContact CG2-CH2 4.48Å; L433-W446 HydrophobicContact CD1-CZ2 4.42Å; L433-W446 HydrophobicContact CD2-CH2 4.45Å; L433-W446 HydrophobicContact CD2-CZ2 3.77Å; W442-W446 AromaticContact CE3-NE1 3.83Å; W442-W446 VanDerWaalsContact O-CD1 3.29Å; W442-W446 PolarHBondContact O-N 2.7Å; I443-W446 PolarHBondContact O-N 3Å; I443-W446 VanDerWaalsContact O-N 3.16Å; W446-G448 VanDerWaalsContact C-N 3.3Å; W446-G448 PolarHBondContact O-N 2.94Å; W446-F449 HydrophobicContact CE3-CB 4.15Å; W446-F449 HydrophobicContact CE3-CD1 4.15Å; W446-F449 HydrophobicContact CE3-CG 4.17Å; W446-F449 HydrophobicContact CZ3-CD1 4.09Å; W446-F449 HydrophobicContact CZ3-CD2 4.49Å; W446-F449 HydrophobicContact CZ3-CE1 4.43Å; W446-F449 HydrophobicContact CZ3-CG 4.12Å; W446-F449 PolarHBondContact O-N 3.32Å; W446-V450 WeakPolarHBondContact O-CG2 3.35Å; W446-V450 PolarHBondContact O-N 3Å; W446-P531 HydrophobicContact CD2-CB 3.89Å; W446-P531 HydrophobicContact CD2-CG 4.38Å; W446-P531 HydrophobicContact CE3-CB 3.63Å; W446-P531 HydrophobicContact CE3-CG 3.65Å; W446-P531 VanDerWaalsContact CH2-CA 3.48Å; W446-P531 HydrophobicContact CH2-CB 4.01Å; W446-P531 HydrophobicContact CH2-CG 4.32Å; W446-P531 HydrophobicContact CZ2-CB 4.16Å; W446-P531 HydrophobicContact CZ3-CB 3.72Å; W446-P531 HydrophobicContact CZ3-CG 3.63Å; W446-L534 HydrophobicContact CH2-CB 3.67Å; W446-L534 HydrophobicContact CH2-CD1 3.72Å; W446-L534 HydrophobicContact CH2-CG 4.3Å; W446-L534 HydrophobicContact CZ2-CB 3.93Å; W446-L534 HydrophobicContact CZ3-CD1 4.38Å; W446-S535 WeakPolarHBondContact CZ2-OG 3.46Å; W446-S535 PolarHBondContact NE1-OG 3.05Å; W446-S535 VanDerWaalsContact NE1-OG 3.16Å
447	C	93.1	Very high	91.2	Very high	81 Å²	81	81.8 Å²	81.8	55%	0.547	40%	0.397	S	S	.	.	H	α-helix	trans	-57.7	-44.8	172.5	-67.1	0	0	0	0	111.2	I443 F451	I443-C447 PolarHBondContact O-N 3.49Å; I443-C447 PolarHBondContact O-SG 3.35Å; C447-F451 VanDerWaalsContact O-CB 3.25Å; C447-F451 WeakPolarHBondContact O-CB 3.43Å; C447-F451 PolarHBondContact O-N 3.27Å
448	G	91.9	Very high	91.7	Very high	37 Å²	37	76.1 Å²	76.1	38%	0.381	36%	0.362	S	S	.	.	H	α-helix	trans	-64.9	-40.1	176.4	0	0	0	0	0	113.2	K444 F445 W446 F451 H452	K444-G448 PolarHBondContact O-N 3.07Å; F445-G448 PolarHBondContact O-N 3.14Å; W446-G448 VanDerWaalsContact C-N 3.3Å; W446-G448 PolarHBondContact O-N 2.94Å; G448-F451 PolarHBondContact O-N 3.49Å; G448-H452 VanDerWaalsContact O-CB 3.31Å; G448-H452 WeakPolarHBondContact O-CB 3.28Å; G448-H452 PolarHBondContact O-N 3.47Å
449	F	91.3	Very high	91.9	Very high	41 Å²	41	76.1 Å²	76.1	18%	0.18	36%	0.361	C	S	.	.	H	α-helix	trans	-60.5	-49.9	176.4	179.3	-88.6	0	0	0	111.4	F445 W446 R453	F445-F449 WeakPolarHBondContact O-CB 3.39Å; F445-F449 PolarHBondContact O-N 2.97Å; W446-F449 HydrophobicContact CE3-CB 4.15Å; W446-F449 HydrophobicContact CE3-CD1 4.15Å; W446-F449 HydrophobicContact CE3-CG 4.17Å; W446-F449 HydrophobicContact CZ3-CD1 4.09Å; W446-F449 HydrophobicContact CZ3-CD2 4.49Å; W446-F449 HydrophobicContact CZ3-CE1 4.43Å; W446-F449 HydrophobicContact CZ3-CG 4.12Å; W446-F449 PolarHBondContact O-N 3.32Å; F449-R453 WeakPolarHBondContact O-CB 3.39Å; F449-R453 PolarHBondContact O-N 3.42Å; F449-R453 VanDerWaalsContact O-N 3.11Å
450	V	92.8	Very high	92.3	Very high	35 Å²	35	68 Å²	68	21%	0.212	33%	0.33	C	S	.	.	H	α-helix	trans	-63.2	-47.8	178.6	171.6	0	0	0	0	110.6	W446 H452 R453 I454 I527	W446-V450 WeakPolarHBondContact O-CG2 3.35Å; W446-V450 PolarHBondContact O-N 3Å; V450-H452 PolarHBondContact O-N 2.93Å; V450-R453 PolarHBondContact O-N 3.16Å; V450-I454 HydrophobicContact CG1-CD1 3.78Å; V450-I454 HydrophobicContact CG1-CG1 4.45Å; V450-I454 WeakPolarHBondContact O-CG1 3.21Å; V450-I454 PolarHBondContact O-N 3.46Å; V450-I527 HydrophobicContact CG1-CD1 3.98Å; V450-I527 HydrophobicContact CG1-CG1 4.28Å; V450-I527 HydrophobicContact CG1-CG2 4.24Å; V450-I527 HydrophobicContact CG2-CG1 4.39Å; V450-I527 HydrophobicContact CG2-CG2 4.03Å
451	F	92.8	Very high	92.6	Very high	137 Å²	137	61.3 Å²	61.3	60%	0.601	30%	0.301	S	S	*	.	H	α-helix	trans	-58.8	-50	179.5	177.6	-102.6	0	0	0	112.4	C447 G448 R453 I454 L455	C447-F451 VanDerWaalsContact O-CB 3.25Å; C447-F451 WeakPolarHBondContact O-CB 3.43Å; C447-F451 PolarHBondContact O-N 3.27Å; G448-F451 PolarHBondContact O-N 3.49Å; F451-R453 PolarHBondContact O-N 3.5Å; F451-I454 PolarHBondContact O-N 2.86Å; F451-L455 HydrophobicContact CE1-CD2 4.2Å; F451-L455 HydrophobicContact CZ-CD2 4.46Å; F451-L455 WeakPolarHBondContact O-CB 3.33Å; F451-L455 PolarHBondContact O-N 3.36Å
452	H	88.9	Confident	92.8	Very high	91 Å²	91	58.8 Å²	58.8	42%	0.421	29%	0.291	S	S	.	.	H	α-helix	trans	-61.1	-35.2	178.8	-178.7	-79.7	0	0	0	111.7	G448 V450 R456	G448-H452 VanDerWaalsContact O-CB 3.31Å; G448-H452 WeakPolarHBondContact O-CB 3.28Å; G448-H452 PolarHBondContact O-N 3.47Å; V450-H452 PolarHBondContact O-N 2.93Å; H452-R456 WeakPolarHBondContact O-CB 3.46Å; H452-R456 PolarHBondContact O-N 3.46Å; H452-R456 VanDerWaalsContact O-N 3.08Å
453	R	91.1	Very high	93.1	Very high	31 Å²	31	56.8 Å²	56.8	12%	0.117	29%	0.285	C	S	.	.	H	α-helix	trans	-70.6	-45.1	179	-175.8	164.6	176.9	143.1	-4.7	112.5	S421 F449 V450 F451 R456 L457 E522 I523 S526	S421-R453 PolarHBondContact OG-NH1 2.87Å; F449-R453 WeakPolarHBondContact O-CB 3.39Å; F449-R453 PolarHBondContact O-N 3.42Å; F449-R453 VanDerWaalsContact O-N 3.11Å; V450-R453 PolarHBondContact O-N 3.16Å; F451-R453 PolarHBondContact O-N 3.5Å; R453-R456 PolarHBondContact O-N 3.46Å; R453-L457 HydrophobicContact CG-CD1 4.13Å; R453-L457 PolarHBondContact O-N 3.27Å; R453-E522 IonicContact CZ-OE1 2.88Å; R453-E522 IonicContact NH1-OE1 3.17Å; R453-E522 VanDerWaalsContact NH2-CG 3.3Å; R453-E522 PolarHBondContact NH2-O 3.01Å; R453-E522 IonicContact NH2-OE1 3.78Å; R453-E522 PolarHBondContact NH2-OE1 3.28Å; R453-I523 HydrophobicContact CG-CD1 4.34Å; R453-S526 VanDerWaalsContact CD-OG 3.29Å; R453-S526 WeakPolarHBondContact CD-OG 3.27Å; R453-S526 VanDerWaalsContact NE-CB 3.27Å; R453-S526 PolarHBondContact NE-OG 3Å; R453-S526 VanDerWaalsContact NH2-CB 3.33Å; R453-S526 PolarHBondContact NH2-OG 3.29Å
454	I	92.9	Very high	93.5	Very high	71 Å²	71	53 Å²	53	36%	0.364	27%	0.266	S	S	.	.	H	α-helix	trans	-60.5	-48.8	174.9	-68.1	172	0	0	0	109.7	V450 F451 R456 L457 T458 I527	V450-I454 HydrophobicContact CG1-CD1 3.78Å; V450-I454 HydrophobicContact CG1-CG1 4.45Å; V450-I454 WeakPolarHBondContact O-CG1 3.21Å; V450-I454 PolarHBondContact O-N 3.46Å; F451-I454 PolarHBondContact O-N 2.86Å; I454-R456 PolarHBondContact O-N 2.9Å; I454-R456 VanDerWaalsContact O-N 3.16Å; I454-L457 PolarHBondContact O-N 3.38Å; I454-T458 VanDerWaalsContact O-CB 3.28Å; I454-T458 WeakPolarHBondContact O-CB 3.31Å; I454-T458 PolarHBondContact O-N 3.3Å; I454-T458 PolarHBondContact O-OG1 3.07Å; I454-T458 VanDerWaalsContact O-OG1 3.04Å; I454-I527 HydrophobicContact CD1-CD1 4.24Å; I454-I527 HydrophobicContact CG1-CD1 4.21Å
455	L	91.8	Very high	93.7	Very high	56 Å²	56	45.4 Å²	45.4	29%	0.293	23%	0.233	S	C	.	.	H	α-helix	trans	-58.8	-32	179.3	-172.5	67.9	0	0	0	112.7	F451 P459 V756	F451-L455 HydrophobicContact CE1-CD2 4.2Å; F451-L455 HydrophobicContact CZ-CD2 4.46Å; F451-L455 WeakPolarHBondContact O-CB 3.33Å; F451-L455 PolarHBondContact O-N 3.36Å; L455-P459 WeakPolarHBondContact O-CD 3.48Å; L455-P459 VanDerWaalsContact O-CG 3.23Å; L455-P459 WeakPolarHBondContact O-CG 3.2Å; L455-V756 HydrophobicContact CD2-CG1 3.95Å; L455-V756 HydrophobicContact CG-CG1 3.77Å; L455-V756 HydrophobicContact CG-CG2 4.48Å
456	R	88.8	Confident	93.8	Very high	119 Å²	119	44.8 Å²	44.8	45%	0.449	23%	0.231	S	C	.	.	H	α-helix	trans	-73.1	-44.7	177.9	-178.6	179	177.3	176.8	1.5	112.9	H452 R453 I454	H452-R456 WeakPolarHBondContact O-CB 3.46Å; H452-R456 PolarHBondContact O-N 3.46Å; H452-R456 VanDerWaalsContact O-N 3.08Å; R453-R456 PolarHBondContact O-N 3.46Å; I454-R456 PolarHBondContact O-N 2.9Å; I454-R456 VanDerWaalsContact O-N 3.16Å
457	L	93	Very high	94	Very high	22 Å²	22	45.2 Å²	45.2	12%	0.115	24%	0.236	C	C	.	.	H	α-helix	trans	-90.7	-42.2	-169	-66.2	172.1	0	0	0	112.5	R453 I454 Y461 I523 Y702	R453-L457 HydrophobicContact CG-CD1 4.13Å; R453-L457 PolarHBondContact O-N 3.27Å; I454-L457 PolarHBondContact O-N 3.38Å; L457-Y461 PolarHBondContact O-N 2.88Å; L457-I523 HydrophobicContact CD1-CD1 3.48Å; L457-I523 VanDerWaalsContact CD1-CD1 3.48Å; L457-I523 HydrophobicContact CD1-CG1 4.34Å; L457-Y702 HydrophobicContact CD2-CD1 4.17Å; L457-Y702 HydrophobicContact CD2-CD2 4Å; L457-Y702 HydrophobicContact CD2-CE1 3.84Å; L457-Y702 HydrophobicContact CD2-CE2 3.74Å; L457-Y702 HydrophobicContact CD2-CG 4.2Å; L457-Y702 PolarHBondContact O-OH 2.91Å
458	T	94.8	Very high	94.2	Very high	26 Å²	26	41.6 Å²	41.6	16%	0.16	21%	0.211	C	C	.	.	H	α-helix	trans	-64.9	-39.8	-168.5	-56.3	0	0	0	0	114.5	I454 A460 Y461 L462 Y501	I454-T458 VanDerWaalsContact O-CB 3.28Å; I454-T458 WeakPolarHBondContact O-CB 3.31Å; I454-T458 PolarHBondContact O-N 3.3Å; I454-T458 PolarHBondContact O-OG1 3.07Å; I454-T458 VanDerWaalsContact O-OG1 3.04Å; T458-A460 PolarHBondContact O-N 2.96Å; T458-Y461 WeakPolarHBondContact O-CB 3.36Å; T458-Y461 PolarHBondContact O-N 3.3Å; T458-L462 HydrophobicContact CG2-CD1 3.59Å; T458-L462 HydrophobicContact CG2-CG 3.79Å; T458-L462 WeakPolarHBondContact O-CG 3.38Å; T458-L462 PolarHBondContact O-N 2.85Å; T458-Y501 WeakPolarHBondContact CA-OH 3.26Å; T458-Y501 PolarHBondContact N-OH 3.35Å; T458-Y501 WeakPolarHBondContact OG1-CE2 3.17Å; T458-Y501 PolarHBondContact OG1-OH 2.99Å; T458-Y501 VanDerWaalsContact OG1-OH 3.06Å
459	P	94.9	Very high	94.4	Very high	41 Å²	41	39.9 Å²	39.9	27%	0.266	19%	0.193	S	C	.	.	H	α-helix	trans	-59.1	-45.6	-178.3	-28.4	37.6	0	0	0	114	L455 L463 T752 V756	L455-P459 WeakPolarHBondContact O-CD 3.48Å; L455-P459 VanDerWaalsContact O-CG 3.23Å; L455-P459 WeakPolarHBondContact O-CG 3.2Å; P459-L463 WeakPolarHBondContact O-CB 3.07Å; P459-L463 PolarHBondContact O-N 3.22Å; P459-T752 HydrophobicContact CB-CG2 4.43Å; P459-V756 HydrophobicContact CG-CG2 4.42Å
460	A	96.5	Very high	94.6	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-67.1	-39.2	177.2	0	0	0	0	0	111.8	T458 V464 Y702 T703 L706 V748 T752	T458-A460 PolarHBondContact O-N 2.96Å; A460-V464 WeakPolarHBondContact O-CG2 3.36Å; A460-V464 PolarHBondContact O-N 3.13Å; A460-Y702 HydrophobicContact CB-CD1 4.45Å; A460-Y702 HydrophobicContact CB-CE1 3.81Å; A460-T703 HydrophobicContact CB-CG2 4.17Å; A460-L706 HydrophobicContact CB-CD1 3.92Å; A460-V748 HydrophobicContact CB-CG1 4.07Å; A460-T752 WeakPolarHBondContact CB-OG1 3.43Å
461	Y	96.7	Very high	94.7	Very high	2 Å²	2	38 Å²	38	1%	0.008	18%	0.183	C	C	.	.	H	α-helix	trans	-60.1	-52.2	177.1	-175.8	-83.8	0	0	0	111.3	L457 T458 L463 V464 L465 T500 S516 L519 L706	L457-Y461 PolarHBondContact O-N 2.88Å; T458-Y461 WeakPolarHBondContact O-CB 3.36Å; T458-Y461 PolarHBondContact O-N 3.3Å; Y461-L463 PolarHBondContact O-N 3.41Å; Y461-V464 PolarHBondContact O-N 2.91Å; Y461-L465 HydrophobicContact CD1-CD1 4.38Å; Y461-L465 HydrophobicContact CE1-CB 4.43Å; Y461-L465 HydrophobicContact CE1-CD1 3.62Å; Y461-L465 WeakPolarHBondContact O-CB 2.97Å; Y461-L465 PolarHBondContact O-N 2.65Å; Y461-T500 HydrophobicContact CD1-CG2 3.65Å; Y461-T500 HydrophobicContact CE1-CG2 3.28Å; Y461-T500 WeakPolarHBondContact CE1-OG1 3.47Å; Y461-T500 HydrophobicContact CG-CG2 4.48Å; Y461-S516 WeakPolarHBondContact OH-CB 3.4Å; Y461-L519 HydrophobicContact CD2-CD1 3.59Å; Y461-L519 HydrophobicContact CE2-CD1 3.87Å; Y461-L706 HydrophobicContact CD2-CD2 3.86Å
462	L	96.1	Very high	94.8	Very high	62 Å²	62	32 Å²	32	33%	0.325	16%	0.157	S	C	.	.	H	α-helix	trans	-64.3	-40.2	-178.9	-68.8	179.6	0	0	0	111.8	T458 L465 I466	T458-L462 HydrophobicContact CG2-CD1 3.59Å; T458-L462 HydrophobicContact CG2-CG 3.79Å; T458-L462 WeakPolarHBondContact O-CG 3.38Å; T458-L462 PolarHBondContact O-N 2.85Å; L462-L465 PolarHBondContact O-N 2.82Å; L462-I466 WeakPolarHBondContact O-CB 3.42Å; L462-I466 WeakPolarHBondContact O-CD1 3.45Å; L462-I466 VanDerWaalsContact O-CG1 3.22Å; L462-I466 WeakPolarHBondContact O-CG1 3.24Å; L462-I466 PolarHBondContact O-N 3.35Å
463	L	97.3	Very high	95	Very high	14 Å²	14	27.9 Å²	27.9	7%	0.073	14%	0.138	C	C	.	.	H	α-helix	trans	-59.1	-50.3	175.7	179.4	62.5	0	0	0	110.8	V233 V237 P459 Y461 I466 L467 V748 A751 T752	V233-L463 HydrophobicContact CG1-CD1 3.66Å; V237-L463 HydrophobicContact CG2-CD1 4.22Å; P459-L463 WeakPolarHBondContact O-CB 3.07Å; P459-L463 PolarHBondContact O-N 3.22Å; Y461-L463 PolarHBondContact O-N 3.41Å; L463-I466 PolarHBondContact O-N 3.31Å; L463-L467 HydrophobicContact CD1-CD1 3.89Å; L463-L467 HydrophobicContact CD1-CG 4.13Å; L463-L467 HydrophobicContact CG-CD1 3.99Å; L463-L467 WeakPolarHBondContact O-CB 3.35Å; L463-L467 VanDerWaalsContact O-CG 3.25Å; L463-L467 WeakPolarHBondContact O-CG 3.19Å; L463-L467 PolarHBondContact O-N 3.31Å; L463-V748 HydrophobicContact CD2-CG1 4.46Å; L463-A751 HydrophobicContact CD2-CB 4.02Å; L463-T752 HydrophobicContact CB-CG2 4.12Å; L463-T752 HydrophobicContact CD2-CG2 3.51Å; L463-T752 HydrophobicContact CG-CG2 4.45Å
464	V	97.9	Very high	95	Very high	6 Å²	6	28.1 Å²	28.1	4%	0.036	14%	0.14	C	C	.	.	H	α-helix	trans	-64.3	-42.7	179.8	174	0	0	0	0	111.2	A460 Y461 I466 L467 Y468 M513 L706 V707 I710 V748	A460-V464 WeakPolarHBondContact O-CG2 3.36Å; A460-V464 PolarHBondContact O-N 3.13Å; Y461-V464 PolarHBondContact O-N 2.91Å; V464-I466 PolarHBondContact O-N 3.1Å; V464-L467 PolarHBondContact O-N 2.95Å; V464-Y468 WeakPolarHBondContact O-CB 3.26Å; V464-Y468 PolarHBondContact O-N 3.42Å; V464-M513 HydrophobicContact CG1-CE 3.78Å; V464-L706 HydrophobicContact CB-CB 4.41Å; V464-L706 HydrophobicContact CG1-CB 4.26Å; V464-L706 HydrophobicContact CG2-CB 4.07Å; V464-L706 HydrophobicContact CG2-CD1 4.3Å; V464-V707 HydrophobicContact CG1-CG1 4.5Å; V464-V707 HydrophobicContact CG2-CG1 3.92Å; V464-I710 HydrophobicContact CG1-CD1 3.56Å; V464-V748 HydrophobicContact CG2-CG1 4.17Å; V464-V748 HydrophobicContact CG2-CG2 4.35Å
465	L	97	Very high	95	Very high	2 Å²	2	27 Å²	27	1%	0.01	14%	0.142	C	C	.	.	H	α-helix	trans	-59.1	-48	177.3	178.8	159.5	0	0	0	111.4	Y461 L462 Y468 T469 W497 M513	Y461-L465 HydrophobicContact CD1-CD1 4.38Å; Y461-L465 HydrophobicContact CE1-CB 4.43Å; Y461-L465 HydrophobicContact CE1-CD1 3.62Å; Y461-L465 WeakPolarHBondContact O-CB 2.97Å; Y461-L465 PolarHBondContact O-N 2.65Å; L462-L465 PolarHBondContact O-N 2.82Å; L465-Y468 PolarHBondContact O-N 3.09Å; L465-T469 VanDerWaalsContact O-CB 3.22Å; L465-T469 WeakPolarHBondContact O-CB 3.35Å; L465-T469 PolarHBondContact O-N 2.9Å; L465-T469 PolarHBondContact O-OG1 2.85Å; L465-W497 HydrophobicContact CD1-CB 4.22Å; L465-W497 HydrophobicContact CD2-CB 4.13Å; L465-M513 HydrophobicContact CB-SD 3.97Å; L465-M513 HydrophobicContact CG-SD 4.44Å
466	I	97.4	Very high	95	Very high	34 Å²	34	28.4 Å²	28.4	17%	0.174	14%	0.144	C	C	.	.	H	α-helix	trans	-63.6	-47.7	-179.5	-71.6	166.9	0	0	0	110.4	V229 A230 V233 L462 L463 V464 T469 G470	V229-I466 HydrophobicContact CG1-CG2 4.06Å; A230-I466 HydrophobicContact CB-CG2 3.95Å; V233-I466 HydrophobicContact CB-CG2 4.37Å; V233-I466 HydrophobicContact CG2-CD1 4.39Å; V233-I466 HydrophobicContact CG2-CG2 4.26Å; L462-I466 WeakPolarHBondContact O-CB 3.42Å; L462-I466 WeakPolarHBondContact O-CD1 3.45Å; L462-I466 VanDerWaalsContact O-CG1 3.22Å; L462-I466 WeakPolarHBondContact O-CG1 3.24Å; L462-I466 PolarHBondContact O-N 3.35Å; L463-I466 PolarHBondContact O-N 3.31Å; V464-I466 PolarHBondContact O-N 3.1Å; I466-T469 PolarHBondContact O-N 3.4Å; I466-G470 PolarHBondContact O-N 3.25Å
467	L	97.3	Very high	95	Very high	42 Å²	42	23.6 Å²	23.6	22%	0.22	13%	0.127	C	C	.	.	H	α-helix	trans	-64.2	-42.1	179.3	-66.1	176.8	0	0	0	111.6	A230 L234 L463 V464 L471	A230-L467 HydrophobicContact CB-CD2 4.42Å; L234-L467 HydrophobicContact CB-CD2 4.18Å; L234-L467 HydrophobicContact CD1-CD2 4.38Å; L463-L467 HydrophobicContact CD1-CD1 3.89Å; L463-L467 HydrophobicContact CD1-CG 4.13Å; L463-L467 HydrophobicContact CG-CD1 3.99Å; L463-L467 WeakPolarHBondContact O-CB 3.35Å; L463-L467 VanDerWaalsContact O-CG 3.25Å; L463-L467 WeakPolarHBondContact O-CG 3.19Å; L463-L467 PolarHBondContact O-N 3.31Å; V464-L467 PolarHBondContact O-N 2.95Å; L467-L471 HydrophobicContact CD2-CD1 3.75Å; L467-L471 WeakPolarHBondContact O-CA 3.26Å; L467-L471 VanDerWaalsContact O-CB 3.26Å; L467-L471 WeakPolarHBondContact O-CB 3.46Å; L467-L471 PolarHBondContact O-N 3.42Å
468	Y	96.8	Very high	94.9	Very high	5 Å²	5	22.5 Å²	22.5	2%	0.02	12%	0.122	C	C	.	.	H	α-helix	trans	-61.1	-52.1	175.8	-179.1	-117.8	0	0	0	111.2	V464 L465 G470 F472 D489 V490 M513 I710	V464-Y468 WeakPolarHBondContact O-CB 3.26Å; V464-Y468 PolarHBondContact O-N 3.42Å; L465-Y468 PolarHBondContact O-N 3.09Å; Y468-G470 VanDerWaalsContact C-N 3.33Å; Y468-G470 PolarHBondContact O-N 3.49Å; Y468-F472 HydrophobicContact CD2-CB 3.72Å; Y468-F472 AromaticContact CD2-CD2 3.88Å; Y468-F472 HydrophobicContact CD2-CD2 3.88Å; Y468-F472 AromaticContact CD2-CG 3.79Å; Y468-F472 HydrophobicContact CD2-CG 3.79Å; Y468-F472 HydrophobicContact CE2-CB 3.86Å; Y468-F472 AromaticContact CE2-CD1 3.8Å; Y468-F472 HydrophobicContact CE2-CD1 3.8Å; Y468-F472 AromaticContact CE2-CD2 3.7Å; Y468-F472 HydrophobicContact CE2-CD2 3.7Å; Y468-F472 HydrophobicContact CE2-CE1 4.27Å; Y468-F472 HydrophobicContact CE2-CE2 4.17Å; Y468-F472 AromaticContact CE2-CG 3.5Å; Y468-F472 HydrophobicContact CE2-CG 3.5Å; Y468-F472 VanDerWaalsContact CE2-CG 3.5Å; Y468-F472 HydrophobicContact CE2-CZ 4.44Å; Y468-F472 WeakPolarHBondContact O-CB 3.49Å; Y468-F472 PolarHBondContact O-N 3.36Å; Y468-F472 VanDerWaalsContact O-N 3.14Å; Y468-D489 WeakPolarHBondContact CE1-OD1 3.25Å; Y468-D489 PolarHBondContact OH-OD1 3.23Å; Y468-V490 HydrophobicContact CD1-CG2 4.21Å; Y468-V490 HydrophobicContact CE1-CG2 3.6Å; Y468-V490 HydrophobicContact CE2-CG2 4.26Å; Y468-M513 HydrophobicContact CD1-CG 3.9Å; Y468-M513 HydrophobicContact CE1-CG 4.27Å; Y468-I710 HydrophobicContact CD2-CD1 3.9Å; Y468-I710 HydrophobicContact CD2-CG1 3.87Å; Y468-I710 HydrophobicContact CD2-CG2 4.11Å; Y468-I710 HydrophobicContact CE2-CG1 4.27Å; Y468-I710 HydrophobicContact CG-CD1 4.16Å
469	T	95.9	Very high	94.7	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-66.4	-35.1	-175	-55.5	0	0	0	0	113	W226 L465 I466 V490 C493 R494	W226-T469 HydrophobicContact CD2-CG2 3.75Å; W226-T469 HydrophobicContact CE3-CG2 3.75Å; W226-T469 HydrophobicContact CG-CG2 4.12Å; W226-T469 HydrophobicContact CZ3-CG2 4.2Å; L465-T469 VanDerWaalsContact O-CB 3.22Å; L465-T469 WeakPolarHBondContact O-CB 3.35Å; L465-T469 PolarHBondContact O-N 2.9Å; L465-T469 PolarHBondContact O-OG1 2.85Å; I466-T469 PolarHBondContact O-N 3.4Å; T469-V490 HydrophobicContact CG2-CG1 4.35Å; T469-C493 HydrophobicContact CG2-CB 4.2Å; T469-C493 WeakPolarHBondContact OG1-CB 3.37Å; T469-R494 HydrophobicContact CG2-CB 4.49Å; T469-R494 HydrophobicContact CG2-CG 3.33Å; T469-R494 PolarHBondContact O-NH2 2.83Å; T469-R494 VanDerWaalsContact O-NH2 3.11Å
470	G	95.1	Very high	94.4	Very high	0 Å²	0	20 Å²	20	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-92.7	-31.1	-176.6	0	0	0	0	0	115.1	W226 F227 I466 Y468 H474	W226-G470 WeakPolarHBondContact O-CA 3.47Å; F227-G470 WeakPolarHBondContact CA-O 3.48Å; I466-G470 PolarHBondContact O-N 3.25Å; Y468-G470 VanDerWaalsContact C-N 3.33Å; Y468-G470 PolarHBondContact O-N 3.49Å; G470-H474 PolarHBondContact O-CD2 3.11Å
471	L	95.3	Very high	94.2	Very high	38 Å²	38	20 Å²	20	20%	0.199	11%	0.105	C	C	.	.	H	α-helix	trans	-114.8	-23.5	-170.3	-55.1	178.2	0	0	0	114.4	F227 A230 M231 L467 I473 H474 A475	F227-L471 HydrophobicContact CD2-CD2 3.78Å; F227-L471 HydrophobicContact CE2-CD2 3.86Å; A230-L471 HydrophobicContact CB-CD1 4.26Å; A230-L471 HydrophobicContact CB-CD2 3.97Å; A230-L471 HydrophobicContact CB-CG 3.73Å; M231-L471 HydrophobicContact CG-CD2 4.05Å; M231-L471 HydrophobicContact SD-CD2 3.78Å; L467-L471 HydrophobicContact CD2-CD1 3.75Å; L467-L471 WeakPolarHBondContact O-CA 3.26Å; L467-L471 VanDerWaalsContact O-CB 3.26Å; L467-L471 WeakPolarHBondContact O-CB 3.46Å; L467-L471 PolarHBondContact O-N 3.42Å; L471-I473 PolarHBondContact O-N 3.11Å; L471-H474 CarbonylContact O-C 3.6Å; L471-H474 PolarHBondContact O-N 2.86Å; L471-A475 PolarHBondContact O-N 3.05Å; L471-A475 VanDerWaalsContact O-N 3.1Å
472	F	95	Very high	93.8	Very high	9 Å²	9	20.2 Å²	20.2	4%	0.039	11%	0.107	C	C	.	.	G	3₁₀ helix	trans	-57.9	-50.4	-171.5	-171.3	-99.9	0	0	0	111.8	Y468 H474 A475 Y481 M488 I710 L713 F714 L717	Y468-F472 HydrophobicContact CD2-CB 3.72Å; Y468-F472 AromaticContact CD2-CD2 3.88Å; Y468-F472 HydrophobicContact CD2-CD2 3.88Å; Y468-F472 AromaticContact CD2-CG 3.79Å; Y468-F472 HydrophobicContact CD2-CG 3.79Å; Y468-F472 HydrophobicContact CE2-CB 3.86Å; Y468-F472 AromaticContact CE2-CD1 3.8Å; Y468-F472 HydrophobicContact CE2-CD1 3.8Å; Y468-F472 AromaticContact CE2-CD2 3.7Å; Y468-F472 HydrophobicContact CE2-CD2 3.7Å; Y468-F472 HydrophobicContact CE2-CE1 4.27Å; Y468-F472 HydrophobicContact CE2-CE2 4.17Å; Y468-F472 AromaticContact CE2-CG 3.5Å; Y468-F472 HydrophobicContact CE2-CG 3.5Å; Y468-F472 VanDerWaalsContact CE2-CG 3.5Å; Y468-F472 HydrophobicContact CE2-CZ 4.44Å; Y468-F472 WeakPolarHBondContact O-CB 3.49Å; Y468-F472 PolarHBondContact O-N 3.36Å; Y468-F472 VanDerWaalsContact O-N 3.14Å; F472-H474 PolarHBondContact O-N 3.27Å; F472-A475 VanDerWaalsContact O-CB 3.26Å; F472-A475 WeakPolarHBondContact O-CB 3.27Å; F472-A475 PolarHBondContact O-N 2.88Å; F472-Y481 WeakPolarHBondContact CD1-OH 3.46Å; F472-Y481 HydrophobicContact CE1-CE2 4.31Å; F472-Y481 AromaticContact CE1-CZ 3.91Å; F472-Y481 WeakPolarHBondContact CE1-OH 3.22Å; F472-Y481 WeakPolarHBondContact CE2-OH 3.45Å; F472-Y481 HydrophobicContact CZ-CE2 4.16Å; F472-Y481 WeakPolarHBondContact CZ-OH 3.01Å; F472-Y481 WeakPolarHBondContact O-CE1 3.33Å; F472-Y481 PolarHBondContact O-OH 2.78Å; F472-M488 HydrophobicContact CE1-CE 3.89Å; F472-I710 HydrophobicContact CD2-CG2 3.73Å; F472-I710 HydrophobicContact CE2-CG2 3.81Å; F472-L713 HydrophobicContact CE2-CB 4.35Å; F472-L713 HydrophobicContact CZ-CB 3.78Å; F472-F714 HydrophobicContact CE2-CB 4.24Å; F472-L717 HydrophobicContact CE1-CD1 4.14Å; F472-L717 HydrophobicContact CZ-CD1 4.21Å
473	I	92.9	Very high	93.4	Very high	6 Å²	6	18.1 Å²	18.1	3%	0.031	10%	0.095	C	C	.	.	G	3₁₀ helix	trans	-59.8	-17.9	179.1	67.4	174.4	0	0	0	114.3	L221 L471 V490	L221-I473 VanDerWaalsContact CD2-O 3.28Å; L221-I473 WeakPolarHBondContact CD2-O 3.45Å; L471-I473 PolarHBondContact O-N 3.11Å; I473-V490 HydrophobicContact CG2-CG1 4.46Å
474	H	92.4	Very high	92.9	Very high	36 Å²	36	19 Å²	19	17%	0.167	10%	0.102	C	C	.	.	G	3₁₀ helix	trans	-101.8	-3.8	178.4	-59.7	-73.9	0	0	0	113.2	L221 P222 F227 G470 L471 F472 Y476	L221-H474 WeakPolarHBondContact CB-ND1 3.44Å; P222-H474 PolarHBondContact O-CE1 3.5Å; P222-H474 VanDerWaalsContact O-CE1 3.32Å; F227-H474 AromaticContact CD2-CD2 3.5Å; F227-H474 VanDerWaalsContact CD2-CD2 3.5Å; F227-H474 WeakPolarHBondContact CD2-CD2 3.22Å; F227-H474 AromaticContact CD2-NE2 3.89Å; G470-H474 PolarHBondContact O-CD2 3.11Å; L471-H474 CarbonylContact O-C 3.6Å; L471-H474 PolarHBondContact O-N 2.86Å; F472-H474 PolarHBondContact O-N 3.27Å; H474-Y476 VanDerWaalsContact C-N 3.34Å; H474-Y476 PolarHBondContact O-N 2.98Å
475	A	92.1	Very high	92.4	Very high	48 Å²	48	20 Å²	20	40%	0.397	11%	0.108	S	C	.	.	S	Bend	trans	-72.8	-27.9	-172.7	0	0	0	0	0	112.8	L471 F472 F714	L471-A475 PolarHBondContact O-N 3.05Å; L471-A475 VanDerWaalsContact O-N 3.1Å; F472-A475 VanDerWaalsContact O-CB 3.26Å; F472-A475 WeakPolarHBondContact O-CB 3.27Å; F472-A475 PolarHBondContact O-N 2.88Å; A475-F714 HydrophobicContact CB-CD2 4.22Å; A475-F714 HydrophobicContact CB-CE2 4.05Å
476	Y	92	Very high	91.9	Very high	85 Å²	85	24.7 Å²	24.7	33%	0.333	13%	0.133	S	C	.	.			trans	-153.7	169.5	179.7	-163.2	-112.1	0	0	0	112.3	H474 Y481 G718 Q720	H474-Y476 VanDerWaalsContact C-N 3.34Å; H474-Y476 PolarHBondContact O-N 2.98Å; Y476-Y481 HydrophobicContact CD1-CD2 4.37Å; Y476-Y481 HydrophobicContact CD1-CG 4.48Å; Y476-Y481 VanDerWaalsContact O-CD1 3.27Å; Y476-Y481 WeakPolarHBondContact O-CD1 3.27Å; Y476-G718 VanDerWaalsContact CE1-O 3.24Å; Y476-G718 WeakPolarHBondContact CE1-O 3.35Å; Y476-Q720 PolarHBondContact OH-NE2 3.23Å; Y476-Q720 VanDerWaalsContact OH-NE2 3.16Å
477	V	89.2	Confident	91.3	Very high	17 Å²	17	25.1 Å²	25.1	10%	0.103	14%	0.135	C	C	.	.			trans	-135.6	119.5	174.6	176.6	0	0	0	0	108.6	M125 F218 L221 Q483	M125-V477 HydrophobicContact CE-CG1 3.62Å; F218-V477 HydrophobicContact CB-CG2 4.47Å; F218-V477 HydrophobicContact CD2-CG2 3.97Å; L221-V477 HydrophobicContact CD1-CG2 4.37Å; V477-Q483 VanDerWaalsContact CG2-NE2 3.32Å
478	G	90	Very high	90.8	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	13%	0.132	C	C	.	.			trans	-163.1	165.1	178.4	0	0	0	0	0	110.8	H215 M480 Y481	H215-G478 PolarHBondContact CE1-O 3.28Å; H215-G478 PolarHBondContact ND1-O 3.19Å; G478-M480 PolarHBondContact O-N 3.34Å; G478-Y481 PolarHBondContact O-N 3.28Å
479	P	90.8	Very high	90.5	Very high	1 Å²	1	25.7 Å²	25.7	1%	0.006	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-26.2	-171.1	25.1	-34.5	0	0	0	113.4	L122 M125 Y146 S148 Q720	L122-P479 HydrophobicContact CB-CB 4.18Å; L122-P479 HydrophobicContact CD1-CB 3.99Å; L122-P479 HydrophobicContact CD1-CG 3.87Å; L122-P479 HydrophobicContact CG-CB 4.48Å; M125-P479 HydrophobicContact CB-CB 4.26Å; M125-P479 HydrophobicContact SD-CB 4.04Å; M125-P479 HydrophobicContact SD-CG 4.45Å; M125-P479 VanDerWaalsContact SD-N 3.39Å; Y146-P479 HydrophobicContact CE1-CB 3.8Å; Y146-P479 WeakPolarHBondContact OH-CB 3.23Å; S148-P479 PolarHBondContact OG-O 3.06Å; P479-Q720 VanDerWaalsContact CG-O 3.27Å; P479-Q720 WeakPolarHBondContact CG-O 3.37Å
480	M	89.5	Confident	90.4	Very high	12 Å²	12	25.7 Å²	25.7	6%	0.059	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.3	-10.2	173.3	-66.4	-60.6	-75	0	0	113.5	N120 L122 N168 V387 G478 P482 L717	N120-M480 HydrophobicContact CB-CE 4.46Å; N120-M480 HydrophobicContact CB-SD 4.38Å; N120-M480 WeakPolarHBondContact OD1-CE 3.43Å; L122-M480 HydrophobicContact CD1-CG 3.46Å; L122-M480 VanDerWaalsContact CD1-CG 3.46Å; L122-M480 HydrophobicContact CD1-SD 3.6Å; L122-M480 HydrophobicContact CD2-CG 4.34Å; L122-M480 HydrophobicContact CD2-SD 3.41Å; L122-M480 WeakPolarHBondContact CD2-SD 3.41Å; L122-M480 HydrophobicContact CG-SD 4.06Å; N168-M480 PolarHBondContact ND2-SD 3.19Å; V387-M480 HydrophobicContact CB-CE 3.76Å; V387-M480 HydrophobicContact CG1-CE 3.74Å; G478-M480 PolarHBondContact O-N 3.34Å; M480-P482 VanDerWaalsContact O-CD 3.23Å; M480-P482 WeakPolarHBondContact O-CD 3.02Å; M480-L717 CarbonylContact C-O 3.58Å; M480-L717 WeakPolarHBondContact CB-O 3.29Å
481	Y	92	Very high	90.3	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.151	C	C	.	.	S	Bend	trans	-86.8	109.9	-173.9	-156.5	-88.1	0	0	0	109.9	F472 Y476 G478 Q483 F714 L717	F472-Y481 WeakPolarHBondContact CD1-OH 3.46Å; F472-Y481 HydrophobicContact CE1-CE2 4.31Å; F472-Y481 AromaticContact CE1-CZ 3.91Å; F472-Y481 WeakPolarHBondContact CE1-OH 3.22Å; F472-Y481 WeakPolarHBondContact CE2-OH 3.45Å; F472-Y481 HydrophobicContact CZ-CE2 4.16Å; F472-Y481 WeakPolarHBondContact CZ-OH 3.01Å; F472-Y481 WeakPolarHBondContact O-CE1 3.33Å; F472-Y481 PolarHBondContact O-OH 2.78Å; Y476-Y481 HydrophobicContact CD1-CD2 4.37Å; Y476-Y481 HydrophobicContact CD1-CG 4.48Å; Y476-Y481 VanDerWaalsContact O-CD1 3.27Å; Y476-Y481 WeakPolarHBondContact O-CD1 3.27Å; G478-Y481 PolarHBondContact O-N 3.28Å; Y481-Q483 PolarHBondContact O-N 3.32Å; Y481-F714 HydrophobicContact CE2-CD2 4.37Å; Y481-L717 HydrophobicContact CD2-CB 3.66Å; Y481-L717 HydrophobicContact CE2-CB 4.12Å; Y481-L717 PolarHBondContact N-O 3.45Å
482	P	87.4	Confident	90.2	Very high	7 Å²	7	29.4 Å²	29.4	5%	0.045	15%	0.153	C	C	.	.			trans	-71	123.2	-177.2	27	-31	0	0	0	110.5	M480 T484 L487 M488	M480-P482 VanDerWaalsContact O-CD 3.23Å; M480-P482 WeakPolarHBondContact O-CD 3.02Å; P482-T484 VanDerWaalsContact C-N 3.29Å; P482-L487 HydrophobicContact CB-CB 3.8Å; P482-L487 HydrophobicContact CB-CD1 4.15Å; P482-M488 HydrophobicContact CB-CG 4.1Å; P482-M488 HydrophobicContact CG-CG 3.3Å; P482-M488 HydrophobicContact CG-SD 3.55Å; P482-M488 VanDerWaalsContact CG-SD 3.55Å
483	Q	88.1	Confident	90.2	Very high	19 Å²	19	29 Å²	29	9%	0.089	15%	0.151	C	C	.	.			trans	-93.4	11.7	177.5	-63.6	-177.7	-30.3	0	0	112.8	F213 A216 L221 V477 Y481	F213-Q483 HydrophobicContact CE2-CB 4.37Å; A216-Q483 PolarHBondContact O-NE2 3.44Å; L221-Q483 HydrophobicContact CD2-CB 3.8Å; L221-Q483 HydrophobicContact CD2-CG 4.03Å; L221-Q483 HydrophobicContact CG-CB 4.43Å; V477-Q483 VanDerWaalsContact CG2-NE2 3.32Å; Y481-Q483 PolarHBondContact O-N 3.32Å
484	T	87.2	Confident	90.2	Very high	33 Å²	33	30.6 Å²	30.6	20%	0.202	16%	0.157	C	C	.	.	S	Bend	trans	-128.1	137.8	179.9	173.2	0	0	0	0	109.7	F213 P482 N486 L487	F213-T484 HydrophobicContact CG-CG2 4.38Å; P482-T484 VanDerWaalsContact C-N 3.29Å; T484-N486 PolarHBondContact O-N 3.05Å; T484-N486 PolarHBondContact OG1-N 3.43Å; T484-L487 HydrophobicContact CG2-CB 4.09Å; T484-L487 HydrophobicContact CG2-CD1 3.45Å; T484-L487 VanDerWaalsContact CG2-CD1 3.45Å; T484-L487 HydrophobicContact CG2-CG 3.59Å
485	P	87	Confident	90.3	Very high	25 Å²	25	32.5 Å²	32.5	16%	0.162	17%	0.168	C	C	.	.	G	3₁₀ helix	trans	-61.6	-27.3	177.8	27.3	-37.4	0	0	0	112.6	L487 M488 V490 K491	P485-L487 PolarHBondContact O-N 3.09Å; P485-M488 PolarHBondContact O-N 3.08Å; P485-M488 VanDerWaalsContact O-O 3.09Å; P485-V490 HydrophobicContact CB-CG1 4.04Å; P485-K491 VanDerWaalsContact O-CB 3.22Å; P485-K491 WeakPolarHBondContact O-CB 3.34Å; P485-K491 PolarHBondContact O-N 3.34Å
486	N	86.4	Confident	90.3	Very high	102 Å²	102	31.5 Å²	31.5	55%	0.545	16%	0.155	S	C	.	.	G	3₁₀ helix	trans	-68.3	-16.1	-172.5	-67.2	-16.4	0	0	0	114.6	T484 K491	T484-N486 PolarHBondContact O-N 3.05Å; T484-N486 PolarHBondContact OG1-N 3.43Å; N486-K491 HydrophobicContact CB-CD 4.49Å
