A0A077YW33_TRITR Loading...

Nuclear pore complex protein

Functions as a component of the nuclear pore complex (NPC).

AlphaFold DB , UniProt , Accession A0A077YW33, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 886 aa.

						>A0A077YW33_TRITR|A0A077YW33
MESANFVSFGSISSPQPSLKFHKGFGRLRHGTDEISSNRSLSDITDTKARSKGLFEDDLSSESAESGEKAREVTRLENALLEMTQDLRNEFYRGLSMYTDQNDIVQLVRHFETVCEEHYFRLEKHSQSAGGASSVLRLLKAEKLAWRWLWTLIECRQESLDNSKPTESLDGWMTDSDIFHYMLKFDNKFRELRALVRCLECEAVEWTNDNIAFNFEDKIDFLWTNTRDCLRKNEKNYSTFLVNELDPDAPFRQERSIKDVDAAKQETVFKTVFNLIRIGHIDEAIVLSQRQGSQWLAAILAGGRLSRSIDGSNSIIENAISNEGDMDRRLYNKICMSVAKEATLSPNERAIYGALSGFLPATLLGCSTWEDHLWAFASASCEKLFIDFLTLLRMKAPAETAKFLDEASFAEQKDMFQRFILHSAEKFSSEDDTAPYRLIPLFFNLEAYNKLLDMLNSWKRYVQPHEQILLWSNLHRFVCHVTIVFHQLYRAPNMSPVHANENERENLHKIGSPFSCDYFSLPDCIGTIQGYLDLLAAEKEILLYPHYAVFLPRGSHVNFVADFLYDIASDEDRKMCLSVIENCELNVVEICRAVVQNVIDNLLPSPFSIIADAVTGKESAPLPTSQQVVEVVRSLLFLQSIPDLRFDAISQACLMARRFLLLQMFSAASEVFSRVHVDFVKNAVKYMPSSDEDEDAWKVCQNRLREYNCLREYSNAYSAFRDWSDMFSNKKPERAECSTVYDAGMPTSMWQQTERERSQAMERWNADTLTYFEIAELTMRQILIGTDGEWLVDAHEEDDTIRRQEMVALRKRCIPMVADMLVFMYQSMKQYDKVLALSEVIADESGKLYQLFEKSQLKSWFDRLTECSFQCLHEGLDSFGLPYRRL
					

Structure Viewer

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	28.9	Very low	29	Very low	250 Å²	250	97.9 Å²	97.9	100%	1.232	54%	0.539	S	S	*	.				0	115.1	0	-71.3	-175.4	159.6	0	0	106.9
2	E	23.5	Very low	28.8	Very low	189 Å²	189	92.7 Å²	92.7	88%	0.883	51%	0.509	S	S	*	.			cis	-117	155.4	8.2	-64.7	164.7	147.4	0	0	108.7
3	S	23.8	Very low	28.5	Very low	123 Å²	123	93.4 Å²	93.4	86%	0.86	53%	0.525	S	S	*	.	S	Bend	trans	79.1	72.3	177.7	75.2	0	0	0	0	119
4	A	26.3	Very low	28.3	Very low	71 Å²	71	93.4 Å²	93.4	59%	0.587	53%	0.534	S	S	*	.			trans	-154.6	84.4	153.5	0	0	0	0	0	110.1	F6	A4-F6 HydrophobicContact CB-CD2 3.8Å; A4-F6 HydrophobicContact CB-CE2 3.56Å; A4-F6 WeakPolarHBondContact O-CD2 3.48Å; A4-F6 PolarHBondContact O-N 2.93Å
5	N	25	Very low	28	Very low	148 Å²	148	95.4 Å²	95.4	79%	0.791	55%	0.552	S	S	*	*			trans	-76.3	96.3	178.4	-72.5	-26.3	0	0	0	109.8
6	F	27.5	Very low	27.7	Very low	138 Å²	138	100.2 Å²	100.2	61%	0.605	57%	0.568	S	S	*	*			trans	-98.7	103	-176.8	-84.9	-76	0	0	0	112.2	A4 R197	A4-F6 HydrophobicContact CB-CD2 3.8Å; A4-F6 HydrophobicContact CB-CE2 3.56Å; A4-F6 WeakPolarHBondContact O-CD2 3.48Å; A4-F6 PolarHBondContact O-N 2.93Å; F6-R197 PolarHBondContact O-NH2 3.4Å; F6-R197 VanDerWaalsContact O-NH2 3.07Å
7	V	34.4	Very low	27.4	Very low	75 Å²	75	100.9 Å²	100.9	46%	0.455	58%	0.577	S	S	.	*			trans	-93.2	127.5	-178.8	178.6	0	0	0	0	113.3	S11 R197	V7-S11 WeakPolarHBondContact CG1-O 3.38Å; V7-R197 VanDerWaalsContact C-NH2 3.26Å; V7-R197 VanDerWaalsContact N-NH1 3.19Å; V7-R197 PolarHBondContact O-NH1 2.93Å; V7-R197 PolarHBondContact O-NH2 3.34Å
8	S	32	Very low	27.1	Very low	24 Å²	24	101.3 Å²	101.3	17%	0.168	59%	0.587	C	S	.	*			trans	-157.2	142.3	156.5	71.8	0	0	0	0	112.6	R193	S8-R193 VanDerWaalsContact OG-CZ 3.23Å; S8-R193 PolarHBondContact OG-NE 3.42Å; S8-R193 PolarHBondContact OG-NH2 2.92Å
9	F	33.6	Very low	27	Very low	34 Å²	34	103.3 Å²	103.3	15%	0.149	59%	0.594	C	S	.	*	S	Bend	trans	48.8	83.2	-177.5	-78.1	-80	0	0	0	113.5	I281 G303 L305	F9-I281 HydrophobicContact CD1-CD1 4.29Å; F9-I281 HydrophobicContact CE1-CD1 3.58Å; F9-I281 HydrophobicContact CE2-CD1 4.15Å; F9-I281 HydrophobicContact CZ-CD1 3.5Å; F9-I281 VanDerWaalsContact CZ-CD1 3.5Å; F9-G303 VanDerWaalsContact CD1-O 3.25Å; F9-G303 WeakPolarHBondContact CD1-O 3.16Å; F9-L305 HydrophobicContact CB-CG 4.32Å; F9-L305 WeakPolarHBondContact O-CD1 3.42Å; F9-L305 WeakPolarHBondContact O-CG 3.48Å
10	G	29.6	Very low	26.7	Very low	7 Å²	7	107.5 Å²	107.5	7%	0.072	61%	0.605	C	S	.	*	S	Bend	trans	94	78.5	-178.6	0	0	0	0	0	112.3	R307	G10-R307 PolarHBondContact O-NE 3.47Å; G10-R307 PolarHBondContact O-NH2 2.82Å
11	S	34.3	Very low	26.7	Very low	18 Å²	18	111.1 Å²	111.1	13%	0.126	62%	0.615	C	S	.	*				144.7	128.1	127.4	67.3	0	0	0	0	117.8	V7 R307	V7-S11 WeakPolarHBondContact CG1-O 3.38Å; S11-R307 VanDerWaalsContact CB-NH2 3.26Å; S11-R307 PolarHBondContact OG-NH1 3.37Å; S11-R307 PolarHBondContact OG-NH2 2.79Å
12	I	26.9	Very low	26.5	Very low	35 Å²	35	108 Å²	108	18%	0.179	60%	0.597	C	S	.	*			trans	58.2	90.5	132.3	-49.5	179.2	0	0	0	117.6	A319	I12-A319 VanDerWaalsContact CD1-CA 3.42Å; I12-A319 HydrophobicContact CD1-CB 3.37Å
13	S	24.8	Very low	26.5	Very low	102 Å²	102	109 Å²	109	71%	0.713	60%	0.599	S	S	*	*			trans	17	117.9	132.8	58	0	0	0	0	119.2
14	S	25.9	Very low	26.5	Very low	94 Å²	94	106 Å²	106	66%	0.657	59%	0.587	S	S	*	*			trans	-150.2	157	145.7	71.9	0	0	0	0	109.9
15	P	23.1	Very low	26.6	Very low	123 Å²	123	112.8 Å²	112.8	80%	0.799	60%	0.603	S	S	*	*			trans	-82.6	152.7	-152	34	-34.6	0	0	0	113.3
16	Q	23.4	Very low	26.5	Very low	172 Å²	172	109.2 Å²	109.2	80%	0.804	60%	0.602	S	S	*	*			trans	-43.1	138.9	174.1	-69.4	-154.2	-33.6	0	0	113.6	S18	Q16-S18 PolarHBondContact O-N 3.15Å
17	P	22.6	Very low	26.5	Very low	112 Å²	112	114.2 Å²	114.2	73%	0.727	62%	0.617	S	S	*	*			trans	-68.1	120.9	149.7	26.2	-19	0	0	0	106.9	L19	P17-L19 VanDerWaalsContact C-N 3.33Å; P17-L19 PolarHBondContact O-N 3.45Å
18	S	21.7	Very low	26.1	Very low	108 Å²	108	118.7 Å²	118.7	76%	0.755	64%	0.637	S	S	*	*			trans	-60.8	87.2	178.2	44.5	0	0	0	0	111.7	Q16 K20	Q16-S18 PolarHBondContact O-N 3.15Å; S18-K20 PolarHBondContact O-N 2.77Å
19	L	24.9	Very low	25.7	Very low	139 Å²	139	128.6 Å²	128.6	73%	0.728	67%	0.671	S	S	*	*			trans	-80.2	98.2	156.9	-99	130.2	0	0	0	107.7	P17 F21	P17-L19 VanDerWaalsContact C-N 3.33Å; P17-L19 PolarHBondContact O-N 3.45Å; L19-F21 VanDerWaalsContact C-N 3.3Å; L19-F21 PolarHBondContact O-N 3.13Å
20	K	22.4	Very low	25.5	Very low	188 Å²	188	136 Å²	136	82%	0.817	71%	0.705	S	S	*	*			trans	-58.8	91.2	170.5	-72.2	177.1	178.1	173.9	0	109.4	S18 H22	S18-K20 PolarHBondContact O-N 2.77Å; K20-H22 PolarHBondContact O-N 2.9Å
21	F	25.8	Very low	25.3	Very low	184 Å²	184	138.4 Å²	138.4	81%	0.807	73%	0.73	S	S	*	*			trans	-71.9	108.6	159.8	-87.7	-85.2	0	0	0	108.3	L19 K23	L19-F21 VanDerWaalsContact C-N 3.3Å; L19-F21 PolarHBondContact O-N 3.13Å; F21-K23 PolarHBondContact O-N 3.37Å
22	H	24.7	Very low	24.9	Very low	184 Å²	184	143.8 Å²	143.8	85%	0.852	76%	0.763	S	S	*	*			trans	-59.1	101.2	167.6	-99.6	-61.7	0	0	0	109	K20 G24	K20-H22 PolarHBondContact O-N 2.9Å; H22-G24 PolarHBondContact O-N 2.86Å
23	K	23.9	Very low	25	Very low	211 Å²	211	149.2 Å²	149.2	92%	0.917	79%	0.792	S	S	*	*			trans	-59.6	116.9	162.7	-77.5	-178	175.1	179.6	0	108.8	F21	F21-K23 PolarHBondContact O-N 3.37Å
24	G	24.1	Very low	24.9	Very low	60 Å²	60	153.2 Å²	153.2	62%	0.619	80%	0.8	S	S	*	*			trans	177.4	88.2	170.7	0	0	0	0	0	111.4	H22	H22-G24 PolarHBondContact O-N 2.86Å
25	F	27.6	Very low	25	Very low	212 Å²	212	156.4 Å²	156.4	93%	0.93	81%	0.808	S	S	*	*			trans	149.7	94.4	137.5	-88.9	-76.9	0	0	0	110.3
26	G	23.4	Very low	25	Very low	74 Å²	74	155.9 Å²	155.9	76%	0.763	81%	0.807	S	S	*	*			trans	-68.4	146.3	162.8	0	0	0	0	0	110.8
27	R	28	Very low	25.3	Very low	243 Å²	243	153 Å²	153	92%	0.917	81%	0.806	S	S	*	*			trans	-135.6	129.5	154.1	-81.4	-165.5	-176.6	-160.5	3.2	110.5
28	L	26	Very low	25.4	Very low	168 Å²	168	155.3 Å²	155.3	88%	0.88	81%	0.812	S	S	*	*			trans	-62.2	138.7	178.1	-72.8	132.1	0	0	0	111.5
29	R	23.1	Very low	25.7	Very low	232 Å²	232	161.5 Å²	161.5	88%	0.875	82%	0.819	S	S	*	*			trans	-80.4	128	164.7	-77.5	-175.3	176.9	-167	-0.8	110.6
30	H	29.5	Very low	25.6	Very low	189 Å²	189	160.2 Å²	160.2	88%	0.875	82%	0.822	S	S	*	*			trans	-125	129.1	142.2	-74.6	-69.1	0	0	0	103.5
31	G	26.1	Very low	25.8	Very low	58 Å²	58	158.7 Å²	158.7	60%	0.598	82%	0.822	S	S	*	*			cis	123.2	122	34.6	0	0	0	0	0	105.7
32	T	25.8	Very low	25.8	Very low	132 Å²	132	154.4 Å²	154.4	81%	0.81	81%	0.814	S	S	*	*			trans	65	139.2	162	53.2	0	0	0	0	116.7
33	D	27.7	Very low	25.9	Very low	148 Å²	148	152.4 Å²	152.4	79%	0.791	81%	0.81	S	S	*	*			cis	-159.3	159.7	14.7	-92.7	-29.5	0	0	0	110.4
34	E	23.8	Very low	26.2	Very low	187 Å²	187	150.1 Å²	150.1	87%	0.874	81%	0.806	S	S	*	*			trans	-60.2	128.6	171.8	-60.2	172	150.5	0	0	113
35	I	27.6	Very low	26.3	Very low	161 Å²	161	152.8 Å²	152.8	83%	0.826	81%	0.81	S	S	*	*			trans	-141.9	110.1	147.6	-58.2	-176.7	0	0	0	109.7
36	S	23.4	Very low	26.3	Very low	112 Å²	112	149.5 Å²	149.5	78%	0.783	80%	0.803	S	S	*	*			trans	-67.8	133.1	163.6	55.5	0	0	0	0	111.7
37	S	29.3	Very low	26.6	Very low	112 Å²	112	152.6 Å²	152.6	78%	0.783	81%	0.807	S	S	*	*			trans	-163.7	115.4	144.7	56.3	0	0	0	0	112.6
38	N	24.4	Very low	26.5	Very low	160 Å²	160	150.9 Å²	150.9	86%	0.856	81%	0.806	S	S	*	*			trans	-48.1	142.4	157.8	-72.3	-32.5	0	0	0	112
39	R	27.8	Very low	26.7	Very low	237 Å²	237	147.4 Å²	147.4	89%	0.894	80%	0.801	S	S	*	*			trans	-167.4	107.9	137.8	-106.1	166.4	-163.6	-156.4	4.2	111
40	S	23.5	Very low	26.9	Very low	113 Å²	113	147.5 Å²	147.5	79%	0.79	80%	0.802	S	S	*	*			trans	-69.5	138.1	154.5	54.4	0	0	0	0	109.7
41	L	27.5	Very low	26.7	Very low	156 Å²	156	143.1 Å²	143.1	82%	0.817	79%	0.793	S	S	*	*			trans	-152.4	105.9	154	-107.4	132.7	0	0	0	108.8
42	S	25	Very low	26.7	Very low	93 Å²	93	150.6 Å²	150.6	65%	0.65	81%	0.809	S	S	*	*			trans	-55.9	137.3	153.5	49.1	0	0	0	0	109.8
43	D	26.9	Very low	26.7	Very low	142 Å²	142	147.5 Å²	147.5	76%	0.759	80%	0.803	S	S	*	*				158.5	151.7	127.9	-79.9	-18.3	0	0	0	110.2
44	I	29.8	Very low	26.7	Very low	163 Å²	163	147.9 Å²	147.9	84%	0.836	80%	0.804	S	S	*	*			trans	109.2	81.6	164	-51.6	162.9	0	0	0	114
45	T	26.6	Very low	27.1	Very low	116 Å²	116	147 Å²	147	71%	0.712	80%	0.798	S	S	*	*			trans	-30.8	161.9	143.8	47.8	0	0	0	0	116.7
46	D	26.8	Very low	27.2	Very low	143 Å²	143	146.6 Å²	146.6	77%	0.765	79%	0.792	S	S	*	*			trans	82.2	101.5	154	-80.5	-20.5	0	0	0	117.7
47	T	30.5	Very low	27.7	Very low	140 Å²	140	147.3 Å²	147.3	86%	0.859	79%	0.787	S	S	*	*				168.4	145.1	97.7	31.8	0	0	0	0	114
48	K	26.1	Very low	27.8	Very low	207 Å²	207	148.5 Å²	148.5	90%	0.9	79%	0.785	S	S	*	*			trans	-54	155	166.5	-69.9	161.7	168.2	171.1	0	113.9
49	A	30	Very low	28.2	Very low	94 Å²	94	148.1 Å²	148.1	78%	0.777	78%	0.782	S	S	*	*			trans	122.8	105.3	145.7	0	0	0	0	0	112.9
50	R	26.2	Very low	28.5	Very low	234 Å²	234	141.2 Å²	141.2	88%	0.883	77%	0.77	S	S	*	*				66.9	107	83.5	-142.3	-176.6	-166.2	-176.4	3.4	113.9
51	S	25.7	Very low	29	Very low	98 Å²	98	141.4 Å²	141.4	69%	0.685	77%	0.772	S	S	*	*			trans	64.3	119.8	142.4	63	0	0	0	0	121.2
52	K	27.4	Very low	29.5	Very low	215 Å²	215	143.3 Å²	143.3	94%	0.935	78%	0.777	S	S	*	*			trans	45	113.6	132.5	-74.6	-176.1	174.4	-179.4	0	118.2
53	G	25.4	Very low	30.3	Very low	67 Å²	67	142.2 Å²	142.2	69%	0.691	77%	0.769	S	S	*	*				123.1	127.2	128.2	0	0	0	0	0	116.2
54	L	27.2	Very low	30.9	Very low	155 Å²	155	139.2 Å²	139.2	81%	0.812	76%	0.764	S	S	*	*			trans	100	121.2	133.3	-66.3	159.1	0	0	0	119.4
55	F	31.2	Very low	31.5	Very low	169 Å²	169	139.1 Å²	139.1	74%	0.741	76%	0.76	S	S	*	*			trans	80.5	109.1	150.9	-73.1	-71.6	0	0	0	120.9
56	E	31	Very low	32.3	Very low	152 Å²	152	137.2 Å²	137.2	71%	0.71	75%	0.751	S	S	*	*				17.1	135.1	112.6	-69.3	173.7	167.3	0	0	115.7
57	D	32.8	Very low	33.1	Very low	127 Å²	127	131.8 Å²	131.8	68%	0.679	73%	0.729	S	S	*	*			cis	-166.5	161.9	39.2	-106.7	-27.5	0	0	0	111.1
58	D	31	Very low	34.2	Very low	137 Å²	137	131.8 Å²	131.8	73%	0.733	72%	0.719	S	S	*	*			trans	62.3	118.7	148.4	-73.6	-25.9	0	0	0	121
59	L	34.2	Very low	35.4	Very low	152 Å²	152	128.8 Å²	128.8	80%	0.796	71%	0.706	S	S	*	*				179.1	111.3	115.9	-88.2	165.6	0	0	0	112.6
60	S	33.9	Very low	36.6	Very low	92 Å²	92	127 Å²	127	64%	0.643	69%	0.691	S	S	*	*			trans	53.3	96.8	138.9	55.9	0	0	0	0	122.2	E62	S60-E62 PolarHBondContact O-N 2.91Å
61	S	34.8	Very low	38.1	Very low	118 Å²	118	124.5 Å²	124.5	83%	0.825	68%	0.681	S	S	*	*	S	Bend		65.1	8.3	123.3	72.5	0	0	0	0	124.6
62	E	37.6	Very low	39.8	Very low	196 Å²	196	124.5 Å²	124.5	92%	0.916	67%	0.671	S	S	*	*	S	Bend	trans	-125.6	8.8	162.2	-80.1	-174.6	165.3	0	0	113.7	S60	S60-E62 PolarHBondContact O-N 2.91Å
63	S	42.3	Very low	41.3	Very low	69 Å²	69	118 Å²	118	48%	0.483	65%	0.649	S	S	.	*			trans	-103.7	3.9	-169.8	55.4	0	0	0	0	115.7	S66 G67	S63-S66 PolarHBondContact O-OG 3.18Å; S63-S66 VanDerWaalsContact O-OG 3.06Å; S63-G67 PolarHBondContact O-N 3.07Å
64	A	38.2	Very low	43.2	Very low	80 Å²	80	118.2 Å²	118.2	66%	0.661	64%	0.637	S	S	*	*	H	α-helix	trans	-67.4	-45.8	-172.2	0	0	0	0	0	113.1	G67 E68	A64-G67 PolarHBondContact O-N 3.32Å; A64-E68 WeakPolarHBondContact O-CB 3.41Å; A64-E68 PolarHBondContact O-N 2.88Å
65	E	42.4	Very low	45.1	Very low	160 Å²	160	119.6 Å²	119.6	75%	0.748	63%	0.631	S	S	*	*	H	α-helix	trans	-70.9	-34.5	-179.8	-74.4	-172.8	168.4	0	0	112.9	K69	E65-K69 PolarHBondContact O-N 3.01Å
66	S	44.2	Very low	46.9	Very low	77 Å²	77	113.8 Å²	113.8	54%	0.538	61%	0.608	S	S	.	*	H	α-helix	trans	-72.8	-36.5	174.7	55.1	0	0	0	0	112.1	S63 A70	S63-S66 PolarHBondContact O-OG 3.18Å; S63-S66 VanDerWaalsContact O-OG 3.06Å; S66-A70 WeakPolarHBondContact O-CB 3.29Å; S66-A70 PolarHBondContact O-N 2.89Å
67	G	43.6	Very low	48.6	Very low	28 Å²	28	111.8 Å²	111.8	29%	0.289	60%	0.598	S	S	.	*	H	α-helix	trans	-69.5	-34.6	176.1	0	0	0	0	0	112.9	S63 A64 R71	S63-G67 PolarHBondContact O-N 3.07Å; A64-G67 PolarHBondContact O-N 3.32Å; G67-R71 WeakPolarHBondContact O-CB 3.43Å; G67-R71 WeakPolarHBondContact O-CG 3.43Å; G67-R71 PolarHBondContact O-N 3.42Å
68	E	53.2	Low	50.5	Low	141 Å²	141	109.9 Å²	109.9	66%	0.659	59%	0.588	S	S	*	*	H	α-helix	trans	-69.8	-44.5	176.4	-165.8	160.6	-155	0	0	111.7	A64 A70 R71 E72	A64-E68 WeakPolarHBondContact O-CB 3.41Å; A64-E68 PolarHBondContact O-N 2.88Å; E68-A70 PolarHBondContact O-N 3.46Å; E68-R71 PolarHBondContact O-N 3.45Å; E68-E72 WeakPolarHBondContact O-CB 3.41Å; E68-E72 PolarHBondContact O-N 3.11Å
69	K	51.3	Low	52.5	Low	144 Å²	144	105.5 Å²	105.5	63%	0.626	57%	0.571	S	S	*	*	H	α-helix	trans	-60.9	-43.6	172.3	-74.2	-177.7	-178.6	177.8	0	112.7	E65 E72 V73	E65-K69 PolarHBondContact O-N 3.01Å; K69-E72 PolarHBondContact O-N 3Å; K69-V73 WeakPolarHBondContact O-CG2 3.33Å; K69-V73 PolarHBondContact O-N 3.2Å
70	A	55.6	Low	54.6	Low	55 Å²	55	98.8 Å²	98.8	46%	0.455	54%	0.536	S	S	.	.	H	α-helix	trans	-63.3	-42.5	177.1	0	0	0	0	0	111.8	S66 E68 E72 V73 T74	S66-A70 WeakPolarHBondContact O-CB 3.29Å; S66-A70 PolarHBondContact O-N 2.89Å; E68-A70 PolarHBondContact O-N 3.46Å; A70-E72 VanDerWaalsContact C-N 3.32Å; A70-E72 PolarHBondContact O-N 2.98Å; A70-V73 PolarHBondContact O-N 3.14Å; A70-T74 PolarHBondContact O-N 3.06Å; A70-T74 PolarHBondContact O-OG1 3.37Å; A70-T74 VanDerWaalsContact O-OG1 3.1Å
71	R	58.2	Low	56.6	Low	182 Å²	182	97.7 Å²	97.7	69%	0.687	52%	0.522	S	S	*	.	H	α-helix	trans	-63.6	-37.1	174.1	-75.8	172.2	179.2	179.8	0.9	112.3	G67 E68 R75	G67-R71 WeakPolarHBondContact O-CB 3.43Å; G67-R71 WeakPolarHBondContact O-CG 3.43Å; G67-R71 PolarHBondContact O-N 3.42Å; E68-R71 PolarHBondContact O-N 3.45Å; R71-R75 WeakPolarHBondContact O-CB 3.4Å; R71-R75 VanDerWaalsContact O-CG 3.23Å; R71-R75 WeakPolarHBondContact O-CG 3.48Å; R71-R75 PolarHBondContact O-N 2.96Å
72	E	59.9	Low	58.7	Low	98 Å²	98	97.9 Å²	97.9	46%	0.458	51%	0.51	S	S	.	.	H	α-helix	trans	-68.3	-41.5	177.5	-167.1	171.4	-159.6	0	0	111.9	E68 K69 A70 R75 L76	E68-E72 WeakPolarHBondContact O-CB 3.41Å; E68-E72 PolarHBondContact O-N 3.11Å; K69-E72 PolarHBondContact O-N 3Å; A70-E72 VanDerWaalsContact C-N 3.32Å; A70-E72 PolarHBondContact O-N 2.98Å; E72-R75 PolarHBondContact O-N 3.45Å; E72-L76 WeakPolarHBondContact O-CB 3.44Å; E72-L76 PolarHBondContact O-N 2.96Å
73	V	60.2	Low	60.7	Low	80 Å²	80	89.8 Å²	89.8	49%	0.485	47%	0.473	S	S	.	.	H	α-helix	trans	-61.7	-49.4	173.4	172.8	0	0	0	0	111	K69 A70 R75 L76 E77	K69-V73 WeakPolarHBondContact O-CG2 3.33Å; K69-V73 PolarHBondContact O-N 3.2Å; A70-V73 PolarHBondContact O-N 3.14Å; V73-R75 VanDerWaalsContact C-N 3.31Å; V73-R75 PolarHBondContact O-N 3.18Å; V73-L76 WeakPolarHBondContact O-CB 3.44Å; V73-L76 PolarHBondContact O-N 3.39Å; V73-L76 VanDerWaalsContact O-N 3.14Å; V73-E77 HydrophobicContact CG1-CG 4.47Å; V73-E77 WeakPolarHBondContact O-CG 3.4Å; V73-E77 PolarHBondContact O-N 3.31Å
74	T	64.6	Low	62.5	Low	70 Å²	70	86.9 Å²	86.9	43%	0.429	45%	0.452	S	S	.	.	H	α-helix	trans	-63.5	-35.4	177.8	-54.6	0	0	0	0	112.5	A70 N78	A70-T74 PolarHBondContact O-N 3.06Å; A70-T74 PolarHBondContact O-OG1 3.37Å; A70-T74 VanDerWaalsContact O-OG1 3.1Å; T74-N78 WeakPolarHBondContact O-CB 3.01Å; T74-N78 VanDerWaalsContact O-CG 3.27Å; T74-N78 PolarHBondContact O-N 3.18Å; T74-N78 PolarHBondContact O-ND2 3Å
75	R	67.9	Low	64.7	Low	185 Å²	185	86.4 Å²	86.4	70%	0.698	44%	0.436	S	S	*	.	H	α-helix	trans	-64.3	-43.1	173.3	-80.3	174.5	-177.7	171.9	1.7	111.7	R71 E72 V73 A79	R71-R75 WeakPolarHBondContact O-CB 3.4Å; R71-R75 VanDerWaalsContact O-CG 3.23Å; R71-R75 WeakPolarHBondContact O-CG 3.48Å; R71-R75 PolarHBondContact O-N 2.96Å; E72-R75 PolarHBondContact O-N 3.45Å; V73-R75 VanDerWaalsContact C-N 3.31Å; V73-R75 PolarHBondContact O-N 3.18Å; R75-A79 VanDerWaalsContact O-CB 3.3Å; R75-A79 WeakPolarHBondContact O-CB 3.29Å; R75-A79 PolarHBondContact O-N 3.29Å
76	L	67	Low	66.9	Low	46 Å²	46	82.2 Å²	82.2	24%	0.241	42%	0.419	C	S	.	.	H	α-helix	trans	-64.3	-44.4	177.5	-164.9	106.2	0	0	0	110.8	E72 V73 A79 L80 A129	E72-L76 WeakPolarHBondContact O-CB 3.44Å; E72-L76 PolarHBondContact O-N 2.96Å; V73-L76 WeakPolarHBondContact O-CB 3.44Å; V73-L76 PolarHBondContact O-N 3.39Å; V73-L76 VanDerWaalsContact O-N 3.14Å; L76-A79 PolarHBondContact O-N 3.16Å; L76-L80 HydrophobicContact CD2-CD1 3.75Å; L76-L80 HydrophobicContact CG-CD1 4.1Å; L76-L80 HydrophobicContact CG-CG 4.49Å; L76-L80 WeakPolarHBondContact O-CB 2.98Å; L76-L80 WeakPolarHBondContact O-CG 3.46Å; L76-L80 PolarHBondContact O-N 3.44Å; L76-A129 HydrophobicContact CD1-CB 3.77Å
77	E	68.4	Low	69.2	Low	111 Å²	111	78.8 Å²	78.8	52%	0.519	39%	0.394	S	S	.	.	H	α-helix	trans	-60.4	-46.4	176.6	-73.5	174.6	165	0	0	112.3	V73 L80 L81	V73-E77 HydrophobicContact CG1-CG 4.47Å; V73-E77 WeakPolarHBondContact O-CG 3.4Å; V73-E77 PolarHBondContact O-N 3.31Å; E77-L80 PolarHBondContact O-N 3.35Å; E77-L81 WeakPolarHBondContact O-CB 3.41Å; E77-L81 PolarHBondContact O-N 3.06Å
78	N	72.2	Confident	71.4	Confident	86 Å²	86	77.5 Å²	77.5	46%	0.46	38%	0.381	S	S	.	.	H	α-helix	trans	-63.5	-43.7	176.3	-72.5	-26.2	0	0	0	111.7	T74 L80 L81 E82	T74-N78 WeakPolarHBondContact O-CB 3.01Å; T74-N78 VanDerWaalsContact O-CG 3.27Å; T74-N78 PolarHBondContact O-N 3.18Å; T74-N78 PolarHBondContact O-ND2 3Å; N78-L80 VanDerWaalsContact C-N 3.32Å; N78-L80 PolarHBondContact O-N 3.02Å; N78-L81 PolarHBondContact O-N 3.33Å; N78-E82 WeakPolarHBondContact O-CG 3.22Å; N78-E82 PolarHBondContact O-N 3.2Å
79	A	73.7	Confident	73.3	Confident	45 Å²	45	73.4 Å²	73.4	37%	0.372	36%	0.364	S	S	.	.	H	α-helix	trans	-62.3	-40.4	176.7	0	0	0	0	0	111.7	R75 L76 L81 E82 M83	R75-A79 VanDerWaalsContact O-CB 3.3Å; R75-A79 WeakPolarHBondContact O-CB 3.29Å; R75-A79 PolarHBondContact O-N 3.29Å; L76-A79 PolarHBondContact O-N 3.16Å; A79-L81 VanDerWaalsContact C-N 3.33Å; A79-E82 PolarHBondContact O-N 3.45Å; A79-M83 WeakPolarHBondContact O-CB 3.42Å; A79-M83 VanDerWaalsContact O-CG 3.24Å; A79-M83 WeakPolarHBondContact O-CG 3.47Å; A79-M83 PolarHBondContact O-N 3.06Å
80	L	76.7	Confident	75.3	Confident	12 Å²	12	68.7 Å²	68.7	6%	0.063	34%	0.344	C	S	.	.	H	α-helix	trans	-66.8	-35	176.4	-72.4	170.1	0	0	0	112.2	L76 E77 N78 T84 L122 V135 L469	L76-L80 HydrophobicContact CD2-CD1 3.75Å; L76-L80 HydrophobicContact CG-CD1 4.1Å; L76-L80 HydrophobicContact CG-CG 4.49Å; L76-L80 WeakPolarHBondContact O-CB 2.98Å; L76-L80 WeakPolarHBondContact O-CG 3.46Å; L76-L80 PolarHBondContact O-N 3.44Å; E77-L80 PolarHBondContact O-N 3.35Å; N78-L80 VanDerWaalsContact C-N 3.32Å; N78-L80 PolarHBondContact O-N 3.02Å; L80-T84 PolarHBondContact O-N 3.29Å; L80-T84 PolarHBondContact O-OG1 2.96Å; L80-L122 HydrophobicContact CD2-CD1 3.75Å; L80-L122 HydrophobicContact CD2-CD2 4.09Å; L80-V135 HydrophobicContact CD2-CB 4.38Å; L80-V135 HydrophobicContact CD2-CG1 4.28Å; L80-V135 HydrophobicContact CD2-CG2 4.12Å; L80-L469 HydrophobicContact CB-CD1 3.62Å; L80-L469 HydrophobicContact CB-CD2 4.08Å; L80-L469 HydrophobicContact CD1-CD1 3.7Å; L80-L469 HydrophobicContact CG-CD1 4.14Å
81	L	76	Confident	77.2	Confident	68 Å²	68	66 Å²	66	36%	0.356	32%	0.322	S	S	.	.	H	α-helix	trans	-68.4	-46.7	175.7	-170.8	66.5	0	0	0	111.6	E77 N78 A79 M83 T84 Q85	E77-L81 WeakPolarHBondContact O-CB 3.41Å; E77-L81 PolarHBondContact O-N 3.06Å; N78-L81 PolarHBondContact O-N 3.33Å; A79-L81 VanDerWaalsContact C-N 3.33Å; L81-M83 VanDerWaalsContact C-N 3.3Å; L81-M83 PolarHBondContact O-N 3.36Å; L81-T84 WeakPolarHBondContact O-CB 3.29Å; L81-T84 PolarHBondContact O-N 3.18Å; L81-T84 VanDerWaalsContact O-N 3.08Å; L81-Q85 PolarHBondContact O-N 3.39Å
82	E	79.6	Confident	78.8	Confident	122 Å²	122	59.6 Å²	59.6	57%	0.57	30%	0.298	S	S	*	.	H	α-helix	trans	-57.5	-44.1	173.3	-73.5	176.5	-178.6	0	0	111	N78 A79 T84 Q85 D86	N78-E82 WeakPolarHBondContact O-CG 3.22Å; N78-E82 PolarHBondContact O-N 3.2Å; A79-E82 PolarHBondContact O-N 3.45Å; E82-T84 VanDerWaalsContact C-N 3.26Å; E82-T84 PolarHBondContact O-N 3.04Å; E82-Q85 WeakPolarHBondContact O-CB 3.46Å; E82-Q85 PolarHBondContact O-N 2.85Å; E82-D86 PolarHBondContact O-N 2.97Å
83	M	79.6	Confident	80.3	Confident	27 Å²	27	61.4 Å²	61.4	13%	0.133	30%	0.3	C	S	.	.	H	α-helix	trans	-62.2	-33.2	176.1	-77	-168.6	65.6	0	0	113.2	A79 L81 L87 H118 R121 L122	A79-M83 WeakPolarHBondContact O-CB 3.42Å; A79-M83 VanDerWaalsContact O-CG 3.24Å; A79-M83 WeakPolarHBondContact O-CG 3.47Å; A79-M83 PolarHBondContact O-N 3.06Å; L81-M83 VanDerWaalsContact C-N 3.3Å; L81-M83 PolarHBondContact O-N 3.36Å; M83-L87 WeakPolarHBondContact O-CB 3.43Å; M83-L87 PolarHBondContact O-N 3.22Å; M83-H118 WeakPolarHBondContact CE-O 3.43Å; M83-H118 PolarHBondContact O-ND1 3.03Å; M83-R121 HydrophobicContact CE-CB 4.44Å; M83-L122 HydrophobicContact CE-CB 3.66Å; M83-L122 HydrophobicContact CE-CD1 4.34Å; M83-L122 HydrophobicContact CE-CG 4.45Å; M83-L122 HydrophobicContact SD-CB 4.15Å; M83-L122 HydrophobicContact SD-CD1 3.74Å; M83-L122 HydrophobicContact SD-CG 4.47Å
84	T	80.4	Confident	81.7	Confident	7 Å²	7	57.6 Å²	57.6	4%	0.043	28%	0.277	C	S	.	.	H	α-helix	trans	-71.4	-38.7	176.7	-56.7	0	0	0	0	111	L80 L81 E82 L87 R88 L469	L80-T84 PolarHBondContact O-N 3.29Å; L80-T84 PolarHBondContact O-OG1 2.96Å; L81-T84 WeakPolarHBondContact O-CB 3.29Å; L81-T84 PolarHBondContact O-N 3.18Å; L81-T84 VanDerWaalsContact O-N 3.08Å; E82-T84 VanDerWaalsContact C-N 3.26Å; E82-T84 PolarHBondContact O-N 3.04Å; T84-L87 PolarHBondContact O-N 3.24Å; T84-R88 WeakPolarHBondContact O-CG 3.44Å; T84-R88 PolarHBondContact O-N 3.02Å; T84-R88 VanDerWaalsContact O-N 3.1Å; T84-L469 WeakPolarHBondContact OG1-CD2 3.21Å
85	Q	84.3	Confident	83	Confident	70 Å²	70	54.5 Å²	54.5	33%	0.327	26%	0.258	S	S	.	.	H	α-helix	trans	-62.7	-50.4	172.9	-80.2	174.4	-16.3	0	0	111.9	L81 E82 L87 R88 N89	L81-Q85 PolarHBondContact O-N 3.39Å; E82-Q85 WeakPolarHBondContact O-CB 3.46Å; E82-Q85 PolarHBondContact O-N 2.85Å; Q85-L87 VanDerWaalsContact C-N 3.26Å; Q85-L87 PolarHBondContact O-N 3.39Å; Q85-R88 VanDerWaalsContact CG-NH2 3.26Å; Q85-R88 PolarHBondContact O-N 3.06Å; Q85-R88 VanDerWaalsContact O-N 3.16Å; Q85-N89 PolarHBondContact O-N 3.44Å; Q85-N89 PolarHBondContact O-ND2 3.34Å
86	D	88.7	Confident	83.8	Confident	73 Å²	73	48.4 Å²	48.4	39%	0.39	24%	0.244	S	C	.	.	H	α-helix	trans	-56.3	-44	176	-77.3	-11.2	0	0	0	111.1	E82 R88 N89 E90	E82-D86 PolarHBondContact O-N 2.97Å; D86-R88 VanDerWaalsContact C-N 3.34Å; D86-R88 PolarHBondContact O-N 2.99Å; D86-N89 WeakPolarHBondContact O-CB 3.4Å; D86-N89 PolarHBondContact O-N 3.47Å; D86-N89 VanDerWaalsContact O-N 3.16Å; D86-E90 PolarHBondContact O-N 2.88Å
87	L	91	Very high	84.8	Confident	4 Å²	4	51.2 Å²	51.2	2%	0.021	26%	0.257	C	S	.	.	H	α-helix	trans	-60	-43.1	178.9	-176	54.1	0	0	0	111.5	M83 T84 Q85 E90 F91 V114 H118 L139	M83-L87 WeakPolarHBondContact O-CB 3.43Å; M83-L87 PolarHBondContact O-N 3.22Å; T84-L87 PolarHBondContact O-N 3.24Å; Q85-L87 VanDerWaalsContact C-N 3.26Å; Q85-L87 PolarHBondContact O-N 3.39Å; L87-E90 PolarHBondContact O-N 2.86Å; L87-F91 HydrophobicContact CD1-CD2 3.84Å; L87-F91 HydrophobicContact CD1-CE2 3.54Å; L87-F91 HydrophobicContact CG-CD2 4.31Å; L87-F91 HydrophobicContact CG-CE2 4.2Å; L87-F91 WeakPolarHBondContact O-CD2 3.34Å; L87-F91 PolarHBondContact O-N 2.82Å; L87-F91 VanDerWaalsContact O-N 3.1Å; L87-V114 HydrophobicContact CD1-CG1 3.45Å; L87-V114 VanDerWaalsContact CD1-CG1 3.45Å; L87-H118 VanDerWaalsContact CA-CE1 3.5Å; L87-H118 WeakPolarHBondContact CA-CE1 3.42Å; L87-H118 HydrophobicContact CD1-CB 4.35Å; L87-H118 PolarHBondContact N-CE1 2.75Å; L87-H118 VanDerWaalsContact N-CE1 3.31Å; L87-L139 HydrophobicContact CD2-CD2 3.71Å
88	R	91.8	Very high	85.7	Confident	1 Å²	1	48.3 Å²	48.3	0%	0.004	24%	0.242	C	C	.	.	H	α-helix	trans	-62.7	-42.4	174.9	-70.9	-174.5	-56.7	-132.6	14.7	112.4	T84 Q85 D86 E90 F91 Y92 S472 R476 Y531 E538 E540 L543	T84-R88 WeakPolarHBondContact O-CG 3.44Å; T84-R88 PolarHBondContact O-N 3.02Å; T84-R88 VanDerWaalsContact O-N 3.1Å; Q85-R88 VanDerWaalsContact CG-NH2 3.26Å; Q85-R88 PolarHBondContact O-N 3.06Å; Q85-R88 VanDerWaalsContact O-N 3.16Å; D86-R88 VanDerWaalsContact C-N 3.34Å; D86-R88 PolarHBondContact O-N 2.99Å; R88-E90 PolarHBondContact O-N 3.39Å; R88-F91 PolarHBondContact O-N 3.41Å; R88-Y92 PolarHBondContact O-N 3.28Å; R88-S472 PolarHBondContact NH1-OG 3.06Å; R88-R476 HydrophobicContact CG-CG 4.4Å; R88-Y531 WeakPolarHBondContact CD-OH 3.4Å; R88-Y531 WeakPolarHBondContact CG-OH 3.4Å; R88-E538 IonicContact CZ-OE2 3.34Å; R88-E538 IonicContact NH1-OE1 2.78Å; R88-E538 PolarHBondContact NH1-OE1 3.45Å; R88-E538 IonicContact NH1-OE2 3.73Å; R88-E538 PolarHBondContact NH1-OE2 2.82Å; R88-E538 IonicContact NH2-OE2 3.97Å; R88-E538 PolarHBondContact NH2-OE2 3.49Å; R88-E540 IonicContact CZ-OE1 3.47Å; R88-E540 IonicContact NH2-OE1 2.78Å; R88-E540 PolarHBondContact NH2-OE1 3.39Å; R88-L543 HydrophobicContact CB-CD1 4.43Å
89	N	91.8	Very high	85.9	Confident	56 Å²	56	45.9 Å²	45.9	30%	0.299	23%	0.23	S	C	.	.	H	α-helix	trans	-62.7	-41.9	179.4	-73.4	-38.7	0	0	0	111.9	Q85 D86 Y92 R93	Q85-N89 PolarHBondContact O-N 3.44Å; Q85-N89 PolarHBondContact O-ND2 3.34Å; D86-N89 WeakPolarHBondContact O-CB 3.4Å; D86-N89 PolarHBondContact O-N 3.47Å; D86-N89 VanDerWaalsContact O-N 3.16Å; N89-Y92 PolarHBondContact O-N 2.94Å; N89-R93 WeakPolarHBondContact O-CG 3.39Å; N89-R93 PolarHBondContact O-N 3.26Å
90	E	94.1	Very high	85.8	Confident	44 Å²	44	50.6 Å²	50.6	21%	0.206	25%	0.249	C	C	.	.	H	α-helix	trans	-68.4	-36	177.1	-66	-55.6	152.2	0	0	112.7	D86 L87 R88 R93 G94 H110 V114	D86-E90 PolarHBondContact O-N 2.88Å; L87-E90 PolarHBondContact O-N 2.86Å; R88-E90 PolarHBondContact O-N 3.39Å; E90-R93 VanDerWaalsContact CD-NH1 3.27Å; E90-R93 PolarHBondContact O-N 3.1Å; E90-R93 IonicContact OE1-CZ 3.85Å; E90-R93 VanDerWaalsContact OE1-CZ 3.31Å; E90-R93 IonicContact OE1-NH1 2.9Å; E90-R93 PolarHBondContact OE1-NH1 2.94Å; E90-R93 IonicContact OE1-NH2 3.94Å; E90-R93 WeakPolarHBondContact OE2-CD 3.3Å; E90-R93 IonicContact OE2-CZ 3.46Å; E90-R93 IonicContact OE2-NH1 3.1Å; E90-R93 PolarHBondContact OE2-NH1 3.03Å; E90-R93 VanDerWaalsContact OE2-NH1 3.17Å; E90-G94 PolarHBondContact O-N 3.35Å; E90-G94 VanDerWaalsContact O-N 3.12Å; E90-H110 PolarHBondContact O-NE2 3.07Å; E90-V114 HydrophobicContact CB-CB 4.42Å; E90-V114 HydrophobicContact CB-CG1 3.55Å; E90-V114 HydrophobicContact CB-CG2 3.87Å; E90-V114 HydrophobicContact CG-CG1 4.37Å