487	L	85.4	Confident	90.3	Very high	43 Å²	43	33 Å²	33	23%	0.225	16%	0.161	C	C	.	.	G	3₁₀ helix	trans	-97.1	-0.7	-178.2	-71.6	179.4	0	0	0	113.8	T211 F213 P482 T484 P485	T211-L487 HydrophobicContact CG2-CD2 3.78Å; T211-L487 WeakPolarHBondContact O-CD1 3.26Å; T211-L487 WeakPolarHBondContact O-CD2 3.42Å; F213-L487 HydrophobicContact CD1-CD1 3.28Å; F213-L487 HydrophobicContact CE1-CD1 3.24Å; F213-L487 HydrophobicContact CG-CD1 4.2Å; F213-L487 HydrophobicContact CZ-CD1 4.16Å; P482-L487 HydrophobicContact CB-CB 3.8Å; P482-L487 HydrophobicContact CB-CD1 4.15Å; T484-L487 HydrophobicContact CG2-CB 4.09Å; T484-L487 HydrophobicContact CG2-CD1 3.45Å; T484-L487 VanDerWaalsContact CG2-CD1 3.45Å; T484-L487 HydrophobicContact CG2-CG 3.59Å; P485-L487 PolarHBondContact O-N 3.09Å
488	M	87	Confident	90.3	Very high	29 Å²	29	39.3 Å²	39.3	14%	0.143	18%	0.183	C	C	.	.	S	Bend	trans	-131.4	163.7	-176.3	-69.4	-66.8	-65.7	0	0	110	F472 P482 P485 V490 K491 L713 L717	F472-M488 HydrophobicContact CE1-CE 3.89Å; P482-M488 HydrophobicContact CB-CG 4.1Å; P482-M488 HydrophobicContact CG-CG 3.3Å; P482-M488 HydrophobicContact CG-SD 3.55Å; P482-M488 VanDerWaalsContact CG-SD 3.55Å; P485-M488 PolarHBondContact O-N 3.08Å; P485-M488 VanDerWaalsContact O-O 3.09Å; M488-V490 HydrophobicContact CB-CB 4.08Å; M488-V490 HydrophobicContact CB-CG2 4.01Å; M488-V490 PolarHBondContact O-N 3.22Å; M488-K491 PolarHBondContact O-N 3.03Å; M488-K491 VanDerWaalsContact O-N 3.08Å; M488-L713 HydrophobicContact CE-CD1 4.27Å; M488-L717 HydrophobicContact CE-CD1 3.79Å; M488-L717 HydrophobicContact SD-CD1 3.97Å
489	D	90.2	Very high	90.2	Very high	30 Å²	30	39.5 Å²	39.5	16%	0.16	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-9.4	169.1	67.9	-23.4	0	0	0	113.3	Y468 K491 F492 C493 M513 G514	Y468-D489 WeakPolarHBondContact CE1-OD1 3.25Å; Y468-D489 PolarHBondContact OH-OD1 3.23Å; D489-K491 PolarHBondContact O-N 3.26Å; D489-F492 HydrophobicContact CB-CD2 4.09Å; D489-F492 PolarHBondContact O-N 3.18Å; D489-F492 VanDerWaalsContact O-N 3.11Å; D489-C493 PolarHBondContact O-N 2.5Å; D489-M513 VanDerWaalsContact OD2-CA 3.23Å; D489-M513 WeakPolarHBondContact OD2-CA 3.15Å; D489-M513 PolarHBondContact OD2-N 3.27Å; D489-G514 PolarHBondContact OD2-N 3.08Å
490	V	93	Very high	90.1	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-52	-40.2	166.1	174.1	0	0	0	0	111.7	Y468 T469 I473 P485 M488 F492 C493 R494	Y468-V490 HydrophobicContact CD1-CG2 4.21Å; Y468-V490 HydrophobicContact CE1-CG2 3.6Å; Y468-V490 HydrophobicContact CE2-CG2 4.26Å; T469-V490 HydrophobicContact CG2-CG1 4.35Å; I473-V490 HydrophobicContact CG2-CG1 4.46Å; P485-V490 HydrophobicContact CB-CG1 4.04Å; M488-V490 HydrophobicContact CB-CB 4.08Å; M488-V490 HydrophobicContact CB-CG2 4.01Å; M488-V490 PolarHBondContact O-N 3.22Å; V490-F492 PolarHBondContact O-N 3.25Å; V490-C493 WeakPolarHBondContact O-CB 3.29Å; V490-C493 PolarHBondContact O-N 3.29Å; V490-R494 WeakPolarHBondContact O-CG 3.43Å; V490-R494 PolarHBondContact O-N 2.91Å
491	K	93.5	Very high	90.2	Very high	62 Å²	62	41.5 Å²	41.5	27%	0.27	19%	0.194	S	C	.	.	H	α-helix	trans	-58.1	-49.3	175	170.4	179.1	-179.3	-54.1	0	111.1	P485 N486 M488 D489 C493 R494 D495	P485-K491 VanDerWaalsContact O-CB 3.22Å; P485-K491 WeakPolarHBondContact O-CB 3.34Å; P485-K491 PolarHBondContact O-N 3.34Å; N486-K491 HydrophobicContact CB-CD 4.49Å; M488-K491 PolarHBondContact O-N 3.03Å; M488-K491 VanDerWaalsContact O-N 3.08Å; D489-K491 PolarHBondContact O-N 3.26Å; K491-C493 PolarHBondContact O-N 2.58Å; K491-R494 WeakPolarHBondContact O-CB 3.45Å; K491-R494 PolarHBondContact O-N 3.08Å; K491-D495 WeakPolarHBondContact CG-OD2 3.29Å; K491-D495 IonicContact NZ-OD2 3.6Å; K491-D495 PolarHBondContact NZ-OD2 3.46Å; K491-D495 PolarHBondContact O-N 3.41Å
492	F	92.7	Very high	90.2	Very high	54 Å²	54	45.4 Å²	45.4	24%	0.237	21%	0.214	C	C	.	.	H	α-helix	trans	-64.7	-31.2	179.9	-50.9	-47.5	0	0	0	112	D489 V490 H496 E510	D489-F492 HydrophobicContact CB-CD2 4.09Å; D489-F492 PolarHBondContact O-N 3.18Å; D489-F492 VanDerWaalsContact O-N 3.11Å; V490-F492 PolarHBondContact O-N 3.25Å; F492-H496 WeakPolarHBondContact O-CA 3.43Å; F492-H496 WeakPolarHBondContact O-CB 3.28Å; F492-H496 PolarHBondContact O-N 2.85Å; F492-E510 HydrophobicContact CB-CB 4.38Å; F492-E510 WeakPolarHBondContact CB-O 3.38Å; F492-E510 HydrophobicContact CD1-CB 3.51Å; F492-E510 HydrophobicContact CD1-CG 3.8Å; F492-E510 HydrophobicContact CD2-CB 4.32Å; F492-E510 HydrophobicContact CE1-CB 3.77Å; F492-E510 HydrophobicContact CE1-CG 3.52Å; F492-E510 HydrophobicContact CG-CB 3.83Å; F492-E510 HydrophobicContact CZ-CB 4.29Å; F492-E510 HydrophobicContact CZ-CG 4.03Å
493	C	94.7	Very high	90.4	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-62.9	-43.5	168.8	-67.3	0	0	0	0	112.5	T469 D489 V490 K491 D495 W497 C512 M513	T469-C493 HydrophobicContact CG2-CB 4.2Å; T469-C493 WeakPolarHBondContact OG1-CB 3.37Å; D489-C493 PolarHBondContact O-N 2.5Å; V490-C493 WeakPolarHBondContact O-CB 3.29Å; V490-C493 PolarHBondContact O-N 3.29Å; K491-C493 PolarHBondContact O-N 2.58Å; C493-D495 VanDerWaalsContact C-N 3.35Å; C493-D495 PolarHBondContact O-N 3.42Å; C493-W497 WeakPolarHBondContact O-CA 3.44Å; C493-W497 WeakPolarHBondContact O-CB 3.45Å; C493-W497 PolarHBondContact O-N 3.06Å; C493-C512 WeakPolarHBondContact CA-SG 3.17Å; C493-C512 HydrophobicContact CB-CB 3.86Å; C493-C512 WeakPolarHBondContact CB-SG 3.41Å; C493-C512 WeakPolarHBondContact SG-CA 3.48Å; C493-C512 WeakPolarHBondContact SG-CB 3.33Å; C493-C512 CovalentContact SG-SG 2.04Å; C493-C512 PolarHBondContact SG-SG 2.95Å; C493-M513 PolarHBondContact SG-N 2.84Å; C493-M513 VanDerWaalsContact SG-N 3.41Å
494	R	94.5	Very high	90.5	Very high	39 Å²	39	44.7 Å²	44.7	15%	0.147	21%	0.21	C	C	.	.	H	α-helix	trans	-64.4	-41.2	178.1	-65.2	175	176.3	-153	-9.1	112.2	D224 W226 T469 V490 K491	D224-R494 IonicContact OD1-NH2 3.59Å; D224-R494 IonicContact OD2-CZ 3.67Å; D224-R494 IonicContact OD2-NH1 3.82Å; D224-R494 PolarHBondContact OD2-NH1 2.88Å; D224-R494 IonicContact OD2-NH2 3.69Å; D224-R494 PolarHBondContact OD2-NH2 3.31Å; W226-R494 HydrophobicContact CD2-CG 4.39Å; W226-R494 HydrophobicContact CG-CG 4.26Å; T469-R494 HydrophobicContact CG2-CB 4.49Å; T469-R494 HydrophobicContact CG2-CG 3.33Å; T469-R494 PolarHBondContact O-NH2 2.83Å; T469-R494 VanDerWaalsContact O-NH2 3.11Å; V490-R494 WeakPolarHBondContact O-CG 3.43Å; V490-R494 PolarHBondContact O-N 2.91Å; K491-R494 WeakPolarHBondContact O-CB 3.45Å; K491-R494 PolarHBondContact O-N 3.08Å
495	D	93.4	Very high	90.7	Very high	76 Å²	76	48 Å²	48	41%	0.406	22%	0.222	S	C	.	.	H	α-helix	trans	-77.9	-39.8	-175.6	-62.7	-16.4	0	0	0	112	K491 C493	K491-D495 WeakPolarHBondContact CG-OD2 3.29Å; K491-D495 IonicContact NZ-OD2 3.6Å; K491-D495 PolarHBondContact NZ-OD2 3.46Å; K491-D495 PolarHBondContact O-N 3.41Å; C493-D495 VanDerWaalsContact C-N 3.35Å; C493-D495 PolarHBondContact O-N 3.42Å
496	H	92	Very high	90.9	Very high	28 Å²	28	49.9 Å²	49.9	13%	0.13	23%	0.23	C	C	.	.	H	α-helix	trans	-125.7	18.2	-166.5	-52.5	120.2	0	0	0	114.7	F492 W498 V499 Y507 E510	F492-H496 WeakPolarHBondContact O-CA 3.43Å; F492-H496 WeakPolarHBondContact O-CB 3.28Å; F492-H496 PolarHBondContact O-N 2.85Å; H496-W498 PolarHBondContact O-N 2.95Å; H496-V499 HydrophobicContact CB-CG2 4.16Å; H496-V499 WeakPolarHBondContact O-CB 3.45Å; H496-V499 WeakPolarHBondContact O-CG2 3.36Å; H496-V499 PolarHBondContact O-N 3Å; H496-Y507 HydrophobicContact CB-CD2 4.32Å; H496-Y507 AromaticContact CD2-CD2 3.45Å; H496-Y507 VanDerWaalsContact CD2-CD2 3.45Å; H496-Y507 WeakPolarHBondContact CD2-CD2 3.35Å; H496-Y507 AromaticContact CD2-CE2 3.41Å; H496-Y507 VanDerWaalsContact CD2-CE2 3.41Å; H496-Y507 WeakPolarHBondContact CD2-CE2 3.45Å; H496-Y507 AromaticContact CD2-CG 3.97Å; H496-Y507 AromaticContact CD2-CZ 3.85Å; H496-Y507 AromaticContact CG-CD2 3.78Å; H496-Y507 AromaticContact NE2-CD1 3.89Å; H496-Y507 AromaticContact NE2-CD2 3.83Å; H496-Y507 AromaticContact NE2-CE1 3.74Å; H496-Y507 AromaticContact NE2-CE2 3.72Å; H496-Y507 AromaticContact NE2-CG 3.94Å; H496-Y507 AromaticContact NE2-CZ 3.66Å; H496-E510 IonicContact CE1-OE2 2.73Å; H496-E510 PolarHBondContact CE1-OE2 2.9Å; H496-E510 IonicContact ND1-OE2 2.7Å
497	W	91.3	Very high	90.8	Very high	117 Å²	117	50.5 Å²	50.5	44%	0.443	23%	0.226	S	C	.	.	G	3₁₀ helix	trans	-52.4	-33.7	180	65.3	-84.8	0	0	0	113.7	W226 L465 C493 V499 T500	W226-W497 AromaticContact CH2-CD1 3.75Å; W226-W497 HydrophobicContact CH2-CG 4.05Å; W226-W497 AromaticContact CZ2-CD1 3.85Å; L465-W497 HydrophobicContact CD1-CB 4.22Å; L465-W497 HydrophobicContact CD2-CB 4.13Å; C493-W497 WeakPolarHBondContact O-CA 3.44Å; C493-W497 WeakPolarHBondContact O-CB 3.45Å; C493-W497 PolarHBondContact O-N 3.06Å; W497-V499 PolarHBondContact O-N 3.26Å; W497-T500 PolarHBondContact O-N 2.92Å; W497-T500 PolarHBondContact O-OG1 3.39Å
498	W	89.6	Confident	90.8	Very high	149 Å²	149	49.2 Å²	49.2	56%	0.564	22%	0.22	S	C	*	.	G	3₁₀ helix	trans	-66	-18.1	-177.7	60.6	-91	0	0	0	113.1	H496 T500 Y507	H496-W498 PolarHBondContact O-N 2.95Å; W498-T500 PolarHBondContact O-N 3.38Å; W498-T500 VanDerWaalsContact O-N 3.16Å; W498-Y507 HydrophobicContact CZ2-CE2 4.2Å
499	V	88.7	Confident	90.6	Very high	4 Å²	4	52.7 Å²	52.7	2%	0.024	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-80.5	18.2	176.2	-165.1	0	0	0	0	111.5	H496 W497 Y501 L502 N503 I506 Y507	H496-V499 HydrophobicContact CB-CG2 4.16Å; H496-V499 WeakPolarHBondContact O-CB 3.45Å; H496-V499 WeakPolarHBondContact O-CG2 3.36Å; H496-V499 PolarHBondContact O-N 3Å; W497-V499 PolarHBondContact O-N 3.26Å; V499-Y501 PolarHBondContact O-N 3.25Å; V499-L502 HydrophobicContact CG1-CB 3.76Å; V499-L502 CarbonylContact O-C 3.6Å; V499-L502 WeakPolarHBondContact O-CA 3.23Å; V499-L502 PolarHBondContact O-N 3.26Å; V499-N503 PolarHBondContact O-N 2.84Å; V499-N503 VanDerWaalsContact O-N 3.14Å; V499-I506 HydrophobicContact CG1-CB 3.65Å; V499-I506 HydrophobicContact CG1-CD1 4.21Å; V499-I506 HydrophobicContact CG1-CG1 4.39Å; V499-I506 HydrophobicContact CG1-CG2 4.05Å; V499-Y507 HydrophobicContact CG2-CD2 4.21Å; V499-Y507 HydrophobicContact CG2-CE2 4.45Å
500	T	87.7	Confident	90.5	Very high	26 Å²	26	54.7 Å²	54.7	16%	0.16	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.6	129.4	174.9	-66.1	0	0	0	0	110.2	Y461 W497 W498 L502	Y461-T500 HydrophobicContact CD1-CG2 3.65Å; Y461-T500 HydrophobicContact CE1-CG2 3.28Å; Y461-T500 WeakPolarHBondContact CE1-OG1 3.47Å; Y461-T500 HydrophobicContact CG-CG2 4.48Å; W497-T500 PolarHBondContact O-N 2.92Å; W497-T500 PolarHBondContact O-OG1 3.39Å; W498-T500 PolarHBondContact O-N 3.38Å; W498-T500 VanDerWaalsContact O-N 3.16Å; T500-L502 VanDerWaalsContact C-N 3.26Å; T500-L502 PolarHBondContact O-N 3.21Å
501	Y	91.8	Very high	90.3	Very high	29 Å²	29	55.6 Å²	55.6	11%	0.114	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	70.8	1.1	-173	-49.4	-55.1	0	0	0	117.4	T458 V499 L519 S520 I523 Q524	T458-Y501 WeakPolarHBondContact CA-OH 3.26Å; T458-Y501 PolarHBondContact N-OH 3.35Å; T458-Y501 WeakPolarHBondContact OG1-CE2 3.17Å; T458-Y501 PolarHBondContact OG1-OH 2.99Å; T458-Y501 VanDerWaalsContact OG1-OH 3.06Å; V499-Y501 PolarHBondContact O-N 3.25Å; Y501-L519 HydrophobicContact CD1-CB 4.44Å; Y501-L519 HydrophobicContact CE1-CB 4.22Å; Y501-S520 VanDerWaalsContact CA-OG 3.22Å; Y501-S520 WeakPolarHBondContact CA-OG 3.27Å; Y501-S520 WeakPolarHBondContact O-CB 3.34Å; Y501-I523 HydrophobicContact CD1-CB 4.02Å; Y501-I523 HydrophobicContact CD1-CG1 3.52Å; Y501-I523 HydrophobicContact CD1-CG2 4.5Å; Y501-I523 HydrophobicContact CD2-CG1 4.36Å; Y501-I523 HydrophobicContact CD2-CG2 4.49Å; Y501-I523 HydrophobicContact CE1-CD1 4.47Å; Y501-I523 HydrophobicContact CE1-CG1 3.56Å; Y501-I523 HydrophobicContact CE2-CG1 4.39Å; Y501-I523 HydrophobicContact CG-CB 4.18Å; Y501-I523 HydrophobicContact CG-CG1 3.94Å; Y501-I523 HydrophobicContact CG-CG2 4.15Å; Y501-Q524 PolarHBondContact O-NE2 3Å
502	L	93.2	Very high	90.2	Very high	82 Å²	82	53 Å²	53	43%	0.429	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-122.9	0.5	175.8	-66.4	176.6	0	0	0	113.6	V499 T500 N504 F505 I506	V499-L502 HydrophobicContact CG1-CB 3.76Å; V499-L502 CarbonylContact O-C 3.6Å; V499-L502 WeakPolarHBondContact O-CA 3.23Å; V499-L502 PolarHBondContact O-N 3.26Å; T500-L502 VanDerWaalsContact C-N 3.26Å; T500-L502 PolarHBondContact O-N 3.21Å; L502-N504 PolarHBondContact O-N 3.29Å; L502-N504 VanDerWaalsContact O-N 3.09Å; L502-N504 PolarHBondContact O-OD1 3.47Å; L502-F505 PolarHBondContact O-N 3.38Å; L502-I506 HydrophobicContact CB-CD1 4.12Å; L502-I506 HydrophobicContact CD1-CD1 4.2Å; L502-I506 PolarHBondContact O-N 2.86Å
503	N	90.5	Very high	90.2	Very high	10 Å²	10	50.4 Å²	50.4	5%	0.053	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-10	-176.7	69.9	-10.5	0	0	0	114.7	V499 F505 I506 L511 S516 S520	V499-N503 PolarHBondContact O-N 2.84Å; V499-N503 VanDerWaalsContact O-N 3.14Å; N503-F505 VanDerWaalsContact C-N 3.34Å; N503-I506 WeakPolarHBondContact CA-O 3.46Å; N503-L511 HydrophobicContact CB-CD2 4.09Å; N503-L511 WeakPolarHBondContact O-CD2 3.27Å; N503-S516 PolarHBondContact ND2-OG 3Å; N503-S520 WeakPolarHBondContact OD1-CB 3.36Å; N503-S520 PolarHBondContact OD1-OG 2.89Å
504	N	91.8	Very high	90	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-21.4	171	63.7	-30.5	0	0	0	112.8	L502 N521 Q524 K584	L502-N504 PolarHBondContact O-N 3.29Å; L502-N504 VanDerWaalsContact O-N 3.09Å; L502-N504 PolarHBondContact O-OD1 3.47Å; N504-N521 PolarHBondContact ND2-OD1 3.46Å; N504-Q524 PolarHBondContact ND2-NE2 3.38Å; N504-Q524 PolarHBondContact ND2-OE1 3.11Å; N504-Q524 PolarHBondContact OD1-NE2 3.2Å; N504-K584 PolarHBondContact O-NZ 3.37Å
505	F	91.2	Very high	90	Very high	102 Å²	102	50 Å²	50	45%	0.447	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.4	-47.5	177.6	-77.6	-67	0	0	0	112.7	L502 N503 P585 Y586	L502-F505 PolarHBondContact O-N 3.38Å; N503-F505 VanDerWaalsContact C-N 3.34Å; F505-P585 HydrophobicContact CE1-CG 4.13Å; F505-P585 HydrophobicContact CE2-CG 3.48Å; F505-P585 VanDerWaalsContact CE2-CG 3.48Å; F505-P585 HydrophobicContact CZ-CG 3.21Å; F505-Y586 HydrophobicContact CE1-CE1 4.28Å
506	I	90.2	Very high	90	Very high	66 Å²	66	46.3 Å²	46.3	34%	0.338	22%	0.218	S	C	.	.	S	Bend	trans	-99.9	129.6	-174.2	-51.3	176.1	0	0	0	107.8	V499 L502 N503 S508	V499-I506 HydrophobicContact CG1-CB 3.65Å; V499-I506 HydrophobicContact CG1-CD1 4.21Å; V499-I506 HydrophobicContact CG1-CG1 4.39Å; V499-I506 HydrophobicContact CG1-CG2 4.05Å; L502-I506 HydrophobicContact CB-CD1 4.12Å; L502-I506 HydrophobicContact CD1-CD1 4.2Å; L502-I506 PolarHBondContact O-N 2.86Å; N503-I506 WeakPolarHBondContact CA-O 3.46Å; I506-S508 VanDerWaalsContact C-N 3.31Å; I506-S508 PolarHBondContact O-N 2.84Å
507	Y	85.2	Confident	90.2	Very high	115 Å²	115	45.5 Å²	45.5	45%	0.451	21%	0.213	S	C	.	.	S	Bend	trans	52.9	43.2	-176.3	-54.5	-68.8	0	0	0	113.4	H496 W498 V499 D509 E510	H496-Y507 HydrophobicContact CB-CD2 4.32Å; H496-Y507 AromaticContact CD2-CD2 3.45Å; H496-Y507 VanDerWaalsContact CD2-CD2 3.45Å; H496-Y507 WeakPolarHBondContact CD2-CD2 3.35Å; H496-Y507 AromaticContact CD2-CE2 3.41Å; H496-Y507 VanDerWaalsContact CD2-CE2 3.41Å; H496-Y507 WeakPolarHBondContact CD2-CE2 3.45Å; H496-Y507 AromaticContact CD2-CG 3.97Å; H496-Y507 AromaticContact CD2-CZ 3.85Å; H496-Y507 AromaticContact CG-CD2 3.78Å; H496-Y507 AromaticContact NE2-CD1 3.89Å; H496-Y507 AromaticContact NE2-CD2 3.83Å; H496-Y507 AromaticContact NE2-CE1 3.74Å; H496-Y507 AromaticContact NE2-CE2 3.72Å; H496-Y507 AromaticContact NE2-CG 3.94Å; H496-Y507 AromaticContact NE2-CZ 3.66Å; W498-Y507 HydrophobicContact CZ2-CE2 4.2Å; V499-Y507 HydrophobicContact CG2-CD2 4.21Å; V499-Y507 HydrophobicContact CG2-CE2 4.45Å; Y507-D509 PolarHBondContact O-N 3.44Å; Y507-D509 VanDerWaalsContact O-N 3.1Å; Y507-E510 CarbonylContact O-C 3.54Å; Y507-E510 PolarHBondContact O-N 2.8Å
508	S	84.2	Confident	90.3	Very high	16 Å²	16	40.8 Å²	40.8	11%	0.112	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-13.8	-176.3	54.3	0	0	0	0	114.9	I506 K584	I506-S508 VanDerWaalsContact C-N 3.31Å; I506-S508 PolarHBondContact O-N 2.84Å; S508-K584 PolarHBondContact OG-NZ 3.47Å
509	D	83.9	Confident	90.6	Very high	102 Å²	102	33.9 Å²	33.9	55%	0.545	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86	-15.1	171.6	-62.4	-65.3	0	0	0	112.7	K162 Y507	K162-D509 IonicContact NZ-OD1 3.35Å; Y507-D509 PolarHBondContact O-N 3.44Å; Y507-D509 VanDerWaalsContact O-N 3.1Å
510	E	87.7	Confident	90.9	Very high	72 Å²	72	33.7 Å²	33.7	34%	0.336	17%	0.169	S	C	.	.	S	Bend	trans	-125.4	64.5	-174.4	-67.5	-170.4	-171.1	0	0	110.4	F492 H496 Y507 C512	F492-E510 HydrophobicContact CB-CB 4.38Å; F492-E510 WeakPolarHBondContact CB-O 3.38Å; F492-E510 HydrophobicContact CD1-CB 3.51Å; F492-E510 HydrophobicContact CD1-CG 3.8Å; F492-E510 HydrophobicContact CD2-CB 4.32Å; F492-E510 HydrophobicContact CE1-CB 3.77Å; F492-E510 HydrophobicContact CE1-CG 3.52Å; F492-E510 HydrophobicContact CG-CB 3.83Å; F492-E510 HydrophobicContact CZ-CB 4.29Å; F492-E510 HydrophobicContact CZ-CG 4.03Å; H496-E510 IonicContact CE1-OE2 2.73Å; H496-E510 PolarHBondContact CE1-OE2 2.9Å; H496-E510 IonicContact ND1-OE2 2.7Å; Y507-E510 CarbonylContact O-C 3.54Å; Y507-E510 PolarHBondContact O-N 2.8Å; E510-C512 PolarHBondContact O-N 2.99Å
511	L	88.2	Confident	91.3	Very high	19 Å²	19	32.5 Å²	32.5	10%	0.099	16%	0.161	C	C	.	.			trans	-78.2	116.2	-172.6	-68.9	157.4	0	0	0	111.8	N503 M513 F578 L583	N503-L511 HydrophobicContact CB-CD2 4.09Å; N503-L511 WeakPolarHBondContact O-CD2 3.27Å; L511-M513 PolarHBondContact O-N 3.3Å; L511-F578 HydrophobicContact CD1-CE1 3.78Å; L511-L583 HydrophobicContact CD1-CD1 3.93Å; L511-L583 HydrophobicContact CD1-CD2 3.83Å; L511-L583 HydrophobicContact CD2-CD2 3.92Å
512	C	91.6	Very high	91.5	Very high	7 Å²	7	31.9 Å²	31.9	5%	0.047	16%	0.16	C	C	.	.	S	Bend	trans	-65.5	126.2	162	170.4	0	0	0	0	110.6	C493 E510 S516	C493-C512 WeakPolarHBondContact CA-SG 3.17Å; C493-C512 HydrophobicContact CB-CB 3.86Å; C493-C512 WeakPolarHBondContact CB-SG 3.41Å; C493-C512 WeakPolarHBondContact SG-CA 3.48Å; C493-C512 WeakPolarHBondContact SG-CB 3.33Å; C493-C512 CovalentContact SG-SG 2.04Å; C493-C512 PolarHBondContact SG-SG 2.95Å; E510-C512 PolarHBondContact O-N 2.99Å; C512-S516 PolarHBondContact O-OG 3.34Å
513	M	93.4	Very high	91.6	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	14%	0.142	C	C	.	.	S	Bend	trans	50.5	84.2	-173.8	-67.5	172.1	63	0	0	109.2	V464 L465 Y468 D489 C493 L511 W515 S516 L706	V464-M513 HydrophobicContact CG1-CE 3.78Å; L465-M513 HydrophobicContact CB-SD 3.97Å; L465-M513 HydrophobicContact CG-SD 4.44Å; Y468-M513 HydrophobicContact CD1-CG 3.9Å; Y468-M513 HydrophobicContact CE1-CG 4.27Å; D489-M513 VanDerWaalsContact OD2-CA 3.23Å; D489-M513 WeakPolarHBondContact OD2-CA 3.15Å; D489-M513 PolarHBondContact OD2-N 3.27Å; C493-M513 PolarHBondContact SG-N 2.84Å; C493-M513 VanDerWaalsContact SG-N 3.41Å; L511-M513 PolarHBondContact O-N 3.3Å; M513-W515 HydrophobicContact CB-CD2 4.22Å; M513-W515 HydrophobicContact CB-CH2 4.22Å; M513-W515 HydrophobicContact CB-CZ2 3.91Å; M513-W515 HydrophobicContact CE-CZ2 3.68Å; M513-W515 HydrophobicContact CG-CH2 4.26Å; M513-W515 HydrophobicContact CG-CZ2 3.92Å; M513-W515 PolarHBondContact O-N 3.35Å; M513-S516 VanDerWaalsContact O-CB 3.24Å; M513-S516 WeakPolarHBondContact O-CB 3.33Å; M513-S516 PolarHBondContact O-N 2.99Å; M513-S516 PolarHBondContact O-OG 3.23Å; M513-L706 HydrophobicContact CE-CD2 4.44Å
514	G	89.7	Confident	91.9	Very high	26 Å²	26	29.5 Å²	29.5	27%	0.268	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-10.9	-169.5	0	0	0	0	0	117.1	D489	D489-G514 PolarHBondContact OD2-N 3.08Å
515	W	94	Very high	92.1	Very high	3 Å²	3	29.6 Å²	29.6	1%	0.011	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.4	-13.2	171.7	54.2	103.6	0	0	0	114.3	F383 M513 W517 Y705 L706 P709 I710 L713	F383-W515 HydrophobicContact CZ-CE3 4.15Å; M513-W515 HydrophobicContact CB-CD2 4.22Å; M513-W515 HydrophobicContact CB-CH2 4.22Å; M513-W515 HydrophobicContact CB-CZ2 3.91Å; M513-W515 HydrophobicContact CE-CZ2 3.68Å; M513-W515 HydrophobicContact CG-CH2 4.26Å; M513-W515 HydrophobicContact CG-CZ2 3.92Å; M513-W515 PolarHBondContact O-N 3.35Å; W515-W517 VanDerWaalsContact C-N 3.28Å; W515-W517 PolarHBondContact O-N 3.45Å; W515-Y705 PolarHBondContact O-OH 3.46Å; W515-L706 PolarHBondContact NE1-O 3.34Å; W515-P709 HydrophobicContact CB-CG 4.24Å; W515-P709 HydrophobicContact CD2-CB 3.68Å; W515-P709 HydrophobicContact CD2-CG 3.44Å; W515-P709 VanDerWaalsContact CD2-CG 3.44Å; W515-P709 HydrophobicContact CE3-CB 3.47Å; W515-P709 VanDerWaalsContact CE3-CB 3.47Å; W515-P709 HydrophobicContact CE3-CG 3.76Å; W515-P709 HydrophobicContact CG-CB 4.4Å; W515-P709 HydrophobicContact CG-CG 3.67Å; W515-P709 HydrophobicContact CH2-CB 3.82Å; W515-P709 HydrophobicContact CZ2-CB 3.96Å; W515-P709 HydrophobicContact CZ2-CG 4.21Å; W515-P709 HydrophobicContact CZ3-CB 3.56Å; W515-P709 HydrophobicContact CZ3-CG 4.3Å; W515-I710 HydrophobicContact CH2-CG1 3.94Å; W515-I710 HydrophobicContact CZ2-CD1 4.22Å; W515-I710 HydrophobicContact CZ2-CG1 3.67Å; W515-L713 HydrophobicContact CH2-CD1 4.46Å; W515-L713 HydrophobicContact CZ3-CD1 4.27Å
516	S	94.9	Very high	92.3	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-15.6	-172.2	67.3	0	0	0	0	114.6	Y461 N503 C512 M513 Y518 L519 S520	Y461-S516 WeakPolarHBondContact OH-CB 3.4Å; N503-S516 PolarHBondContact ND2-OG 3Å; C512-S516 PolarHBondContact O-OG 3.34Å; M513-S516 VanDerWaalsContact O-CB 3.24Å; M513-S516 WeakPolarHBondContact O-CB 3.33Å; M513-S516 PolarHBondContact O-N 2.99Å; M513-S516 PolarHBondContact O-OG 3.23Å; S516-Y518 PolarHBondContact O-N 3.25Å; S516-Y518 VanDerWaalsContact O-N 3.14Å; S516-L519 WeakPolarHBondContact O-CA 3.47Å; S516-L519 WeakPolarHBondContact O-CB 3.28Å; S516-L519 PolarHBondContact O-N 2.72Å; S516-S520 PolarHBondContact O-N 2.96Å
517	W	94.5	Very high	92.5	Very high	10 Å²	10	24 Å²	24	4%	0.038	12%	0.121	C	C	.	.	H	α-helix	trans	-55.2	-32.8	176.7	67	-93.6	0	0	0	113.2	V414 F418 W515 L519 S520 N521 F578 Y582 L583 R588	V414-W517 HydrophobicContact CB-CH2 4.32Å; V414-W517 HydrophobicContact CG1-CH2 4.44Å; V414-W517 HydrophobicContact CG1-CZ2 4.47Å; V414-W517 HydrophobicContact CG2-CH2 4.08Å; F418-W517 HydrophobicContact CE2-CZ3 4.35Å; F418-W517 HydrophobicContact CZ-CZ3 4.04Å; W515-W517 VanDerWaalsContact C-N 3.28Å; W515-W517 PolarHBondContact O-N 3.45Å; W517-L519 PolarHBondContact O-N 2.97Å; W517-S520 WeakPolarHBondContact O-CB 3.41Å; W517-S520 PolarHBondContact O-N 3.11Å; W517-N521 PolarHBondContact O-N 2.9Å; W517-F578 AromaticContact NE1-CZ 3.98Å; W517-Y582 AromaticContact CE2-CE1 3.78Å; W517-Y582 HydrophobicContact CH2-CD1 4.37Å; W517-Y582 AromaticContact CH2-CE1 3.72Å; W517-Y582 HydrophobicContact CH2-CE1 3.72Å; W517-Y582 HydrophobicContact CZ2-CD1 4.03Å; W517-Y582 AromaticContact CZ2-CE1 3.23Å; W517-Y582 HydrophobicContact CZ2-CE1 3.23Å; W517-Y582 AromaticContact CZ2-CZ 3.86Å; W517-L583 HydrophobicContact CB-CD2 3.27Å; W517-L583 HydrophobicContact CD2-CD2 4.33Å; W517-L583 HydrophobicContact CG-CD2 3.59Å; W517-L583 HydrophobicContact CG-CG 4.45Å; W517-R588 VanDerWaalsContact CZ3-NH1 3.25Å
518	Y	94.4	Very high	93	Very high	19 Å²	19	22.2 Å²	22.2	8%	0.075	12%	0.122	C	C	.	.	H	α-helix	trans	-59.1	-41.2	176.7	157.9	-100.1	0	0	0	110.1	V414 F417 F418 S516 S520 N521 E522 Y705	V414-Y518 HydrophobicContact CB-CD2 4.16Å; V414-Y518 HydrophobicContact CG1-CD2 4.21Å; F417-Y518 HydrophobicContact CB-CE2 3.86Å; F417-Y518 WeakPolarHBondContact CB-OH 3.36Å; F418-Y518 HydrophobicContact CD1-CD2 4.17Å; F418-Y518 AromaticContact CD1-CE2 3.72Å; F418-Y518 HydrophobicContact CD1-CE2 3.72Å; F418-Y518 AromaticContact CE1-CD2 3.39Å; F418-Y518 HydrophobicContact CE1-CD2 3.39Å; F418-Y518 AromaticContact CE1-CE2 3.39Å; F418-Y518 HydrophobicContact CE1-CE2 3.39Å; F418-Y518 HydrophobicContact CE1-CG 4.45Å; F418-Y518 HydrophobicContact CE2-CD2 4.2Å; F418-Y518 HydrophobicContact CG-CE2 4.42Å; F418-Y518 AromaticContact CZ-CD2 3.41Å; F418-Y518 HydrophobicContact CZ-CD2 3.41Å; F418-Y518 VanDerWaalsContact CZ-CD2 3.41Å; F418-Y518 AromaticContact CZ-CE2 3.84Å; F418-Y518 HydrophobicContact CZ-CE2 3.84Å; F418-Y518 HydrophobicContact CZ-CG 4.44Å; S516-Y518 PolarHBondContact O-N 3.25Å; S516-Y518 VanDerWaalsContact O-N 3.14Å; Y518-S520 VanDerWaalsContact C-N 3.34Å; Y518-N521 PolarHBondContact O-N 3.39Å; Y518-E522 WeakPolarHBondContact O-CB 3.38Å; Y518-E522 PolarHBondContact O-N 3.38Å; Y518-Y705 VanDerWaalsContact CB-OH 3.24Å; Y518-Y705 WeakPolarHBondContact CB-OH 3.34Å; Y518-Y705 HydrophobicContact CD1-CD1 4.14Å; Y518-Y705 AromaticContact CD1-CE1 3.52Å; Y518-Y705 HydrophobicContact CD1-CE1 3.52Å; Y518-Y705 HydrophobicContact CD1-CE2 4.39Å; Y518-Y705 AromaticContact CD1-CZ 3.66Å; Y518-Y705 HydrophobicContact CE1-CE1 4.32Å; Y518-Y705 HydrophobicContact CG-CE1 4.31Å
519	L	95.4	Very high	93.5	Very high	4 Å²	4	22.2 Å²	22.2	2%	0.021	12%	0.121	C	C	.	.	H	α-helix	trans	-69.5	-34.1	179	-61.1	177.6	0	0	0	112.1	Y461 Y501 S516 W517 E522 I523 Y702 Y705 L706	Y461-L519 HydrophobicContact CD2-CD1 3.59Å; Y461-L519 HydrophobicContact CE2-CD1 3.87Å; Y501-L519 HydrophobicContact CD1-CB 4.44Å; Y501-L519 HydrophobicContact CE1-CB 4.22Å; S516-L519 WeakPolarHBondContact O-CA 3.47Å; S516-L519 WeakPolarHBondContact O-CB 3.28Å; S516-L519 PolarHBondContact O-N 2.72Å; W517-L519 PolarHBondContact O-N 2.97Å; L519-E522 PolarHBondContact O-N 2.89Å; L519-I523 WeakPolarHBondContact O-CB 3.42Å; L519-I523 WeakPolarHBondContact O-CG1 3.24Å; L519-I523 PolarHBondContact O-N 3.49Å; L519-Y702 HydrophobicContact CD1-CE2 3.9Å; L519-Y702 HydrophobicContact CD2-CD2 4.13Å; L519-Y702 HydrophobicContact CD2-CE2 3.59Å; L519-Y702 HydrophobicContact CG-CE2 4.42Å; L519-Y705 HydrophobicContact CG-CE1 4.32Å; L519-L706 HydrophobicContact CD1-CD2 3.49Å; L519-L706 VanDerWaalsContact CD1-CD2 3.49Å
520	S	95.7	Very high	94.1	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-60.8	-50.9	172.3	-55.6	0	0	0	0	111.1	Y501 N503 S516 W517 Y518 E522 I523 Q524	Y501-S520 VanDerWaalsContact CA-OG 3.22Å; Y501-S520 WeakPolarHBondContact CA-OG 3.27Å; Y501-S520 WeakPolarHBondContact O-CB 3.34Å; N503-S520 WeakPolarHBondContact OD1-CB 3.36Å; N503-S520 PolarHBondContact OD1-OG 2.89Å; S516-S520 PolarHBondContact O-N 2.96Å; W517-S520 WeakPolarHBondContact O-CB 3.41Å; W517-S520 PolarHBondContact O-N 3.11Å; Y518-S520 VanDerWaalsContact C-N 3.34Å; S520-E522 VanDerWaalsContact C-N 3.35Å; S520-E522 PolarHBondContact O-N 3.42Å; S520-I523 PolarHBondContact O-N 3.42Å; S520-Q524 WeakPolarHBondContact O-CB 3.17Å; S520-Q524 VanDerWaalsContact O-CD 3.31Å; S520-Q524 WeakPolarHBondContact O-CG 3.35Å; S520-Q524 PolarHBondContact O-N 3.46Å
521	N	96.5	Very high	94.5	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-59.9	-46	175.1	-75.9	-9.9	0	0	0	111.5	F418 N504 W517 Y518 I523 Q524 F525 L583 P585	F418-N521 HydrophobicContact CE1-CB 3.77Å; F418-N521 HydrophobicContact CZ-CB 3.64Å; N504-N521 PolarHBondContact ND2-OD1 3.46Å; W517-N521 PolarHBondContact O-N 2.9Å; Y518-N521 PolarHBondContact O-N 3.39Å; N521-I523 PolarHBondContact O-N 3.02Å; N521-Q524 PolarHBondContact O-N 2.9Å; N521-F525 HydrophobicContact CB-CD2 4.5Å; N521-F525 HydrophobicContact CB-CE2 3.95Å; N521-F525 HydrophobicContact CB-CZ 4.04Å; N521-F525 WeakPolarHBondContact O-CB 3.22Å; N521-F525 VanDerWaalsContact O-CD2 3.31Å; N521-F525 WeakPolarHBondContact O-CD2 3.38Å; N521-F525 WeakPolarHBondContact O-CG 3.46Å; N521-F525 PolarHBondContact O-N 3.1Å; N521-L583 PolarHBondContact ND2-O 3.08Å; N521-L583 VanDerWaalsContact ND2-O 3.16Å; N521-L583 PolarHBondContact OD1-O 3.49Å; N521-P585 WeakPolarHBondContact OD1-CB 3.22Å
522	E	95.6	Very high	94.9	Very high	17 Å²	17	17.3 Å²	17.3	8%	0.079	10%	0.097	C	C	.	.	H	α-helix	trans	-61.2	-41.8	-178.5	177.9	55.5	-160.5	0	0	112.1	F418 S421 R453 Y518 L519 S520 S526	F418-E522 HydrophobicContact CD1-CB 4.41Å; F418-E522 WeakPolarHBondContact CD1-OE2 3.3Å; F418-E522 HydrophobicContact CE1-CB 4.04Å; S421-E522 WeakPolarHBondContact CB-OE1 3.41Å; S421-E522 WeakPolarHBondContact CB-OE2 3.25Å; S421-E522 PolarHBondContact OG-OE1 2.92Å; R453-E522 IonicContact CZ-OE1 2.88Å; R453-E522 IonicContact NH1-OE1 3.17Å; R453-E522 VanDerWaalsContact NH2-CG 3.3Å; R453-E522 PolarHBondContact NH2-O 3.01Å; R453-E522 IonicContact NH2-OE1 3.78Å; R453-E522 PolarHBondContact NH2-OE1 3.28Å; Y518-E522 WeakPolarHBondContact O-CB 3.38Å; Y518-E522 PolarHBondContact O-N 3.38Å; L519-E522 PolarHBondContact O-N 2.89Å; S520-E522 VanDerWaalsContact C-N 3.35Å; S520-E522 PolarHBondContact O-N 3.42Å; E522-S526 VanDerWaalsContact O-CB 3.27Å; E522-S526 WeakPolarHBondContact O-CB 3.25Å; E522-S526 PolarHBondContact O-N 3.27Å; E522-S526 PolarHBondContact O-OG 2.99Å; E522-S526 VanDerWaalsContact O-OG 3.12Å
523	I	95.3	Very high	95.1	Very high	12 Å²	12	17 Å²	17	6%	0.062	10%	0.095	C	C	.	.	H	α-helix	trans	-66	-47.9	172.9	-76.6	-62.1	0	0	0	111.1	R453 L457 Y501 L519 S520 N521 F525 S526 I527	R453-I523 HydrophobicContact CG-CD1 4.34Å; L457-I523 HydrophobicContact CD1-CD1 3.48Å; L457-I523 VanDerWaalsContact CD1-CD1 3.48Å; L457-I523 HydrophobicContact CD1-CG1 4.34Å; Y501-I523 HydrophobicContact CD1-CB 4.02Å; Y501-I523 HydrophobicContact CD1-CG1 3.52Å; Y501-I523 HydrophobicContact CD1-CG2 4.5Å; Y501-I523 HydrophobicContact CD2-CG1 4.36Å; Y501-I523 HydrophobicContact CD2-CG2 4.49Å; Y501-I523 HydrophobicContact CE1-CD1 4.47Å; Y501-I523 HydrophobicContact CE1-CG1 3.56Å; Y501-I523 HydrophobicContact CE2-CG1 4.39Å; Y501-I523 HydrophobicContact CG-CB 4.18Å; Y501-I523 HydrophobicContact CG-CG1 3.94Å; Y501-I523 HydrophobicContact CG-CG2 4.15Å; L519-I523 WeakPolarHBondContact O-CB 3.42Å; L519-I523 WeakPolarHBondContact O-CG1 3.24Å; L519-I523 PolarHBondContact O-N 3.49Å; S520-I523 PolarHBondContact O-N 3.42Å; N521-I523 PolarHBondContact O-N 3.02Å; I523-F525 PolarHBondContact O-N 3.14Å; I523-S526 WeakPolarHBondContact CA-OG 3.46Å; I523-S526 PolarHBondContact O-N 2.93Å; I523-S526 VanDerWaalsContact O-N 3.12Å; I523-S526 PolarHBondContact O-OG 3.03Å; I523-I527 HydrophobicContact CG2-CD1 3.61Å; I523-I527 HydrophobicContact CG2-CG1 4.26Å; I523-I527 WeakPolarHBondContact O-CB 3.49Å; I523-I527 WeakPolarHBondContact O-CG1 3.37Å; I523-I527 PolarHBondContact O-N 3.39Å
524	Q	95.4	Very high	95.3	Very high	29 Å²	29	17 Å²	17	14%	0.136	10%	0.095	C	C	.	.	H	α-helix	trans	-59.9	-47.6	-179	-70.1	163.8	15.5	0	0	111.8	Y501 N504 S520 N521 S526 I527 V528	Y501-Q524 PolarHBondContact O-NE2 3Å; N504-Q524 PolarHBondContact ND2-NE2 3.38Å; N504-Q524 PolarHBondContact ND2-OE1 3.11Å; N504-Q524 PolarHBondContact OD1-NE2 3.2Å; S520-Q524 WeakPolarHBondContact O-CB 3.17Å; S520-Q524 VanDerWaalsContact O-CD 3.31Å; S520-Q524 WeakPolarHBondContact O-CG 3.35Å; S520-Q524 PolarHBondContact O-N 3.46Å; N521-Q524 PolarHBondContact O-N 2.9Å; Q524-S526 PolarHBondContact O-N 2.88Å; Q524-I527 PolarHBondContact O-N 3.04Å; Q524-V528 VanDerWaalsContact O-CB 3.27Å; Q524-V528 WeakPolarHBondContact O-CB 3.49Å; Q524-V528 WeakPolarHBondContact O-CG2 3.22Å; Q524-V528 PolarHBondContact O-N 3.33Å
525	F	97.1	Very high	95.5	Very high	3 Å²	3	17.2 Å²	17.2	1%	0.013	9%	0.093	C	C	.	.	I	π-helix	trans	-59.3	-38.3	176.4	-61.4	-21.2	0	0	0	112	F418 N521 I523 L529 S530 P585 R588 W589 Y592	F418-F525 AromaticContact CD1-CD2 3.89Å; F418-F525 HydrophobicContact CD1-CD2 3.89Å; F418-F525 AromaticContact CD1-CE2 3.84Å; F418-F525 HydrophobicContact CD1-CE2 3.84Å; F418-F525 HydrophobicContact CD2-CE2 4.26Å; F418-F525 HydrophobicContact CE1-CD2 4.2Å; F418-F525 AromaticContact CE1-CE2 3.93Å; F418-F525 HydrophobicContact CE1-CE2 3.93Å; F418-F525 HydrophobicContact CE2-CE2 4.35Å; F418-F525 HydrophobicContact CG-CD2 4.33Å; F418-F525 HydrophobicContact CG-CE2 4.03Å; F418-F525 HydrophobicContact CZ-CE2 4.2Å; N521-F525 HydrophobicContact CB-CD2 4.5Å; N521-F525 HydrophobicContact CB-CE2 3.95Å; N521-F525 HydrophobicContact CB-CZ 4.04Å; N521-F525 WeakPolarHBondContact O-CB 3.22Å; N521-F525 VanDerWaalsContact O-CD2 3.31Å; N521-F525 WeakPolarHBondContact O-CD2 3.38Å; N521-F525 WeakPolarHBondContact O-CG 3.46Å; N521-F525 PolarHBondContact O-N 3.1Å; I523-F525 PolarHBondContact O-N 3.14Å; F525-L529 HydrophobicContact CB-CD1 4.29Å; F525-L529 HydrophobicContact CD1-CD1 3.53Å; F525-L529 HydrophobicContact CD1-CG 4.37Å; F525-L529 HydrophobicContact CE1-CD1 4.19Å; F525-L529 HydrophobicContact CG-CD1 4.16Å; F525-L529 CarbonylContact O-C 3.58Å; F525-L529 WeakPolarHBondContact O-CA 3.41Å; F525-L529 VanDerWaalsContact O-CB 3.31Å; F525-L529 WeakPolarHBondContact O-CB 3.46Å; F525-L529 PolarHBondContact O-N 2.97Å; F525-S530 PolarHBondContact O-N 2.97Å; F525-P585 HydrophobicContact CE1-CB 3.56Å; F525-P585 HydrophobicContact CZ-CB 4.01Å; F525-P585 WeakPolarHBondContact CZ-O 3.38Å; F525-R588 HydrophobicContact CZ-CB 4.47Å; F525-W589 HydrophobicContact CD1-CB 4.16Å; F525-W589 HydrophobicContact CE1-CB 3.61Å; F525-W589 HydrophobicContact CZ-CB 3.93Å; F525-Y592 HydrophobicContact CB-CD1 3.87Å; F525-Y592 HydrophobicContact CB-CD2 3.67Å; F525-Y592 HydrophobicContact CB-CE1 3.87Å; F525-Y592 HydrophobicContact CB-CE2 3.68Å; F525-Y592 HydrophobicContact CB-CG 3.77Å; F525-Y592 AromaticContact CD2-CD2 3.74Å; F525-Y592 HydrophobicContact CD2-CD2 3.74Å; F525-Y592 HydrophobicContact CD2-CE2 4.48Å; F525-Y592 AromaticContact CD2-CG 3.87Å; F525-Y592 HydrophobicContact CD2-CG 3.87Å; F525-Y592 HydrophobicContact CG-CD1 4.43Å; F525-Y592 HydrophobicContact CG-CD2 4.1Å; F525-Y592 HydrophobicContact CG-CG 4.03Å
526	S	95	Very high	95.6	Very high	0 Å²	0	19 Å²	19	0%	0	10%	0.102	C	C	.	.	I	π-helix	trans	-81.4	-29.9	-176.3	71.5	0	0	0	0	116.9	R453 E522 I523 Q524 P531	R453-S526 VanDerWaalsContact CD-OG 3.29Å; R453-S526 WeakPolarHBondContact CD-OG 3.27Å; R453-S526 VanDerWaalsContact NE-CB 3.27Å; R453-S526 PolarHBondContact NE-OG 3Å; R453-S526 VanDerWaalsContact NH2-CB 3.33Å; R453-S526 PolarHBondContact NH2-OG 3.29Å; E522-S526 VanDerWaalsContact O-CB 3.27Å; E522-S526 WeakPolarHBondContact O-CB 3.25Å; E522-S526 PolarHBondContact O-N 3.27Å; E522-S526 PolarHBondContact O-OG 2.99Å; E522-S526 VanDerWaalsContact O-OG 3.12Å; I523-S526 WeakPolarHBondContact CA-OG 3.46Å; I523-S526 PolarHBondContact O-N 2.93Å; I523-S526 VanDerWaalsContact O-N 3.12Å; I523-S526 PolarHBondContact O-OG 3.03Å; Q524-S526 PolarHBondContact O-N 2.88Å; S526-P531 WeakPolarHBondContact O-CD 3.28Å
527	I	94.5	Very high	95.7	Very high	49 Å²	49	19 Å²	19	25%	0.251	10%	0.102	S	C	.	.	I	π-helix	trans	-90.6	-25.5	-179	-65.4	-176.3	0	0	0	109.6	V450 I454 I523 Q524 P531	V450-I527 HydrophobicContact CG1-CD1 3.98Å; V450-I527 HydrophobicContact CG1-CG1 4.28Å; V450-I527 HydrophobicContact CG1-CG2 4.24Å; V450-I527 HydrophobicContact CG2-CG1 4.39Å; V450-I527 HydrophobicContact CG2-CG2 4.03Å; I454-I527 HydrophobicContact CD1-CD1 4.24Å; I454-I527 HydrophobicContact CG1-CD1 4.21Å; I523-I527 HydrophobicContact CG2-CD1 3.61Å; I523-I527 HydrophobicContact CG2-CG1 4.26Å; I523-I527 WeakPolarHBondContact O-CB 3.49Å; I523-I527 WeakPolarHBondContact O-CG1 3.37Å; I523-I527 PolarHBondContact O-N 3.39Å; Q524-I527 PolarHBondContact O-N 3.04Å; I527-P531 WeakPolarHBondContact O-CG 3.36Å
528	V	95	Very high	95.6	Very high	78 Å²	78	19.7 Å²	19.7	47%	0.473	11%	0.11	S	C	.	.	I	π-helix	trans	-108.5	-64.6	-177.5	-173.5	0	0	0	0	111.6	Q524 P531 I532	Q524-V528 VanDerWaalsContact O-CB 3.27Å; Q524-V528 WeakPolarHBondContact O-CB 3.49Å; Q524-V528 WeakPolarHBondContact O-CG2 3.22Å; Q524-V528 PolarHBondContact O-N 3.33Å; V528-P531 WeakPolarHBondContact O-CD 3.11Å; V528-I532 HydrophobicContact CG1-CD1 4.01Å; V528-I532 WeakPolarHBondContact O-CD1 3.5Å; V528-I532 VanDerWaalsContact O-CG1 3.26Å; V528-I532 WeakPolarHBondContact O-CG1 3.19Å; V528-I532 PolarHBondContact O-N 3.21Å
529	L	96.5	Very high	95.4	Very high	16 Å²	16	28.1 Å²	28.1	8%	0.084	14%	0.142	C	C	.	.	I	π-helix	trans	-69.1	-44.9	-171	-56.7	-179.3	0	0	0	112.8	F525 I532 F533 L551 W589	F525-L529 HydrophobicContact CB-CD1 4.29Å; F525-L529 HydrophobicContact CD1-CD1 3.53Å; F525-L529 HydrophobicContact CD1-CG 4.37Å; F525-L529 HydrophobicContact CE1-CD1 4.19Å; F525-L529 HydrophobicContact CG-CD1 4.16Å; F525-L529 CarbonylContact O-C 3.58Å; F525-L529 WeakPolarHBondContact O-CA 3.41Å; F525-L529 VanDerWaalsContact O-CB 3.31Å; F525-L529 WeakPolarHBondContact O-CB 3.46Å; F525-L529 PolarHBondContact O-N 2.97Å; L529-I532 PolarHBondContact O-N 3.28Å; L529-F533 WeakPolarHBondContact O-CB 3.31Å; L529-F533 PolarHBondContact O-N 2.94Å; L529-L551 HydrophobicContact CD1-CD1 4.48Å; L529-L551 HydrophobicContact CD2-CD1 4.37Å; L529-L551 HydrophobicContact CD2-CD2 4.08Å; L529-W589 HydrophobicContact CD1-CB 3.62Å; L529-W589 HydrophobicContact CD1-CD2 4.46Å; L529-W589 HydrophobicContact CD1-CE3 4.18Å; L529-W589 HydrophobicContact CD1-CG 4.29Å
530	S	96.2	Very high	95.4	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-58.1	-52	178.7	-99.9	0	0	0	0	112.4	S425 F525 I532 F533 L534 Y592 L596	S425-S530 WeakPolarHBondContact CB-OG 3.23Å; F525-S530 PolarHBondContact O-N 2.97Å; S530-I532 VanDerWaalsContact C-N 3.34Å; S530-I532 PolarHBondContact O-N 2.7Å; S530-F533 PolarHBondContact O-N 3Å; S530-L534 VanDerWaalsContact O-CB 3.25Å; S530-L534 WeakPolarHBondContact O-CB 3.5Å; S530-L534 WeakPolarHBondContact O-CD1 3.26Å; S530-L534 WeakPolarHBondContact O-CG 3.3Å; S530-L534 PolarHBondContact O-N 3.28Å; S530-Y592 PolarHBondContact OG-OH 3.34Å; S530-L596 WeakPolarHBondContact OG-CD2 3.43Å
531	P	95.2	Very high	95.3	Very high	17 Å²	17	32.7 Å²	32.7	11%	0.11	17%	0.166	C	C	.	.	H	α-helix	trans	-60.1	-40.2	178.6	-31	40.2	0	0	0	113.9	W446 S526 I527 V528 S535	W446-P531 HydrophobicContact CD2-CB 3.89Å; W446-P531 HydrophobicContact CD2-CG 4.38Å; W446-P531 HydrophobicContact CE3-CB 3.63Å; W446-P531 HydrophobicContact CE3-CG 3.65Å; W446-P531 VanDerWaalsContact CH2-CA 3.48Å; W446-P531 HydrophobicContact CH2-CB 4.01Å; W446-P531 HydrophobicContact CH2-CG 4.32Å; W446-P531 HydrophobicContact CZ2-CB 4.16Å; W446-P531 HydrophobicContact CZ3-CB 3.72Å; W446-P531 HydrophobicContact CZ3-CG 3.63Å; S526-P531 WeakPolarHBondContact O-CD 3.28Å; I527-P531 WeakPolarHBondContact O-CG 3.36Å; V528-P531 WeakPolarHBondContact O-CD 3.11Å; P531-S535 WeakPolarHBondContact O-CB 3.45Å; P531-S535 PolarHBondContact O-N 2.98Å; P531-S535 PolarHBondContact O-OG 3.34Å
532	I	96.1	Very high	95.4	Very high	74 Å²	74	37 Å²	37	38%	0.379	19%	0.193	S	C	.	.	H	α-helix	trans	-63.6	-55.2	176.5	-64.2	167.4	0	0	0	109.9	V528 L529 S530 L534 S535 L536 F547	V528-I532 HydrophobicContact CG1-CD1 4.01Å; V528-I532 WeakPolarHBondContact O-CD1 3.5Å; V528-I532 VanDerWaalsContact O-CG1 3.26Å; V528-I532 WeakPolarHBondContact O-CG1 3.19Å; V528-I532 PolarHBondContact O-N 3.21Å; L529-I532 PolarHBondContact O-N 3.28Å; S530-I532 VanDerWaalsContact C-N 3.34Å; S530-I532 PolarHBondContact O-N 2.7Å; I532-L534 PolarHBondContact O-N 2.82Å; I532-S535 PolarHBondContact O-N 3.14Å; I532-L536 HydrophobicContact CG2-CD1 3.97Å; I532-L536 HydrophobicContact CG2-CG 4.46Å; I532-L536 VanDerWaalsContact O-CG 3.28Å; I532-L536 WeakPolarHBondContact O-CG 3.24Å; I532-L536 PolarHBondContact O-N 2.98Å; I532-F547 HydrophobicContact CB-CE1 4.2Å; I532-F547 HydrophobicContact CB-CZ 4.24Å; I532-F547 HydrophobicContact CG2-CD1 4.3Å; I532-F547 HydrophobicContact CG2-CE1 3.67Å; I532-F547 HydrophobicContact CG2-CE2 4.1Å; I532-F547 HydrophobicContact CG2-CZ 3.56Å
533	F	97.7	Very high	95.4	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-57.6	-47.5	-179.1	176.8	-90.4	0	0	0	111.9	T426 L529 S530 S535 L536 I537 G544 F547 L596 L597 W600	T426-F533 HydrophobicContact CG2-CE1 3.99Å; L529-F533 WeakPolarHBondContact O-CB 3.31Å; L529-F533 PolarHBondContact O-N 2.94Å; S530-F533 PolarHBondContact O-N 3Å; F533-S535 PolarHBondContact O-N 3.23Å; F533-L536 PolarHBondContact O-N 3.47Å; F533-I537 HydrophobicContact CD1-CG1 4.07Å; F533-I537 HydrophobicContact CE1-CD1 4.4Å; F533-I537 HydrophobicContact CE1-CG1 3.6Å; F533-I537 HydrophobicContact CE2-CD1 4.41Å; F533-I537 HydrophobicContact CE2-CG1 4.18Å; F533-I537 HydrophobicContact CZ-CD1 3.99Å; F533-I537 HydrophobicContact CZ-CG1 3.66Å; F533-I537 WeakPolarHBondContact O-CG1 3.07Å; F533-I537 PolarHBondContact O-N 3.47Å; F533-G544 WeakPolarHBondContact CD2-O 3.42Å; F533-G544 WeakPolarHBondContact CE2-O 3.23Å; F533-F547 HydrophobicContact CB-CD1 4.03Å; F533-F547 HydrophobicContact CB-CE1 4.04Å; F533-F547 HydrophobicContact CD2-CD1 4.06Å; F533-L596 HydrophobicContact CB-CD1 3.9Å; F533-L596 HydrophobicContact CD1-CB 3.88Å; F533-L596 HydrophobicContact CD1-CD1 4.23Å; F533-L596 HydrophobicContact CD1-CD2 4.16Å; F533-L596 HydrophobicContact CD1-CG 4.33Å; F533-L596 HydrophobicContact CD2-CB 4.33Å; F533-L596 HydrophobicContact CD2-CD1 4.28Å; F533-L596 HydrophobicContact CE1-CB 3.81Å; F533-L596 HydrophobicContact CE2-CB 4.27Å; F533-L596 HydrophobicContact CG-CB 4.16Å; F533-L596 HydrophobicContact CG-CD1 3.88Å; F533-L596 HydrophobicContact CG-CG 4.45Å; F533-L596 HydrophobicContact CZ-CB 4.02Å; F533-L597 HydrophobicContact CE2-CD2 4.04Å; F533-L597 HydrophobicContact CZ-CD2 4.28Å; F533-W600 HydrophobicContact CE1-CB 4.47Å; F533-W600 HydrophobicContact CZ-CB 4.38Å
534	L	96.3	Very high	95.5	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-67.7	-37.7	-177.6	-68.4	170.1	0	0	0	112.3	T426 T429 I430 L433 W446 S530 I532 I537 A538	T426-L534 HydrophobicContact CG2-CD2 3.76Å; T429-L534 HydrophobicContact CG2-CD1 4.04Å; I430-L534 HydrophobicContact CD1-CD2 4.32Å; I430-L534 HydrophobicContact CG1-CD2 3.68Å; L433-L534 HydrophobicContact CD2-CB 4.13Å; L433-L534 WeakPolarHBondContact CD2-O 3.36Å; W446-L534 HydrophobicContact CH2-CB 3.67Å; W446-L534 HydrophobicContact CH2-CD1 3.72Å; W446-L534 HydrophobicContact CH2-CG 4.3Å; W446-L534 HydrophobicContact CZ2-CB 3.93Å; W446-L534 HydrophobicContact CZ3-CD1 4.38Å; S530-L534 VanDerWaalsContact O-CB 3.25Å; S530-L534 WeakPolarHBondContact O-CB 3.5Å; S530-L534 WeakPolarHBondContact O-CD1 3.26Å; S530-L534 WeakPolarHBondContact O-CG 3.3Å; S530-L534 PolarHBondContact O-N 3.28Å; I532-L534 PolarHBondContact O-N 2.82Å; L534-I537 PolarHBondContact O-N 3.44Å; L534-A538 VanDerWaalsContact O-CB 3.28Å; L534-A538 WeakPolarHBondContact O-CB 3.02Å; L534-A538 PolarHBondContact O-N 2.99Å
535	S	94.6	Very high	95.7	Very high	31 Å²	31	38.5 Å²	38.5	22%	0.217	20%	0.203	C	C	.	.	H	α-helix	trans	-64.5	-43.1	174.6	-62.3	0	0	0	0	111.4	W446 P531 I532 F533 A538 W539	W446-S535 WeakPolarHBondContact CZ2-OG 3.46Å; W446-S535 PolarHBondContact NE1-OG 3.05Å; W446-S535 VanDerWaalsContact NE1-OG 3.16Å; P531-S535 WeakPolarHBondContact O-CB 3.45Å; P531-S535 PolarHBondContact O-N 2.98Å; P531-S535 PolarHBondContact O-OG 3.34Å; I532-S535 PolarHBondContact O-N 3.14Å; F533-S535 PolarHBondContact O-N 3.23Å; S535-A538 PolarHBondContact O-N 3.31Å; S535-W539 WeakPolarHBondContact O-CB 3.45Å; S535-W539 PolarHBondContact O-N 2.9Å
536	L	96.2	Very high	95.7	Very high	39 Å²	39	43.7 Å²	43.7	20%	0.204	23%	0.23	C	C	.	.	H	α-helix	trans	-63.6	-45.9	176.2	-68.8	175.3	0	0	0	111.7	I532 F533 W539 N540 I543 F547	I532-L536 HydrophobicContact CG2-CD1 3.97Å; I532-L536 HydrophobicContact CG2-CG 4.46Å; I532-L536 VanDerWaalsContact O-CG 3.28Å; I532-L536 WeakPolarHBondContact O-CG 3.24Å; I532-L536 PolarHBondContact O-N 2.98Å; F533-L536 PolarHBondContact O-N 3.47Å; L536-W539 HydrophobicContact CD2-CE3 4.48Å; L536-W539 PolarHBondContact O-N 2.82Å; L536-N540 CarbonylContact O-C 3.35Å; L536-N540 PolarHBondContact O-N 2.86Å; L536-I543 HydrophobicContact CD2-CG2 3.97Å; L536-F547 HydrophobicContact CD1-CB 3.7Å; L536-F547 HydrophobicContact CD1-CD1 3.91Å; L536-F547 HydrophobicContact CD1-CD2 4.19Å; L536-F547 HydrophobicContact CD1-CG 3.66Å
537	I	95.8	Very high	95.9	Very high	1 Å²	1	46.7 Å²	46.7	1%	0.005	24%	0.243	C	C	.	.	H	α-helix	trans	-62.4	-43.3	176.8	-72.6	-66.3	0	0	0	112	I430 F533 L534 W539 D541 V545 W600	I430-I537 HydrophobicContact CD1-CG2 3.68Å; I430-I537 HydrophobicContact CG1-CG2 4.24Å; F533-I537 HydrophobicContact CD1-CG1 4.07Å; F533-I537 HydrophobicContact CE1-CD1 4.4Å; F533-I537 HydrophobicContact CE1-CG1 3.6Å; F533-I537 HydrophobicContact CE2-CD1 4.41Å; F533-I537 HydrophobicContact CE2-CG1 4.18Å; F533-I537 HydrophobicContact CZ-CD1 3.99Å; F533-I537 HydrophobicContact CZ-CG1 3.66Å; F533-I537 WeakPolarHBondContact O-CG1 3.07Å; F533-I537 PolarHBondContact O-N 3.47Å; L534-I537 PolarHBondContact O-N 3.44Å; I537-W539 PolarHBondContact O-N 3.42Å; I537-D541 WeakPolarHBondContact CD1-O 3.4Å; I537-V545 HydrophobicContact CD1-CG2 3.98Å; I537-W600 HydrophobicContact CD1-CD2 4.47Å; I537-W600 HydrophobicContact CD1-CG 4.12Å
538	A	92.4	Very high	96.1	Very high	25 Å²	25	44.4 Å²	44.4	21%	0.207	23%	0.231	C	C	.	.	H	α-helix	trans	-67.5	-25.1	179.5	0	0	0	0	0	112.5	L433 R434 W442 L534 S535	L433-A538 HydrophobicContact CD2-CB 3.64Å; L433-A538 HydrophobicContact CG-CB 3.85Å; R434-A538 HydrophobicContact CG-CB 4.36Å; W442-A538 HydrophobicContact CH2-CB 3.53Å; W442-A538 HydrophobicContact CZ2-CB 3.89Å; L534-A538 VanDerWaalsContact O-CB 3.28Å; L534-A538 WeakPolarHBondContact O-CB 3.02Å; L534-A538 PolarHBondContact O-N 2.99Å; S535-A538 PolarHBondContact O-N 3.31Å
539	W	91.4	Very high	96.2	Very high	195 Å²	195	44.3 Å²	44.3	74%	0.739	23%	0.227	S	C	*	.	H	α-helix	trans	-82.7	-51.9	171.7	179.7	43.2	0	0	0	112.8	S535 L536 I537 I543	S535-W539 WeakPolarHBondContact O-CB 3.45Å; S535-W539 PolarHBondContact O-N 2.9Å; L536-W539 HydrophobicContact CD2-CE3 4.48Å; L536-W539 PolarHBondContact O-N 2.82Å; I537-W539 PolarHBondContact O-N 3.42Å; W539-I543 HydrophobicContact CE3-CD1 4.18Å; W539-I543 HydrophobicContact CH2-CD1 4.18Å; W539-I543 HydrophobicContact CZ3-CD1 3.7Å
540	N	94.5	Very high	96.3	Very high	67 Å²	67	45.1 Å²	45.1	36%	0.358	24%	0.24	S	C	.	.			trans	-152.6	114.4	178.5	-175.9	-20.3	0	0	0	110.9	L536 T542 I543 G544	L536-N540 CarbonylContact O-C 3.35Å; L536-N540 PolarHBondContact O-N 2.86Å; N540-T542 VanDerWaalsContact C-N 3.27Å; N540-T542 PolarHBondContact O-N 3.34Å; N540-T542 PolarHBondContact OD1-N 3.21Å; N540-I543 HydrophobicContact CB-CB 4.33Å; N540-I543 HydrophobicContact CB-CD1 3.99Å; N540-I543 HydrophobicContact CB-CG1 4.11Å; N540-I543 PolarHBondContact O-N 3.41Å; N540-G544 PolarHBondContact O-N 3.22Å; N540-G544 VanDerWaalsContact O-N 3.13Å
541	D	95.1	Very high	96.4	Very high	33 Å²	33	45.7 Å²	45.7	18%	0.176	24%	0.243	C	C	.	.	H	α-helix	trans	-49.2	-44.3	178.2	-80.8	4.5	0	0	0	112.8	R434 I537 I543 G544 V545 W600 K604	R434-D541 IonicContact NH2-OD1 2.68Å; R434-D541 PolarHBondContact NH2-OD1 2.72Å; R434-D541 IonicContact NH2-OD2 2.92Å; I537-D541 WeakPolarHBondContact CD1-O 3.4Å; D541-I543 PolarHBondContact O-N 2.91Å; D541-G544 PolarHBondContact O-N 3.45Å; D541-V545 WeakPolarHBondContact O-CB 3.39Å; D541-V545 VanDerWaalsContact O-CG2 3.22Å; D541-V545 WeakPolarHBondContact O-CG2 3.43Å; D541-V545 PolarHBondContact O-N 2.91Å; D541-W600 HydrophobicContact CB-CZ2 4.29Å; D541-K604 IonicContact OD2-NZ 3.87Å; D541-K604 PolarHBondContact OD2-NZ 3.37Å
542	T	96.8	Very high	96.6	Very high	91 Å²	91	46 Å²	46	56%	0.558	25%	0.245	S	C	*	.	H	α-helix	trans	-64.6	-44.6	-176.1	-54.5	0	0	0	0	111.6	N540 V545 L546	N540-T542 VanDerWaalsContact C-N 3.27Å; N540-T542 PolarHBondContact O-N 3.34Å; N540-T542 PolarHBondContact OD1-N 3.21Å; T542-V545 PolarHBondContact O-N 3.27Å; T542-L546 HydrophobicContact CG2-CD1 4.17Å; T542-L546 WeakPolarHBondContact O-CB 3.13Å; T542-L546 VanDerWaalsContact O-CG 3.29Å; T542-L546 WeakPolarHBondContact O-CG 3.24Å; T542-L546 PolarHBondContact O-N 3.32Å
543	I	97.4	Very high	96.7	Very high	63 Å²	63	47.8 Å²	47.8	32%	0.323	25%	0.254	S	S	.	.	H	α-helix	trans	-66.3	-43.8	-178.9	-61.1	177.7	0	0	0	110	L536 W539 N540 D541 V545 L546 F547	L536-I543 HydrophobicContact CD2-CG2 3.97Å; W539-I543 HydrophobicContact CE3-CD1 4.18Å; W539-I543 HydrophobicContact CH2-CD1 4.18Å; W539-I543 HydrophobicContact CZ3-CD1 3.7Å; N540-I543 HydrophobicContact CB-CB 4.33Å; N540-I543 HydrophobicContact CB-CD1 3.99Å; N540-I543 HydrophobicContact CB-CG1 4.11Å; N540-I543 PolarHBondContact O-N 3.41Å; D541-I543 PolarHBondContact O-N 2.91Å; I543-V545 PolarHBondContact O-N 3.31Å; I543-L546 PolarHBondContact O-N 3.32Å; I543-F547 WeakPolarHBondContact O-CB 3.4Å; I543-F547 PolarHBondContact O-N 3.49Å
544	G	97.3	Very high	96.7	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-63.3	-40.4	176.9	0	0	0	0	0	112.9	F533 N540 D541 F547 G548	F533-G544 WeakPolarHBondContact CD2-O 3.42Å; F533-G544 WeakPolarHBondContact CE2-O 3.23Å; N540-G544 PolarHBondContact O-N 3.22Å; N540-G544 VanDerWaalsContact O-N 3.13Å; D541-G544 PolarHBondContact O-N 3.45Å; G544-F547 PolarHBondContact O-N 3.05Å; G544-G548 PolarHBondContact O-N 3.44Å
545	V	98.1	Very high	96.8	Very high	27 Å²	27	50.1 Å²	50.1	16%	0.164	27%	0.27	C	S	.	.	H	α-helix	trans	-64.8	-45.5	175.4	170.9	0	0	0	0	111.3	I537 D541 T542 I543 F547 G548 I549 L597 W600	I537-V545 HydrophobicContact CD1-CG2 3.98Å; D541-V545 WeakPolarHBondContact O-CB 3.39Å; D541-V545 VanDerWaalsContact O-CG2 3.22Å; D541-V545 WeakPolarHBondContact O-CG2 3.43Å; D541-V545 PolarHBondContact O-N 2.91Å; T542-V545 PolarHBondContact O-N 3.27Å; I543-V545 PolarHBondContact O-N 3.31Å; V545-F547 VanDerWaalsContact C-N 3.28Å; V545-F547 PolarHBondContact O-N 2.8Å; V545-G548 PolarHBondContact O-N 2.84Å; V545-G548 VanDerWaalsContact O-N 3.16Å; V545-I549 HydrophobicContact CG1-CD1 3.79Å; V545-I549 HydrophobicContact CG1-CG1 4.37Å; V545-I549 WeakPolarHBondContact O-CG1 3.24Å; V545-I549 PolarHBondContact O-N 3.04Å; V545-L597 HydrophobicContact CG1-CD2 4.29Å; V545-W600 HydrophobicContact CG2-CD2 3.91Å; V545-W600 HydrophobicContact CG2-CE3 3.74Å; V545-W600 HydrophobicContact CG2-CH2 3.5Å; V545-W600 HydrophobicContact CG2-CZ2 3.66Å; V545-W600 HydrophobicContact CG2-CZ3 3.55Å
546	L	98.3	Very high	97	Very high	112 Å²	112	50 Å²	50	59%	0.586	27%	0.267	S	S	*	.	H	α-helix	trans	-59.6	-40.6	175.8	-73.1	174.2	0	0	0	111.6	T542 I543 I549 G550	T542-L546 HydrophobicContact CG2-CD1 4.17Å; T542-L546 WeakPolarHBondContact O-CB 3.13Å; T542-L546 VanDerWaalsContact O-CG 3.29Å; T542-L546 WeakPolarHBondContact O-CG 3.24Å; T542-L546 PolarHBondContact O-N 3.32Å; I543-L546 PolarHBondContact O-N 3.32Å; L546-I549 PolarHBondContact O-N 3.12Å; L546-G550 PolarHBondContact O-N 2.86Å
547	F	98.3	Very high	97	Very high	63 Å²	63	50.2 Å²	50.2	28%	0.276	28%	0.278	S	S	.	.	H	α-helix	trans	-61.8	-46.7	173.6	176.6	-106.8	0	0	0	111.8	I532 F533 L536 I543 G544 V545 I549 G550 L551	I532-F547 HydrophobicContact CB-CE1 4.2Å; I532-F547 HydrophobicContact CB-CZ 4.24Å; I532-F547 HydrophobicContact CG2-CD1 4.3Å; I532-F547 HydrophobicContact CG2-CE1 3.67Å; I532-F547 HydrophobicContact CG2-CE2 4.1Å; I532-F547 HydrophobicContact CG2-CZ 3.56Å; F533-F547 HydrophobicContact CB-CD1 4.03Å; F533-F547 HydrophobicContact CB-CE1 4.04Å; F533-F547 HydrophobicContact CD2-CD1 4.06Å; L536-F547 HydrophobicContact CD1-CB 3.7Å; L536-F547 HydrophobicContact CD1-CD1 3.91Å; L536-F547 HydrophobicContact CD1-CD2 4.19Å; L536-F547 HydrophobicContact CD1-CG 3.66Å; I543-F547 WeakPolarHBondContact O-CB 3.4Å; I543-F547 PolarHBondContact O-N 3.49Å; G544-F547 PolarHBondContact O-N 3.05Å; V545-F547 VanDerWaalsContact C-N 3.28Å; V545-F547 PolarHBondContact O-N 2.8Å; F547-I549 PolarHBondContact O-N 3.36Å; F547-G550 PolarHBondContact O-N 3.31Å; F547-L551 HydrophobicContact CD1-CD1 4.2Å; F547-L551 HydrophobicContact CE1-CD1 3.63Å; F547-L551 HydrophobicContact CE1-CG 4.16Å; F547-L551 HydrophobicContact CE2-CD2 4.34Å; F547-L551 HydrophobicContact CE2-CG 4.41Å; F547-L551 HydrophobicContact CZ-CD1 3.91Å; F547-L551 HydrophobicContact CZ-CD2 4.05Å; F547-L551 HydrophobicContact CZ-CG 4.07Å; F547-L551 WeakPolarHBondContact O-CG 3.24Å; F547-L551 PolarHBondContact O-N 3.22Å
548	G	98.1	Very high	97.1	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-60.9	-42.3	176.7	0	0	0	0	0	113.4	G544 V545 L551 V552	G544-G548 PolarHBondContact O-N 3.44Å; V545-G548 PolarHBondContact O-N 2.84Å; V545-G548 VanDerWaalsContact O-N 3.16Å; G548-L551 PolarHBondContact O-N 3.19Å; G548-V552 PolarHBondContact O-N 3.41Å
549	I	98.3	Very high	97.3	Very high	76 Å²	76	50.8 Å²	50.8	39%	0.39	28%	0.281	S	S	.	.	H	α-helix	trans	-64.8	-41.6	174	-67	171.1	0	0	0	110.4	V545 L546 F547 L551 V552 I553 L597	V545-I549 HydrophobicContact CG1-CD1 3.79Å; V545-I549 HydrophobicContact CG1-CG1 4.37Å; V545-I549 WeakPolarHBondContact O-CG1 3.24Å; V545-I549 PolarHBondContact O-N 3.04Å; L546-I549 PolarHBondContact O-N 3.12Å; F547-I549 PolarHBondContact O-N 3.36Å; I549-L551 VanDerWaalsContact C-N 3.32Å; I549-L551 PolarHBondContact O-N 3.33Å; I549-V552 WeakPolarHBondContact O-CB 3.16Å; I549-V552 PolarHBondContact O-N 3.29Å; I549-V552 VanDerWaalsContact O-N 3.11Å; I549-I553 HydrophobicContact CG2-CD1 3.76Å; I549-I553 HydrophobicContact CG2-CG1 4.35Å; I549-I553 WeakPolarHBondContact O-CG1 3.28Å; I549-I553 PolarHBondContact O-N 2.93Å; I549-L597 HydrophobicContact CG1-CD1 4.29Å
550	G	98.3	Very high	97.6	Very high	34 Å²	34	44.2 Å²	44.2	35%	0.351	26%	0.257	S	S	.	.	H	α-helix	trans	-59.6	-38	174.8	0	0	0	0	0	113.2	L546 F547 I553 S554	L546-G550 PolarHBondContact O-N 2.86Å; F547-G550 PolarHBondContact O-N 3.31Å; G550-I553 PolarHBondContact O-N 2.6Å; G550-S554 VanDerWaalsContact O-CB 3.27Å; G550-S554 WeakPolarHBondContact O-CB 3.36Å; G550-S554 PolarHBondContact O-N 3.31Å; G550-S554 PolarHBondContact O-OG 3.36Å
551	L	98.3	Very high	97.8	Very high	12 Å²	12	42.7 Å²	42.7	6%	0.063	26%	0.258	C	S	.	.	H	α-helix	trans	-62.8	-42	172.4	-70.7	177.4	0	0	0	111.8	L529 F547 G548 I549 S554 S555 W589 A593	L529-L551 HydrophobicContact CD1-CD1 4.48Å; L529-L551 HydrophobicContact CD2-CD1 4.37Å; L529-L551 HydrophobicContact CD2-CD2 4.08Å; F547-L551 HydrophobicContact CD1-CD1 4.2Å; F547-L551 HydrophobicContact CE1-CD1 3.63Å; F547-L551 HydrophobicContact CE1-CG 4.16Å; F547-L551 HydrophobicContact CE2-CD2 4.34Å; F547-L551 HydrophobicContact CE2-CG 4.41Å; F547-L551 HydrophobicContact CZ-CD1 3.91Å; F547-L551 HydrophobicContact CZ-CD2 4.05Å; F547-L551 HydrophobicContact CZ-CG 4.07Å; F547-L551 WeakPolarHBondContact O-CG 3.24Å; F547-L551 PolarHBondContact O-N 3.22Å; G548-L551 PolarHBondContact O-N 3.19Å; I549-L551 VanDerWaalsContact C-N 3.32Å; I549-L551 PolarHBondContact O-N 3.33Å; L551-S554 WeakPolarHBondContact CA-OG 3.42Å; L551-S554 PolarHBondContact O-OG 3.34Å; L551-S555 WeakPolarHBondContact O-CB 3.3Å; L551-S555 PolarHBondContact O-N 3.16Å; L551-S555 VanDerWaalsContact O-N 3.07Å; L551-W589 HydrophobicContact CD2-CD2 4.46Å; L551-W589 PolarHBondContact O-NE1 3.09Å; L551-A593 HydrophobicContact CB-CB 3.78Å; L551-A593 HydrophobicContact CD1-CB 4.23Å
552	V	98.5	Very high	97.8	Very high	23 Å²	23	43 Å²	43	14%	0.139	26%	0.259	C	S	.	.	H	α-helix	trans	-63	-49.7	176.4	176.8	0	0	0	0	110.8	G548 I549 S555 I556 A593 I594 L597	G548-V552 PolarHBondContact O-N 3.41Å; I549-V552 WeakPolarHBondContact O-CB 3.16Å; I549-V552 PolarHBondContact O-N 3.29Å; I549-V552 VanDerWaalsContact O-N 3.11Å; V552-S555 WeakPolarHBondContact O-CB 3.15Å; V552-S555 PolarHBondContact O-N 3.29Å; V552-I556 HydrophobicContact CG1-CD1 3.85Å; V552-I556 WeakPolarHBondContact O-CG1 3.25Å; V552-I556 PolarHBondContact O-N 3.43Å; V552-I556 VanDerWaalsContact O-N 3.09Å; V552-A593 HydrophobicContact CG2-CB 3.87Å; V552-I594 HydrophobicContact CG2-CG1 4.08Å; V552-L597 HydrophobicContact CG2-CD1 4.43Å
553	I	98.4	Very high	97.6	Very high	112 Å²	112	38.7 Å²	38.7	57%	0.574	23%	0.232	S	C	*	.	H	α-helix	trans	-62.8	-46.1	-179	-65.8	170.6	0	0	0	111.3	I549 G550 S555 I556 G557	I549-I553 HydrophobicContact CG2-CD1 3.76Å; I549-I553 HydrophobicContact CG2-CG1 4.35Å; I549-I553 WeakPolarHBondContact O-CG1 3.28Å; I549-I553 PolarHBondContact O-N 2.93Å; G550-I553 PolarHBondContact O-N 2.6Å; I553-S555 VanDerWaalsContact C-N 3.29Å; I553-S555 PolarHBondContact O-N 2.93Å; I553-I556 PolarHBondContact O-N 3.44Å; I553-G557 PolarHBondContact O-N 3.34Å
554	S	98.2	Very high	97.5	Very high	48 Å²	48	41.5 Å²	41.5	34%	0.336	24%	0.24	S	C	.	.	H	α-helix	trans	-62.3	-36.9	178.7	57.5	0	0	0	0	112.3	G550 L551 S558 W589	G550-S554 VanDerWaalsContact O-CB 3.27Å; G550-S554 WeakPolarHBondContact O-CB 3.36Å; G550-S554 PolarHBondContact O-N 3.31Å; G550-S554 PolarHBondContact O-OG 3.36Å; L551-S554 WeakPolarHBondContact CA-OG 3.42Å; L551-S554 PolarHBondContact O-OG 3.34Å; S554-S558 WeakPolarHBondContact O-CB 3.28Å; S554-S558 PolarHBondContact O-N 2.94Å; S554-S558 PolarHBondContact O-OG 3.26Å; S554-W589 PolarHBondContact OG-NE1 3.44Å
555	S	98.1	Very high	97.4	Very high	0 Å²	0	45 Å²	45	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-63.2	-51.1	175.4	-152.6	0	0	0	0	111.4	L551 V552 I553 G557 S558 T559 Y586 T587 R588 S590	L551-S555 WeakPolarHBondContact O-CB 3.3Å; L551-S555 PolarHBondContact O-N 3.16Å; L551-S555 VanDerWaalsContact O-N 3.07Å; V552-S555 WeakPolarHBondContact O-CB 3.15Å; V552-S555 PolarHBondContact O-N 3.29Å; I553-S555 VanDerWaalsContact C-N 3.29Å; I553-S555 PolarHBondContact O-N 2.93Å; S555-G557 VanDerWaalsContact C-N 3.32Å; S555-G557 PolarHBondContact O-N 2.85Å; S555-S558 PolarHBondContact O-N 2.7Å; S555-S558 PolarHBondContact O-OG 2.96Å; S555-T559 WeakPolarHBondContact O-CB 3.16Å; S555-T559 PolarHBondContact O-N 3.12Å; S555-T559 PolarHBondContact O-OG1 3.47Å; S555-Y586 VanDerWaalsContact CA-O 3.26Å; S555-Y586 WeakPolarHBondContact CA-O 3.46Å; S555-Y586 WeakPolarHBondContact CB-O 3.32Å; S555-Y586 PolarHBondContact OG-O 3.02Å; S555-T587 PolarHBondContact OG-O 2.88Å; S555-R588 PolarHBondContact OG-N 3.46Å; S555-S590 VanDerWaalsContact CB-CB 3.43Å; S555-S590 WeakPolarHBondContact CB-OG 3.35Å; S555-S590 PolarHBondContact OG-N 2.96Å; S555-S590 PolarHBondContact OG-OG 2.86Å; S555-S590 VanDerWaalsContact OG-OG 3.13Å
556	I	98.4	Very high	97.1	Very high	29 Å²	29	47.5 Å²	47.5	15%	0.149	28%	0.282	C	S	.	.	H	α-helix	trans	-58.3	-46.7	178.9	-67.5	168.6	0	0	0	110	V552 I553 T559 F560 A660 F661 P664	V552-I556 HydrophobicContact CG1-CD1 3.85Å; V552-I556 WeakPolarHBondContact O-CG1 3.25Å; V552-I556 PolarHBondContact O-N 3.43Å; V552-I556 VanDerWaalsContact O-N 3.09Å; I553-I556 PolarHBondContact O-N 3.44Å; I556-T559 PolarHBondContact O-N 3.43Å; I556-F560 VanDerWaalsContact O-CB 3.28Å; I556-F560 WeakPolarHBondContact O-CB 3.29Å; I556-F560 PolarHBondContact O-N 2.98Å; I556-A660 HydrophobicContact CG2-CB 4.1Å; I556-F661 HydrophobicContact CD1-CD1 4.3Å; I556-F661 HydrophobicContact CD1-CE1 4.05Å; I556-F661 HydrophobicContact CG2-CD1 4.48Å; I556-F661 HydrophobicContact CG2-CD2 4.32Å; I556-F661 HydrophobicContact CG2-CE1 4.04Å; I556-F661 HydrophobicContact CG2-CE2 3.86Å; I556-F661 HydrophobicContact CG2-CZ 3.71Å; I556-P664 HydrophobicContact CD1-CG 4.3Å; I556-P664 HydrophobicContact CG1-CG 4.03Å
557	G	98	Very high	96.6	Very high	44 Å²	44	47 Å²	47	45%	0.454	28%	0.279	S	S	.	.	H	α-helix	trans	-62.1	-44.5	178	0	0	0	0	0	113.1	I553 S555 F560 G561	I553-G557 PolarHBondContact O-N 3.34Å; S555-G557 VanDerWaalsContact C-N 3.32Å; S555-G557 PolarHBondContact O-N 2.85Å; G557-F560 PolarHBondContact O-N 3.3Å; G557-G561 PolarHBondContact O-N 3.03Å
558	S	97.6	Very high	96.2	Very high	31 Å²	31	45.4 Å²	45.4	22%	0.217	27%	0.272	C	S	.	.	H	α-helix	trans	-64.6	-44.1	177.9	71.8	0	0	0	0	112.3	S554 S555 G561 I562 Y586	S554-S558 WeakPolarHBondContact O-CB 3.28Å; S554-S558 PolarHBondContact O-N 2.94Å; S554-S558 PolarHBondContact O-OG 3.26Å; S555-S558 PolarHBondContact O-N 2.7Å; S555-S558 PolarHBondContact O-OG 2.96Å; S558-G561 PolarHBondContact O-N 2.96Å; S558-I562 VanDerWaalsContact O-CG1 3.28Å; S558-I562 WeakPolarHBondContact O-CG1 3.41Å; S558-I562 PolarHBondContact O-N 3.49Å; S558-Y586 PolarHBondContact OG-O 3.3Å
559	T	96.8	Very high	95.6	Very high	7 Å²	7	51 Å²	51	4%	0.043	30%	0.301	C	S	.	.	H	α-helix	trans	-65.1	-43.3	178.2	-58.5	0	0	0	0	111.1	S555 I556 S563 I581 T587 T659 A660	S555-T559 WeakPolarHBondContact O-CB 3.16Å; S555-T559 PolarHBondContact O-N 3.12Å; S555-T559 PolarHBondContact O-OG1 3.47Å; I556-T559 PolarHBondContact O-N 3.43Å; T559-S563 WeakPolarHBondContact O-CB 3.42Å; T559-S563 PolarHBondContact O-N 3.1Å; T559-I581 HydrophobicContact CG2-CG2 4.33Å; T559-T587 VanDerWaalsContact OG1-CA 3.24Å; T559-T587 WeakPolarHBondContact OG1-CA 3.22Å; T559-T587 WeakPolarHBondContact OG1-CB 3.36Å; T559-T587 PolarHBondContact OG1-O 3.46Å; T559-T659 HydrophobicContact CG2-CG2 3.91Å; T559-A660 HydrophobicContact CG2-CB 4.37Å