91	F	94.9	Very high	85.7	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-62.5	-46.1	171.6	-91.8	-111.6	0	0	0	111.5	L87 R88 R93 G94 L95 F111 V114 W146 H480	L87-F91 HydrophobicContact CD1-CD2 3.84Å; L87-F91 HydrophobicContact CD1-CE2 3.54Å; L87-F91 HydrophobicContact CG-CD2 4.31Å; L87-F91 HydrophobicContact CG-CE2 4.2Å; L87-F91 WeakPolarHBondContact O-CD2 3.34Å; L87-F91 PolarHBondContact O-N 2.82Å; L87-F91 VanDerWaalsContact O-N 3.1Å; R88-F91 PolarHBondContact O-N 3.41Å; F91-R93 PolarHBondContact O-N 3.39Å; F91-G94 PolarHBondContact O-N 3.26Å; F91-L95 PolarHBondContact O-N 3.43Å; F91-F111 HydrophobicContact CB-CD1 4.46Å; F91-F111 HydrophobicContact CB-CE1 4.27Å; F91-F111 HydrophobicContact CD1-CB 4.39Å; F91-F111 AromaticContact CD1-CD1 3.42Å; F91-F111 HydrophobicContact CD1-CD1 3.42Å; F91-F111 VanDerWaalsContact CD1-CD1 3.42Å; F91-F111 HydrophobicContact CD1-CD2 4.37Å; F91-F111 AromaticContact CD1-CE1 3.67Å; F91-F111 HydrophobicContact CD1-CE1 3.67Å; F91-F111 AromaticContact CD1-CG 3.82Å; F91-F111 HydrophobicContact CD1-CG 3.82Å; F91-F111 HydrophobicContact CD1-CZ 4.24Å; F91-F111 HydrophobicContact CE1-CB 3.73Å; F91-F111 AromaticContact CE1-CD1 3.67Å; F91-F111 HydrophobicContact CE1-CD1 3.67Å; F91-F111 HydrophobicContact CE1-CD2 4.15Å; F91-F111 HydrophobicContact CE1-CE1 4.31Å; F91-F111 AromaticContact CE1-CG 3.59Å; F91-F111 HydrophobicContact CE1-CG 3.59Å; F91-F111 AromaticContact CG-CD1 3.92Å; F91-F111 HydrophobicContact CG-CD1 3.92Å; F91-F111 HydrophobicContact CG-CE1 4.16Å; F91-F111 HydrophobicContact CZ-CB 3.91Å; F91-F111 HydrophobicContact CZ-CD1 4.33Å; F91-F111 HydrophobicContact CZ-CG 4.24Å; F91-F111 WeakPolarHBondContact O-CE1 3.44Å; F91-V114 HydrophobicContact CD2-CB 4.43Å; F91-V114 HydrophobicContact CD2-CG1 3.82Å; F91-V114 HydrophobicContact CE2-CB 4.22Å; F91-V114 HydrophobicContact CE2-CG1 3.82Å; F91-W146 AromaticContact CE1-CE2 3.94Å; F91-W146 AromaticContact CE1-CZ2 3.82Å; F91-W146 HydrophobicContact CE1-CZ2 3.82Å; F91-W146 AromaticContact CE1-NE1 3.79Å; F91-W146 AromaticContact CZ-NE1 3.65Å; F91-H480 HydrophobicContact CD1-CB 4.41Å; F91-H480 AromaticContact CD1-CD2 3.61Å; F91-H480 AromaticContact CD1-CG 3.81Å; F91-H480 AromaticContact CD1-NE2 3.88Å
92	Y	92.4	Very high	85.6	Confident	46 Å²	46	56.3 Å²	56.3	18%	0.18	28%	0.276	C	S	.	.	H	α-helix	trans	-60	-42.9	175.4	166.6	-107.6	0	0	0	112.2	R88 N89 G94 L95 S96 L543 H546	R88-Y92 PolarHBondContact O-N 3.28Å; N89-Y92 PolarHBondContact O-N 2.94Å; Y92-G94 VanDerWaalsContact C-N 3.3Å; Y92-G94 PolarHBondContact O-N 2.99Å; Y92-L95 WeakPolarHBondContact O-CB 3.44Å; Y92-L95 PolarHBondContact O-N 3.43Å; Y92-L95 VanDerWaalsContact O-N 3.09Å; Y92-S96 PolarHBondContact O-N 2.91Å; Y92-L543 HydrophobicContact CD1-CD2 3.68Å; Y92-L543 HydrophobicContact CD2-CD2 4.28Å; Y92-L543 HydrophobicContact CE1-CD2 4.49Å; Y92-L543 HydrophobicContact CG-CD2 3.57Å; Y92-H546 HydrophobicContact CD2-CB 3.83Å; Y92-H546 HydrophobicContact CE2-CB 3.38Å; Y92-H546 AromaticContact CE2-CD2 3.5Å; Y92-H546 VanDerWaalsContact CE2-CD2 3.5Å; Y92-H546 WeakPolarHBondContact CE2-CD2 3.28Å; Y92-H546 AromaticContact CE2-CG 3.19Å; Y92-H546 AromaticContact CE2-ND1 3.56Å; Y92-H546 AromaticContact CZ-CD2 3.56Å; Y92-H546 AromaticContact CZ-CE1 3.51Å; Y92-H546 AromaticContact CZ-CG 3.52Å; Y92-H546 AromaticContact CZ-ND1 3.48Å; Y92-H546 AromaticContact CZ-NE2 3.61Å; Y92-H546 PolarHBondContact OH-CD2 3.41Å; Y92-H546 PolarHBondContact OH-CE1 3.08Å; Y92-H546 PolarHBondContact OH-NE2 3.03Å
93	R	91.4	Very high	85.8	Confident	136 Å²	136	53.3 Å²	53.3	51%	0.513	26%	0.264	S	S	.	.	H	α-helix	trans	-56.8	-44	175.2	-74.9	178.8	-171	165.4	10.4	112	N89 E90 F91 L95 S96 M97	N89-R93 WeakPolarHBondContact O-CG 3.39Å; N89-R93 PolarHBondContact O-N 3.26Å; E90-R93 VanDerWaalsContact CD-NH1 3.27Å; E90-R93 PolarHBondContact O-N 3.1Å; E90-R93 IonicContact OE1-CZ 3.85Å; E90-R93 VanDerWaalsContact OE1-CZ 3.31Å; E90-R93 IonicContact OE1-NH1 2.9Å; E90-R93 PolarHBondContact OE1-NH1 2.94Å; E90-R93 IonicContact OE1-NH2 3.94Å; E90-R93 WeakPolarHBondContact OE2-CD 3.3Å; E90-R93 IonicContact OE2-CZ 3.46Å; E90-R93 IonicContact OE2-NH1 3.1Å; E90-R93 PolarHBondContact OE2-NH1 3.03Å; E90-R93 VanDerWaalsContact OE2-NH1 3.17Å; F91-R93 PolarHBondContact O-N 3.39Å; R93-L95 VanDerWaalsContact C-N 3.34Å; R93-L95 PolarHBondContact O-N 3.33Å; R93-S96 PolarHBondContact O-N 3.27Å; R93-M97 WeakPolarHBondContact O-CB 3.42Å; R93-M97 VanDerWaalsContact O-CG 3.28Å; R93-M97 WeakPolarHBondContact O-CG 3.34Å; R93-M97 PolarHBondContact O-N 3.01Å
94	G	90.1	Very high	86.2	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-58	-47.6	174	0	0	0	0	0	112	E90 F91 Y92 S96 M97 Y98 L107 H110	E90-G94 PolarHBondContact O-N 3.35Å; E90-G94 VanDerWaalsContact O-N 3.12Å; F91-G94 PolarHBondContact O-N 3.26Å; Y92-G94 VanDerWaalsContact C-N 3.3Å; Y92-G94 PolarHBondContact O-N 2.99Å; G94-S96 PolarHBondContact O-N 2.96Å; G94-M97 PolarHBondContact O-N 3.05Å; G94-Y98 WeakPolarHBondContact O-CD2 3.43Å; G94-Y98 PolarHBondContact O-N 3.01Å; G94-L107 VanDerWaalsContact C-CD1 3.45Å; G94-L107 WeakPolarHBondContact O-CD1 3.29Å; G94-H110 WeakPolarHBondContact CA-CD2 3.39Å; G94-H110 WeakPolarHBondContact CA-NE2 3.39Å
95	L	89.9	Confident	86.6	Confident	6 Å²	6	52.2 Å²	52.2	3%	0.031	26%	0.258	C	S	.	.	H	α-helix	trans	-60.1	-45.9	179.1	-169.5	67.1	0	0	0	112.1	F91 Y92 R93 M97 T99 L107 I483 Y547 F550	F91-L95 PolarHBondContact O-N 3.43Å; Y92-L95 WeakPolarHBondContact O-CB 3.44Å; Y92-L95 PolarHBondContact O-N 3.43Å; Y92-L95 VanDerWaalsContact O-N 3.09Å; R93-L95 VanDerWaalsContact C-N 3.34Å; R93-L95 PolarHBondContact O-N 3.33Å; L95-M97 PolarHBondContact O-N 3.28Å; L95-T99 VanDerWaalsContact CD1-OG1 3.32Å; L95-T99 WeakPolarHBondContact CD1-OG1 3.31Å; L95-T99 WeakPolarHBondContact O-CB 3.45Å; L95-T99 PolarHBondContact O-N 3.4Å; L95-T99 PolarHBondContact O-OG1 3.43Å; L95-L107 HydrophobicContact CD1-CD1 4.43Å; L95-L107 HydrophobicContact CD1-CD2 4.08Å; L95-I483 HydrophobicContact CD1-CG2 3.58Å; L95-I483 HydrophobicContact CD2-CD1 4.26Å; L95-I483 HydrophobicContact CD2-CG2 4.46Å; L95-Y547 HydrophobicContact CD2-CE1 4.22Å; L95-F550 HydrophobicContact CD1-CZ 4.14Å; L95-F550 HydrophobicContact CD2-CE2 3.62Å; L95-F550 HydrophobicContact CD2-CZ 3.78Å; L95-F550 HydrophobicContact CG-CZ 4.23Å
96	S	86.5	Confident	87	Confident	56 Å²	56	52.2 Å²	52.2	39%	0.392	26%	0.258	S	S	.	.	H	α-helix	trans	-64.8	-36.2	177.3	174.6	0	0	0	0	112.7	Y92 R93 G94	Y92-S96 PolarHBondContact O-N 2.91Å; R93-S96 PolarHBondContact O-N 3.27Å; G94-S96 PolarHBondContact O-N 2.96Å
97	M	87.5	Confident	87.3	Confident	106 Å²	106	48.8 Å²	48.8	52%	0.522	24%	0.24	S	C	.	.	H	α-helix	trans	-77.6	-42.7	-177.4	-74.1	-178.5	64.5	0	0	113.9	R93 G94 L95	R93-M97 WeakPolarHBondContact O-CB 3.42Å; R93-M97 VanDerWaalsContact O-CG 3.28Å; R93-M97 WeakPolarHBondContact O-CG 3.34Å; R93-M97 PolarHBondContact O-N 3.01Å; G94-M97 PolarHBondContact O-N 3.05Å; L95-M97 PolarHBondContact O-N 3.28Å
98	Y	86.6	Confident	87.4	Confident	49 Å²	49	48.6 Å²	48.6	19%	0.192	24%	0.239	C	C	.	.	H	α-helix	trans	-101.3	-18	-167.6	-61.7	-67	0	0	0	114.2	G94 Q101 N102 D103 Q106 L107 H110	G94-Y98 WeakPolarHBondContact O-CD2 3.43Å; G94-Y98 PolarHBondContact O-N 3.01Å; Y98-Q101 PolarHBondContact O-N 3.07Å; Y98-N102 PolarHBondContact O-N 2.91Å; Y98-D103 PolarHBondContact O-N 3.34Å; Y98-Q106 HydrophobicContact CD1-CB 3.78Å; Y98-Q106 HydrophobicContact CE1-CB 3.84Å; Y98-Q106 HydrophobicContact CG-CB 4.36Å; Y98-L107 HydrophobicContact CD2-CD1 4.39Å; Y98-L107 HydrophobicContact CG-CB 4.43Å; Y98-H110 HydrophobicContact CD2-CB 4.18Å; Y98-H110 HydrophobicContact CE2-CB 3.68Å; Y98-H110 AromaticContact CE2-CG 3.87Å
99	T	77	Confident	87.5	Confident	35 Å²	35	51.5 Å²	51.5	22%	0.215	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-43.2	177	-59.6	0	0	0	0	111.4	L95 Q101 N102	L95-T99 VanDerWaalsContact CD1-OG1 3.32Å; L95-T99 WeakPolarHBondContact CD1-OG1 3.31Å; L95-T99 WeakPolarHBondContact O-CB 3.45Å; L95-T99 PolarHBondContact O-N 3.4Å; L95-T99 PolarHBondContact O-OG1 3.43Å; T99-Q101 PolarHBondContact O-N 3.13Å; T99-N102 PolarHBondContact O-N 3.46Å
100	D	71.8	Confident	87.7	Confident	144 Å²	144	50.5 Å²	50.5	77%	0.77	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65	-29.1	179.6	-65.6	-10.8	0	0	0	112.3	N102	D100-N102 VanDerWaalsContact C-N 3.28Å
101	Q	74.2	Confident	87.8	Confident	129 Å²	129	48.4 Å²	48.4	60%	0.603	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.1	-8.2	176.9	-60.5	-179	8.3	0	0	112.6	Y98 T99 D103	Y98-Q101 PolarHBondContact O-N 3.07Å; T99-Q101 PolarHBondContact O-N 3.13Å; Q101-D103 HydrophobicContact CB-CB 4.33Å; Q101-D103 PolarHBondContact O-N 3.04Å
102	N	74	Confident	87.8	Confident	72 Å²	72	49.1 Å²	49.1	39%	0.385	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.3	28.8	-171.4	-159.9	22.7	0	0	0	113.1	Y98 T99 D100 I104 P492	Y98-N102 PolarHBondContact O-N 2.91Å; T99-N102 PolarHBondContact O-N 3.46Å; D100-N102 VanDerWaalsContact C-N 3.28Å; N102-I104 PolarHBondContact O-N 3.23Å; N102-P492 WeakPolarHBondContact ND2-CD 3.36Å
103	D	84.6	Confident	88	Confident	58 Å²	58	49.7 Å²	49.7	31%	0.31	25%	0.245	S	C	.	.			trans	-98.2	78.5	-179.6	-166	-22	0	0	0	110.1	Y98 Q101 V105 Q106 L107	Y98-D103 PolarHBondContact O-N 3.34Å; Q101-D103 HydrophobicContact CB-CB 4.33Å; Q101-D103 PolarHBondContact O-N 3.04Å; D103-V105 PolarHBondContact O-N 3.46Å; D103-V105 PolarHBondContact OD1-N 3.06Å; D103-Q106 HydrophobicContact CB-CB 4.27Å; D103-Q106 HydrophobicContact CB-CG 4.44Å; D103-Q106 PolarHBondContact O-N 3.29Å; D103-Q106 WeakPolarHBondContact OD1-CG 3.19Å; D103-Q106 PolarHBondContact OD1-N 2.92Å; D103-Q106 WeakPolarHBondContact OD2-CG 3.41Å; D103-L107 PolarHBondContact O-N 3.47Å
104	I	87.4	Confident	88.2	Confident	5 Å²	5	43.3 Å²	43.3	3%	0.026	22%	0.222	C	C	.	.	H	α-helix	trans	-63.8	-31.9	-176.6	-56.9	170.1	0	0	0	111.2	N102 L107 V108 I153 V484 Q487 L488 A491	N102-I104 PolarHBondContact O-N 3.23Å; I104-L107 PolarHBondContact O-N 2.96Å; I104-V108 HydrophobicContact CG2-CG2 4.38Å; I104-V108 VanDerWaalsContact O-CG2 3.3Å; I104-V108 WeakPolarHBondContact O-CG2 3.29Å; I104-V108 PolarHBondContact O-N 2.49Å; I104-I153 HydrophobicContact CG2-CD1 4.21Å; I104-V484 HydrophobicContact CG2-CG1 4.14Å; I104-Q487 HydrophobicContact CD1-CB 3.78Å; I104-Q487 HydrophobicContact CG1-CB 3.97Å; I104-L488 HydrophobicContact CD1-CD2 3.81Å; I104-L488 HydrophobicContact CD1-CG 4.18Å; I104-L488 HydrophobicContact CG2-CD2 3.93Å; I104-L488 HydrophobicContact CG2-CG 4.18Å; I104-A491 HydrophobicContact CD1-CB 4.08Å
105	V	89.7	Confident	88.4	Confident	6 Å²	6	43.3 Å²	43.3	4%	0.036	22%	0.222	C	C	.	.	H	α-helix	trans	-67.4	-46.4	179.1	175.2	0	0	0	0	110.1	D103 V108 R109 W150 I153 E154 Q157	D103-V105 PolarHBondContact O-N 3.46Å; D103-V105 PolarHBondContact OD1-N 3.06Å; V105-V108 PolarHBondContact O-N 3.38Å; V105-R109 WeakPolarHBondContact O-CB 3.4Å; V105-R109 WeakPolarHBondContact O-CG 3.48Å; V105-R109 PolarHBondContact O-N 2.72Å; V105-W150 HydrophobicContact CG1-CB 4.47Å; V105-W150 HydrophobicContact CG1-CE3 4.4Å; V105-I153 HydrophobicContact CG2-CG2 3.77Å; V105-E154 HydrophobicContact CG2-CB 4.39Å; V105-Q157 VanDerWaalsContact CG2-OE1 3.26Å
106	Q	92.3	Very high	88.5	Confident	70 Å²	70	45.3 Å²	45.3	33%	0.327	23%	0.231	S	C	.	.	H	α-helix	trans	-67.2	-36.3	176.7	-64.8	-61.7	-23.3	0	0	112.4	Y98 D103 V108 R109 H110	Y98-Q106 HydrophobicContact CD1-CB 3.78Å; Y98-Q106 HydrophobicContact CE1-CB 3.84Å; Y98-Q106 HydrophobicContact CG-CB 4.36Å; D103-Q106 HydrophobicContact CB-CB 4.27Å; D103-Q106 HydrophobicContact CB-CG 4.44Å; D103-Q106 PolarHBondContact O-N 3.29Å; D103-Q106 WeakPolarHBondContact OD1-CG 3.19Å; D103-Q106 PolarHBondContact OD1-N 2.92Å; D103-Q106 WeakPolarHBondContact OD2-CG 3.41Å; Q106-V108 VanDerWaalsContact C-N 3.34Å; Q106-V108 PolarHBondContact O-N 2.92Å; Q106-R109 PolarHBondContact O-N 3.27Å; Q106-H110 WeakPolarHBondContact O-CB 3.34Å; Q106-H110 PolarHBondContact O-N 3.36Å
107	L	93.7	Very high	88.8	Confident	2 Å²	2	47.4 Å²	47.4	1%	0.01	23%	0.234	C	C	.	.	H	α-helix	trans	-55.7	-49.1	172.7	176.4	59.9	0	0	0	111.8	G94 L95 Y98 D103 I104 H110 F111	G94-L107 VanDerWaalsContact C-CD1 3.45Å; G94-L107 WeakPolarHBondContact O-CD1 3.29Å; L95-L107 HydrophobicContact CD1-CD1 4.43Å; L95-L107 HydrophobicContact CD1-CD2 4.08Å; Y98-L107 HydrophobicContact CD2-CD1 4.39Å; Y98-L107 HydrophobicContact CG-CB 4.43Å; D103-L107 PolarHBondContact O-N 3.47Å; I104-L107 PolarHBondContact O-N 2.96Å; L107-H110 WeakPolarHBondContact O-CB 3.35Å; L107-H110 PolarHBondContact O-N 2.99Å; L107-F111 HydrophobicContact CD1-CE1 3.75Å; L107-F111 HydrophobicContact CD1-CE2 4.11Å; L107-F111 HydrophobicContact CD1-CZ 3.45Å; L107-F111 VanDerWaalsContact CD1-CZ 3.45Å; L107-F111 HydrophobicContact CD2-CZ 4.41Å; L107-F111 HydrophobicContact CG-CE1 4.47Å; L107-F111 HydrophobicContact CG-CE2 3.98Å; L107-F111 HydrophobicContact CG-CZ 3.84Å; L107-F111 PolarHBondContact O-N 3.48Å
108	V	94.2	Very high	89	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-74	-34	-177	179.5	0	0	0	0	111.5	I104 V105 Q106 H110 F111 E112 W146 L149 W150 I153 V484	I104-V108 HydrophobicContact CG2-CG2 4.38Å; I104-V108 VanDerWaalsContact O-CG2 3.3Å; I104-V108 WeakPolarHBondContact O-CG2 3.29Å; I104-V108 PolarHBondContact O-N 2.49Å; V105-V108 PolarHBondContact O-N 3.38Å; Q106-V108 VanDerWaalsContact C-N 3.34Å; Q106-V108 PolarHBondContact O-N 2.92Å; V108-H110 VanDerWaalsContact C-N 3.31Å; V108-H110 PolarHBondContact O-N 3.4Å; V108-F111 PolarHBondContact O-N 2.89Å; V108-E112 PolarHBondContact O-N 3.26Å; V108-E112 VanDerWaalsContact O-N 3.11Å; V108-W146 HydrophobicContact CG1-CB 4.3Å; V108-W146 HydrophobicContact CG1-CE3 3.92Å; V108-W146 WeakPolarHBondContact CG1-O 3.36Å; V108-L149 HydrophobicContact CG1-CB 4.11Å; V108-L149 HydrophobicContact CG1-CD2 4.36Å; V108-L149 HydrophobicContact CG1-CG 4.3Å; V108-W150 HydrophobicContact CB-CB 3.83Å; V108-W150 HydrophobicContact CG1-CB 3.68Å; V108-W150 HydrophobicContact CG1-CG 4.42Å; V108-I153 HydrophobicContact CG2-CD1 4.38Å; V108-V484 HydrophobicContact CG2-CB 4.46Å; V108-V484 HydrophobicContact CG2-CG1 3.75Å; V108-V484 HydrophobicContact CG2-CG2 3.78Å
109	R	94.6	Very high	89.1	Confident	62 Å²	62	41.2 Å²	41.2	23%	0.234	21%	0.205	C	C	.	.	H	α-helix	trans	-62.6	-36.4	170.1	-77.3	-179.9	175.6	159.4	2.8	112.5	V105 Q106 E112 T113 W150 E154	V105-R109 WeakPolarHBondContact O-CB 3.4Å; V105-R109 WeakPolarHBondContact O-CG 3.48Å; V105-R109 PolarHBondContact O-N 2.72Å; Q106-R109 PolarHBondContact O-N 3.27Å; R109-E112 WeakPolarHBondContact O-CB 3.4Å; R109-E112 PolarHBondContact O-N 3.48Å; R109-T113 PolarHBondContact O-N 2.93Å; R109-T113 PolarHBondContact O-OG1 2.88Å; R109-W150 HydrophobicContact CG-CB 4.34Å; R109-W150 HydrophobicContact CG-CD2 3.73Å; R109-W150 HydrophobicContact CG-CE3 4.34Å; R109-W150 HydrophobicContact CG-CG 3.72Å; R109-E154 IonicContact CZ-OE1 2.85Å; R109-E154 IonicContact NH1-OE1 3.88Å; R109-E154 IonicContact NH2-OE1 3.09Å; R109-E154 PolarHBondContact NH2-OE1 2.88Å; R109-E154 IonicContact NH2-OE2 3.33Å; R109-E154 PolarHBondContact NH2-OE2 2.98Å
110	H	95.6	Very high	89.6	Confident	34 Å²	34	43.3 Å²	43.3	16%	0.157	21%	0.211	C	C	.	.	H	α-helix	trans	-61.6	-46	172.8	178.6	84.7	0	0	0	111	E90 G94 Y98 Q106 L107 V108 E112 T113 V114	E90-H110 PolarHBondContact O-NE2 3.07Å; G94-H110 WeakPolarHBondContact CA-CD2 3.39Å; G94-H110 WeakPolarHBondContact CA-NE2 3.39Å; Y98-H110 HydrophobicContact CD2-CB 4.18Å; Y98-H110 HydrophobicContact CE2-CB 3.68Å; Y98-H110 AromaticContact CE2-CG 3.87Å; Q106-H110 WeakPolarHBondContact O-CB 3.34Å; Q106-H110 PolarHBondContact O-N 3.36Å; L107-H110 WeakPolarHBondContact O-CB 3.35Å; L107-H110 PolarHBondContact O-N 2.99Å; V108-H110 VanDerWaalsContact C-N 3.31Å; V108-H110 PolarHBondContact O-N 3.4Å; H110-E112 VanDerWaalsContact C-N 3.32Å; H110-E112 PolarHBondContact O-N 2.89Å; H110-T113 PolarHBondContact O-N 2.84Å; H110-T113 VanDerWaalsContact O-N 3.14Å; H110-V114 WeakPolarHBondContact NE2-CG2 3.18Å; H110-V114 VanDerWaalsContact O-CG2 3.3Å; H110-V114 WeakPolarHBondContact O-CG2 3.42Å; H110-V114 PolarHBondContact O-N 2.89Å
111	F	96	Very high	90.3	Very high	1 Å²	1	40.6 Å²	40.6	0%	0.004	19%	0.19	C	C	.	.	H	α-helix	trans	-58.7	-42.1	176	-62.4	-22.7	0	0	0	112.9	F91 L107 V108 C115 W146 H480 V484	F91-F111 HydrophobicContact CB-CD1 4.46Å; F91-F111 HydrophobicContact CB-CE1 4.27Å; F91-F111 HydrophobicContact CD1-CB 4.39Å; F91-F111 AromaticContact CD1-CD1 3.42Å; F91-F111 HydrophobicContact CD1-CD1 3.42Å; F91-F111 VanDerWaalsContact CD1-CD1 3.42Å; F91-F111 HydrophobicContact CD1-CD2 4.37Å; F91-F111 AromaticContact CD1-CE1 3.67Å; F91-F111 HydrophobicContact CD1-CE1 3.67Å; F91-F111 AromaticContact CD1-CG 3.82Å; F91-F111 HydrophobicContact CD1-CG 3.82Å; F91-F111 HydrophobicContact CD1-CZ 4.24Å; F91-F111 HydrophobicContact CE1-CB 3.73Å; F91-F111 AromaticContact CE1-CD1 3.67Å; F91-F111 HydrophobicContact CE1-CD1 3.67Å; F91-F111 HydrophobicContact CE1-CD2 4.15Å; F91-F111 HydrophobicContact CE1-CE1 4.31Å; F91-F111 AromaticContact CE1-CG 3.59Å; F91-F111 HydrophobicContact CE1-CG 3.59Å; F91-F111 AromaticContact CG-CD1 3.92Å; F91-F111 HydrophobicContact CG-CD1 3.92Å; F91-F111 HydrophobicContact CG-CE1 4.16Å; F91-F111 HydrophobicContact CZ-CB 3.91Å; F91-F111 HydrophobicContact CZ-CD1 4.33Å; F91-F111 HydrophobicContact CZ-CG 4.24Å; F91-F111 WeakPolarHBondContact O-CE1 3.44Å; L107-F111 HydrophobicContact CD1-CE1 3.75Å; L107-F111 HydrophobicContact CD1-CE2 4.11Å; L107-F111 HydrophobicContact CD1-CZ 3.45Å; L107-F111 VanDerWaalsContact CD1-CZ 3.45Å; L107-F111 HydrophobicContact CD2-CZ 4.41Å; L107-F111 HydrophobicContact CG-CE1 4.47Å; L107-F111 HydrophobicContact CG-CE2 3.98Å; L107-F111 HydrophobicContact CG-CZ 3.84Å; L107-F111 PolarHBondContact O-N 3.48Å; V108-F111 PolarHBondContact O-N 2.89Å; F111-C115 PolarHBondContact O-N 3.4Å; F111-C115 VanDerWaalsContact O-N 3.08Å; F111-C115 PolarHBondContact O-SG 3.32Å; F111-C115 VanDerWaalsContact O-SG 3.37Å; F111-W146 HydrophobicContact CB-CB 4.49Å; F111-W146 HydrophobicContact CB-CD2 3.87Å; F111-W146 HydrophobicContact CB-CE3 4.44Å; F111-W146 HydrophobicContact CB-CG 3.87Å; F111-W146 HydrophobicContact CD2-CD2 4.18Å; F111-W146 HydrophobicContact CD2-CE3 4.02Å; F111-W146 AromaticContact CD2-CH2 3.97Å; F111-W146 HydrophobicContact CD2-CH2 3.97Å; F111-W146 HydrophobicContact CD2-CZ2 4.15Å; F111-W146 AromaticContact CD2-CZ3 3.91Å; F111-W146 HydrophobicContact CD2-CZ3 3.91Å; F111-W146 HydrophobicContact CE2-CH2 4.4Å; F111-W146 HydrophobicContact CE2-CZ3 4.47Å; F111-H480 HydrophobicContact CE2-CB 4.24Å; F111-H480 AromaticContact CZ-CD2 3.72Å; F111-V484 HydrophobicContact CD2-CG2 4.49Å; F111-V484 HydrophobicContact CE2-CG2 3.86Å
112	E	95.4	Very high	90.7	Very high	15 Å²	15	34.9 Å²	34.9	7%	0.07	16%	0.164	C	C	.	.	H	α-helix	trans	-58.2	-50.1	173.1	-177.8	-166.5	158.9	0	0	111.9	V108 R109 H110 V114 C115 E116 K143 W146 R147 W150	V108-E112 PolarHBondContact O-N 3.26Å; V108-E112 VanDerWaalsContact O-N 3.11Å; R109-E112 WeakPolarHBondContact O-CB 3.4Å; R109-E112 PolarHBondContact O-N 3.48Å; H110-E112 VanDerWaalsContact C-N 3.32Å; H110-E112 PolarHBondContact O-N 2.89Å; E112-V114 VanDerWaalsContact C-N 3.32Å; E112-V114 PolarHBondContact O-N 2.95Å; E112-C115 WeakPolarHBondContact O-CB 3.44Å; E112-C115 PolarHBondContact O-N 3Å; E112-E116 PolarHBondContact O-N 3.46Å; E112-K143 HydrophobicContact CG-CG 3.63Å; E112-W146 HydrophobicContact CB-CB 4Å; E112-R147 HydrophobicContact CG-CB 4.35Å; E112-R147 IonicContact OE1-CZ 3.93Å; E112-R147 IonicContact OE1-NE 2.8Å; E112-R147 PolarHBondContact OE1-NE 2.6Å; E112-R147 IonicContact OE1-NH2 3.94Å; E112-R147 PolarHBondContact OE1-NH2 3.48Å; E112-R147 IonicContact OE2-NE 3.66Å; E112-W150 PolarHBondContact OE2-NE1 3.32Å
113	T	95.3	Very high	91.1	Very high	58 Å²	58	34.6 Å²	34.6	36%	0.356	16%	0.16	S	C	.	.	H	α-helix	trans	-61.4	-43.4	-177	-56	0	0	0	0	110.8	R109 H110 C115 E116 E117	R109-T113 PolarHBondContact O-N 2.93Å; R109-T113 PolarHBondContact O-OG1 2.88Å; H110-T113 PolarHBondContact O-N 2.84Å; H110-T113 VanDerWaalsContact O-N 3.14Å; T113-C115 PolarHBondContact O-N 3.5Å; T113-E116 WeakPolarHBondContact O-CB 3.5Å; T113-E116 PolarHBondContact O-N 3.32Å; T113-E117 HydrophobicContact CG2-CG 4.48Å; T113-E117 WeakPolarHBondContact O-CG 3.42Å; T113-E117 PolarHBondContact O-N 3.38Å
114	V	95.7	Very high	90.9	Very high	2 Å²	2	39.4 Å²	39.4	1%	0.012	18%	0.178	C	C	.	.	H	α-helix	trans	-62.1	-43.9	176.9	172.7	0	0	0	0	111.3	L87 E90 F91 H110 E112 E116 E117 H118	L87-V114 HydrophobicContact CD1-CG1 3.45Å; L87-V114 VanDerWaalsContact CD1-CG1 3.45Å; E90-V114 HydrophobicContact CB-CB 4.42Å; E90-V114 HydrophobicContact CB-CG1 3.55Å; E90-V114 HydrophobicContact CB-CG2 3.87Å; E90-V114 HydrophobicContact CG-CG1 4.37Å; F91-V114 HydrophobicContact CD2-CB 4.43Å; F91-V114 HydrophobicContact CD2-CG1 3.82Å; F91-V114 HydrophobicContact CE2-CB 4.22Å; F91-V114 HydrophobicContact CE2-CG1 3.82Å; H110-V114 WeakPolarHBondContact NE2-CG2 3.18Å; H110-V114 VanDerWaalsContact O-CG2 3.3Å; H110-V114 WeakPolarHBondContact O-CG2 3.42Å; H110-V114 PolarHBondContact O-N 2.89Å; E112-V114 VanDerWaalsContact C-N 3.32Å; E112-V114 PolarHBondContact O-N 2.95Å; V114-E116 VanDerWaalsContact C-N 3.31Å; V114-E116 PolarHBondContact O-N 3.26Å; V114-E117 PolarHBondContact O-N 3.44Å; V114-H118 WeakPolarHBondContact O-CB 3.5Å; V114-H118 PolarHBondContact O-CD2 2.76Å; V114-H118 PolarHBondContact O-N 3.32Å
115	C	93.8	Very high	90.1	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-60.3	-40.9	174.9	-72.8	0	0	0	0	112.2	F111 E112 T113 Y119 K143	F111-C115 PolarHBondContact O-N 3.4Å; F111-C115 VanDerWaalsContact O-N 3.08Å; F111-C115 PolarHBondContact O-SG 3.32Å; F111-C115 VanDerWaalsContact O-SG 3.37Å; E112-C115 WeakPolarHBondContact O-CB 3.44Å; E112-C115 PolarHBondContact O-N 3Å; T113-C115 PolarHBondContact O-N 3.5Å; C115-Y119 WeakPolarHBondContact O-CB 3.33Å; C115-Y119 PolarHBondContact O-N 3.24Å; C115-K143 HydrophobicContact CB-CB 3.89Å
116	E	92.9	Very high	89.1	Confident	48 Å²	48	46 Å²	46	22%	0.224	21%	0.21	C	C	.	.	H	α-helix	trans	-65.5	-47.5	177.4	179.6	171	-122.2	0	0	112.7	E112 T113 V114 H118 Y119 F120 K143	E112-E116 PolarHBondContact O-N 3.46Å; T113-E116 WeakPolarHBondContact O-CB 3.5Å; T113-E116 PolarHBondContact O-N 3.32Å; V114-E116 VanDerWaalsContact C-N 3.31Å; V114-E116 PolarHBondContact O-N 3.26Å; E116-H118 VanDerWaalsContact C-N 3.3Å; E116-H118 PolarHBondContact O-N 2.87Å; E116-Y119 WeakPolarHBondContact O-CB 3.43Å; E116-Y119 PolarHBondContact O-N 2.87Å; E116-Y119 VanDerWaalsContact O-N 3.16Å; E116-F120 HydrophobicContact CG-CD2 3.69Å; E116-F120 HydrophobicContact CG-CE2 3.45Å; E116-F120 VanDerWaalsContact CG-CE2 3.45Å; E116-F120 WeakPolarHBondContact O-CD2 3.28Å; E116-F120 PolarHBondContact O-N 3.33Å; E116-K143 HydrophobicContact CB-CD 4.02Å; E116-K143 HydrophobicContact CG-CD 4.5Å; E116-K143 WeakPolarHBondContact OE1-CE 3.31Å; E116-K143 IonicContact OE1-NZ 2.63Å; E116-K143 PolarHBondContact OE1-NZ 3.45Å
117	E	92.6	Very high	87.6	Confident	100 Å²	100	50.8 Å²	50.8	47%	0.467	23%	0.233	S	C	.	.	H	α-helix	trans	-60.1	-42.5	177.9	-73.2	-177.2	179	0	0	111.7	T113 V114 F120 R121	T113-E117 HydrophobicContact CG2-CG 4.48Å; T113-E117 WeakPolarHBondContact O-CG 3.42Å; T113-E117 PolarHBondContact O-N 3.38Å; V114-E117 PolarHBondContact O-N 3.44Å; E117-F120 PolarHBondContact O-N 3.02Å; E117-R121 VanDerWaalsContact O-CB 3.27Å; E117-R121 WeakPolarHBondContact O-CB 3.27Å; E117-R121 PolarHBondContact O-N 3.31Å
118	H	90.7	Very high	85.7	Confident	1 Å²	1	55.3 Å²	55.3	1%	0.005	26%	0.264	C	S	.	.	H	α-helix	trans	-66.8	-37.4	176	-84	-110	0	0	0	112.3	M83 L87 V114 E116 R121 L122 L139	M83-H118 WeakPolarHBondContact CE-O 3.43Å; M83-H118 PolarHBondContact O-ND1 3.03Å; L87-H118 VanDerWaalsContact CA-CE1 3.5Å; L87-H118 WeakPolarHBondContact CA-CE1 3.42Å; L87-H118 HydrophobicContact CD1-CB 4.35Å; L87-H118 PolarHBondContact N-CE1 2.75Å; L87-H118 VanDerWaalsContact N-CE1 3.31Å; V114-H118 WeakPolarHBondContact O-CB 3.5Å; V114-H118 PolarHBondContact O-CD2 2.76Å; V114-H118 PolarHBondContact O-N 3.32Å; E116-H118 VanDerWaalsContact C-N 3.3Å; E116-H118 PolarHBondContact O-N 2.87Å; H118-R121 PolarHBondContact CE1-NH1 2.92Å; H118-R121 PolarHBondContact NE2-NH1 3.46Å; H118-R121 PolarHBondContact O-N 2.74Å; H118-L122 WeakPolarHBondContact O-CB 3.48Å; H118-L122 PolarHBondContact O-N 3.36Å; H118-L139 HydrophobicContact CB-CD1 4.29Å; H118-L139 HydrophobicContact CB-CD2 4.49Å
119	Y	89.8	Confident	83.5	Confident	24 Å²	24	56.5 Å²	56.5	9%	0.094	28%	0.275	C	S	.	.	H	α-helix	trans	-58.3	-55.3	172.9	177.1	-75.1	0	0	0	110.6	C115 E116 R121 L122 E123 L136 L139 K140 W206	C115-Y119 WeakPolarHBondContact O-CB 3.33Å; C115-Y119 PolarHBondContact O-N 3.24Å; E116-Y119 WeakPolarHBondContact O-CB 3.43Å; E116-Y119 PolarHBondContact O-N 2.87Å; E116-Y119 VanDerWaalsContact O-N 3.16Å; Y119-R121 VanDerWaalsContact C-N 3.28Å; Y119-R121 PolarHBondContact O-N 2.73Å; Y119-L122 PolarHBondContact O-N 3.35Å; Y119-L122 VanDerWaalsContact O-N 3.09Å; Y119-E123 HydrophobicContact CD1-CB 4.46Å; Y119-E123 HydrophobicContact CE1-CB 4.01Å; Y119-E123 HydrophobicContact CE1-CG 4.3Å; Y119-E123 WeakPolarHBondContact CE1-OE1 3.48Å; Y119-E123 WeakPolarHBondContact O-CB 3.42Å; Y119-E123 PolarHBondContact O-N 2.54Å; Y119-E123 PolarHBondContact OH-OE1 2.93Å; Y119-L136 HydrophobicContact CD1-CD2 4.34Å; Y119-L136 HydrophobicContact CD2-CB 4.24Å; Y119-L136 HydrophobicContact CD2-CD2 3.69Å; Y119-L136 WeakPolarHBondContact CD2-O 3.37Å; Y119-L136 HydrophobicContact CE1-CD2 4.25Å; Y119-L136 HydrophobicContact CE2-CB 3.78Å; Y119-L136 HydrophobicContact CE2-CD2 3.68Å; Y119-L136 HydrophobicContact CE2-CG 4.29Å; Y119-L136 WeakPolarHBondContact CE2-O 3.38Å; Y119-L136 HydrophobicContact CG-CD2 4.03Å; Y119-L136 WeakPolarHBondContact O-CD2 3.24Å; Y119-L139 HydrophobicContact CD2-CB 4.34Å; Y119-K140 HydrophobicContact CD2-CB 4.27Å; Y119-K140 HydrophobicContact CE2-CB 4.21Å; Y119-W206 AromaticContact CD1-CH2 3.39Å; Y119-W206 HydrophobicContact CD1-CH2 3.39Å; Y119-W206 AromaticContact CD1-CZ3 3.71Å; Y119-W206 HydrophobicContact CD1-CZ3 3.71Å; Y119-W206 AromaticContact CD2-CH2 3.78Å; Y119-W206 HydrophobicContact CD2-CH2 3.78Å; Y119-W206 HydrophobicContact CD2-CZ3 4.42Å; Y119-W206 HydrophobicContact CE1-CE3 4.33Å; Y119-W206 AromaticContact CE1-CH2 3.3Å; Y119-W206 HydrophobicContact CE1-CH2 3.3Å; Y119-W206 AromaticContact CE1-CZ3 3.1Å; Y119-W206 HydrophobicContact CE1-CZ3 3.1Å; Y119-W206 AromaticContact CE2-CH2 3.61Å; Y119-W206 HydrophobicContact CE2-CH2 3.61Å; Y119-W206 HydrophobicContact CE2-CZ2 4.44Å; Y119-W206 AromaticContact CE2-CZ3 3.84Å; Y119-W206 HydrophobicContact CE2-CZ3 3.84Å; Y119-W206 AromaticContact CG-CH2 3.69Å; Y119-W206 HydrophobicContact CG-CH2 3.69Å; Y119-W206 HydrophobicContact CG-CZ3 4.37Å; Y119-W206 AromaticContact CZ-CH2 3.4Å; Y119-W206 AromaticContact CZ-CZ3 3.16Å; Y119-W206 WeakPolarHBondContact OH-CZ3 3.48Å
120	F	87.8	Confident	81.5	Confident	78 Å²	78	57.2 Å²	57.2	34%	0.342	30%	0.301	S	S	.	.	H	α-helix	trans	-67.8	-30.1	-176.4	-74	-59.4	0	0	0	112.4	E116 E117 K124 W206	E116-F120 HydrophobicContact CG-CD2 3.69Å; E116-F120 HydrophobicContact CG-CE2 3.45Å; E116-F120 VanDerWaalsContact CG-CE2 3.45Å; E116-F120 WeakPolarHBondContact O-CD2 3.28Å; E116-F120 PolarHBondContact O-N 3.33Å; E117-F120 PolarHBondContact O-N 3.02Å; F120-K124 VanDerWaalsContact O-CG 3.28Å; F120-K124 WeakPolarHBondContact O-CG 3.32Å; F120-K124 PolarHBondContact O-N 2.94Å; F120-W206 HydrophobicContact CE1-CZ3 4.5Å
121	R	85.2	Confident	79.8	Confident	87 Å²	87	57.7 Å²	57.7	33%	0.328	32%	0.315	S	S	.	.	H	α-helix	trans	-62.9	-48.4	170.7	-168	-176.6	-56.9	155.9	9.5	110.2	M83 E117 H118 Y119 H125	M83-R121 HydrophobicContact CE-CB 4.44Å; E117-R121 VanDerWaalsContact O-CB 3.27Å; E117-R121 WeakPolarHBondContact O-CB 3.27Å; E117-R121 PolarHBondContact O-N 3.31Å; H118-R121 PolarHBondContact CE1-NH1 2.92Å; H118-R121 PolarHBondContact NE2-NH1 3.46Å; H118-R121 PolarHBondContact O-N 2.74Å; Y119-R121 VanDerWaalsContact C-N 3.28Å; Y119-R121 PolarHBondContact O-N 2.73Å; R121-H125 PolarHBondContact O-ND1 3.45Å
122	L	82.8	Confident	78.5	Confident	9 Å²	9	57.6 Å²	57.6	5%	0.047	32%	0.315	C	S	.	.	H	α-helix	trans	-66.9	-43.8	-179.6	-176.1	57.6	0	0	0	112.2	L80 M83 H118 Y119 K124 H125 S126 A132 V135 L136 L139	L80-L122 HydrophobicContact CD2-CD1 3.75Å; L80-L122 HydrophobicContact CD2-CD2 4.09Å; M83-L122 HydrophobicContact CE-CB 3.66Å; M83-L122 HydrophobicContact CE-CD1 4.34Å; M83-L122 HydrophobicContact CE-CG 4.45Å; M83-L122 HydrophobicContact SD-CB 4.15Å; M83-L122 HydrophobicContact SD-CD1 3.74Å; M83-L122 HydrophobicContact SD-CG 4.47Å; H118-L122 WeakPolarHBondContact O-CB 3.48Å; H118-L122 PolarHBondContact O-N 3.36Å; Y119-L122 PolarHBondContact O-N 3.35Å; Y119-L122 VanDerWaalsContact O-N 3.09Å; L122-K124 VanDerWaalsContact C-N 3.31Å; L122-K124 PolarHBondContact O-N 3.34Å; L122-H125 PolarHBondContact O-N 2.97Å; L122-S126 WeakPolarHBondContact O-CB 3.46Å; L122-S126 PolarHBondContact O-N 3.38Å; L122-A132 HydrophobicContact CD1-CB 3.97Å; L122-A132 HydrophobicContact CD2-CB 4.15Å; L122-A132 HydrophobicContact CG-CB 4.04Å; L122-V135 HydrophobicContact CD2-CB 3.85Å; L122-V135 HydrophobicContact CD2-CG1 3.61Å; L122-L136 HydrophobicContact CB-CD2 3.81Å; L122-L136 HydrophobicContact CD2-CD2 3.85Å; L122-L136 HydrophobicContact CD2-CG 3.88Å; L122-L136 HydrophobicContact CG-CD2 3.86Å; L122-L136 HydrophobicContact CG-CG 4.13Å; L122-L139 HydrophobicContact CD2-CD1 4.38Å
123	E	82.6	Confident	77.6	Confident	66 Å²	66	60.3 Å²	60.3	31%	0.308	34%	0.335	S	S	.	.	H	α-helix	trans	-59.6	-41.7	-177.8	-174	178.1	-121.5	0	0	111.7	Y119 H125 S126 Q127 L136	Y119-E123 HydrophobicContact CD1-CB 4.46Å; Y119-E123 HydrophobicContact CE1-CB 4.01Å; Y119-E123 HydrophobicContact CE1-CG 4.3Å; Y119-E123 WeakPolarHBondContact CE1-OE1 3.48Å; Y119-E123 WeakPolarHBondContact O-CB 3.42Å; Y119-E123 PolarHBondContact O-N 2.54Å; Y119-E123 PolarHBondContact OH-OE1 2.93Å; E123-H125 PolarHBondContact O-N 3.44Å; E123-S126 PolarHBondContact O-N 3.33Å; E123-Q127 PolarHBondContact O-N 2.99Å; E123-L136 HydrophobicContact CB-CD1 4.49Å; E123-L136 HydrophobicContact CB-CD2 4.03Å
124	K	80.4	Confident	76.7	Confident	160 Å²	160	60.3 Å²	60.3	70%	0.696	34%	0.338	S	S	*	.	H	α-helix	trans	-59	-32.5	174.8	-75.6	173.5	-176.7	174.5	0	113.2	F120 L122	F120-K124 VanDerWaalsContact O-CG 3.28Å; F120-K124 WeakPolarHBondContact O-CG 3.32Å; F120-K124 PolarHBondContact O-N 2.94Å; L122-K124 VanDerWaalsContact C-N 3.31Å; L122-K124 PolarHBondContact O-N 3.34Å
125	H	71.6	Confident	75.9	Confident	129 Å²	129	60.8 Å²	60.8	60%	0.597	34%	0.341	S	S	*	.	H	α-helix	trans	-85.3	-34.5	176.7	-65.2	88.1	0	0	0	112	R121 L122 E123 Q127 S128	R121-H125 PolarHBondContact O-ND1 3.45Å; L122-H125 PolarHBondContact O-N 2.97Å; E123-H125 PolarHBondContact O-N 3.44Å; H125-Q127 PolarHBondContact O-N 2.98Å; H125-S128 PolarHBondContact O-OG 3.01Å
126	S	68.4	Low	75.5	Confident	19 Å²	19	61.7 Å²	61.7	13%	0.133	35%	0.345	C	S	.	.	H	α-helix	trans	-74.2	-14.9	-174.4	-174.8	0	0	0	0	115.1	L122 E123 S128 A129 A132	L122-S126 WeakPolarHBondContact O-CB 3.46Å; L122-S126 PolarHBondContact O-N 3.38Å; E123-S126 PolarHBondContact O-N 3.33Å; S126-S128 PolarHBondContact O-N 3.29Å; S126-A129 PolarHBondContact O-N 3.2Å; S126-A129 PolarHBondContact OG-O 3.22Å; S126-A132 VanDerWaalsContact CB-CB 3.5Å; S126-A132 WeakPolarHBondContact OG-CB 3.26Å
127	Q	60.6	Low	75	Confident	171 Å²	171	64.2 Å²	64.2	80%	0.799	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-8.4	173.2	-71.2	-176	5.1	0	0	113.4	E123 H125	E123-Q127 PolarHBondContact O-N 2.99Å; H125-Q127 PolarHBondContact O-N 2.98Å
128	S	52.5	Low	74.7	Confident	97 Å²	97	59.8 Å²	59.8	68%	0.678	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.8	-18.4	178.3	-27.9	0	0	0	0	114.9	H125 S126	H125-S128 PolarHBondContact O-OG 3.01Å; S126-S128 PolarHBondContact O-N 3.29Å
129	A	49.9	Very low	74.6	Confident	26 Å²	26	60 Å²	60	22%	0.215	33%	0.333	C	S	.	.			trans	-151.2	128	-169.2	0	0	0	0	0	113.7	L76 S126 G131	L76-A129 HydrophobicContact CD1-CB 3.77Å; S126-A129 PolarHBondContact O-N 3.2Å; S126-A129 PolarHBondContact OG-O 3.22Å; A129-G131 VanDerWaalsContact C-N 3.29Å; A129-G131 PolarHBondContact O-N 3.24Å
130	G	52.4	Low	74.6	Confident	76 Å²	76	61.4 Å²	61.4	78%	0.784	34%	0.34	S	S	*	.	G	3₁₀ helix	trans	-70.2	-9.6	-172.2	0	0	0	0	0	117	A132	G130-A132 PolarHBondContact O-N 3.07Å
131	G	58.9	Low	74.7	Confident	44 Å²	44	58.2 Å²	58.2	45%	0.454	33%	0.328	S	S	.	.	G	3₁₀ helix	trans	-71.9	-22.4	-176.8	0	0	0	0	0	115.1	A129 S133	A129-G131 VanDerWaalsContact C-N 3.29Å; A129-G131 PolarHBondContact O-N 3.24Å; G131-S133 VanDerWaalsContact C-N 3.3Å; G131-S133 PolarHBondContact O-N 2.75Å
132	A	68.8	Low	75	Confident	0 Å²	0	54 Å²	54	0%	0	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-81.1	-5.4	-175.9	0	0	0	0	0	114.3	L122 S126 G130 S134 V135 L136	L122-A132 HydrophobicContact CD1-CB 3.97Å; L122-A132 HydrophobicContact CD2-CB 4.15Å; L122-A132 HydrophobicContact CG-CB 4.04Å; S126-A132 VanDerWaalsContact CB-CB 3.5Å; S126-A132 WeakPolarHBondContact OG-CB 3.26Å; G130-A132 PolarHBondContact O-N 3.07Å; A132-S134 PolarHBondContact O-N 3.35Å; A132-V135 PolarHBondContact O-N 3.43Å; A132-L136 WeakPolarHBondContact O-CB 3.48Å; A132-L136 VanDerWaalsContact O-CG 3.25Å; A132-L136 WeakPolarHBondContact O-CG 3.42Å; A132-L136 PolarHBondContact O-N 3.24Å
133	S	76.2	Confident	75.5	Confident	71 Å²	71	53.9 Å²	53.9	50%	0.497	31%	0.311	S	S	.	.	H	α-helix	trans	-62.3	-38.3	-177	-177	0	0	0	0	113.4	G131 R137	G131-S133 VanDerWaalsContact C-N 3.3Å; G131-S133 PolarHBondContact O-N 2.75Å; S133-R137 WeakPolarHBondContact O-CG 3.38Å; S133-R137 PolarHBondContact O-N 2.9Å; S133-R137 VanDerWaalsContact O-N 3.09Å
134	S	76.1	Confident	75.9	Confident	59 Å²	59	51.2 Å²	51.2	41%	0.413	30%	0.299	S	S	.	.	H	α-helix	trans	-67.2	-46.2	177.1	55	0	0	0	0	111.6	A132 L136 R137 L138	A132-S134 PolarHBondContact O-N 3.35Å; S134-L136 PolarHBondContact O-N 3.35Å; S134-R137 WeakPolarHBondContact O-CB 3.5Å; S134-R137 PolarHBondContact O-N 3.4Å; S134-L138 WeakPolarHBondContact O-CG 3.25Å; S134-L138 PolarHBondContact O-N 3.07Å
135	V	79.1	Confident	76.5	Confident	12 Å²	12	43.7 Å²	43.7	7%	0.073	27%	0.266	C	S	.	.	H	α-helix	trans	-64.3	-40.1	178.9	-177.7	0	0	0	0	111.5	L80 L122 A132 R137 L138 L139 L469	L80-V135 HydrophobicContact CD2-CB 4.38Å; L80-V135 HydrophobicContact CD2-CG1 4.28Å; L80-V135 HydrophobicContact CD2-CG2 4.12Å; L122-V135 HydrophobicContact CD2-CB 3.85Å; L122-V135 HydrophobicContact CD2-CG1 3.61Å; A132-V135 PolarHBondContact O-N 3.43Å; V135-R137 VanDerWaalsContact C-N 3.34Å; V135-R137 PolarHBondContact O-N 2.92Å; V135-L138 PolarHBondContact O-N 3.38Å; V135-L139 HydrophobicContact CG1-CD1 4.27Å; V135-L139 WeakPolarHBondContact O-CG 3.31Å; V135-L139 PolarHBondContact O-N 2.86Å; V135-L469 HydrophobicContact CG2-CD1 3.96Å
136	L	85	Confident	77.6	Confident	18 Å²	18	37.6 Å²	37.6	9%	0.094	24%	0.238	C	C	.	.	H	α-helix	trans	-60	-43.1	173.6	-73.3	170.7	0	0	0	111.7	Y119 L122 E123 A132 S134 L138 L139 K140	Y119-L136 HydrophobicContact CD1-CD2 4.34Å; Y119-L136 HydrophobicContact CD2-CB 4.24Å; Y119-L136 HydrophobicContact CD2-CD2 3.69Å; Y119-L136 WeakPolarHBondContact CD2-O 3.37Å; Y119-L136 HydrophobicContact CE1-CD2 4.25Å; Y119-L136 HydrophobicContact CE2-CB 3.78Å; Y119-L136 HydrophobicContact CE2-CD2 3.68Å; Y119-L136 HydrophobicContact CE2-CG 4.29Å; Y119-L136 WeakPolarHBondContact CE2-O 3.38Å; Y119-L136 HydrophobicContact CG-CD2 4.03Å; Y119-L136 WeakPolarHBondContact O-CD2 3.24Å; L122-L136 HydrophobicContact CB-CD2 3.81Å; L122-L136 HydrophobicContact CD2-CD2 3.85Å; L122-L136 HydrophobicContact CD2-CG 3.88Å; L122-L136 HydrophobicContact CG-CD2 3.86Å; L122-L136 HydrophobicContact CG-CG 4.13Å; E123-L136 HydrophobicContact CB-CD1 4.49Å; E123-L136 HydrophobicContact CB-CD2 4.03Å; A132-L136 WeakPolarHBondContact O-CB 3.48Å; A132-L136 VanDerWaalsContact O-CG 3.25Å; A132-L136 WeakPolarHBondContact O-CG 3.42Å; A132-L136 PolarHBondContact O-N 3.24Å; S134-L136 PolarHBondContact O-N 3.35Å; L136-L138 VanDerWaalsContact C-N 3.34Å; L136-L138 PolarHBondContact O-N 3.36Å; L136-L139 PolarHBondContact O-N 2.71Å; L136-K140 WeakPolarHBondContact O-CB 3.34Å; L136-K140 PolarHBondContact O-N 3.02Å
137	R	84.3	Confident	78.8	Confident	102 Å²	102	37.6 Å²	37.6	39%	0.385	24%	0.235	S	C	.	.	H	α-helix	trans	-60.3	-42.7	174.1	-77.3	170.4	46	155	-3.2	112.3	S133 S134 V135 K140 A141 D432 T433	S133-R137 WeakPolarHBondContact O-CG 3.38Å; S133-R137 PolarHBondContact O-N 2.9Å; S133-R137 VanDerWaalsContact O-N 3.09Å; S134-R137 WeakPolarHBondContact O-CB 3.5Å; S134-R137 PolarHBondContact O-N 3.4Å; V135-R137 VanDerWaalsContact C-N 3.34Å; V135-R137 PolarHBondContact O-N 2.92Å; R137-K140 PolarHBondContact O-N 3.43Å; R137-A141 WeakPolarHBondContact O-CB 3.43Å; R137-A141 PolarHBondContact O-N 3.3Å; R137-D432 IonicContact CZ-OD1 2.65Å; R137-D432 IonicContact CZ-OD2 2.79Å; R137-D432 IonicContact NE-OD2 3.18Å; R137-D432 IonicContact NH2-OD1 2.69Å; R137-D432 PolarHBondContact NH2-OD1 3.13Å; R137-D432 IonicContact NH2-OD2 3.08Å; R137-T433 HydrophobicContact CB-CG2 4.27Å
138	L	86.2	Confident	80.2	Confident	6 Å²	6	29.6 Å²	29.6	3%	0.031	20%	0.198	C	C	.	.	H	α-helix	trans	-63.5	-48.6	178.2	-65.7	171.7	0	0	0	111.8	S134 V135 L136 K140 A141 E142 D432 T433 Y436 L470	S134-L138 WeakPolarHBondContact O-CG 3.25Å; S134-L138 PolarHBondContact O-N 3.07Å; V135-L138 PolarHBondContact O-N 3.38Å; L136-L138 VanDerWaalsContact C-N 3.34Å; L136-L138 PolarHBondContact O-N 3.36Å; L138-K140 VanDerWaalsContact C-N 3.29Å; L138-K140 PolarHBondContact O-N 3.34Å; L138-A141 PolarHBondContact O-N 3.15Å; L138-E142 WeakPolarHBondContact O-CB 3.16Å; L138-E142 PolarHBondContact O-N 3.36Å; L138-D432 HydrophobicContact CD2-CB 4.12Å; L138-D432 WeakPolarHBondContact CD2-O 3.35Å; L138-T433 HydrophobicContact CD2-CG2 4.47Å; L138-Y436 HydrophobicContact CD2-CE2 3.71Å; L138-L470 HydrophobicContact CD1-CB 4.3Å; L138-L470 HydrophobicContact CD1-CD1 3.72Å; L138-L470 HydrophobicContact CD2-CD1 3.6Å; L138-L470 HydrophobicContact CG-CD1 4.33Å
139	L	88.9	Confident	82	Confident	5 Å²	5	25 Å²	25	3%	0.026	17%	0.166	C	C	.	.	H	α-helix	trans	-61	-39.4	177.8	-71.5	172.1	0	0	0	111.9	L87 H118 Y119 L122 V135 L136 E142 K143	L87-L139 HydrophobicContact CD2-CD2 3.71Å; H118-L139 HydrophobicContact CB-CD1 4.29Å; H118-L139 HydrophobicContact CB-CD2 4.49Å; Y119-L139 HydrophobicContact CD2-CB 4.34Å; L122-L139 HydrophobicContact CD2-CD1 4.38Å; V135-L139 HydrophobicContact CG1-CD1 4.27Å; V135-L139 WeakPolarHBondContact O-CG 3.31Å; V135-L139 PolarHBondContact O-N 2.86Å; L136-L139 PolarHBondContact O-N 2.71Å; L139-E142 PolarHBondContact O-N 2.97Å; L139-K143 VanDerWaalsContact O-CB 3.29Å; L139-K143 WeakPolarHBondContact O-CB 3.21Å; L139-K143 PolarHBondContact O-N 2.89Å
140	K	89	Confident	84	Confident	55 Å²	55	25.2 Å²	25.2	24%	0.239	16%	0.161	C	C	.	.	H	α-helix	trans	-63.1	-45.9	174.7	177.2	174.2	168.9	163.6	0	111.7	Y119 L136 R137 L138 L144 E202 W206	Y119-K140 HydrophobicContact CD2-CB 4.27Å; Y119-K140 HydrophobicContact CE2-CB 4.21Å; L136-K140 WeakPolarHBondContact O-CB 3.34Å; L136-K140 PolarHBondContact O-N 3.02Å; R137-K140 PolarHBondContact O-N 3.43Å; L138-K140 VanDerWaalsContact C-N 3.29Å; L138-K140 PolarHBondContact O-N 3.34Å; K140-L144 WeakPolarHBondContact O-CB 3.49Å; K140-L144 PolarHBondContact O-N 3.09Å; K140-L144 VanDerWaalsContact O-N 3.13Å; K140-E202 WeakPolarHBondContact CE-OE1 3.32Å; K140-E202 IonicContact NZ-OE1 3.98Å; K140-E202 PolarHBondContact NZ-OE1 2.88Å; K140-W206 HydrophobicContact CB-CZ2 4.26Å; K140-W206 HydrophobicContact CD-CD2 3.93Å; K140-W206 HydrophobicContact CD-CG 4.22Å; K140-W206 HydrophobicContact CD-CZ2 3.96Å; K140-W206 VanDerWaalsContact CE-NE1 3.31Å; K140-W206 HydrophobicContact CG-CZ2 3.82Å
141	A	89.1	Confident	85.8	Confident	10 Å²	10	22 Å²	22	8%	0.083	13%	0.126	C	C	.	.	H	α-helix	trans	-65.2	-40	177.9	0	0	0	0	0	112.1	R137 L138 L144 A145 T433 Y436	R137-A141 WeakPolarHBondContact O-CB 3.43Å; R137-A141 PolarHBondContact O-N 3.3Å; L138-A141 PolarHBondContact O-N 3.15Å; A141-L144 PolarHBondContact O-N 3.44Å; A141-A145 PolarHBondContact O-N 3Å; A141-T433 HydrophobicContact CB-CG2 3.96Å; A141-Y436 HydrophobicContact CB-CD2 4.16Å; A141-Y436 HydrophobicContact CB-CG 4.18Å
142	E	92.3	Very high	87.1	Confident	0 Å²	0	20 Å²	20	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-67.3	-46	177.5	-173.1	169.7	171.5	0	0	112.4	L138 L139 L144 A145 W146 Y436 R476 F477	L138-E142 WeakPolarHBondContact O-CB 3.16Å; L138-E142 PolarHBondContact O-N 3.36Å; L139-E142 PolarHBondContact O-N 2.97Å; E142-L144 VanDerWaalsContact C-N 3.25Å; E142-L144 PolarHBondContact O-N 3.03Å; E142-A145 WeakPolarHBondContact O-CB 3.29Å; E142-A145 PolarHBondContact O-N 2.67Å; E142-A145 VanDerWaalsContact O-N 3.12Å; E142-W146 VanDerWaalsContact CG-NE1 3.31Å; E142-W146 PolarHBondContact O-N 3.15Å; E142-W146 PolarHBondContact OE1-NE1 3.13Å; E142-Y436 HydrophobicContact CB-CD1 3.62Å; E142-Y436 HydrophobicContact CB-CE1 3.61Å; E142-Y436 HydrophobicContact CB-CG 4.45Å; E142-Y436 HydrophobicContact CG-CD1 3.92Å; E142-Y436 HydrophobicContact CG-CE1 3.78Å; E142-R476 IonicContact OE1-CZ 2.85Å; E142-R476 IonicContact OE1-NE 3.88Å; E142-R476 IonicContact OE1-NH2 3.73Å; E142-R476 PolarHBondContact OE1-NH2 3.36Å; E142-R476 IonicContact OE2-CZ 3.3Å; E142-R476 IonicContact OE2-NH2 2.88Å; E142-R476 PolarHBondContact OE2-NH2 2.81Å; E142-F477 HydrophobicContact CG-CD2 3.75Å; E142-F477 HydrophobicContact CG-CE2 4.1Å
143	K	93	Very high	87.9	Confident	5 Å²	5	20.1 Å²	20.1	2%	0.022	11%	0.106	C	C	.	.	H	α-helix	trans	-51	-49.5	172	179.6	-163.6	177.1	-174.2	0	110.5	E112 C115 E116 L139 A145 W146 R147 E205	E112-K143 HydrophobicContact CG-CG 3.63Å; C115-K143 HydrophobicContact CB-CB 3.89Å; E116-K143 HydrophobicContact CB-CD 4.02Å; E116-K143 HydrophobicContact CG-CD 4.5Å; E116-K143 WeakPolarHBondContact OE1-CE 3.31Å; E116-K143 IonicContact OE1-NZ 2.63Å; E116-K143 PolarHBondContact OE1-NZ 3.45Å; L139-K143 VanDerWaalsContact O-CB 3.29Å; L139-K143 WeakPolarHBondContact O-CB 3.21Å; L139-K143 PolarHBondContact O-N 2.89Å; K143-A145 VanDerWaalsContact C-N 3.35Å; K143-A145 PolarHBondContact O-N 3.35Å; K143-W146 PolarHBondContact O-N 3.37Å; K143-R147 PolarHBondContact O-N 3Å; K143-E205 IonicContact NZ-OE1 3.93Å; K143-E205 IonicContact NZ-OE2 3.07Å; K143-E205 PolarHBondContact NZ-OE2 3.45Å
144	L	91.1	Very high	88.4	Confident	11 Å²	11	19.4 Å²	19.4	6%	0.058	9%	0.094	C	C	.	.	H	α-helix	trans	-63.7	-40.3	-179.2	-176	58.4	0	0	0	111.9	K140 A141 E142 W146 R147 W148 E202 E370	K140-L144 WeakPolarHBondContact O-CB 3.49Å; K140-L144 PolarHBondContact O-N 3.09Å; K140-L144 VanDerWaalsContact O-N 3.13Å; A141-L144 PolarHBondContact O-N 3.44Å; E142-L144 VanDerWaalsContact C-N 3.25Å; E142-L144 PolarHBondContact O-N 3.03Å; L144-W146 PolarHBondContact O-N 3.45Å; L144-R147 PolarHBondContact O-N 3.42Å; L144-W148 HydrophobicContact CD1-CZ2 3.59Å; L144-W148 VanDerWaalsContact CD1-NE1 3.27Å; L144-W148 HydrophobicContact CG-CZ2 4.47Å; L144-W148 VanDerWaalsContact O-CG 3.29Å; L144-W148 PolarHBondContact O-N 3.37Å; L144-E202 HydrophobicContact CD1-CB 4.08Å; L144-E202 HydrophobicContact CD1-CG 4.03Å; L144-E202 HydrophobicContact CD2-CG 4.41Å; L144-E370 HydrophobicContact CD2-CG 3.55Å
145	A	92.8	Very high	88.8	Confident	2 Å²	2	17.2 Å²	17.2	2%	0.017	8%	0.079	C	C	.	.	H	α-helix	trans	-61.1	-42.4	175.3	0	0	0	0	0	112.5	A141 E142 K143 W148 L149 Y436 I439 F477	A141-A145 PolarHBondContact O-N 3Å; E142-A145 WeakPolarHBondContact O-CB 3.29Å; E142-A145 PolarHBondContact O-N 2.67Å; E142-A145 VanDerWaalsContact O-N 3.12Å; K143-A145 VanDerWaalsContact C-N 3.35Å; K143-A145 PolarHBondContact O-N 3.35Å; A145-W148 PolarHBondContact O-N 2.91Å; A145-L149 WeakPolarHBondContact O-CB 3.31Å; A145-L149 PolarHBondContact O-N 2.99Å; A145-Y436 WeakPolarHBondContact CB-O 3.44Å; A145-I439 HydrophobicContact CB-CB 4.33Å; A145-I439 HydrophobicContact CB-CG1 4.19Å; A145-F477 HydrophobicContact CB-CE2 4.11Å; A145-F477 HydrophobicContact CB-CZ 3.97Å
146	W	94.7	Very high	89	Confident	1 Å²	1	18 Å²	18	0%	0.004	8%	0.081	C	C	.	.	H	α-helix	trans	-66.6	-42.9	175.1	-65.3	125.6	0	0	0	112.2	F91 V108 F111 E112 E142 K143 L144 W148 L149 W150 F477 H480 V481 V484	F91-W146 AromaticContact CE1-CE2 3.94Å; F91-W146 AromaticContact CE1-CZ2 3.82Å; F91-W146 HydrophobicContact CE1-CZ2 3.82Å; F91-W146 AromaticContact CE1-NE1 3.79Å; F91-W146 AromaticContact CZ-NE1 3.65Å; V108-W146 HydrophobicContact CG1-CB 4.3Å; V108-W146 HydrophobicContact CG1-CE3 3.92Å; V108-W146 WeakPolarHBondContact CG1-O 3.36Å; F111-W146 HydrophobicContact CB-CB 4.49Å; F111-W146 HydrophobicContact CB-CD2 3.87Å; F111-W146 HydrophobicContact CB-CE3 4.44Å; F111-W146 HydrophobicContact CB-CG 3.87Å; F111-W146 HydrophobicContact CD2-CD2 4.18Å; F111-W146 HydrophobicContact CD2-CE3 4.02Å; F111-W146 AromaticContact CD2-CH2 3.97Å; F111-W146 HydrophobicContact CD2-CH2 3.97Å; F111-W146 HydrophobicContact CD2-CZ2 4.15Å; F111-W146 AromaticContact CD2-CZ3 3.91Å; F111-W146 HydrophobicContact CD2-CZ3 3.91Å; F111-W146 HydrophobicContact CE2-CH2 4.4Å; F111-W146 HydrophobicContact CE2-CZ3 4.47Å; E112-W146 HydrophobicContact CB-CB 4Å; E142-W146 VanDerWaalsContact CG-NE1 3.31Å; E142-W146 PolarHBondContact O-N 3.15Å; E142-W146 PolarHBondContact OE1-NE1 3.13Å; K143-W146 PolarHBondContact O-N 3.37Å; L144-W146 PolarHBondContact O-N 3.45Å; W146-W148 VanDerWaalsContact C-N 3.25Å; W146-W148 PolarHBondContact O-N 2.97Å; W146-L149 HydrophobicContact CE3-CD2 3.94Å; W146-L149 HydrophobicContact CZ3-CD2 3.8Å; W146-L149 PolarHBondContact O-N 3.49Å; W146-L149 VanDerWaalsContact O-N 3.11Å; W146-W150 PolarHBondContact O-N 2.88Å; W146-F477 HydrophobicContact CD2-CE2 4.44Å; W146-F477 AromaticContact CE2-CD2 3.86Å; W146-F477 AromaticContact CE2-CE2 3.85Å; W146-F477 HydrophobicContact CH2-CD2 4.24Å; W146-F477 HydrophobicContact CH2-CE2 4.25Å; W146-F477 AromaticContact CZ2-CD2 3.51Å; W146-F477 HydrophobicContact CZ2-CD2 3.51Å; W146-F477 AromaticContact CZ2-CE2 3.76Å; W146-F477 HydrophobicContact CZ2-CE2 3.76Å; W146-H480 HydrophobicContact CH2-CB 3.74Å; W146-H480 HydrophobicContact CZ2-CB 4.03Å; W146-V481 HydrophobicContact CH2-CG2 3.63Å; W146-V481 HydrophobicContact CZ2-CG2 4.41Å; W146-V481 HydrophobicContact CZ3-CG2 3.95Å; W146-V484 HydrophobicContact CZ3-CG2 4.28Å
147	R	92.9	Very high	88.8	Confident	18 Å²	18	20.4 Å²	20.4	7%	0.068	9%	0.091	C	C	.	.	H	α-helix	trans	-53.9	-46.5	174	-175.9	173.5	-72.1	-178.1	-5.3	111.4	E112 K143 L144 L149 W150 T151 C198 E205	E112-R147 HydrophobicContact CG-CB 4.35Å; E112-R147 IonicContact OE1-CZ 3.93Å; E112-R147 IonicContact OE1-NE 2.8Å; E112-R147 PolarHBondContact OE1-NE 2.6Å; E112-R147 IonicContact OE1-NH2 3.94Å; E112-R147 PolarHBondContact OE1-NH2 3.48Å; E112-R147 IonicContact OE2-NE 3.66Å; K143-R147 PolarHBondContact O-N 3Å; L144-R147 PolarHBondContact O-N 3.42Å; R147-L149 PolarHBondContact O-N 2.66Å; R147-W150 HydrophobicContact CG-CZ2 4.36Å; R147-T151 VanDerWaalsContact O-CB 3.28Å; R147-T151 WeakPolarHBondContact O-CB 3.38Å; R147-T151 PolarHBondContact O-N 3.23Å; R147-T151 VanDerWaalsContact O-N 3.1Å; R147-T151 PolarHBondContact O-OG1 2.94Å; R147-C198 HydrophobicContact CG-CB 4.23Å; R147-E205 IonicContact CZ-OE1 3.25Å; R147-E205 IonicContact CZ-OE2 2.77Å; R147-E205 VanDerWaalsContact NH1-CD 3.26Å; R147-E205 IonicContact NH1-OE1 2.69Å; R147-E205 PolarHBondContact NH1-OE1 3.47Å; R147-E205 IonicContact NH1-OE2 2.65Å; R147-E205 PolarHBondContact NH1-OE2 3.14Å; R147-E205 VanDerWaalsContact NH1-OE2 3.1Å; R147-E205 IonicContact NH2-OE1 3.69Å; R147-E205 PolarHBondContact NH2-OE1 3.18Å; R147-E205 IonicContact NH2-OE2 3.51Å; R147-E205 PolarHBondContact NH2-OE2 3.03Å
148	W	90.6	Very high	88.4	Confident	4 Å²	4	19.6 Å²	19.6	2%	0.015	9%	0.092	C	C	.	.	H	α-helix	trans	-60.2	-47	176.8	-70.4	132.6	0	0	0	113.3	L144 A145 W146 T151 L152 L195 C198 L199 P440	L144-W148 HydrophobicContact CD1-CZ2 3.59Å; L144-W148 VanDerWaalsContact CD1-NE1 3.27Å; L144-W148 HydrophobicContact CG-CZ2 4.47Å; L144-W148 VanDerWaalsContact O-CG 3.29Å; L144-W148 PolarHBondContact O-N 3.37Å; A145-W148 PolarHBondContact O-N 2.91Å; W146-W148 VanDerWaalsContact C-N 3.25Å; W146-W148 PolarHBondContact O-N 2.97Å; W148-T151 PolarHBondContact O-N 3.27Å; W148-L152 WeakPolarHBondContact O-CG 3.37Å; W148-L152 PolarHBondContact O-N 3.25Å; W148-L195 HydrophobicContact CD2-CD1 3.92Å; W148-L195 HydrophobicContact CE3-CD1 3.71Å; W148-L195 HydrophobicContact CH2-CD1 3.65Å; W148-L195 WeakPolarHBondContact CH2-O 3.46Å; W148-L195 HydrophobicContact CZ2-CD1 3.88Å; W148-L195 VanDerWaalsContact CZ3-CA 3.42Å; W148-L195 HydrophobicContact CZ3-CB 4.33Å; W148-L195 HydrophobicContact CZ3-CD1 3.58Å; W148-L195 HydrophobicContact CZ3-CG 4.46Å; W148-L195 WeakPolarHBondContact CZ3-O 3.37Å; W148-C198 HydrophobicContact CE3-CB 4.01Å; W148-C198 VanDerWaalsContact CH2-CA 3.5Å; W148-C198 HydrophobicContact CH2-CB 2.92Å; W148-C198 HydrophobicContact CZ2-CB 3.87Å; W148-C198 HydrophobicContact CZ3-CB 3.02Å; W148-L199 HydrophobicContact CH2-CB 4.35Å; W148-L199 HydrophobicContact CH2-CD2 4.31Å; W148-L199 HydrophobicContact CH2-CG 3.69Å; W148-L199 HydrophobicContact CZ2-CB 4.3Å; W148-L199 HydrophobicContact CZ2-CD1 4.43Å; W148-L199 HydrophobicContact CZ2-CD2 3.51Å; W148-L199 HydrophobicContact CZ2-CG 3.41Å; W148-L199 VanDerWaalsContact CZ2-CG 3.41Å; W148-P440 HydrophobicContact CB-CB 4.39Å; W148-P440 HydrophobicContact CG-CB 4.02Å; W148-P440 HydrophobicContact CG-CG 4.46Å
149	L	90.7	Very high	87.9	Confident	1 Å²	1	20.4 Å²	20.4	1%	0.005	10%	0.098	C	C	.	.	H	α-helix	trans	-62.8	-50	-174.7	-175.3	57.4	0	0	0	111.3	V108 A145 W146 R147 T151 L152 I153 I439 F443 V484 F485	V108-L149 HydrophobicContact CG1-CB 4.11Å; V108-L149 HydrophobicContact CG1-CD2 4.36Å; V108-L149 HydrophobicContact CG1-CG 4.3Å; A145-L149 WeakPolarHBondContact O-CB 3.31Å; A145-L149 PolarHBondContact O-N 2.99Å; W146-L149 HydrophobicContact CE3-CD2 3.94Å; W146-L149 HydrophobicContact CZ3-CD2 3.8Å; W146-L149 PolarHBondContact O-N 3.49Å; W146-L149 VanDerWaalsContact O-N 3.11Å; R147-L149 PolarHBondContact O-N 2.66Å; L149-T151 VanDerWaalsContact C-N 3.34Å; L149-T151 PolarHBondContact O-N 3.45Å; L149-L152 PolarHBondContact O-N 2.85Å; L149-I153 HydrophobicContact CD1-CD1 3.99Å; L149-I153 HydrophobicContact CD1-CG1 4.39Å; L149-I153 HydrophobicContact CG-CD1 3.82Å; L149-I153 WeakPolarHBondContact O-CD1 3.33Å; L149-I153 WeakPolarHBondContact O-CG1 3.23Å; L149-I153 PolarHBondContact O-N 2.79Å; L149-I439 HydrophobicContact CB-CG2 4.24Å; L149-I439 HydrophobicContact CD1-CG2 4.5Å; L149-F443 HydrophobicContact CD1-CD2 3.53Å; L149-F443 HydrophobicContact CD1-CE2 3.32Å; L149-F443 HydrophobicContact CD1-CG 4.25Å; L149-F443 HydrophobicContact CD1-CZ 3.86Å; L149-V484 HydrophobicContact CD2-CB 4.44Å; L149-V484 HydrophobicContact CD2-CG1 3.82Å; L149-V484 HydrophobicContact CG-CG1 4.48Å; L149-F485 HydrophobicContact CD1-CE1 4.11Å
150	W	91.3	Very high	87	Confident	29 Å²	29	23.4 Å²	23.4	11%	0.11	11%	0.114	C	C	.	.	H	α-helix	trans	-68.1	-35	179	73.7	-104.9	0	0	0	112.4	V105 V108 R109 E112 W146 R147 L152 I153 E154	V105-W150 HydrophobicContact CG1-CB 4.47Å; V105-W150 HydrophobicContact CG1-CE3 4.4Å; V108-W150 HydrophobicContact CB-CB 3.83Å; V108-W150 HydrophobicContact CG1-CB 3.68Å; V108-W150 HydrophobicContact CG1-CG 4.42Å; R109-W150 HydrophobicContact CG-CB 4.34Å; R109-W150 HydrophobicContact CG-CD2 3.73Å; R109-W150 HydrophobicContact CG-CE3 4.34Å; R109-W150 HydrophobicContact CG-CG 3.72Å; E112-W150 PolarHBondContact OE2-NE1 3.32Å; W146-W150 PolarHBondContact O-N 2.88Å; R147-W150 HydrophobicContact CG-CZ2 4.36Å; W150-L152 VanDerWaalsContact C-N 3.31Å; W150-L152 PolarHBondContact O-N 3.11Å; W150-I153 PolarHBondContact O-N 3.26Å; W150-E154 HydrophobicContact CE3-CB 4.48Å; W150-E154 WeakPolarHBondContact CZ3-OE2 3.44Å; W150-E154 WeakPolarHBondContact O-CB 3.48Å; W150-E154 PolarHBondContact O-N 2.68Å
151	T	90.3	Very high	86.1	Confident	9 Å²	9	27.2 Å²	27.2	6%	0.055	14%	0.137	C	C	.	.	H	α-helix	trans	-60.2	-44.4	178.1	-61.5	0	0	0	0	110.7	R147 W148 L149 C155 A194 C198	R147-T151 VanDerWaalsContact O-CB 3.28Å; R147-T151 WeakPolarHBondContact O-CB 3.38Å; R147-T151 PolarHBondContact O-N 3.23Å; R147-T151 VanDerWaalsContact O-N 3.1Å; R147-T151 PolarHBondContact O-OG1 2.94Å; W148-T151 PolarHBondContact O-N 3.27Å; L149-T151 VanDerWaalsContact C-N 3.34Å; L149-T151 PolarHBondContact O-N 3.45Å; T151-C155 WeakPolarHBondContact O-CB 3.44Å; T151-C155 PolarHBondContact O-N 3.47Å; T151-C155 PolarHBondContact O-SG 3.28Å; T151-A194 HydrophobicContact CG2-CB 3.54Å; T151-C198 PolarHBondContact OG1-SG 3.44Å; T151-C198 VanDerWaalsContact OG1-SG 3.4Å
152	L	87.8	Confident	85.2	Confident	3 Å²	3	29.8 Å²	29.8	2%	0.016	15%	0.149	C	C	.	.	H	α-helix	trans	-70.6	-39.4	177.2	-68.7	170.6	0	0	0	112.2	W148 L149 W150 E154 C155 R156 E191 F443 N444	W148-L152 WeakPolarHBondContact O-CG 3.37Å; W148-L152 PolarHBondContact O-N 3.25Å; L149-L152 PolarHBondContact O-N 2.85Å; W150-L152 VanDerWaalsContact C-N 3.31Å; W150-L152 PolarHBondContact O-N 3.11Å; L152-E154 VanDerWaalsContact C-N 3.34Å; L152-C155 PolarHBondContact O-N 3.08Å; L152-R156 WeakPolarHBondContact O-CB 3.46Å; L152-R156 VanDerWaalsContact O-CG 3.27Å; L152-R156 WeakPolarHBondContact O-CG 3.44Å; L152-R156 PolarHBondContact O-N 2.74Å; L152-E191 HydrophobicContact CD2-CB 3.94Å; L152-E191 HydrophobicContact CD2-CG 3.95Å; L152-F443 HydrophobicContact CB-CD1 3.9Å; L152-F443 HydrophobicContact CB-CE1 3.73Å; L152-F443 HydrophobicContact CD1-CB 4.32Å; L152-F443 HydrophobicContact CD1-CD1 3.57Å; L152-F443 HydrophobicContact CD1-CE1 4.29Å; L152-F443 HydrophobicContact CD1-CG 4.27Å; L152-F443 HydrophobicContact CG-CD1 4.35Å; L152-N444 WeakPolarHBondContact CD1-ND2 3.26Å; L152-N444 WeakPolarHBondContact CD2-OD1 3.34Å
153	I	85.4	Confident	83.9	Confident	2 Å²	2	33.9 Å²	33.9	1%	0.01	18%	0.178	C	C	.	.	H	α-helix	trans	-59.7	-47.1	175.2	-68.4	163.3	0	0	0	110.2	I104 V105 V108 L149 W150 R156 Q157 F443 V484 L488	I104-I153 HydrophobicContact CG2-CD1 4.21Å; V105-I153 HydrophobicContact CG2-CG2 3.77Å; V108-I153 HydrophobicContact CG2-CD1 4.38Å; L149-I153 HydrophobicContact CD1-CD1 3.99Å; L149-I153 HydrophobicContact CD1-CG1 4.39Å; L149-I153 HydrophobicContact CG-CD1 3.82Å; L149-I153 WeakPolarHBondContact O-CD1 3.33Å; L149-I153 WeakPolarHBondContact O-CG1 3.23Å; L149-I153 PolarHBondContact O-N 2.79Å; W150-I153 PolarHBondContact O-N 3.26Å; I153-R156 PolarHBondContact O-N 2.64Å; I153-Q157 HydrophobicContact CG2-CG 4.44Å; I153-Q157 WeakPolarHBondContact O-CG 3.43Å; I153-Q157 PolarHBondContact O-N 2.78Å; I153-F443 HydrophobicContact CG1-CZ 4.19Å; I153-V484 HydrophobicContact CD1-CG1 4.23Å; I153-L488 HydrophobicContact CD1-CD1 3.86Å; I153-L488 HydrophobicContact CD1-CD2 4.1Å; I153-L488 HydrophobicContact CD1-CG 4.43Å; I153-L488 HydrophobicContact CG1-CD1 4.04Å; I153-L488 HydrophobicContact CG1-CD2 4.05Å; I153-L488 HydrophobicContact CG2-CD2 3.9Å