560	F	97.4	Very high	94.9	Very high	56 Å²	56	48 Å²	48	25%	0.246	29%	0.286	C	S	.	.	H	α-helix	trans	-59.9	-51.7	175	180	-90.4	0	0	0	111.3	I556 G557 I562 S563 Y564 F653 A656 A660	I556-F560 VanDerWaalsContact O-CB 3.28Å; I556-F560 WeakPolarHBondContact O-CB 3.29Å; I556-F560 PolarHBondContact O-N 2.98Å; G557-F560 PolarHBondContact O-N 3.3Å; F560-I562 PolarHBondContact O-N 3.28Å; F560-S563 PolarHBondContact O-N 2.85Å; F560-Y564 HydrophobicContact CZ-CD2 4.49Å; F560-Y564 VanDerWaalsContact O-CB 3.25Å; F560-Y564 WeakPolarHBondContact O-CB 3.33Å; F560-Y564 PolarHBondContact O-N 3.03Å; F560-F653 HydrophobicContact CE2-CD2 4.19Å; F560-F653 HydrophobicContact CE2-CE2 4.04Å; F560-F653 AromaticContact CZ-CD2 3.76Å; F560-F653 HydrophobicContact CZ-CD2 3.76Å; F560-F653 AromaticContact CZ-CE2 3.64Å; F560-F653 HydrophobicContact CZ-CE2 3.64Å; F560-A656 HydrophobicContact CD2-CB 3.82Å; F560-A656 HydrophobicContact CE2-CB 3.78Å; F560-A656 HydrophobicContact CG-CB 4.48Å; F560-A656 HydrophobicContact CZ-CB 4.4Å; F560-A660 HydrophobicContact CB-CB 3.8Å; F560-A660 HydrophobicContact CD2-CB 4.48Å
561	G	97.2	Very high	94.1	Very high	36 Å²	36	47.4 Å²	47.4	37%	0.371	28%	0.28	S	S	.	.	H	α-helix	trans	-59.9	-45.3	-177.6	0	0	0	0	0	112.8	G557 S558 A565	G557-G561 PolarHBondContact O-N 3.03Å; S558-G561 PolarHBondContact O-N 2.96Å; G561-A565 VanDerWaalsContact O-CB 3.24Å; G561-A565 WeakPolarHBondContact O-CB 3.41Å; G561-A565 PolarHBondContact O-N 3.29Å
562	I	95.4	Very high	93.1	Very high	39 Å²	39	50 Å²	50	20%	0.2	30%	0.298	C	S	.	.	H	α-helix	trans	-68.3	-43	178.3	-64.2	166.7	0	0	0	110.9	S558 F560 Y564 A565 N566 Y568 I581 Y586 T587	S558-I562 VanDerWaalsContact O-CG1 3.28Å; S558-I562 WeakPolarHBondContact O-CG1 3.41Å; S558-I562 PolarHBondContact O-N 3.49Å; F560-I562 PolarHBondContact O-N 3.28Å; I562-Y564 VanDerWaalsContact C-N 3.33Å; I562-Y564 PolarHBondContact O-N 3.07Å; I562-A565 PolarHBondContact O-N 3.25Å; I562-N566 PolarHBondContact O-N 2.96Å; I562-N566 PolarHBondContact O-ND2 3.11Å; I562-Y568 HydrophobicContact CG2-CE2 4.38Å; I562-I581 HydrophobicContact CB-CG1 4.33Å; I562-I581 HydrophobicContact CG2-CD1 4.03Å; I562-I581 HydrophobicContact CG2-CG1 3.61Å; I562-Y586 HydrophobicContact CD1-CD2 4.41Å; I562-Y586 HydrophobicContact CD1-CE2 3.57Å; I562-T587 HydrophobicContact CD1-CG2 4.14Å
563	S	94.2	Very high	92	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-64.7	-38.7	179.5	-168.3	0	0	0	0	112.2	T559 F560 D567 Y568	T559-S563 WeakPolarHBondContact O-CB 3.42Å; T559-S563 PolarHBondContact O-N 3.1Å; F560-S563 PolarHBondContact O-N 2.85Å; S563-D567 PolarHBondContact O-N 3.25Å; S563-Y568 PolarHBondContact O-N 2.6Å; S563-Y568 VanDerWaalsContact O-N 3.13Å; S563-Y568 PolarHBondContact OG-O 3.32Å
564	Y	95.4	Very high	91.1	Very high	122 Å²	122	48.8 Å²	48.8	48%	0.478	30%	0.295	S	S	.	.	H	α-helix	trans	-70.7	-42.8	177.9	-174.6	-98	0	0	0	111.7	F560 I562 N566 T652 F653 A656	F560-Y564 HydrophobicContact CZ-CD2 4.49Å; F560-Y564 VanDerWaalsContact O-CB 3.25Å; F560-Y564 WeakPolarHBondContact O-CB 3.33Å; F560-Y564 PolarHBondContact O-N 3.03Å; I562-Y564 VanDerWaalsContact C-N 3.33Å; I562-Y564 PolarHBondContact O-N 3.07Å; Y564-N566 VanDerWaalsContact C-N 3.28Å; Y564-N566 PolarHBondContact O-N 2.97Å; Y564-T652 HydrophobicContact CD2-CG2 3.72Å; Y564-T652 HydrophobicContact CE2-CG2 3.96Å; Y564-T652 HydrophobicContact CG-CG2 4.38Å; Y564-F653 HydrophobicContact CE2-CB 4.42Å; Y564-A656 HydrophobicContact CD2-CB 4.35Å
565	A	94.5	Very high	90.1	Very high	74 Å²	74	50.9 Å²	50.9	61%	0.612	30%	0.301	S	S	*	.	H	α-helix	trans	-69.4	-21.2	-177.9	0	0	0	0	0	114.5	G561 I562	G561-A565 VanDerWaalsContact O-CB 3.24Å; G561-A565 WeakPolarHBondContact O-CB 3.41Å; G561-A565 PolarHBondContact O-N 3.29Å; I562-A565 PolarHBondContact O-N 3.25Å
566	N	91.1	Very high	89.3	Confident	80 Å²	80	52.8 Å²	52.8	43%	0.428	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.6	10.4	-177.4	-65.9	-88.1	0	0	0	113.3	I562 Y564 Y568	I562-N566 PolarHBondContact O-N 2.96Å; I562-N566 PolarHBondContact O-ND2 3.11Å; Y564-N566 VanDerWaalsContact C-N 3.28Å; Y564-N566 PolarHBondContact O-N 2.97Å; N566-Y568 HydrophobicContact CB-CD1 4.13Å; N566-Y568 HydrophobicContact CB-CD2 3.71Å; N566-Y568 HydrophobicContact CB-CE1 3.81Å; N566-Y568 HydrophobicContact CB-CE2 3.39Å; N566-Y568 HydrophobicContact CB-CG 4.07Å; N566-Y568 VanDerWaalsContact CB-CZ 3.43Å; N566-Y568 PolarHBondContact O-N 2.67Å; N566-Y568 VanDerWaalsContact O-N 3.12Å
567	D	88.6	Confident	88.5	Confident	101 Å²	101	52.1 Å²	52.1	54%	0.54	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.4	39.1	-177.9	-66.8	-62.3	0	0	0	113.8	S563 L569 T652	S563-D567 PolarHBondContact O-N 3.25Å; D567-L569 WeakPolarHBondContact O-CD1 3.29Å; D567-L569 PolarHBondContact O-N 2.93Å; D567-T652 WeakPolarHBondContact OD1-CG2 2.91Å; D567-T652 PolarHBondContact OD1-OG1 3.41Å
568	Y	89.2	Confident	88	Confident	29 Å²	29	52 Å²	52	11%	0.114	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-74.7	119.8	-178.7	-68.9	-39.8	0	0	0	111.4	I562 S563 N566 T580 I581	I562-Y568 HydrophobicContact CG2-CE2 4.38Å; S563-Y568 PolarHBondContact O-N 2.6Å; S563-Y568 VanDerWaalsContact O-N 3.13Å; S563-Y568 PolarHBondContact OG-O 3.32Å; N566-Y568 HydrophobicContact CB-CD1 4.13Å; N566-Y568 HydrophobicContact CB-CD2 3.71Å; N566-Y568 HydrophobicContact CB-CE1 3.81Å; N566-Y568 HydrophobicContact CB-CE2 3.39Å; N566-Y568 HydrophobicContact CB-CG 4.07Å; N566-Y568 VanDerWaalsContact CB-CZ 3.43Å; N566-Y568 PolarHBondContact O-N 2.67Å; N566-Y568 VanDerWaalsContact O-N 3.12Å; Y568-T580 WeakPolarHBondContact CE2-OG1 3.4Å; Y568-T580 PolarHBondContact OH-OG1 3.37Å; Y568-I581 HydrophobicContact CD2-CD1 3.48Å; Y568-I581 VanDerWaalsContact CD2-CD1 3.48Å; Y568-I581 HydrophobicContact CD2-CG1 4.18Å; Y568-I581 HydrophobicContact CE2-CD1 4.01Å; Y568-I581 HydrophobicContact CE2-CG1 4.21Å; Y568-I581 HydrophobicContact CG-CD1 4.5Å
569	L	85	Confident	87.4	Confident	119 Å²	119	51.1 Å²	51.1	62%	0.623	29%	0.293	S	S	*	.	P	Polyproline II helix	trans	-77.1	140.3	171.1	-85.7	70.8	0	0	0	110.9	D567	D567-L569 WeakPolarHBondContact O-CD1 3.29Å; D567-L569 PolarHBondContact O-N 2.93Å
570	P	83.7	Confident	87	Confident	12 Å²	12	52.7 Å²	52.7	8%	0.078	30%	0.303	C	S	.	.	S	Bend	trans	-72.5	144.5	173	32.5	-36.4	0	0	0	110.7	L639 L642 F650 A655 Y658	P570-L639 HydrophobicContact CB-CD1 4.22Å; P570-L639 HydrophobicContact CB-CD2 3.83Å; P570-L639 HydrophobicContact CG-CD2 3.85Å; P570-L642 HydrophobicContact CG-CD2 4.25Å; P570-F650 HydrophobicContact CG-CD2 3.55Å; P570-F650 HydrophobicContact CG-CE2 3.77Å; P570-A655 HydrophobicContact CG-CB 4.46Å; P570-Y658 HydrophobicContact CB-CD1 3.54Å; P570-Y658 HydrophobicContact CB-CE1 4.02Å; P570-Y658 HydrophobicContact CB-CG 4.44Å; P570-Y658 HydrophobicContact CG-CD1 4.12Å
571	G	81.3	Confident	86.7	Confident	22 Å²	22	50.8 Å²	50.8	23%	0.227	30%	0.295	C	S	.	.	S	Bend	trans	140.6	-140.2	-178.9	0	0	0	0	0	112.5	L573	G571-L573 PolarHBondContact O-N 2.79Å
572	P	77.5	Confident	86.3	Confident	67 Å²	67	49.8 Å²	49.8	44%	0.435	28%	0.28	S	S	.	.	S	Bend	trans	-54.6	134.1	174.8	-21.7	31.8	0	0	0	111.4	S574	P572-S574 PolarHBondContact O-N 3.26Å
573	L	76.9	Confident	86.2	Confident	68 Å²	68	48 Å²	48	36%	0.356	27%	0.271	S	S	.	.	P	Polyproline II helix	trans	-67.2	119.3	176.9	-71.4	164.5	0	0	0	109.5	T411 G571 F578 Y582	T411-L573 HydrophobicContact CG2-CD1 3.48Å; T411-L573 VanDerWaalsContact CG2-CD1 3.48Å; T411-L573 HydrophobicContact CG2-CG 4.22Å; G571-L573 PolarHBondContact O-N 2.79Å; L573-F578 HydrophobicContact CD1-CD2 4.22Å; L573-Y582 HydrophobicContact CD1-CD1 4.29Å; L573-Y582 HydrophobicContact CD1-CD2 4.07Å; L573-Y582 HydrophobicContact CD1-CE1 4.33Å; L573-Y582 HydrophobicContact CD1-CE2 4.17Å; L573-Y582 HydrophobicContact CD1-CG 4.12Å; L573-Y582 HydrophobicContact CD2-CD2 3.99Å; L573-Y582 HydrophobicContact CD2-CG 4.1Å
574	S	78.2	Confident	86.2	Confident	40 Å²	40	49.1 Å²	49.1	28%	0.28	28%	0.276	S	S	.	.	P	Polyproline II helix	trans	-79.2	161.2	166	70.3	0	0	0	0	109.4	P572 S576 S577 F578	P572-S574 PolarHBondContact O-N 3.26Å; S574-S576 PolarHBondContact O-N 3.44Å; S574-S576 PolarHBondContact OG-OG 3.11Å; S574-S577 PolarHBondContact N-OG 3.05Å; S574-S577 VanDerWaalsContact N-OG 3.07Å; S574-S577 PolarHBondContact O-N 2.61Å; S574-S577 PolarHBondContact O-OG 3.32Å; S574-S577 WeakPolarHBondContact OG-CB 3.47Å; S574-S577 PolarHBondContact OG-N 2.89Å; S574-S577 PolarHBondContact OG-OG 3.29Å; S574-S577 VanDerWaalsContact OG-OG 3.1Å; S574-F578 VanDerWaalsContact O-CB 3.24Å; S574-F578 WeakPolarHBondContact O-CB 2.99Å; S574-F578 PolarHBondContact O-N 2.68Å
575	L	77.8	Confident	86.2	Confident	92 Å²	92	43.6 Å²	43.6	48%	0.482	26%	0.255	S	S	.	.	H	α-helix	trans	-60.8	-34.7	177.6	-170.6	58.7	0	0	0	111.8	K162 T579	K162-L575 HydrophobicContact CB-CB 4.45Å; K162-L575 HydrophobicContact CB-CD2 4.11Å; K162-L575 HydrophobicContact CD-CD2 4.19Å; L575-T579 WeakPolarHBondContact O-CG2 3.47Å; L575-T579 PolarHBondContact O-N 2.9Å; L575-T579 PolarHBondContact O-OG1 3.09Å
576	S	80.6	Confident	86.2	Confident	40 Å²	40	43.5 Å²	43.5	28%	0.28	24%	0.239	S	C	.	.	H	α-helix	trans	-71.3	-44.9	176.2	53.8	0	0	0	0	112.6	S574 F578 T579 T580	S574-S576 PolarHBondContact O-N 3.44Å; S574-S576 PolarHBondContact OG-OG 3.11Å; S576-F578 VanDerWaalsContact C-N 3.3Å; S576-F578 PolarHBondContact O-N 3.21Å; S576-T579 PolarHBondContact O-N 2.8Å; S576-T579 PolarHBondContact O-OG1 2.91Å; S576-T579 VanDerWaalsContact O-OG1 3.04Å; S576-T580 WeakPolarHBondContact O-CB 2.97Å; S576-T580 WeakPolarHBondContact O-CG2 3.27Å; S576-T580 PolarHBondContact O-N 3.43Å; S576-T580 PolarHBondContact O-OG1 2.97Å
577	S	83	Confident	86.4	Confident	15 Å²	15	39.9 Å²	39.9	11%	0.105	22%	0.22	C	C	.	.	H	α-helix	trans	-71	-29.4	178.5	72.1	0	0	0	0	112	S574 I581 Y582	S574-S577 PolarHBondContact N-OG 3.05Å; S574-S577 VanDerWaalsContact N-OG 3.07Å; S574-S577 PolarHBondContact O-N 2.61Å; S574-S577 PolarHBondContact O-OG 3.32Å; S574-S577 WeakPolarHBondContact OG-CB 3.47Å; S574-S577 PolarHBondContact OG-N 2.89Å; S574-S577 PolarHBondContact OG-OG 3.29Å; S574-S577 VanDerWaalsContact OG-OG 3.1Å; S577-I581 WeakPolarHBondContact O-CB 3.49Å; S577-I581 PolarHBondContact O-N 2.96Å; S577-Y582 PolarHBondContact O-N 2.86Å; S577-Y582 VanDerWaalsContact O-N 3.1Å
578	F	86.6	Confident	86.7	Confident	43 Å²	43	35.1 Å²	35.1	19%	0.189	19%	0.194	C	C	.	.	I	π-helix	trans	-60.6	-52.6	171.5	-175.7	-106.3	0	0	0	111.2	L511 W517 L573 S574 S576 Y582 L583	L511-F578 HydrophobicContact CD1-CE1 3.78Å; W517-F578 AromaticContact NE1-CZ 3.98Å; L573-F578 HydrophobicContact CD1-CD2 4.22Å; S574-F578 VanDerWaalsContact O-CB 3.24Å; S574-F578 WeakPolarHBondContact O-CB 2.99Å; S574-F578 PolarHBondContact O-N 2.68Å; S576-F578 VanDerWaalsContact C-N 3.3Å; S576-F578 PolarHBondContact O-N 3.21Å; F578-Y582 AromaticContact CD2-CD1 3.44Å; F578-Y582 HydrophobicContact CD2-CD1 3.44Å; F578-Y582 VanDerWaalsContact CD2-CD1 3.44Å; F578-Y582 HydrophobicContact CD2-CE1 4.23Å; F578-Y582 HydrophobicContact CD2-CG 4Å; F578-Y582 AromaticContact CE2-CD1 3.31Å; F578-Y582 HydrophobicContact CE2-CD1 3.31Å; F578-Y582 AromaticContact CE2-CE1 3.78Å; F578-Y582 HydrophobicContact CE2-CE1 3.78Å; F578-Y582 HydrophobicContact CE2-CG 4.31Å; F578-Y582 HydrophobicContact CZ-CD1 4.37Å; F578-Y582 WeakPolarHBondContact O-CB 3.06Å; F578-Y582 PolarHBondContact O-N 3.32Å; F578-Y582 VanDerWaalsContact O-N 3.11Å; F578-L583 HydrophobicContact CD1-CD1 3.36Å; F578-L583 HydrophobicContact CD1-CG 4.17Å; F578-L583 HydrophobicContact CE1-CD1 3.35Å; F578-L583 HydrophobicContact CE1-CD2 4.35Å; F578-L583 HydrophobicContact CE1-CG 3.89Å; F578-L583 HydrophobicContact CG-CD1 4.15Å; F578-L583 HydrophobicContact CZ-CD1 4.13Å; F578-L583 HydrophobicContact CZ-CG 4.17Å; F578-L583 WeakPolarHBondContact O-CB 3.5Å; F578-L583 WeakPolarHBondContact O-CD1 3.16Å; F578-L583 PolarHBondContact O-N 2.81Å
579	T	86.1	Confident	87.1	Confident	11 Å²	11	36.6 Å²	36.6	7%	0.067	20%	0.2	C	C	.	.	I	π-helix	trans	-70.3	-37	-176.8	50.2	0	0	0	0	114.1	L575 S576 L583 K584	L575-T579 WeakPolarHBondContact O-CG2 3.47Å; L575-T579 PolarHBondContact O-N 2.9Å; L575-T579 PolarHBondContact O-OG1 3.09Å; S576-T579 PolarHBondContact O-N 2.8Å; S576-T579 PolarHBondContact O-OG1 2.91Å; S576-T579 VanDerWaalsContact O-OG1 3.04Å; T579-L583 VanDerWaalsContact CA-CD1 3.49Å; T579-L583 HydrophobicContact CG2-CD1 3.97Å; T579-K584 WeakPolarHBondContact O-CE 3.38Å
580	T	87.5	Confident	87.7	Confident	41 Å²	41	31 Å²	31	25%	0.252	17%	0.171	S	C	.	.	I	π-helix	trans	-89.9	-34.3	-175.4	57.8	0	0	0	0	113.9	Y568 S576 K584	Y568-T580 WeakPolarHBondContact CE2-OG1 3.4Å; Y568-T580 PolarHBondContact OH-OG1 3.37Å; S576-T580 WeakPolarHBondContact O-CB 2.97Å; S576-T580 WeakPolarHBondContact O-CG2 3.27Å; S576-T580 PolarHBondContact O-N 3.43Å; S576-T580 PolarHBondContact O-OG1 2.97Å; T580-K584 VanDerWaalsContact O-CG 3.26Å; T580-K584 WeakPolarHBondContact O-CG 3.45Å
581	I	90.2	Very high	88.4	Confident	15 Å²	15	30.4 Å²	30.4	8%	0.077	17%	0.167	C	C	.	.	I	π-helix	trans	-110.9	-57	-177.8	-66.2	-176.5	0	0	0	111.2	T559 I562 Y568 S577 L583 K584 T587 T659	T559-I581 HydrophobicContact CG2-CG2 4.33Å; I562-I581 HydrophobicContact CB-CG1 4.33Å; I562-I581 HydrophobicContact CG2-CD1 4.03Å; I562-I581 HydrophobicContact CG2-CG1 3.61Å; Y568-I581 HydrophobicContact CD2-CD1 3.48Å; Y568-I581 VanDerWaalsContact CD2-CD1 3.48Å; Y568-I581 HydrophobicContact CD2-CG1 4.18Å; Y568-I581 HydrophobicContact CE2-CD1 4.01Å; Y568-I581 HydrophobicContact CE2-CG1 4.21Å; Y568-I581 HydrophobicContact CG-CD1 4.5Å; S577-I581 WeakPolarHBondContact O-CB 3.49Å; S577-I581 PolarHBondContact O-N 2.96Å; I581-L583 PolarHBondContact O-N 3.16Å; I581-K584 PolarHBondContact O-N 3.23Å; I581-T587 HydrophobicContact CG2-CG2 4.37Å; I581-T587 PolarHBondContact O-OG1 2.96Å; I581-T659 HydrophobicContact CD1-CG2 4.42Å
582	Y	89.9	Confident	89.2	Confident	16 Å²	16	29.4 Å²	29.4	6%	0.063	16%	0.156	C	C	.	.	I	π-helix	trans	-68.8	-37.6	-163.6	-168.3	-103.8	0	0	0	114	T411 V414 W517 L573 S577 F578 R588	T411-Y582 HydrophobicContact CG2-CE2 4.47Å; T411-Y582 PolarHBondContact O-OH 2.72Å; T411-Y582 VanDerWaalsContact O-OH 3.05Å; V414-Y582 VanDerWaalsContact CG2-OH 3.23Å; V414-Y582 WeakPolarHBondContact CG2-OH 3.25Å; W517-Y582 AromaticContact CE2-CE1 3.78Å; W517-Y582 HydrophobicContact CH2-CD1 4.37Å; W517-Y582 AromaticContact CH2-CE1 3.72Å; W517-Y582 HydrophobicContact CH2-CE1 3.72Å; W517-Y582 HydrophobicContact CZ2-CD1 4.03Å; W517-Y582 AromaticContact CZ2-CE1 3.23Å; W517-Y582 HydrophobicContact CZ2-CE1 3.23Å; W517-Y582 AromaticContact CZ2-CZ 3.86Å; L573-Y582 HydrophobicContact CD1-CD1 4.29Å; L573-Y582 HydrophobicContact CD1-CD2 4.07Å; L573-Y582 HydrophobicContact CD1-CE1 4.33Å; L573-Y582 HydrophobicContact CD1-CE2 4.17Å; L573-Y582 HydrophobicContact CD1-CG 4.12Å; L573-Y582 HydrophobicContact CD2-CD2 3.99Å; L573-Y582 HydrophobicContact CD2-CG 4.1Å; S577-Y582 PolarHBondContact O-N 2.86Å; S577-Y582 VanDerWaalsContact O-N 3.1Å; F578-Y582 AromaticContact CD2-CD1 3.44Å; F578-Y582 HydrophobicContact CD2-CD1 3.44Å; F578-Y582 VanDerWaalsContact CD2-CD1 3.44Å; F578-Y582 HydrophobicContact CD2-CE1 4.23Å; F578-Y582 HydrophobicContact CD2-CG 4Å; F578-Y582 AromaticContact CE2-CD1 3.31Å; F578-Y582 HydrophobicContact CE2-CD1 3.31Å; F578-Y582 AromaticContact CE2-CE1 3.78Å; F578-Y582 HydrophobicContact CE2-CE1 3.78Å; F578-Y582 HydrophobicContact CE2-CG 4.31Å; F578-Y582 HydrophobicContact CZ-CD1 4.37Å; F578-Y582 WeakPolarHBondContact O-CB 3.06Å; F578-Y582 PolarHBondContact O-N 3.32Å; F578-Y582 VanDerWaalsContact O-N 3.11Å; Y582-R588 VanDerWaalsContact O-CD 3.27Å; Y582-R588 WeakPolarHBondContact O-CD 3.34Å; Y582-R588 PolarHBondContact O-NH1 3.04Å
583	L	92.5	Very high	90.2	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.135	C	C	.	.	S	Bend	trans	-71.6	-32.7	179	-87.2	148.8	0	0	0	113	L511 W517 N521 F578 T579 I581	L511-L583 HydrophobicContact CD1-CD1 3.93Å; L511-L583 HydrophobicContact CD1-CD2 3.83Å; L511-L583 HydrophobicContact CD2-CD2 3.92Å; W517-L583 HydrophobicContact CB-CD2 3.27Å; W517-L583 HydrophobicContact CD2-CD2 4.33Å; W517-L583 HydrophobicContact CG-CD2 3.59Å; W517-L583 HydrophobicContact CG-CG 4.45Å; N521-L583 PolarHBondContact ND2-O 3.08Å; N521-L583 VanDerWaalsContact ND2-O 3.16Å; N521-L583 PolarHBondContact OD1-O 3.49Å; F578-L583 HydrophobicContact CD1-CD1 3.36Å; F578-L583 HydrophobicContact CD1-CG 4.17Å; F578-L583 HydrophobicContact CE1-CD1 3.35Å; F578-L583 HydrophobicContact CE1-CD2 4.35Å; F578-L583 HydrophobicContact CE1-CG 3.89Å; F578-L583 HydrophobicContact CG-CD1 4.15Å; F578-L583 HydrophobicContact CZ-CD1 4.13Å; F578-L583 HydrophobicContact CZ-CG 4.17Å; F578-L583 WeakPolarHBondContact O-CB 3.5Å; F578-L583 WeakPolarHBondContact O-CD1 3.16Å; F578-L583 PolarHBondContact O-N 2.81Å; T579-L583 VanDerWaalsContact CA-CD1 3.49Å; T579-L583 HydrophobicContact CG2-CD1 3.97Å; I581-L583 PolarHBondContact O-N 3.16Å
584	K	94.2	Very high	91.3	Very high	25 Å²	25	23.6 Å²	23.6	11%	0.109	12%	0.122	C	C	.	.			trans	-75.5	138.8	-165.2	-59.6	-62	177.1	-164	0	111.9	N504 S508 T579 T580 I581 Y586 T587	N504-K584 PolarHBondContact O-NZ 3.37Å; S508-K584 PolarHBondContact OG-NZ 3.47Å; T579-K584 WeakPolarHBondContact O-CE 3.38Å; T580-K584 VanDerWaalsContact O-CG 3.26Å; T580-K584 WeakPolarHBondContact O-CG 3.45Å; I581-K584 PolarHBondContact O-N 3.23Å; K584-Y586 HydrophobicContact CB-CD1 4.38Å; K584-Y586 HydrophobicContact CB-CD2 4.35Å; K584-Y586 HydrophobicContact CB-CE1 3.86Å; K584-Y586 HydrophobicContact CB-CE2 3.79Å; K584-Y586 HydrophobicContact CD-CE1 4.33Å; K584-Y586 HydrophobicContact CG-CE1 4.27Å; K584-Y586 HydrophobicContact CG-CE2 4.32Å; K584-Y586 WeakPolarHBondContact CG-OH 3.42Å; K584-T587 HydrophobicContact CB-CG2 4.46Å; K584-T587 PolarHBondContact O-OG1 3.25Å
585	P	95.3	Very high	92.2	Very high	6 Å²	6	21.7 Å²	21.7	4%	0.039	11%	0.109	C	C	.	.	S	Bend	trans	-71.4	-35.6	-176.3	22.9	-30.4	0	0	0	112.9	F505 N521 F525 T587 R588 W589	F505-P585 HydrophobicContact CE1-CG 4.13Å; F505-P585 HydrophobicContact CE2-CG 3.48Å; F505-P585 VanDerWaalsContact CE2-CG 3.48Å; F505-P585 HydrophobicContact CZ-CG 3.21Å; N521-P585 WeakPolarHBondContact OD1-CB 3.22Å; F525-P585 HydrophobicContact CE1-CB 3.56Å; F525-P585 HydrophobicContact CZ-CB 4.01Å; F525-P585 WeakPolarHBondContact CZ-O 3.38Å; P585-T587 VanDerWaalsContact C-N 3.3Å; P585-T587 PolarHBondContact O-N 3.46Å; P585-R588 PolarHBondContact O-N 3.16Å; P585-R588 VanDerWaalsContact O-N 3.09Å; P585-W589 PolarHBondContact O-N 3.39Å
586	Y	95.2	Very high	93.2	Very high	71 Å²	71	17.3 Å²	17.3	28%	0.278	9%	0.086	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-27.4	-176.8	47.5	-101.3	0	0	0	113.5	F505 S555 S558 I562 K584 R588 W589	F505-Y586 HydrophobicContact CE1-CE1 4.28Å; S555-Y586 VanDerWaalsContact CA-O 3.26Å; S555-Y586 WeakPolarHBondContact CA-O 3.46Å; S555-Y586 WeakPolarHBondContact CB-O 3.32Å; S555-Y586 PolarHBondContact OG-O 3.02Å; S558-Y586 PolarHBondContact OG-O 3.3Å; I562-Y586 HydrophobicContact CD1-CD2 4.41Å; I562-Y586 HydrophobicContact CD1-CE2 3.57Å; K584-Y586 HydrophobicContact CB-CD1 4.38Å; K584-Y586 HydrophobicContact CB-CD2 4.35Å; K584-Y586 HydrophobicContact CB-CE1 3.86Å; K584-Y586 HydrophobicContact CB-CE2 3.79Å; K584-Y586 HydrophobicContact CD-CE1 4.33Å; K584-Y586 HydrophobicContact CG-CE1 4.27Å; K584-Y586 HydrophobicContact CG-CE2 4.32Å; K584-Y586 WeakPolarHBondContact CG-OH 3.42Å; Y586-R588 PolarHBondContact O-N 3.3Å; Y586-W589 PolarHBondContact O-NE1 3.33Å
587	T	95.4	Very high	94.1	Very high	4 Å²	4	17 Å²	17	3%	0.025	8%	0.081	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-7.3	175.2	57.5	0	0	0	0	113.2	S555 T559 I562 I581 K584 P585	S555-T587 PolarHBondContact OG-O 2.88Å; T559-T587 VanDerWaalsContact OG1-CA 3.24Å; T559-T587 WeakPolarHBondContact OG1-CA 3.22Å; T559-T587 WeakPolarHBondContact OG1-CB 3.36Å; T559-T587 PolarHBondContact OG1-O 3.46Å; I562-T587 HydrophobicContact CD1-CG2 4.14Å; I581-T587 HydrophobicContact CG2-CG2 4.37Å; I581-T587 PolarHBondContact O-OG1 2.96Å; K584-T587 HydrophobicContact CB-CG2 4.46Å; K584-T587 PolarHBondContact O-OG1 3.25Å; P585-T587 VanDerWaalsContact C-N 3.3Å; P585-T587 PolarHBondContact O-N 3.46Å
588	R	95.2	Very high	94.8	Very high	1 Å²	1	17.2 Å²	17.2	0%	0.004	8%	0.081	C	C	.	.	T	Hydrogen-bonded Turn	trans	-131.2	-14.4	-171.4	-60	-167.3	71.3	159.9	6.6	115.6	D415 W517 F525 S555 Y582 P585 Y586 S590 T591	D415-R588 IonicContact OD1-CZ 3.73Å; D415-R588 IonicContact OD1-NE 2.63Å; D415-R588 PolarHBondContact OD1-NE 3Å; D415-R588 VanDerWaalsContact OD1-NE 3.11Å; D415-R588 IonicContact OD1-NH2 3.07Å; D415-R588 PolarHBondContact OD1-NH2 3.24Å; D415-R588 IonicContact OD2-CZ 3.18Å; D415-R588 IonicContact OD2-NH2 2.78Å; D415-R588 PolarHBondContact OD2-NH2 3.41Å; W517-R588 VanDerWaalsContact CZ3-NH1 3.25Å; F525-R588 HydrophobicContact CZ-CB 4.47Å; S555-R588 PolarHBondContact OG-N 3.46Å; Y582-R588 VanDerWaalsContact O-CD 3.27Å; Y582-R588 WeakPolarHBondContact O-CD 3.34Å; Y582-R588 PolarHBondContact O-NH1 3.04Å; P585-R588 PolarHBondContact O-N 3.16Å; P585-R588 VanDerWaalsContact O-N 3.09Å; Y586-R588 PolarHBondContact O-N 3.3Å; R588-S590 PolarHBondContact O-N 3.26Å; R588-T591 PolarHBondContact O-N 3.36Å; R588-T591 VanDerWaalsContact O-N 3.07Å; R588-T591 PolarHBondContact O-OG1 2.82Å
589	W	97.2	Very high	95.3	Very high	60 Å²	60	15.2 Å²	15.2	23%	0.227	7%	0.072	C	C	.	.	H	α-helix	trans	-61.1	-12.7	-179.7	58.9	37.9	0	0	0	113.7	F525 L529 L551 S554 P585 Y586 T591 Y592 A593	F525-W589 HydrophobicContact CD1-CB 4.16Å; F525-W589 HydrophobicContact CE1-CB 3.61Å; F525-W589 HydrophobicContact CZ-CB 3.93Å; L529-W589 HydrophobicContact CD1-CB 3.62Å; L529-W589 HydrophobicContact CD1-CD2 4.46Å; L529-W589 HydrophobicContact CD1-CE3 4.18Å; L529-W589 HydrophobicContact CD1-CG 4.29Å; L551-W589 HydrophobicContact CD2-CD2 4.46Å; L551-W589 PolarHBondContact O-NE1 3.09Å; S554-W589 PolarHBondContact OG-NE1 3.44Å; P585-W589 PolarHBondContact O-N 3.39Å; Y586-W589 PolarHBondContact O-NE1 3.33Å; W589-T591 VanDerWaalsContact C-N 3.29Å; W589-T591 PolarHBondContact O-N 2.95Å; W589-Y592 PolarHBondContact O-N 2.81Å; W589-A593 VanDerWaalsContact O-CB 3.24Å; W589-A593 WeakPolarHBondContact O-CB 3.34Å; W589-A593 PolarHBondContact O-N 3.04Å
590	S	97.9	Very high	95.8	Very high	2 Å²	2	16.5 Å²	16.5	1%	0.014	8%	0.075	C	C	.	.	H	α-helix	trans	-58.2	-40.9	172	43.6	0	0	0	0	112.1	S555 R588 A593 I594	S555-S590 VanDerWaalsContact CB-CB 3.43Å; S555-S590 WeakPolarHBondContact CB-OG 3.35Å; S555-S590 PolarHBondContact OG-N 2.96Å; S555-S590 PolarHBondContact OG-OG 2.86Å; S555-S590 VanDerWaalsContact OG-OG 3.13Å; R588-S590 PolarHBondContact O-N 3.26Å; S590-A593 PolarHBondContact O-N 3.08Å; S590-I594 VanDerWaalsContact O-CG1 3.28Å; S590-I594 WeakPolarHBondContact O-CG1 3.49Å; S590-I594 PolarHBondContact O-N 2.84Å
591	T	98.1	Very high	96.2	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-69.9	-38.9	-178.1	61.6	0	0	0	0	111.1	D415 F419 R588 W589 G595 R663 I667	D415-T591 HydrophobicContact CB-CG2 3.82Å; D415-T591 PolarHBondContact OD1-OG1 2.04Å; F419-T591 WeakPolarHBondContact CA-O 3.31Å; R588-T591 PolarHBondContact O-N 3.36Å; R588-T591 VanDerWaalsContact O-N 3.07Å; R588-T591 PolarHBondContact O-OG1 2.82Å; W589-T591 VanDerWaalsContact C-N 3.29Å; W589-T591 PolarHBondContact O-N 2.95Å; T591-G595 PolarHBondContact O-N 3.35Å; T591-R663 HydrophobicContact CG2-CB 4.02Å; T591-I667 HydrophobicContact CG2-CB 4.35Å; T591-I667 HydrophobicContact CG2-CG1 3.69Å
592	Y	98.5	Very high	96.3	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-62.8	-45.6	169.5	-167.4	-92.7	0	0	0	112.2	F418 F525 S530 W589 I594 G595 L596	F418-Y592 HydrophobicContact CB-CD2 4.29Å; F418-Y592 WeakPolarHBondContact O-CD2 3.05Å; F525-Y592 HydrophobicContact CB-CD1 3.87Å; F525-Y592 HydrophobicContact CB-CD2 3.67Å; F525-Y592 HydrophobicContact CB-CE1 3.87Å; F525-Y592 HydrophobicContact CB-CE2 3.68Å; F525-Y592 HydrophobicContact CB-CG 3.77Å; F525-Y592 AromaticContact CD2-CD2 3.74Å; F525-Y592 HydrophobicContact CD2-CD2 3.74Å; F525-Y592 HydrophobicContact CD2-CE2 4.48Å; F525-Y592 AromaticContact CD2-CG 3.87Å; F525-Y592 HydrophobicContact CD2-CG 3.87Å; F525-Y592 HydrophobicContact CG-CD1 4.43Å; F525-Y592 HydrophobicContact CG-CD2 4.1Å; F525-Y592 HydrophobicContact CG-CG 4.03Å; S530-Y592 PolarHBondContact OG-OH 3.34Å; W589-Y592 PolarHBondContact O-N 2.81Å; Y592-I594 PolarHBondContact O-N 2.89Å; Y592-G595 CarbonylContact O-C 3.58Å; Y592-G595 WeakPolarHBondContact O-CA 3.43Å; Y592-G595 PolarHBondContact O-N 3.4Å; Y592-L596 HydrophobicContact CD1-CD1 3.8Å; Y592-L596 HydrophobicContact CD1-CD2 4.35Å; Y592-L596 HydrophobicContact CD1-CG 3.89Å; Y592-L596 HydrophobicContact CE1-CD1 3.8Å; Y592-L596 HydrophobicContact CE1-CD2 3.76Å; Y592-L596 HydrophobicContact CE1-CG 3.81Å; Y592-L596 PolarHBondContact O-N 2.87Å
593	A	98.5	Very high	96.4	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-65.4	-37.1	-178.7	0	0	0	0	0	113	L551 V552 W589 S590 G595 L596 L597	L551-A593 HydrophobicContact CB-CB 3.78Å; L551-A593 HydrophobicContact CD1-CB 4.23Å; V552-A593 HydrophobicContact CG2-CB 3.87Å; W589-A593 VanDerWaalsContact O-CB 3.24Å; W589-A593 WeakPolarHBondContact O-CB 3.34Å; W589-A593 PolarHBondContact O-N 3.04Å; S590-A593 PolarHBondContact O-N 3.08Å; A593-G595 PolarHBondContact O-N 3.24Å; A593-L596 WeakPolarHBondContact O-CB 3.43Å; A593-L596 PolarHBondContact O-N 2.87Å; A593-L596 VanDerWaalsContact O-N 3.13Å; A593-L597 WeakPolarHBondContact O-CG 3.37Å; A593-L597 PolarHBondContact O-N 2.75Å
594	I	98.7	Very high	96.3	Very high	14 Å²	14	23.6 Å²	23.6	7%	0.072	10%	0.103	C	C	.	.	H	α-helix	trans	-58.7	-40.1	170.3	-68.5	161.4	0	0	0	110.3	F419 V552 S590 Y592 L597 L598 P664 I667 L668 A671	F419-I594 HydrophobicContact CD2-CG2 4.27Å; F419-I594 HydrophobicContact CE2-CG2 4.43Å; V552-I594 HydrophobicContact CG2-CG1 4.08Å; S590-I594 VanDerWaalsContact O-CG1 3.28Å; S590-I594 WeakPolarHBondContact O-CG1 3.49Å; S590-I594 PolarHBondContact O-N 2.84Å; Y592-I594 PolarHBondContact O-N 2.89Å; I594-L597 PolarHBondContact O-N 2.88Å; I594-L598 WeakPolarHBondContact O-CB 3.14Å; I594-L598 PolarHBondContact O-N 2.61Å; I594-P664 HydrophobicContact CD1-CB 4.06Å; I594-I667 HydrophobicContact CB-CG2 4.02Å; I594-I667 HydrophobicContact CD1-CB 4.32Å; I594-I667 HydrophobicContact CD1-CG2 4.08Å; I594-I667 HydrophobicContact CG2-CG2 3.87Å; I594-L668 HydrophobicContact CD1-CD2 4.32Å; I594-L668 HydrophobicContact CD1-CG 4.17Å; I594-L668 HydrophobicContact CG1-CD2 4.45Å; I594-L668 HydrophobicContact CG2-CD2 4.08Å; I594-A671 HydrophobicContact CG2-CB 4.15Å
595	G	98.5	Very high	96.1	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-59.3	-49.1	171.9	0	0	0	0	0	112.3	F419 L423 T591 Y592 A593 L597 L598 G599	F419-G595 VanDerWaalsContact CD2-CA 3.45Å; F419-G595 WeakPolarHBondContact O-CA 3.41Å; L423-G595 WeakPolarHBondContact CA-O 3.44Å; L423-G595 PolarHBondContact N-O 2.55Å; T591-G595 PolarHBondContact O-N 3.35Å; Y592-G595 CarbonylContact O-C 3.58Å; Y592-G595 WeakPolarHBondContact O-CA 3.43Å; Y592-G595 PolarHBondContact O-N 3.4Å; A593-G595 PolarHBondContact O-N 3.24Å; G595-L597 PolarHBondContact O-N 2.59Å; G595-L598 PolarHBondContact O-N 3.22Å; G595-G599 PolarHBondContact O-N 3.48Å
596	L	98.4	Very high	95.7	Very high	0 Å²	0	25 Å²	25	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-56.3	-49.3	177.4	-65.9	175.5	0	0	0	111.9	T426 S530 F533 Y592 A593 G599 W600	T426-L596 WeakPolarHBondContact CG2-O 3.25Å; T426-L596 WeakPolarHBondContact OG1-CA 3.18Å; T426-L596 WeakPolarHBondContact OG1-CD2 3.11Å; T426-L596 PolarHBondContact OG1-O 3.14Å; S530-L596 WeakPolarHBondContact OG-CD2 3.43Å; F533-L596 HydrophobicContact CB-CD1 3.9Å; F533-L596 HydrophobicContact CD1-CB 3.88Å; F533-L596 HydrophobicContact CD1-CD1 4.23Å; F533-L596 HydrophobicContact CD1-CD2 4.16Å; F533-L596 HydrophobicContact CD1-CG 4.33Å; F533-L596 HydrophobicContact CD2-CB 4.33Å; F533-L596 HydrophobicContact CD2-CD1 4.28Å; F533-L596 HydrophobicContact CE1-CB 3.81Å; F533-L596 HydrophobicContact CE2-CB 4.27Å; F533-L596 HydrophobicContact CG-CB 4.16Å; F533-L596 HydrophobicContact CG-CD1 3.88Å; F533-L596 HydrophobicContact CG-CG 4.45Å; F533-L596 HydrophobicContact CZ-CB 4.02Å; Y592-L596 HydrophobicContact CD1-CD1 3.8Å; Y592-L596 HydrophobicContact CD1-CD2 4.35Å; Y592-L596 HydrophobicContact CD1-CG 3.89Å; Y592-L596 HydrophobicContact CE1-CD1 3.8Å; Y592-L596 HydrophobicContact CE1-CD2 3.76Å; Y592-L596 HydrophobicContact CE1-CG 3.81Å; Y592-L596 PolarHBondContact O-N 2.87Å; A593-L596 WeakPolarHBondContact O-CB 3.43Å; A593-L596 PolarHBondContact O-N 2.87Å; A593-L596 VanDerWaalsContact O-N 3.13Å; L596-G599 PolarHBondContact O-N 2.8Å; L596-W600 PolarHBondContact O-N 3.11Å; L596-W600 VanDerWaalsContact O-N 3.12Å
597	L	98.5	Very high	95.2	Very high	34 Å²	34	26 Å²	26	18%	0.178	12%	0.12	C	C	.	.	H	α-helix	trans	-62.2	-44.9	179.4	-70.9	168.8	0	0	0	111.6	F533 V545 I549 V552 A593 I594 G595 G599 W600 F601	F533-L597 HydrophobicContact CE2-CD2 4.04Å; F533-L597 HydrophobicContact CZ-CD2 4.28Å; V545-L597 HydrophobicContact CG1-CD2 4.29Å; I549-L597 HydrophobicContact CG1-CD1 4.29Å; V552-L597 HydrophobicContact CG2-CD1 4.43Å; A593-L597 WeakPolarHBondContact O-CG 3.37Å; A593-L597 PolarHBondContact O-N 2.75Å; I594-L597 PolarHBondContact O-N 2.88Å; G595-L597 PolarHBondContact O-N 2.59Å; L597-G599 PolarHBondContact O-N 3.35Å; L597-W600 PolarHBondContact O-N 3.19Å; L597-F601 WeakPolarHBondContact O-CB 3.41Å; L597-F601 PolarHBondContact O-N 2.89Å
598	L	97.9	Very high	94.7	Very high	19 Å²	19	31.3 Å²	31.3	10%	0.099	15%	0.147	C	C	.	.	H	α-helix	trans	-65.1	-39.9	177.9	-174.3	70.6	0	0	0	111.8	F419 L423 I594 G595 W600 F601 L602 A671 V674 S675	F419-L598 HydrophobicContact CE2-CB 4.39Å; F419-L598 HydrophobicContact CE2-CD2 3.7Å; F419-L598 HydrophobicContact CZ-CD2 3.55Å; L423-L598 HydrophobicContact CD1-CB 4.31Å; L423-L598 HydrophobicContact CD1-CD2 4.08Å; L423-L598 HydrophobicContact CD1-CG 4.15Å; I594-L598 WeakPolarHBondContact O-CB 3.14Å; I594-L598 PolarHBondContact O-N 2.61Å; G595-L598 PolarHBondContact O-N 3.22Å; L598-W600 VanDerWaalsContact C-N 3.3Å; L598-W600 PolarHBondContact O-N 3.16Å; L598-F601 HydrophobicContact CD1-CD1 4.45Å; L598-F601 PolarHBondContact O-N 3.04Å; L598-L602 HydrophobicContact CD1-CD1 4.47Å; L598-L602 HydrophobicContact CD1-CG 4.29Å; L598-L602 HydrophobicContact CD2-CD1 4.33Å; L598-L602 HydrophobicContact CG-CD1 4.04Å; L598-L602 HydrophobicContact CG-CG 4.23Å; L598-L602 WeakPolarHBondContact O-CB 3.44Å; L598-L602 WeakPolarHBondContact O-CG 3.37Å; L598-L602 PolarHBondContact O-N 2.83Å; L598-A671 HydrophobicContact CD2-CB 3.92Å; L598-V674 HydrophobicContact CD2-CG1 4.42Å; L598-S675 WeakPolarHBondContact CD1-OG 3.4Å