154	E	85.8	Confident	82.7	Confident	56 Å²	56	42.4 Å²	42.4	26%	0.262	22%	0.215	S	C	.	.	H	α-helix	trans	-62.8	-47.1	178.6	-169.2	173.8	-126.9	0	0	111.1	V105 R109 W150 L152 R156 Q157 E158	V105-E154 HydrophobicContact CG2-CB 4.39Å; R109-E154 IonicContact CZ-OE1 2.85Å; R109-E154 IonicContact NH1-OE1 3.88Å; R109-E154 IonicContact NH2-OE1 3.09Å; R109-E154 PolarHBondContact NH2-OE1 2.88Å; R109-E154 IonicContact NH2-OE2 3.33Å; R109-E154 PolarHBondContact NH2-OE2 2.98Å; W150-E154 HydrophobicContact CE3-CB 4.48Å; W150-E154 WeakPolarHBondContact CZ3-OE2 3.44Å; W150-E154 WeakPolarHBondContact O-CB 3.48Å; W150-E154 PolarHBondContact O-N 2.68Å; L152-E154 VanDerWaalsContact C-N 3.34Å; E154-R156 PolarHBondContact O-N 3.5Å; E154-Q157 PolarHBondContact O-N 3.47Å; E154-Q157 VanDerWaalsContact O-N 3.15Å; E154-E158 WeakPolarHBondContact O-CG 3.19Å; E154-E158 PolarHBondContact O-N 3.3Å
155	C	84.9	Confident	81.7	Confident	13 Å²	13	44.8 Å²	44.8	9%	0.088	23%	0.231	C	C	.	.	H	α-helix	trans	-55.2	-38.4	175.4	-72.7	0	0	0	0	112.8	T151 L152 S159 R190 E191	T151-C155 WeakPolarHBondContact O-CB 3.44Å; T151-C155 PolarHBondContact O-N 3.47Å; T151-C155 PolarHBondContact O-SG 3.28Å; L152-C155 PolarHBondContact O-N 3.08Å; C155-S159 PolarHBondContact O-N 3.43Å; C155-R190 PolarHBondContact O-NH2 2.86Å; C155-E191 HydrophobicContact CB-CG 4.24Å
156	R	83.5	Confident	80.3	Confident	28 Å²	28	50.5 Å²	50.5	11%	0.106	27%	0.266	C	S	.	.	H	α-helix	trans	-78.2	-34.1	179.7	-70.5	175.2	178.3	-166.6	4	112.9	L152 I153 E154 S159 E191 F443 E446 Y448 M494	L152-R156 WeakPolarHBondContact O-CB 3.46Å; L152-R156 VanDerWaalsContact O-CG 3.27Å; L152-R156 WeakPolarHBondContact O-CG 3.44Å; L152-R156 PolarHBondContact O-N 2.74Å; I153-R156 PolarHBondContact O-N 2.64Å; E154-R156 PolarHBondContact O-N 3.5Å; R156-S159 VanDerWaalsContact O-CB 3.29Å; R156-S159 WeakPolarHBondContact O-CB 3.27Å; R156-S159 PolarHBondContact O-N 2.77Å; R156-E191 VanDerWaalsContact CG-OE1 3.28Å; R156-E191 WeakPolarHBondContact CG-OE1 3.47Å; R156-E191 IonicContact CZ-OE1 2.79Å; R156-E191 IonicContact NE-OE1 3.55Å; R156-E191 PolarHBondContact NE-OE1 2.93Å; R156-E191 IonicContact NH2-OE1 2.82Å; R156-F443 VanDerWaalsContact CZ-CE1 3.49Å; R156-F443 PolarHBondContact NH2-O 3.37Å; R156-F443 VanDerWaalsContact NH2-O 3.07Å; R156-E446 IonicContact NH2-OE1 3.76Å; R156-Y448 PolarHBondContact NH1-OH 3.35Å; R156-Y448 PolarHBondContact NH2-OH 3.39Å; R156-M494 HydrophobicContact CB-CE 3.92Å
157	Q	79.2	Confident	79	Confident	69 Å²	69	55 Å²	55	32%	0.322	29%	0.287	S	S	.	.	H	α-helix	trans	-63	-44.3	171.5	-74.5	177.8	-17.1	0	0	110.7	V105 I153 E154 S159 L160 M494	V105-Q157 VanDerWaalsContact CG2-OE1 3.26Å; I153-Q157 HydrophobicContact CG2-CG 4.44Å; I153-Q157 WeakPolarHBondContact O-CG 3.43Å; I153-Q157 PolarHBondContact O-N 2.78Å; E154-Q157 PolarHBondContact O-N 3.47Å; E154-Q157 VanDerWaalsContact O-N 3.15Å; Q157-S159 PolarHBondContact O-N 3.34Å; Q157-L160 WeakPolarHBondContact O-CB 3.43Å; Q157-L160 PolarHBondContact O-N 2.89Å; Q157-L160 VanDerWaalsContact O-N 3.11Å; Q157-M494 HydrophobicContact CG-CE 3.97Å
158	E	77.7	Confident	77.9	Confident	84 Å²	84	58.8 Å²	58.8	39%	0.393	32%	0.316	S	S	.	.	H	α-helix	trans	-61.9	-29.9	175.2	-68.4	179.9	176.2	0	0	113.5	E154 L160 D161 N162 R190	E154-E158 WeakPolarHBondContact O-CG 3.19Å; E154-E158 PolarHBondContact O-N 3.3Å; E158-L160 VanDerWaalsContact C-N 3.27Å; E158-L160 PolarHBondContact O-N 3.29Å; E158-D161 PolarHBondContact O-N 3.42Å; E158-N162 VanDerWaalsContact O-CG 3.31Å; E158-N162 PolarHBondContact O-N 3.12Å; E158-N162 VanDerWaalsContact O-N 3.15Å; E158-R190 IonicContact OE2-CZ 2.82Å; E158-R190 IonicContact OE2-NE 2.74Å; E158-R190 IonicContact OE2-NH1 3.4Å; E158-R190 PolarHBondContact OE2-NH1 2.93Å
159	S	75.8	Confident	77.2	Confident	23 Å²	23	60.8 Å²	60.8	16%	0.161	33%	0.327	C	S	.	.	H	α-helix	trans	-60.7	-37.6	174.7	-173.8	0	0	0	0	112.4	C155 R156 Q157 D161 N162 N187 R190	C155-S159 PolarHBondContact O-N 3.43Å; R156-S159 VanDerWaalsContact O-CB 3.29Å; R156-S159 WeakPolarHBondContact O-CB 3.27Å; R156-S159 PolarHBondContact O-N 2.77Å; Q157-S159 PolarHBondContact O-N 3.34Å; S159-D161 VanDerWaalsContact C-N 3.3Å; S159-D161 PolarHBondContact O-N 2.83Å; S159-N162 PolarHBondContact O-N 2.93Å; S159-N187 VanDerWaalsContact CB-OD1 3.23Å; S159-N187 WeakPolarHBondContact CB-OD1 3.33Å; S159-N187 PolarHBondContact OG-ND2 2.95Å; S159-N187 PolarHBondContact OG-OD1 2.91Å; S159-R190 VanDerWaalsContact CA-NH2 3.27Å
160	L	69.8	Low	76.2	Confident	69 Å²	69	64.5 Å²	64.5	36%	0.361	35%	0.347	S	S	.	.	H	α-helix	trans	-68.8	-31.6	-179.9	-63	167.4	0	0	0	112	Q157 E158 N493 M494	Q157-L160 WeakPolarHBondContact O-CB 3.43Å; Q157-L160 PolarHBondContact O-N 2.89Å; Q157-L160 VanDerWaalsContact O-N 3.11Å; E158-L160 VanDerWaalsContact C-N 3.27Å; E158-L160 PolarHBondContact O-N 3.29Å; L160-N493 HydrophobicContact CD1-CB 4.22Å; L160-N493 WeakPolarHBondContact CD1-O 3.32Å; L160-M494 HydrophobicContact CD1-CE 3.95Å; L160-M494 HydrophobicContact CD1-SD 3.83Å
161	D	69.5	Low	75.1	Confident	135 Å²	135	66.2 Å²	66.2	72%	0.722	37%	0.373	S	S	*	.	H	α-helix	trans	-82.3	-25.4	179.5	-68.2	-21.8	0	0	0	112.7	E158 S159 S163	E158-D161 PolarHBondContact O-N 3.42Å; S159-D161 VanDerWaalsContact C-N 3.3Å; S159-D161 PolarHBondContact O-N 2.83Å; D161-S163 PolarHBondContact O-N 3.16Å
162	N	69.7	Low	74.3	Confident	63 Å²	63	77 Å²	77	34%	0.337	41%	0.413	S	S	.	.			trans	-73.9	109.8	-177.1	-78.5	-13.9	0	0	0	111.7	E158 S159 K184 R190	E158-N162 VanDerWaalsContact O-CG 3.31Å; E158-N162 PolarHBondContact O-N 3.12Å; E158-N162 VanDerWaalsContact O-N 3.15Å; S159-N162 PolarHBondContact O-N 2.93Å; N162-K184 PolarHBondContact ND2-O 2.73Å; N162-R190 PolarHBondContact ND2-NH1 2.95Å
163	S	65.4	Low	73.9	Confident	87 Å²	87	78.3 Å²	78.3	61%	0.608	42%	0.419	S	S	*	.			trans	-62.6	152.2	169.3	62.8	0	0	0	0	112.1	D161	D161-S163 PolarHBondContact O-N 3.16Å
164	K	68.2	Low	73.9	Confident	184 Å²	184	79 Å²	79	80%	0.8	42%	0.424	S	S	*	.			trans	-49	149.5	176.9	-71.2	-175.4	179.2	-179.1	0	111.6	T166	K164-T166 PolarHBondContact O-N 3.3Å
165	P	69.1	Low	74	Confident	60 Å²	60	76.7 Å²	76.7	39%	0.39	41%	0.413	S	S	.	.			trans	-55.8	111.5	-179	-15.7	23.9	0	0	0	111.2	Y181 F185	P165-Y181 HydrophobicContact CB-CE2 4.33Å; P165-Y181 VanDerWaalsContact CB-OH 3.23Å; P165-Y181 WeakPolarHBondContact CB-OH 3.17Å; P165-F185 HydrophobicContact CB-CD1 3.99Å; P165-F185 HydrophobicContact CB-CD2 4.22Å; P165-F185 HydrophobicContact CB-CE1 4.02Å; P165-F185 HydrophobicContact CB-CE2 4.24Å; P165-F185 HydrophobicContact CB-CG 4.09Å; P165-F185 HydrophobicContact CB-CZ 4.13Å; P165-F185 HydrophobicContact CG-CB 4.05Å; P165-F185 HydrophobicContact CG-CD1 3.69Å; P165-F185 HydrophobicContact CG-CD2 4.38Å; P165-F185 HydrophobicContact CG-CE1 4.19Å; P165-F185 HydrophobicContact CG-CG 3.79Å
166	T	63.8	Low	74	Confident	123 Å²	123	76.2 Å²	76.2	76%	0.755	41%	0.41	S	S	*	.			trans	-90.1	-23.2	169.7	49.3	0	0	0	0	111.3	K164	K164-T166 PolarHBondContact O-N 3.3Å
167	E	67.8	Low	74.1	Confident	94 Å²	94	78.3 Å²	78.3	44%	0.439	42%	0.423	S	S	.	.	S	Bend	trans	-76	121.4	178.9	-67.3	165.1	-147.9	0	0	110.1	Y181 K184	E167-Y181 HydrophobicContact CB-CE2 4.38Å; E167-K184 IonicContact OE1-NZ 3.94Å; E167-K184 PolarHBondContact OE1-NZ 2.76Å
168	S	68.6	Low	74.6	Confident	98 Å²	98	75.1 Å²	75.1	69%	0.685	41%	0.408	S	S	*	.			trans	-75.9	124.8	172.1	60.1	0	0	0	0	109.7	D170	S168-D170 PolarHBondContact O-N 2.76Å; S168-D170 VanDerWaalsContact O-N 3.14Å
169	L	76.2	Confident	75.1	Confident	47 Å²	47	71.8 Å²	71.8	25%	0.246	39%	0.393	C	S	.	.			trans	-62	114.8	167.9	-71	162	0	0	0	108.7	M173 Y181 F388 L392 T400	L169-M173 HydrophobicContact CD2-CE 4.11Å; L169-M173 HydrophobicContact CD2-SD 3.83Å; L169-Y181 HydrophobicContact CD1-CD1 4.17Å; L169-Y181 HydrophobicContact CD1-CE1 3.61Å; L169-Y181 HydrophobicContact CD1-CE2 4.35Å; L169-Y181 HydrophobicContact CD2-CD1 3.75Å; L169-Y181 HydrophobicContact CD2-CD2 3.67Å; L169-Y181 HydrophobicContact CD2-CE1 3.96Å; L169-Y181 HydrophobicContact CD2-CE2 3.86Å; L169-Y181 HydrophobicContact CD2-CG 3.61Å; L169-Y181 HydrophobicContact CG-CD1 4.3Å; L169-Y181 HydrophobicContact CG-CD2 4.2Å; L169-Y181 HydrophobicContact CG-CE1 3.98Å; L169-Y181 HydrophobicContact CG-CE2 3.84Å; L169-Y181 HydrophobicContact CG-CG 4.41Å; L169-F388 HydrophobicContact CD1-CE1 4.45Å; L169-F388 HydrophobicContact CD1-CZ 3.92Å; L169-L392 HydrophobicContact CB-CD2 3.82Å; L169-L392 HydrophobicContact CD1-CD1 4.35Å; L169-L392 HydrophobicContact CD1-CD2 3.71Å; L169-L392 HydrophobicContact CD2-CD1 4.22Å; L169-L392 HydrophobicContact CD2-CD2 4.48Å; L169-L392 HydrophobicContact CG-CD2 4.19Å; L169-T400 HydrophobicContact CD1-CG2 3.77Å
170	D	70.6	Confident	75.7	Confident	79 Å²	79	75.1 Å²	75.1	42%	0.422	41%	0.406	S	S	.	.			trans	-105.1	162.8	177	80.9	34.5	0	0	0	111.5	S168 W172 M173	S168-D170 PolarHBondContact O-N 2.76Å; S168-D170 VanDerWaalsContact O-N 3.14Å; D170-W172 PolarHBondContact O-N 3.39Å; D170-W172 VanDerWaalsContact OD1-CA 3.28Å; D170-W172 WeakPolarHBondContact OD1-CA 3.14Å; D170-W172 WeakPolarHBondContact OD1-CB 3.11Å; D170-W172 PolarHBondContact OD1-N 3.14Å; D170-M173 WeakPolarHBondContact OD1-CG 3.33Å; D170-M173 PolarHBondContact OD1-N 3.49Å
171	G	68.3	Low	76.6	Confident	64 Å²	64	72.7 Å²	72.7	66%	0.66	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.6	-10.3	-179.6	0	0	0	0	0	114.7	R393	G171-R393 PolarHBondContact O-NH1 2.91Å
172	W	73.1	Confident	77.6	Confident	237 Å²	237	66.2 Å²	66.2	90%	0.898	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95	-14.9	-177.5	-58.8	103.9	0	0	0	112.8	D170 T174	D170-W172 PolarHBondContact O-N 3.39Å; D170-W172 VanDerWaalsContact OD1-CA 3.28Å; D170-W172 WeakPolarHBondContact OD1-CA 3.14Å; D170-W172 WeakPolarHBondContact OD1-CB 3.11Å; D170-W172 PolarHBondContact OD1-N 3.14Å; W172-T174 PolarHBondContact O-N 3.38Å
173	M	80.3	Confident	78.5	Confident	29 Å²	29	65.5 Å²	65.5	14%	0.143	35%	0.353	C	S	.	.			trans	-53.6	131.8	172.1	-71.8	179.2	80.3	0	0	110.8	L169 D170 D177 I178 R393	L169-M173 HydrophobicContact CD2-CE 4.11Å; L169-M173 HydrophobicContact CD2-SD 3.83Å; D170-M173 WeakPolarHBondContact OD1-CG 3.33Å; D170-M173 PolarHBondContact OD1-N 3.49Å; M173-D177 HydrophobicContact CB-CB 4.07Å; M173-D177 HydrophobicContact CE-CB 3.71Å; M173-D177 HydrophobicContact CG-CB 4.35Å; M173-I178 HydrophobicContact CB-CD1 4.44Å; M173-I178 HydrophobicContact CB-CG1 3.98Å; M173-R393 PolarHBondContact O-NH1 2.88Å; M173-R393 PolarHBondContact O-NH2 3.07Å
174	T	85	Confident	79.5	Confident	16 Å²	16	65.4 Å²	65.4	10%	0.098	34%	0.342	C	S	.	.			trans	-72.4	161.4	174.7	68.3	0	0	0	0	110.4	W172 S176 D177 I178 S306	W172-T174 PolarHBondContact O-N 3.38Å; T174-S176 PolarHBondContact O-N 3.32Å; T174-D177 WeakPolarHBondContact CB-OD2 3.22Å; T174-D177 PolarHBondContact N-OD2 2.83Å; T174-D177 PolarHBondContact O-N 2.97Å; T174-D177 PolarHBondContact OG1-N 3.06Å; T174-D177 PolarHBondContact OG1-OD2 3Å; T174-I178 WeakPolarHBondContact O-CG1 2.89Å; T174-I178 PolarHBondContact O-N 3.46Å; T174-S306 VanDerWaalsContact CB-O 3.3Å; T174-S306 WeakPolarHBondContact CB-O 3.27Å; T174-S306 PolarHBondContact OG1-O 3.32Å
175	D	86.6	Confident	80.3	Confident	8 Å²	8	57.6 Å²	57.6	4%	0.043	31%	0.308	C	S	.	.	H	α-helix	trans	-61.2	-30.4	177.6	-68.2	-7.9	0	0	0	111.1	F179 L305 R328 F385 L389 R393	D175-F179 WeakPolarHBondContact O-CB 3.41Å; D175-F179 PolarHBondContact O-N 3.36Å; D175-L305 HydrophobicContact CB-CD2 4.5Å; D175-R328 WeakPolarHBondContact OD2-CB 3.17Å; D175-F385 HydrophobicContact CB-CZ 4.27Å; D175-F385 WeakPolarHBondContact O-CZ 3.38Å; D175-L389 HydrophobicContact CB-CD2 4.48Å; D175-R393 IonicContact OD1-CZ 3.77Å; D175-R393 IonicContact OD1-NH2 3.76Å; D175-R393 PolarHBondContact OD1-NH2 3.12Å
176	S	86.5	Confident	81.2	Confident	4 Å²	4	54.8 Å²	54.8	3%	0.028	29%	0.289	C	S	.	.	H	α-helix	trans	-62.8	-46.1	169.8	-179.4	0	0	0	0	112.2	T174 I178 F179 H180 S306 R307	T174-S176 PolarHBondContact O-N 3.32Å; S176-I178 VanDerWaalsContact C-N 3.31Å; S176-I178 PolarHBondContact O-N 2.94Å; S176-F179 PolarHBondContact O-N 3.49Å; S176-H180 PolarHBondContact O-N 3.28Å; S176-H180 PolarHBondContact O-ND1 3.3Å; S176-S306 WeakPolarHBondContact CB-O 3.39Å; S176-S306 PolarHBondContact N-O 3.4Å; S176-S306 VanDerWaalsContact N-O 3.14Å; S176-R307 PolarHBondContact OG-NE 3.37Å; S176-R307 VanDerWaalsContact OG-NE 3.08Å; S176-R307 PolarHBondContact OG-NH2 3.36Å
177	D	85.5	Confident	82.3	Confident	71 Å²	71	50.5 Å²	50.5	38%	0.38	26%	0.262	S	S	.	.	H	α-helix	trans	-63.2	-40.5	179.2	-56.4	-42.9	0	0	0	111.2	M173 T174 H180 Y181	M173-D177 HydrophobicContact CB-CB 4.07Å; M173-D177 HydrophobicContact CE-CB 3.71Å; M173-D177 HydrophobicContact CG-CB 4.35Å; T174-D177 WeakPolarHBondContact CB-OD2 3.22Å; T174-D177 PolarHBondContact N-OD2 2.83Å; T174-D177 PolarHBondContact O-N 2.97Å; T174-D177 PolarHBondContact OG1-N 3.06Å; T174-D177 PolarHBondContact OG1-OD2 3Å; D177-H180 PolarHBondContact O-N 2.92Å; D177-Y181 WeakPolarHBondContact O-CB 3.27Å; D177-Y181 PolarHBondContact O-N 3.08Å
178	I	88.4	Confident	83.3	Confident	2 Å²	2	47 Å²	47	1%	0.01	25%	0.245	C	C	.	.	H	α-helix	trans	-64.9	-42	177.1	-64.7	169.7	0	0	0	110.9	M173 T174 S176 Y181 M182 F385 F388 L389 L392 R393	M173-I178 HydrophobicContact CB-CD1 4.44Å; M173-I178 HydrophobicContact CB-CG1 3.98Å; T174-I178 WeakPolarHBondContact O-CG1 2.89Å; T174-I178 PolarHBondContact O-N 3.46Å; S176-I178 VanDerWaalsContact C-N 3.31Å; S176-I178 PolarHBondContact O-N 2.94Å; I178-Y181 WeakPolarHBondContact O-CB 3.42Å; I178-Y181 PolarHBondContact O-N 3.06Å; I178-M182 PolarHBondContact O-N 2.94Å; I178-F385 HydrophobicContact CG2-CE2 4.32Å; I178-F388 HydrophobicContact CG2-CD1 3.73Å; I178-F388 HydrophobicContact CG2-CE1 3.79Å; I178-L389 HydrophobicContact CB-CD2 4.12Å; I178-L389 HydrophobicContact CD1-CD2 3.59Å; I178-L389 HydrophobicContact CG1-CD2 4.46Å; I178-L389 HydrophobicContact CG2-CD2 3.8Å; I178-L392 HydrophobicContact CD1-CD1 4.09Å; I178-L392 HydrophobicContact CG1-CD1 4.2Å; I178-L392 HydrophobicContact CG2-CD1 3.58Å; I178-R393 VanDerWaalsContact CD1-NH2 3.33Å
179	F	89.4	Confident	84.4	Confident	14 Å²	14	42.3 Å²	42.3	6%	0.061	21%	0.212	C	C	.	.	H	α-helix	trans	-62.2	-44.2	176.1	-173.3	-91.2	0	0	0	111.8	D175 S176 Y181 M182 L183 F189 R193 L305 F385	D175-F179 WeakPolarHBondContact O-CB 3.41Å; D175-F179 PolarHBondContact O-N 3.36Å; S176-F179 PolarHBondContact O-N 3.49Å; F179-Y181 VanDerWaalsContact C-N 3.31Å; F179-Y181 PolarHBondContact O-N 3.27Å; F179-M182 PolarHBondContact O-N 3.39Å; F179-L183 HydrophobicContact CD1-CD1 3.83Å; F179-L183 HydrophobicContact CD1-CG 4.18Å; F179-L183 HydrophobicContact CE1-CD1 3.55Å; F179-L183 HydrophobicContact CE1-CD2 4.39Å; F179-L183 HydrophobicContact CE1-CG 3.99Å; F179-L183 PolarHBondContact O-N 3.31Å; F179-F189 HydrophobicContact CD2-CE1 4.32Å; F179-F189 AromaticContact CD2-CZ 3.97Å; F179-F189 HydrophobicContact CD2-CZ 3.97Å; F179-F189 HydrophobicContact CE2-CE1 4.03Å; F179-F189 AromaticContact CE2-CZ 3.56Å; F179-F189 HydrophobicContact CE2-CZ 3.56Å; F179-F189 HydrophobicContact CZ-CE1 4.25Å; F179-F189 HydrophobicContact CZ-CZ 4.12Å; F179-R193 HydrophobicContact CZ-CG 4.41Å; F179-L305 HydrophobicContact CB-CD1 3.49Å; F179-L305 VanDerWaalsContact CB-CD1 3.49Å; F179-L305 HydrophobicContact CD1-CD1 4.12Å; F179-L305 HydrophobicContact CD2-CD1 3.86Å; F179-L305 HydrophobicContact CG-CD1 3.58Å; F179-F385 HydrophobicContact CB-CD2 4.31Å; F179-F385 HydrophobicContact CB-CE2 3.61Å; F179-F385 HydrophobicContact CB-CZ 3.95Å; F179-F385 HydrophobicContact CD2-CD1 4.32Å; F179-F385 AromaticContact CD2-CD2 3.7Å; F179-F385 HydrophobicContact CD2-CD2 3.7Å; F179-F385 HydrophobicContact CD2-CE1 4.35Å; F179-F385 AromaticContact CD2-CE2 3.76Å; F179-F385 HydrophobicContact CD2-CE2 3.76Å; F179-F385 AromaticContact CD2-CG 3.99Å; F179-F385 HydrophobicContact CD2-CG 3.99Å; F179-F385 HydrophobicContact CD2-CZ 4.07Å; F179-F385 HydrophobicContact CG-CD2 4.48Å; F179-F385 HydrophobicContact CG-CE2 4.19Å
180	H	88.3	Confident	85.1	Confident	94 Å²	94	40.9 Å²	40.9	44%	0.435	20%	0.204	S	C	.	.	H	α-helix	trans	-64.6	-36.4	175.3	-73.3	89.3	0	0	0	112.2	S176 D177 L183 K184	S176-H180 PolarHBondContact O-N 3.28Å; S176-H180 PolarHBondContact O-ND1 3.3Å; D177-H180 PolarHBondContact O-N 2.92Å; H180-L183 PolarHBondContact O-N 3.06Å; H180-K184 WeakPolarHBondContact O-CB 3.36Å; H180-K184 PolarHBondContact O-N 3.15Å
181	Y	88.3	Confident	85.9	Confident	17 Å²	17	37.3 Å²	37.3	7%	0.067	19%	0.185	C	C	.	.	H	α-helix	trans	-59.4	-47.3	172.5	-177.7	-80.4	0	0	0	111.1	P165 E167 L169 D177 I178 F179 L183 K184 F185 F388 L404	P165-Y181 HydrophobicContact CB-CE2 4.33Å; P165-Y181 VanDerWaalsContact CB-OH 3.23Å; P165-Y181 WeakPolarHBondContact CB-OH 3.17Å; E167-Y181 HydrophobicContact CB-CE2 4.38Å; L169-Y181 HydrophobicContact CD1-CD1 4.17Å; L169-Y181 HydrophobicContact CD1-CE1 3.61Å; L169-Y181 HydrophobicContact CD1-CE2 4.35Å; L169-Y181 HydrophobicContact CD2-CD1 3.75Å; L169-Y181 HydrophobicContact CD2-CD2 3.67Å; L169-Y181 HydrophobicContact CD2-CE1 3.96Å; L169-Y181 HydrophobicContact CD2-CE2 3.86Å; L169-Y181 HydrophobicContact CD2-CG 3.61Å; L169-Y181 HydrophobicContact CG-CD1 4.3Å; L169-Y181 HydrophobicContact CG-CD2 4.2Å; L169-Y181 HydrophobicContact CG-CE1 3.98Å; L169-Y181 HydrophobicContact CG-CE2 3.84Å; L169-Y181 HydrophobicContact CG-CG 4.41Å; D177-Y181 WeakPolarHBondContact O-CB 3.27Å; D177-Y181 PolarHBondContact O-N 3.08Å; I178-Y181 WeakPolarHBondContact O-CB 3.42Å; I178-Y181 PolarHBondContact O-N 3.06Å; F179-Y181 VanDerWaalsContact C-N 3.31Å; F179-Y181 PolarHBondContact O-N 3.27Å; Y181-L183 PolarHBondContact O-N 2.87Å; Y181-K184 PolarHBondContact O-N 2.95Å; Y181-F185 AromaticContact CD1-CD2 3.92Å; Y181-F185 HydrophobicContact CD1-CD2 3.92Å; Y181-F185 AromaticContact CD2-CD2 3.5Å; Y181-F185 HydrophobicContact CD2-CD2 3.5Å; Y181-F185 VanDerWaalsContact CD2-CD2 3.5Å; Y181-F185 AromaticContact CD2-CE2 3.56Å; Y181-F185 HydrophobicContact CD2-CE2 3.56Å; Y181-F185 HydrophobicContact CE1-CB 4.24Å; Y181-F185 AromaticContact CE1-CD2 3.82Å; Y181-F185 HydrophobicContact CE1-CD2 3.82Å; Y181-F185 HydrophobicContact CE1-CG 4.43Å; Y181-F185 AromaticContact CE2-CD2 3.42Å; Y181-F185 HydrophobicContact CE2-CD2 3.42Å; Y181-F185 VanDerWaalsContact CE2-CD2 3.42Å; Y181-F185 AromaticContact CE2-CE2 3.49Å; Y181-F185 HydrophobicContact CE2-CE2 3.49Å; Y181-F185 VanDerWaalsContact CE2-CE2 3.49Å; Y181-F185 AromaticContact CG-CD2 3.75Å; Y181-F185 HydrophobicContact CG-CD2 3.75Å; Y181-F185 HydrophobicContact CG-CE2 4.23Å; Y181-F185 AromaticContact CZ-CD2 3.59Å; Y181-F185 WeakPolarHBondContact O-CD2 3.5Å; Y181-F185 PolarHBondContact O-N 3.07Å; Y181-F388 HydrophobicContact CD1-CE1 4.42Å; Y181-F388 HydrophobicContact CD1-CZ 4.26Å; Y181-F388 HydrophobicContact CE1-CZ 4.28Å; Y181-L404 HydrophobicContact CE1-CD1 4.22Å; Y181-L404 HydrophobicContact CE1-CD2 4.37Å
182	M	90.2	Very high	87	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-60.9	-44.6	175.7	-68.8	-177.8	73.2	0	0	111.8	I178 F179 K184 F185 D186 F189 F385 F388 F403	I178-M182 PolarHBondContact O-N 2.94Å; F179-M182 PolarHBondContact O-N 3.39Å; M182-K184 PolarHBondContact O-N 2.99Å; M182-F185 PolarHBondContact O-N 3.5Å; M182-D186 WeakPolarHBondContact O-CA 3.47Å; M182-D186 VanDerWaalsContact O-CB 3.26Å; M182-D186 WeakPolarHBondContact O-CB 3.36Å; M182-D186 PolarHBondContact O-N 3.46Å; M182-F189 HydrophobicContact CB-CD1 3.65Å; M182-F189 HydrophobicContact CB-CE1 3.82Å; M182-F189 HydrophobicContact CB-CG 4.26Å; M182-F189 HydrophobicContact CE-CB 4.41Å; M182-F189 HydrophobicContact CE-CD1 4.33Å; M182-F189 HydrophobicContact CE-CD2 3.69Å; M182-F189 HydrophobicContact CE-CE2 3.94Å; M182-F189 HydrophobicContact CE-CG 3.89Å; M182-F189 HydrophobicContact CE-CZ 4.35Å; M182-F385 HydrophobicContact SD-CD2 3.75Å; M182-F388 HydrophobicContact CE-CB 3.76Å; M182-F388 HydrophobicContact CE-CD1 4.3Å; M182-F388 HydrophobicContact CE-CD2 4.48Å; M182-F388 HydrophobicContact CE-CG 3.96Å; M182-F388 HydrophobicContact CG-CD1 3.51Å; M182-F388 HydrophobicContact CG-CE1 3.58Å; M182-F388 HydrophobicContact CG-CG 4.06Å; M182-F388 HydrophobicContact CG-CZ 4.21Å; M182-F388 HydrophobicContact SD-CB 3.61Å; M182-F388 HydrophobicContact SD-CD1 3.33Å; M182-F388 WeakPolarHBondContact SD-CD1 3.41Å; M182-F388 HydrophobicContact SD-CD2 4.5Å; M182-F388 HydrophobicContact SD-CE1 4.07Å; M182-F388 HydrophobicContact SD-CG 3.58Å; M182-F388 VanDerWaalsContact SD-CG 3.58Å; M182-F403 HydrophobicContact CE-CE1 4Å
183	L	89	Confident	87.9	Confident	47 Å²	47	23.7 Å²	23.7	25%	0.246	11%	0.113	C	C	.	.	H	α-helix	trans	-59.4	-34.4	176.6	-71.4	178.3	0	0	0	113.3	F179 H180 Y181 F189 R190 R193	F179-L183 HydrophobicContact CD1-CD1 3.83Å; F179-L183 HydrophobicContact CD1-CG 4.18Å; F179-L183 HydrophobicContact CE1-CD1 3.55Å; F179-L183 HydrophobicContact CE1-CD2 4.39Å; F179-L183 HydrophobicContact CE1-CG 3.99Å; F179-L183 PolarHBondContact O-N 3.31Å; H180-L183 PolarHBondContact O-N 3.06Å; Y181-L183 PolarHBondContact O-N 2.87Å; L183-F189 HydrophobicContact CD2-CD1 3.89Å; L183-F189 HydrophobicContact CD2-CE1 3.72Å; L183-F189 HydrophobicContact CG-CD1 4.43Å; L183-F189 HydrophobicContact CG-CE1 4.08Å; L183-R190 WeakPolarHBondContact O-CD 3.35Å; L183-R193 HydrophobicContact CD2-CB 3.88Å; L183-R193 HydrophobicContact CD2-CG 3.92Å
184	K	85.7	Confident	88.5	Confident	85 Å²	85	23.1 Å²	23.1	37%	0.37	11%	0.113	S	C	.	.	H	α-helix	trans	-79	-39.2	-178.2	-174	174.8	174.8	-176.7	0	112.5	N162 E167 H180 Y181 M182	N162-K184 PolarHBondContact ND2-O 2.73Å; E167-K184 IonicContact OE1-NZ 3.94Å; E167-K184 PolarHBondContact OE1-NZ 2.76Å; H180-K184 WeakPolarHBondContact O-CB 3.36Å; H180-K184 PolarHBondContact O-N 3.15Å; Y181-K184 PolarHBondContact O-N 2.95Å; M182-K184 PolarHBondContact O-N 2.99Å
185	F	86.4	Confident	88.8	Confident	21 Å²	21	22.5 Å²	22.5	9%	0.092	11%	0.109	C	C	.	.	H	α-helix	trans	-116.4	-12.2	-166.7	-61.2	-61.9	0	0	0	115.4	P165 Y181 M182	P165-F185 HydrophobicContact CB-CD1 3.99Å; P165-F185 HydrophobicContact CB-CD2 4.22Å; P165-F185 HydrophobicContact CB-CE1 4.02Å; P165-F185 HydrophobicContact CB-CE2 4.24Å; P165-F185 HydrophobicContact CB-CG 4.09Å; P165-F185 HydrophobicContact CB-CZ 4.13Å; P165-F185 HydrophobicContact CG-CB 4.05Å; P165-F185 HydrophobicContact CG-CD1 3.69Å; P165-F185 HydrophobicContact CG-CD2 4.38Å; P165-F185 HydrophobicContact CG-CE1 4.19Å; P165-F185 HydrophobicContact CG-CG 3.79Å; Y181-F185 AromaticContact CD1-CD2 3.92Å; Y181-F185 HydrophobicContact CD1-CD2 3.92Å; Y181-F185 AromaticContact CD2-CD2 3.5Å; Y181-F185 HydrophobicContact CD2-CD2 3.5Å; Y181-F185 VanDerWaalsContact CD2-CD2 3.5Å; Y181-F185 AromaticContact CD2-CE2 3.56Å; Y181-F185 HydrophobicContact CD2-CE2 3.56Å; Y181-F185 HydrophobicContact CE1-CB 4.24Å; Y181-F185 AromaticContact CE1-CD2 3.82Å; Y181-F185 HydrophobicContact CE1-CD2 3.82Å; Y181-F185 HydrophobicContact CE1-CG 4.43Å; Y181-F185 AromaticContact CE2-CD2 3.42Å; Y181-F185 HydrophobicContact CE2-CD2 3.42Å; Y181-F185 VanDerWaalsContact CE2-CD2 3.42Å; Y181-F185 AromaticContact CE2-CE2 3.49Å; Y181-F185 HydrophobicContact CE2-CE2 3.49Å; Y181-F185 VanDerWaalsContact CE2-CE2 3.49Å; Y181-F185 AromaticContact CG-CD2 3.75Å; Y181-F185 HydrophobicContact CG-CD2 3.75Å; Y181-F185 HydrophobicContact CG-CE2 4.23Å; Y181-F185 AromaticContact CZ-CD2 3.59Å; Y181-F185 WeakPolarHBondContact O-CD2 3.5Å; Y181-F185 PolarHBondContact O-N 3.07Å; M182-F185 PolarHBondContact O-N 3.5Å
186	D	88.1	Confident	89.1	Confident	0 Å²	0	22.1 Å²	22.1	0%	0	11%	0.107	C	C	.	.			trans	-107.7	104	172.3	-172.4	-33.8	0	0	0	109.2	M182 K188 F189 R190 L404 D405 S408	M182-D186 WeakPolarHBondContact O-CA 3.47Å; M182-D186 VanDerWaalsContact O-CB 3.26Å; M182-D186 WeakPolarHBondContact O-CB 3.36Å; M182-D186 PolarHBondContact O-N 3.46Å; D186-K188 VanDerWaalsContact C-N 3.32Å; D186-K188 PolarHBondContact O-N 3.45Å; D186-K188 PolarHBondContact OD1-N 2.85Å; D186-K188 VanDerWaalsContact OD1-N 3.16Å; D186-F189 HydrophobicContact CB-CB 3.77Å; D186-F189 VanDerWaalsContact CG-CB 3.44Å; D186-F189 PolarHBondContact O-N 2.88Å; D186-F189 WeakPolarHBondContact OD1-CB 3.46Å; D186-F189 PolarHBondContact OD1-N 3.15Å; D186-R190 WeakPolarHBondContact O-CB 3.29Å; D186-R190 PolarHBondContact O-N 2.88Å; D186-L404 HydrophobicContact CB-CD2 3.88Å; D186-D405 PolarHBondContact OD2-N 3.22Å; D186-S408 VanDerWaalsContact CG-OG 3.32Å; D186-S408 VanDerWaalsContact OD1-CB 3.29Å; D186-S408 WeakPolarHBondContact OD1-CB 3.13Å; D186-S408 PolarHBondContact OD1-OG 2.98Å; D186-S408 WeakPolarHBondContact OD2-CB 3.49Å; D186-S408 PolarHBondContact OD2-OG 3.46Å
187	N	86.4	Confident	89.3	Confident	33 Å²	33	24 Å²	24	18%	0.176	11%	0.114	C	C	.	.	H	α-helix	trans	-64.2	-40.8	-174.7	-62.4	-56.9	0	0	0	111.3	S159 R190 E191 D405	S159-N187 VanDerWaalsContact CB-OD1 3.23Å; S159-N187 WeakPolarHBondContact CB-OD1 3.33Å; S159-N187 PolarHBondContact OG-ND2 2.95Å; S159-N187 PolarHBondContact OG-OD1 2.91Å; N187-R190 PolarHBondContact O-N 2.95Å; N187-R190 PolarHBondContact OD1-NH2 3.21Å; N187-E191 WeakPolarHBondContact O-CG 3.19Å; N187-E191 PolarHBondContact O-N 3.14Å; N187-D405 WeakPolarHBondContact CB-OD1 3.33Å; N187-D405 PolarHBondContact N-OD1 3.44Å; N187-D405 PolarHBondContact ND2-OD1 3.31Å; N187-D405 PolarHBondContact ND2-OD2 3.49Å
188	K	88.2	Confident	89.6	Confident	20 Å²	20	21.2 Å²	21.2	9%	0.087	10%	0.1	C	C	.	.	H	α-helix	trans	-74.9	-36.3	-176.4	-62.2	-55.8	-173.9	178.2	0	111.8	D186 E191 L192 F409 E446	D186-K188 VanDerWaalsContact C-N 3.32Å; D186-K188 PolarHBondContact O-N 3.45Å; D186-K188 PolarHBondContact OD1-N 2.85Å; D186-K188 VanDerWaalsContact OD1-N 3.16Å; K188-E191 WeakPolarHBondContact CD-OE2 3.48Å; K188-E191 IonicContact NZ-OE1 3.53Å; K188-E191 IonicContact NZ-OE2 3.37Å; K188-E191 PolarHBondContact NZ-OE2 3.16Å; K188-L192 WeakPolarHBondContact O-CB 3.39Å; K188-L192 PolarHBondContact O-N 2.79Å; K188-F409 HydrophobicContact CD-CD2 4.1Å; K188-F409 HydrophobicContact CG-CB 4.01Å; K188-F409 HydrophobicContact CG-CD2 4.29Å; K188-E446 IonicContact NZ-OE1 2.65Å; K188-E446 PolarHBondContact NZ-OE1 3.35Å
189	F	91.5	Very high	89.8	Confident	0 Å²	0	21.1 Å²	21.1	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-62.5	-42.8	169.7	-177.7	-100.7	0	0	0	111.8	F179 M182 L183 D186 L192 R193 L384 F385	F179-F189 HydrophobicContact CD2-CE1 4.32Å; F179-F189 AromaticContact CD2-CZ 3.97Å; F179-F189 HydrophobicContact CD2-CZ 3.97Å; F179-F189 HydrophobicContact CE2-CE1 4.03Å; F179-F189 AromaticContact CE2-CZ 3.56Å; F179-F189 HydrophobicContact CE2-CZ 3.56Å; F179-F189 HydrophobicContact CZ-CE1 4.25Å; F179-F189 HydrophobicContact CZ-CZ 4.12Å; M182-F189 HydrophobicContact CB-CD1 3.65Å; M182-F189 HydrophobicContact CB-CE1 3.82Å; M182-F189 HydrophobicContact CB-CG 4.26Å; M182-F189 HydrophobicContact CE-CB 4.41Å; M182-F189 HydrophobicContact CE-CD1 4.33Å; M182-F189 HydrophobicContact CE-CD2 3.69Å; M182-F189 HydrophobicContact CE-CE2 3.94Å; M182-F189 HydrophobicContact CE-CG 3.89Å; M182-F189 HydrophobicContact CE-CZ 4.35Å; L183-F189 HydrophobicContact CD2-CD1 3.89Å; L183-F189 HydrophobicContact CD2-CE1 3.72Å; L183-F189 HydrophobicContact CG-CD1 4.43Å; L183-F189 HydrophobicContact CG-CE1 4.08Å; D186-F189 HydrophobicContact CB-CB 3.77Å; D186-F189 VanDerWaalsContact CG-CB 3.44Å; D186-F189 PolarHBondContact O-N 2.88Å; D186-F189 WeakPolarHBondContact OD1-CB 3.46Å; D186-F189 PolarHBondContact OD1-N 3.15Å; F189-L192 PolarHBondContact O-N 2.94Å; F189-R193 WeakPolarHBondContact O-CB 3.23Å; F189-R193 PolarHBondContact O-N 3.4Å; F189-L384 HydrophobicContact CD2-CB 4Å; F189-L384 HydrophobicContact CD2-CD1 4.23Å; F189-L384 HydrophobicContact CE2-CB 4.26Å; F189-F385 HydrophobicContact CE2-CB 4.28Å; F189-F385 HydrophobicContact CZ-CB 4.41Å