599	G	96.8	Very high	94	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-61.4	-39.4	177.2	0	0	0	0	0	112.8	G595 L596 L597 E603	G595-G599 PolarHBondContact O-N 3.48Å; L596-G599 PolarHBondContact O-N 2.8Å; L597-G599 PolarHBondContact O-N 3.35Å; G599-E603 WeakPolarHBondContact O-CB 3.46Å; G599-E603 PolarHBondContact O-N 3.49Å
600	W	96.2	Very high	93.2	Very high	38 Å²	38	33.4 Å²	33.4	14%	0.144	16%	0.16	C	C	.	.	H	α-helix	trans	-66.2	-47.6	172.8	164.5	77.5	0	0	0	111.3	T426 I430 F533 I537 D541 V545 L596 L597 L598 L602 E603 K604	T426-W600 HydrophobicContact CG2-CB 3.89Å; I430-W600 HydrophobicContact CD1-CB 4.09Å; I430-W600 HydrophobicContact CD1-CG 4.5Å; F533-W600 HydrophobicContact CE1-CB 4.47Å; F533-W600 HydrophobicContact CZ-CB 4.38Å; I537-W600 HydrophobicContact CD1-CD2 4.47Å; I537-W600 HydrophobicContact CD1-CG 4.12Å; D541-W600 HydrophobicContact CB-CZ2 4.29Å; V545-W600 HydrophobicContact CG2-CD2 3.91Å; V545-W600 HydrophobicContact CG2-CE3 3.74Å; V545-W600 HydrophobicContact CG2-CH2 3.5Å; V545-W600 HydrophobicContact CG2-CZ2 3.66Å; V545-W600 HydrophobicContact CG2-CZ3 3.55Å; L596-W600 PolarHBondContact O-N 3.11Å; L596-W600 VanDerWaalsContact O-N 3.12Å; L597-W600 PolarHBondContact O-N 3.19Å; L598-W600 VanDerWaalsContact C-N 3.3Å; L598-W600 PolarHBondContact O-N 3.16Å; W600-L602 VanDerWaalsContact C-N 3.34Å; W600-L602 PolarHBondContact O-N 3.31Å; W600-E603 PolarHBondContact O-N 3.35Å; W600-K604 HydrophobicContact CZ2-CD 3.99Å; W600-K604 PolarHBondContact O-N 3.41Å
601	F	95.9	Very high	92.6	Very high	85 Å²	85	40.2 Å²	40.2	37%	0.373	20%	0.196	S	C	.	.	H	α-helix	trans	-58.6	-45.5	179.9	178.4	-98.5	0	0	0	111.9	L597 L598 K604 H605 L609	L597-F601 WeakPolarHBondContact O-CB 3.41Å; L597-F601 PolarHBondContact O-N 2.89Å; L598-F601 HydrophobicContact CD1-CD1 4.45Å; L598-F601 PolarHBondContact O-N 3.04Å; F601-K604 PolarHBondContact O-N 3.45Å; F601-H605 AromaticContact CD2-CD2 3.72Å; F601-H605 AromaticContact CE2-CD2 3.8Å; F601-H605 WeakPolarHBondContact O-CB 3.28Å; F601-H605 PolarHBondContact O-CD2 2.04Å; F601-H605 PolarHBondContact O-N 3.3Å; F601-L609 HydrophobicContact CE1-CD1 3.83Å; F601-L609 HydrophobicContact CZ-CD1 4.03Å
602	L	93.7	Very high	92.1	Very high	1 Å²	1	42.3 Å²	42.3	1%	0.005	21%	0.209	C	C	.	.	H	α-helix	trans	-67.4	-41.6	177.1	-70	178.6	0	0	0	111.9	L361 L423 Y427 L598 W600 K604 I606 A678	L361-L602 HydrophobicContact CD2-CD1 3.97Å; L423-L602 HydrophobicContact CD1-CD1 4.13Å; Y427-L602 HydrophobicContact CD2-CB 4.02Å; Y427-L602 HydrophobicContact CE2-CB 4.14Å; L598-L602 HydrophobicContact CD1-CD1 4.47Å; L598-L602 HydrophobicContact CD1-CG 4.29Å; L598-L602 HydrophobicContact CD2-CD1 4.33Å; L598-L602 HydrophobicContact CG-CD1 4.04Å; L598-L602 HydrophobicContact CG-CG 4.23Å; L598-L602 WeakPolarHBondContact O-CB 3.44Å; L598-L602 WeakPolarHBondContact O-CG 3.37Å; L598-L602 PolarHBondContact O-N 2.83Å; W600-L602 VanDerWaalsContact C-N 3.34Å; W600-L602 PolarHBondContact O-N 3.31Å; L602-K604 VanDerWaalsContact C-N 3.29Å; L602-K604 PolarHBondContact O-N 3.08Å; L602-I606 WeakPolarHBondContact O-CB 3.34Å; L602-I606 WeakPolarHBondContact O-CG2 3.41Å; L602-I606 PolarHBondContact O-N 3.44Å; L602-A678 HydrophobicContact CD1-CB 4.26Å; L602-A678 HydrophobicContact CD2-CB 4.29Å
603	E	91.2	Very high	91.6	Very high	41 Å²	41	46.8 Å²	46.8	19%	0.192	23%	0.232	C	C	.	.	H	α-helix	trans	-57.1	-45.1	176.9	-173.4	-89.3	170.2	0	0	111.6	Y427 I430 P431 R434 G599 W600	Y427-E603 HydrophobicContact CD2-CB 4.2Å; I430-E603 HydrophobicContact CB-CG 4.36Å; I430-E603 HydrophobicContact CG2-CG 4.2Å; P431-E603 HydrophobicContact CG-CG 3.96Å; R434-E603 IonicContact CZ-OE2 3.82Å; R434-E603 IonicContact NH1-OE1 2.85Å; R434-E603 PolarHBondContact NH1-OE1 3.49Å; R434-E603 VanDerWaalsContact NH1-OE1 3.17Å; R434-E603 IonicContact NH1-OE2 3.51Å; R434-E603 PolarHBondContact NH1-OE2 3.49Å; G599-E603 WeakPolarHBondContact O-CB 3.46Å; G599-E603 PolarHBondContact O-N 3.49Å; W600-E603 PolarHBondContact O-N 3.35Å
604	K	90.3	Very high	91.1	Very high	94 Å²	94	51.2 Å²	51.2	41%	0.409	26%	0.264	S	S	.	.	H	α-helix	trans	-75.4	-39.2	-176.2	-170.5	170.3	-177.7	168.1	0	113.6	D541 W600 F601 L602	D541-K604 IonicContact OD2-NZ 3.87Å; D541-K604 PolarHBondContact OD2-NZ 3.37Å; W600-K604 HydrophobicContact CZ2-CD 3.99Å; W600-K604 PolarHBondContact O-N 3.41Å; F601-K604 PolarHBondContact O-N 3.45Å; L602-K604 VanDerWaalsContact C-N 3.29Å; L602-K604 PolarHBondContact O-N 3.08Å
605	H	90.3	Very high	90.6	Very high	53 Å²	53	59.3 Å²	59.3	25%	0.245	30%	0.298	C	S	.	.	H	α-helix	trans	-114.3	-5.6	-166.1	-62.4	-68.6	0	0	0	115.2	F601 N607 I608 L609	F601-H605 AromaticContact CD2-CD2 3.72Å; F601-H605 AromaticContact CE2-CD2 3.8Å; F601-H605 WeakPolarHBondContact O-CB 3.28Å; F601-H605 PolarHBondContact O-CD2 2.04Å; F601-H605 PolarHBondContact O-N 3.3Å; H605-N607 VanDerWaalsContact C-N 3.31Å; H605-N607 PolarHBondContact O-N 3.45Å; H605-I608 PolarHBondContact O-N 2.68Å; H605-L609 HydrophobicContact CB-CD1 3.89Å; H605-L609 HydrophobicContact CB-CG 4.23Å; H605-L609 WeakPolarHBondContact O-CB 3.48Å; H605-L609 VanDerWaalsContact O-CG 3.27Å; H605-L609 WeakPolarHBondContact O-CG 3.48Å; H605-L609 PolarHBondContact O-N 3.43Å
606	I	88.1	Confident	90.3	Very high	7 Å²	7	61.8 Å²	61.8	4%	0.036	31%	0.314	C	S	.	.	H	α-helix	trans	-56.9	-40	-174.2	-171.2	164.4	0	0	0	113.9	P360 L602 K610	P360-I606 HydrophobicContact CB-CD1 3.55Å; P360-I606 HydrophobicContact CG-CD1 3.62Å; L602-I606 WeakPolarHBondContact O-CB 3.34Å; L602-I606 WeakPolarHBondContact O-CG2 3.41Å; L602-I606 PolarHBondContact O-N 3.44Å; I606-K610 HydrophobicContact CG1-CD 4.03Å; I606-K610 HydrophobicContact CG1-CG 4.31Å; I606-K610 WeakPolarHBondContact O-CB 3.11Å; I606-K610 VanDerWaalsContact O-CG 3.25Å; I606-K610 WeakPolarHBondContact O-CG 3.35Å; I606-K610 PolarHBondContact O-N 3.05Å
607	N	84.3	Confident	89.9	Confident	94 Å²	94	64.6 Å²	64.6	50%	0.503	33%	0.326	S	S	.	.	H	α-helix	trans	-69.7	-40.4	-178.2	-68.2	-27.2	0	0	0	111.7	H605 K610 N611	H605-N607 VanDerWaalsContact C-N 3.31Å; H605-N607 PolarHBondContact O-N 3.45Å; N607-K610 PolarHBondContact O-N 3.49Å; N607-N611 PolarHBondContact O-N 2.71Å
608	I	83.6	Confident	89.5	Confident	115 Å²	115	67.1 Å²	67.1	59%	0.59	34%	0.343	S	S	*	.	H	α-helix	trans	-63.8	-47.5	176.7	-60.9	172.3	0	0	0	109.5	H605 K610 N611	H605-I608 PolarHBondContact O-N 2.68Å; I608-K610 VanDerWaalsContact C-N 3.32Å; I608-K610 PolarHBondContact O-N 3.02Å; I608-N611 PolarHBondContact O-N 3.34Å
609	L	80.4	Confident	89.3	Confident	46 Å²	46	70.9 Å²	70.9	24%	0.241	36%	0.362	C	S	.	.	H	α-helix	trans	-68.9	-28.9	-178.2	-64.8	170.1	0	0	0	112.8	F601 H605 N611 V612 L679	F601-L609 HydrophobicContact CE1-CD1 3.83Å; F601-L609 HydrophobicContact CZ-CD1 4.03Å; H605-L609 HydrophobicContact CB-CD1 3.89Å; H605-L609 HydrophobicContact CB-CG 4.23Å; H605-L609 WeakPolarHBondContact O-CB 3.48Å; H605-L609 VanDerWaalsContact O-CG 3.27Å; H605-L609 WeakPolarHBondContact O-CG 3.48Å; H605-L609 PolarHBondContact O-N 3.43Å; L609-N611 VanDerWaalsContact C-N 3.32Å; L609-N611 PolarHBondContact O-N 3.5Å; L609-V612 WeakPolarHBondContact O-CB 3.44Å; L609-V612 VanDerWaalsContact O-CG2 3.29Å; L609-V612 WeakPolarHBondContact O-CG2 3.27Å; L609-V612 PolarHBondContact O-N 3.13Å; L609-L679 HydrophobicContact CB-CD1 4.28Å; L609-L679 HydrophobicContact CB-CD2 3.27Å; L609-L679 HydrophobicContact CB-CG 4.37Å; L609-L679 HydrophobicContact CD1-CD1 4.32Å; L609-L679 HydrophobicContact CD1-CD2 3.85Å; L609-L679 HydrophobicContact CG-CD2 4.19Å
610	K	82.2	Confident	89	Confident	58 Å²	58	74 Å²	74	25%	0.252	38%	0.378	S	S	.	.	H	α-helix	trans	-69.4	-26.6	174.8	-83.6	178.4	175.3	-179.8	0	113.6	I606 N607 I608 V612 K617 A678	I606-K610 HydrophobicContact CG1-CD 4.03Å; I606-K610 HydrophobicContact CG1-CG 4.31Å; I606-K610 WeakPolarHBondContact O-CB 3.11Å; I606-K610 VanDerWaalsContact O-CG 3.25Å; I606-K610 WeakPolarHBondContact O-CG 3.35Å; I606-K610 PolarHBondContact O-N 3.05Å; N607-K610 PolarHBondContact O-N 3.49Å; I608-K610 VanDerWaalsContact C-N 3.32Å; I608-K610 PolarHBondContact O-N 3.02Å; K610-V612 PolarHBondContact O-N 3.19Å; K610-K617 VanDerWaalsContact O-CE 3.26Å; K610-K617 WeakPolarHBondContact O-CE 3.43Å; K610-K617 PolarHBondContact O-NZ 3.46Å; K610-A678 WeakPolarHBondContact CE-O 3.46Å
611	N	85.1	Confident	88.8	Confident	146 Å²	146	72.5 Å²	72.5	78%	0.781	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	0	-179.5	-74	-6.4	0	0	0	113.8	N607 I608 L609	N607-N611 PolarHBondContact O-N 2.71Å; I608-N611 PolarHBondContact O-N 3.34Å; L609-N611 VanDerWaalsContact C-N 3.32Å; L609-N611 PolarHBondContact O-N 3.5Å
612	V	86.2	Confident	88.7	Confident	43 Å²	43	73.7 Å²	73.7	26%	0.261	38%	0.384	S	S	.	.	S	Bend	trans	-64.3	143.3	175	175.3	0	0	0	0	110.8	L609 K610 T616 K617 I620	L609-V612 WeakPolarHBondContact O-CB 3.44Å; L609-V612 VanDerWaalsContact O-CG2 3.29Å; L609-V612 WeakPolarHBondContact O-CG2 3.27Å; L609-V612 PolarHBondContact O-N 3.13Å; K610-V612 PolarHBondContact O-N 3.19Å; V612-T616 HydrophobicContact CG1-CG2 3.35Å; V612-K617 HydrophobicContact CG1-CG 4.49Å; V612-K617 WeakPolarHBondContact O-CE 3.22Å; V612-I620 HydrophobicContact CG1-CD1 4.45Å
613	N	88.9	Confident	88.8	Confident	94 Å²	94	78.5 Å²	78.5	50%	0.503	41%	0.409	S	S	.	.			trans	-60.8	157.9	-178.9	75.8	48.7	0	0	0	112.2	K615 T616 K617	N613-K615 VanDerWaalsContact C-N 3.35Å; N613-K615 PolarHBondContact O-N 3.08Å; N613-K615 PolarHBondContact OD1-N 3.48Å; N613-K615 VanDerWaalsContact OD1-N 3.14Å; N613-T616 PolarHBondContact ND2-OG1 3.45Å; N613-T616 VanDerWaalsContact ND2-OG1 3.14Å; N613-T616 PolarHBondContact O-N 3.33Å; N613-T616 VanDerWaalsContact OD1-CB 3.3Å; N613-T616 WeakPolarHBondContact OD1-CB 3.31Å; N613-T616 PolarHBondContact OD1-N 3.12Å; N613-T616 PolarHBondContact OD1-OG1 3.13Å; N613-K617 PolarHBondContact O-N 3.24Å
614	S	86.9	Confident	89	Confident	94 Å²	94	77 Å²	77	66%	0.657	40%	0.404	S	S	*	.	H	α-helix	trans	-60.9	-38.9	-175.7	-169.3	0	0	0	0	113.4	K617 V618	S614-K617 WeakPolarHBondContact O-CB 3.23Å; S614-K617 PolarHBondContact O-N 2.95Å; S614-V618 WeakPolarHBondContact O-CG2 3.44Å; S614-V618 PolarHBondContact O-N 3.29Å
615	K	90.2	Very high	89.2	Confident	184 Å²	184	73.7 Å²	73.7	80%	0.8	40%	0.395	S	S	*	.	H	α-helix	trans	-64.4	-44.3	179.7	-66.8	-175.9	179	-178.8	0	111.8	N613 K617 V618 L619	N613-K615 VanDerWaalsContact C-N 3.35Å; N613-K615 PolarHBondContact O-N 3.08Å; N613-K615 PolarHBondContact OD1-N 3.48Å; N613-K615 VanDerWaalsContact OD1-N 3.14Å; K615-K617 VanDerWaalsContact C-N 3.34Å; K615-V618 PolarHBondContact O-N 3.47Å; K615-L619 PolarHBondContact O-N 2.74Å
616	T	90.8	Very high	89.5	Confident	52 Å²	52	75 Å²	75	32%	0.319	41%	0.408	S	S	.	.	H	α-helix	trans	-68.1	-34.2	177	-57.2	0	0	0	0	110.9	V612 N613 L619 I620	V612-T616 HydrophobicContact CG1-CG2 3.35Å; N613-T616 PolarHBondContact ND2-OG1 3.45Å; N613-T616 VanDerWaalsContact ND2-OG1 3.14Å; N613-T616 PolarHBondContact O-N 3.33Å; N613-T616 VanDerWaalsContact OD1-CB 3.3Å; N613-T616 WeakPolarHBondContact OD1-CB 3.31Å; N613-T616 PolarHBondContact OD1-N 3.12Å; N613-T616 PolarHBondContact OD1-OG1 3.13Å; T616-L619 PolarHBondContact O-N 3.36Å; T616-I620 HydrophobicContact CG2-CD1 3.83Å; T616-I620 HydrophobicContact CG2-CG1 4.24Å; T616-I620 WeakPolarHBondContact O-CB 3.15Å; T616-I620 VanDerWaalsContact O-CG1 3.23Å; T616-I620 WeakPolarHBondContact O-CG1 3.27Å; T616-I620 PolarHBondContact O-N 3.39Å
617	K	89.4	Confident	90	Very high	58 Å²	58	77.9 Å²	77.9	25%	0.252	42%	0.424	S	S	.	.	H	α-helix	trans	-60	-45.1	170.6	-76.2	178.4	177.3	169.1	0	112	K610 V612 N613 S614 K615 I620 G621 C681	K610-K617 VanDerWaalsContact O-CE 3.26Å; K610-K617 WeakPolarHBondContact O-CE 3.43Å; K610-K617 PolarHBondContact O-NZ 3.46Å; V612-K617 HydrophobicContact CG1-CG 4.49Å; V612-K617 WeakPolarHBondContact O-CE 3.22Å; N613-K617 PolarHBondContact O-N 3.24Å; S614-K617 WeakPolarHBondContact O-CB 3.23Å; S614-K617 PolarHBondContact O-N 2.95Å; K615-K617 VanDerWaalsContact C-N 3.34Å; K617-I620 PolarHBondContact O-N 3.41Å; K617-G621 PolarHBondContact O-N 2.85Å; K617-C681 HydrophobicContact CB-CB 4.12Å; K617-C681 WeakPolarHBondContact O-CB 3.04Å
618	V	91.4	Very high	90.6	Very high	88 Å²	88	73.7 Å²	73.7	53%	0.533	40%	0.402	S	S	.	.	H	α-helix	trans	-61.8	-44.7	176.1	174.9	0	0	0	0	110.9	S614 K615 G621 L622	S614-V618 WeakPolarHBondContact O-CG2 3.44Å; S614-V618 PolarHBondContact O-N 3.29Å; K615-V618 PolarHBondContact O-N 3.47Å; V618-G621 PolarHBondContact O-N 2.72Å; V618-L622 HydrophobicContact CG1-CD1 4.13Å; V618-L622 HydrophobicContact CG1-CG 4.48Å; V618-L622 WeakPolarHBondContact O-CG 3.4Å; V618-L622 PolarHBondContact O-N 3.31Å
619	L	92.7	Very high	91.2	Very high	98 Å²	98	71.2 Å²	71.2	51%	0.513	40%	0.395	S	S	.	.	H	α-helix	trans	-62.1	-47.8	177.8	-178.6	61.8	0	0	0	112.5	K615 T616 G621 L622 I623	K615-L619 PolarHBondContact O-N 2.74Å; T616-L619 PolarHBondContact O-N 3.36Å; L619-G621 PolarHBondContact O-N 3.02Å; L619-L622 PolarHBondContact O-N 2.93Å; L619-I623 HydrophobicContact CD1-CD1 3.92Å; L619-I623 HydrophobicContact CD1-CG1 4.26Å; L619-I623 HydrophobicContact CG-CD1 3.89Å; L619-I623 WeakPolarHBondContact O-CG1 3.23Å; L619-I623 PolarHBondContact O-N 3.14Å
620	I	91.7	Very high	92.1	Very high	65 Å²	65	74 Å²	74	33%	0.333	41%	0.409	S	S	.	.	H	α-helix	trans	-59.2	-40.6	174.8	-68.9	167.8	0	0	0	110.1	V612 T616 K617 G624	V612-I620 HydrophobicContact CG1-CD1 4.45Å; T616-I620 HydrophobicContact CG2-CD1 3.83Å; T616-I620 HydrophobicContact CG2-CG1 4.24Å; T616-I620 WeakPolarHBondContact O-CB 3.15Å; T616-I620 VanDerWaalsContact O-CG1 3.23Å; T616-I620 WeakPolarHBondContact O-CG1 3.27Å; T616-I620 PolarHBondContact O-N 3.39Å; K617-I620 PolarHBondContact O-N 3.41Å; I620-G624 PolarHBondContact O-N 3.48Å
621	G	92.3	Very high	92.8	Very high	7 Å²	7	73.8 Å²	73.8	7%	0.072	41%	0.408	C	S	.	.	H	α-helix	trans	-62.3	-44.9	177.1	0	0	0	0	0	112.8	K617 V618 L619 A625 M676 C681	K617-G621 PolarHBondContact O-N 2.85Å; V618-G621 PolarHBondContact O-N 2.72Å; L619-G621 PolarHBondContact O-N 3.02Å; G621-A625 VanDerWaalsContact O-CB 3.29Å; G621-A625 WeakPolarHBondContact O-CB 3.31Å; G621-A625 PolarHBondContact O-N 2.99Å; G621-M676 WeakPolarHBondContact O-CE 3.25Å; G621-C681 WeakPolarHBondContact CA-O 3.48Å
622	L	93.9	Very high	93.4	Very high	110 Å²	110	68 Å²	68	58%	0.576	38%	0.378	S	S	*	.	H	α-helix	trans	-66	-48.3	177.4	-72.2	170.9	0	0	0	112	V618 L619 G624 A625 C626	V618-L622 HydrophobicContact CG1-CD1 4.13Å; V618-L622 HydrophobicContact CG1-CG 4.48Å; V618-L622 WeakPolarHBondContact O-CG 3.4Å; V618-L622 PolarHBondContact O-N 3.31Å; L619-L622 PolarHBondContact O-N 2.93Å; L622-G624 VanDerWaalsContact C-N 3.33Å; L622-G624 PolarHBondContact O-N 2.8Å; L622-A625 PolarHBondContact O-N 3.15Å; L622-C626 PolarHBondContact O-N 2.92Å; L622-C626 PolarHBondContact O-SG 3.42Å; L622-C626 VanDerWaalsContact O-SG 3.38Å
623	I	95.2	Very high	93.9	Very high	102 Å²	102	69.8 Å²	69.8	52%	0.523	39%	0.389	S	S	.	.	H	α-helix	trans	-60.8	-45.8	177.7	-66.4	169.8	0	0	0	110.1	L619 C626 L627	L619-I623 HydrophobicContact CD1-CD1 3.92Å; L619-I623 HydrophobicContact CD1-CG1 4.26Å; L619-I623 HydrophobicContact CG-CD1 3.89Å; L619-I623 WeakPolarHBondContact O-CG1 3.23Å; L619-I623 PolarHBondContact O-N 3.14Å; I623-C626 PolarHBondContact O-N 3.24Å; I623-L627 WeakPolarHBondContact O-CB 3.32Å; I623-L627 PolarHBondContact O-N 2.78Å
624	G	95.3	Very high	94.2	Very high	9 Å²	9	68 Å²	68	9%	0.093	38%	0.384	C	S	.	.	H	α-helix	trans	-62.5	-42.7	178	0	0	0	0	0	112.4	I620 L622 L627 S628 I672 M676	I620-G624 PolarHBondContact O-N 3.48Å; L622-G624 VanDerWaalsContact C-N 3.33Å; L622-G624 PolarHBondContact O-N 2.8Å; G624-L627 PolarHBondContact O-N 3.47Å; G624-S628 VanDerWaalsContact O-CB 3.25Å; G624-S628 WeakPolarHBondContact O-CB 3.48Å; G624-S628 PolarHBondContact O-N 2.82Å; G624-S628 PolarHBondContact O-OG 3.17Å; G624-S628 VanDerWaalsContact O-OG 3.08Å; G624-I672 VanDerWaalsContact O-CG2 3.29Å; G624-I672 WeakPolarHBondContact O-CG2 3.48Å; G624-M676 VanDerWaalsContact CA-SD 3.55Å
625	A	95.5	Very high	94.6	Very high	25 Å²	25	63.7 Å²	63.7	21%	0.207	35%	0.354	C	S	.	.	H	α-helix	trans	-60.9	-48	176.2	0	0	0	0	0	111.3	G621 L622 S628 S629 M676 I685	G621-A625 VanDerWaalsContact O-CB 3.29Å; G621-A625 WeakPolarHBondContact O-CB 3.31Å; G621-A625 PolarHBondContact O-N 2.99Å; L622-A625 PolarHBondContact O-N 3.15Å; A625-S628 PolarHBondContact O-OG 3.41Å; A625-S629 VanDerWaalsContact O-CB 3.3Å; A625-S629 WeakPolarHBondContact O-CB 3.43Å; A625-S629 PolarHBondContact O-N 2.94Å; A625-S629 PolarHBondContact O-OG 3.25Å; A625-M676 HydrophobicContact CB-CE 4.13Å; A625-M676 PolarHBondContact N-SD 3.38Å; A625-I685 HydrophobicContact CB-CD1 4.44Å
626	C	96.4	Very high	94.8	Very high	79 Å²	79	55.7 Å²	55.7	53%	0.534	32%	0.321	S	S	.	.	H	α-helix	trans	-59.6	-49.6	176.4	-70	0	0	0	0	111.7	L622 I623 S629 I630	L622-C626 PolarHBondContact O-N 2.92Å; L622-C626 PolarHBondContact O-SG 3.42Å; L622-C626 VanDerWaalsContact O-SG 3.38Å; I623-C626 PolarHBondContact O-N 3.24Å; C626-S629 WeakPolarHBondContact O-CB 3.01Å; C626-S629 PolarHBondContact O-N 3.43Å; C626-I630 VanDerWaalsContact O-CG1 3.31Å; C626-I630 WeakPolarHBondContact O-CG1 3.43Å; C626-I630 PolarHBondContact O-N 3.5Å
627	L	97.3	Very high	95	Very high	69 Å²	69	56.8 Å²	56.8	36%	0.361	32%	0.319	S	S	.	.	H	α-helix	trans	-64.9	-43.6	-178.4	-172.8	61.3	0	0	0	112.2	I623 G624 S629 I630 F631 I672	I623-L627 WeakPolarHBondContact O-CB 3.32Å; I623-L627 PolarHBondContact O-N 2.78Å; G624-L627 PolarHBondContact O-N 3.47Å; L627-S629 VanDerWaalsContact C-N 3.28Å; L627-S629 PolarHBondContact O-N 3.01Å; L627-I630 PolarHBondContact O-N 3.34Å; L627-F631 HydrophobicContact CD1-CD1 4.47Å; L627-F631 HydrophobicContact CD1-CE1 3.88Å; L627-F631 HydrophobicContact CD1-CE2 3.97Å; L627-F631 HydrophobicContact CD1-CZ 3.6Å; L627-F631 HydrophobicContact CD2-CE2 4.28Å; L627-F631 HydrophobicContact CG-CD2 4.31Å; L627-F631 HydrophobicContact CG-CE2 3.88Å; L627-F631 HydrophobicContact CG-CZ 4.05Å; L627-F631 WeakPolarHBondContact O-CG 3.47Å; L627-F631 PolarHBondContact O-N 2.98Å; L627-I672 HydrophobicContact CB-CD1 4.2Å; L627-I672 HydrophobicContact CD2-CD1 3.59Å; L627-I672 HydrophobicContact CG-CD1 3.66Å
628	S	97.3	Very high	95.1	Very high	6 Å²	6	55.7 Å²	55.7	4%	0.042	33%	0.325	C	S	.	.	H	α-helix	trans	-62.6	-37.3	174.8	71	0	0	0	0	112	G624 A625 F631 C632 G669	G624-S628 VanDerWaalsContact O-CB 3.25Å; G624-S628 WeakPolarHBondContact O-CB 3.48Å; G624-S628 PolarHBondContact O-N 2.82Å; G624-S628 PolarHBondContact O-OG 3.17Å; G624-S628 VanDerWaalsContact O-OG 3.08Å; A625-S628 PolarHBondContact O-OG 3.41Å; S628-F631 PolarHBondContact O-N 3.16Å; S628-C632 VanDerWaalsContact O-CB 3.28Å; S628-C632 WeakPolarHBondContact O-CB 3.49Å; S628-C632 PolarHBondContact O-N 3.37Å; S628-C632 PolarHBondContact O-SG 3.24Å; S628-C632 VanDerWaalsContact O-SG 3.34Å; S628-G669 WeakPolarHBondContact CB-O 3.4Å
629	S	96.9	Very high	95	Very high	62 Å²	62	52 Å²	52	43%	0.434	30%	0.302	S	S	.	.	H	α-helix	trans	-67	-44.1	177.4	-59.8	0	0	0	0	110.3	A625 C626 L627 F631 V633	A625-S629 VanDerWaalsContact O-CB 3.3Å; A625-S629 WeakPolarHBondContact O-CB 3.43Å; A625-S629 PolarHBondContact O-N 2.94Å; A625-S629 PolarHBondContact O-OG 3.25Å; C626-S629 WeakPolarHBondContact O-CB 3.01Å; C626-S629 PolarHBondContact O-N 3.43Å; L627-S629 VanDerWaalsContact C-N 3.28Å; L627-S629 PolarHBondContact O-N 3.01Å; S629-F631 PolarHBondContact O-N 3Å; S629-V633 WeakPolarHBondContact O-CA 3.5Å; S629-V633 WeakPolarHBondContact O-CB 3.49Å; S629-V633 WeakPolarHBondContact O-CG2 3.31Å; S629-V633 PolarHBondContact O-N 3.39Å
630	I	97.6	Very high	95	Very high	106 Å²	106	50.6 Å²	50.6	54%	0.544	29%	0.29	S	S	.	.	H	α-helix	trans	-57.2	-51.5	175	-68.6	164.8	0	0	0	110	C626 L627 S634	C626-I630 VanDerWaalsContact O-CG1 3.31Å; C626-I630 WeakPolarHBondContact O-CG1 3.43Å; C626-I630 PolarHBondContact O-N 3.5Å; L627-I630 PolarHBondContact O-N 3.34Å; I630-S634 WeakPolarHBondContact O-CB 3.31Å; I630-S634 PolarHBondContact O-N 2.95Å; I630-S634 PolarHBondContact O-OG 3.16Å
631	F	98.1	Very high	94.9	Very high	52 Å²	52	48.3 Å²	48.3	23%	0.228	28%	0.283	C	S	.	.	H	α-helix	trans	-65.6	-46.1	-178.5	-69.6	-13.3	0	0	0	113.4	L627 S628 S629 S634 T635 I665 L668 I672	L627-F631 HydrophobicContact CD1-CD1 4.47Å; L627-F631 HydrophobicContact CD1-CE1 3.88Å; L627-F631 HydrophobicContact CD1-CE2 3.97Å; L627-F631 HydrophobicContact CD1-CZ 3.6Å; L627-F631 HydrophobicContact CD2-CE2 4.28Å; L627-F631 HydrophobicContact CG-CD2 4.31Å; L627-F631 HydrophobicContact CG-CE2 3.88Å; L627-F631 HydrophobicContact CG-CZ 4.05Å; L627-F631 WeakPolarHBondContact O-CG 3.47Å; L627-F631 PolarHBondContact O-N 2.98Å; S628-F631 PolarHBondContact O-N 3.16Å; S629-F631 PolarHBondContact O-N 3Å; F631-S634 PolarHBondContact O-OG 2.81Å; F631-T635 WeakPolarHBondContact O-CB 3.36Å; F631-T635 VanDerWaalsContact O-CG2 3.27Å; F631-T635 WeakPolarHBondContact O-CG2 3.4Å; F631-T635 PolarHBondContact O-N 2.89Å; F631-T635 PolarHBondContact O-OG1 2.78Å; F631-I665 HydrophobicContact CB-CG2 3.86Å; F631-I665 HydrophobicContact CD1-CG2 3.83Å; F631-I665 HydrophobicContact CG-CG2 3.9Å; F631-L668 HydrophobicContact CD2-CB 3.95Å; F631-L668 HydrophobicContact CE2-CB 4.08Å; F631-I672 HydrophobicContact CD2-CD1 3.87Å; F631-I672 HydrophobicContact CE2-CD1 3.88Å
632	C	97.4	Very high	94.7	Very high	24 Å²	24	49.5 Å²	49.5	16%	0.162	29%	0.288	C	S	.	.	H	α-helix	trans	-71.8	-45.3	-179	-67.9	0	0	0	0	112.2	S628 T635 V636 F666	S628-C632 VanDerWaalsContact O-CB 3.28Å; S628-C632 WeakPolarHBondContact O-CB 3.49Å; S628-C632 PolarHBondContact O-N 3.37Å; S628-C632 PolarHBondContact O-SG 3.24Å; S628-C632 VanDerWaalsContact O-SG 3.34Å; C632-T635 PolarHBondContact O-N 2.96Å; C632-T635 PolarHBondContact O-OG1 3.43Å; C632-T635 VanDerWaalsContact O-OG1 3.05Å; C632-V636 WeakPolarHBondContact O-CB 3.3Å; C632-V636 VanDerWaalsContact O-CG2 3.23Å; C632-V636 WeakPolarHBondContact O-CG2 3.48Å; C632-V636 PolarHBondContact O-N 3.41Å; C632-F666 HydrophobicContact CB-CD2 4.39Å; C632-F666 HydrophobicContact CB-CE2 4.34Å
633	V	96.3	Very high	94.3	Very high	81 Å²	81	45.8 Å²	45.8	49%	0.491	27%	0.268	S	S	.	.	H	α-helix	trans	-70.1	-41.7	-178.2	176.8	0	0	0	0	110.8	S629 T635 V636 Y637	S629-V633 WeakPolarHBondContact O-CA 3.5Å; S629-V633 WeakPolarHBondContact O-CB 3.49Å; S629-V633 WeakPolarHBondContact O-CG2 3.31Å; S629-V633 PolarHBondContact O-N 3.39Å; V633-T635 VanDerWaalsContact C-N 3.28Å; V633-T635 PolarHBondContact O-N 3.3Å; V633-V636 PolarHBondContact O-N 3.3Å; V633-Y637 HydrophobicContact CG1-CD2 3.87Å; V633-Y637 WeakPolarHBondContact O-CB 3.06Å; V633-Y637 PolarHBondContact O-N 3.12Å
634	S	95.4	Very high	94	Very high	57 Å²	57	42 Å²	42	40%	0.399	25%	0.251	S	S	.	.	H	α-helix	trans	-63.3	-34.3	177.7	62.9	0	0	0	0	112.8	I630 F631 G638	I630-S634 WeakPolarHBondContact O-CB 3.31Å; I630-S634 PolarHBondContact O-N 2.95Å; I630-S634 PolarHBondContact O-OG 3.16Å; F631-S634 PolarHBondContact O-OG 2.81Å; S634-G638 WeakPolarHBondContact O-CA 2.97Å; S634-G638 PolarHBondContact O-N 3.43Å
635	T	95.4	Very high	93.5	Very high	4 Å²	4	44.8 Å²	44.8	3%	0.025	28%	0.279	C	S	.	.	H	α-helix	trans	-80.1	-38.9	178.8	50.1	0	0	0	0	111.9	F631 C632 V633 Y658 H662 I665 F666	F631-T635 WeakPolarHBondContact O-CB 3.36Å; F631-T635 VanDerWaalsContact O-CG2 3.27Å; F631-T635 WeakPolarHBondContact O-CG2 3.4Å; F631-T635 PolarHBondContact O-N 2.89Å; F631-T635 PolarHBondContact O-OG1 2.78Å; C632-T635 PolarHBondContact O-N 2.96Å; C632-T635 PolarHBondContact O-OG1 3.43Å; C632-T635 VanDerWaalsContact O-OG1 3.05Å; V633-T635 VanDerWaalsContact C-N 3.28Å; V633-T635 PolarHBondContact O-N 3.3Å; T635-Y658 PolarHBondContact O-OH 2.88Å; T635-Y658 VanDerWaalsContact O-OH 3.11Å; T635-H662 HydrophobicContact CG2-CB 4.22Å; T635-H662 VanDerWaalsContact CG2-O 3.25Å; T635-H662 WeakPolarHBondContact CG2-O 3.46Å; T635-I665 HydrophobicContact CG2-CB 3.92Å; T635-I665 HydrophobicContact CG2-CG2 3.66Å; T635-F666 HydrophobicContact CG2-CB 4.23Å; T635-F666 WeakPolarHBondContact OG1-CD2 3.47Å
636	V	94.9	Very high	93.1	Very high	15 Å²	15	50.4 Å²	50.4	9%	0.091	30%	0.299	C	S	.	.	H	α-helix	trans	-70.9	-38.7	178.5	171.3	0	0	0	0	112.7	W374 V406 S409 L412 C632 V633 F666	W374-V636 HydrophobicContact CH2-CG2 4.2Å; V406-V636 HydrophobicContact CG2-CG1 4.34Å; S409-V636 WeakPolarHBondContact OG-CA 3.45Å; S409-V636 PolarHBondContact OG-O 2.87Å; L412-V636 HydrophobicContact CD1-CG2 4.35Å; C632-V636 WeakPolarHBondContact O-CB 3.3Å; C632-V636 VanDerWaalsContact O-CG2 3.23Å; C632-V636 WeakPolarHBondContact O-CG2 3.48Å; C632-V636 PolarHBondContact O-N 3.41Å; V633-V636 PolarHBondContact O-N 3.3Å; V636-F666 HydrophobicContact CG2-CD2 4.35Å; V636-F666 HydrophobicContact CG2-CE2 4.1Å
637	Y	94.7	Very high	92.7	Very high	75 Å²	75	51 Å²	51	29%	0.294	30%	0.3	S	S	.	.	H	α-helix	trans	-108.6	0.6	-176.3	-66.2	-84.4	0	0	0	113.8	W402 Q405 V406 V633 L639 Y640	W402-Y637 HydrophobicContact CE3-CE1 4.07Å; W402-Y637 WeakPolarHBondContact O-CE1 3.37Å; Q405-Y637 HydrophobicContact CB-CD1 3.77Å; Q405-Y637 HydrophobicContact CB-CE1 4.11Å; Q405-Y637 HydrophobicContact CG-CD1 4.21Å; V406-Y637 HydrophobicContact CG2-CE1 4.31Å; V406-Y637 VanDerWaalsContact CG2-OH 3.31Å; V406-Y637 WeakPolarHBondContact CG2-OH 3.44Å; V633-Y637 HydrophobicContact CG1-CD2 3.87Å; V633-Y637 WeakPolarHBondContact O-CB 3.06Å; V633-Y637 PolarHBondContact O-N 3.12Å; Y637-L639 PolarHBondContact O-N 3.14Å; Y637-L639 VanDerWaalsContact O-N 3.15Å; Y637-Y640 WeakPolarHBondContact O-CB 3.15Å; Y637-Y640 PolarHBondContact O-N 3.41Å
638	G	91	Very high	92.1	Very high	36 Å²	36	55.7 Å²	55.7	37%	0.371	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-26.5	-174.6	0	0	0	0	0	114.4	S634	S634-G638 WeakPolarHBondContact O-CA 2.97Å; S634-G638 PolarHBondContact O-N 3.43Å
639	L	90.7	Very high	91.4	Very high	10 Å²	10	60.3 Å²	60.3	5%	0.052	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-5.3	177.4	-62.2	-179.5	0	0	0	114	P570 Y637 G641 L642 L643 F650 Y658	P570-L639 HydrophobicContact CB-CD1 4.22Å; P570-L639 HydrophobicContact CB-CD2 3.83Å; P570-L639 HydrophobicContact CG-CD2 3.85Å; Y637-L639 PolarHBondContact O-N 3.14Å; Y637-L639 VanDerWaalsContact O-N 3.15Å; L639-G641 PolarHBondContact O-N 3.39Å; L639-L642 HydrophobicContact CD2-CD2 4.29Å; L639-L642 PolarHBondContact O-N 3.49Å; L639-L643 HydrophobicContact CB-CD1 3.83Å; L639-L643 HydrophobicContact CB-CG 4.17Å; L639-L643 WeakPolarHBondContact O-CB 3.45Å; L639-L643 WeakPolarHBondContact O-CG 3.27Å; L639-L643 PolarHBondContact O-N 2.84Å; L639-F650 HydrophobicContact CD2-CE2 3.89Å; L639-Y658 HydrophobicContact CD1-CE1 3.94Å; L639-Y658 HydrophobicContact CD2-CD1 3.94Å; L639-Y658 HydrophobicContact CD2-CD2 4.43Å; L639-Y658 HydrophobicContact CD2-CE1 3.54Å; L639-Y658 HydrophobicContact CD2-CE2 4.06Å; L639-Y658 HydrophobicContact CD2-CG 4.39Å; L639-Y658 HydrophobicContact CG-CE1 3.78Å; L639-Y658 HydrophobicContact CG-CE2 4.43Å; L639-Y658 WeakPolarHBondContact CG-OH 3.27Å
640	Y	91.4	Very high	90.7	Very high	68 Å²	68	61 Å²	61	27%	0.267	35%	0.345	S	S	.	.	H	α-helix	trans	-55.7	-48.2	-177.8	175	-120.4	0	0	0	112.4	P400 W402 Q405 Y637 L642 L643 S644 K646	P400-Y640 WeakPolarHBondContact O-CE2 3.43Å; W402-Y640 HydrophobicContact CB-CD2 4.05Å; W402-Y640 HydrophobicContact CB-CE2 3.67Å; Q405-Y640 HydrophobicContact CG-CD2 4.06Å; Q405-Y640 HydrophobicContact CG-CG 4.45Å; Y637-Y640 WeakPolarHBondContact O-CB 3.15Å; Y637-Y640 PolarHBondContact O-N 3.41Å; Y640-L642 VanDerWaalsContact C-N 3.3Å; Y640-L642 PolarHBondContact O-N 3.28Å; Y640-L643 PolarHBondContact O-N 2.77Å; Y640-S644 WeakPolarHBondContact CD2-OG 3.43Å; Y640-S644 WeakPolarHBondContact CE2-OG 3.14Å; Y640-S644 VanDerWaalsContact O-CB 3.22Å; Y640-S644 WeakPolarHBondContact O-CB 3.3Å; Y640-S644 PolarHBondContact O-N 2.96Å; Y640-S644 PolarHBondContact O-OG 3.35Å; Y640-K646 PolarHBondContact OH-NZ 2.95Å
641	G	89.4	Confident	90.4	Very high	18 Å²	18	60.6 Å²	60.6	19%	0.186	35%	0.348	C	S	.	.	H	α-helix	trans	-58.8	-40.9	-179.8	0	0	0	0	0	113.3	L639 K646 V647	L639-G641 PolarHBondContact O-N 3.39Å; G641-K646 PolarHBondContact O-N 3.33Å; G641-V647 PolarHBondContact O-N 2.91Å; G641-V647 VanDerWaalsContact O-N 3.1Å
642	L	88.1	Confident	90.1	Very high	32 Å²	32	60.7 Å²	60.7	17%	0.168	35%	0.353	C	S	.	.	H	α-helix	trans	-68	-54.3	177.3	179.3	76.8	0	0	0	111.3	P570 L639 Y640 S644 G645 F650	P570-L642 HydrophobicContact CG-CD2 4.25Å; L639-L642 HydrophobicContact CD2-CD2 4.29Å; L639-L642 PolarHBondContact O-N 3.49Å; Y640-L642 VanDerWaalsContact C-N 3.3Å; Y640-L642 PolarHBondContact O-N 3.28Å; L642-S644 VanDerWaalsContact C-N 3.28Å; L642-S644 PolarHBondContact O-N 2.89Å; L642-G645 PolarHBondContact O-N 2.04Å; L642-F650 HydrophobicContact CB-CE2 4.4Å; L642-F650 HydrophobicContact CD1-CD2 4.07Å; L642-F650 HydrophobicContact CD2-CD2 3.62Å; L642-F650 HydrophobicContact CD2-CE2 3.77Å; L642-F650 HydrophobicContact CG-CD2 4.35Å; L642-F650 HydrophobicContact CG-CE2 4.46Å
643	L	87	Confident	89.9	Confident	31 Å²	31	65.6 Å²	65.6	16%	0.162	37%	0.372	C	S	.	.	H	α-helix	trans	-72.2	-22.1	-173.6	-64.4	175.6	0	0	0	113	I408 L639 Y640 G645	I408-L643 HydrophobicContact CD1-CD1 3.49Å; I408-L643 VanDerWaalsContact CD1-CD1 3.49Å; I408-L643 HydrophobicContact CG2-CD1 4.44Å; L639-L643 HydrophobicContact CB-CD1 3.83Å; L639-L643 HydrophobicContact CB-CG 4.17Å; L639-L643 WeakPolarHBondContact O-CB 3.45Å; L639-L643 WeakPolarHBondContact O-CG 3.27Å; L639-L643 PolarHBondContact O-N 2.84Å; Y640-L643 PolarHBondContact O-N 2.77Å; L643-G645 VanDerWaalsContact C-N 3.28Å
644	S	87.9	Confident	89.8	Confident	24 Å²	24	62.6 Å²	62.6	17%	0.168	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-4.3	169.8	-59.2	0	0	0	0	114.2	P400 Y640 L642 K646	P400-S644 PolarHBondContact O-OG 3.28Å; Y640-S644 WeakPolarHBondContact CD2-OG 3.43Å; Y640-S644 WeakPolarHBondContact CE2-OG 3.14Å; Y640-S644 VanDerWaalsContact O-CB 3.22Å; Y640-S644 WeakPolarHBondContact O-CB 3.3Å; Y640-S644 PolarHBondContact O-N 2.96Å; Y640-S644 PolarHBondContact O-OG 3.35Å; L642-S644 VanDerWaalsContact C-N 3.28Å; L642-S644 PolarHBondContact O-N 2.89Å; S644-K646 PolarHBondContact O-N 2.81Å