190	R	90.5	Very high	89.9	Confident	17 Å²	17	21.1 Å²	21.1	6%	0.064	10%	0.099	C	C	.	.	H	α-helix	trans	-61.3	-48.4	175.9	179.6	176.5	48.7	-172.2	-13	112.2	C155 E158 S159 N162 L183 D186 N187 L192 R193 A194	C155-R190 PolarHBondContact O-NH2 2.86Å; E158-R190 IonicContact OE2-CZ 2.82Å; E158-R190 IonicContact OE2-NE 2.74Å; E158-R190 IonicContact OE2-NH1 3.4Å; E158-R190 PolarHBondContact OE2-NH1 2.93Å; S159-R190 VanDerWaalsContact CA-NH2 3.27Å; N162-R190 PolarHBondContact ND2-NH1 2.95Å; L183-R190 WeakPolarHBondContact O-CD 3.35Å; D186-R190 WeakPolarHBondContact O-CB 3.29Å; D186-R190 PolarHBondContact O-N 2.88Å; N187-R190 PolarHBondContact O-N 2.95Å; N187-R190 PolarHBondContact OD1-NH2 3.21Å; R190-L192 VanDerWaalsContact C-N 3.32Å; R190-L192 PolarHBondContact O-N 3.44Å; R190-R193 PolarHBondContact O-N 2.82Å; R190-A194 WeakPolarHBondContact O-CB 3.47Å; R190-A194 PolarHBondContact O-N 2.94Å
191	E	89.1	Confident	90	Very high	5 Å²	5	19 Å²	19	2%	0.023	9%	0.094	C	C	.	.	H	α-helix	trans	-56.3	-46.1	175.9	-75.6	-178.4	166.2	0	0	111.4	L152 C155 R156 N187 K188 A194 L195 Q412	L152-E191 HydrophobicContact CD2-CB 3.94Å; L152-E191 HydrophobicContact CD2-CG 3.95Å; C155-E191 HydrophobicContact CB-CG 4.24Å; R156-E191 VanDerWaalsContact CG-OE1 3.28Å; R156-E191 WeakPolarHBondContact CG-OE1 3.47Å; R156-E191 IonicContact CZ-OE1 2.79Å; R156-E191 IonicContact NE-OE1 3.55Å; R156-E191 PolarHBondContact NE-OE1 2.93Å; R156-E191 IonicContact NH2-OE1 2.82Å; N187-E191 WeakPolarHBondContact O-CG 3.19Å; N187-E191 PolarHBondContact O-N 3.14Å; K188-E191 WeakPolarHBondContact CD-OE2 3.48Å; K188-E191 IonicContact NZ-OE1 3.53Å; K188-E191 IonicContact NZ-OE2 3.37Å; K188-E191 PolarHBondContact NZ-OE2 3.16Å; E191-A194 PolarHBondContact O-N 3.44Å; E191-L195 PolarHBondContact O-N 3.32Å; E191-Q412 PolarHBondContact OE2-NE2 3.01Å
192	L	90.9	Very high	90.1	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-66.3	-39.1	178.9	-171.8	66.4	0	0	0	112.3	K188 F189 R190 A194 L195 V196 A377 C381 L384 M415	K188-L192 WeakPolarHBondContact O-CB 3.39Å; K188-L192 PolarHBondContact O-N 2.79Å; F189-L192 PolarHBondContact O-N 2.94Å; R190-L192 VanDerWaalsContact C-N 3.32Å; R190-L192 PolarHBondContact O-N 3.44Å; L192-A194 VanDerWaalsContact C-N 3.33Å; L192-L195 HydrophobicContact CD1-CD2 4.3Å; L192-L195 WeakPolarHBondContact O-CB 3.44Å; L192-L195 PolarHBondContact O-N 3.23Å; L192-V196 PolarHBondContact O-N 2.93Å; L192-A377 HydrophobicContact CD1-CB 3.89Å; L192-C381 HydrophobicContact CD2-CB 4.43Å; L192-C381 VanDerWaalsContact CG-SG 3.52Å; L192-L384 HydrophobicContact CD2-CD1 4Å; L192-M415 HydrophobicContact CD1-CE 3.58Å
193	R	92.5	Very high	90.1	Very high	15 Å²	15	19.2 Å²	19.2	6%	0.057	10%	0.098	C	C	.	.	H	α-helix	trans	-67.3	-37.4	176.3	-173.7	68.1	-166.2	148.8	18.6	111.6	S8 F179 L183 F189 R190 L195 V196 R197 E200	S8-R193 VanDerWaalsContact OG-CZ 3.23Å; S8-R193 PolarHBondContact OG-NE 3.42Å; S8-R193 PolarHBondContact OG-NH2 2.92Å; F179-R193 HydrophobicContact CZ-CG 4.41Å; L183-R193 HydrophobicContact CD2-CB 3.88Å; L183-R193 HydrophobicContact CD2-CG 3.92Å; F189-R193 WeakPolarHBondContact O-CB 3.23Å; F189-R193 PolarHBondContact O-N 3.4Å; R190-R193 PolarHBondContact O-N 2.82Å; R193-L195 VanDerWaalsContact C-N 3.3Å; R193-V196 PolarHBondContact O-N 3.44Å; R193-R197 PolarHBondContact O-N 2.8Å; R193-E200 IonicContact NH2-OE2 3.6Å
194	A	91.8	Very high	90.1	Very high	17 Å²	17	19.6 Å²	19.6	14%	0.14	10%	0.103	C	C	.	.	H	α-helix	trans	-63.3	-38.4	174.1	0	0	0	0	0	111.1	T151 R190 E191 L192 V196 R197 C198	T151-A194 HydrophobicContact CG2-CB 3.54Å; R190-A194 WeakPolarHBondContact O-CB 3.47Å; R190-A194 PolarHBondContact O-N 2.94Å; E191-A194 PolarHBondContact O-N 3.44Å; L192-A194 VanDerWaalsContact C-N 3.33Å; A194-V196 PolarHBondContact O-N 2.85Å; A194-R197 PolarHBondContact O-N 2.81Å; A194-C198 PolarHBondContact O-N 3.47Å
195	L	91.1	Very high	90	Very high	3 Å²	3	18.8 Å²	18.8	2%	0.016	10%	0.1	C	C	.	.	H	α-helix	trans	-56.9	-47.4	169.7	-179.9	61.8	0	0	0	112.7	W148 E191 L192 R193 R197 L199 L373 A377 F416	W148-L195 HydrophobicContact CD2-CD1 3.92Å; W148-L195 HydrophobicContact CE3-CD1 3.71Å; W148-L195 HydrophobicContact CH2-CD1 3.65Å; W148-L195 WeakPolarHBondContact CH2-O 3.46Å; W148-L195 HydrophobicContact CZ2-CD1 3.88Å; W148-L195 VanDerWaalsContact CZ3-CA 3.42Å; W148-L195 HydrophobicContact CZ3-CB 4.33Å; W148-L195 HydrophobicContact CZ3-CD1 3.58Å; W148-L195 HydrophobicContact CZ3-CG 4.46Å; W148-L195 WeakPolarHBondContact CZ3-O 3.37Å; E191-L195 PolarHBondContact O-N 3.32Å; L192-L195 HydrophobicContact CD1-CD2 4.3Å; L192-L195 WeakPolarHBondContact O-CB 3.44Å; L192-L195 PolarHBondContact O-N 3.23Å; R193-L195 VanDerWaalsContact C-N 3.3Å; L195-R197 PolarHBondContact O-N 2.74Å; L195-L199 HydrophobicContact CD1-CD1 4.01Å; L195-L199 HydrophobicContact CD1-CG 4.38Å; L195-L199 HydrophobicContact CG-CD1 4.1Å; L195-L199 WeakPolarHBondContact O-CD1 3.47Å; L195-L199 WeakPolarHBondContact O-CG 3.25Å; L195-L199 PolarHBondContact O-N 3.47Å; L195-L373 HydrophobicContact CD1-CD2 4.18Å; L195-L373 HydrophobicContact CD2-CD1 4.36Å; L195-A377 HydrophobicContact CD2-CB 3.81Å; L195-A377 HydrophobicContact CG-CB 4.13Å; L195-F416 HydrophobicContact CD2-CE1 4.2Å; L195-F416 HydrophobicContact CD2-CZ 3.65Å
196	V	93.6	Very high	89.7	Confident	0 Å²	0	20 Å²	20	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-61.7	-46.8	177.7	175.6	0	0	0	0	110.8	L192 R193 A194 C198 L199 E200 A377	L192-V196 PolarHBondContact O-N 2.93Å; R193-V196 PolarHBondContact O-N 3.44Å; A194-V196 PolarHBondContact O-N 2.85Å; V196-C198 PolarHBondContact O-N 3.42Å; V196-L199 PolarHBondContact O-N 2.96Å; V196-E200 HydrophobicContact CG1-CG 4.4Å; V196-E200 WeakPolarHBondContact CG1-OE1 3.39Å; V196-E200 WeakPolarHBondContact O-CG 3.36Å; V196-E200 PolarHBondContact O-N 3.28Å; V196-A377 HydrophobicContact CG2-CB 3.76Å
197	R	90.9	Very high	89.2	Confident	44 Å²	44	21.7 Å²	21.7	17%	0.166	11%	0.114	C	C	.	.	H	α-helix	trans	-57.3	-51	-177.2	-179.7	75	75.5	134.8	2	112.5	F6 V7 R193 A194 L195 L199 E200 C201	F6-R197 PolarHBondContact O-NH2 3.4Å; F6-R197 VanDerWaalsContact O-NH2 3.07Å; V7-R197 VanDerWaalsContact C-NH2 3.26Å; V7-R197 VanDerWaalsContact N-NH1 3.19Å; V7-R197 PolarHBondContact O-NH1 2.93Å; V7-R197 PolarHBondContact O-NH2 3.34Å; R193-R197 PolarHBondContact O-N 2.8Å; A194-R197 PolarHBondContact O-N 2.81Å; L195-R197 PolarHBondContact O-N 2.74Å; R197-L199 VanDerWaalsContact C-N 3.25Å; R197-L199 PolarHBondContact O-N 3.43Å; R197-E200 WeakPolarHBondContact O-CB 3.49Å; R197-E200 PolarHBondContact O-N 2.87Å; R197-C201 PolarHBondContact O-N 2.99Å; R197-C201 PolarHBondContact O-SG 3.31Å
198	C	90.9	Very high	88.1	Confident	12 Å²	12	25.8 Å²	25.8	8%	0.081	14%	0.136	C	C	.	.	H	α-helix	trans	-73.4	-21	-173.8	-79.7	0	0	0	0	111.6	R147 W148 T151 A194 V196 E202	R147-C198 HydrophobicContact CG-CB 4.23Å; W148-C198 HydrophobicContact CE3-CB 4.01Å; W148-C198 VanDerWaalsContact CH2-CA 3.5Å; W148-C198 HydrophobicContact CH2-CB 2.92Å; W148-C198 HydrophobicContact CZ2-CB 3.87Å; W148-C198 HydrophobicContact CZ3-CB 3.02Å; T151-C198 PolarHBondContact OG1-SG 3.44Å; T151-C198 VanDerWaalsContact OG1-SG 3.4Å; A194-C198 PolarHBondContact O-N 3.47Å; V196-C198 PolarHBondContact O-N 3.42Å; C198-E202 VanDerWaalsContact O-CB 3.3Å; C198-E202 WeakPolarHBondContact O-CB 3.38Å; C198-E202 PolarHBondContact O-N 2.86Å
199	L	91.9	Very high	86.5	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-74.9	-36.5	171.1	-72.3	166.6	0	0	0	109.9	W148 L195 V196 R197 A203 R277 E370 L373 W374	W148-L199 HydrophobicContact CH2-CB 4.35Å; W148-L199 HydrophobicContact CH2-CD2 4.31Å; W148-L199 HydrophobicContact CH2-CG 3.69Å; W148-L199 HydrophobicContact CZ2-CB 4.3Å; W148-L199 HydrophobicContact CZ2-CD1 4.43Å; W148-L199 HydrophobicContact CZ2-CD2 3.51Å; W148-L199 HydrophobicContact CZ2-CG 3.41Å; W148-L199 VanDerWaalsContact CZ2-CG 3.41Å; L195-L199 HydrophobicContact CD1-CD1 4.01Å; L195-L199 HydrophobicContact CD1-CG 4.38Å; L195-L199 HydrophobicContact CG-CD1 4.1Å; L195-L199 WeakPolarHBondContact O-CD1 3.47Å; L195-L199 WeakPolarHBondContact O-CG 3.25Å; L195-L199 PolarHBondContact O-N 3.47Å; V196-L199 PolarHBondContact O-N 2.96Å; R197-L199 VanDerWaalsContact C-N 3.25Å; R197-L199 PolarHBondContact O-N 3.43Å; L199-A203 WeakPolarHBondContact O-CB 3.5Å; L199-A203 PolarHBondContact O-N 3.41Å; L199-A203 VanDerWaalsContact O-N 3.08Å; L199-R277 VanDerWaalsContact C-NH1 3.26Å; L199-R277 PolarHBondContact O-NH1 3.04Å; L199-R277 PolarHBondContact O-NH2 3.45Å; L199-E370 HydrophobicContact CD2-CB 4.06Å; L199-L373 HydrophobicContact CD1-CB 4.22Å; L199-L373 HydrophobicContact CD1-CD2 4.22Å; L199-L373 HydrophobicContact CD1-CG 3.9Å; L199-L373 HydrophobicContact CD2-CD2 4.49Å; L199-W374 HydrophobicContact CB-CB 4.06Å; L199-W374 VanDerWaalsContact CD1-CA 3.5Å; L199-W374 HydrophobicContact CD1-CB 3.8Å; L199-W374 HydrophobicContact CG-CB 4.47Å
200	E	92.9	Very high	84.3	Confident	13 Å²	13	38.7 Å²	38.7	6%	0.061	21%	0.206	C	C	.	.	H	α-helix	trans	-63	-50.3	170.5	-68.8	166.8	170.5	0	0	110.2	R193 V196 R197 E202 A203 V204 W374	R193-E200 IonicContact NH2-OE2 3.6Å; V196-E200 HydrophobicContact CG1-CG 4.4Å; V196-E200 WeakPolarHBondContact CG1-OE1 3.39Å; V196-E200 WeakPolarHBondContact O-CG 3.36Å; V196-E200 PolarHBondContact O-N 3.28Å; R197-E200 WeakPolarHBondContact O-CB 3.49Å; R197-E200 PolarHBondContact O-N 2.87Å; E200-E202 PolarHBondContact O-N 3.27Å; E200-A203 PolarHBondContact O-N 3.49Å; E200-A203 VanDerWaalsContact O-N 3.17Å; E200-V204 WeakPolarHBondContact O-CG2 3.34Å; E200-V204 PolarHBondContact O-N 2.85Å; E200-W374 PolarHBondContact OE1-NE1 3.45Å
201	C	90.2	Very high	82.5	Confident	49 Å²	49	40.7 Å²	40.7	33%	0.331	22%	0.217	S	C	.	.	H	α-helix	trans	-61.1	-43.1	178.2	-66.4	0	0	0	0	112.9	R197 A203 V204 E205	R197-C201 PolarHBondContact O-N 2.99Å; R197-C201 PolarHBondContact O-SG 3.31Å; C201-A203 VanDerWaalsContact C-N 3.35Å; C201-V204 WeakPolarHBondContact O-CB 3.1Å; C201-V204 PolarHBondContact O-N 3.2Å; C201-E205 WeakPolarHBondContact O-CG 3.34Å; C201-E205 PolarHBondContact O-N 3.28Å
202	E	89.4	Confident	80.5	Confident	9 Å²	9	42.6 Å²	42.6	4%	0.042	23%	0.234	C	C	.	.	H	α-helix	trans	-58.8	-48	173.4	178.1	-84.6	155.5	0	0	110.5	K140 L144 C198 E200 V204 E205 W206 R277	K140-E202 WeakPolarHBondContact CE-OE1 3.32Å; K140-E202 IonicContact NZ-OE1 3.98Å; K140-E202 PolarHBondContact NZ-OE1 2.88Å; L144-E202 HydrophobicContact CD1-CB 4.08Å; L144-E202 HydrophobicContact CD1-CG 4.03Å; L144-E202 HydrophobicContact CD2-CG 4.41Å; C198-E202 VanDerWaalsContact O-CB 3.3Å; C198-E202 WeakPolarHBondContact O-CB 3.38Å; C198-E202 PolarHBondContact O-N 2.86Å; E200-E202 PolarHBondContact O-N 3.27Å; E202-V204 VanDerWaalsContact C-N 3.28Å; E202-V204 PolarHBondContact O-N 3Å; E202-E205 WeakPolarHBondContact O-CB 3.31Å; E202-E205 PolarHBondContact O-N 2.82Å; E202-E205 VanDerWaalsContact O-N 3.08Å; E202-W206 PolarHBondContact O-N 3.19Å; E202-W206 PolarHBondContact OE1-NE1 3.14Å; E202-R277 IonicContact OE2-NH2 2.88Å
203	A	90	Very high	78.7	Confident	13 Å²	13	47 Å²	47	11%	0.107	25%	0.254	C	S	.	.	H	α-helix	trans	-61.5	-35.8	179.9	0	0	0	0	0	112.7	L199 E200 C201 E205 W206 T207 I278	L199-A203 WeakPolarHBondContact O-CB 3.5Å; L199-A203 PolarHBondContact O-N 3.41Å; L199-A203 VanDerWaalsContact O-N 3.08Å; E200-A203 PolarHBondContact O-N 3.49Å; E200-A203 VanDerWaalsContact O-N 3.17Å; C201-A203 VanDerWaalsContact C-N 3.35Å; A203-E205 PolarHBondContact O-N 2.94Å; A203-W206 PolarHBondContact O-N 3.32Å; A203-T207 PolarHBondContact O-N 3.07Å; A203-T207 VanDerWaalsContact O-N 3.08Å; A203-T207 PolarHBondContact O-OG1 2.84Å; A203-I278 HydrophobicContact CB-CG2 3.81Å
204	V	89.3	Confident	76.6	Confident	56 Å²	56	52.7 Å²	52.7	34%	0.339	29%	0.285	S	S	.	.	H	α-helix	trans	-57.5	-47.8	172.6	174.7	0	0	0	0	111.1	E200 C201 E202 W206 T207 I278	E200-V204 WeakPolarHBondContact O-CG2 3.34Å; E200-V204 PolarHBondContact O-N 2.85Å; C201-V204 WeakPolarHBondContact O-CB 3.1Å; C201-V204 PolarHBondContact O-N 3.2Å; E202-V204 VanDerWaalsContact C-N 3.28Å; E202-V204 PolarHBondContact O-N 3Å; V204-W206 VanDerWaalsContact C-N 3.26Å; V204-W206 PolarHBondContact O-N 2.91Å; V204-T207 WeakPolarHBondContact O-CB 3.44Å; V204-T207 PolarHBondContact O-N 3.36Å; V204-I278 HydrophobicContact CG2-CB 3.73Å; V204-I278 HydrophobicContact CG2-CG1 4.44Å; V204-I278 HydrophobicContact CG2-CG2 4.49Å; V204-I278 WeakPolarHBondContact CG2-O 3.29Å
205	E	84.6	Confident	74.8	Confident	68 Å²	68	54.7 Å²	54.7	32%	0.318	29%	0.29	S	S	.	.	H	α-helix	trans	-62.5	-32.3	-175.5	-69.1	162.5	-178.6	0	0	113.4	K143 R147 C201 E202 A203	K143-E205 IonicContact NZ-OE1 3.93Å; K143-E205 IonicContact NZ-OE2 3.07Å; K143-E205 PolarHBondContact NZ-OE2 3.45Å; R147-E205 IonicContact CZ-OE1 3.25Å; R147-E205 IonicContact CZ-OE2 2.77Å; R147-E205 VanDerWaalsContact NH1-CD 3.26Å; R147-E205 IonicContact NH1-OE1 2.69Å; R147-E205 PolarHBondContact NH1-OE1 3.47Å; R147-E205 IonicContact NH1-OE2 2.65Å; R147-E205 PolarHBondContact NH1-OE2 3.14Å; R147-E205 VanDerWaalsContact NH1-OE2 3.1Å; R147-E205 IonicContact NH2-OE1 3.69Å; R147-E205 PolarHBondContact NH2-OE1 3.18Å; R147-E205 IonicContact NH2-OE2 3.51Å; R147-E205 PolarHBondContact NH2-OE2 3.03Å; C201-E205 WeakPolarHBondContact O-CG 3.34Å; C201-E205 PolarHBondContact O-N 3.28Å; E202-E205 WeakPolarHBondContact O-CB 3.31Å; E202-E205 PolarHBondContact O-N 2.82Å; E202-E205 VanDerWaalsContact O-N 3.08Å; A203-E205 PolarHBondContact O-N 2.94Å
206	W	80.9	Confident	73	Confident	47 Å²	47	62.2 Å²	62.2	18%	0.178	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.7	3.8	-179	-54.7	107.5	0	0	0	113.5	Y119 F120 K140 E202 A203 V204 N208	Y119-W206 AromaticContact CD1-CH2 3.39Å; Y119-W206 HydrophobicContact CD1-CH2 3.39Å; Y119-W206 AromaticContact CD1-CZ3 3.71Å; Y119-W206 HydrophobicContact CD1-CZ3 3.71Å; Y119-W206 AromaticContact CD2-CH2 3.78Å; Y119-W206 HydrophobicContact CD2-CH2 3.78Å; Y119-W206 HydrophobicContact CD2-CZ3 4.42Å; Y119-W206 HydrophobicContact CE1-CE3 4.33Å; Y119-W206 AromaticContact CE1-CH2 3.3Å; Y119-W206 HydrophobicContact CE1-CH2 3.3Å; Y119-W206 AromaticContact CE1-CZ3 3.1Å; Y119-W206 HydrophobicContact CE1-CZ3 3.1Å; Y119-W206 AromaticContact CE2-CH2 3.61Å; Y119-W206 HydrophobicContact CE2-CH2 3.61Å; Y119-W206 HydrophobicContact CE2-CZ2 4.44Å; Y119-W206 AromaticContact CE2-CZ3 3.84Å; Y119-W206 HydrophobicContact CE2-CZ3 3.84Å; Y119-W206 AromaticContact CG-CH2 3.69Å; Y119-W206 HydrophobicContact CG-CH2 3.69Å; Y119-W206 HydrophobicContact CG-CZ3 4.37Å; Y119-W206 AromaticContact CZ-CH2 3.4Å; Y119-W206 AromaticContact CZ-CZ3 3.16Å; Y119-W206 WeakPolarHBondContact OH-CZ3 3.48Å; F120-W206 HydrophobicContact CE1-CZ3 4.5Å; K140-W206 HydrophobicContact CB-CZ2 4.26Å; K140-W206 HydrophobicContact CD-CD2 3.93Å; K140-W206 HydrophobicContact CD-CG 4.22Å; K140-W206 HydrophobicContact CD-CZ2 3.96Å; K140-W206 VanDerWaalsContact CE-NE1 3.31Å; K140-W206 HydrophobicContact CG-CZ2 3.82Å; E202-W206 PolarHBondContact O-N 3.19Å; E202-W206 PolarHBondContact OE1-NE1 3.14Å; A203-W206 PolarHBondContact O-N 3.32Å; V204-W206 VanDerWaalsContact C-N 3.26Å; V204-W206 PolarHBondContact O-N 2.91Å; W206-N208 PolarHBondContact O-N 3.41Å; W206-N208 VanDerWaalsContact O-N 3.11Å
207	T	75.9	Confident	71.2	Confident	35 Å²	35	70.5 Å²	70.5	22%	0.215	37%	0.37	C	S	.	.	S	Bend	trans	-69.5	110.9	173	-65.6	0	0	0	0	107.9	A203 V204 D209 I211	A203-T207 PolarHBondContact O-N 3.07Å; A203-T207 VanDerWaalsContact O-N 3.08Å; A203-T207 PolarHBondContact O-OG1 2.84Å; V204-T207 WeakPolarHBondContact O-CB 3.44Å; V204-T207 PolarHBondContact O-N 3.36Å; T207-D209 PolarHBondContact O-N 3.46Å; T207-I211 HydrophobicContact CG2-CB 3.84Å; T207-I211 HydrophobicContact CG2-CD1 3.53Å; T207-I211 HydrophobicContact CG2-CG1 3.71Å
208	N	63.7	Low	69.9	Low	118 Å²	118	76.6 Å²	76.6	63%	0.631	40%	0.397	S	S	*	.			trans	-50.6	140.2	174.8	-78.1	-40.6	0	0	0	110	W206 N210 I211	W206-N208 PolarHBondContact O-N 3.41Å; W206-N208 VanDerWaalsContact O-N 3.11Å; N208-N210 HydrophobicContact CB-CB 4.23Å; N208-N210 PolarHBondContact O-N 2.92Å; N208-I211 PolarHBondContact O-N 3.34Å
209	D	54.3	Low	69.1	Low	148 Å²	148	80.8 Å²	80.8	79%	0.791	42%	0.418	S	S	*	.	G	3₁₀ helix	trans	-52	-7.6	165.8	-76.6	-19	0	0	0	112.8	T207 I211 A212	T207-D209 PolarHBondContact O-N 3.46Å; D209-I211 VanDerWaalsContact C-N 3.32Å; D209-A212 WeakPolarHBondContact O-CA 3.4Å; D209-A212 WeakPolarHBondContact O-CB 3.29Å; D209-A212 PolarHBondContact O-N 3.22Å
210	N	46.1	Very low	68.5	Low	144 Å²	144	84.3 Å²	84.3	77%	0.77	44%	0.437	S	S	*	.	G	3₁₀ helix	trans	-75.5	-15.6	171.5	-68.7	-30.4	0	0	0	114	N208 A212	N208-N210 HydrophobicContact CB-CB 4.23Å; N208-N210 PolarHBondContact O-N 2.92Å; N210-A212 PolarHBondContact O-N 2.97Å
211	I	53	Low	68.3	Low	58 Å²	58	88.3 Å²	88.3	30%	0.297	46%	0.455	S	S	.	.	G	3₁₀ helix	trans	-83.9	22.8	156.5	-37.2	-168.7	0	0	0	109.1	T207 N208 D209 F213	T207-I211 HydrophobicContact CG2-CB 3.84Å; T207-I211 HydrophobicContact CG2-CD1 3.53Å; T207-I211 HydrophobicContact CG2-CG1 3.71Å; N208-I211 PolarHBondContact O-N 3.34Å; D209-I211 VanDerWaalsContact C-N 3.32Å; I211-F213 PolarHBondContact O-N 2.89Å
212	A	46.6	Very low	68.3	Low	45 Å²	45	87.1 Å²	87.1	37%	0.372	44%	0.444	S	S	.	.			trans	-45.9	121.9	175.6	0	0	0	0	0	107.9	D209 N210 N214	D209-A212 WeakPolarHBondContact O-CA 3.4Å; D209-A212 WeakPolarHBondContact O-CB 3.29Å; D209-A212 PolarHBondContact O-N 3.22Å; N210-A212 PolarHBondContact O-N 2.97Å; A212-N214 HydrophobicContact CB-CB 4.36Å; A212-N214 PolarHBondContact O-N 2.87Å
213	F	54	Low	68.4	Low	94 Å²	94	87.7 Å²	87.7	41%	0.412	45%	0.446	S	S	.	.			trans	-57	24.1	166.7	-51.9	-73.4	0	0	0	113.2	I211 F215 L275 E283	I211-F213 PolarHBondContact O-N 2.89Å; F213-F215 HydrophobicContact CB-CD2 4.34Å; F213-F215 HydrophobicContact CB-CE2 4.09Å; F213-F215 HydrophobicContact CD1-CE2 4.17Å; F213-F215 WeakPolarHBondContact O-CD2 3.48Å; F213-F215 PolarHBondContact O-N 3.08Å; F213-L275 HydrophobicContact CE1-CD2 3.85Å; F213-E283 WeakPolarHBondContact CE1-OE2 3.46Å; F213-E283 VanDerWaalsContact CZ-OE2 3.29Å; F213-E283 WeakPolarHBondContact CZ-OE2 3.31Å
214	N	48.1	Very low	68.5	Low	134 Å²	134	88.6 Å²	88.6	72%	0.717	45%	0.451	S	S	*	.			trans	-69.6	69.3	157.6	-75.5	-9.7	0	0	0	107.9	A212 E216	A212-N214 HydrophobicContact CB-CB 4.36Å; A212-N214 PolarHBondContact O-N 2.87Å; N214-E216 PolarHBondContact O-N 2.83Å
215	F	54	Low	68.5	Low	58 Å²	58	89 Å²	89	25%	0.254	45%	0.451	S	S	.	.			trans	-61.3	83.6	150.1	-55.3	-87.3	0	0	0	106.2	F213 D217 L287	F213-F215 HydrophobicContact CB-CD2 4.34Å; F213-F215 HydrophobicContact CB-CE2 4.09Å; F213-F215 HydrophobicContact CD1-CE2 4.17Å; F213-F215 WeakPolarHBondContact O-CD2 3.48Å; F213-F215 PolarHBondContact O-N 3.08Å; F215-D217 PolarHBondContact O-N 2.98Å; F215-L287 HydrophobicContact CD1-CD1 4.26Å; F215-L287 HydrophobicContact CE1-CB 3.81Å; F215-L287 HydrophobicContact CE1-CD1 3.76Å; F215-L287 HydrophobicContact CE1-CG 4.33Å; F215-L287 HydrophobicContact CZ-CB 4.39Å
216	E	53.1	Low	68.8	Low	162 Å²	162	85.8 Å²	85.8	76%	0.757	44%	0.436	S	S	*	.			trans	-46.6	144.3	168.6	-69.1	-177.7	161.6	0	0	108.3	N214 K218	N214-E216 PolarHBondContact O-N 2.83Å; E216-K218 PolarHBondContact O-N 3.03Å
217	D	54.7	Low	69.3	Low	173 Å²	173	88.6 Å²	88.6	93%	0.925	45%	0.447	S	S	*	.	S	Bend	trans	-54.6	-5.8	-172.3	-73	-40.7	0	0	0	115.1	F215 I219	F215-D217 PolarHBondContact O-N 2.98Å; D217-I219 PolarHBondContact O-N 3.19Å
218	K	65.2	Low	69.9	Low	172 Å²	172	89.5 Å²	89.5	75%	0.748	45%	0.45	S	S	*	.			trans	-85.8	104.5	-178.6	-163.7	175.5	179.6	-173.7	0	111.4	E216 D220	E216-K218 PolarHBondContact O-N 3.03Å; K218-D220 PolarHBondContact O-N 3.14Å
219	I	73.2	Confident	71.1	Confident	100 Å²	100	84.1 Å²	84.1	51%	0.513	42%	0.421	S	S	.	.			trans	-60.4	117.7	162.9	-57.1	177.9	0	0	0	108.2	D217 F221 R290	D217-I219 PolarHBondContact O-N 3.19Å; I219-F221 HydrophobicContact CB-CE2 4.27Å; I219-F221 HydrophobicContact CG2-CD2 3.81Å; I219-F221 HydrophobicContact CG2-CE1 4.19Å; I219-F221 HydrophobicContact CG2-CE2 3.26Å; I219-F221 HydrophobicContact CG2-CG 4.47Å; I219-F221 HydrophobicContact CG2-CZ 3.46Å; I219-F221 VanDerWaalsContact CG2-CZ 3.46Å; I219-R290 WeakPolarHBondContact CG2-O 3.35Å
220	D	80.2	Confident	72.6	Confident	75 Å²	75	79.3 Å²	79.3	40%	0.401	40%	0.396	S	S	.	.			trans	-118.9	94.4	-177.7	-173.7	15.4	0	0	0	109.5	K218 K264 Q291	K218-D220 PolarHBondContact O-N 3.14Å; D220-K264 PolarHBondContact O-NZ 3.04Å; D220-K264 IonicContact OD1-NZ 2.81Å; D220-K264 PolarHBondContact OD1-NZ 2.88Å; D220-K264 WeakPolarHBondContact OD2-CE 3.33Å; D220-K264 IonicContact OD2-NZ 3.31Å; D220-K264 PolarHBondContact OD2-NZ 2.8Å; D220-Q291 PolarHBondContact O-OE1 3.02Å
221	F	87.7	Confident	74.6	Confident	97 Å²	97	82.8 Å²	82.8	43%	0.425	40%	0.398	S	S	.	.			trans	-68.4	138.5	-173.3	-69.4	-91.6	0	0	0	113	I219 T224 K264 Q291 G292	I219-F221 HydrophobicContact CB-CE2 4.27Å; I219-F221 HydrophobicContact CG2-CD2 3.81Å; I219-F221 HydrophobicContact CG2-CE1 4.19Å; I219-F221 HydrophobicContact CG2-CE2 3.26Å; I219-F221 HydrophobicContact CG2-CG 4.47Å; I219-F221 HydrophobicContact CG2-CZ 3.46Å; I219-F221 VanDerWaalsContact CG2-CZ 3.46Å; F221-T224 PolarHBondContact O-OG1 3.03Å; F221-K264 VanDerWaalsContact C-NZ 3.32Å; F221-K264 PolarHBondContact O-NZ 3.47Å; F221-Q291 CarbonylContact C-O 3.51Å; F221-Q291 WeakPolarHBondContact CA-O 3.42Å; F221-G292 VanDerWaalsContact CD1-CA 3.43Å
222	L	90	Very high	76	Confident	23 Å²	23	86.8 Å²	86.8	12%	0.12	41%	0.413	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	152.4	165.2	-70.2	-172	0	0	0	110.7	T224 K264 Q265 V268 Q291 S293	L222-T224 PolarHBondContact O-N 3.44Å; L222-T224 VanDerWaalsContact O-N 3.13Å; L222-K264 HydrophobicContact CD2-CB 4.47Å; L222-K264 HydrophobicContact CD2-CD 4.01Å; L222-K264 HydrophobicContact CD2-CG 3.9Å; L222-Q265 HydrophobicContact CD1-CB 4.21Å; L222-Q265 HydrophobicContact CD1-CG 4.13Å; L222-Q265 HydrophobicContact CD2-CB 4.18Å; L222-V268 HydrophobicContact CD2-CG2 4Å; L222-Q291 HydrophobicContact CG-CB 4.42Å; L222-Q291 PolarHBondContact N-O 3.49Å; L222-S293 WeakPolarHBondContact CD1-OG 3.41Å
223	W	92.2	Very high	77.2	Confident	21 Å²	21	90.8 Å²	90.8	8%	0.08	43%	0.428	C	S	.	.	T	Hydrogen-bonded Turn	trans	61.7	20.2	175.3	-58	4.1	0	0	0	114.9	N225 T226 R227 L245 D246 P250 I257 D261	W223-N225 VanDerWaalsContact C-N 3.31Å; W223-N225 PolarHBondContact O-N 2.91Å; W223-T226 PolarHBondContact O-N 2.9Å; W223-R227 WeakPolarHBondContact O-CB 3.04Å; W223-R227 PolarHBondContact O-N 3.38Å; W223-L245 HydrophobicContact CE3-CD2 4.18Å; W223-D246 WeakPolarHBondContact CH2-O 3.48Å; W223-D246 VanDerWaalsContact CZ3-O 3.25Å; W223-D246 WeakPolarHBondContact CZ3-O 3.49Å; W223-P250 HydrophobicContact CH2-CG 3.73Å; W223-P250 HydrophobicContact CZ2-CG 4.06Å; W223-I257 HydrophobicContact CD2-CG2 4.01Å; W223-I257 HydrophobicContact CE3-CG2 4.3Å; W223-I257 HydrophobicContact CH2-CG2 4.3Å; W223-I257 HydrophobicContact CZ2-CD1 4.28Å; W223-I257 HydrophobicContact CZ2-CG2 4Å; W223-I257 HydrophobicContact CZ3-CG2 4.43Å; W223-D261 VanDerWaalsContact CA-CG 3.43Å; W223-D261 VanDerWaalsContact CA-OD2 3.32Å; W223-D261 WeakPolarHBondContact CA-OD2 3.5Å
224	T	91.5	Very high	77.8	Confident	32 Å²	32	89.5 Å²	89.5	20%	0.196	42%	0.423	C	S	.	.	H	α-helix	trans	-59	-42.3	179.1	-65.9	0	0	0	0	111.3	F221 L222 D228	F221-T224 PolarHBondContact O-OG1 3.03Å; L222-T224 PolarHBondContact O-N 3.44Å; L222-T224 VanDerWaalsContact O-N 3.13Å; T224-D228 WeakPolarHBondContact O-CB 3.2Å; T224-D228 PolarHBondContact O-N 3.32Å
225	N	90.4	Very high	78.5	Confident	65 Å²	65	91.9 Å²	91.9	35%	0.348	43%	0.427	S	S	.	.	H	α-helix	trans	-71.7	-34.5	-178.7	-61.5	-81.8	0	0	0	112.4	W223 C229 K258 D261	W223-N225 VanDerWaalsContact C-N 3.31Å; W223-N225 PolarHBondContact O-N 2.91Å; N225-C229 WeakPolarHBondContact O-CB 3.2Å; N225-C229 PolarHBondContact O-N 3.25Å; N225-K258 HydrophobicContact CB-CB 4.44Å; N225-K258 HydrophobicContact CB-CD 3.76Å; N225-K258 PolarHBondContact O-NZ 3.45Å; N225-D261 WeakPolarHBondContact CA-OD2 3.49Å; N225-D261 WeakPolarHBondContact CB-OD1 3.35Å; N225-D261 WeakPolarHBondContact CB-OD2 3.46Å; N225-D261 PolarHBondContact N-OD1 2.82Å; N225-D261 PolarHBondContact N-OD2 2.94Å; N225-D261 PolarHBondContact ND2-OD1 3.28Å
226	T	90.8	Very high	78.9	Confident	0 Å²	0	95.9 Å²	95.9	0%	0	45%	0.451	C	S	.	.	H	α-helix	trans	-67.6	-50.3	176.9	-58.6	0	0	0	0	109.6	W223 D228 C229 L230 V242 I257 K258 D261	W223-T226 PolarHBondContact O-N 2.9Å; T226-D228 VanDerWaalsContact C-N 3.31Å; T226-D228 PolarHBondContact O-N 3.03Å; T226-C229 WeakPolarHBondContact O-CB 3.41Å; T226-C229 PolarHBondContact O-N 3.02Å; T226-C229 VanDerWaalsContact O-N 3.16Å; T226-L230 HydrophobicContact CG2-CD1 4.39Å; T226-L230 WeakPolarHBondContact O-CG 3.45Å; T226-L230 PolarHBondContact O-N 2.89Å; T226-V242 HydrophobicContact CG2-CG2 3.89Å; T226-I257 HydrophobicContact CG2-CB 4.36Å; T226-I257 HydrophobicContact CG2-CG2 4.3Å; T226-K258 PolarHBondContact OG1-N 3.38Å; T226-D261 VanDerWaalsContact CB-OD2 3.29Å; T226-D261 WeakPolarHBondContact CB-OD2 3.44Å; T226-D261 PolarHBondContact N-OD2 3.4Å; T226-D261 PolarHBondContact OG1-OD2 3.43Å
227	R	90.4	Very high	79.3	Confident	107 Å²	107	93.8 Å²	93.8	40%	0.404	44%	0.438	S	S	.	.	H	α-helix	trans	-54.2	-46.9	172.4	-178.8	-161.5	72.2	-168.7	-1.7	111.8	W223 C229 L230 R231 L245	W223-R227 WeakPolarHBondContact O-CB 3.04Å; W223-R227 PolarHBondContact O-N 3.38Å; R227-C229 VanDerWaalsContact C-N 3.3Å; R227-C229 PolarHBondContact O-N 2.95Å; R227-L230 PolarHBondContact O-N 3.47Å; R227-R231 WeakPolarHBondContact O-CB 3.34Å; R227-R231 PolarHBondContact O-N 2.92Å; R227-L245 HydrophobicContact CB-CD1 4.04Å; R227-L245 HydrophobicContact CB-CD2 4.35Å; R227-L245 HydrophobicContact CG-CD1 3.86Å
228	D	89.8	Confident	79.7	Confident	54 Å²	54	88.2 Å²	88.2	29%	0.289	41%	0.412	S	S	.	.	H	α-helix	trans	-66.6	-33.7	-178.1	-71.4	-2.4	0	0	0	111.9	T224 T226 K232	T224-D228 WeakPolarHBondContact O-CB 3.2Å; T224-D228 PolarHBondContact O-N 3.32Å; T226-D228 VanDerWaalsContact C-N 3.31Å; T226-D228 PolarHBondContact O-N 3.03Å; D228-K232 WeakPolarHBondContact O-CB 3.19Å; D228-K232 VanDerWaalsContact O-CG 3.31Å; D228-K232 WeakPolarHBondContact O-CG 3.3Å; D228-K232 PolarHBondContact O-N 3.09Å; D228-K232 VanDerWaalsContact O-N 3.12Å
229	C	87.5	Confident	80.1	Confident	4 Å²	4	84.3 Å²	84.3	3%	0.027	40%	0.403	C	S	.	.	H	α-helix	trans	-66.5	-45.6	173.6	-163.2	0	0	0	0	111.9	N225 T226 R227 R231 K232 N233 E234 L241 K258	N225-C229 WeakPolarHBondContact O-CB 3.2Å; N225-C229 PolarHBondContact O-N 3.25Å; T226-C229 WeakPolarHBondContact O-CB 3.41Å; T226-C229 PolarHBondContact O-N 3.02Å; T226-C229 VanDerWaalsContact O-N 3.16Å; R227-C229 VanDerWaalsContact C-N 3.3Å; R227-C229 PolarHBondContact O-N 2.95Å; C229-R231 VanDerWaalsContact C-N 3.35Å; C229-R231 PolarHBondContact O-N 3.29Å; C229-K232 PolarHBondContact O-N 3.5Å; C229-N233 PolarHBondContact O-N 3.29Å; C229-E234 PolarHBondContact SG-OE2 3.32Å; C229-L241 HydrophobicContact CB-CD1 3.95Å; C229-L241 VanDerWaalsContact SG-CD1 3.6Å; C229-K258 HydrophobicContact CB-CD 4.47Å
230	L	86.3	Confident	80.6	Confident	48 Å²	48	86.4 Å²	86.4	25%	0.251	41%	0.408	S	S	.	.	H	α-helix	trans	-61.6	-42.8	176.3	-68	172	0	0	0	111.8	T226 R227 K232 N233 V242 L245	T226-L230 HydrophobicContact CG2-CD1 4.39Å; T226-L230 WeakPolarHBondContact O-CG 3.45Å; T226-L230 PolarHBondContact O-N 2.89Å; R227-L230 PolarHBondContact O-N 3.47Å; L230-K232 VanDerWaalsContact C-N 3.35Å; L230-K232 PolarHBondContact O-N 3.33Å; L230-N233 PolarHBondContact O-N 2.85Å; L230-V242 VanDerWaalsContact CD1-O 3.29Å; L230-V242 WeakPolarHBondContact CD1-O 3.33Å; L230-V242 WeakPolarHBondContact CD2-O 3.2Å; L230-L245 HydrophobicContact CD1-CD2 4.05Å
231	R	87.1	Confident	81	Confident	216 Å²	216	83.1 Å²	83.1	82%	0.815	39%	0.391	S	S	*	.	H	α-helix	trans	-65.5	-35.9	178.5	-173.2	176.8	176.1	-178.3	-0	112.9	R227 C229 N233	R227-R231 WeakPolarHBondContact O-CB 3.34Å; R227-R231 PolarHBondContact O-N 2.92Å; C229-R231 VanDerWaalsContact C-N 3.35Å; C229-R231 PolarHBondContact O-N 3.29Å; R231-N233 PolarHBondContact O-N 3.48Å