645	G	84.7	Confident	89.7	Confident	66 Å²	66	60 Å²	60	68%	0.68	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.6	19.8	-174.1	0	0	0	0	0	114	L642 L643	L642-G645 PolarHBondContact O-N 2.04Å; L643-G645 VanDerWaalsContact C-N 3.28Å
646	K	86.5	Confident	89.6	Confident	143 Å²	143	59.8 Å²	59.8	62%	0.622	34%	0.338	S	S	*	.	S	Bend	trans	-86	-18.6	179.4	-70.3	178.3	177.5	173.4	0	112.7	Y640 G641 S644	Y640-K646 PolarHBondContact OH-NZ 2.95Å; G641-K646 PolarHBondContact O-N 3.33Å; S644-K646 PolarHBondContact O-N 2.81Å
647	V	87.7	Confident	89.7	Confident	92 Å²	92	61.2 Å²	61.2	56%	0.558	35%	0.347	S	S	*	.	S	Bend	trans	-127.4	146.6	-179.3	-176.4	0	0	0	0	107.6	G641	G641-V647 PolarHBondContact O-N 2.91Å; G641-V647 VanDerWaalsContact O-N 3.1Å
648	E	85.4	Confident	89.7	Confident	167 Å²	167	59.6 Å²	59.6	78%	0.78	34%	0.34	S	S	*	.	P	Polyproline II helix	trans	-57.4	151.8	175.4	-65.8	-176.8	172.7	0	0	111.8
649	P	82.5	Confident	89.8	Confident	103 Å²	103	58.8 Å²	58.8	67%	0.669	33%	0.328	S	S	*	.	P	Polyproline II helix	trans	-53	142.3	174.1	-25.2	34.4	0	0	0	112.1	T651	P649-T651 PolarHBondContact O-N 3.14Å
650	F	83.3	Confident	90.1	Very high	76 Å²	76	58.5 Å²	58.5	33%	0.333	33%	0.327	S	S	.	.	P	Polyproline II helix	trans	-57.7	141.1	172.8	-78	-64.6	0	0	0	110.7	P570 L639 L642 A655	P570-F650 HydrophobicContact CG-CD2 3.55Å; P570-F650 HydrophobicContact CG-CE2 3.77Å; L639-F650 HydrophobicContact CD2-CE2 3.89Å; L642-F650 HydrophobicContact CB-CE2 4.4Å; L642-F650 HydrophobicContact CD1-CD2 4.07Å; L642-F650 HydrophobicContact CD2-CD2 3.62Å; L642-F650 HydrophobicContact CD2-CE2 3.77Å; L642-F650 HydrophobicContact CG-CD2 4.35Å; L642-F650 HydrophobicContact CG-CE2 4.46Å; F650-A655 HydrophobicContact CB-CB 3.9Å
651	T	91.1	Very high	90.3	Very high	98 Å²	98	59.6 Å²	59.6	60%	0.601	33%	0.334	S	S	*	.	P	Polyproline II helix	trans	-60.6	153.2	159.8	62.4	0	0	0	0	109.3	P649 F653 G654 A655	P649-T651 PolarHBondContact O-N 3.14Å; T651-F653 PolarHBondContact O-N 3.19Å; T651-F653 VanDerWaalsContact O-N 3.11Å; T651-G654 WeakPolarHBondContact O-CA 3.37Å; T651-G654 PolarHBondContact O-N 3.35Å; T651-G654 PolarHBondContact OG1-N 3.18Å; T651-G654 VanDerWaalsContact OG1-N 3.1Å; T651-A655 WeakPolarHBondContact O-CB 3.05Å; T651-A655 PolarHBondContact O-N 3Å
652	T	90.7	Very high	90.6	Very high	54 Å²	54	59.8 Å²	59.8	33%	0.331	33%	0.329	S	S	.	.	H	α-helix	trans	-50.4	-40.4	176	-55.9	0	0	0	0	111.6	Y564 D567 A656	Y564-T652 HydrophobicContact CD2-CG2 3.72Å; Y564-T652 HydrophobicContact CE2-CG2 3.96Å; Y564-T652 HydrophobicContact CG-CG2 4.38Å; D567-T652 WeakPolarHBondContact OD1-CG2 2.91Å; D567-T652 PolarHBondContact OD1-OG1 3.41Å; T652-A656 VanDerWaalsContact O-CB 3.31Å; T652-A656 WeakPolarHBondContact O-CB 3.37Å; T652-A656 PolarHBondContact O-N 2.74Å
653	F	94.7	Very high	91	Very high	127 Å²	127	59.4 Å²	59.4	56%	0.557	33%	0.326	S	S	*	.	H	α-helix	trans	-64.1	-45.8	175.4	-177.9	-92.3	0	0	0	112.9	F560 Y564 T651 A656 T657	F560-F653 HydrophobicContact CE2-CD2 4.19Å; F560-F653 HydrophobicContact CE2-CE2 4.04Å; F560-F653 AromaticContact CZ-CD2 3.76Å; F560-F653 HydrophobicContact CZ-CD2 3.76Å; F560-F653 AromaticContact CZ-CE2 3.64Å; F560-F653 HydrophobicContact CZ-CE2 3.64Å; Y564-F653 HydrophobicContact CE2-CB 4.42Å; T651-F653 PolarHBondContact O-N 3.19Å; T651-F653 VanDerWaalsContact O-N 3.11Å; F653-A656 PolarHBondContact O-N 3.42Å; F653-T657 WeakPolarHBondContact O-CB 3.31Å; F653-T657 PolarHBondContact O-N 3.4Å; F653-T657 PolarHBondContact O-OG1 3.47Å
654	G	93.1	Very high	91.5	Very high	18 Å²	18	58.2 Å²	58.2	19%	0.186	32%	0.32	C	S	.	.	H	α-helix	trans	-63.4	-42.5	177.6	0	0	0	0	0	112.5	T651 T657 Y658	T651-G654 WeakPolarHBondContact O-CA 3.37Å; T651-G654 PolarHBondContact O-N 3.35Å; T651-G654 PolarHBondContact OG1-N 3.18Å; T651-G654 VanDerWaalsContact OG1-N 3.1Å; G654-T657 PolarHBondContact O-N 3.33Å; G654-Y658 WeakPolarHBondContact O-CB 3.21Å; G654-Y658 PolarHBondContact O-N 2.85Å
655	A	92.5	Very high	92	Very high	3 Å²	3	59.5 Å²	59.5	3%	0.025	32%	0.324	C	S	.	.	H	α-helix	trans	-59.9	-51.6	175	0	0	0	0	0	111.4	P570 F650 T651 T657 Y658 T659	P570-A655 HydrophobicContact CG-CB 4.46Å; F650-A655 HydrophobicContact CB-CB 3.9Å; T651-A655 WeakPolarHBondContact O-CB 3.05Å; T651-A655 PolarHBondContact O-N 3Å; A655-T657 VanDerWaalsContact C-N 3.32Å; A655-T657 PolarHBondContact O-N 3.49Å; A655-Y658 PolarHBondContact O-N 3.23Å; A655-T659 WeakPolarHBondContact O-CB 3.09Å; A655-T659 PolarHBondContact O-N 3.36Å; A655-T659 PolarHBondContact O-OG1 3.22Å
656	A	94.9	Very high	92.7	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-61.5	-40.1	178.1	0	0	0	0	0	112.3	F560 Y564 T652 F653 T659 A660	F560-A656 HydrophobicContact CD2-CB 3.82Å; F560-A656 HydrophobicContact CE2-CB 3.78Å; F560-A656 HydrophobicContact CG-CB 4.48Å; F560-A656 HydrophobicContact CZ-CB 4.4Å; Y564-A656 HydrophobicContact CD2-CB 4.35Å; T652-A656 VanDerWaalsContact O-CB 3.31Å; T652-A656 WeakPolarHBondContact O-CB 3.37Å; T652-A656 PolarHBondContact O-N 2.74Å; F653-A656 PolarHBondContact O-N 3.42Å; A656-T659 PolarHBondContact O-N 2.82Å; A656-A660 VanDerWaalsContact O-CB 3.29Å; A656-A660 WeakPolarHBondContact O-CB 3.47Å; A656-A660 PolarHBondContact O-N 3.15Å
657	T	95.9	Very high	93.2	Very high	44 Å²	44	50 Å²	50	27%	0.27	26%	0.264	S	S	.	.	H	α-helix	trans	-62.9	-50	176.2	-57.1	0	0	0	0	110.9	F653 G654 A655 T659 A660 F661	F653-T657 WeakPolarHBondContact O-CB 3.31Å; F653-T657 PolarHBondContact O-N 3.4Å; F653-T657 PolarHBondContact O-OG1 3.47Å; G654-T657 PolarHBondContact O-N 3.33Å; A655-T657 VanDerWaalsContact C-N 3.32Å; A655-T657 PolarHBondContact O-N 3.49Å; T657-T659 PolarHBondContact O-N 3.08Å; T657-A660 PolarHBondContact O-N 2.67Å; T657-F661 HydrophobicContact CG2-CD2 3.96Å; T657-F661 HydrophobicContact CG2-CE2 4.24Å; T657-F661 WeakPolarHBondContact O-CD2 3.46Å; T657-F661 PolarHBondContact O-N 2.76Å; T657-F661 VanDerWaalsContact O-N 3.12Å
658	Y	94.7	Very high	93.7	Very high	42 Å²	42	49 Å²	49	17%	0.165	26%	0.255	C	S	.	.	H	α-helix	trans	-58.2	-48.6	177.3	-179.6	-83.9	0	0	0	111.3	P570 T635 L639 G654 A655 A660 F661 H662	P570-Y658 HydrophobicContact CB-CD1 3.54Å; P570-Y658 HydrophobicContact CB-CE1 4.02Å; P570-Y658 HydrophobicContact CB-CG 4.44Å; P570-Y658 HydrophobicContact CG-CD1 4.12Å; T635-Y658 PolarHBondContact O-OH 2.88Å; T635-Y658 VanDerWaalsContact O-OH 3.11Å; L639-Y658 HydrophobicContact CD1-CE1 3.94Å; L639-Y658 HydrophobicContact CD2-CD1 3.94Å; L639-Y658 HydrophobicContact CD2-CD2 4.43Å; L639-Y658 HydrophobicContact CD2-CE1 3.54Å; L639-Y658 HydrophobicContact CD2-CE2 4.06Å; L639-Y658 HydrophobicContact CD2-CG 4.39Å; L639-Y658 HydrophobicContact CG-CE1 3.78Å; L639-Y658 HydrophobicContact CG-CE2 4.43Å; L639-Y658 WeakPolarHBondContact CG-OH 3.27Å; G654-Y658 WeakPolarHBondContact O-CB 3.21Å; G654-Y658 PolarHBondContact O-N 2.85Å; A655-Y658 PolarHBondContact O-N 3.23Å; Y658-A660 VanDerWaalsContact C-N 3.27Å; Y658-A660 PolarHBondContact O-N 2.72Å; Y658-F661 PolarHBondContact O-N 2.95Å; Y658-H662 HydrophobicContact CD1-CB 4.36Å; Y658-H662 HydrophobicContact CE1-CB 3.89Å; Y658-H662 AromaticContact CE1-CG 3.91Å; Y658-H662 HydrophobicContact CE2-CB 4.39Å; Y658-H662 WeakPolarHBondContact O-CB 3.4Å; Y658-H662 PolarHBondContact O-N 3.1Å; Y658-H662 PolarHBondContact O-ND1 3.11Å; Y658-H662 VanDerWaalsContact O-ND1 3.11Å
659	T	93.9	Very high	94.4	Very high	19 Å²	19	41 Å²	41	12%	0.117	22%	0.218	C	C	.	.	H	α-helix	trans	-58.8	-38.8	179.7	-60.2	0	0	0	0	111.8	T559 I581 A655 A656 T657 H662	T559-T659 HydrophobicContact CG2-CG2 3.91Å; I581-T659 HydrophobicContact CD1-CG2 4.42Å; A655-T659 WeakPolarHBondContact O-CB 3.09Å; A655-T659 PolarHBondContact O-N 3.36Å; A655-T659 PolarHBondContact O-OG1 3.22Å; A656-T659 PolarHBondContact O-N 2.82Å; T657-T659 PolarHBondContact O-N 3.08Å; T659-H662 PolarHBondContact O-CE1 3.47Å; T659-H662 VanDerWaalsContact O-CE1 3.25Å; T659-H662 PolarHBondContact O-ND1 3.16Å
660	A	96.1	Very high	95.1	Very high	3 Å²	3	37.3 Å²	37.3	3%	0.025	19%	0.192	C	C	.	.	H	α-helix	trans	-71.1	-35.6	179.5	0	0	0	0	0	114.1	I556 T559 F560 A656 T657 Y658	I556-A660 HydrophobicContact CG2-CB 4.1Å; T559-A660 HydrophobicContact CG2-CB 4.37Å; F560-A660 HydrophobicContact CB-CB 3.8Å; F560-A660 HydrophobicContact CD2-CB 4.48Å; A656-A660 VanDerWaalsContact O-CB 3.29Å; A656-A660 WeakPolarHBondContact O-CB 3.47Å; A656-A660 PolarHBondContact O-N 3.15Å; T657-A660 PolarHBondContact O-N 2.67Å; Y658-A660 VanDerWaalsContact C-N 3.27Å; Y658-A660 PolarHBondContact O-N 2.72Å
661	F	96.6	Very high	95.8	Very high	92 Å²	92	34 Å²	34	40%	0.404	18%	0.179	S	C	.	.	H	α-helix	trans	-100.9	-25.6	-170.5	-79.5	-83.7	0	0	0	115.3	I556 T657 Y658 R663 P664 I665	I556-F661 HydrophobicContact CD1-CD1 4.3Å; I556-F661 HydrophobicContact CD1-CE1 4.05Å; I556-F661 HydrophobicContact CG2-CD1 4.48Å; I556-F661 HydrophobicContact CG2-CD2 4.32Å; I556-F661 HydrophobicContact CG2-CE1 4.04Å; I556-F661 HydrophobicContact CG2-CE2 3.86Å; I556-F661 HydrophobicContact CG2-CZ 3.71Å; T657-F661 HydrophobicContact CG2-CD2 3.96Å; T657-F661 HydrophobicContact CG2-CE2 4.24Å; T657-F661 WeakPolarHBondContact O-CD2 3.46Å; T657-F661 PolarHBondContact O-N 2.76Å; T657-F661 VanDerWaalsContact O-N 3.12Å; Y658-F661 PolarHBondContact O-N 2.95Å; F661-R663 PolarHBondContact O-N 3.23Å; F661-P664 VanDerWaalsContact O-CD 3.3Å; F661-P664 WeakPolarHBondContact O-CD 3.26Å; F661-I665 HydrophobicContact CB-CD1 3.88Å; F661-I665 WeakPolarHBondContact O-CB 3.43Å; F661-I665 VanDerWaalsContact O-CG1 3.25Å; F661-I665 WeakPolarHBondContact O-CG1 3.49Å; F661-I665 PolarHBondContact O-N 3.16Å
662	H	95.8	Very high	96.1	Very high	21 Å²	21	30.9 Å²	30.9	10%	0.097	16%	0.159	C	C	.	.	H	α-helix	trans	-61.6	-38.5	-170.6	75.8	-69.6	0	0	0	113.7	T635 Y658 T659 F666	T635-H662 HydrophobicContact CG2-CB 4.22Å; T635-H662 VanDerWaalsContact CG2-O 3.25Å; T635-H662 WeakPolarHBondContact CG2-O 3.46Å; Y658-H662 HydrophobicContact CD1-CB 4.36Å; Y658-H662 HydrophobicContact CE1-CB 3.89Å; Y658-H662 AromaticContact CE1-CG 3.91Å; Y658-H662 HydrophobicContact CE2-CB 4.39Å; Y658-H662 WeakPolarHBondContact O-CB 3.4Å; Y658-H662 PolarHBondContact O-N 3.1Å; Y658-H662 PolarHBondContact O-ND1 3.11Å; Y658-H662 VanDerWaalsContact O-ND1 3.11Å; T659-H662 PolarHBondContact O-CE1 3.47Å; T659-H662 VanDerWaalsContact O-CE1 3.25Å; T659-H662 PolarHBondContact O-ND1 3.16Å; H662-F666 WeakPolarHBondContact O-CB 3.19Å; H662-F666 PolarHBondContact O-N 2.92Å
663	R	96.1	Very high	96.4	Very high	24 Å²	24	29.3 Å²	29.3	9%	0.091	15%	0.149	C	C	.	.	H	α-helix	trans	-70.2	-50.4	179.7	-46.2	-178.7	172	-76.1	-14.1	112.5	T411 L412 D415 T591 F661 I665 F666 I667	T411-R663 PolarHBondContact O-NH1 2.55Å; T411-R663 PolarHBondContact OG1-NH2 3.36Å; L412-R663 HydrophobicContact CD2-CB 4.26Å; L412-R663 HydrophobicContact CD2-CG 3.85Å; D415-R663 IonicContact OD2-CZ 3.14Å; D415-R663 IonicContact OD2-NH1 3.54Å; D415-R663 PolarHBondContact OD2-NH1 3.41Å; T591-R663 HydrophobicContact CG2-CB 4.02Å; F661-R663 PolarHBondContact O-N 3.23Å; R663-I665 VanDerWaalsContact C-N 3.31Å; R663-I665 PolarHBondContact O-N 2.86Å; R663-F666 PolarHBondContact O-N 3.08Å; R663-I667 WeakPolarHBondContact O-CG1 3.3Å; R663-I667 PolarHBondContact O-N 3.25Å
664	P	98	Very high	96.5	Very high	7 Å²	7	23.2 Å²	23.2	5%	0.045	12%	0.122	C	C	.	.	H	α-helix	trans	-55.1	-44.1	172.5	-27.3	34.4	0	0	0	113.2	I556 I594 F661 I667 L668	I556-P664 HydrophobicContact CD1-CG 4.3Å; I556-P664 HydrophobicContact CG1-CG 4.03Å; I594-P664 HydrophobicContact CD1-CB 4.06Å; F661-P664 VanDerWaalsContact O-CD 3.3Å; F661-P664 WeakPolarHBondContact O-CD 3.26Å; P664-I667 PolarHBondContact O-N 3.47Å; P664-L668 WeakPolarHBondContact O-CG 3.48Å; P664-L668 PolarHBondContact O-N 2.86Å
665	I	98.2	Very high	96.6	Very high	50 Å²	50	23.3 Å²	23.3	26%	0.256	12%	0.12	S	C	.	.	H	α-helix	trans	-62.9	-46.8	179.9	-69.2	171.6	0	0	0	111	F631 T635 F661 R663 I667 L668 G669	F631-I665 HydrophobicContact CB-CG2 3.86Å; F631-I665 HydrophobicContact CD1-CG2 3.83Å; F631-I665 HydrophobicContact CG-CG2 3.9Å; T635-I665 HydrophobicContact CG2-CB 3.92Å; T635-I665 HydrophobicContact CG2-CG2 3.66Å; F661-I665 HydrophobicContact CB-CD1 3.88Å; F661-I665 WeakPolarHBondContact O-CB 3.43Å; F661-I665 VanDerWaalsContact O-CG1 3.25Å; F661-I665 WeakPolarHBondContact O-CG1 3.49Å; F661-I665 PolarHBondContact O-N 3.16Å; R663-I665 VanDerWaalsContact C-N 3.31Å; R663-I665 PolarHBondContact O-N 2.86Å; I665-I667 VanDerWaalsContact C-N 3.26Å; I665-I667 PolarHBondContact O-N 3.37Å; I665-L668 WeakPolarHBondContact O-CB 3.49Å; I665-L668 PolarHBondContact O-N 2.88Å; I665-G669 PolarHBondContact O-N 3.02Å
666	F	98.4	Very high	96.6	Very high	9 Å²	9	23.5 Å²	23.5	4%	0.039	12%	0.121	C	C	.	.	H	α-helix	trans	-55.2	-45.4	176	176.6	-103.6	0	0	0	111.1	W374 L412 C632 T635 V636 H662 R663 G669 I670	W374-F666 HydrophobicContact CH2-CE2 4.32Å; W374-F666 HydrophobicContact CH2-CZ 4.09Å; W374-F666 HydrophobicContact CZ3-CE1 4.39Å; W374-F666 HydrophobicContact CZ3-CE2 4.34Å; W374-F666 AromaticContact CZ3-CZ 3.71Å; W374-F666 HydrophobicContact CZ3-CZ 3.71Å; L412-F666 HydrophobicContact CB-CD1 3.92Å; L412-F666 HydrophobicContact CB-CE1 4Å; L412-F666 HydrophobicContact CB-CG 4.29Å; L412-F666 HydrophobicContact CB-CZ 4.44Å; L412-F666 HydrophobicContact CD1-CB 4.24Å; L412-F666 HydrophobicContact CD1-CD1 4.42Å; L412-F666 HydrophobicContact CD1-CD2 3.95Å; L412-F666 HydrophobicContact CD1-CE2 4.48Å; L412-F666 HydrophobicContact CD1-CG 3.94Å; L412-F666 HydrophobicContact CD2-CB 4.35Å; L412-F666 HydrophobicContact CD2-CG 4.46Å; L412-F666 HydrophobicContact CG-CG 4.47Å; C632-F666 HydrophobicContact CB-CD2 4.39Å; C632-F666 HydrophobicContact CB-CE2 4.34Å; T635-F666 HydrophobicContact CG2-CB 4.23Å; T635-F666 WeakPolarHBondContact OG1-CD2 3.47Å; V636-F666 HydrophobicContact CG2-CD2 4.35Å; V636-F666 HydrophobicContact CG2-CE2 4.1Å; H662-F666 WeakPolarHBondContact O-CB 3.19Å; H662-F666 PolarHBondContact O-N 2.92Å; R663-F666 PolarHBondContact O-N 3.08Å; F666-G669 WeakPolarHBondContact O-CA 3.27Å; F666-G669 PolarHBondContact O-N 3.33Å; F666-G669 VanDerWaalsContact O-N 3.08Å; F666-I670 HydrophobicContact CD1-CG1 4.45Å; F666-I670 HydrophobicContact CE1-CD1 4.46Å; F666-I670 HydrophobicContact CE1-CG1 3.98Å; F666-I670 HydrophobicContact CZ-CD1 4.06Å; F666-I670 HydrophobicContact CZ-CG1 4.07Å; F666-I670 PolarHBondContact O-N 3.15Å; F666-I670 VanDerWaalsContact O-N 3.09Å
667	I	98.6	Very high	96.5	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-71.4	-31.3	-179.5	-65.8	-61.7	0	0	0	113.3	D415 F419 T591 I594 R663 P664 I665 G669 I670 A671	D415-I667 HydrophobicContact CB-CD1 3.67Å; D415-I667 HydrophobicContact CB-CG1 3.8Å; D415-I667 WeakPolarHBondContact O-CD1 2.98Å; F419-I667 HydrophobicContact CB-CD1 4.13Å; F419-I667 HydrophobicContact CB-CG2 3.67Å; F419-I667 HydrophobicContact CD2-CG2 3.68Å; F419-I667 HydrophobicContact CG-CG2 3.81Å; T591-I667 HydrophobicContact CG2-CB 4.35Å; T591-I667 HydrophobicContact CG2-CG1 3.69Å; I594-I667 HydrophobicContact CB-CG2 4.02Å; I594-I667 HydrophobicContact CD1-CB 4.32Å; I594-I667 HydrophobicContact CD1-CG2 4.08Å; I594-I667 HydrophobicContact CG2-CG2 3.87Å; R663-I667 WeakPolarHBondContact O-CG1 3.3Å; R663-I667 PolarHBondContact O-N 3.25Å; P664-I667 PolarHBondContact O-N 3.47Å; I665-I667 VanDerWaalsContact C-N 3.26Å; I665-I667 PolarHBondContact O-N 3.37Å; I667-G669 VanDerWaalsContact C-N 3.26Å; I667-G669 PolarHBondContact O-N 2.89Å; I667-I670 PolarHBondContact O-N 3.39Å; I667-A671 VanDerWaalsContact O-CB 3.27Å; I667-A671 WeakPolarHBondContact O-CB 3.44Å; I667-A671 PolarHBondContact O-N 3.33Å
668	L	98.3	Very high	96.2	Very high	71 Å²	71	21.7 Å²	21.7	37%	0.372	11%	0.109	S	C	.	.	H	α-helix	trans	-60.7	-39.2	167.7	-72.3	170.3	0	0	0	111	I594 F631 P664 I665 A671 I672	I594-L668 HydrophobicContact CD1-CD2 4.32Å; I594-L668 HydrophobicContact CD1-CG 4.17Å; I594-L668 HydrophobicContact CG1-CD2 4.45Å; I594-L668 HydrophobicContact CG2-CD2 4.08Å; F631-L668 HydrophobicContact CD2-CB 3.95Å; F631-L668 HydrophobicContact CE2-CB 4.08Å; P664-L668 WeakPolarHBondContact O-CG 3.48Å; P664-L668 PolarHBondContact O-N 2.86Å; I665-L668 WeakPolarHBondContact O-CB 3.49Å; I665-L668 PolarHBondContact O-N 2.88Å; L668-A671 WeakPolarHBondContact O-CB 3.35Å; L668-A671 PolarHBondContact O-N 3.2Å; L668-I672 WeakPolarHBondContact O-CD1 3.3Å; L668-I672 VanDerWaalsContact O-CG1 3.27Å; L668-I672 WeakPolarHBondContact O-CG1 3.44Å; L668-I672 PolarHBondContact O-N 3.29Å
669	G	98.3	Very high	96	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-58.3	-48.8	172.6	0	0	0	0	0	112.4	S628 I665 F666 I667 A671 I672 V673	S628-G669 WeakPolarHBondContact CB-O 3.4Å; I665-G669 PolarHBondContact O-N 3.02Å; F666-G669 WeakPolarHBondContact O-CA 3.27Å; F666-G669 PolarHBondContact O-N 3.33Å; F666-G669 VanDerWaalsContact O-N 3.08Å; I667-G669 VanDerWaalsContact C-N 3.26Å; I667-G669 PolarHBondContact O-N 2.89Å; G669-A671 PolarHBondContact O-N 3.35Å; G669-I672 PolarHBondContact O-N 2.91Å; G669-V673 PolarHBondContact O-N 3.34Å
670	I	98.1	Very high	95.6	Very high	25 Å²	25	21.7 Å²	21.7	13%	0.128	12%	0.122	C	C	.	.	H	α-helix	trans	-64.4	-38.8	175.8	-57.5	-58	0	0	0	111.9	T416 F419 F666 I667 I672 V673 V674	T416-I670 HydrophobicContact CG2-CG2 4.18Å; F419-I670 HydrophobicContact CD1-CG2 4Å; F419-I670 HydrophobicContact CE1-CG2 3.85Å; F666-I670 HydrophobicContact CD1-CG1 4.45Å; F666-I670 HydrophobicContact CE1-CD1 4.46Å; F666-I670 HydrophobicContact CE1-CG1 3.98Å; F666-I670 HydrophobicContact CZ-CD1 4.06Å; F666-I670 HydrophobicContact CZ-CG1 4.07Å; F666-I670 PolarHBondContact O-N 3.15Å; F666-I670 VanDerWaalsContact O-N 3.09Å; I667-I670 PolarHBondContact O-N 3.39Å; I670-I672 VanDerWaalsContact C-N 3.3Å; I670-I672 PolarHBondContact O-N 2.85Å; I670-V673 PolarHBondContact O-N 3.42Å; I670-V674 HydrophobicContact CG2-CG2 4.42Å; I670-V674 WeakPolarHBondContact O-CG2 3.36Å; I670-V674 PolarHBondContact O-N 3.5Å
671	A	98.3	Very high	95.3	Very high	7 Å²	7	22.3 Å²	22.3	6%	0.058	13%	0.125	C	C	.	.	H	α-helix	trans	-60.7	-39.1	177	0	0	0	0	0	112	F419 I594 L598 I667 L668 G669 S675	F419-A671 HydrophobicContact CE2-CB 3.75Å; F419-A671 HydrophobicContact CZ-CB 4.02Å; I594-A671 HydrophobicContact CG2-CB 4.15Å; L598-A671 HydrophobicContact CD2-CB 3.92Å; I667-A671 VanDerWaalsContact O-CB 3.27Å; I667-A671 WeakPolarHBondContact O-CB 3.44Å; I667-A671 PolarHBondContact O-N 3.33Å; L668-A671 WeakPolarHBondContact O-CB 3.35Å; L668-A671 PolarHBondContact O-N 3.2Å; G669-A671 PolarHBondContact O-N 3.35Å; A671-S675 WeakPolarHBondContact O-CB 3.42Å; A671-S675 PolarHBondContact O-N 2.94Å; A671-S675 PolarHBondContact O-OG 2.9Å
672	I	97.5	Very high	94.9	Very high	33 Å²	33	18 Å²	18	17%	0.169	11%	0.108	C	C	.	.	H	α-helix	trans	-64	-47.3	173.9	-67.3	158.9	0	0	0	110.4	G624 L627 F631 L668 G669 I670 V674 S675 M676	G624-I672 VanDerWaalsContact O-CG2 3.29Å; G624-I672 WeakPolarHBondContact O-CG2 3.48Å; L627-I672 HydrophobicContact CB-CD1 4.2Å; L627-I672 HydrophobicContact CD2-CD1 3.59Å; L627-I672 HydrophobicContact CG-CD1 3.66Å; F631-I672 HydrophobicContact CD2-CD1 3.87Å; F631-I672 HydrophobicContact CE2-CD1 3.88Å; L668-I672 WeakPolarHBondContact O-CD1 3.3Å; L668-I672 VanDerWaalsContact O-CG1 3.27Å; L668-I672 WeakPolarHBondContact O-CG1 3.44Å; L668-I672 PolarHBondContact O-N 3.29Å; G669-I672 PolarHBondContact O-N 2.91Å; I670-I672 VanDerWaalsContact C-N 3.3Å; I670-I672 PolarHBondContact O-N 2.85Å; I672-V674 VanDerWaalsContact C-N 3.35Å; I672-V674 PolarHBondContact O-N 3.28Å; I672-S675 WeakPolarHBondContact O-CB 3.32Å; I672-S675 PolarHBondContact O-N 3.28Å; I672-M676 HydrophobicContact CG2-CG 4.39Å; I672-M676 HydrophobicContact CG2-SD 3.91Å; I672-M676 VanDerWaalsContact O-CG 3.29Å; I672-M676 WeakPolarHBondContact O-CG 2.99Å; I672-M676 PolarHBondContact O-N 3.19Å
673	V	96.9	Very high	94.5	Very high	20 Å²	20	19.2 Å²	19.2	12%	0.121	13%	0.125	C	C	.	.	H	α-helix	trans	-58	-46.4	177.6	171.7	0	0	0	0	111.6	G669 I670 M676 C677 I685 L689	G669-V673 PolarHBondContact O-N 3.34Å; I670-V673 PolarHBondContact O-N 3.42Å; V673-M676 PolarHBondContact O-N 3.03Å; V673-C677 PolarHBondContact O-N 2.97Å; V673-C677 PolarHBondContact O-SG 3.34Å; V673-I685 HydrophobicContact CG1-CG2 3.82Å; V673-L689 HydrophobicContact CG1-CD1 3.9Å
674	V	96.3	Very high	94.3	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-64.4	-42.6	178.3	171.7	0	0	0	0	111.3	L361 L364 I367 F419 L423 L598 I670 I672 M676 C677 A678	L361-V674 HydrophobicContact CD2-CG1 3.89Å; L364-V674 HydrophobicContact CD2-CG1 4.2Å; L364-V674 HydrophobicContact CD2-CG2 3.81Å; I367-V674 HydrophobicContact CD1-CG2 3.47Å; I367-V674 VanDerWaalsContact CD1-CG2 3.47Å; F419-V674 HydrophobicContact CE1-CB 4.5Å; F419-V674 HydrophobicContact CE1-CG2 3.93Å; F419-V674 HydrophobicContact CZ-CB 4.35Å; F419-V674 HydrophobicContact CZ-CG2 4.27Å; L423-V674 HydrophobicContact CD2-CG1 3.73Å; L598-V674 HydrophobicContact CD2-CG1 4.42Å; I670-V674 HydrophobicContact CG2-CG2 4.42Å; I670-V674 WeakPolarHBondContact O-CG2 3.36Å; I670-V674 PolarHBondContact O-N 3.5Å; I672-V674 VanDerWaalsContact C-N 3.35Å; I672-V674 PolarHBondContact O-N 3.28Å; V674-M676 VanDerWaalsContact C-N 3.34Å; V674-M676 PolarHBondContact O-N 3Å; V674-C677 PolarHBondContact O-N 3.32Å; V674-A678 WeakPolarHBondContact O-CB 3.45Å; V674-A678 PolarHBondContact O-N 2.93Å
675	S	94.6	Very high	94.1	Very high	20 Å²	20	25.3 Å²	25.3	14%	0.14	16%	0.164	C	C	.	.	H	α-helix	trans	-60	-46.2	176.2	-60	0	0	0	0	111	L598 A671 I672 C677 A678 L679	L598-S675 WeakPolarHBondContact CD1-OG 3.4Å; A671-S675 WeakPolarHBondContact O-CB 3.42Å; A671-S675 PolarHBondContact O-N 2.94Å; A671-S675 PolarHBondContact O-OG 2.9Å; I672-S675 WeakPolarHBondContact O-CB 3.32Å; I672-S675 PolarHBondContact O-N 3.28Å; S675-C677 VanDerWaalsContact C-N 3.31Å; S675-C677 PolarHBondContact O-N 3.03Å; S675-A678 PolarHBondContact O-N 3.47Å; S675-A678 VanDerWaalsContact O-N 3.15Å; S675-L679 WeakPolarHBondContact O-CB 3.36Å; S675-L679 VanDerWaalsContact O-CG 3.22Å; S675-L679 WeakPolarHBondContact O-CG 3.35Å; S675-L679 PolarHBondContact O-N 3.28Å
676	M	93.3	Very high	93.8	Very high	7 Å²	7	25.6 Å²	25.6	3%	0.034	16%	0.164	C	C	.	.	H	α-helix	trans	-58.7	-44	177.5	-70.9	167.1	55.1	0	0	112.3	G621 G624 A625 I672 V673 V674 L679 G680 C681 G682 I685	G621-M676 WeakPolarHBondContact O-CE 3.25Å; G624-M676 VanDerWaalsContact CA-SD 3.55Å; A625-M676 HydrophobicContact CB-CE 4.13Å; A625-M676 PolarHBondContact N-SD 3.38Å; I672-M676 HydrophobicContact CG2-CG 4.39Å; I672-M676 HydrophobicContact CG2-SD 3.91Å; I672-M676 VanDerWaalsContact O-CG 3.29Å; I672-M676 WeakPolarHBondContact O-CG 2.99Å; I672-M676 PolarHBondContact O-N 3.19Å; V673-M676 PolarHBondContact O-N 3.03Å; V674-M676 VanDerWaalsContact C-N 3.34Å; V674-M676 PolarHBondContact O-N 3Å; M676-L679 PolarHBondContact O-N 3.25Å; M676-G680 PolarHBondContact O-N 2.7Å; M676-C681 WeakPolarHBondContact CA-SG 3.06Å; M676-C681 PolarHBondContact O-N 2.97Å; M676-C681 PolarHBondContact O-SG 3.48Å; M676-G682 PolarHBondContact O-N 3.45Å; M676-G682 VanDerWaalsContact O-N 3.13Å; M676-I685 HydrophobicContact CE-CD1 4.37Å
677	C	92.7	Very high	93.5	Very high	3 Å²	3	33.2 Å²	33.2	2%	0.02	19%	0.193	C	C	.	.	H	α-helix	trans	-64.6	-42.1	176.2	-65.4	0	0	0	0	112	C363 V673 V674 S675 L679 G680 Q686	C363-C677 HydrophobicContact CB-CB 3.61Å; C363-C677 WeakPolarHBondContact SG-CB 3.23Å; V673-C677 PolarHBondContact O-N 2.97Å; V673-C677 PolarHBondContact O-SG 3.34Å; V674-C677 PolarHBondContact O-N 3.32Å; S675-C677 VanDerWaalsContact C-N 3.31Å; S675-C677 PolarHBondContact O-N 3.03Å; C677-L679 VanDerWaalsContact C-N 3.3Å; C677-L679 PolarHBondContact O-N 2.89Å; C677-G680 PolarHBondContact O-N 2.97Å; C677-Q686 HydrophobicContact CB-CB 4.43Å; C677-Q686 HydrophobicContact CB-CG 4.33Å; C677-Q686 PolarHBondContact O-NE2 2.92Å
678	A	90.6	Very high	93.4	Very high	2 Å²	2	36.9 Å²	36.9	2%	0.017	21%	0.212	C	C	.	.	H	α-helix	trans	-65.4	-33	-180	0	0	0	0	0	112.9	P360 L361 L602 K610 V674 S675 G680	P360-A678 HydrophobicContact CB-CB 4.34Å; P360-A678 WeakPolarHBondContact O-CA 3.43Å; L361-A678 HydrophobicContact CD2-CB 4.02Å; L602-A678 HydrophobicContact CD1-CB 4.26Å; L602-A678 HydrophobicContact CD2-CB 4.29Å; K610-A678 WeakPolarHBondContact CE-O 3.46Å; V674-A678 WeakPolarHBondContact O-CB 3.45Å; V674-A678 PolarHBondContact O-N 2.93Å; S675-A678 PolarHBondContact O-N 3.47Å; S675-A678 VanDerWaalsContact O-N 3.15Å; A678-G680 VanDerWaalsContact C-N 3.35Å
679	L	89.2	Confident	93.3	Very high	20 Å²	20	34.2 Å²	34.2	11%	0.105	20%	0.197	C	C	.	.	H	α-helix	trans	-81.7	-12	177.1	-64.1	-177.2	0	0	0	113.7	L609 S675 M676 C677 C681	L609-L679 HydrophobicContact CB-CD1 4.28Å; L609-L679 HydrophobicContact CB-CD2 3.27Å; L609-L679 HydrophobicContact CB-CG 4.37Å; L609-L679 HydrophobicContact CD1-CD1 4.32Å; L609-L679 HydrophobicContact CD1-CD2 3.85Å; L609-L679 HydrophobicContact CG-CD2 4.19Å; S675-L679 WeakPolarHBondContact O-CB 3.36Å; S675-L679 VanDerWaalsContact O-CG 3.22Å; S675-L679 WeakPolarHBondContact O-CG 3.35Å; S675-L679 PolarHBondContact O-N 3.28Å; M676-L679 PolarHBondContact O-N 3.25Å; C677-L679 VanDerWaalsContact C-N 3.3Å; C677-L679 PolarHBondContact O-N 2.89Å; L679-C681 VanDerWaalsContact C-N 3.34Å
680	G	86.9	Confident	93	Very high	42 Å²	42	36 Å²	36	43%	0.433	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.8	20.7	-174.8	0	0	0	0	0	113.8	M676 C677 A678	M676-G680 PolarHBondContact O-N 2.7Å; C677-G680 PolarHBondContact O-N 2.97Å; A678-G680 VanDerWaalsContact C-N 3.35Å
681	C	89.6	Confident	92.7	Very high	15 Å²	15	37.6 Å²	37.6	10%	0.101	22%	0.217	C	C	.	.			trans	-104.8	6.2	175.1	58.4	0	0	0	0	113.3	K617 G621 M676 L679 G683	K617-C681 HydrophobicContact CB-CB 4.12Å; K617-C681 WeakPolarHBondContact O-CB 3.04Å; G621-C681 WeakPolarHBondContact CA-O 3.48Å; M676-C681 WeakPolarHBondContact CA-SG 3.06Å; M676-C681 PolarHBondContact O-N 2.97Å; M676-C681 PolarHBondContact O-SG 3.48Å; L679-C681 VanDerWaalsContact C-N 3.34Å; C681-G683 VanDerWaalsContact C-N 3.27Å; C681-G683 PolarHBondContact O-N 3.15Å
682	G	87.2	Confident	92.3	Very high	3 Å²	3	41.1 Å²	41.1	3%	0.031	24%	0.241	C	C	.	.			trans	-76.1	-8.4	-178.2	0	0	0	0	0	115.1	M676 I685 Q686	M676-G682 PolarHBondContact O-N 3.45Å; M676-G682 VanDerWaalsContact O-N 3.13Å; G682-I685 WeakPolarHBondContact O-CB 3.3Å; G682-I685 PolarHBondContact O-N 3.17Å; G682-Q686 PolarHBondContact O-N 2.86Å; G682-Q686 VanDerWaalsContact O-N 3.14Å
683	G	88.5	Confident	92	Very high	45 Å²	45	44.2 Å²	44.2	46%	0.464	26%	0.262	S	S	.	.	H	α-helix	trans	46.6	-120.7	173.8	0	0	0	0	0	113.2	C681 I685 Q686 W687	C681-G683 VanDerWaalsContact C-N 3.27Å; C681-G683 PolarHBondContact O-N 3.15Å; G683-I685 PolarHBondContact O-N 2.96Å; G683-Q686 PolarHBondContact O-N 3.19Å; G683-W687 PolarHBondContact O-N 2.84Å
684	P	91.8	Very high	91.8	Very high	99 Å²	99	44.2 Å²	44.2	64%	0.643	26%	0.26	S	S	*	.	H	α-helix	trans	-59.6	-38.7	177.3	-23.2	33.6	0	0	0	114.4	Q686 W687 I688	P684-Q686 VanDerWaalsContact C-N 3.35Å; P684-Q686 PolarHBondContact O-N 2.98Å; P684-W687 WeakPolarHBondContact O-CB 3.39Å; P684-W687 PolarHBondContact O-N 3.02Å; P684-I688 WeakPolarHBondContact O-CG1 3.41Å; P684-I688 PolarHBondContact O-N 3.07Å
685	I	93	Very high	91.4	Very high	60 Å²	60	46.9 Å²	46.9	31%	0.308	27%	0.27	S	S	.	.	H	α-helix	trans	-63.7	-45.4	-179.6	-60.1	171.8	0	0	0	109.6	A625 V673 M676 G682 G683 W687 I688 L689	A625-I685 HydrophobicContact CB-CD1 4.44Å; V673-I685 HydrophobicContact CG1-CG2 3.82Å; M676-I685 HydrophobicContact CE-CD1 4.37Å; G682-I685 WeakPolarHBondContact O-CB 3.3Å; G682-I685 PolarHBondContact O-N 3.17Å; G683-I685 PolarHBondContact O-N 2.96Å; I685-W687 VanDerWaalsContact C-N 3.33Å; I685-W687 PolarHBondContact O-N 3.08Å; I685-I688 PolarHBondContact O-N 2.68Å; I685-L689 HydrophobicContact CG2-CD1 3.74Å; I685-L689 HydrophobicContact CG2-CG 4.36Å; I685-L689 WeakPolarHBondContact O-CB 3.39Å; I685-L689 VanDerWaalsContact O-CG 3.28Å; I685-L689 WeakPolarHBondContact O-CG 3.22Å; I685-L689 PolarHBondContact O-N 3.37Å
686	Q	92.1	Very high	91.3	Very high	56 Å²	56	47 Å²	47	26%	0.262	27%	0.27	S	S	.	.	H	α-helix	trans	-62.8	-41.5	175.3	179.9	179.1	-2.7	0	0	111.4	C677 G682 G683 P684 L689 T690	C677-Q686 HydrophobicContact CB-CB 4.43Å; C677-Q686 HydrophobicContact CB-CG 4.33Å; C677-Q686 PolarHBondContact O-NE2 2.92Å; G682-Q686 PolarHBondContact O-N 2.86Å; G682-Q686 VanDerWaalsContact O-N 3.14Å; G683-Q686 PolarHBondContact O-N 3.19Å; P684-Q686 VanDerWaalsContact C-N 3.35Å; P684-Q686 PolarHBondContact O-N 2.98Å; Q686-L689 PolarHBondContact O-N 2.86Å; Q686-T690 HydrophobicContact CG-CG2 4.19Å; Q686-T690 VanDerWaalsContact O-CB 3.32Å; Q686-T690 WeakPolarHBondContact O-CB 3.24Å; Q686-T690 WeakPolarHBondContact O-CG2 3.29Å; Q686-T690 PolarHBondContact O-N 3.36Å; Q686-T690 VanDerWaalsContact O-N 3.08Å; Q686-T690 PolarHBondContact O-OG1 2.92Å
687	W	92.9	Very high	91.3	Very high	169 Å²	169	48.1 Å²	48.1	64%	0.64	28%	0.277	S	S	*	.	H	α-helix	trans	-58.5	-51.5	177.8	173.8	75.6	0	0	0	111.7	G683 P684 I685 T690 L691	G683-W687 PolarHBondContact O-N 2.84Å; P684-W687 WeakPolarHBondContact O-CB 3.39Å; P684-W687 PolarHBondContact O-N 3.02Å; I685-W687 VanDerWaalsContact C-N 3.33Å; I685-W687 PolarHBondContact O-N 3.08Å; W687-T690 PolarHBondContact O-N 3.34Å; W687-T690 PolarHBondContact O-OG1 3.47Å; W687-L691 HydrophobicContact CZ2-CD2 4.32Å; W687-L691 PolarHBondContact O-N 2.74Å
688	I	95.8	Very high	91.4	Very high	78 Å²	78	48 Å²	48	40%	0.4	28%	0.277	S	S	.	.	H	α-helix	trans	-59.5	-52.8	177.9	-64.5	172.8	0	0	0	110.3	P684 I685 T690 L691 F694	P684-I688 WeakPolarHBondContact O-CG1 3.41Å; P684-I688 PolarHBondContact O-N 3.07Å; I685-I688 PolarHBondContact O-N 2.68Å; I688-T690 PolarHBondContact O-N 2.86Å; I688-T690 VanDerWaalsContact O-N 3.1Å; I688-L691 WeakPolarHBondContact O-CB 3.28Å; I688-L691 WeakPolarHBondContact O-CD1 3.44Å; I688-L691 WeakPolarHBondContact O-CG 3.28Å; I688-L691 PolarHBondContact O-N 2.89Å; I688-F694 WeakPolarHBondContact O-CE2 3.29Å
689	L	95.1	Very high	91.4	Very high	14 Å²	14	51.2 Å²	51.2	7%	0.073	29%	0.288	C	S	.	.	H	α-helix	trans	-68.3	-13.8	-173.6	-66.5	177.4	0	0	0	114.1	C363 G366 I367 L370 V673 I685 Q686	C363-L689 HydrophobicContact CB-CB 3.78Å; C363-L689 HydrophobicContact CB-CD1 4.13Å; G366-L689 WeakPolarHBondContact CA-O 3.46Å; G366-L689 PolarHBondContact N-O 2.75Å; I367-L689 HydrophobicContact CD1-CD1 4.18Å; I367-L689 HydrophobicContact CG1-CD1 3.92Å; I367-L689 HydrophobicContact CG1-CD2 4.02Å; L370-L689 HydrophobicContact CD1-CD2 3.75Å; V673-L689 HydrophobicContact CG1-CD1 3.9Å; I685-L689 HydrophobicContact CG2-CD1 3.74Å; I685-L689 HydrophobicContact CG2-CG 4.36Å; I685-L689 WeakPolarHBondContact O-CB 3.39Å; I685-L689 VanDerWaalsContact O-CG 3.28Å; I685-L689 WeakPolarHBondContact O-CG 3.22Å; I685-L689 PolarHBondContact O-N 3.37Å; Q686-L689 PolarHBondContact O-N 2.86Å
690	T	92.6	Very high	91.7	Very high	38 Å²	38	50.6 Å²	50.6	23%	0.233	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.8	8.5	-179.8	61.8	0	0	0	0	113.9	R346 M362 C363 Q686 W687 I688	R346-T690 PolarHBondContact NH2-O 3.15Å; M362-T690 HydrophobicContact CB-CG2 3.92Å; C363-T690 HydrophobicContact CB-CG2 4.39Å; Q686-T690 HydrophobicContact CG-CG2 4.19Å; Q686-T690 VanDerWaalsContact O-CB 3.32Å; Q686-T690 WeakPolarHBondContact O-CB 3.24Å; Q686-T690 WeakPolarHBondContact O-CG2 3.29Å; Q686-T690 PolarHBondContact O-N 3.36Å; Q686-T690 VanDerWaalsContact O-N 3.08Å; Q686-T690 PolarHBondContact O-OG1 2.92Å; W687-T690 PolarHBondContact O-N 3.34Å; W687-T690 PolarHBondContact O-OG1 3.47Å; I688-T690 PolarHBondContact O-N 2.86Å; I688-T690 VanDerWaalsContact O-N 3.1Å
691	L	92.4	Very high	92.2	Very high	59 Å²	59	49 Å²	49	31%	0.309	27%	0.267	S	S	.	.			trans	-53.8	140.6	174.2	-70.5	172.7	0	0	0	111.4	W687 I688 V693 F694	W687-L691 HydrophobicContact CZ2-CD2 4.32Å; W687-L691 PolarHBondContact O-N 2.74Å; I688-L691 WeakPolarHBondContact O-CB 3.28Å; I688-L691 WeakPolarHBondContact O-CD1 3.44Å; I688-L691 WeakPolarHBondContact O-CG 3.28Å; I688-L691 PolarHBondContact O-N 2.89Å; L691-V693 HydrophobicContact CB-CG1 3.94Å; L691-V693 PolarHBondContact O-N 3.46Å; L691-F694 HydrophobicContact CB-CD2 4.17Å; L691-F694 HydrophobicContact CB-CE2 4.23Å; L691-F694 HydrophobicContact CD1-CE2 4.36Å; L691-F694 PolarHBondContact O-N 3.36Å
692	S	89.3	Confident	92.5	Very high	80 Å²	80	49.8 Å²	49.8	56%	0.559	27%	0.268	S	S	*	.	G	3₁₀ helix	trans	-64.6	-26.8	-179.5	46.5	0	0	0	0	113.2	F694 R695	S692-F694 PolarHBondContact O-N 3.38Å; S692-R695 VanDerWaalsContact O-CB 3.25Å; S692-R695 WeakPolarHBondContact O-CB 3.27Å; S692-R695 PolarHBondContact O-N 2.94Å; S692-R695 VanDerWaalsContact O-N 3.12Å
693	V	91.3	Very high	93	Very high	99 Å²	99	49.7 Å²	49.7	60%	0.6	27%	0.267	S	S	*	.	G	3₁₀ helix	trans	-58.3	-31	179.4	70.8	0	0	0	0	112.7	L691 R695 P697	L691-V693 HydrophobicContact CB-CG1 3.94Å; L691-V693 PolarHBondContact O-N 3.46Å; V693-R695 VanDerWaalsContact C-N 3.3Å; V693-R695 PolarHBondContact O-N 2.78Å; V693-P697 WeakPolarHBondContact O-CD 3.49Å
694	F	92.4	Very high	93.5	Very high	20 Å²	20	47.5 Å²	47.5	9%	0.088	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-77.7	-11.7	-179.3	-59.1	-37.9	0	0	0	114.2	D365 F369 I688 L691 S692 V696 S698	D365-F694 HydrophobicContact CB-CB 4.49Å; F369-F694 HydrophobicContact CB-CB 4.37Å; F369-F694 HydrophobicContact CB-CD1 4.01Å; F369-F694 HydrophobicContact CB-CG 4.33Å; F369-F694 AromaticContact CD1-CD1 3.25Å; F369-F694 HydrophobicContact CD1-CD1 3.25Å; F369-F694 AromaticContact CD1-CE1 3.22Å; F369-F694 HydrophobicContact CD1-CE1 3.22Å; F369-F694 HydrophobicContact CD1-CG 4.28Å; F369-F694 HydrophobicContact CD1-CZ 4.18Å; F369-F694 AromaticContact CE1-CD1 3.79Å; F369-F694 HydrophobicContact CE1-CD1 3.79Å; F369-F694 AromaticContact CE1-CE1 3.48Å; F369-F694 HydrophobicContact CE1-CE1 3.48Å; F369-F694 VanDerWaalsContact CE1-CE1 3.48Å; F369-F694 AromaticContact CG-CD1 3.69Å; F369-F694 HydrophobicContact CG-CD1 3.69Å; F369-F694 HydrophobicContact CG-CE1 4.14Å; F369-F694 HydrophobicContact CG-CG 4.48Å; I688-F694 WeakPolarHBondContact O-CE2 3.29Å; L691-F694 HydrophobicContact CB-CD2 4.17Å; L691-F694 HydrophobicContact CB-CE2 4.23Å; L691-F694 HydrophobicContact CD1-CE2 4.36Å; L691-F694 PolarHBondContact O-N 3.36Å; S692-F694 PolarHBondContact O-N 3.38Å; F694-V696 PolarHBondContact O-N 2.93Å; F694-S698 WeakPolarHBondContact O-CB 3.11Å; F694-S698 PolarHBondContact O-N 2.95Å; F694-S698 PolarHBondContact O-OG 3.23Å
695	R	88.2	Confident	93.8	Very high	56 Å²	56	43.2 Å²	43.2	21%	0.211	22%	0.216	C	C	.	.	H	α-helix	trans	-62	-46.1	-170.9	-174.8	-171.7	-57.3	169.6	4.9	114	S692 V693 S698 R699	S692-R695 VanDerWaalsContact O-CB 3.25Å; S692-R695 WeakPolarHBondContact O-CB 3.27Å; S692-R695 PolarHBondContact O-N 2.94Å; S692-R695 VanDerWaalsContact O-N 3.12Å; V693-R695 VanDerWaalsContact C-N 3.3Å; V693-R695 PolarHBondContact O-N 2.78Å; R695-S698 PolarHBondContact O-OG 3.42Å; R695-S698 VanDerWaalsContact O-OG 3.08Å; R695-R699 WeakPolarHBondContact O-CD 3.22Å; R695-R699 WeakPolarHBondContact O-CG 2.99Å
696	V	92.3	Very high	94	Very high	23 Å²	23	40.4 Å²	40.4	14%	0.139	20%	0.201	C	C	.	.	H	α-helix	trans	-77.4	-49	-177.1	175.6	0	0	0	0	110.3	L341 W342 F694 S698 R699 L700	L341-V696 HydrophobicContact CD2-CG1 4.29Å; L341-V696 HydrophobicContact CG-CG1 4.32Å; W342-V696 HydrophobicContact CD2-CG2 4.11Å; W342-V696 HydrophobicContact CE3-CB 4.43Å; W342-V696 HydrophobicContact CE3-CG1 4.26Å; W342-V696 HydrophobicContact CE3-CG2 3.68Å; W342-V696 HydrophobicContact CZ3-CB 4.4Å; W342-V696 HydrophobicContact CZ3-CG1 4.26Å; W342-V696 HydrophobicContact CZ3-CG2 4.03Å; F694-V696 PolarHBondContact O-N 2.93Å; V696-S698 VanDerWaalsContact C-N 3.29Å; V696-S698 PolarHBondContact O-N 3.31Å; V696-R699 WeakPolarHBondContact O-CB 3.3Å; V696-R699 PolarHBondContact O-N 2.9Å; V696-R699 VanDerWaalsContact O-N 3.08Å; V696-L700 HydrophobicContact CG1-CD1 4.24Å; V696-L700 PolarHBondContact O-N 3.15Å
697	P	94.3	Very high	94.3	Very high	29 Å²	29	38.1 Å²	38.1	19%	0.188	19%	0.191	C	C	.	.	H	α-helix	trans	-57.4	-36.3	174.6	-27.3	36.7	0	0	0	114.4	F369 V693 R699 L700 T701 Y742	F369-P697 HydrophobicContact CD2-CB 3.36Å; F369-P697 HydrophobicContact CD2-CG 4.15Å; F369-P697 HydrophobicContact CE2-CB 3.75Å; F369-P697 HydrophobicContact CE2-CG 4.16Å; F369-P697 HydrophobicContact CG-CB 4.34Å; V693-P697 WeakPolarHBondContact O-CD 3.49Å; P697-R699 PolarHBondContact O-N 2.91Å; P697-L700 PolarHBondContact O-N 3.22Å; P697-T701 PolarHBondContact O-N 3.28Å; P697-T701 VanDerWaalsContact O-N 3.15Å; P697-T701 PolarHBondContact O-OG1 3.26Å; P697-Y742 HydrophobicContact CB-CD1 4.39Å; P697-Y742 HydrophobicContact CB-CE1 3.74Å
698	S	93.1	Very high	94.5	Very high	2 Å²	2	30.1 Å²	30.1	1%	0.014	16%	0.161	C	C	.	.	H	α-helix	trans	-66.5	-24.3	178.5	75.4	0	0	0	0	113.5	D365 F694 R695 V696 T701	D365-S698 VanDerWaalsContact CG-OG 3.3Å; D365-S698 WeakPolarHBondContact O-CB 3.19Å; D365-S698 WeakPolarHBondContact OD1-CB 3.39Å; D365-S698 PolarHBondContact OD1-OG 3.21Å; F694-S698 WeakPolarHBondContact O-CB 3.11Å; F694-S698 PolarHBondContact O-N 2.95Å; F694-S698 PolarHBondContact O-OG 3.23Å; R695-S698 PolarHBondContact O-OG 3.42Å; R695-S698 VanDerWaalsContact O-OG 3.08Å; V696-S698 VanDerWaalsContact C-N 3.29Å; V696-S698 PolarHBondContact O-N 3.31Å; S698-T701 WeakPolarHBondContact CA-OG1 3.31Å; S698-T701 PolarHBondContact O-OG1 3.33Å
699	R	91.7	Very high	94.6	Very high	68 Å²	68	26.4 Å²	26.4	26%	0.257	14%	0.142	S	C	.	.	H	α-helix	trans	-81	-32.5	174.4	-69.2	172	176.2	175.5	-5.4	111.8	L341 S344 R695 V696 P697 T701	L341-R699 HydrophobicContact CD1-CB 3.85Å; L341-R699 PolarHBondContact O-NH1 3.13Å; S344-R699 PolarHBondContact O-NH2 3.34Å; S344-R699 PolarHBondContact OG-NH2 3.35Å; R695-R699 WeakPolarHBondContact O-CD 3.22Å; R695-R699 WeakPolarHBondContact O-CG 2.99Å; V696-R699 WeakPolarHBondContact O-CB 3.3Å; V696-R699 PolarHBondContact O-N 2.9Å; V696-R699 VanDerWaalsContact O-N 3.08Å; P697-R699 PolarHBondContact O-N 2.91Å; R699-T701 VanDerWaalsContact C-N 3.33Å
700	L	96.1	Very high	94.7	Very high	8 Å²	8	27.3 Å²	27.3	4%	0.042	15%	0.146	C	C	.	.	H	α-helix	trans	-82.9	-7	179.2	-63.2	179.1	0	0	0	114	L341 V696 P697 Y702 T703 A704 Y742 A745 T749	L341-L700 HydrophobicContact CD2-CD2 3.97Å; V696-L700 HydrophobicContact CG1-CD1 4.24Å; V696-L700 PolarHBondContact O-N 3.15Å; P697-L700 PolarHBondContact O-N 3.22Å; L700-Y702 VanDerWaalsContact C-N 3.28Å; L700-Y702 PolarHBondContact O-N 3.49Å; L700-Y702 VanDerWaalsContact O-N 3.17Å; L700-T703 PolarHBondContact O-N 2.66Å; L700-T703 VanDerWaalsContact O-N 3.16Å; L700-T703 PolarHBondContact O-OG1 3.2Å; L700-A704 WeakPolarHBondContact O-CB 3.42Å; L700-A704 PolarHBondContact O-N 3.14Å; L700-Y742 HydrophobicContact CB-CD1 4.22Å; L700-Y742 HydrophobicContact CB-CE1 4.45Å; L700-Y742 HydrophobicContact CD1-CD1 4.33Å; L700-A745 HydrophobicContact CB-CB 4.29Å; L700-T749 HydrophobicContact CD2-CG2 3.88Å; L700-T749 VanDerWaalsContact CD2-OG1 3.24Å; L700-T749 WeakPolarHBondContact CD2-OG1 3.23Å
701	T	96.2	Very high	95	Very high	8 Å²	8	25.9 Å²	25.9	5%	0.049	14%	0.138	C	C	.	.	H	α-helix	trans	-55.1	-38.8	-169.8	-57.5	0	0	0	0	113.6	M372 F417 P697 S698 R699 A704 Y705	M372-T701 HydrophobicContact CB-CG2 3.82Å; M372-T701 HydrophobicContact CG-CG2 3.91Å; M372-T701 HydrophobicContact SD-CG2 4.01Å; F417-T701 HydrophobicContact CE1-CG2 3.52Å; F417-T701 HydrophobicContact CZ-CG2 3.52Å; P697-T701 PolarHBondContact O-N 3.28Å; P697-T701 VanDerWaalsContact O-N 3.15Å; P697-T701 PolarHBondContact O-OG1 3.26Å; S698-T701 WeakPolarHBondContact CA-OG1 3.31Å; S698-T701 PolarHBondContact O-OG1 3.33Å; R699-T701 VanDerWaalsContact C-N 3.33Å; T701-A704 PolarHBondContact O-N 3.34Å; T701-Y705 WeakPolarHBondContact O-CB 3.34Å; T701-Y705 PolarHBondContact O-N 3.42Å
702	Y	96.3	Very high	95.2	Very high	32 Å²	32	23 Å²	23	13%	0.125	12%	0.123	C	C	.	.	H	α-helix	trans	-65.1	-50.4	178.6	172.4	-116.8	0	0	0	112.2	L457 A460 L519 L700 A704 Y705 L706 E753	L457-Y702 HydrophobicContact CD2-CD1 4.17Å; L457-Y702 HydrophobicContact CD2-CD2 4Å; L457-Y702 HydrophobicContact CD2-CE1 3.84Å; L457-Y702 HydrophobicContact CD2-CE2 3.74Å; L457-Y702 HydrophobicContact CD2-CG 4.2Å; L457-Y702 PolarHBondContact O-OH 2.91Å; A460-Y702 HydrophobicContact CB-CD1 4.45Å; A460-Y702 HydrophobicContact CB-CE1 3.81Å; L519-Y702 HydrophobicContact CD1-CE2 3.9Å; L519-Y702 HydrophobicContact CD2-CD2 4.13Å; L519-Y702 HydrophobicContact CD2-CE2 3.59Å; L519-Y702 HydrophobicContact CG-CE2 4.42Å; L700-Y702 VanDerWaalsContact C-N 3.28Å; L700-Y702 PolarHBondContact O-N 3.49Å; L700-Y702 VanDerWaalsContact O-N 3.17Å; Y702-A704 VanDerWaalsContact C-N 3.33Å; Y702-A704 PolarHBondContact O-N 3.49Å; Y702-Y705 VanDerWaalsContact O-CB 3.31Å; Y702-Y705 WeakPolarHBondContact O-CB 3.42Å; Y702-Y705 PolarHBondContact O-N 2.98Å; Y702-Y705 VanDerWaalsContact O-N 3.15Å; Y702-L706 HydrophobicContact CD1-CD1 4.43Å; Y702-L706 HydrophobicContact CE1-CD1 3.9Å; Y702-L706 HydrophobicContact CE2-CD1 4.22Å; Y702-L706 HydrophobicContact CE2-CD2 4.49Å; Y702-L706 HydrophobicContact CE2-CG 4.29Å; Y702-L706 PolarHBondContact O-N 3.26Å; Y702-L706 VanDerWaalsContact O-N 3.1Å; Y702-E753 WeakPolarHBondContact CD1-OE1 3.17Å
703	T	97.7	Very high	95.4	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-66.7	-34.6	177.1	49.9	0	0	0	0	112.5	A460 L700 Y705 L706 V707 A745 V748 T749	A460-T703 HydrophobicContact CB-CG2 4.17Å; L700-T703 PolarHBondContact O-N 2.66Å; L700-T703 VanDerWaalsContact O-N 3.16Å; L700-T703 PolarHBondContact O-OG1 3.2Å; T703-Y705 VanDerWaalsContact C-N 3.3Å; T703-Y705 PolarHBondContact O-N 2.94Å; T703-L706 PolarHBondContact O-N 3.44Å; T703-V707 WeakPolarHBondContact O-CG2 3.49Å; T703-V707 PolarHBondContact O-N 3.48Å; T703-V707 VanDerWaalsContact O-N 3.16Å; T703-A745 WeakPolarHBondContact OG1-CB 3.29Å; T703-A745 PolarHBondContact OG1-O 3.49Å; T703-A745 VanDerWaalsContact OG1-O 3.04Å; T703-V748 HydrophobicContact CG2-CB 4.18Å; T703-V748 HydrophobicContact CG2-CG1 3.73Å; T703-T749 WeakPolarHBondContact CG2-OG1 3.43Å; T703-T749 PolarHBondContact OG1-OG1 3.42Å
704	A	98.3	Very high	95.6	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-61.3	-41.5	171.9	0	0	0	0	0	110.8	M372 L700 T701 Y702 L706 V707 H708 T741 Y742 A745	M372-A704 HydrophobicContact CE-CB 4.15Å; L700-A704 WeakPolarHBondContact O-CB 3.42Å; L700-A704 PolarHBondContact O-N 3.14Å; T701-A704 PolarHBondContact O-N 3.34Å; Y702-A704 VanDerWaalsContact C-N 3.33Å; Y702-A704 PolarHBondContact O-N 3.49Å; A704-L706 VanDerWaalsContact C-N 3.3Å; A704-L706 PolarHBondContact O-N 3.46Å; A704-V707 PolarHBondContact O-N 3.38Å; A704-H708 WeakPolarHBondContact O-CB 3.45Å; A704-H708 PolarHBondContact O-N 2.93Å; A704-H708 PolarHBondContact O-ND1 2.85Å; A704-H708 VanDerWaalsContact O-ND1 3.09Å; A704-T741 HydrophobicContact CB-CG2 3.85Å; A704-Y742 HydrophobicContact CB-CD1 4.45Å; A704-Y742 HydrophobicContact CB-CE1 4.25Å; A704-A745 HydrophobicContact CB-CB 3.83Å
705	Y	98.1	Very high	95.8	Very high	9 Å²	9	21.1 Å²	21.1	4%	0.035	10%	0.099	C	C	.	.	H	α-helix	trans	-60.4	-39.1	175	-176.4	-96.8	0	0	0	112.5	M372 I375 W515 Y518 L519 T701 Y702 T703 H708	M372-Y705 VanDerWaalsContact CE-CA 3.49Å; M372-Y705 HydrophobicContact CE-CD2 4.34Å; M372-Y705 HydrophobicContact SD-CD2 4.23Å; I375-Y705 HydrophobicContact CD1-CD2 4.33Å; I375-Y705 HydrophobicContact CD1-CE2 4.31Å; I375-Y705 HydrophobicContact CG2-CD2 4.41Å; I375-Y705 HydrophobicContact CG2-CE2 4.23Å; W515-Y705 PolarHBondContact O-OH 3.46Å; Y518-Y705 VanDerWaalsContact CB-OH 3.24Å; Y518-Y705 WeakPolarHBondContact CB-OH 3.34Å; Y518-Y705 HydrophobicContact CD1-CD1 4.14Å; Y518-Y705 AromaticContact CD1-CE1 3.52Å; Y518-Y705 HydrophobicContact CD1-CE1 3.52Å; Y518-Y705 HydrophobicContact CD1-CE2 4.39Å; Y518-Y705 AromaticContact CD1-CZ 3.66Å; Y518-Y705 HydrophobicContact CE1-CE1 4.32Å; Y518-Y705 HydrophobicContact CG-CE1 4.31Å; L519-Y705 HydrophobicContact CG-CE1 4.32Å; T701-Y705 WeakPolarHBondContact O-CB 3.34Å; T701-Y705 PolarHBondContact O-N 3.42Å; Y702-Y705 VanDerWaalsContact O-CB 3.31Å; Y702-Y705 WeakPolarHBondContact O-CB 3.42Å; Y702-Y705 PolarHBondContact O-N 2.98Å; Y702-Y705 VanDerWaalsContact O-N 3.15Å; T703-Y705 VanDerWaalsContact C-N 3.3Å; T703-Y705 PolarHBondContact O-N 2.94Å; Y705-H708 WeakPolarHBondContact CA-ND1 3.27Å; Y705-H708 AromaticContact CD2-CE1 3.75Å; Y705-H708 PolarHBondContact O-CE1 2.94Å; Y705-H708 PolarHBondContact O-ND1 2.93Å
706	L	98	Very high	96.1	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-67.7	-39.1	178.3	-69.2	174.9	0	0	0	113.3	A460 Y461 V464 M513 W515 L519 Y702 T703 A704	A460-L706 HydrophobicContact CB-CD1 3.92Å; Y461-L706 HydrophobicContact CD2-CD2 3.86Å; V464-L706 HydrophobicContact CB-CB 4.41Å; V464-L706 HydrophobicContact CG1-CB 4.26Å; V464-L706 HydrophobicContact CG2-CB 4.07Å; V464-L706 HydrophobicContact CG2-CD1 4.3Å; M513-L706 HydrophobicContact CE-CD2 4.44Å; W515-L706 PolarHBondContact NE1-O 3.34Å; L519-L706 HydrophobicContact CD1-CD2 3.49Å; L519-L706 VanDerWaalsContact CD1-CD2 3.49Å; Y702-L706 HydrophobicContact CD1-CD1 4.43Å; Y702-L706 HydrophobicContact CE1-CD1 3.9Å; Y702-L706 HydrophobicContact CE2-CD1 4.22Å; Y702-L706 HydrophobicContact CE2-CD2 4.49Å; Y702-L706 HydrophobicContact CE2-CG 4.29Å; Y702-L706 PolarHBondContact O-N 3.26Å; Y702-L706 VanDerWaalsContact O-N 3.1Å; T703-L706 PolarHBondContact O-N 3.44Å; A704-L706 VanDerWaalsContact C-N 3.3Å; A704-L706 PolarHBondContact O-N 3.46Å
707	V	98.3	Very high	96.1	Very high	9 Å²	9	18.3 Å²	18.3	6%	0.055	9%	0.088	C	C	.	.	H	α-helix	trans	-97.6	-24.5	-169	-55.9	0	0	0	0	114.7	V464 T703 A704 P709 I710 V711 T741 L744 V748	V464-V707 HydrophobicContact CG1-CG1 4.5Å; V464-V707 HydrophobicContact CG2-CG1 3.92Å; T703-V707 WeakPolarHBondContact O-CG2 3.49Å; T703-V707 PolarHBondContact O-N 3.48Å; T703-V707 VanDerWaalsContact O-N 3.16Å; A704-V707 PolarHBondContact O-N 3.38Å; V707-P709 VanDerWaalsContact C-CD 3.44Å; V707-I710 WeakPolarHBondContact O-CB 3.14Å; V707-I710 PolarHBondContact O-N 3.01Å; V707-I710 VanDerWaalsContact O-N 3.07Å; V707-V711 PolarHBondContact O-N 3.49Å; V707-V711 VanDerWaalsContact O-N 3.13Å; V707-T741 HydrophobicContact CG2-CG2 4.07Å; V707-L744 HydrophobicContact CB-CB 4.47Å; V707-L744 HydrophobicContact CG2-CB 4.03Å; V707-V748 HydrophobicContact CG1-CG2 4.2Å
708	H	97.9	Very high	96	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-56.7	-38.7	-173.3	74	-78.7	0	0	0	114.8	M372 I376 H379 A704 Y705 I710 V711 I712 T741	M372-H708 HydrophobicContact CE-CB 4.43Å; M372-H708 WeakPolarHBondContact CE-ND1 3.19Å; I376-H708 HydrophobicContact CD1-CB 4.49Å; I376-H708 HydrophobicContact CG1-CB 4.08Å; H379-H708 AromaticContact CE1-NE2 3.69Å; H379-H708 AromaticContact CG-NE2 3.87Å; H379-H708 AromaticContact ND1-CD2 3.73Å; H379-H708 AromaticContact ND1-CE1 3.87Å; H379-H708 AromaticContact ND1-NE2 2.84Å; H379-H708 PolarHBondContact ND1-NE2 3.1Å; A704-H708 WeakPolarHBondContact O-CB 3.45Å; A704-H708 PolarHBondContact O-N 2.93Å; A704-H708 PolarHBondContact O-ND1 2.85Å; A704-H708 VanDerWaalsContact O-ND1 3.09Å; Y705-H708 WeakPolarHBondContact CA-ND1 3.27Å; Y705-H708 AromaticContact CD2-CE1 3.75Å; Y705-H708 PolarHBondContact O-CE1 2.94Å; Y705-H708 PolarHBondContact O-ND1 2.93Å; H708-I710 VanDerWaalsContact C-N 3.3Å; H708-I710 PolarHBondContact O-N 3.11Å; H708-V711 PolarHBondContact O-N 3.5Å; H708-I712 VanDerWaalsContact O-CG1 3.27Å; H708-I712 WeakPolarHBondContact O-CG1 3.48Å; H708-I712 PolarHBondContact O-N 3.1Å; H708-T741 HydrophobicContact CB-CG2 3.56Å
709	P	97.3	Very high	95.9	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-70.6	-32.3	-179.9	-22.5	41.9	0	0	0	110.9	F383 W515 V707 V711 I712 L713	F383-P709 HydrophobicContact CD2-CB 4.36Å; F383-P709 HydrophobicContact CE2-CB 3.65Å; F383-P709 HydrophobicContact CE2-CG 4.2Å; F383-P709 HydrophobicContact CZ-CB 3.86Å; W515-P709 HydrophobicContact CB-CG 4.24Å; W515-P709 HydrophobicContact CD2-CB 3.68Å; W515-P709 HydrophobicContact CD2-CG 3.44Å; W515-P709 VanDerWaalsContact CD2-CG 3.44Å; W515-P709 HydrophobicContact CE3-CB 3.47Å; W515-P709 VanDerWaalsContact CE3-CB 3.47Å; W515-P709 HydrophobicContact CE3-CG 3.76Å; W515-P709 HydrophobicContact CG-CB 4.4Å; W515-P709 HydrophobicContact CG-CG 3.67Å; W515-P709 HydrophobicContact CH2-CB 3.82Å; W515-P709 HydrophobicContact CZ2-CB 3.96Å; W515-P709 HydrophobicContact CZ2-CG 4.21Å; W515-P709 HydrophobicContact CZ3-CB 3.56Å; W515-P709 HydrophobicContact CZ3-CG 4.3Å; V707-P709 VanDerWaalsContact C-CD 3.44Å; P709-V711 VanDerWaalsContact C-N 3.32Å; P709-V711 PolarHBondContact O-N 3.43Å; P709-I712 PolarHBondContact O-N 3.42Å; P709-L713 VanDerWaalsContact O-CB 3.26Å; P709-L713 WeakPolarHBondContact O-CB 3.25Å; P709-L713 WeakPolarHBondContact O-CG 3.28Å; P709-L713 PolarHBondContact O-N 3.4Å
710	I	97.2	Very high	95.7	Very high	33 Å²	33	19.7 Å²	19.7	17%	0.169	10%	0.102	C	C	.	.	H	α-helix	trans	-63.2	-42.4	175	-53.6	176.2	0	0	0	109.9	V464 Y468 F472 W515 V707 H708 F714	V464-I710 HydrophobicContact CG1-CD1 3.56Å; Y468-I710 HydrophobicContact CD2-CD1 3.9Å; Y468-I710 HydrophobicContact CD2-CG1 3.87Å; Y468-I710 HydrophobicContact CD2-CG2 4.11Å; Y468-I710 HydrophobicContact CE2-CG1 4.27Å; Y468-I710 HydrophobicContact CG-CD1 4.16Å; F472-I710 HydrophobicContact CD2-CG2 3.73Å; F472-I710 HydrophobicContact CE2-CG2 3.81Å; W515-I710 HydrophobicContact CH2-CG1 3.94Å; W515-I710 HydrophobicContact CZ2-CD1 4.22Å; W515-I710 HydrophobicContact CZ2-CG1 3.67Å; V707-I710 WeakPolarHBondContact O-CB 3.14Å; V707-I710 PolarHBondContact O-N 3.01Å; V707-I710 VanDerWaalsContact O-N 3.07Å; H708-I710 VanDerWaalsContact C-N 3.3Å; H708-I710 PolarHBondContact O-N 3.11Å; I710-F714 VanDerWaalsContact O-CB 3.23Å; I710-F714 WeakPolarHBondContact O-CB 3.46Å; I710-F714 PolarHBondContact O-N 3.47Å
711	V	97.9	Very high	95.5	Very high	8 Å²	8	24.5 Å²	24.5	5%	0.048	13%	0.128	C	C	.	.	H	α-helix	trans	-63	-47	175.2	177.7	0	0	0	0	111.1	V707 H708 P709 F714 I715 V737 I740 L744	V707-V711 PolarHBondContact O-N 3.49Å; V707-V711 VanDerWaalsContact O-N 3.13Å; H708-V711 PolarHBondContact O-N 3.5Å; P709-V711 VanDerWaalsContact C-N 3.32Å; P709-V711 PolarHBondContact O-N 3.43Å; V711-F714 PolarHBondContact O-N 2.92Å; V711-I715 HydrophobicContact CG1-CD1 4.03Å; V711-I715 WeakPolarHBondContact O-CG1 3.34Å; V711-I715 PolarHBondContact O-N 3.48Å; V711-I715 VanDerWaalsContact O-N 3.11Å; V711-V737 HydrophobicContact CG1-CB 4.48Å; V711-V737 HydrophobicContact CG1-CG1 4.22Å; V711-V737 HydrophobicContact CG1-CG2 4.31Å; V711-I740 HydrophobicContact CB-CG2 4.5Å; V711-I740 HydrophobicContact CG1-CB 3.96Å; V711-I740 HydrophobicContact CG1-CG2 3.63Å; V711-I740 HydrophobicContact CG2-CG2 3.97Å; V711-L744 HydrophobicContact CG2-CD1 3.56Å
712	I	97	Very high	95.3	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-60.5	-50.2	178.8	-66.5	162.1	0	0	0	110.3	H379 F383 H708 P709 F714 I715 A716 M733 V737	H379-I712 HydrophobicContact CB-CD1 3.89Å; F383-I712 HydrophobicContact CB-CG2 3.59Å; F383-I712 HydrophobicContact CD2-CD1 4.39Å; F383-I712 HydrophobicContact CD2-CG2 4.22Å; F383-I712 HydrophobicContact CG-CG2 4.3Å; H708-I712 VanDerWaalsContact O-CG1 3.27Å; H708-I712 WeakPolarHBondContact O-CG1 3.48Å; H708-I712 PolarHBondContact O-N 3.1Å; P709-I712 PolarHBondContact O-N 3.42Å; I712-F714 VanDerWaalsContact C-N 3.34Å; I712-F714 PolarHBondContact O-N 3.29Å; I712-I715 PolarHBondContact O-N 2.89Å; I712-A716 VanDerWaalsContact O-CB 3.24Å; I712-A716 WeakPolarHBondContact O-CB 3.28Å; I712-A716 PolarHBondContact O-N 2.86Å; I712-M733 HydrophobicContact CB-CE 4.18Å; I712-M733 HydrophobicContact CG1-CE 4.4Å; I712-M733 HydrophobicContact CG2-CE 3.75Å; I712-V737 HydrophobicContact CD1-CG1 4.21Å; I712-V737 HydrophobicContact CG1-CB 4.36Å; I712-V737 HydrophobicContact CG1-CG1 3.65Å; I712-V737 HydrophobicContact CG1-CG2 3.79Å
713	L	94.9	Very high	95.1	Very high	14 Å²	14	24.4 Å²	24.4	7%	0.073	13%	0.131	C	C	.	.	H	α-helix	trans	-61.7	-41.3	179.1	-72.7	169.4	0	0	0	111.5	F383 F472 M488 W515 P709 I715 A716 L717	F383-L713 HydrophobicContact CB-CD2 4.3Å; F383-L713 HydrophobicContact CD1-CD2 3.87Å; F383-L713 HydrophobicContact CD1-CG 4.27Å; F383-L713 HydrophobicContact CG-CD2 4.31Å; F472-L713 HydrophobicContact CE2-CB 4.35Å; F472-L713 HydrophobicContact CZ-CB 3.78Å; M488-L713 HydrophobicContact CE-CD1 4.27Å; W515-L713 HydrophobicContact CH2-CD1 4.46Å; W515-L713 HydrophobicContact CZ3-CD1 4.27Å; P709-L713 VanDerWaalsContact O-CB 3.26Å; P709-L713 WeakPolarHBondContact O-CB 3.25Å; P709-L713 WeakPolarHBondContact O-CG 3.28Å; P709-L713 PolarHBondContact O-N 3.4Å; L713-I715 PolarHBondContact O-N 3.22Å; L713-A716 PolarHBondContact O-N 3.49Å; L713-L717 HydrophobicContact CB-CD1 4.16Å; L713-L717 HydrophobicContact CD2-CD1 4.15Å; L713-L717 WeakPolarHBondContact O-CB 3.06Å; L713-L717 WeakPolarHBondContact O-CG 3.46Å; L713-L717 PolarHBondContact O-N 2.87Å
714	F	95.5	Very high	94.8	Very high	86 Å²	86	29.9 Å²	29.9	38%	0.377	16%	0.159	S	C	.	.	H	α-helix	trans	-59	-47	176.9	176.3	-97.2	0	0	0	111.9	F472 A475 Y481 I710 V711 I712 G718	F472-F714 HydrophobicContact CE2-CB 4.24Å; A475-F714 HydrophobicContact CB-CD2 4.22Å; A475-F714 HydrophobicContact CB-CE2 4.05Å; Y481-F714 HydrophobicContact CE2-CD2 4.37Å; I710-F714 VanDerWaalsContact O-CB 3.23Å; I710-F714 WeakPolarHBondContact O-CB 3.46Å; I710-F714 PolarHBondContact O-N 3.47Å; V711-F714 PolarHBondContact O-N 2.92Å; I712-F714 VanDerWaalsContact C-N 3.34Å; I712-F714 PolarHBondContact O-N 3.29Å; F714-G718 WeakPolarHBondContact O-CA 3.35Å; F714-G718 PolarHBondContact O-N 3.02Å
715	I	95.2	Very high	94.6	Very high	59 Å²	59	30 Å²	30	30%	0.303	16%	0.16	S	C	.	.	H	α-helix	trans	-70.3	-44.5	179.5	-64.1	167.6	0	0	0	110.8	V711 I712 L713 S719 M733 V737 I740	V711-I715 HydrophobicContact CG1-CD1 4.03Å; V711-I715 WeakPolarHBondContact O-CG1 3.34Å; V711-I715 PolarHBondContact O-N 3.48Å; V711-I715 VanDerWaalsContact O-N 3.11Å; I712-I715 PolarHBondContact O-N 2.89Å; L713-I715 PolarHBondContact O-N 3.22Å; I715-S719 PolarHBondContact O-N 3.23Å; I715-M733 HydrophobicContact CB-CE 3.9Å; I715-M733 HydrophobicContact CB-SD 4.28Å; I715-M733 HydrophobicContact CD1-CE 4.46Å; I715-M733 HydrophobicContact CD1-SD 4.48Å; I715-M733 HydrophobicContact CG2-CE 3.89Å; I715-M733 HydrophobicContact CG2-SD 3.65Å; I715-V737 HydrophobicContact CD1-CG2 3.97Å; I715-I740 HydrophobicContact CD1-CD1 4.24Å
716	A	94.1	Very high	94.3	Very high	1 Å²	1	33.2 Å²	33.2	1%	0.008	18%	0.178	C	C	.	.	H	α-helix	trans	-69.3	-49.1	-175.7	0	0	0	0	0	112.4	V387 I712 L713 G718 S719 I723	V387-A716 HydrophobicContact CG2-CB 3.94Å; I712-A716 VanDerWaalsContact O-CB 3.24Å; I712-A716 WeakPolarHBondContact O-CB 3.28Å; I712-A716 PolarHBondContact O-N 2.86Å; L713-A716 PolarHBondContact O-N 3.49Å; A716-G718 VanDerWaalsContact C-N 3.33Å; A716-S719 WeakPolarHBondContact O-CB 3.41Å; A716-S719 PolarHBondContact O-N 2.74Å; A716-I723 HydrophobicContact CB-CD1 4.16Å
717	L	93.5	Very high	94	Very high	18 Å²	18	36.8 Å²	36.8	9%	0.094	20%	0.197	C	C	.	.	H	α-helix	trans	-73.8	-25.8	177.3	-62.8	167.5	0	0	0	112.2	V387 F472 M480 Y481 M488 L713 S719	V387-L717 HydrophobicContact CG1-CD2 3.61Å; V387-L717 HydrophobicContact CG1-CG 4.44Å; F472-L717 HydrophobicContact CE1-CD1 4.14Å; F472-L717 HydrophobicContact CZ-CD1 4.21Å; M480-L717 CarbonylContact C-O 3.58Å; M480-L717 WeakPolarHBondContact CB-O 3.29Å; Y481-L717 HydrophobicContact CD2-CB 3.66Å; Y481-L717 HydrophobicContact CE2-CB 4.12Å; Y481-L717 PolarHBondContact N-O 3.45Å; M488-L717 HydrophobicContact CE-CD1 3.79Å; M488-L717 HydrophobicContact SD-CD1 3.97Å; L713-L717 HydrophobicContact CB-CD1 4.16Å; L713-L717 HydrophobicContact CD2-CD1 4.15Å; L713-L717 WeakPolarHBondContact O-CB 3.06Å; L713-L717 WeakPolarHBondContact O-CG 3.46Å; L713-L717 PolarHBondContact O-N 2.87Å; L717-S719 PolarHBondContact O-N 2.91Å
718	G	92.2	Very high	93.7	Very high	14 Å²	14	42.1 Å²	42.1	14%	0.144	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-6.4	176.2	0	0	0	0	0	113.8	Y476 F714 A716	Y476-G718 VanDerWaalsContact CE1-O 3.24Å; Y476-G718 WeakPolarHBondContact CE1-O 3.35Å; F714-G718 WeakPolarHBondContact O-CA 3.35Å; F714-G718 PolarHBondContact O-N 3.02Å; A716-G718 VanDerWaalsContact C-N 3.33Å
719	S	90.2	Very high	93.5	Very high	39 Å²	39	44.5 Å²	44.5	27%	0.273	24%	0.235	S	C	.	.			trans	-67	134	177.4	-170.1	0	0	0	0	111.6	I715 A716 L717 N721	I715-S719 PolarHBondContact O-N 3.23Å; A716-S719 WeakPolarHBondContact O-CB 3.41Å; A716-S719 PolarHBondContact O-N 2.74Å; L717-S719 PolarHBondContact O-N 2.91Å; S719-N721 VanDerWaalsContact C-N 3.27Å; S719-N721 VanDerWaalsContact CB-O 3.31Å; S719-N721 WeakPolarHBondContact CB-O 3.41Å; S719-N721 PolarHBondContact OG-N 3.37Å; S719-N721 PolarHBondContact OG-O 2.87Å
720	Q	89	Confident	93.3	Very high	76 Å²	76	44.5 Å²	44.5	36%	0.355	24%	0.236	S	C	.	.	S	Bend	trans	-73.5	-22.1	175.9	-62.9	-64.2	-29.6	0	0	112.3	Y476 P479	Y476-Q720 PolarHBondContact OH-NE2 3.23Å; Y476-Q720 VanDerWaalsContact OH-NE2 3.16Å; P479-Q720 VanDerWaalsContact CG-O 3.27Å; P479-Q720 WeakPolarHBondContact CG-O 3.37Å
721	N	90.3	Very high	93.2	Very high	109 Å²	109	46.9 Å²	46.9	58%	0.583	25%	0.248	S	C	*	.	S	Bend	trans	-124	150.7	176.1	-69.4	-55	0	0	0	110.3	S719	S719-N721 VanDerWaalsContact C-N 3.27Å; S719-N721 VanDerWaalsContact CB-O 3.31Å; S719-N721 WeakPolarHBondContact CB-O 3.41Å; S719-N721 PolarHBondContact OG-N 3.37Å; S719-N721 PolarHBondContact OG-O 2.87Å
722	P	91.8	Very high	93.1	Very high	25 Å²	25	50.7 Å²	50.7	16%	0.162	27%	0.271	C	S	.	.			trans	-58.6	142.5	172.2	-22.3	35.8	0	0	0	110.8	N120 L122 V387 N389	N120-P722 HydrophobicContact CB-CB 3.92Å; N120-P722 HydrophobicContact CB-CG 3.51Å; N120-P722 WeakPolarHBondContact O-CG 3.38Å; L122-P722 HydrophobicContact CD1-CG 3.75Å; L122-P722 HydrophobicContact CG-CG 3.91Å; V387-P722 WeakPolarHBondContact O-CA 3.32Å; N389-P722 HydrophobicContact CB-CB 4.02Å; N389-P722 VanDerWaalsContact CG-CB 3.46Å; N389-P722 VanDerWaalsContact ND2-CB 3.32Å; N389-P722 WeakPolarHBondContact ND2-CB 3.27Å; N389-P722 WeakPolarHBondContact ND2-CG 3.32Å
723	I	92.2	Very high	93	Very high	13 Å²	13	51 Å²	51	7%	0.067	27%	0.272	C	S	.	.	B	Isolated β-bridge	trans	-73.6	144.4	-178	-66.4	178	0	0	0	109.7	V387 A388 N389 A716 L725 H729	V387-I723 HydrophobicContact CG2-CB 4.34Å; V387-I723 HydrophobicContact CG2-CD1 3.65Å; V387-I723 HydrophobicContact CG2-CG1 4.04Å; V387-I723 PolarHBondContact O-N 3.38Å; A388-I723 CarbonylContact C-O 3.5Å; A388-I723 WeakPolarHBondContact CA-O 3.47Å; N389-I723 PolarHBondContact N-O 2.99Å; A716-I723 HydrophobicContact CB-CD1 4.16Å; I723-L725 HydrophobicContact CG2-CD2 4.19Å; I723-H729 VanDerWaalsContact CG2-CE1 3.44Å; I723-H729 WeakPolarHBondContact CG2-CE1 3.24Å; I723-H729 WeakPolarHBondContact CG2-NE2 3.49Å
724	L	92.9	Very high	93.1	Very high	114 Å²	114	52.4 Å²	52.4	60%	0.597	28%	0.278	S	S	*	.			trans	-103.4	115.4	162.8	-66.3	174.7	0	0	0	107.7	N389 N390 D726	N389-L724 HydrophobicContact CB-CD2 4.23Å; N390-L724 HydrophobicContact CB-CD2 4.3Å; L724-D726 PolarHBondContact O-N 2.82Å
725	L	92.6	Very high	93.2	Very high	4 Å²	4	53.6 Å²	53.6	2%	0.021	29%	0.287	C	S	.	.			trans	-75	120.5	178	-65.7	171.7	0	0	0	109.5	M385 A388 N390 F394 I723 L730	M385-L725 HydrophobicContact CG-CD1 3.7Å; A388-L725 HydrophobicContact CB-CD1 3.57Å; A388-L725 HydrophobicContact CB-CD2 4.46Å; A388-L725 HydrophobicContact CB-CG 3.63Å; N390-L725 PolarHBondContact ND2-N 3.29Å; N390-L725 PolarHBondContact ND2-O 3.22Å; N390-L725 PolarHBondContact OD1-N 2.9Å; F394-L725 HydrophobicContact CB-CB 4.12Å; F394-L725 HydrophobicContact CB-CD1 4.43Å; F394-L725 HydrophobicContact CD1-CB 4.17Å; F394-L725 HydrophobicContact CD1-CD1 4.02Å; F394-L725 HydrophobicContact CD2-CB 3.59Å; F394-L725 VanDerWaalsContact CD2-O 3.27Å; F394-L725 WeakPolarHBondContact CD2-O 3.24Å; F394-L725 HydrophobicContact CE2-CB 4.03Å; F394-L725 HydrophobicContact CG-CB 3.67Å; F394-L725 HydrophobicContact CG-CD1 4.18Å; I723-L725 HydrophobicContact CG2-CD2 4.19Å; L725-L730 HydrophobicContact CD2-CD2 4.04Å