232	K	83.8	Confident	81.1	Confident	142 Å²	142	78.5 Å²	78.5	62%	0.617	37%	0.371	S	S	*	.	H	α-helix	trans	-78.1	-7.9	178.8	-73.2	175.7	-177.5	176.4	0	113.5	D228 C229 L230 E234	D228-K232 WeakPolarHBondContact O-CB 3.19Å; D228-K232 VanDerWaalsContact O-CG 3.31Å; D228-K232 WeakPolarHBondContact O-CG 3.3Å; D228-K232 PolarHBondContact O-N 3.09Å; D228-K232 VanDerWaalsContact O-N 3.12Å; C229-K232 PolarHBondContact O-N 3.5Å; L230-K232 VanDerWaalsContact C-N 3.35Å; L230-K232 PolarHBondContact O-N 3.33Å; K232-E234 HydrophobicContact CB-CG 3.91Å; K232-E234 WeakPolarHBondContact CD-OE1 3.36Å; K232-E234 PolarHBondContact O-N 3.45Å
233	N	72.2	Confident	81	Confident	129 Å²	129	81.9 Å²	81.9	69%	0.69	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	53	40.5	-178.3	-128.4	0.5	0	0	0	111.7	C229 L230 R231 K235	C229-N233 PolarHBondContact O-N 3.29Å; L230-N233 PolarHBondContact O-N 2.85Å; R231-N233 PolarHBondContact O-N 3.48Å; N233-K235 PolarHBondContact O-N 3.49Å
234	E	66.1	Low	80.8	Confident	67 Å²	67	85.3 Å²	85.3	31%	0.313	41%	0.406	S	S	.	.			trans	-63.9	98.7	-180	-74.8	175.6	178.8	0	0	109	C229 K232 N236 Y237 S238	C229-E234 PolarHBondContact SG-OE2 3.32Å; K232-E234 HydrophobicContact CB-CG 3.91Å; K232-E234 WeakPolarHBondContact CD-OE1 3.36Å; K232-E234 PolarHBondContact O-N 3.45Å; E234-N236 PolarHBondContact O-N 3.41Å; E234-Y237 HydrophobicContact CB-CD2 4.21Å; E234-Y237 PolarHBondContact O-N 3.05Å; E234-S238 PolarHBondContact O-N 2.83Å
235	K	62	Low	80.7	Confident	184 Å²	184	88 Å²	88	80%	0.8	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	-22.5	-173.6	-68.9	-175.1	177.8	-178.8	0	114.4	N233	N233-K235 PolarHBondContact O-N 3.49Å
236	N	62.9	Low	80.7	Confident	142 Å²	142	87 Å²	87	76%	0.759	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-18.4	-178.9	-66.7	-5.2	0	0	0	113.3	E234	E234-N236 PolarHBondContact O-N 3.41Å
237	Y	62.6	Low	80.6	Confident	119 Å²	119	89.2 Å²	89.2	47%	0.467	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.4	-17.9	-176.6	-69.4	-78.7	0	0	0	113.9	E234 T239 F240 L241	E234-Y237 HydrophobicContact CB-CD2 4.21Å; E234-Y237 PolarHBondContact O-N 3.05Å; Y237-T239 PolarHBondContact O-N 2.97Å; Y237-F240 PolarHBondContact O-N 2.88Å; Y237-F240 VanDerWaalsContact O-N 3.08Å; Y237-L241 HydrophobicContact CD1-CD1 4.47Å; Y237-L241 HydrophobicContact CG-CD1 4.33Å; Y237-L241 PolarHBondContact O-N 2.76Å
238	S	62.5	Low	80.5	Confident	56 Å²	56	88.1 Å²	88.1	39%	0.392	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-17.3	-168.6	64.2	0	0	0	0	115.4	E234 R255	E234-S238 PolarHBondContact O-N 2.83Å; S238-R255 PolarHBondContact O-NH1 3.32Å
239	T	73.5	Confident	80.6	Confident	89 Å²	89	85.5 Å²	85.5	55%	0.546	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-24.7	176.6	52.9	0	0	0	0	113.7	Y237	Y237-T239 PolarHBondContact O-N 2.97Å
240	F	82.9	Confident	80.7	Confident	144 Å²	144	86.6 Å²	86.6	63%	0.632	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.7	-28.5	-174.9	-60.5	-74.2	0	0	0	113.1	Y237 R255 S256	Y237-F240 PolarHBondContact O-N 2.88Å; Y237-F240 VanDerWaalsContact O-N 3.08Å; F240-R255 WeakPolarHBondContact O-CB 3.46Å; F240-S256 PolarHBondContact O-N 2.97Å; F240-S256 VanDerWaalsContact O-N 3.14Å
241	L	88.5	Confident	80.7	Confident	7 Å²	7	88.4 Å²	88.4	4%	0.037	43%	0.428	C	S	.	.	B	Isolated β-bridge	trans	-81.3	147.4	177.8	-67.1	179.8	0	0	0	112.2	C229 Y237 R255 S256 K258	C229-L241 HydrophobicContact CB-CD1 3.95Å; C229-L241 VanDerWaalsContact SG-CD1 3.6Å; Y237-L241 HydrophobicContact CD1-CD1 4.47Å; Y237-L241 HydrophobicContact CG-CD1 4.33Å; Y237-L241 PolarHBondContact O-N 2.76Å; L241-R255 WeakPolarHBondContact O-CD 3.4Å; L241-R255 PolarHBondContact O-NH1 2.75Å; L241-S256 VanDerWaalsContact CA-O 3.26Å; L241-S256 WeakPolarHBondContact CA-O 3.46Å; L241-S256 WeakPolarHBondContact CD2-O 3.27Å; L241-K258 HydrophobicContact CD1-CG 4.16Å; L241-K258 HydrophobicContact CD2-CG 4.17Å
242	V	90.3	Very high	80.9	Confident	0 Å²	0	83.5 Å²	83.5	0%	0	41%	0.41	C	S	.	.			trans	-52	140.8	168.7	-65.5	0	0	0	0	110.8	T226 L230 E244 A249 P250 Q253 R255 S256 I257	T226-V242 HydrophobicContact CG2-CG2 3.89Å; L230-V242 VanDerWaalsContact CD1-O 3.29Å; L230-V242 WeakPolarHBondContact CD1-O 3.33Å; L230-V242 WeakPolarHBondContact CD2-O 3.2Å; V242-E244 WeakPolarHBondContact CG2-O 3.31Å; V242-A249 HydrophobicContact CB-CB 4.27Å; V242-A249 HydrophobicContact CG1-CB 4.26Å; V242-P250 HydrophobicContact CG1-CB 4.23Å; V242-P250 HydrophobicContact CG1-CG 4.04Å; V242-Q253 VanDerWaalsContact CA-OE1 3.28Å; V242-R255 HydrophobicContact CG1-CB 3.86Å; V242-R255 WeakPolarHBondContact CG1-O 3.44Å; V242-S256 PolarHBondContact N-O 3.19Å; V242-I257 HydrophobicContact CG2-CG2 3.87Å
243	N	87.9	Confident	81.3	Confident	94 Å²	94	78.5 Å²	78.5	50%	0.503	39%	0.389	S	S	.	.	S	Bend	trans	-97.6	-7.9	177.1	66.6	5.5	0	0	0	113.4	Q253	N243-Q253 PolarHBondContact OD1-NE2 2.8Å; N243-Q253 PolarHBondContact OD1-OE1 3.38Å
244	E	88.9	Confident	82	Confident	93 Å²	93	81.1 Å²	81.1	44%	0.435	40%	0.397	S	S	.	.	S	Bend	trans	-123.4	159.9	176.2	-63.2	165	159.6	0	0	109.5	V242 D246 A249 R252 Q253	V242-E244 WeakPolarHBondContact CG2-O 3.31Å; E244-D246 VanDerWaalsContact CB-OD1 3.26Å; E244-D246 WeakPolarHBondContact CB-OD1 3.32Å; E244-A249 HydrophobicContact CB-CB 4.22Å; E244-A249 WeakPolarHBondContact O-CB 3.35Å; E244-R252 IonicContact OE2-CZ 3.55Å; E244-R252 IonicContact OE2-NE 3.63Å; E244-R252 IonicContact OE2-NH2 2.67Å; E244-R252 PolarHBondContact OE2-NH2 2.78Å; E244-Q253 PolarHBondContact OE2-NE2 2.88Å; E244-Q253 VanDerWaalsContact OE2-NE2 3.14Å
245	L	88.7	Confident	83.2	Confident	88 Å²	88	82 Å²	82	46%	0.461	40%	0.397	S	S	.	.			trans	-115.2	12.3	-170.5	-66.3	174.9	0	0	0	113.7	W223 R227 L230	W223-L245 HydrophobicContact CE3-CD2 4.18Å; R227-L245 HydrophobicContact CB-CD1 4.04Å; R227-L245 HydrophobicContact CB-CD2 4.35Å; R227-L245 HydrophobicContact CG-CD1 3.86Å; L230-L245 HydrophobicContact CD1-CD2 4.05Å
246	D	90.6	Very high	84.5	Confident	45 Å²	45	76.3 Å²	76.3	24%	0.241	38%	0.381	C	S	.	.	S	Bend	trans	-74.1	152.9	168.8	54.9	-86.6	0	0	0	111.1	W223 E244 D248 A249 R252	W223-D246 WeakPolarHBondContact CH2-O 3.48Å; W223-D246 VanDerWaalsContact CZ3-O 3.25Å; W223-D246 WeakPolarHBondContact CZ3-O 3.49Å; E244-D246 VanDerWaalsContact CB-OD1 3.26Å; E244-D246 WeakPolarHBondContact CB-OD1 3.32Å; D246-D248 PolarHBondContact O-N 2.86Å; D246-A249 VanDerWaalsContact O-CB 3.24Å; D246-A249 WeakPolarHBondContact O-CB 3.46Å; D246-A249 PolarHBondContact O-N 3.45Å; D246-A249 VanDerWaalsContact O-N 3.08Å; D246-A249 WeakPolarHBondContact OD2-CA 3.4Å; D246-A249 WeakPolarHBondContact OD2-CB 3.33Å; D246-A249 PolarHBondContact OD2-N 3.45Å; D246-R252 IonicContact OD1-CZ 3.91Å; D246-R252 IonicContact OD1-NH2 3.59Å; D246-R252 PolarHBondContact OD1-NH2 3.49Å; D246-R252 IonicContact OD2-CZ 2.75Å; D246-R252 IonicContact OD2-NH1 2.88Å; D246-R252 PolarHBondContact OD2-NH1 2.64Å; D246-R252 IonicContact OD2-NH2 3.93Å; D246-R252 PolarHBondContact OD2-NH2 2.87Å
247	P	88.5	Confident	85.9	Confident	46 Å²	46	70.4 Å²	70.4	30%	0.299	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-24.7	-173.7	26.5	-37.1	0	0	0	113.9	P250 W295	P247-P250 WeakPolarHBondContact O-CD 3.13Å; P247-W295 HydrophobicContact CB-CD2 3.66Å; P247-W295 HydrophobicContact CB-CE3 4.14Å; P247-W295 HydrophobicContact CB-CG 3.9Å; P247-W295 HydrophobicContact CB-CZ2 4.13Å; P247-W295 HydrophobicContact CG-CB 3.93Å; P247-W295 HydrophobicContact CG-CD2 3.85Å; P247-W295 HydrophobicContact CG-CE3 4.34Å; P247-W295 HydrophobicContact CG-CG 3.64Å
248	D	89.1	Confident	87.2	Confident	83 Å²	83	67.1 Å²	67.1	44%	0.444	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-2.6	177.9	65.6	-46.2	0	0	0	113.4	D246 F251 R252	D246-D248 PolarHBondContact O-N 2.86Å; D248-F251 PolarHBondContact O-N 3.33Å; D248-F251 VanDerWaalsContact O-N 3.1Å; D248-R252 WeakPolarHBondContact O-CB 3.25Å; D248-R252 PolarHBondContact O-N 3.22Å; D248-R252 IonicContact OD1-NH1 3.2Å; D248-R252 PolarHBondContact OD1-NH1 2.79Å; D248-R252 IonicContact OD2-CZ 2.81Å; D248-R252 IonicContact OD2-NH1 3.55Å; D248-R252 PolarHBondContact OD2-NH1 2.87Å
249	A	91.8	Very high	88.6	Confident	0 Å²	0	71 Å²	71	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-55.8	-43.5	177.9	0	0	0	0	0	113.7	V242 E244 D246 F251 R252 Q253	V242-A249 HydrophobicContact CB-CB 4.27Å; V242-A249 HydrophobicContact CG1-CB 4.26Å; E244-A249 HydrophobicContact CB-CB 4.22Å; E244-A249 WeakPolarHBondContact O-CB 3.35Å; D246-A249 VanDerWaalsContact O-CB 3.24Å; D246-A249 WeakPolarHBondContact O-CB 3.46Å; D246-A249 PolarHBondContact O-N 3.45Å; D246-A249 VanDerWaalsContact O-N 3.08Å; D246-A249 WeakPolarHBondContact OD2-CA 3.4Å; D246-A249 WeakPolarHBondContact OD2-CB 3.33Å; D246-A249 PolarHBondContact OD2-N 3.45Å; A249-F251 PolarHBondContact O-N 3.43Å; A249-R252 PolarHBondContact O-N 3.06Å; A249-Q253 WeakPolarHBondContact O-CB 3.28Å; A249-Q253 WeakPolarHBondContact O-CG 3.35Å; A249-Q253 PolarHBondContact O-N 3.41Å
250	P	89.8	Confident	89.4	Confident	27 Å²	27	71.4 Å²	71.4	18%	0.175	36%	0.356	C	S	.	.	H	α-helix	trans	-59	-36.9	177	-24.4	35	0	0	0	113	W223 V242 P247 E254 R255 I257	W223-P250 HydrophobicContact CH2-CG 3.73Å; W223-P250 HydrophobicContact CZ2-CG 4.06Å; V242-P250 HydrophobicContact CG1-CB 4.23Å; V242-P250 HydrophobicContact CG1-CG 4.04Å; P247-P250 WeakPolarHBondContact O-CD 3.13Å; P250-E254 VanDerWaalsContact O-CA 3.31Å; P250-E254 WeakPolarHBondContact O-CA 3.11Å; P250-E254 PolarHBondContact O-N 2.92Å; P250-E254 VanDerWaalsContact O-N 3.11Å; P250-R255 VanDerWaalsContact CA-O 3.24Å; P250-R255 WeakPolarHBondContact CA-O 3.37Å; P250-R255 WeakPolarHBondContact CB-O 3.17Å; P250-R255 PolarHBondContact O-N 3.16Å; P250-I257 HydrophobicContact CG-CG2 4.18Å
251	F	86.3	Confident	89.9	Confident	85 Å²	85	64.6 Å²	64.6	37%	0.373	33%	0.326	S	S	.	.	H	α-helix	trans	-78.6	-49.8	180	-59.5	-79.6	0	0	0	111.5	D248 A249 Q253 E254 T343 L344	D248-F251 PolarHBondContact O-N 3.33Å; D248-F251 VanDerWaalsContact O-N 3.1Å; A249-F251 PolarHBondContact O-N 3.43Å; F251-Q253 VanDerWaalsContact C-N 3.26Å; F251-Q253 PolarHBondContact O-N 2.94Å; F251-E254 PolarHBondContact O-N 3.26Å; F251-T343 WeakPolarHBondContact CE1-OG1 3.49Å; F251-L344 HydrophobicContact CE1-CD2 3.89Å; F251-L344 HydrophobicContact CE1-CG 4.37Å; F251-L344 HydrophobicContact CE2-CD2 3.62Å; F251-L344 HydrophobicContact CZ-CD2 3.17Å; F251-L344 HydrophobicContact CZ-CG 4.07Å
252	R	90.4	Very high	90.1	Very high	114 Å²	114	66.1 Å²	66.1	43%	0.43	34%	0.34	S	S	.	.	H	α-helix	trans	-63.2	-33	-178.3	-176	173	65.6	-99.6	-5.4	112.4	E244 D246 D248 A249	E244-R252 IonicContact OE2-CZ 3.55Å; E244-R252 IonicContact OE2-NE 3.63Å; E244-R252 IonicContact OE2-NH2 2.67Å; E244-R252 PolarHBondContact OE2-NH2 2.78Å; D246-R252 IonicContact OD1-CZ 3.91Å; D246-R252 IonicContact OD1-NH2 3.59Å; D246-R252 PolarHBondContact OD1-NH2 3.49Å; D246-R252 IonicContact OD2-CZ 2.75Å; D246-R252 IonicContact OD2-NH1 2.88Å; D246-R252 PolarHBondContact OD2-NH1 2.64Å; D246-R252 IonicContact OD2-NH2 3.93Å; D246-R252 PolarHBondContact OD2-NH2 2.87Å; D248-R252 WeakPolarHBondContact O-CB 3.25Å; D248-R252 PolarHBondContact O-N 3.22Å; D248-R252 IonicContact OD1-NH1 3.2Å; D248-R252 PolarHBondContact OD1-NH1 2.79Å; D248-R252 IonicContact OD2-CZ 2.81Å; D248-R252 IonicContact OD2-NH1 3.55Å; D248-R252 PolarHBondContact OD2-NH1 2.87Å; A249-R252 PolarHBondContact O-N 3.06Å
253	Q	91	Very high	90.2	Very high	37 Å²	37	69 Å²	69	17%	0.173	36%	0.363	C	S	.	.	H	α-helix	trans	-100.7	-11.1	-176.2	-55.4	178.8	17	0	0	113.4	V242 N243 E244 A249 F251 R255	V242-Q253 VanDerWaalsContact CA-OE1 3.28Å; N243-Q253 PolarHBondContact OD1-NE2 2.8Å; N243-Q253 PolarHBondContact OD1-OE1 3.38Å; E244-Q253 PolarHBondContact OE2-NE2 2.88Å; E244-Q253 VanDerWaalsContact OE2-NE2 3.14Å; A249-Q253 WeakPolarHBondContact O-CB 3.28Å; A249-Q253 WeakPolarHBondContact O-CG 3.35Å; A249-Q253 PolarHBondContact O-N 3.41Å; F251-Q253 VanDerWaalsContact C-N 3.26Å; F251-Q253 PolarHBondContact O-N 2.94Å; Q253-R255 VanDerWaalsContact C-N 3.26Å; Q253-R255 HydrophobicContact CB-CB 4.2Å; Q253-R255 HydrophobicContact CB-CG 4.15Å; Q253-R255 WeakPolarHBondContact O-CG 3.36Å; Q253-R255 PolarHBondContact O-N 2.92Å
254	E	88.7	Confident	90.3	Very high	184 Å²	184	66.4 Å²	66.4	86%	0.86	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.4	44.7	-171.5	-57.9	178.4	-175.9	0	0	111.8	P250 F251	P250-E254 VanDerWaalsContact O-CA 3.31Å; P250-E254 WeakPolarHBondContact O-CA 3.11Å; P250-E254 PolarHBondContact O-N 2.92Å; P250-E254 VanDerWaalsContact O-N 3.11Å; F251-E254 PolarHBondContact O-N 3.26Å
255	R	89.9	Confident	90.5	Very high	85 Å²	85	63 Å²	63	32%	0.321	33%	0.331	S	S	.	.			trans	-129.5	154.5	-176.6	-72.1	-172.8	-167	-167.2	-1.3	111.1	S238 F240 L241 V242 P250 Q253	S238-R255 PolarHBondContact O-NH1 3.32Å; F240-R255 WeakPolarHBondContact O-CB 3.46Å; L241-R255 WeakPolarHBondContact O-CD 3.4Å; L241-R255 PolarHBondContact O-NH1 2.75Å; V242-R255 HydrophobicContact CG1-CB 3.86Å; V242-R255 WeakPolarHBondContact CG1-O 3.44Å; P250-R255 VanDerWaalsContact CA-O 3.24Å; P250-R255 WeakPolarHBondContact CA-O 3.37Å; P250-R255 WeakPolarHBondContact CB-O 3.17Å; P250-R255 PolarHBondContact O-N 3.16Å; Q253-R255 VanDerWaalsContact C-N 3.26Å; Q253-R255 HydrophobicContact CB-CB 4.2Å; Q253-R255 HydrophobicContact CB-CG 4.15Å; Q253-R255 WeakPolarHBondContact O-CG 3.36Å; Q253-R255 PolarHBondContact O-N 2.92Å
256	S	89.4	Confident	90.7	Very high	64 Å²	64	61.4 Å²	61.4	45%	0.448	32%	0.322	S	S	.	.	B	Isolated β-bridge	trans	-91.9	162.7	-179.1	65.4	0	0	0	0	112.3	F240 L241 V242	F240-S256 PolarHBondContact O-N 2.97Å; F240-S256 VanDerWaalsContact O-N 3.14Å; L241-S256 VanDerWaalsContact CA-O 3.26Å; L241-S256 WeakPolarHBondContact CA-O 3.46Å; L241-S256 WeakPolarHBondContact CD2-O 3.27Å; V242-S256 PolarHBondContact N-O 3.19Å
257	I	91.7	Very high	90.7	Very high	18 Å²	18	63.5 Å²	63.5	9%	0.092	34%	0.336	C	S	.	.	P	Polyproline II helix	trans	-93.5	171.9	160.5	59.2	177.8	0	0	0	108.8	W223 T226 V242 P250 D261 A262 Q265	W223-I257 HydrophobicContact CD2-CG2 4.01Å; W223-I257 HydrophobicContact CE3-CG2 4.3Å; W223-I257 HydrophobicContact CH2-CG2 4.3Å; W223-I257 HydrophobicContact CZ2-CD1 4.28Å; W223-I257 HydrophobicContact CZ2-CG2 4Å; W223-I257 HydrophobicContact CZ3-CG2 4.43Å; T226-I257 HydrophobicContact CG2-CB 4.36Å; T226-I257 HydrophobicContact CG2-CG2 4.3Å; V242-I257 HydrophobicContact CG2-CG2 3.87Å; P250-I257 HydrophobicContact CG-CG2 4.18Å; I257-D261 HydrophobicContact CD1-CB 4.4Å; I257-A262 HydrophobicContact CD1-CB 3.93Å; I257-A262 HydrophobicContact CG1-CB 3.98Å; I257-Q265 VanDerWaalsContact CD1-OE1 3.3Å
258	K	91.5	Very high	90.9	Very high	51 Å²	51	61.8 Å²	61.8	22%	0.222	32%	0.324	C	S	.	.	P	Polyproline II helix	trans	-63.2	140	173.6	-80.4	-167.7	171.4	174.1	0	111.2	N225 T226 C229 L241 V260 D261 A262	N225-K258 HydrophobicContact CB-CB 4.44Å; N225-K258 HydrophobicContact CB-CD 3.76Å; N225-K258 PolarHBondContact O-NZ 3.45Å; T226-K258 PolarHBondContact OG1-N 3.38Å; C229-K258 HydrophobicContact CB-CD 4.47Å; L241-K258 HydrophobicContact CD1-CG 4.16Å; L241-K258 HydrophobicContact CD2-CG 4.17Å; K258-V260 PolarHBondContact O-N 3.04Å; K258-V260 VanDerWaalsContact O-N 3.14Å; K258-D261 WeakPolarHBondContact O-CA 3.36Å; K258-D261 WeakPolarHBondContact O-CB 3.43Å; K258-D261 PolarHBondContact O-N 3.5Å; K258-A262 PolarHBondContact O-N 2.99Å
259	D	91.2	Very high	91.2	Very high	136 Å²	136	57.9 Å²	57.9	73%	0.727	30%	0.304	S	S	*	.	H	α-helix	trans	-54	-37.9	-178.8	-56.8	-19.7	0	0	0	113.5	D261 A262 A263	D259-D261 VanDerWaalsContact C-N 3.32Å; D259-D261 PolarHBondContact O-N 3.23Å; D259-A262 PolarHBondContact O-N 3.42Å; D259-A263 WeakPolarHBondContact O-CB 3.48Å; D259-A263 PolarHBondContact O-N 3.47Å
260	V	91.3	Very high	91.2	Very high	99 Å²	99	63.4 Å²	63.4	60%	0.6	33%	0.328	S	S	*	.	H	α-helix	trans	-62.9	-39.8	176.1	-180	0	0	0	0	111.5	K258 K264	K258-V260 PolarHBondContact O-N 3.04Å; K258-V260 VanDerWaalsContact O-N 3.14Å; V260-K264 WeakPolarHBondContact O-CB 3.26Å; V260-K264 PolarHBondContact O-N 2.86Å; V260-K264 VanDerWaalsContact O-N 3.13Å
261	D	92.9	Very high	91.3	Very high	1 Å²	1	64.2 Å²	64.2	1%	0.005	33%	0.332	C	S	.	.	H	α-helix	trans	-74	-36.5	177.3	-66.7	-31.3	0	0	0	111.3	W223 N225 T226 I257 K258 D259 K264 Q265	W223-D261 VanDerWaalsContact CA-CG 3.43Å; W223-D261 VanDerWaalsContact CA-OD2 3.32Å; W223-D261 WeakPolarHBondContact CA-OD2 3.5Å; N225-D261 WeakPolarHBondContact CA-OD2 3.49Å; N225-D261 WeakPolarHBondContact CB-OD1 3.35Å; N225-D261 WeakPolarHBondContact CB-OD2 3.46Å; N225-D261 PolarHBondContact N-OD1 2.82Å; N225-D261 PolarHBondContact N-OD2 2.94Å; N225-D261 PolarHBondContact ND2-OD1 3.28Å; T226-D261 VanDerWaalsContact CB-OD2 3.29Å; T226-D261 WeakPolarHBondContact CB-OD2 3.44Å; T226-D261 PolarHBondContact N-OD2 3.4Å; T226-D261 PolarHBondContact OG1-OD2 3.43Å; I257-D261 HydrophobicContact CD1-CB 4.4Å; K258-D261 WeakPolarHBondContact O-CA 3.36Å; K258-D261 WeakPolarHBondContact O-CB 3.43Å; K258-D261 PolarHBondContact O-N 3.5Å; D259-D261 VanDerWaalsContact C-N 3.32Å; D259-D261 PolarHBondContact O-N 3.23Å; D261-K264 PolarHBondContact O-N 3.34Å; D261-Q265 VanDerWaalsContact O-CB 3.3Å; D261-Q265 WeakPolarHBondContact O-CB 3.33Å; D261-Q265 PolarHBondContact O-N 3.47Å
262	A	92	Very high	91.7	Very high	39 Å²	39	60.2 Å²	60.2	32%	0.322	32%	0.315	S	S	.	.	H	α-helix	trans	-62	-46.4	174.1	0	0	0	0	0	111.8	I257 K258 D259 K264 Q265 E266	I257-A262 HydrophobicContact CD1-CB 3.93Å; I257-A262 HydrophobicContact CG1-CB 3.98Å; K258-A262 PolarHBondContact O-N 2.99Å; D259-A262 PolarHBondContact O-N 3.42Å; A262-K264 VanDerWaalsContact C-N 3.33Å; A262-K264 PolarHBondContact O-N 3.35Å; A262-Q265 PolarHBondContact O-N 2.94Å; A262-E266 PolarHBondContact O-N 2.83Å
263	A	91.9	Very high	91.9	Very high	59 Å²	59	54.9 Å²	54.9	49%	0.488	30%	0.295	S	S	.	.	H	α-helix	trans	-63.1	-39.1	176.7	0	0	0	0	0	112.3	D259 T267	D259-A263 WeakPolarHBondContact O-CB 3.48Å; D259-A263 PolarHBondContact O-N 3.47Å; A263-T267 PolarHBondContact O-N 3.41Å; A263-T267 VanDerWaalsContact O-N 3.14Å; A263-T267 PolarHBondContact O-OG1 3.11Å
264	K	91.5	Very high	92	Very high	40 Å²	40	55.6 Å²	55.6	17%	0.174	30%	0.3	C	S	.	.	H	α-helix	trans	-65.3	-46.5	174.8	-175.7	-175.7	172.1	-167.5	0	111.5	D220 F221 L222 V260 D261 A262 E266 T267 V268 Q291	D220-K264 PolarHBondContact O-NZ 3.04Å; D220-K264 IonicContact OD1-NZ 2.81Å; D220-K264 PolarHBondContact OD1-NZ 2.88Å; D220-K264 WeakPolarHBondContact OD2-CE 3.33Å; D220-K264 IonicContact OD2-NZ 3.31Å; D220-K264 PolarHBondContact OD2-NZ 2.8Å; F221-K264 VanDerWaalsContact C-NZ 3.32Å; F221-K264 PolarHBondContact O-NZ 3.47Å; L222-K264 HydrophobicContact CD2-CB 4.47Å; L222-K264 HydrophobicContact CD2-CD 4.01Å; L222-K264 HydrophobicContact CD2-CG 3.9Å; V260-K264 WeakPolarHBondContact O-CB 3.26Å; V260-K264 PolarHBondContact O-N 2.86Å; V260-K264 VanDerWaalsContact O-N 3.13Å; D261-K264 PolarHBondContact O-N 3.34Å; A262-K264 VanDerWaalsContact C-N 3.33Å; A262-K264 PolarHBondContact O-N 3.35Å; K264-E266 VanDerWaalsContact C-N 3.3Å; K264-E266 PolarHBondContact O-N 3.4Å; K264-T267 WeakPolarHBondContact O-CB 3.46Å; K264-T267 PolarHBondContact O-N 2.87Å; K264-T267 VanDerWaalsContact O-N 3.17Å; K264-V268 WeakPolarHBondContact O-CG2 3.47Å; K264-V268 PolarHBondContact O-N 2.85Å; K264-Q291 VanDerWaalsContact CE-OE1 3.27Å
265	Q	92.6	Very high	92.2	Very high	23 Å²	23	47.1 Å²	47.1	11%	0.107	26%	0.26	C	S	.	.	H	α-helix	trans	-57.8	-43.8	177.1	175.7	176	-8.1	0	0	111.3	L222 I257 D261 A262 T267 V268 F269	L222-Q265 HydrophobicContact CD1-CB 4.21Å; L222-Q265 HydrophobicContact CD1-CG 4.13Å; L222-Q265 HydrophobicContact CD2-CB 4.18Å; I257-Q265 VanDerWaalsContact CD1-OE1 3.3Å; D261-Q265 VanDerWaalsContact O-CB 3.3Å; D261-Q265 WeakPolarHBondContact O-CB 3.33Å; D261-Q265 PolarHBondContact O-N 3.47Å; A262-Q265 PolarHBondContact O-N 2.94Å; Q265-T267 VanDerWaalsContact C-N 3.31Å; Q265-T267 PolarHBondContact O-N 3.33Å; Q265-V268 PolarHBondContact O-N 2.95Å; Q265-F269 HydrophobicContact CG-CD2 3.89Å; Q265-F269 HydrophobicContact CG-CE1 4.24Å; Q265-F269 HydrophobicContact CG-CE2 3.39Å; Q265-F269 HydrophobicContact CG-CZ 3.6Å; Q265-F269 WeakPolarHBondContact O-CG 3.43Å; Q265-F269 PolarHBondContact O-N 3.48Å
266	E	92.6	Very high	92.4	Very high	54 Å²	54	43.2 Å²	43.2	25%	0.252	25%	0.246	S	C	.	.	H	α-helix	trans	-61.8	-39.4	176.9	-172.1	62.9	-174.4	0	0	112.6	A262 K264 F269 K270 S345 N347	A262-E266 PolarHBondContact O-N 2.83Å; K264-E266 VanDerWaalsContact C-N 3.3Å; K264-E266 PolarHBondContact O-N 3.4Å; E266-F269 PolarHBondContact O-N 3.36Å; E266-K270 WeakPolarHBondContact O-CB 3.45Å; E266-K270 PolarHBondContact O-N 3.36Å; E266-S345 WeakPolarHBondContact OE2-CB 3.43Å; E266-S345 PolarHBondContact OE2-OG 3.24Å; E266-N347 WeakPolarHBondContact OE1-CB 3.12Å; E266-N347 PolarHBondContact OE1-ND2 2.92Å
267	T	91	Very high	92.5	Very high	89 Å²	89	40.6 Å²	40.6	55%	0.546	23%	0.226	S	C	.	.	H	α-helix	trans	-64.1	-43.5	174.9	-55.2	0	0	0	0	111.2	A263 K264 Q265 K270 T271	A263-T267 PolarHBondContact O-N 3.41Å; A263-T267 VanDerWaalsContact O-N 3.14Å; A263-T267 PolarHBondContact O-OG1 3.11Å; K264-T267 WeakPolarHBondContact O-CB 3.46Å; K264-T267 PolarHBondContact O-N 2.87Å; K264-T267 VanDerWaalsContact O-N 3.17Å; Q265-T267 VanDerWaalsContact C-N 3.31Å; Q265-T267 PolarHBondContact O-N 3.33Å; T267-K270 PolarHBondContact O-N 3.17Å; T267-T271 PolarHBondContact O-N 2.96Å; T267-T271 PolarHBondContact O-OG1 3.01Å
268	V	92.1	Very high	92.6	Very high	9 Å²	9	40.4 Å²	40.4	6%	0.055	23%	0.225	C	C	.	.	H	α-helix	trans	-62.5	-44.4	176.4	171.9	0	0	0	0	110.9	L222 K264 Q265 K270 T271 V272 Q291	L222-V268 HydrophobicContact CD2-CG2 4Å; K264-V268 WeakPolarHBondContact O-CG2 3.47Å; K264-V268 PolarHBondContact O-N 2.85Å; Q265-V268 PolarHBondContact O-N 2.95Å; V268-K270 PolarHBondContact O-N 3.14Å; V268-T271 PolarHBondContact O-N 3.47Å; V268-V272 HydrophobicContact CG1-CG2 4.28Å; V268-V272 WeakPolarHBondContact O-CG2 3.14Å; V268-V272 PolarHBondContact O-N 2.95Å; V268-Q291 HydrophobicContact CG1-CB 4.36Å; V268-Q291 HydrophobicContact CG1-CG 4.07Å; V268-Q291 HydrophobicContact CG2-CG 3.86Å
269	F	95	Very high	92.4	Very high	1 Å²	1	39.6 Å²	39.6	0%	0.004	23%	0.231	C	C	.	.	H	α-helix	trans	-61.9	-42.2	177	-67.9	-29.6	0	0	0	112.4	Q265 E266 T271 V272 F273 W295 L296 N347 E348 I351	Q265-F269 HydrophobicContact CG-CD2 3.89Å; Q265-F269 HydrophobicContact CG-CE1 4.24Å; Q265-F269 HydrophobicContact CG-CE2 3.39Å; Q265-F269 HydrophobicContact CG-CZ 3.6Å; Q265-F269 WeakPolarHBondContact O-CG 3.43Å; Q265-F269 PolarHBondContact O-N 3.48Å; E266-F269 PolarHBondContact O-N 3.36Å; F269-T271 VanDerWaalsContact C-N 3.34Å; F269-T271 PolarHBondContact O-N 3.06Å; F269-V272 PolarHBondContact O-N 2.86Å; F269-F273 WeakPolarHBondContact O-CB 3.41Å; F269-F273 PolarHBondContact O-N 3.39Å; F269-W295 AromaticContact CE1-CH2 3.7Å; F269-W295 HydrophobicContact CE1-CH2 3.7Å; F269-W295 HydrophobicContact CE1-CZ2 4.02Å; F269-W295 AromaticContact CZ-CH2 3.7Å; F269-W295 HydrophobicContact CZ-CH2 3.7Å; F269-W295 HydrophobicContact CZ-CZ2 4.03Å; F269-L296 HydrophobicContact CD1-CD2 4.06Å; F269-L296 HydrophobicContact CE1-CD2 3.98Å; F269-N347 HydrophobicContact CB-CB 3.79Å; F269-E348 HydrophobicContact CD2-CB 3.67Å; F269-E348 HydrophobicContact CD2-CG 4.35Å; F269-E348 HydrophobicContact CE2-CB 3.6Å; F269-E348 VanDerWaalsContact CE2-CD 3.49Å; F269-E348 HydrophobicContact CE2-CG 3.85Å; F269-E348 WeakPolarHBondContact CE2-OE2 3.48Å; F269-E348 HydrophobicContact CG-CB 4.32Å; F269-E348 HydrophobicContact CZ-CB 4.23Å; F269-E348 HydrophobicContact CZ-CG 4.01Å; F269-I351 HydrophobicContact CB-CD1 3.9Å; F269-I351 HydrophobicContact CD1-CD1 3.84Å; F269-I351 HydrophobicContact CG-CD1 4.15Å
270	K	93.3	Very high	92.4	Very high	116 Å²	116	35.7 Å²	35.7	50%	0.504	21%	0.208	S	C	.	.	H	α-helix	trans	-59.1	-44.7	174.4	-171.4	176.7	-178.5	177.6	0	111.9	E266 T267 V268 F273 N274	E266-K270 WeakPolarHBondContact O-CB 3.45Å; E266-K270 PolarHBondContact O-N 3.36Å; T267-K270 PolarHBondContact O-N 3.17Å; V268-K270 PolarHBondContact O-N 3.14Å; K270-F273 PolarHBondContact O-N 2.97Å; K270-N274 VanDerWaalsContact O-CG 3.3Å; K270-N274 PolarHBondContact O-N 3.37Å; K270-N274 PolarHBondContact O-OD1 3.32Å
271	T	91.8	Very high	92.3	Very high	45 Å²	45	32 Å²	32	28%	0.276	19%	0.185	S	C	.	.	H	α-helix	trans	-65.4	-42.1	176.7	-55.6	0	0	0	0	111.8	T267 V268 F269 N274 L275 L287	T267-T271 PolarHBondContact O-N 2.96Å; T267-T271 PolarHBondContact O-OG1 3.01Å; V268-T271 PolarHBondContact O-N 3.47Å; F269-T271 VanDerWaalsContact C-N 3.34Å; F269-T271 PolarHBondContact O-N 3.06Å; T271-N274 PolarHBondContact O-N 3.17Å; T271-L275 HydrophobicContact CG2-CD1 4.32Å; T271-L275 WeakPolarHBondContact O-CG 3.46Å; T271-L275 PolarHBondContact O-N 2.88Å; T271-L287 HydrophobicContact CG2-CD2 3.5Å
272	V	93.9	Very high	92.1	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-61.3	-44	175.9	167.3	0	0	0	0	111	V268 F269 N274 L275 I276 A284 L287 L296 L300 I351	V268-V272 HydrophobicContact CG1-CG2 4.28Å; V268-V272 WeakPolarHBondContact O-CG2 3.14Å; V268-V272 PolarHBondContact O-N 2.95Å; F269-V272 PolarHBondContact O-N 2.86Å; V272-N274 PolarHBondContact O-N 3.47Å; V272-L275 PolarHBondContact O-N 3.01Å; V272-I276 HydrophobicContact CG1-CD1 4.14Å; V272-I276 WeakPolarHBondContact O-CG1 3.31Å; V272-I276 PolarHBondContact O-N 3.42Å; V272-A284 HydrophobicContact CG1-CB 4.29Å; V272-L287 HydrophobicContact CG2-CD2 3.92Å; V272-L296 HydrophobicContact CG1-CD2 4.32Å; V272-L296 HydrophobicContact CG2-CD2 4.06Å; V272-L300 HydrophobicContact CG1-CD1 4Å; V272-L300 HydrophobicContact CG1-CD2 4.23Å; V272-I351 HydrophobicContact CB-CD1 3.95Å; V272-I351 HydrophobicContact CG1-CD1 3.64Å; V272-I351 HydrophobicContact CG1-CG1 4.01Å; V272-I351 HydrophobicContact CG1-CG2 4.45Å
273	F	95.1	Very high	91.9	Very high	2 Å²	2	36.9 Å²	36.9	1%	0.009	20%	0.204	C	C	.	.	H	α-helix	trans	-60	-45.4	174.7	178.9	-93.4	0	0	0	111.8	F269 K270 L275 I276 R277 A350 I351 A354 T362 G365 W374	F269-F273 WeakPolarHBondContact O-CB 3.41Å; F269-F273 PolarHBondContact O-N 3.39Å; K270-F273 PolarHBondContact O-N 2.97Å; F273-L275 VanDerWaalsContact C-N 3.29Å; F273-L275 PolarHBondContact O-N 3Å; F273-I276 WeakPolarHBondContact O-CB 3.49Å; F273-I276 PolarHBondContact O-N 3.19Å; F273-I276 VanDerWaalsContact O-N 3.1Å; F273-R277 HydrophobicContact CE1-CB 4.47Å; F273-R277 PolarHBondContact O-N 2.82Å; F273-A350 HydrophobicContact CD2-CB 3.5Å; F273-A350 HydrophobicContact CE2-CB 3.61Å; F273-A350 HydrophobicContact CG-CB 4.19Å; F273-A350 HydrophobicContact CZ-CB 4.39Å; F273-I351 HydrophobicContact CB-CG1 4.1Å; F273-A354 HydrophobicContact CE2-CB 4.21Å; F273-T362 HydrophobicContact CE2-CG2 4.42Å; F273-G365 VanDerWaalsContact CE1-CA 3.47Å; F273-G365 WeakPolarHBondContact CE1-O 3.39Å; F273-W374 HydrophobicContact CE2-CZ3 4.43Å; F273-W374 HydrophobicContact CZ-CZ3 4.03Å
274	N	92.6	Very high	91.9	Very high	53 Å²	53	34 Å²	34	28%	0.283	18%	0.18	S	C	.	.	H	α-helix	trans	-60.1	-40	176.8	-71.5	-8.1	0	0	0	112	K270 T271 V272 I276 R277 I278	K270-N274 VanDerWaalsContact O-CG 3.3Å; K270-N274 PolarHBondContact O-N 3.37Å; K270-N274 PolarHBondContact O-OD1 3.32Å; T271-N274 PolarHBondContact O-N 3.17Å; V272-N274 PolarHBondContact O-N 3.47Å; N274-I276 VanDerWaalsContact C-N 3.33Å; N274-I276 PolarHBondContact O-N 2.92Å; N274-R277 WeakPolarHBondContact O-CB 3.49Å; N274-R277 PolarHBondContact O-N 2.92Å; N274-I278 WeakPolarHBondContact O-CG1 3.08Å; N274-I278 PolarHBondContact O-N 3.48Å; N274-I278 VanDerWaalsContact O-N 3.12Å