726	D	92.2	Very high	93.3	Very high	75 Å²	75	52.7 Å²	52.7	40%	0.401	29%	0.288	S	S	.	.			trans	-145.6	173.9	167	65.9	18.3	0	0	0	109.4	L724 L728 H729 L730	L724-D726 PolarHBondContact O-N 2.82Å; D726-L728 VanDerWaalsContact C-N 3.26Å; D726-L728 PolarHBondContact O-N 2.96Å; D726-L728 PolarHBondContact OD1-N 3.35Å; D726-H729 PolarHBondContact O-N 2.97Å; D726-H729 WeakPolarHBondContact OD1-CB 3.44Å; D726-H729 PolarHBondContact OD1-N 3.31Å; D726-L730 VanDerWaalsContact O-CG 3.27Å; D726-L730 WeakPolarHBondContact O-CG 3.49Å; D726-L730 PolarHBondContact O-N 3.47Å; D726-L730 VanDerWaalsContact O-N 3.16Å
727	D	91.1	Very high	93.5	Very high	75 Å²	75	52.7 Å²	52.7	40%	0.401	29%	0.288	S	S	.	.	H	α-helix	trans	-63.2	-34.1	-176.6	-65	-37.5	0	0	0	112	H398 I731	H398-D727 IonicContact CE1-OD1 3.9Å; H398-D727 PolarHBondContact CE1-OD1 3.38Å; H398-D727 IonicContact CE1-OD2 2.86Å; H398-D727 IonicContact ND1-OD1 3.87Å; H398-D727 PolarHBondContact ND1-OD1 2.9Å; D727-I731 WeakPolarHBondContact O-CD1 3.28Å; D727-I731 VanDerWaalsContact O-CG1 3.23Å; D727-I731 WeakPolarHBondContact O-CG1 3.35Å; D727-I731 PolarHBondContact O-N 3.07Å; D727-I731 VanDerWaalsContact O-N 3.11Å
728	L	93.5	Very high	93.7	Very high	122 Å²	122	54 Å²	54	64%	0.639	30%	0.295	S	S	*	.	H	α-helix	trans	-69.7	-48.9	-179.5	178.2	62	0	0	0	111.4	D726 L730 I731 V732	D726-L728 VanDerWaalsContact C-N 3.26Å; D726-L728 PolarHBondContact O-N 2.96Å; D726-L728 PolarHBondContact OD1-N 3.35Å; L728-L730 VanDerWaalsContact C-N 3.26Å; L728-L730 PolarHBondContact O-N 3.28Å; L728-I731 PolarHBondContact O-N 2.87Å; L728-V732 HydrophobicContact CD1-CG2 4.12Å; L728-V732 HydrophobicContact CG-CG2 4.4Å; L728-V732 WeakPolarHBondContact O-CG2 3.43Å; L728-V732 PolarHBondContact O-N 3.34Å
729	H	93	Very high	93.9	Very high	49 Å²	49	56.8 Å²	56.8	23%	0.227	31%	0.311	C	S	.	.	H	α-helix	trans	-54.9	-45.4	176.4	176.3	77.7	0	0	0	110.5	I723 D726 I731 V732 M733	I723-H729 VanDerWaalsContact CG2-CE1 3.44Å; I723-H729 WeakPolarHBondContact CG2-CE1 3.24Å; I723-H729 WeakPolarHBondContact CG2-NE2 3.49Å; D726-H729 PolarHBondContact O-N 2.97Å; D726-H729 WeakPolarHBondContact OD1-CB 3.44Å; D726-H729 PolarHBondContact OD1-N 3.31Å; H729-I731 PolarHBondContact O-N 3.05Å; H729-V732 PolarHBondContact O-N 3.33Å; H729-M733 WeakPolarHBondContact O-CB 3.33Å; H729-M733 PolarHBondContact O-N 2.92Å
730	L	92.8	Very high	94.3	Very high	1 Å²	1	58.6 Å²	58.6	1%	0.005	32%	0.316	C	S	.	.	H	α-helix	trans	-64.6	-40.6	179.4	-67.8	177	0	0	0	113	I381 F394 L725 D726 L728 F734	I381-L730 HydrophobicContact CB-CD2 4.31Å; I381-L730 HydrophobicContact CD1-CD1 3.76Å; I381-L730 HydrophobicContact CD1-CD2 4.37Å; I381-L730 HydrophobicContact CG1-CD1 3.6Å; I381-L730 HydrophobicContact CG1-CD2 3.37Å; I381-L730 HydrophobicContact CG1-CG 4.02Å; F394-L730 HydrophobicContact CE1-CD1 4.43Å; F394-L730 HydrophobicContact CE2-CD1 4.16Å; F394-L730 HydrophobicContact CZ-CD1 3.57Å; L725-L730 HydrophobicContact CD2-CD2 4.04Å; D726-L730 VanDerWaalsContact O-CG 3.27Å; D726-L730 WeakPolarHBondContact O-CG 3.49Å; D726-L730 PolarHBondContact O-N 3.47Å; D726-L730 VanDerWaalsContact O-N 3.16Å; L728-L730 VanDerWaalsContact C-N 3.26Å; L728-L730 PolarHBondContact O-N 3.28Å; L730-F734 VanDerWaalsContact O-CB 3.28Å; L730-F734 WeakPolarHBondContact O-CB 3.5Å; L730-F734 PolarHBondContact O-N 3.23Å
731	I	94.5	Very high	94.8	Very high	83 Å²	83	55 Å²	55	43%	0.426	30%	0.299	S	S	.	.	H	α-helix	trans	-64.6	-47.1	175.5	-69.7	165.1	0	0	0	110.4	D727 L728 H729 F734 I735	D727-I731 WeakPolarHBondContact O-CD1 3.28Å; D727-I731 VanDerWaalsContact O-CG1 3.23Å; D727-I731 WeakPolarHBondContact O-CG1 3.35Å; D727-I731 PolarHBondContact O-N 3.07Å; D727-I731 VanDerWaalsContact O-N 3.11Å; L728-I731 PolarHBondContact O-N 2.87Å; H729-I731 PolarHBondContact O-N 3.05Å; I731-F734 PolarHBondContact O-N 3.49Å; I731-I735 HydrophobicContact CG2-CD1 3.69Å; I731-I735 HydrophobicContact CG2-CG1 4.46Å; I731-I735 WeakPolarHBondContact O-CB 3.33Å; I731-I735 VanDerWaalsContact O-CG1 3.3Å; I731-I735 WeakPolarHBondContact O-CG1 3.37Å; I731-I735 PolarHBondContact O-N 2.98Å
732	V	96.4	Very high	95.1	Very high	87 Å²	87	51 Å²	51	53%	0.527	28%	0.277	S	S	.	.	H	α-helix	trans	-61.7	-46.4	178.5	171.5	0	0	0	0	110.7	L728 H729 F734 I735 A736	L728-V732 HydrophobicContact CD1-CG2 4.12Å; L728-V732 HydrophobicContact CG-CG2 4.4Å; L728-V732 WeakPolarHBondContact O-CG2 3.43Å; L728-V732 PolarHBondContact O-N 3.34Å; H729-V732 PolarHBondContact O-N 3.33Å; V732-F734 VanDerWaalsContact C-N 3.34Å; V732-F734 PolarHBondContact O-N 3.37Å; V732-I735 PolarHBondContact O-N 3.07Å; V732-A736 WeakPolarHBondContact O-CB 3.26Å; V732-A736 PolarHBondContact O-N 3.47Å
733	M	95.8	Very high	95.4	Very high	7 Å²	7	53.3 Å²	53.3	3%	0.034	29%	0.292	C	S	.	.	H	α-helix	trans	-59.8	-45.2	178	-176	58.3	177	0	0	111.2	C380 I712 I715 H729 A736 V737	C380-M733 HydrophobicContact CB-CG 4.19Å; I712-M733 HydrophobicContact CB-CE 4.18Å; I712-M733 HydrophobicContact CG1-CE 4.4Å; I712-M733 HydrophobicContact CG2-CE 3.75Å; I715-M733 HydrophobicContact CB-CE 3.9Å; I715-M733 HydrophobicContact CB-SD 4.28Å; I715-M733 HydrophobicContact CD1-CE 4.46Å; I715-M733 HydrophobicContact CD1-SD 4.48Å; I715-M733 HydrophobicContact CG2-CE 3.89Å; I715-M733 HydrophobicContact CG2-SD 3.65Å; H729-M733 WeakPolarHBondContact O-CB 3.33Å; H729-M733 PolarHBondContact O-N 2.92Å; M733-A736 PolarHBondContact O-N 3.37Å; M733-V737 HydrophobicContact CE-CG2 3.68Å; M733-V737 HydrophobicContact CG-CG2 4.32Å; M733-V737 WeakPolarHBondContact O-CB 3.39Å; M733-V737 WeakPolarHBondContact O-CG2 3.39Å; M733-V737 PolarHBondContact O-N 3.48Å; M733-V737 HydrophobicContact SD-CG2 3.92Å
734	F	96.7	Very high	95.7	Very high	43 Å²	43	56.1 Å²	56.1	19%	0.189	31%	0.307	C	S	.	.	H	α-helix	trans	-62	-47	175.9	177.3	-109	0	0	0	112.9	N373 I376 Y377 L730 I731 V732 A736 V737 L738	N373-F734 HydrophobicContact CB-CZ 4.23Å; N373-F734 WeakPolarHBondContact O-CE2 3.31Å; I376-F734 HydrophobicContact CB-CE2 4.18Å; I376-F734 HydrophobicContact CG2-CD2 3.95Å; I376-F734 HydrophobicContact CG2-CE2 4Å; Y377-F734 HydrophobicContact CD2-CB 3.86Å; Y377-F734 HydrophobicContact CD2-CD1 4.32Å; Y377-F734 AromaticContact CD2-CD2 3.79Å; Y377-F734 HydrophobicContact CD2-CD2 3.79Å; Y377-F734 HydrophobicContact CD2-CE2 4.43Å; Y377-F734 AromaticContact CD2-CG 3.72Å; Y377-F734 HydrophobicContact CD2-CG 3.72Å; Y377-F734 HydrophobicContact CE2-CB 4.31Å; Y377-F734 HydrophobicContact CE2-CG 4.48Å; Y377-F734 HydrophobicContact CG-CD2 4.31Å; L730-F734 VanDerWaalsContact O-CB 3.28Å; L730-F734 WeakPolarHBondContact O-CB 3.5Å; L730-F734 PolarHBondContact O-N 3.23Å; I731-F734 PolarHBondContact O-N 3.49Å; V732-F734 VanDerWaalsContact C-N 3.34Å; V732-F734 PolarHBondContact O-N 3.37Å; F734-A736 VanDerWaalsContact C-N 3.26Å; F734-A736 PolarHBondContact O-N 2.92Å; F734-V737 PolarHBondContact O-N 3.32Å; F734-L738 HydrophobicContact CE1-CD1 4Å; F734-L738 HydrophobicContact CE2-CD1 4.2Å; F734-L738 HydrophobicContact CZ-CD1 3.64Å; F734-L738 WeakPolarHBondContact O-CB 3.44Å; F734-L738 PolarHBondContact O-N 3.1Å; F734-L738 VanDerWaalsContact O-N 3.08Å
735	I	97.3	Very high	96	Very high	112 Å²	112	50.7 Å²	50.7	57%	0.574	28%	0.279	S	S	*	.	H	α-helix	trans	-64.5	-31.7	178.7	-69.1	171.4	0	0	0	111.5	I731 V732 P739	I731-I735 HydrophobicContact CG2-CD1 3.69Å; I731-I735 HydrophobicContact CG2-CG1 4.46Å; I731-I735 WeakPolarHBondContact O-CB 3.33Å; I731-I735 VanDerWaalsContact O-CG1 3.3Å; I731-I735 WeakPolarHBondContact O-CG1 3.37Å; I731-I735 PolarHBondContact O-N 2.98Å; V732-I735 PolarHBondContact O-N 3.07Å; I735-P739 WeakPolarHBondContact O-CD 3.25Å; I735-P739 WeakPolarHBondContact O-CG 3.08Å
736	A	97.2	Very high	96.2	Very high	40 Å²	40	53.6 Å²	53.6	33%	0.331	29%	0.29	S	S	.	.	H	α-helix	trans	-75.1	-45.9	175.3	0	0	0	0	0	112.6	V732 M733 F734 L738 P739 I740	V732-A736 WeakPolarHBondContact O-CB 3.26Å; V732-A736 PolarHBondContact O-N 3.47Å; M733-A736 PolarHBondContact O-N 3.37Å; F734-A736 VanDerWaalsContact C-N 3.26Å; F734-A736 PolarHBondContact O-N 2.92Å; A736-L738 PolarHBondContact O-N 3.39Å; A736-P739 WeakPolarHBondContact O-CD 3.48Å; A736-I740 WeakPolarHBondContact O-CD1 3.46Å; A736-I740 WeakPolarHBondContact O-CG1 3.39Å
737	V	98.2	Very high	96.4	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-67.6	-38	-175.6	167	0	0	0	0	112.1	I376 V711 I712 I715 M733 F734 I740 T741	I376-V737 HydrophobicContact CG2-CG1 3.72Å; V711-V737 HydrophobicContact CG1-CB 4.48Å; V711-V737 HydrophobicContact CG1-CG1 4.22Å; V711-V737 HydrophobicContact CG1-CG2 4.31Å; I712-V737 HydrophobicContact CD1-CG1 4.21Å; I712-V737 HydrophobicContact CG1-CB 4.36Å; I712-V737 HydrophobicContact CG1-CG1 3.65Å; I712-V737 HydrophobicContact CG1-CG2 3.79Å; I715-V737 HydrophobicContact CD1-CG2 3.97Å; M733-V737 HydrophobicContact CE-CG2 3.68Å; M733-V737 HydrophobicContact CG-CG2 4.32Å; M733-V737 WeakPolarHBondContact O-CB 3.39Å; M733-V737 WeakPolarHBondContact O-CG2 3.39Å; M733-V737 PolarHBondContact O-N 3.48Å; M733-V737 HydrophobicContact SD-CG2 3.92Å; F734-V737 PolarHBondContact O-N 3.32Å; V737-I740 PolarHBondContact O-N 3.02Å; V737-T741 WeakPolarHBondContact CG1-OG1 3.17Å; V737-T741 WeakPolarHBondContact O-CB 3.21Å; V737-T741 PolarHBondContact O-N 2.94Å; V737-T741 PolarHBondContact O-OG1 2.74Å
738	L	97.6	Very high	96.7	Very high	45 Å²	45	51.5 Å²	51.5	24%	0.236	28%	0.279	C	S	.	.	H	α-helix	trans	-57.6	-57.8	-174.2	-171.6	158.1	0	0	0	113.3	N373 F734 A736 I740 T741 Y742	N373-L738 WeakPolarHBondContact OD1-CD1 3.44Å; F734-L738 HydrophobicContact CE1-CD1 4Å; F734-L738 HydrophobicContact CE2-CD1 4.2Å; F734-L738 HydrophobicContact CZ-CD1 3.64Å; F734-L738 WeakPolarHBondContact O-CB 3.44Å; F734-L738 PolarHBondContact O-N 3.1Å; F734-L738 VanDerWaalsContact O-N 3.08Å; A736-L738 PolarHBondContact O-N 3.39Å; L738-I740 PolarHBondContact O-N 3.21Å; L738-T741 PolarHBondContact O-N 3.35Å; L738-Y742 HydrophobicContact CD2-CD2 3.93Å; L738-Y742 HydrophobicContact CD2-CE2 4.17Å; L738-Y742 HydrophobicContact CG-CD2 4.22Å; L738-Y742 HydrophobicContact CG-CE2 4.18Å; L738-Y742 VanDerWaalsContact O-CD2 3.31Å; L738-Y742 WeakPolarHBondContact O-CD2 2.86Å; L738-Y742 PolarHBondContact O-N 3.3Å
739	P	97.5	Very high	96.8	Very high	73 Å²	73	45.9 Å²	45.9	47%	0.474	25%	0.25	S	C	.	.	H	α-helix	trans	-64.7	-38.3	-179.9	25.2	-34.2	0	0	0	112.6	I735 A736 T741 Y742 C743	I735-P739 WeakPolarHBondContact O-CD 3.25Å; I735-P739 WeakPolarHBondContact O-CG 3.08Å; A736-P739 WeakPolarHBondContact O-CD 3.48Å; P739-T741 PolarHBondContact O-N 3.36Å; P739-Y742 PolarHBondContact O-N 3.36Å; P739-C743 WeakPolarHBondContact O-CB 3.31Å; P739-C743 PolarHBondContact O-N 2.78Å
740	I	98.2	Very high	96.9	Very high	77 Å²	77	43.8 Å²	43.8	40%	0.395	24%	0.24	S	C	.	.	H	α-helix	trans	-62.6	-45.8	177.8	-61.4	171.6	0	0	0	110.1	V711 I715 A736 V737 L738 Y742 C743 L744	V711-I740 HydrophobicContact CB-CG2 4.5Å; V711-I740 HydrophobicContact CG1-CB 3.96Å; V711-I740 HydrophobicContact CG1-CG2 3.63Å; V711-I740 HydrophobicContact CG2-CG2 3.97Å; I715-I740 HydrophobicContact CD1-CD1 4.24Å; A736-I740 WeakPolarHBondContact O-CD1 3.46Å; A736-I740 WeakPolarHBondContact O-CG1 3.39Å; V737-I740 PolarHBondContact O-N 3.02Å; L738-I740 PolarHBondContact O-N 3.21Å; I740-Y742 PolarHBondContact O-N 3.23Å; I740-C743 WeakPolarHBondContact O-CB 3.35Å; I740-C743 PolarHBondContact O-N 3.42Å; I740-L744 HydrophobicContact CG2-CD1 4.25Å; I740-L744 WeakPolarHBondContact O-CG 3.08Å; I740-L744 PolarHBondContact O-N 3.22Å
741	T	98.5	Very high	97	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-58.3	-49.5	177.1	-65.5	0	0	0	0	111.3	I376 A704 V707 H708 V737 L738 P739 C743 L744 A745	I376-T741 HydrophobicContact CD1-CG2 4.25Å; A704-T741 HydrophobicContact CB-CG2 3.85Å; V707-T741 HydrophobicContact CG2-CG2 4.07Å; H708-T741 HydrophobicContact CB-CG2 3.56Å; V737-T741 WeakPolarHBondContact CG1-OG1 3.17Å; V737-T741 WeakPolarHBondContact O-CB 3.21Å; V737-T741 PolarHBondContact O-N 2.94Å; V737-T741 PolarHBondContact O-OG1 2.74Å; L738-T741 PolarHBondContact O-N 3.35Å; P739-T741 PolarHBondContact O-N 3.36Å; T741-C743 VanDerWaalsContact C-N 3.33Å; T741-C743 PolarHBondContact O-N 3.41Å; T741-L744 PolarHBondContact O-N 2.85Å; T741-A745 WeakPolarHBondContact O-CB 3.16Å; T741-A745 PolarHBondContact O-N 3.47Å
742	Y	98	Very high	97.1	Very high	26 Å²	26	40.7 Å²	40.7	10%	0.102	23%	0.226	C	C	.	.	H	α-helix	trans	-69.3	-30.5	-179.2	-81.8	-72.8	0	0	0	112.9	F369 P697 L700 A704 L738 P739 I740 Y746	F369-Y742 WeakPolarHBondContact CD2-OH 3.2Å; F369-Y742 HydrophobicContact CE2-CE2 4.2Å; P697-Y742 HydrophobicContact CB-CD1 4.39Å; P697-Y742 HydrophobicContact CB-CE1 3.74Å; L700-Y742 HydrophobicContact CB-CD1 4.22Å; L700-Y742 HydrophobicContact CB-CE1 4.45Å; L700-Y742 HydrophobicContact CD1-CD1 4.33Å; A704-Y742 HydrophobicContact CB-CD1 4.45Å; A704-Y742 HydrophobicContact CB-CE1 4.25Å; L738-Y742 HydrophobicContact CD2-CD2 3.93Å; L738-Y742 HydrophobicContact CD2-CE2 4.17Å; L738-Y742 HydrophobicContact CG-CD2 4.22Å; L738-Y742 HydrophobicContact CG-CE2 4.18Å; L738-Y742 VanDerWaalsContact O-CD2 3.31Å; L738-Y742 WeakPolarHBondContact O-CD2 2.86Å; L738-Y742 PolarHBondContact O-N 3.3Å; P739-Y742 PolarHBondContact O-N 3.36Å; I740-Y742 PolarHBondContact O-N 3.23Å; Y742-Y746 WeakPolarHBondContact O-CB 2.95Å; Y742-Y746 PolarHBondContact O-N 3.14Å
743	C	97.8	Very high	96.8	Very high	73 Å²	73	37.1 Å²	37.1	49%	0.493	20%	0.203	S	C	.	.	H	α-helix	trans	-64.2	-50	172.1	-173.4	0	0	0	0	111.3	P739 I740 T741 A745 Y746 L747	P739-C743 WeakPolarHBondContact O-CB 3.31Å; P739-C743 PolarHBondContact O-N 2.78Å; I740-C743 WeakPolarHBondContact O-CB 3.35Å; I740-C743 PolarHBondContact O-N 3.42Å; T741-C743 VanDerWaalsContact C-N 3.33Å; T741-C743 PolarHBondContact O-N 3.41Å; C743-A745 PolarHBondContact O-N 2.67Å; C743-Y746 WeakPolarHBondContact O-CB 3.23Å; C743-Y746 PolarHBondContact O-N 2.66Å; C743-L747 WeakPolarHBondContact O-CG 3.07Å; C743-L747 PolarHBondContact O-N 3.13Å; C743-L747 VanDerWaalsContact O-N 3.13Å
744	L	98	Very high	96.6	Very high	72 Å²	72	37.2 Å²	37.2	38%	0.377	21%	0.205	S	C	.	.	H	α-helix	trans	-64.8	-40.7	176.4	-67.6	178.7	0	0	0	112	V707 V711 I740 T741 Y746 L747 V748	V707-L744 HydrophobicContact CB-CB 4.47Å; V707-L744 HydrophobicContact CG2-CB 4.03Å; V711-L744 HydrophobicContact CG2-CD1 3.56Å; I740-L744 HydrophobicContact CG2-CD1 4.25Å; I740-L744 WeakPolarHBondContact O-CG 3.08Å; I740-L744 PolarHBondContact O-N 3.22Å; T741-L744 PolarHBondContact O-N 2.85Å; L744-Y746 VanDerWaalsContact C-N 3.28Å; L744-Y746 PolarHBondContact O-N 3.19Å; L744-L747 HydrophobicContact CD2-CD1 4.46Å; L744-L747 PolarHBondContact O-N 2.82Å; L744-L747 VanDerWaalsContact O-N 3.16Å; L744-V748 WeakPolarHBondContact O-CG2 3.29Å; L744-V748 PolarHBondContact O-N 3.15Å
745	A	98.2	Very high	96.3	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-57.8	-42.6	175.8	0	0	0	0	0	111.7	L700 T703 A704 T741 C743 V748 T749	L700-A745 HydrophobicContact CB-CB 4.29Å; T703-A745 WeakPolarHBondContact OG1-CB 3.29Å; T703-A745 PolarHBondContact OG1-O 3.49Å; T703-A745 VanDerWaalsContact OG1-O 3.04Å; A704-A745 HydrophobicContact CB-CB 3.83Å; T741-A745 WeakPolarHBondContact O-CB 3.16Å; T741-A745 PolarHBondContact O-N 3.47Å; C743-A745 PolarHBondContact O-N 2.67Å; A745-V748 PolarHBondContact O-N 2.93Å; A745-T749 VanDerWaalsContact O-CB 3.28Å; A745-T749 WeakPolarHBondContact O-CB 2.96Å; A745-T749 PolarHBondContact O-N 2.92Å; A745-T749 PolarHBondContact O-OG1 3.39Å
746	Y	97.1	Very high	95.9	Very high	65 Å²	65	30.4 Å²	30.4	26%	0.255	17%	0.172	S	C	.	.	H	α-helix	trans	-60.3	-48.3	174.3	166.9	-102.1	0	0	0	111.8	T338 L341 Y742 C743 L744 V748 T749 L750	T338-Y746 HydrophobicContact CG2-CE2 4.23Å; T338-Y746 VanDerWaalsContact CG2-OH 3.23Å; T338-Y746 WeakPolarHBondContact CG2-OH 3.37Å; T338-Y746 PolarHBondContact OG1-OH 3.05Å; L341-Y746 HydrophobicContact CD2-CD2 3.76Å; L341-Y746 HydrophobicContact CD2-CE2 4.02Å; Y742-Y746 WeakPolarHBondContact O-CB 2.95Å; Y742-Y746 PolarHBondContact O-N 3.14Å; C743-Y746 WeakPolarHBondContact O-CB 3.23Å; C743-Y746 PolarHBondContact O-N 2.66Å; L744-Y746 VanDerWaalsContact C-N 3.28Å; L744-Y746 PolarHBondContact O-N 3.19Å; Y746-V748 PolarHBondContact O-N 3.39Å; Y746-T749 PolarHBondContact O-N 2.98Å; Y746-L750 HydrophobicContact CD1-CD1 4.25Å; Y746-L750 HydrophobicContact CD2-CD1 4.41Å; Y746-L750 HydrophobicContact CD2-CG 4.41Å; Y746-L750 HydrophobicContact CE1-CD1 3.63Å; Y746-L750 HydrophobicContact CE2-CD1 3.81Å; Y746-L750 HydrophobicContact CE2-CD2 4.3Å; Y746-L750 HydrophobicContact CE2-CG 4.09Å; Y746-L750 WeakPolarHBondContact O-CG 3.28Å; Y746-L750 PolarHBondContact O-N 2.98Å
747	L	96.7	Very high	95.2	Very high	91 Å²	91	31.1 Å²	31.1	48%	0.476	17%	0.17	S	C	.	.	H	α-helix	trans	-60.7	-45.4	177.8	-64.2	176.9	0	0	0	112.1	C743 L744 T749 L750 A751	C743-L747 WeakPolarHBondContact O-CG 3.07Å; C743-L747 PolarHBondContact O-N 3.13Å; C743-L747 VanDerWaalsContact O-N 3.13Å; L744-L747 HydrophobicContact CD2-CD1 4.46Å; L744-L747 PolarHBondContact O-N 2.82Å; L744-L747 VanDerWaalsContact O-N 3.16Å; L747-T749 VanDerWaalsContact C-N 3.34Å; L747-T749 PolarHBondContact O-N 3.15Å; L747-L750 PolarHBondContact O-N 3.18Å; L747-A751 WeakPolarHBondContact O-CB 3.39Å; L747-A751 PolarHBondContact O-N 3.21Å
748	V	97.3	Very high	94.4	Very high	16 Å²	16	31.9 Å²	31.9	10%	0.097	18%	0.176	C	C	.	.	H	α-helix	trans	-64.1	-40.1	177.6	175.1	0	0	0	0	111.2	A460 L463 V464 T703 V707 L744 A745 Y746 L750 A751 T752	A460-V748 HydrophobicContact CB-CG1 4.07Å; L463-V748 HydrophobicContact CD2-CG1 4.46Å; V464-V748 HydrophobicContact CG2-CG1 4.17Å; V464-V748 HydrophobicContact CG2-CG2 4.35Å; T703-V748 HydrophobicContact CG2-CB 4.18Å; T703-V748 HydrophobicContact CG2-CG1 3.73Å; V707-V748 HydrophobicContact CG1-CG2 4.2Å; L744-V748 WeakPolarHBondContact O-CG2 3.29Å; L744-V748 PolarHBondContact O-N 3.15Å; A745-V748 PolarHBondContact O-N 2.93Å; Y746-V748 PolarHBondContact O-N 3.39Å; V748-L750 VanDerWaalsContact C-N 3.34Å; V748-L750 PolarHBondContact O-N 3.41Å; V748-A751 PolarHBondContact O-N 3.04Å; V748-T752 PolarHBondContact O-N 2.89Å; V748-T752 PolarHBondContact O-OG1 2.96Å
749	T	96.5	Very high	93.5	Very high	4 Å²	4	32 Å²	32	3%	0.025	18%	0.176	C	C	.	.	H	α-helix	trans	-62.6	-39.7	177	-65.4	0	0	0	0	111.8	L700 T703 A745 Y746 L747 E753 S754	L700-T749 HydrophobicContact CD2-CG2 3.88Å; L700-T749 VanDerWaalsContact CD2-OG1 3.24Å; L700-T749 WeakPolarHBondContact CD2-OG1 3.23Å; T703-T749 WeakPolarHBondContact CG2-OG1 3.43Å; T703-T749 PolarHBondContact OG1-OG1 3.42Å; A745-T749 VanDerWaalsContact O-CB 3.28Å; A745-T749 WeakPolarHBondContact O-CB 2.96Å; A745-T749 PolarHBondContact O-N 2.92Å; A745-T749 PolarHBondContact O-OG1 3.39Å; Y746-T749 PolarHBondContact O-N 2.98Å; L747-T749 VanDerWaalsContact C-N 3.34Å; L747-T749 PolarHBondContact O-N 3.15Å; T749-E753 HydrophobicContact CG2-CB 4.25Å; T749-E753 PolarHBondContact O-N 2.95Å; T749-S754 WeakPolarHBondContact O-CB 3.36Å; T749-S754 PolarHBondContact O-N 3.33Å; T749-S754 PolarHBondContact O-OG 3.06Å
750	L	95.5	Very high	92.1	Very high	4 Å²	4	31 Å²	31	2%	0.021	17%	0.169	C	C	.	.	H	α-helix	trans	-68.7	-37.5	175.6	-68.9	-178.5	0	0	0	112.2	V334 N337 Y746 L747 V748 T752 P755	V334-L750 HydrophobicContact CG1-CD1 3.99Å; N337-L750 HydrophobicContact CB-CD2 3.49Å; N337-L750 VanDerWaalsContact CB-CD2 3.49Å; Y746-L750 HydrophobicContact CD1-CD1 4.25Å; Y746-L750 HydrophobicContact CD2-CD1 4.41Å; Y746-L750 HydrophobicContact CD2-CG 4.41Å; Y746-L750 HydrophobicContact CE1-CD1 3.63Å; Y746-L750 HydrophobicContact CE2-CD1 3.81Å; Y746-L750 HydrophobicContact CE2-CD2 4.3Å; Y746-L750 HydrophobicContact CE2-CG 4.09Å; Y746-L750 WeakPolarHBondContact O-CG 3.28Å; Y746-L750 PolarHBondContact O-N 2.98Å; L747-L750 PolarHBondContact O-N 3.18Å; V748-L750 VanDerWaalsContact C-N 3.34Å; V748-L750 PolarHBondContact O-N 3.41Å; L750-T752 VanDerWaalsContact C-N 3.34Å; L750-P755 VanDerWaalsContact O-CD 3.22Å; L750-P755 WeakPolarHBondContact O-CD 3.46Å
751	A	95	Very high	90.5	Very high	8 Å²	8	33.8 Å²	33.8	7%	0.066	18%	0.18	C	C	.	.	H	α-helix	trans	-71	-26.7	179	0	0	0	0	0	113.8	V237 Y332 L463 L747 V748	V237-A751 HydrophobicContact CG1-CB 3.5Å; Y332-A751 WeakPolarHBondContact CE1-O 3.46Å; L463-A751 HydrophobicContact CD2-CB 4.02Å; L747-A751 WeakPolarHBondContact O-CB 3.39Å; L747-A751 PolarHBondContact O-N 3.21Å; V748-A751 PolarHBondContact O-N 3.04Å
752	T	95	Very high	88.3	Confident	12 Å²	12	35.6 Å²	35.6	7%	0.074	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-129.7	-68.2	-166.4	60.2	0	0	0	0	113.7	P459 A460 L463 V748 L750 S754 P755 V756	P459-T752 HydrophobicContact CB-CG2 4.43Å; A460-T752 WeakPolarHBondContact CB-OG1 3.43Å; L463-T752 HydrophobicContact CB-CG2 4.12Å; L463-T752 HydrophobicContact CD2-CG2 3.51Å; L463-T752 HydrophobicContact CG-CG2 4.45Å; V748-T752 PolarHBondContact O-N 2.89Å; V748-T752 PolarHBondContact O-OG1 2.96Å; L750-T752 VanDerWaalsContact C-N 3.34Å; T752-S754 PolarHBondContact O-N 3.27Å; T752-P755 WeakPolarHBondContact O-CD 3.39Å; T752-V756 WeakPolarHBondContact O-CG2 3.12Å
753	E	91.7	Very high	85.6	Confident	11 Å²	11	39.5 Å²	39.5	5%	0.051	22%	0.216	C	C	.	.	H	α-helix	trans	-66.7	-40.9	-174.3	-65.7	-158.1	153.9	0	0	113.2	Y702 T749 V756 I757	Y702-E753 WeakPolarHBondContact CD1-OE1 3.17Å; T749-E753 HydrophobicContact CG2-CB 4.25Å; T749-E753 PolarHBondContact O-N 2.95Å; E753-V756 WeakPolarHBondContact O-CB 3.3Å; E753-V756 PolarHBondContact O-N 3.45Å; E753-I757 HydrophobicContact CB-CD1 4.45Å; E753-I757 VanDerWaalsContact O-CG1 3.29Å; E753-I757 WeakPolarHBondContact O-CG1 3.3Å; E753-I757 PolarHBondContact O-N 3.11Å
754	S	91.1	Very high	82.5	Confident	9 Å²	9	38.9 Å²	38.9	6%	0.063	22%	0.222	C	C	.	.	H	α-helix	trans	-64.2	-46.5	-173.9	-51.2	0	0	0	0	112.4	N337 T749 T752 V756 I757 A758	N337-S754 VanDerWaalsContact CG-CB 3.49Å; T749-S754 WeakPolarHBondContact O-CB 3.36Å; T749-S754 PolarHBondContact O-N 3.33Å; T749-S754 PolarHBondContact O-OG 3.06Å; T752-S754 PolarHBondContact O-N 3.27Å; S754-V756 VanDerWaalsContact C-N 3.32Å; S754-V756 PolarHBondContact O-N 3.01Å; S754-I757 PolarHBondContact O-N 3.44Å; S754-A758 WeakPolarHBondContact O-CB 3.39Å; S754-A758 PolarHBondContact O-N 3.22Å
755	P	91.1	Very high	79.3	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-55.2	-44.8	170.7	-26.9	33.4	0	0	0	112.8	Y332 L750 T752 I757 A758 M759	Y332-P755 HydrophobicContact CD1-CB 4.23Å; Y332-P755 HydrophobicContact CD1-CG 3.47Å; Y332-P755 VanDerWaalsContact CD1-CG 3.47Å; Y332-P755 HydrophobicContact CD2-CB 4.23Å; Y332-P755 HydrophobicContact CD2-CG 4.27Å; Y332-P755 HydrophobicContact CE1-CB 3.98Å; Y332-P755 HydrophobicContact CE1-CG 3.47Å; Y332-P755 VanDerWaalsContact CE1-CG 3.47Å; Y332-P755 HydrophobicContact CE2-CB 3.97Å; Y332-P755 HydrophobicContact CE2-CG 4.26Å; Y332-P755 HydrophobicContact CG-CB 4.35Å; Y332-P755 HydrophobicContact CG-CG 3.89Å; L750-P755 VanDerWaalsContact O-CD 3.22Å; L750-P755 WeakPolarHBondContact O-CD 3.46Å; T752-P755 WeakPolarHBondContact O-CD 3.39Å; P755-I757 PolarHBondContact O-N 3.43Å; P755-A758 PolarHBondContact O-N 3.12Å; P755-M759 VanDerWaalsContact O-CG 3.29Å; P755-M759 WeakPolarHBondContact O-CG 3.18Å; P755-M759 PolarHBondContact O-N 2.74Å
756	V	87.8	Confident	75.9	Confident	13 Å²	13	54 Å²	54	8%	0.079	28%	0.282	C	S	.	.	H	α-helix	trans	-60.4	-46.2	179	172.6	0	0	0	0	111.5	L455 P459 T752 E753 S754 M759 T760	L455-V756 HydrophobicContact CD2-CG1 3.95Å; L455-V756 HydrophobicContact CG-CG1 3.77Å; L455-V756 HydrophobicContact CG-CG2 4.48Å; P459-V756 HydrophobicContact CG-CG2 4.42Å; T752-V756 WeakPolarHBondContact O-CG2 3.12Å; E753-V756 WeakPolarHBondContact O-CB 3.3Å; E753-V756 PolarHBondContact O-N 3.45Å; S754-V756 VanDerWaalsContact C-N 3.32Å; S754-V756 PolarHBondContact O-N 3.01Å; V756-M759 HydrophobicContact CB-CE 4.41Å; V756-M759 HydrophobicContact CG2-CE 4.07Å; V756-M759 PolarHBondContact O-N 3.27Å; V756-T760 WeakPolarHBondContact O-CG2 3.31Å; V756-T760 PolarHBondContact O-N 3.13Å; V756-T760 VanDerWaalsContact O-N 3.08Å; V756-T760 PolarHBondContact O-OG1 3.01Å
757	I	83.5	Confident	72.5	Confident	54 Å²	54	60.1 Å²	60.1	28%	0.277	31%	0.31	S	S	.	.	H	α-helix	trans	-64.2	-43.1	177.1	-66.9	165	0	0	0	110.7	E753 S754 P755 M759 T760 H761	E753-I757 HydrophobicContact CB-CD1 4.45Å; E753-I757 VanDerWaalsContact O-CG1 3.29Å; E753-I757 WeakPolarHBondContact O-CG1 3.3Å; E753-I757 PolarHBondContact O-N 3.11Å; S754-I757 PolarHBondContact O-N 3.44Å; P755-I757 PolarHBondContact O-N 3.43Å; I757-M759 VanDerWaalsContact C-N 3.32Å; I757-M759 PolarHBondContact O-N 3.48Å; I757-T760 PolarHBondContact O-N 3.49Å; I757-T760 PolarHBondContact O-OG1 2.83Å; I757-H761 PolarHBondContact O-CD2 2.97Å; I757-H761 VanDerWaalsContact O-CD2 3.26Å; I757-H761 PolarHBondContact O-N 2.91Å
758	A	80.5	Confident	69.2	Low	17 Å²	17	61.6 Å²	61.6	14%	0.14	33%	0.325	C	S	.	.	H	α-helix	trans	-63.9	-37.8	178.5	0	0	0	0	0	111.9	T331 S754 P755 G762	T331-A758 HydrophobicContact CG2-CB 4.14Å; S754-A758 WeakPolarHBondContact O-CB 3.39Å; S754-A758 PolarHBondContact O-N 3.22Å; P755-A758 PolarHBondContact O-N 3.12Å; A758-G762 WeakPolarHBondContact O-CA 3.48Å; A758-G762 PolarHBondContact O-N 3.13Å
759	M	77.7	Confident	65.9	Low	47 Å²	47	65.3 Å²	65.3	23%	0.232	35%	0.352	C	S	.	.	H	α-helix	trans	-62.5	-51.1	173.5	-72.8	-174.3	-69.3	0	0	110.8	Y328 T331 P755 V756 I757 H761 G762 F763	Y328-M759 HydrophobicContact CD1-CG 4.34Å; Y328-M759 HydrophobicContact CD1-SD 3.85Å; Y328-M759 HydrophobicContact CE1-SD 4.02Å; T331-M759 HydrophobicContact CG2-CG 3.92Å; P755-M759 VanDerWaalsContact O-CG 3.29Å; P755-M759 WeakPolarHBondContact O-CG 3.18Å; P755-M759 PolarHBondContact O-N 2.74Å; V756-M759 HydrophobicContact CB-CE 4.41Å; V756-M759 HydrophobicContact CG2-CE 4.07Å; V756-M759 PolarHBondContact O-N 3.27Å; I757-M759 VanDerWaalsContact C-N 3.32Å; I757-M759 PolarHBondContact O-N 3.48Å; M759-H761 VanDerWaalsContact C-N 3.31Å; M759-H761 PolarHBondContact O-N 3.02Å; M759-G762 PolarHBondContact O-N 3.22Å; M759-F763 HydrophobicContact CB-CD2 4.44Å; M759-F763 HydrophobicContact CB-CE2 4.44Å; M759-F763 WeakPolarHBondContact O-CD2 3.26Å; M759-F763 PolarHBondContact O-N 3.37Å; M759-F763 VanDerWaalsContact O-N 3.11Å
760	T	69.9	Low	62.6	Low	53 Å²	53	71.2 Å²	71.2	33%	0.325	39%	0.393	S	S	.	.	H	α-helix	trans	-62.8	-36.3	-177.5	57.7	0	0	0	0	112.7	V756 I757	V756-T760 WeakPolarHBondContact O-CG2 3.31Å; V756-T760 PolarHBondContact O-N 3.13Å; V756-T760 VanDerWaalsContact O-N 3.08Å; V756-T760 PolarHBondContact O-OG1 3.01Å; I757-T760 PolarHBondContact O-N 3.49Å; I757-T760 PolarHBondContact O-OG1 2.83Å
761	H	64.2	Low	59.4	Low	135 Å²	135	74.8 Å²	74.8	63%	0.625	42%	0.418	S	S	*	.	H	α-helix	trans	-76	-36.4	174.4	-78.5	-73.5	0	0	0	113.8	I757 M759 G764	I757-H761 PolarHBondContact O-CD2 2.97Å; I757-H761 VanDerWaalsContact O-CD2 3.26Å; I757-H761 PolarHBondContact O-N 2.91Å; M759-H761 VanDerWaalsContact C-N 3.31Å; M759-H761 PolarHBondContact O-N 3.02Å; H761-G764 PolarHBondContact O-N 3.46Å
762	G	51.2	Low	56.4	Low	38 Å²	38	83.8 Å²	83.8	39%	0.392	46%	0.459	S	S	.	.	H	α-helix	trans	-77.2	-16.6	-176.5	0	0	0	0	0	115.2	K327 A758 M759	K327-G762 PolarHBondContact NZ-O 2.85Å; A758-G762 WeakPolarHBondContact O-CA 3.48Å; A758-G762 PolarHBondContact O-N 3.13Å; M759-G762 PolarHBondContact O-N 3.22Å
763	F	42.2	Very low	53.2	Low	108 Å²	108	89 Å²	89	47%	0.474	50%	0.496	S	S	.	.	H	α-helix	trans	-94.5	-20.7	171.8	-74.6	-72.8	0	0	0	113.3	Y328 M759	Y328-F763 AromaticContact CE1-CE2 3.68Å; Y328-F763 HydrophobicContact CE1-CE2 3.68Å; Y328-F763 AromaticContact CE1-CZ 3.69Å; Y328-F763 HydrophobicContact CE1-CZ 3.69Å; Y328-F763 AromaticContact CZ-CZ 3.63Å; Y328-F763 WeakPolarHBondContact OH-CZ 3.36Å; M759-F763 HydrophobicContact CB-CD2 4.44Å; M759-F763 HydrophobicContact CB-CE2 4.44Å; M759-F763 WeakPolarHBondContact O-CD2 3.26Å; M759-F763 PolarHBondContact O-N 3.37Å; M759-F763 VanDerWaalsContact O-N 3.11Å
764	G	32.4	Very low	50.2	Low	60 Å²	60	93.7 Å²	93.7	62%	0.619	53%	0.53	S	S	*	.			trans	-86	-4.5	-173.5	0	0	0	0	0	116.8	H761 E766	H761-G764 PolarHBondContact O-N 3.46Å; G764-E766 VanDerWaalsContact C-N 3.28Å; G764-E766 PolarHBondContact O-N 2.76Å; G764-E766 VanDerWaalsContact O-N 3.11Å
765	R	31.6	Very low	47.3	Very low	211 Å²	211	106.2 Å²	106.2	80%	0.796	59%	0.591	S	S	*	*			trans	-80.5	84.6	163.5	-80.8	-174.2	172.3	177.6	-3.5	107.7	K767	R765-K767 PolarHBondContact O-N 3.2Å
766	E	26.3	Very low	45.1	Very low	178 Å²	178	111.5 Å²	111.5	83%	0.832	62%	0.62	S	S	*	*	P	Polyproline II helix	trans	-47.7	132.7	156.8	-77.6	178.7	164.9	0	0	107.5	G764	G764-E766 VanDerWaalsContact C-N 3.28Å; G764-E766 PolarHBondContact O-N 2.76Å; G764-E766 VanDerWaalsContact O-N 3.11Å
767	K	25.2	Very low	42.8	Very low	193 Å²	193	116.7 Å²	116.7	84%	0.839	65%	0.649	S	S	*	*	P	Polyproline II helix	trans	-46.6	130.9	171.2	-75.7	177.4	175.3	178.3	0	106.8	R765 S769	R765-K767 PolarHBondContact O-N 3.2Å; K767-S769 PolarHBondContact O-N 3.09Å
768	P	28.2	Very low	40.6	Very low	122 Å²	122	120.2 Å²	120.2	79%	0.792	67%	0.669	S	S	*	*	P	Polyproline II helix	trans	-51.4	122	166.9	22	-29.5	0	0	0	106	S770	P768-S770 PolarHBondContact O-N 3.16Å
769	S	27.7	Very low	38.2	Very low	95 Å²	95	126.2 Å²	126.2	66%	0.664	70%	0.7	S	S	*	*			trans	-47.6	114.7	175.6	45.3	0	0	0	0	107.1	K767 S771	K767-S769 PolarHBondContact O-N 3.09Å; S769-S771 PolarHBondContact O-N 3.46Å
770	S	26.8	Very low	35.8	Very low	128 Å²	128	131.2 Å²	131.2	90%	0.895	73%	0.73	S	S	*	*	S	Bend	trans	-69.1	74.7	167.2	54.1	0	0	0	0	107	P768	P768-S770 PolarHBondContact O-N 3.16Å
771	S	28.9	Very low	33.5	Very low	79 Å²	79	136.4 Å²	136.4	55%	0.552	76%	0.757	S	S	*	*			trans	-151.9	69.7	175.6	61.7	0	0	0	0	106.7	S769	S769-S771 PolarHBondContact O-N 3.46Å
772	E	30.3	Very low	31.3	Very low	196 Å²	196	136.5 Å²	136.5	92%	0.916	77%	0.766	S	S	*	*			trans	176.6	64.8	156.3	-98	163.4	-155	0	0	107.8
773	S	28.9	Very low	29.8	Very low	121 Å²	121	144.1 Å²	144.1	85%	0.846	80%	0.795	S	S	*	*			trans	-132.9	58.7	158.8	68.8	0	0	0	0	107.7
774	S	28.1	Very low	28.7	Very low	110 Å²	110	147.1 Å²	147.1	77%	0.769	82%	0.822	S	S	*	*			trans	-165.8	78.4	165.9	61.3	0	0	0	0	108.9
775	M	30.2	Very low	28.4	Very low	272 Å²	272	155 Å²	155	100%	1.34	84%	0.84	S	S	*	*			trans	-159.5	0	143.3	-107.7	-177	-168.1	0	0	108.9

Retrieved 775 of 775 residues in 1371.6 ms (Link to these results)

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