275	L	92.3	Very high	92	Very high	5 Å²	5	32.6 Å²	32.6	3%	0.026	17%	0.174	C	C	.	.	H	α-helix	trans	-64.3	-37.2	175.1	-69.3	169.7	0	0	0	112.1	F213 T271 V272 F273 I278 G279 H280 E283 A284 L287	F213-L275 HydrophobicContact CE1-CD2 3.85Å; T271-L275 HydrophobicContact CG2-CD1 4.32Å; T271-L275 WeakPolarHBondContact O-CG 3.46Å; T271-L275 PolarHBondContact O-N 2.88Å; V272-L275 PolarHBondContact O-N 3.01Å; F273-L275 VanDerWaalsContact C-N 3.29Å; F273-L275 PolarHBondContact O-N 3Å; L275-I278 HydrophobicContact CD2-CD1 4.18Å; L275-I278 WeakPolarHBondContact O-CG1 3.47Å; L275-G279 PolarHBondContact O-N 2.95Å; L275-H280 HydrophobicContact CD2-CB 4.28Å; L275-H280 CarbonylContact O-C 3.58Å; L275-H280 WeakPolarHBondContact O-CA 3.41Å; L275-H280 PolarHBondContact O-N 3.34Å; L275-E283 HydrophobicContact CD1-CB 4.44Å; L275-E283 HydrophobicContact CD2-CB 4.16Å; L275-A284 HydrophobicContact CB-CB 3.76Å; L275-A284 HydrophobicContact CD1-CB 4.03Å; L275-L287 HydrophobicContact CD1-CB 4.32Å; L275-L287 HydrophobicContact CD1-CD2 3.75Å
276	I	93.8	Very high	91.9	Very high	4 Å²	4	34 Å²	34	2%	0.021	18%	0.184	C	C	.	.	H	α-helix	trans	-65.6	-44.7	172.7	-64.7	164	0	0	0	110.6	V272 F273 N274 I278 G279 L300 I351 A354 W374	V272-I276 HydrophobicContact CG1-CD1 4.14Å; V272-I276 WeakPolarHBondContact O-CG1 3.31Å; V272-I276 PolarHBondContact O-N 3.42Å; F273-I276 WeakPolarHBondContact O-CB 3.49Å; F273-I276 PolarHBondContact O-N 3.19Å; F273-I276 VanDerWaalsContact O-N 3.1Å; N274-I276 VanDerWaalsContact C-N 3.33Å; N274-I276 PolarHBondContact O-N 2.92Å; I276-I278 PolarHBondContact O-N 3.36Å; I276-G279 PolarHBondContact O-N 3.24Å; I276-L300 HydrophobicContact CD1-CD2 3.8Å; I276-L300 HydrophobicContact CG1-CD2 4.25Å; I276-I351 HydrophobicContact CD1-CB 4.35Å; I276-I351 HydrophobicContact CD1-CG1 4.3Å; I276-I351 HydrophobicContact CD1-CG2 3.81Å; I276-A354 HydrophobicContact CG2-CB 3.82Å; I276-W374 HydrophobicContact CG2-CH2 4.4Å; I276-W374 HydrophobicContact CG2-CZ2 4.41Å
277	R	93.4	Very high	91.8	Very high	8 Å²	8	32.2 Å²	32.2	3%	0.03	18%	0.176	C	C	.	.	H	α-helix	trans	-58.7	-33.6	-179.9	170.7	60.2	-172.2	90.4	1.5	113	L199 E202 F273 N274 D371 W374	L199-R277 VanDerWaalsContact C-NH1 3.26Å; L199-R277 PolarHBondContact O-NH1 3.04Å; L199-R277 PolarHBondContact O-NH2 3.45Å; E202-R277 IonicContact OE2-NH2 2.88Å; F273-R277 HydrophobicContact CE1-CB 4.47Å; F273-R277 PolarHBondContact O-N 2.82Å; N274-R277 WeakPolarHBondContact O-CB 3.49Å; N274-R277 PolarHBondContact O-N 2.92Å; R277-D371 IonicContact CZ-OD1 2.85Å; R277-D371 IonicContact NE-OD1 3.91Å; R277-D371 PolarHBondContact NE-OD1 3.32Å; R277-D371 IonicContact NH2-OD1 3.46Å; R277-D371 PolarHBondContact NH2-OD1 2.81Å; R277-W374 HydrophobicContact CB-CH2 4.35Å
278	I	91.9	Very high	91.8	Very high	15 Å²	15	28 Å²	28	8%	0.077	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.8	3.8	176.6	70.4	174	0	0	0	113.2	A203 V204 N274 L275 I276 H280	A203-I278 HydrophobicContact CB-CG2 3.81Å; V204-I278 HydrophobicContact CG2-CB 3.73Å; V204-I278 HydrophobicContact CG2-CG1 4.44Å; V204-I278 HydrophobicContact CG2-CG2 4.49Å; V204-I278 WeakPolarHBondContact CG2-O 3.29Å; N274-I278 WeakPolarHBondContact O-CG1 3.08Å; N274-I278 PolarHBondContact O-N 3.48Å; N274-I278 VanDerWaalsContact O-N 3.12Å; L275-I278 HydrophobicContact CD2-CD1 4.18Å; L275-I278 WeakPolarHBondContact O-CG1 3.47Å; I276-I278 PolarHBondContact O-N 3.36Å; I278-H280 VanDerWaalsContact C-N 3.32Å; I278-H280 HydrophobicContact CD1-CB 4.01Å; I278-H280 HydrophobicContact CG1-CB 3.83Å; I278-H280 PolarHBondContact O-CD2 3.17Å; I278-H280 VanDerWaalsContact O-CD2 3.3Å; I278-H280 PolarHBondContact O-N 2.95Å
279	G	89.1	Confident	91.8	Very high	33 Å²	33	32.7 Å²	32.7	34%	0.34	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.5	5.5	-180	0	0	0	0	0	115.4	L275 I276 I281	L275-G279 PolarHBondContact O-N 2.95Å; I276-G279 PolarHBondContact O-N 3.24Å; G279-I281 VanDerWaalsContact C-N 3.33Å; G279-I281 PolarHBondContact O-N 3.23Å; G279-I281 VanDerWaalsContact O-N 3.16Å
280	H	89.9	Confident	91.5	Very high	55 Å²	55	37.9 Å²	37.9	26%	0.255	19%	0.191	S	C	.	.			trans	-90.7	56.5	-176.5	-71.5	-154	0	0	0	112.4	L275 I278 D282 E283 A284	L275-H280 HydrophobicContact CD2-CB 4.28Å; L275-H280 CarbonylContact O-C 3.58Å; L275-H280 WeakPolarHBondContact O-CA 3.41Å; L275-H280 PolarHBondContact O-N 3.34Å; I278-H280 VanDerWaalsContact C-N 3.32Å; I278-H280 HydrophobicContact CD1-CB 4.01Å; I278-H280 HydrophobicContact CG1-CB 3.83Å; I278-H280 PolarHBondContact O-CD2 3.17Å; I278-H280 VanDerWaalsContact O-CD2 3.3Å; I278-H280 PolarHBondContact O-N 2.95Å; H280-D282 VanDerWaalsContact C-N 3.27Å; H280-D282 PolarHBondContact O-N 2.81Å; H280-E283 HydrophobicContact CB-CB 4.3Å; H280-E283 HydrophobicContact CB-CG 4.44Å; H280-E283 WeakPolarHBondContact CB-OE2 3.25Å; H280-E283 IonicContact CE1-OE2 2.76Å; H280-E283 IonicContact CG-OE2 3.42Å; H280-E283 VanDerWaalsContact ND1-CD 3.35Å; H280-E283 IonicContact ND1-OE1 2.7Å; H280-E283 IonicContact ND1-OE2 3.21Å; H280-E283 PolarHBondContact ND1-OE2 2.99Å; H280-E283 PolarHBondContact O-N 3.18Å; H280-A284 PolarHBondContact O-N 3.05Å; H280-A284 VanDerWaalsContact O-N 3.14Å
281	I	89	Confident	91.3	Very high	22 Å²	22	33.9 Å²	33.9	11%	0.113	18%	0.175	C	C	.	.	H	α-helix	trans	-63.7	-33.1	-176.4	-59.4	176.3	0	0	0	111.8	F9 G279 E283 A284 I285 L300	F9-I281 HydrophobicContact CD1-CD1 4.29Å; F9-I281 HydrophobicContact CE1-CD1 3.58Å; F9-I281 HydrophobicContact CE2-CD1 4.15Å; F9-I281 HydrophobicContact CZ-CD1 3.5Å; F9-I281 VanDerWaalsContact CZ-CD1 3.5Å; G279-I281 VanDerWaalsContact C-N 3.33Å; G279-I281 PolarHBondContact O-N 3.23Å; G279-I281 VanDerWaalsContact O-N 3.16Å; I281-E283 VanDerWaalsContact C-N 3.33Å; I281-E283 PolarHBondContact O-N 2.98Å; I281-A284 CarbonylContact O-C 3.6Å; I281-A284 WeakPolarHBondContact O-CA 3.21Å; I281-A284 VanDerWaalsContact O-CB 3.3Å; I281-A284 WeakPolarHBondContact O-CB 3.48Å; I281-A284 PolarHBondContact O-N 2.91Å; I281-A284 VanDerWaalsContact O-N 3.12Å; I281-I285 HydrophobicContact CG2-CD1 4.13Å; I281-I285 HydrophobicContact CG2-CG1 4.42Å; I281-I285 WeakPolarHBondContact O-CG1 3.45Å; I281-I285 PolarHBondContact O-N 3.2Å; I281-L300 HydrophobicContact CG2-CB 4.45Å
282	D	88.5	Confident	91.1	Very high	82 Å²	82	33 Å²	33	44%	0.439	18%	0.175	S	C	.	.	H	α-helix	trans	-64	-39.9	178.7	-66.8	-26.3	0	0	0	111.9	H280 A284 I285 V286 R304	H280-D282 VanDerWaalsContact C-N 3.27Å; H280-D282 PolarHBondContact O-N 2.81Å; D282-A284 VanDerWaalsContact C-N 3.31Å; D282-I285 WeakPolarHBondContact O-CB 3.3Å; D282-I285 PolarHBondContact O-N 3.49Å; D282-V286 WeakPolarHBondContact O-CG2 3.35Å; D282-V286 PolarHBondContact O-N 3.16Å; D282-R304 IonicContact OD1-CZ 2.69Å; D282-R304 IonicContact OD1-NE 3.04Å; D282-R304 IonicContact OD1-NH2 3.92Å; D282-R304 PolarHBondContact OD1-NH2 3.25Å
283	E	89.4	Confident	90.9	Very high	59 Å²	59	33.1 Å²	33.1	28%	0.276	18%	0.175	S	C	.	.	H	α-helix	trans	-68.6	-33.9	174	-65.9	173.5	173.5	0	0	111.2	F213 L275 H280 I281 V286 L287	F213-E283 WeakPolarHBondContact CE1-OE2 3.46Å; F213-E283 VanDerWaalsContact CZ-OE2 3.29Å; F213-E283 WeakPolarHBondContact CZ-OE2 3.31Å; L275-E283 HydrophobicContact CD1-CB 4.44Å; L275-E283 HydrophobicContact CD2-CB 4.16Å; H280-E283 HydrophobicContact CB-CB 4.3Å; H280-E283 HydrophobicContact CB-CG 4.44Å; H280-E283 WeakPolarHBondContact CB-OE2 3.25Å; H280-E283 IonicContact CE1-OE2 2.76Å; H280-E283 IonicContact CG-OE2 3.42Å; H280-E283 VanDerWaalsContact ND1-CD 3.35Å; H280-E283 IonicContact ND1-OE1 2.7Å; H280-E283 IonicContact ND1-OE2 3.21Å; H280-E283 PolarHBondContact ND1-OE2 2.99Å; H280-E283 PolarHBondContact O-N 3.18Å; I281-E283 VanDerWaalsContact C-N 3.33Å; I281-E283 PolarHBondContact O-N 2.98Å; E283-V286 PolarHBondContact O-N 3.46Å; E283-L287 VanDerWaalsContact O-CB 3.28Å; E283-L287 WeakPolarHBondContact O-CB 3.29Å; E283-L287 PolarHBondContact O-N 2.9Å
284	A	91.4	Very high	90.8	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-64.3	-39.5	173	0	0	0	0	0	112.1	V272 L275 H280 I281 D282 S288 L300	V272-A284 HydrophobicContact CG1-CB 4.29Å; L275-A284 HydrophobicContact CB-CB 3.76Å; L275-A284 HydrophobicContact CD1-CB 4.03Å; H280-A284 PolarHBondContact O-N 3.05Å; H280-A284 VanDerWaalsContact O-N 3.14Å; I281-A284 CarbonylContact O-C 3.6Å; I281-A284 WeakPolarHBondContact O-CA 3.21Å; I281-A284 VanDerWaalsContact O-CB 3.3Å; I281-A284 WeakPolarHBondContact O-CB 3.48Å; I281-A284 PolarHBondContact O-N 2.91Å; I281-A284 VanDerWaalsContact O-N 3.12Å; D282-A284 VanDerWaalsContact C-N 3.31Å; A284-S288 WeakPolarHBondContact O-CB 2.91Å; A284-S288 PolarHBondContact O-N 3.05Å; A284-S288 PolarHBondContact O-OG 3.32Å; A284-L300 HydrophobicContact CB-CD1 3.96Å
285	I	92.4	Very high	90.8	Very high	10 Å²	10	40.6 Å²	40.6	5%	0.051	21%	0.206	C	C	.	.	H	α-helix	trans	-63.2	-49.4	173.9	-69.1	164.6	0	0	0	109.8	I281 D282 L287 S288 Q289 A297 L300 A301	I281-I285 HydrophobicContact CG2-CD1 4.13Å; I281-I285 HydrophobicContact CG2-CG1 4.42Å; I281-I285 WeakPolarHBondContact O-CG1 3.45Å; I281-I285 PolarHBondContact O-N 3.2Å; D282-I285 WeakPolarHBondContact O-CB 3.3Å; D282-I285 PolarHBondContact O-N 3.49Å; I285-L287 PolarHBondContact O-N 3.35Å; I285-S288 WeakPolarHBondContact O-CB 3.25Å; I285-S288 PolarHBondContact O-N 3.04Å; I285-Q289 WeakPolarHBondContact O-CG 3.35Å; I285-Q289 PolarHBondContact O-N 2.95Å; I285-A297 HydrophobicContact CG2-CB 4.24Å; I285-L300 HydrophobicContact CD1-CB 4.26Å; I285-L300 HydrophobicContact CG1-CB 3.52Å; I285-L300 HydrophobicContact CG1-CD1 4.29Å; I285-A301 HydrophobicContact CD1-CB 4.11Å
286	V	90.8	Very high	90.9	Very high	52 Å²	52	40.4 Å²	40.4	32%	0.315	21%	0.205	S	C	.	.	H	α-helix	trans	-62.3	-43.3	179	171.6	0	0	0	0	111.4	D282 E283 S288 Q289 R290	D282-V286 WeakPolarHBondContact O-CG2 3.35Å; D282-V286 PolarHBondContact O-N 3.16Å; E283-V286 PolarHBondContact O-N 3.46Å; V286-S288 VanDerWaalsContact C-N 3.34Å; V286-S288 PolarHBondContact O-N 3.38Å; V286-Q289 PolarHBondContact O-N 3.21Å; V286-R290 HydrophobicContact CG1-CG 4.48Å; V286-R290 WeakPolarHBondContact O-CB 3.43Å; V286-R290 WeakPolarHBondContact O-CG 3.41Å; V286-R290 PolarHBondContact O-N 3.21Å
287	L	90.1	Very high	90.9	Very high	16 Å²	16	40.5 Å²	40.5	8%	0.084	21%	0.206	C	C	.	.	H	α-helix	trans	-57.4	-49	174.1	176	60.6	0	0	0	110.6	F215 T271 V272 L275 E283 I285 Q289 R290 Q291	F215-L287 HydrophobicContact CD1-CD1 4.26Å; F215-L287 HydrophobicContact CE1-CB 3.81Å; F215-L287 HydrophobicContact CE1-CD1 3.76Å; F215-L287 HydrophobicContact CE1-CG 4.33Å; F215-L287 HydrophobicContact CZ-CB 4.39Å; T271-L287 HydrophobicContact CG2-CD2 3.5Å; V272-L287 HydrophobicContact CG2-CD2 3.92Å; L275-L287 HydrophobicContact CD1-CB 4.32Å; L275-L287 HydrophobicContact CD1-CD2 3.75Å; E283-L287 VanDerWaalsContact O-CB 3.28Å; E283-L287 WeakPolarHBondContact O-CB 3.29Å; E283-L287 PolarHBondContact O-N 2.9Å; I285-L287 PolarHBondContact O-N 3.35Å; L287-Q289 VanDerWaalsContact C-N 3.32Å; L287-Q289 PolarHBondContact O-N 3.15Å; L287-R290 PolarHBondContact O-N 3.32Å; L287-Q291 HydrophobicContact CD1-CG 3.95Å; L287-Q291 HydrophobicContact CG-CG 4.43Å; L287-Q291 WeakPolarHBondContact O-CB 3.41Å; L287-Q291 VanDerWaalsContact O-CG 3.3Å; L287-Q291 WeakPolarHBondContact O-CG 3.43Å; L287-Q291 PolarHBondContact O-N 2.93Å
288	S	92.5	Very high	90.9	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-60	-42.5	179.7	-60.8	0	0	0	0	111.6	A284 I285 V286 Q291 G292 S293 L296 L300	A284-S288 WeakPolarHBondContact O-CB 2.91Å; A284-S288 PolarHBondContact O-N 3.05Å; A284-S288 PolarHBondContact O-OG 3.32Å; I285-S288 WeakPolarHBondContact O-CB 3.25Å; I285-S288 PolarHBondContact O-N 3.04Å; V286-S288 VanDerWaalsContact C-N 3.34Å; V286-S288 PolarHBondContact O-N 3.38Å; S288-Q291 PolarHBondContact O-N 3.08Å; S288-G292 PolarHBondContact O-N 2.84Å; S288-S293 CarbonylContact O-C 3.56Å; S288-S293 WeakPolarHBondContact O-CA 3.4Å; S288-S293 WeakPolarHBondContact O-CB 3.46Å; S288-S293 PolarHBondContact O-N 3.39Å; S288-L296 WeakPolarHBondContact OG-CD2 3.31Å; S288-L300 WeakPolarHBondContact OG-CD1 3.29Å
289	Q	91.7	Very high	91	Very high	109 Å²	109	44.4 Å²	44.4	51%	0.509	24%	0.237	S	C	.	.	H	α-helix	trans	-62.7	-44.3	175	-70.4	171.6	-9	0	0	112.2	I285 V286 L287 Q291 G292 A297	I285-Q289 WeakPolarHBondContact O-CG 3.35Å; I285-Q289 PolarHBondContact O-N 2.95Å; V286-Q289 PolarHBondContact O-N 3.21Å; L287-Q289 VanDerWaalsContact C-N 3.32Å; L287-Q289 PolarHBondContact O-N 3.15Å; Q289-Q291 VanDerWaalsContact C-N 3.3Å; Q289-Q291 PolarHBondContact O-N 2.96Å; Q289-G292 PolarHBondContact O-N 3.36Å; Q289-A297 HydrophobicContact CG-CB 3.66Å
290	R	88.7	Confident	91.2	Very high	109 Å²	109	42.9 Å²	42.9	41%	0.411	22%	0.22	S	C	.	.	H	α-helix	trans	-68.2	-26.8	178.6	-74.7	178.2	166.6	161.2	-7.3	113.5	I219 V286 L287 G292	I219-R290 WeakPolarHBondContact CG2-O 3.35Å; V286-R290 HydrophobicContact CG1-CG 4.48Å; V286-R290 WeakPolarHBondContact O-CB 3.43Å; V286-R290 WeakPolarHBondContact O-CG 3.41Å; V286-R290 PolarHBondContact O-N 3.21Å; L287-R290 PolarHBondContact O-N 3.32Å; R290-G292 VanDerWaalsContact C-N 3.25Å
291	Q	89.5	Confident	91.2	Very high	33 Å²	33	41.8 Å²	41.8	15%	0.154	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.7	1.1	172.7	-65.5	-69.7	-28.9	0	0	112.3	D220 F221 L222 K264 V268 L287 S288 Q289 S293	D220-Q291 PolarHBondContact O-OE1 3.02Å; F221-Q291 CarbonylContact C-O 3.51Å; F221-Q291 WeakPolarHBondContact CA-O 3.42Å; L222-Q291 HydrophobicContact CG-CB 4.42Å; L222-Q291 PolarHBondContact N-O 3.49Å; K264-Q291 VanDerWaalsContact CE-OE1 3.27Å; V268-Q291 HydrophobicContact CG1-CB 4.36Å; V268-Q291 HydrophobicContact CG1-CG 4.07Å; V268-Q291 HydrophobicContact CG2-CG 3.86Å; L287-Q291 HydrophobicContact CD1-CG 3.95Å; L287-Q291 HydrophobicContact CG-CG 4.43Å; L287-Q291 WeakPolarHBondContact O-CB 3.41Å; L287-Q291 VanDerWaalsContact O-CG 3.3Å; L287-Q291 WeakPolarHBondContact O-CG 3.43Å; L287-Q291 PolarHBondContact O-N 2.93Å; S288-Q291 PolarHBondContact O-N 3.08Å; Q289-Q291 VanDerWaalsContact C-N 3.3Å; Q289-Q291 PolarHBondContact O-N 2.96Å; Q291-S293 PolarHBondContact O-N 3.02Å
292	G	87.4	Confident	91.1	Very high	27 Å²	27	41.3 Å²	41.3	28%	0.278	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	78.7	2	-178	0	0	0	0	0	115.3	F221 S288 Q289 R290 Q294	F221-G292 VanDerWaalsContact CD1-CA 3.43Å; S288-G292 PolarHBondContact O-N 2.84Å; Q289-G292 PolarHBondContact O-N 3.36Å; R290-G292 VanDerWaalsContact C-N 3.25Å; G292-Q294 PolarHBondContact O-N 3.39Å
293	S	90	Very high	90.9	Very high	1 Å²	1	37.5 Å²	37.5	1%	0.007	20%	0.201	C	C	.	.			trans	-82.3	58.5	-178	-39.7	0	0	0	0	110.4	L222 S288 Q291 W295 L296 A297	L222-S293 WeakPolarHBondContact CD1-OG 3.41Å; S288-S293 CarbonylContact O-C 3.56Å; S288-S293 WeakPolarHBondContact O-CA 3.4Å; S288-S293 WeakPolarHBondContact O-CB 3.46Å; S288-S293 PolarHBondContact O-N 3.39Å; Q291-S293 PolarHBondContact O-N 3.02Å; S293-W295 PolarHBondContact O-N 2.83Å; S293-L296 WeakPolarHBondContact O-CB 3.5Å; S293-L296 PolarHBondContact O-N 3.24Å; S293-A297 PolarHBondContact O-N 3.21Å
294	Q	91.5	Very high	90.7	Very high	151 Å²	151	37.7 Å²	37.7	71%	0.706	20%	0.2	S	C	*	.	H	α-helix	trans	-58.3	-33.4	-177.4	-68	-175.8	0.3	0	0	112.5	G292 A297 A298	G292-Q294 PolarHBondContact O-N 3.39Å; Q294-A297 PolarHBondContact O-N 3.02Å; Q294-A298 WeakPolarHBondContact O-CB 3.18Å; Q294-A298 PolarHBondContact O-N 3.4Å
295	W	93.3	Very high	90.3	Very high	61 Å²	61	37.9 Å²	37.9	23%	0.231	20%	0.201	C	C	.	.	H	α-helix	trans	-60.5	-44.5	174.2	63.3	-93.3	0	0	0	111.7	P247 F269 S293 A298 I299 Y352	P247-W295 HydrophobicContact CB-CD2 3.66Å; P247-W295 HydrophobicContact CB-CE3 4.14Å; P247-W295 HydrophobicContact CB-CG 3.9Å; P247-W295 HydrophobicContact CB-CZ2 4.13Å; P247-W295 HydrophobicContact CG-CB 3.93Å; P247-W295 HydrophobicContact CG-CD2 3.85Å; P247-W295 HydrophobicContact CG-CE3 4.34Å; P247-W295 HydrophobicContact CG-CG 3.64Å; F269-W295 AromaticContact CE1-CH2 3.7Å; F269-W295 HydrophobicContact CE1-CH2 3.7Å; F269-W295 HydrophobicContact CE1-CZ2 4.02Å; F269-W295 AromaticContact CZ-CH2 3.7Å; F269-W295 HydrophobicContact CZ-CH2 3.7Å; F269-W295 HydrophobicContact CZ-CZ2 4.03Å; S293-W295 PolarHBondContact O-N 2.83Å; W295-A298 PolarHBondContact O-N 3.25Å; W295-I299 HydrophobicContact CE3-CD1 3.68Å; W295-I299 HydrophobicContact CZ3-CD1 4.02Å; W295-I299 VanDerWaalsContact O-CG1 3.29Å; W295-I299 WeakPolarHBondContact O-CG1 3.21Å; W295-I299 PolarHBondContact O-N 3.37Å; W295-Y352 WeakPolarHBondContact CZ3-OH 3.31Å
296	L	94.5	Very high	89.5	Confident	1 Å²	1	37.7 Å²	37.7	1%	0.005	20%	0.2	C	C	.	.	H	α-helix	trans	-68.5	-41.8	177.9	-178.1	61.6	0	0	0	110.7	F269 V272 S288 S293 A298 I299 L300 I351	F269-L296 HydrophobicContact CD1-CD2 4.06Å; F269-L296 HydrophobicContact CE1-CD2 3.98Å; V272-L296 HydrophobicContact CG1-CD2 4.32Å; V272-L296 HydrophobicContact CG2-CD2 4.06Å; S288-L296 WeakPolarHBondContact OG-CD2 3.31Å; S293-L296 WeakPolarHBondContact O-CB 3.5Å; S293-L296 PolarHBondContact O-N 3.24Å; L296-A298 VanDerWaalsContact C-N 3.29Å; L296-A298 PolarHBondContact O-N 2.84Å; L296-I299 PolarHBondContact O-N 3.14Å; L296-L300 HydrophobicContact CD1-CG 4.42Å; L296-L300 HydrophobicContact CG-CD1 4.09Å; L296-L300 HydrophobicContact CG-CG 4.46Å; L296-L300 WeakPolarHBondContact O-CB 3.43Å; L296-L300 VanDerWaalsContact O-CG 3.27Å; L296-L300 WeakPolarHBondContact O-CG 3.27Å; L296-L300 PolarHBondContact O-N 3.36Å; L296-I351 HydrophobicContact CD1-CG2 4.35Å
297	A	94	Very high	88.5	Confident	6 Å²	6	36.7 Å²	36.7	5%	0.05	19%	0.191	C	C	.	.	H	α-helix	trans	-58.3	-41.2	174.1	0	0	0	0	0	112	I285 Q289 S293 Q294 A301	I285-A297 HydrophobicContact CG2-CB 4.24Å; Q289-A297 HydrophobicContact CG-CB 3.66Å; S293-A297 PolarHBondContact O-N 3.21Å; Q294-A297 PolarHBondContact O-N 3.02Å; A297-A301 VanDerWaalsContact O-CB 3.29Å; A297-A301 WeakPolarHBondContact O-CB 3.34Å; A297-A301 PolarHBondContact O-N 3.49Å
298	A	92.9	Very high	87	Confident	64 Å²	64	39 Å²	39	53%	0.529	21%	0.208	S	C	.	.	H	α-helix	trans	-66.3	-42.2	176.6	0	0	0	0	0	112.1	Q294 W295 L296 A301 G302	Q294-A298 WeakPolarHBondContact O-CB 3.18Å; Q294-A298 PolarHBondContact O-N 3.4Å; W295-A298 PolarHBondContact O-N 3.25Å; L296-A298 VanDerWaalsContact C-N 3.29Å; L296-A298 PolarHBondContact O-N 2.84Å; A298-A301 PolarHBondContact O-N 3.32Å; A298-G302 PolarHBondContact O-N 3.4Å
299	I	93.4	Very high	85.2	Confident	42 Å²	42	43.7 Å²	43.7	22%	0.215	23%	0.232	C	C	.	.	H	α-helix	trans	-61.4	-46.7	175.8	-69.5	164.7	0	0	0	110.8	W295 L296 G302 G303 Y331 Y352 L355	W295-I299 HydrophobicContact CE3-CD1 3.68Å; W295-I299 HydrophobicContact CZ3-CD1 4.02Å; W295-I299 VanDerWaalsContact O-CG1 3.29Å; W295-I299 WeakPolarHBondContact O-CG1 3.21Å; W295-I299 PolarHBondContact O-N 3.37Å; L296-I299 PolarHBondContact O-N 3.14Å; I299-G302 PolarHBondContact O-N 3.03Å; I299-G303 PolarHBondContact O-N 3.4Å; I299-Y331 WeakPolarHBondContact O-CE2 3.44Å; I299-Y331 PolarHBondContact O-OH 3.26Å; I299-Y352 HydrophobicContact CD1-CE1 4Å; I299-Y352 HydrophobicContact CG2-CD1 4.43Å; I299-Y352 HydrophobicContact CG2-CE1 3.9Å; I299-L355 HydrophobicContact CG2-CD1 3.93Å
300	L	93.5	Very high	83.2	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-62.8	-41.7	177.1	-68.7	168.6	0	0	0	111.5	V272 I276 I281 A284 I285 S288 L296 G303 I351 L355	V272-L300 HydrophobicContact CG1-CD1 4Å; V272-L300 HydrophobicContact CG1-CD2 4.23Å; I276-L300 HydrophobicContact CD1-CD2 3.8Å; I276-L300 HydrophobicContact CG1-CD2 4.25Å; I281-L300 HydrophobicContact CG2-CB 4.45Å; A284-L300 HydrophobicContact CB-CD1 3.96Å; I285-L300 HydrophobicContact CD1-CB 4.26Å; I285-L300 HydrophobicContact CG1-CB 3.52Å; I285-L300 HydrophobicContact CG1-CD1 4.29Å; S288-L300 WeakPolarHBondContact OG-CD1 3.29Å; L296-L300 HydrophobicContact CD1-CG 4.42Å; L296-L300 HydrophobicContact CG-CD1 4.09Å; L296-L300 HydrophobicContact CG-CG 4.46Å; L296-L300 WeakPolarHBondContact O-CB 3.43Å; L296-L300 VanDerWaalsContact O-CG 3.27Å; L296-L300 WeakPolarHBondContact O-CG 3.27Å; L296-L300 PolarHBondContact O-N 3.36Å; L300-G303 WeakPolarHBondContact O-CA 3.34Å; L300-G303 PolarHBondContact O-N 2.83Å; L300-I351 HydrophobicContact CD2-CG2 4.38Å; L300-L355 HydrophobicContact CD2-CD1 4.12Å; L300-L355 HydrophobicContact CD2-CD2 4.3Å
301	A	90.3	Very high	81	Confident	32 Å²	32	42.8 Å²	42.8	26%	0.264	25%	0.251	S	S	.	.	H	α-helix	trans	-65.9	-37.2	177.2	0	0	0	0	0	112.8	I285 A297 A298 G303 R304	I285-A301 HydrophobicContact CD1-CB 4.11Å; A297-A301 VanDerWaalsContact O-CB 3.29Å; A297-A301 WeakPolarHBondContact O-CB 3.34Å; A297-A301 PolarHBondContact O-N 3.49Å; A298-A301 PolarHBondContact O-N 3.32Å; A301-G303 PolarHBondContact O-N 3.23Å; A301-R304 WeakPolarHBondContact O-CB 3.34Å; A301-R304 WeakPolarHBondContact O-CG 3.38Å; A301-R304 PolarHBondContact O-N 3Å; A301-R304 VanDerWaalsContact O-N 3.11Å
302	G	87.4	Confident	78.4	Confident	13 Å²	13	46.4 Å²	46.4	13%	0.134	28%	0.28	C	S	.	.	H	α-helix	trans	-63.2	-18.3	171.5	0	0	0	0	0	113.1	A298 I299 R304 Y331	A298-G302 PolarHBondContact O-N 3.4Å; I299-G302 PolarHBondContact O-N 3.03Å; G302-R304 PolarHBondContact O-N 3.45Å; G302-Y331 VanDerWaalsContact C-CE2 3.41Å
303	G	84.9	Confident	76.2	Confident	1 Å²	1	52.8 Å²	52.8	1%	0.01	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-17.6	172.2	0	0	0	0	0	114	F9 I299 L300 A301 R328 Y331	F9-G303 VanDerWaalsContact CD1-O 3.25Å; F9-G303 WeakPolarHBondContact CD1-O 3.16Å; I299-G303 PolarHBondContact O-N 3.4Å; L300-G303 WeakPolarHBondContact O-CA 3.34Å; L300-G303 PolarHBondContact O-N 2.83Å; A301-G303 PolarHBondContact O-N 3.23Å; G303-R328 VanDerWaalsContact C-NH1 3.33Å; G303-R328 PolarHBondContact O-NH1 2.94Å; G303-Y331 VanDerWaalsContact CA-OH 3.28Å; G303-Y331 WeakPolarHBondContact CA-OH 3.45Å; G303-Y331 PolarHBondContact N-OH 3.05Å
304	R	84.6	Confident	73.7	Confident	64 Å²	64	56.7 Å²	56.7	24%	0.242	34%	0.335	C	S	.	.	S	Bend	trans	-73.1	149.5	177.1	-62.1	179.5	-176.6	155	-0.5	111.2	D282 A301 G302 G324	D282-R304 IonicContact OD1-CZ 2.69Å; D282-R304 IonicContact OD1-NE 3.04Å; D282-R304 IonicContact OD1-NH2 3.92Å; D282-R304 PolarHBondContact OD1-NH2 3.25Å; A301-R304 WeakPolarHBondContact O-CB 3.34Å; A301-R304 WeakPolarHBondContact O-CG 3.38Å; A301-R304 PolarHBondContact O-N 3Å; A301-R304 VanDerWaalsContact O-N 3.11Å; G302-R304 PolarHBondContact O-N 3.45Å; R304-G324 WeakPolarHBondContact O-CA 3.3Å
305	L	82.6	Confident	71.5	Confident	3 Å²	3	57.6 Å²	57.6	2%	0.016	34%	0.343	C	S	.	.	B	Isolated β-bridge	trans	-74.4	139.9	175.1	-62.5	-177.1	0	0	0	111.2	F9 D175 F179 R328 F385	F9-L305 HydrophobicContact CB-CG 4.32Å; F9-L305 WeakPolarHBondContact O-CD1 3.42Å; F9-L305 WeakPolarHBondContact O-CG 3.48Å; D175-L305 HydrophobicContact CB-CD2 4.5Å; F179-L305 HydrophobicContact CB-CD1 3.49Å; F179-L305 VanDerWaalsContact CB-CD1 3.49Å; F179-L305 HydrophobicContact CD1-CD1 4.12Å; F179-L305 HydrophobicContact CD2-CD1 3.86Å; F179-L305 HydrophobicContact CG-CD1 3.58Å; L305-R328 HydrophobicContact CD2-CG 4.45Å; L305-F385 HydrophobicContact CD1-CE1 4.44Å; L305-F385 HydrophobicContact CD1-CZ 4.19Å; L305-F385 HydrophobicContact CD2-CD1 4.45Å; L305-F385 HydrophobicContact CD2-CE1 3.39Å; L305-F385 HydrophobicContact CD2-CZ 3.75Å
306	S	76.7	Confident	69.3	Low	6 Å²	6	58.7 Å²	58.7	4%	0.042	35%	0.353	C	S	.	.	P	Polyproline II helix	trans	-56.1	135.2	175.3	-178.7	0	0	0	0	111.7	T174 S176 E323 D325 M326	T174-S306 VanDerWaalsContact CB-O 3.3Å; T174-S306 WeakPolarHBondContact CB-O 3.27Å; T174-S306 PolarHBondContact OG1-O 3.32Å; S176-S306 WeakPolarHBondContact CB-O 3.39Å; S176-S306 PolarHBondContact N-O 3.4Å; S176-S306 VanDerWaalsContact N-O 3.14Å; S306-E323 WeakPolarHBondContact CA-O 3.48Å; S306-D325 WeakPolarHBondContact CB-O 3.36Å; S306-M326 PolarHBondContact OG-SD 3.32Å
307	R	69.3	Low	66.7	Low	31 Å²	31	67.8 Å²	67.8	12%	0.117	40%	0.395	C	S	.	.			trans	-132.5	146.7	172.7	-71.5	-176.9	167.1	-147.9	0.4	111.5	G10 S11 S176 N322 E323	G10-R307 PolarHBondContact O-NE 3.47Å; G10-R307 PolarHBondContact O-NH2 2.82Å; S11-R307 VanDerWaalsContact CB-NH2 3.26Å; S11-R307 PolarHBondContact OG-NH1 3.37Å; S11-R307 PolarHBondContact OG-NH2 2.79Å; S176-R307 PolarHBondContact OG-NE 3.37Å; S176-R307 VanDerWaalsContact OG-NE 3.08Å; S176-R307 PolarHBondContact OG-NH2 3.36Å; R307-N322 PolarHBondContact O-OD1 3.25Å; R307-E323 PolarHBondContact N-O 3.39Å
308	S	57.6	Low	64.3	Low	65 Å²	65	73.2 Å²	73.2	46%	0.455	42%	0.423	S	S	.	.			trans	-112	133.1	178.1	178.9	0	0	0	0	110	D310	S308-D310 PolarHBondContact O-N 3.14Å; S308-D310 PolarHBondContact OG-N 3.36Å
309	I	54.4	Low	61.8	Low	98 Å²	98	72 Å²	72	50%	0.503	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-25.8	174.2	-67.6	158.1	0	0	0	111.8	N322	I309-N322 WeakPolarHBondContact CD1-OD1 3.31Å; I309-N322 VanDerWaalsContact CG1-OD1 3.28Å; I309-N322 WeakPolarHBondContact CG1-OD1 3.44Å; I309-N322 PolarHBondContact N-OD1 3.46Å
310	D	49.7	Very low	59.6	Low	149 Å²	149	77.2 Å²	77.2	80%	0.797	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103	6.6	-161.7	-59.5	-26.5	0	0	0	114.3	S308	S308-D310 PolarHBondContact O-N 3.14Å; S308-D310 PolarHBondContact OG-N 3.36Å
311	G	43.3	Very low	57.8	Low	51 Å²	51	80.2 Å²	80.2	53%	0.526	46%	0.461	S	S	.	.			trans	-98.8	111.7	-174.5	0	0	0	0	0	114.2
312	S	35.4	Very low	56.3	Low	109 Å²	109	83.6 Å²	83.6	76%	0.762	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.5	132.1	175.5	50.3	0	0	0	0	115
313	N	40.7	Very low	55.3	Low	161 Å²	161	84.4 Å²	84.4	86%	0.861	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	107.7	6.3	164.8	-67.5	-9.8	0	0	0	120.1	I315	N313-I315 PolarHBondContact O-N 3.39Å
314	S	38.1	Very low	54.3	Low	82 Å²	82	85.8 Å²	85.8	57%	0.573	49%	0.489	S	S	*	.			trans	-81.8	120.6	169.9	94.6	0	0	0	0	111.5	I316	S314-I316 PolarHBondContact O-N 3.48Å
315	I	44.6	Very low	53.5	Low	170 Å²	170	85.7 Å²	85.7	87%	0.872	49%	0.493	S	S	*	.			trans	-69.1	12.7	179.4	-66.3	164.6	0	0	0	112.3	N313 E317	N313-I315 PolarHBondContact O-N 3.39Å; I315-E317 PolarHBondContact O-N 2.85Å
316	I	47.8	Very low	53	Low	84 Å²	84	92.6 Å²	92.6	43%	0.431	53%	0.527	S	S	.	.			trans	-102.4	90	-171.4	-51.6	178.4	0	0	0	109.3	S314 N318	S314-I316 PolarHBondContact O-N 3.48Å; I316-N318 PolarHBondContact O-N 3.26Å
317	E	39.4	Very low	53.3	Low	192 Å²	192	95.7 Å²	95.7	90%	0.897	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	9.2	-176.8	-86.7	-173.1	157.3	0	0	116.8	I315	I315-E317 PolarHBondContact O-N 2.85Å
318	N	42.7	Very low	54.3	Low	120 Å²	120	94.4 Å²	94.4	64%	0.642	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-137.6	20.4	-171	-76.3	-43.1	0	0	0	116.9	I316 I320	I316-N318 PolarHBondContact O-N 3.26Å; N318-I320 PolarHBondContact O-N 3.36Å
319	A	42.4	Very low	55.8	Low	38 Å²	38	95.9 Å²	95.9	31%	0.314	53%	0.534	S	S	.	.			trans	-88	92.5	176.6	0	0	0	0	0	113.5	I12	I12-A319 VanDerWaalsContact CD1-CA 3.42Å; I12-A319 HydrophobicContact CD1-CB 3.37Å
320	I	46.7	Very low	57.6	Low	152 Å²	152	95.4 Å²	95.4	78%	0.779	53%	0.532	S	S	*	.			trans	-88.5	-3.1	-173.3	-58.9	172.2	0	0	0	113.3	N318	N318-I320 PolarHBondContact O-N 3.36Å
321	S	54.4	Low	59.6	Low	63 Å²	63	89 Å²	89	44%	0.441	50%	0.497	S	S	.	.	S	Bend	trans	-145.4	141.6	-178.3	52.2	0	0	0	0	114.1	E323	S321-E323 PolarHBondContact O-N 3.26Å
322	N	58.7	Low	62	Low	103 Å²	103	87 Å²	87	55%	0.551	48%	0.475	S	S	*	.			trans	-59.6	123.6	162.4	-68.9	-18.8	0	0	0	108.4	R307 I309	R307-N322 PolarHBondContact O-OD1 3.25Å; I309-N322 WeakPolarHBondContact CD1-OD1 3.31Å; I309-N322 VanDerWaalsContact CG1-OD1 3.28Å; I309-N322 WeakPolarHBondContact CG1-OD1 3.44Å; I309-N322 PolarHBondContact N-OD1 3.46Å
323	E	66.4	Low	64.8	Low	30 Å²	30	89.2 Å²	89.2	14%	0.14	47%	0.47	C	S	.	.			trans	-117.2	157	179.6	-69.2	-177	179.2	0	0	110.2	S306 R307 S321	S306-E323 WeakPolarHBondContact CA-O 3.48Å; R307-E323 PolarHBondContact N-O 3.39Å; S321-E323 PolarHBondContact O-N 3.26Å
324	G	63.8	Low	67.4	Low	30 Å²	30	85.9 Å²	85.9	31%	0.309	45%	0.452	S	S	.	.	S	Bend	trans	87.4	168.5	173	0	0	0	0	0	115.8	R304	R304-G324 WeakPolarHBondContact O-CA 3.3Å
325	D	69.7	Low	70.1	Confident	62 Å²	62	82.2 Å²	82.2	33%	0.332	43%	0.426	S	S	.	.	B	Isolated β-bridge	trans	-76.8	138.7	169.5	-161.5	-45.1	0	0	0	109.7	S306 D327	S306-D325 WeakPolarHBondContact CB-O 3.36Å; D325-D327 VanDerWaalsContact C-N 3.28Å; D325-D327 PolarHBondContact O-N 3.32Å; D325-D327 PolarHBondContact OD1-N 3.47Å
326	M	71.9	Confident	72.5	Confident	148 Å²	148	76.6 Å²	76.6	73%	0.729	40%	0.397	S	S	*	.	S	Bend	trans	-72.3	-22.1	178.2	-67.9	-59.1	-65.2	0	0	112.8	S306	S306-M326 PolarHBondContact OG-SD 3.32Å
327	D	83	Confident	74.8	Confident	72 Å²	72	76.5 Å²	76.5	39%	0.385	40%	0.403	S	S	.	.			trans	-121.3	81	175	-169.9	-14.6	0	0	0	110.3	D325 R329 L330 Y331	D325-D327 VanDerWaalsContact C-N 3.28Å; D325-D327 PolarHBondContact O-N 3.32Å; D325-D327 PolarHBondContact OD1-N 3.47Å; D327-R329 PolarHBondContact O-N 3.38Å; D327-R329 VanDerWaalsContact O-N 3.15Å; D327-R329 WeakPolarHBondContact OD1-CB 3.49Å; D327-R329 PolarHBondContact OD1-N 3.36Å; D327-L330 HydrophobicContact CB-CB 4Å; D327-L330 VanDerWaalsContact CG-CB 3.48Å; D327-L330 PolarHBondContact O-N 3.35Å; D327-L330 VanDerWaalsContact O-N 3.12Å; D327-L330 PolarHBondContact OD1-N 3.4Å; D327-Y331 PolarHBondContact O-N 3.17Å
328	R	88.6	Confident	77.5	Confident	3 Å²	3	69.6 Å²	69.6	1%	0.011	37%	0.374	C	S	.	.	H	α-helix	trans	-55.7	-31.4	177	179.5	57.1	-179.4	-160.8	-4.8	113	D175 G303 L305 N332 E382 F385 I386 L389	D175-R328 WeakPolarHBondContact OD2-CB 3.17Å; G303-R328 VanDerWaalsContact C-NH1 3.33Å; G303-R328 PolarHBondContact O-NH1 2.94Å; L305-R328 HydrophobicContact CD2-CG 4.45Å; R328-N332 VanDerWaalsContact O-CB 3.27Å; R328-N332 WeakPolarHBondContact O-CB 3.34Å; R328-N332 PolarHBondContact O-N 3.38Å; R328-E382 IonicContact CZ-OE1 2.76Å; R328-E382 IonicContact CZ-OE2 3.45Å; R328-E382 IonicContact NE-OE1 2.65Å; R328-E382 PolarHBondContact NE-OE1 2.94Å; R328-E382 VanDerWaalsContact NE-OE1 3.09Å; R328-E382 IonicContact NH2-OE1 2.85Å; R328-E382 PolarHBondContact NH2-OE1 3.15Å; R328-E382 IonicContact NH2-OE2 3.51Å; R328-E382 PolarHBondContact NH2-OE2 2.83Å; R328-F385 HydrophobicContact CG-CE1 4.05Å; R328-I386 HydrophobicContact CG-CD1 3.8Å; R328-L389 HydrophobicContact CB-CD1 4.24Å; R328-L389 HydrophobicContact CG-CD1 4.13Å
329	R	90.4	Very high	80	Confident	96 Å²	96	63.9 Å²	63.9	36%	0.362	34%	0.343	S	S	.	.	H	α-helix	trans	-68.5	-43.1	179.5	-64.7	167.2	56.8	-150.5	-6.8	110.9	D327 K333 L389 T390	D327-R329 PolarHBondContact O-N 3.38Å; D327-R329 VanDerWaalsContact O-N 3.15Å; D327-R329 WeakPolarHBondContact OD1-CB 3.49Å; D327-R329 PolarHBondContact OD1-N 3.36Å; R329-K333 WeakPolarHBondContact O-CB 3.35Å; R329-K333 PolarHBondContact O-N 3.36Å; R329-K333 VanDerWaalsContact O-N 3.09Å; R329-L389 HydrophobicContact CG-CB 4.45Å; R329-T390 PolarHBondContact NE-OG1 3.22Å; R329-T390 VanDerWaalsContact NE-OG1 3.16Å
330	L	91.8	Very high	82.5	Confident	88 Å²	88	67.5 Å²	67.5	46%	0.461	35%	0.352	S	S	.	.	H	α-helix	trans	-66.2	-46.6	175.3	-179	60.5	0	0	0	111.3	D327 N332 K333 I334	D327-L330 HydrophobicContact CB-CB 4Å; D327-L330 VanDerWaalsContact CG-CB 3.48Å; D327-L330 PolarHBondContact O-N 3.35Å; D327-L330 VanDerWaalsContact O-N 3.12Å; D327-L330 PolarHBondContact OD1-N 3.4Å; L330-N332 VanDerWaalsContact C-N 3.35Å; L330-N332 PolarHBondContact O-N 3.25Å; L330-K333 PolarHBondContact O-N 3.05Å; L330-I334 HydrophobicContact CD1-CD1 3.95Å; L330-I334 HydrophobicContact CD1-CG1 4.2Å; L330-I334 HydrophobicContact CG-CD1 3.88Å; L330-I334 WeakPolarHBondContact O-CG1 3.38Å; L330-I334 PolarHBondContact O-N 2.82Å
331	Y	92.5	Very high	84.8	Confident	14 Å²	14	64.5 Å²	64.5	6%	0.055	34%	0.335	C	S	.	.	H	α-helix	trans	-53.3	-51.2	175.9	173	-91.1	0	0	0	111.8	I299 G302 G303 D327 K333 I334 C335	I299-Y331 WeakPolarHBondContact O-CE2 3.44Å; I299-Y331 PolarHBondContact O-OH 3.26Å; G302-Y331 VanDerWaalsContact C-CE2 3.41Å; G303-Y331 VanDerWaalsContact CA-OH 3.28Å; G303-Y331 WeakPolarHBondContact CA-OH 3.45Å; G303-Y331 PolarHBondContact N-OH 3.05Å; D327-Y331 PolarHBondContact O-N 3.17Å; Y331-K333 PolarHBondContact O-N 2.66Å; Y331-I334 PolarHBondContact O-N 2.85Å; Y331-C335 VanDerWaalsContact CZ-SG 3.57Å; Y331-C335 PolarHBondContact O-N 3.44Å; Y331-C335 PolarHBondContact O-SG 3.05Å
332	N	92.8	Very high	86.5	Confident	11 Å²	11	65.2 Å²	65.2	6%	0.059	35%	0.345	C	S	.	.	H	α-helix	trans	-59.4	-47	179.5	-179.1	-76.2	0	0	0	111.3	R328 L330 I334 C335 M336 S356 E382 I386	R328-N332 VanDerWaalsContact O-CB 3.27Å; R328-N332 WeakPolarHBondContact O-CB 3.34Å; R328-N332 PolarHBondContact O-N 3.38Å; L330-N332 VanDerWaalsContact C-N 3.35Å; L330-N332 PolarHBondContact O-N 3.25Å; N332-I334 VanDerWaalsContact C-N 3.34Å; N332-I334 PolarHBondContact O-N 2.88Å; N332-C335 PolarHBondContact O-N 3.06Å; N332-M336 WeakPolarHBondContact O-CB 3.48Å; N332-M336 PolarHBondContact O-N 3.39Å; N332-S356 WeakPolarHBondContact ND2-CA 3.39Å; N332-S356 PolarHBondContact ND2-O 2.74Å; N332-E382 VanDerWaalsContact ND2-CG 3.28Å; N332-E382 WeakPolarHBondContact ND2-CG 3.34Å; N332-E382 PolarHBondContact ND2-OE1 2.98Å; N332-I386 HydrophobicContact CB-CD1 3.74Å; N332-I386 HydrophobicContact CB-CG1 4.17Å
333	K	94.6	Very high	87.9	Confident	154 Å²	154	64.8 Å²	64.8	67%	0.67	35%	0.346	S	S	*	.	H	α-helix	trans	-60.8	-40.5	179	-175.4	178	179.2	-179.1	0	112.6	R329 L330 Y331 S337	R329-K333 WeakPolarHBondContact O-CB 3.35Å; R329-K333 PolarHBondContact O-N 3.36Å; R329-K333 VanDerWaalsContact O-N 3.09Å; L330-K333 PolarHBondContact O-N 3.05Å; Y331-K333 PolarHBondContact O-N 2.66Å; K333-S337 WeakPolarHBondContact O-CB 3.26Å; K333-S337 PolarHBondContact O-N 3.02Å
334	I	94.8	Very high	89.1	Confident	92 Å²	92	64.1 Å²	64.1	47%	0.472	34%	0.343	S	S	.	.	H	α-helix	trans	-66.9	-52	177.7	-68.1	169.7	0	0	0	109.9	L330 Y331 N332 M336 S337 V338	L330-I334 HydrophobicContact CD1-CD1 3.95Å; L330-I334 HydrophobicContact CD1-CG1 4.2Å; L330-I334 HydrophobicContact CG-CD1 3.88Å; L330-I334 WeakPolarHBondContact O-CG1 3.38Å; L330-I334 PolarHBondContact O-N 2.82Å; Y331-I334 PolarHBondContact O-N 2.85Å; N332-I334 VanDerWaalsContact C-N 3.34Å; N332-I334 PolarHBondContact O-N 2.88Å; I334-M336 VanDerWaalsContact C-N 3.25Å; I334-M336 PolarHBondContact O-N 2.95Å; I334-S337 WeakPolarHBondContact O-CA 3.18Å; I334-S337 WeakPolarHBondContact O-CB 3.3Å; I334-S337 PolarHBondContact O-N 3.17Å; I334-V338 HydrophobicContact CG2-CG2 4.44Å; I334-V338 WeakPolarHBondContact O-CG2 3.21Å; I334-V338 PolarHBondContact O-N 2.74Å
335	C	95	Very high	90.4	Very high	5 Å²	5	64 Å²	64	3%	0.034	34%	0.338	C	S	.	.	H	α-helix	trans	-56.5	-41.7	178.1	-70.1	0	0	0	0	111.5	Y331 N332 S337 V338 A339	Y331-C335 VanDerWaalsContact CZ-SG 3.57Å; Y331-C335 PolarHBondContact O-N 3.44Å; Y331-C335 PolarHBondContact O-SG 3.05Å; N332-C335 PolarHBondContact O-N 3.06Å; C335-S337 PolarHBondContact O-N 3.36Å; C335-V338 PolarHBondContact O-N 3.37Å; C335-A339 WeakPolarHBondContact O-CB 3.5Å; C335-A339 PolarHBondContact O-N 3.3Å
336	M	95.7	Very high	91.6	Very high	52 Å²	52	64.4 Å²	64.4	26%	0.256	34%	0.344	S	S	.	.	H	α-helix	trans	-64.2	-38.2	175.5	-175.9	177.8	-59.1	0	0	112.8	N332 I334 K340 F358	N332-M336 WeakPolarHBondContact O-CB 3.48Å; N332-M336 PolarHBondContact O-N 3.39Å; I334-M336 VanDerWaalsContact C-N 3.25Å; I334-M336 PolarHBondContact O-N 2.95Å; M336-K340 WeakPolarHBondContact O-CG 3.27Å; M336-K340 PolarHBondContact O-N 3.47Å; M336-F358 HydrophobicContact CG-CB 4.05Å; M336-F358 HydrophobicContact CG-CD2 3.98Å; M336-F358 HydrophobicContact CG-CG 4.08Å; M336-F358 HydrophobicContact SD-CD2 4.36Å
337	S	96.2	Very high	92.8	Very high	82 Å²	82	58.6 Å²	58.6	57%	0.573	32%	0.316	S	S	*	.	H	α-helix	trans	-64.6	-41.9	175.7	-168.6	0	0	0	0	111.3	K333 I334 C335 K340	K333-S337 WeakPolarHBondContact O-CB 3.26Å; K333-S337 PolarHBondContact O-N 3.02Å; I334-S337 WeakPolarHBondContact O-CA 3.18Å; I334-S337 WeakPolarHBondContact O-CB 3.3Å; I334-S337 PolarHBondContact O-N 3.17Å; C335-S337 PolarHBondContact O-N 3.36Å; S337-K340 PolarHBondContact O-N 3.26Å
338	V	94.5	Very high	93.3	Very high	46 Å²	46	56 Å²	56	28%	0.279	30%	0.301	S	S	.	.	H	α-helix	trans	-67.8	-42.9	178.1	-179.7	0	0	0	0	110.6	I334 C335 K340 E341 L344 Y352	I334-V338 HydrophobicContact CG2-CG2 4.44Å; I334-V338 WeakPolarHBondContact O-CG2 3.21Å; I334-V338 PolarHBondContact O-N 2.74Å; C335-V338 PolarHBondContact O-N 3.37Å; V338-K340 PolarHBondContact O-N 3.42Å; V338-K340 VanDerWaalsContact O-N 3.08Å; V338-E341 VanDerWaalsContact O-CB 3.26Å; V338-E341 WeakPolarHBondContact O-CB 3.28Å; V338-E341 PolarHBondContact O-N 3.29Å; V338-L344 HydrophobicContact CG1-CD1 3.5Å; V338-L344 VanDerWaalsContact CG1-CD1 3.5Å; V338-L344 VanDerWaalsContact O-CD1 3.31Å; V338-L344 WeakPolarHBondContact O-CD1 3.45Å; V338-Y352 HydrophobicContact CB-CD1 4.34Å; V338-Y352 HydrophobicContact CB-CD2 4.38Å; V338-Y352 HydrophobicContact CB-CG 4.25Å; V338-Y352 HydrophobicContact CG1-CD1 4.13Å; V338-Y352 HydrophobicContact CG1-CD2 3.55Å; V338-Y352 HydrophobicContact CG1-CE1 4.03Å; V338-Y352 HydrophobicContact CG1-CE2 3.45Å; V338-Y352 VanDerWaalsContact CG1-CE2 3.45Å; V338-Y352 HydrophobicContact CG1-CG 3.9Å
339	A	96	Very high	93.8	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-58.9	-25.5	178.3	0	0	0	0	0	114.3	C335 E341 R349 F358 A361	C335-A339 WeakPolarHBondContact O-CB 3.5Å; C335-A339 PolarHBondContact O-N 3.3Å; A339-E341 VanDerWaalsContact C-N 3.34Å; A339-R349 PolarHBondContact O-NE 3.49Å; A339-R349 VanDerWaalsContact O-NE 3.1Å; A339-F358 HydrophobicContact CB-CB 4.38Å; A339-F358 HydrophobicContact CB-CD1 3.74Å; A339-F358 HydrophobicContact CB-CG 4.44Å; A339-A361 HydrophobicContact CB-CB 3.85Å
340	K	96.1	Very high	94.1	Very high	115 Å²	115	53.7 Å²	53.7	50%	0.5	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-16.3	177.1	-72.9	170.9	-176.6	174.8	0	113.6	M336 S337 V338 A342 F358	M336-K340 WeakPolarHBondContact O-CG 3.27Å; M336-K340 PolarHBondContact O-N 3.47Å; S337-K340 PolarHBondContact O-N 3.26Å; V338-K340 PolarHBondContact O-N 3.42Å; V338-K340 VanDerWaalsContact O-N 3.08Å; K340-A342 PolarHBondContact O-N 3.12Å; K340-F358 HydrophobicContact CD-CZ 4.36Å; K340-F358 HydrophobicContact CG-CD1 4.32Å; K340-F358 HydrophobicContact CG-CE1 3.65Å; K340-F358 HydrophobicContact CG-CE2 4.25Å; K340-F358 HydrophobicContact CG-CZ 3.62Å
341	E	93.8	Very high	94.4	Very high	89 Å²	89	49.6 Å²	49.6	42%	0.416	27%	0.271	S	S	.	.			trans	-71.2	110	-177.5	-176.2	49.6	-120.7	0	0	110.2	V338 A339 T343 L344 R349	V338-E341 VanDerWaalsContact O-CB 3.26Å; V338-E341 WeakPolarHBondContact O-CB 3.28Å; V338-E341 PolarHBondContact O-N 3.29Å; A339-E341 VanDerWaalsContact C-N 3.34Å; E341-T343 VanDerWaalsContact CG-OG1 3.25Å; E341-T343 WeakPolarHBondContact CG-OG1 3.15Å; E341-T343 PolarHBondContact O-N 2.93Å; E341-T343 WeakPolarHBondContact OE1-CG2 3.43Å; E341-T343 PolarHBondContact OE1-N 3.35Å; E341-T343 PolarHBondContact OE1-OG1 3.29Å; E341-L344 HydrophobicContact CB-CD1 3.88Å; E341-L344 HydrophobicContact CB-CG 4.19Å; E341-L344 HydrophobicContact CG-CD1 4.31Å; E341-L344 HydrophobicContact CG-CG 4.14Å; E341-L344 PolarHBondContact O-N 3.4Å; E341-R349 VanDerWaalsContact O-CD 3.28Å; E341-R349 WeakPolarHBondContact O-CD 3.22Å; E341-R349 PolarHBondContact O-NE 2.88Å
342	A	90.5	Very high	94.6	Very high	78 Å²	78	49.7 Å²	49.7	65%	0.645	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.2	-15.4	-172.2	0	0	0	0	0	113.3	K340 L344	K340-A342 PolarHBondContact O-N 3.12Å; A342-L344 VanDerWaalsContact C-N 3.35Å
343	T	88.9	Confident	94.8	Very high	93 Å²	93	49.2 Å²	49.2	57%	0.571	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-18.5	178	56.2	0	0	0	0	113.4	F251 E341	F251-T343 WeakPolarHBondContact CE1-OG1 3.49Å; E341-T343 VanDerWaalsContact CG-OG1 3.25Å; E341-T343 WeakPolarHBondContact CG-OG1 3.15Å; E341-T343 PolarHBondContact O-N 2.93Å; E341-T343 WeakPolarHBondContact OE1-CG2 3.43Å; E341-T343 PolarHBondContact OE1-N 3.35Å; E341-T343 PolarHBondContact OE1-OG1 3.29Å
344	L	91.1	Very high	94.9	Very high	17 Å²	17	42.1 Å²	42.1	9%	0.089	24%	0.239	C	C	.	.	S	Bend	trans	-73.4	154.7	173.4	-65.5	169.1	0	0	0	111.4	F251 V338 E341 A342 E348 R349 Y352	F251-L344 HydrophobicContact CE1-CD2 3.89Å; F251-L344 HydrophobicContact CE1-CG 4.37Å; F251-L344 HydrophobicContact CE2-CD2 3.62Å; F251-L344 HydrophobicContact CZ-CD2 3.17Å; F251-L344 HydrophobicContact CZ-CG 4.07Å; V338-L344 HydrophobicContact CG1-CD1 3.5Å; V338-L344 VanDerWaalsContact CG1-CD1 3.5Å; V338-L344 VanDerWaalsContact O-CD1 3.31Å; V338-L344 WeakPolarHBondContact O-CD1 3.45Å; E341-L344 HydrophobicContact CB-CD1 3.88Å; E341-L344 HydrophobicContact CB-CG 4.19Å; E341-L344 HydrophobicContact CG-CD1 4.31Å; E341-L344 HydrophobicContact CG-CG 4.14Å; E341-L344 PolarHBondContact O-N 3.4Å; A342-L344 VanDerWaalsContact C-N 3.35Å; L344-E348 HydrophobicContact CB-CG 4.44Å; L344-E348 HydrophobicContact CD2-CG 4.27Å; L344-E348 VanDerWaalsContact CD2-OE2 3.3Å; L344-E348 WeakPolarHBondContact CD2-OE2 3.3Å; L344-R349 HydrophobicContact CB-CG 3.6Å; L344-R349 HydrophobicContact CD1-CG 4.41Å; L344-R349 WeakPolarHBondContact O-CD 3.42Å; L344-Y352 HydrophobicContact CD1-CE2 4.45Å
345	S	91.6	Very high	94.9	Very high	28 Å²	28	37.8 Å²	37.8	20%	0.196	22%	0.217	C	C	.	.			trans	-67	154.3	179.4	86	0	0	0	0	112	E266 N347 E348 R349	E266-S345 WeakPolarHBondContact OE2-CB 3.43Å; E266-S345 PolarHBondContact OE2-OG 3.24Å; S345-N347 VanDerWaalsContact C-N 3.31Å; S345-N347 PolarHBondContact O-N 3.06Å; S345-E348 PolarHBondContact O-N 3.34Å; S345-E348 WeakPolarHBondContact OG-CB 3.35Å; S345-E348 PolarHBondContact OG-N 2.93Å; S345-R349 VanDerWaalsContact O-CG 3.3Å; S345-R349 WeakPolarHBondContact O-CG 3.42Å; S345-R349 PolarHBondContact O-N 3.24Å
346	P	94.8	Very high	94.8	Very high	70 Å²	70	37.7 Å²	37.7	46%	0.455	22%	0.216	S	C	.	.	H	α-helix	trans	-56.5	-41.5	179.3	-26.2	35.3	0	0	0	113.6	A350 L364	P346-A350 WeakPolarHBondContact O-CB 3.38Å; P346-A350 PolarHBondContact O-N 3.09Å; P346-L364 HydrophobicContact CB-CB 4.28Å; P346-L364 HydrophobicContact CB-CD1 4.39Å
347	N	95.4	Very high	94.8	Very high	26 Å²	26	35.9 Å²	35.9	14%	0.139	21%	0.211	C	C	.	.	H	α-helix	trans	-70.4	-37.1	179.1	-74.9	-52.8	0	0	0	112.3	E266 F269 S345 A350 I351	E266-N347 WeakPolarHBondContact OE1-CB 3.12Å; E266-N347 PolarHBondContact OE1-ND2 2.92Å; F269-N347 HydrophobicContact CB-CB 3.79Å; S345-N347 VanDerWaalsContact C-N 3.31Å; S345-N347 PolarHBondContact O-N 3.06Å; N347-A350 WeakPolarHBondContact O-CB 3.22Å; N347-A350 PolarHBondContact O-N 2.95Å; N347-I351 WeakPolarHBondContact O-CG1 3.5Å; N347-I351 PolarHBondContact O-N 3.4Å; N347-I351 VanDerWaalsContact O-N 3.13Å
348	E	95.4	Very high	94.8	Very high	16 Å²	16	33.9 Å²	33.9	8%	0.075	19%	0.192	C	C	.	.	H	α-helix	trans	-62.8	-48.1	174	-176.8	163.1	-153.5	0	0	111.3	F269 L344 S345 A350 I351 Y352	F269-E348 HydrophobicContact CD2-CB 3.67Å; F269-E348 HydrophobicContact CD2-CG 4.35Å; F269-E348 HydrophobicContact CE2-CB 3.6Å; F269-E348 VanDerWaalsContact CE2-CD 3.49Å; F269-E348 HydrophobicContact CE2-CG 3.85Å; F269-E348 WeakPolarHBondContact CE2-OE2 3.48Å; F269-E348 HydrophobicContact CG-CB 4.32Å; F269-E348 HydrophobicContact CZ-CB 4.23Å; F269-E348 HydrophobicContact CZ-CG 4.01Å; L344-E348 HydrophobicContact CB-CG 4.44Å; L344-E348 HydrophobicContact CD2-CG 4.27Å; L344-E348 VanDerWaalsContact CD2-OE2 3.3Å; L344-E348 WeakPolarHBondContact CD2-OE2 3.3Å; S345-E348 PolarHBondContact O-N 3.34Å; S345-E348 WeakPolarHBondContact OG-CB 3.35Å; S345-E348 PolarHBondContact OG-N 2.93Å; E348-A350 VanDerWaalsContact C-N 3.25Å; E348-A350 PolarHBondContact O-N 3.15Å; E348-I351 WeakPolarHBondContact O-CB 3.36Å; E348-I351 PolarHBondContact O-N 3.03Å; E348-I351 VanDerWaalsContact O-N 3.15Å; E348-Y352 HydrophobicContact CG-CD2 4.03Å; E348-Y352 HydrophobicContact CG-CE2 3.53Å; E348-Y352 WeakPolarHBondContact O-CD2 3.14Å; E348-Y352 PolarHBondContact O-N 3.4Å
349	R	97.1	Very high	94.9	Very high	52 Å²	52	32.9 Å²	32.9	20%	0.196	19%	0.185	C	C	.	.	H	α-helix	trans	-59.7	-38.1	175.2	-67.9	174.6	65.4	-155.1	-5.4	111.6	A339 E341 L344 S345 I351 Y352 G353 A361 L364	A339-R349 PolarHBondContact O-NE 3.49Å; A339-R349 VanDerWaalsContact O-NE 3.1Å; E341-R349 VanDerWaalsContact O-CD 3.28Å; E341-R349 WeakPolarHBondContact O-CD 3.22Å; E341-R349 PolarHBondContact O-NE 2.88Å; L344-R349 HydrophobicContact CB-CG 3.6Å; L344-R349 HydrophobicContact CD1-CG 4.41Å; L344-R349 WeakPolarHBondContact O-CD 3.42Å; S345-R349 VanDerWaalsContact O-CG 3.3Å; S345-R349 WeakPolarHBondContact O-CG 3.42Å; S345-R349 PolarHBondContact O-N 3.24Å; R349-I351 VanDerWaalsContact C-N 3.34Å; R349-I351 PolarHBondContact O-N 3.48Å; R349-Y352 PolarHBondContact O-N 3.37Å; R349-G353 PolarHBondContact O-N 3.15Å; R349-A361 HydrophobicContact CB-CB 4.24Å; R349-A361 WeakPolarHBondContact O-CB 3.17Å; R349-L364 HydrophobicContact CB-CD1 3.93Å
350	A	97.5	Very high	95	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-62.5	-38.5	177.1	0	0	0	0	0	112.7	F273 P346 N347 E348 G353 A354 A361 L364	F273-A350 HydrophobicContact CD2-CB 3.5Å; F273-A350 HydrophobicContact CE2-CB 3.61Å; F273-A350 HydrophobicContact CG-CB 4.19Å; F273-A350 HydrophobicContact CZ-CB 4.39Å; P346-A350 WeakPolarHBondContact O-CB 3.38Å; P346-A350 PolarHBondContact O-N 3.09Å; N347-A350 WeakPolarHBondContact O-CB 3.22Å; N347-A350 PolarHBondContact O-N 2.95Å; E348-A350 VanDerWaalsContact C-N 3.25Å; E348-A350 PolarHBondContact O-N 3.15Å; A350-G353 PolarHBondContact O-N 3.14Å; A350-A354 WeakPolarHBondContact O-CB 3.46Å; A350-A354 PolarHBondContact O-N 3.44Å; A350-A361 VanDerWaalsContact CA-O 3.29Å; A350-A361 WeakPolarHBondContact CA-O 3.31Å; A350-L364 HydrophobicContact CB-CB 4.35Å
351	I	97.5	Very high	95.1	Very high	1 Å²	1	31 Å²	31	1%	0.005	18%	0.184	C	C	.	.	H	α-helix	trans	-60.2	-53.2	174.2	-66.8	164.6	0	0	0	110.4	F269 V272 F273 I276 L296 L300 N347 E348 R349 G353 A354 L355	F269-I351 HydrophobicContact CB-CD1 3.9Å; F269-I351 HydrophobicContact CD1-CD1 3.84Å; F269-I351 HydrophobicContact CG-CD1 4.15Å; V272-I351 HydrophobicContact CB-CD1 3.95Å; V272-I351 HydrophobicContact CG1-CD1 3.64Å; V272-I351 HydrophobicContact CG1-CG1 4.01Å; V272-I351 HydrophobicContact CG1-CG2 4.45Å; F273-I351 HydrophobicContact CB-CG1 4.1Å; I276-I351 HydrophobicContact CD1-CB 4.35Å; I276-I351 HydrophobicContact CD1-CG1 4.3Å; I276-I351 HydrophobicContact CD1-CG2 3.81Å; L296-I351 HydrophobicContact CD1-CG2 4.35Å; L300-I351 HydrophobicContact CD2-CG2 4.38Å; N347-I351 WeakPolarHBondContact O-CG1 3.5Å; N347-I351 PolarHBondContact O-N 3.4Å; N347-I351 VanDerWaalsContact O-N 3.13Å; E348-I351 WeakPolarHBondContact O-CB 3.36Å; E348-I351 PolarHBondContact O-N 3.03Å; E348-I351 VanDerWaalsContact O-N 3.15Å; R349-I351 VanDerWaalsContact C-N 3.34Å; R349-I351 PolarHBondContact O-N 3.48Å; I351-G353 VanDerWaalsContact C-N 3.29Å; I351-G353 PolarHBondContact O-N 2.91Å; I351-A354 PolarHBondContact O-N 3.18Å; I351-L355 HydrophobicContact CG2-CD1 3.88Å; I351-L355 WeakPolarHBondContact O-CG 3.28Å; I351-L355 PolarHBondContact O-N 3.29Å
352	Y	97.1	Very high	95.2	Very high	17 Å²	17	27 Å²	27	7%	0.067	17%	0.165	C	C	.	.	H	α-helix	trans	-64.4	-35.7	179.8	-66.3	-65.2	0	0	0	112.7	W295 I299 V338 L344 E348 R349 L355 S356	W295-Y352 WeakPolarHBondContact CZ3-OH 3.31Å; I299-Y352 HydrophobicContact CD1-CE1 4Å; I299-Y352 HydrophobicContact CG2-CD1 4.43Å; I299-Y352 HydrophobicContact CG2-CE1 3.9Å; V338-Y352 HydrophobicContact CB-CD1 4.34Å; V338-Y352 HydrophobicContact CB-CD2 4.38Å; V338-Y352 HydrophobicContact CB-CG 4.25Å; V338-Y352 HydrophobicContact CG1-CD1 4.13Å; V338-Y352 HydrophobicContact CG1-CD2 3.55Å; V338-Y352 HydrophobicContact CG1-CE1 4.03Å; V338-Y352 HydrophobicContact CG1-CE2 3.45Å; V338-Y352 VanDerWaalsContact CG1-CE2 3.45Å; V338-Y352 HydrophobicContact CG1-CG 3.9Å; L344-Y352 HydrophobicContact CD1-CE2 4.45Å; E348-Y352 HydrophobicContact CG-CD2 4.03Å; E348-Y352 HydrophobicContact CG-CE2 3.53Å; E348-Y352 WeakPolarHBondContact O-CD2 3.14Å; E348-Y352 PolarHBondContact O-N 3.4Å; R349-Y352 PolarHBondContact O-N 3.37Å; Y352-L355 PolarHBondContact O-N 3.24Å; Y352-S356 WeakPolarHBondContact O-CB 3.41Å; Y352-S356 PolarHBondContact O-N 3.08Å; Y352-S356 VanDerWaalsContact O-N 3.08Å; Y352-S356 PolarHBondContact O-OG 2.94Å
353	G	97	Very high	95.5	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-59.2	-50.8	172.4	0	0	0	0	0	111.6	R349 A350 I351 L355 S356 G357 F358 T362	R349-G353 PolarHBondContact O-N 3.15Å; A350-G353 PolarHBondContact O-N 3.14Å; I351-G353 VanDerWaalsContact C-N 3.29Å; I351-G353 PolarHBondContact O-N 2.91Å; G353-L355 VanDerWaalsContact C-N 3.34Å; G353-L355 PolarHBondContact O-N 2.9Å; G353-S356 PolarHBondContact O-N 3.03Å; G353-S356 PolarHBondContact O-OG 3.34Å; G353-G357 CarbonylContact O-C 3.53Å; G353-G357 WeakPolarHBondContact O-CA 3.14Å; G353-G357 PolarHBondContact O-N 3.39Å; G353-F358 PolarHBondContact O-N 2.87Å; G353-T362 WeakPolarHBondContact CA-OG1 3.33Å; G353-T362 PolarHBondContact O-OG1 3.49Å; G353-T362 VanDerWaalsContact O-OG1 3.13Å
354	A	96.5	Very high	95.9	Very high	6 Å²	6	24 Å²	24	5%	0.05	14%	0.135	C	C	.	.	H	α-helix	trans	-61.7	-40.1	179.2	0	0	0	0	0	112.4	F273 I276 A350 I351 T362 W374	F273-A354 HydrophobicContact CE2-CB 4.21Å; I276-A354 HydrophobicContact CG2-CB 3.82Å; A350-A354 WeakPolarHBondContact O-CB 3.46Å; A350-A354 PolarHBondContact O-N 3.44Å; I351-A354 PolarHBondContact O-N 3.18Å; A354-T362 HydrophobicContact CB-CG2 4.2Å; A354-T362 PolarHBondContact N-OG1 3.06Å; A354-W374 HydrophobicContact CB-CH2 3.96Å
355	L	94.7	Very high	96.1	Very high	1 Å²	1	24 Å²	24	1%	0.005	14%	0.138	C	C	.	.	H	α-helix	trans	-71.5	-28.3	179.6	-67.7	169.6	0	0	0	113.9	I299 L300 I351 Y352 G353	I299-L355 HydrophobicContact CG2-CD1 3.93Å; L300-L355 HydrophobicContact CD2-CD1 4.12Å; L300-L355 HydrophobicContact CD2-CD2 4.3Å; I351-L355 HydrophobicContact CG2-CD1 3.88Å; I351-L355 WeakPolarHBondContact O-CG 3.28Å; I351-L355 PolarHBondContact O-N 3.29Å; Y352-L355 PolarHBondContact O-N 3.24Å; G353-L355 VanDerWaalsContact C-N 3.34Å; G353-L355 PolarHBondContact O-N 2.9Å
356	S	94.5	Very high	96.2	Very high	3 Å²	3	23.1 Å²	23.1	2%	0.021	13%	0.133	C	C	.	.	H	α-helix	trans	-104.7	-7	-176.5	60.8	0	0	0	0	114.6	N332 Y352 G353 F358 E382	N332-S356 WeakPolarHBondContact ND2-CA 3.39Å; N332-S356 PolarHBondContact ND2-O 2.74Å; Y352-S356 WeakPolarHBondContact O-CB 3.41Å; Y352-S356 PolarHBondContact O-N 3.08Å; Y352-S356 VanDerWaalsContact O-N 3.08Å; Y352-S356 PolarHBondContact O-OG 2.94Å; G353-S356 PolarHBondContact O-N 3.03Å; G353-S356 PolarHBondContact O-OG 3.34Å; S356-F358 VanDerWaalsContact C-N 3.26Å; S356-F358 PolarHBondContact O-N 3.48Å; S356-F358 WeakPolarHBondContact OG-CB 3.25Å; S356-F358 PolarHBondContact OG-N 3.21Å; S356-E382 WeakPolarHBondContact O-CG 3.29Å
357	G	94.2	Very high	96	Very high	14 Å²	14	23.9 Å²	23.9	14%	0.144	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.5	19.1	-169.9	0	0	0	0	0	113.7	G353 L359 A379	G353-G357 CarbonylContact O-C 3.53Å; G353-G357 WeakPolarHBondContact O-CA 3.14Å; G353-G357 PolarHBondContact O-N 3.39Å; G357-L359 PolarHBondContact O-N 3.46Å; G357-A379 VanDerWaalsContact O-CB 3.23Å; G357-A379 WeakPolarHBondContact O-CB 3.42Å
358	F	97	Very high	95.7	Very high	40 Å²	40	25.3 Å²	25.3	18%	0.175	15%	0.149	C	C	.	.			trans	-80	86.5	177.4	-174.1	-116.1	0	0	0	111.5	M336 A339 K340 G353 S356 P360 A361 T362	M336-F358 HydrophobicContact CG-CB 4.05Å; M336-F358 HydrophobicContact CG-CD2 3.98Å; M336-F358 HydrophobicContact CG-CG 4.08Å; M336-F358 HydrophobicContact SD-CD2 4.36Å; A339-F358 HydrophobicContact CB-CB 4.38Å; A339-F358 HydrophobicContact CB-CD1 3.74Å; A339-F358 HydrophobicContact CB-CG 4.44Å; K340-F358 HydrophobicContact CD-CZ 4.36Å; K340-F358 HydrophobicContact CG-CD1 4.32Å; K340-F358 HydrophobicContact CG-CE1 3.65Å; K340-F358 HydrophobicContact CG-CE2 4.25Å; K340-F358 HydrophobicContact CG-CZ 3.62Å; G353-F358 PolarHBondContact O-N 2.87Å; S356-F358 VanDerWaalsContact C-N 3.26Å; S356-F358 PolarHBondContact O-N 3.48Å; S356-F358 WeakPolarHBondContact OG-CB 3.25Å; S356-F358 PolarHBondContact OG-N 3.21Å; F358-P360 VanDerWaalsContact C-CD 3.48Å; F358-P360 HydrophobicContact CE1-CB 4.07Å; F358-P360 HydrophobicContact CE1-CG 4.21Å; F358-P360 HydrophobicContact CE2-CG 3.99Å; F358-P360 HydrophobicContact CZ-CB 4.06Å; F358-P360 HydrophobicContact CZ-CG 3.77Å; F358-A361 HydrophobicContact CD1-CB 3.63Å; F358-A361 HydrophobicContact CE1-CB 4.1Å; F358-A361 PolarHBondContact O-N 3.31Å; F358-T362 PolarHBondContact O-N 3.04Å; F358-T362 PolarHBondContact O-OG1 3.41Å
359	L	97.1	Very high	95.6	Very high	25 Å²	25	24.8 Å²	24.8	13%	0.131	15%	0.146	C	C	.	.	H	α-helix	trans	-45.4	-49.1	-172.3	-178.6	64	0	0	0	115.2	G357 A361 T362 L363 A375 F376 A379	G357-L359 PolarHBondContact O-N 3.46Å; L359-A361 PolarHBondContact O-N 2.92Å; L359-A361 VanDerWaalsContact O-N 3.13Å; L359-T362 PolarHBondContact O-N 2.87Å; L359-T362 VanDerWaalsContact O-N 3.16Å; L359-L363 HydrophobicContact CD1-CD1 4.07Å; L359-L363 HydrophobicContact CD1-CD2 3.96Å; L359-L363 HydrophobicContact CD1-CG 3.78Å; L359-L363 HydrophobicContact CG-CD1 4.01Å; L359-L363 HydrophobicContact CG-CG 4.17Å; L359-L363 VanDerWaalsContact O-CG 3.29Å; L359-L363 WeakPolarHBondContact O-CG 3.38Å; L359-L363 PolarHBondContact O-N 3.39Å; L359-A375 HydrophobicContact CD1-CB 3.96Å; L359-F376 HydrophobicContact CD1-CD2 3.71Å; L359-F376 HydrophobicContact CD1-CE2 4.08Å; L359-F376 HydrophobicContact CD1-CG 4.07Å; L359-F376 HydrophobicContact CD2-CD1 3.85Å; L359-F376 HydrophobicContact CD2-CD2 4.12Å; L359-F376 HydrophobicContact CD2-CE1 3.73Å; L359-F376 HydrophobicContact CD2-CE2 4.04Å; L359-F376 HydrophobicContact CD2-CG 4.06Å; L359-F376 HydrophobicContact CD2-CZ 3.85Å; L359-F376 HydrophobicContact CG-CD2 4.49Å; L359-F376 HydrophobicContact CG-CE2 4.5Å; L359-A379 HydrophobicContact CB-CB 4.07Å; L359-A379 HydrophobicContact CD1-CB 4.42Å
360	P	97.1	Very high	95.2	Very high	76 Å²	76	23.1 Å²	23.1	49%	0.494	14%	0.141	S	C	.	.	H	α-helix	trans	-58.3	-32.3	-176.9	-25.6	35.8	0	0	0	114.1	F358	F358-P360 VanDerWaalsContact C-CD 3.48Å; F358-P360 HydrophobicContact CE1-CB 4.07Å; F358-P360 HydrophobicContact CE1-CG 4.21Å; F358-P360 HydrophobicContact CE2-CG 3.99Å; F358-P360 HydrophobicContact CZ-CB 4.06Å; F358-P360 HydrophobicContact CZ-CG 3.77Å
361	A	97.5	Very high	95.1	Very high	0 Å²	0	24 Å²	24	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-83.9	-39.9	177.5	0	0	0	0	0	111.7	A339 R349 A350 F358 L359 L363 L364	A339-A361 HydrophobicContact CB-CB 3.85Å; R349-A361 HydrophobicContact CB-CB 4.24Å; R349-A361 WeakPolarHBondContact O-CB 3.17Å; A350-A361 VanDerWaalsContact CA-O 3.29Å; A350-A361 WeakPolarHBondContact CA-O 3.31Å; F358-A361 HydrophobicContact CD1-CB 3.63Å; F358-A361 HydrophobicContact CE1-CB 4.1Å; F358-A361 PolarHBondContact O-N 3.31Å; L359-A361 PolarHBondContact O-N 2.92Å; L359-A361 VanDerWaalsContact O-N 3.13Å; A361-L363 PolarHBondContact O-N 2.87Å; A361-L364 VanDerWaalsContact O-CB 3.23Å; A361-L364 WeakPolarHBondContact O-CB 3.48Å; A361-L364 WeakPolarHBondContact O-CG 3.43Å; A361-L364 PolarHBondContact O-N 2.88Å
362	T	97.5	Very high	95	Very high	3 Å²	3	24 Å²	24	2%	0.018	15%	0.146	C	C	.	.	H	α-helix	trans	-54.6	-43.2	175.5	-48.1	0	0	0	0	111.6	F273 G353 A354 F358 L359 L364 G365 C366 W374 A375	F273-T362 HydrophobicContact CE2-CG2 4.42Å; G353-T362 WeakPolarHBondContact CA-OG1 3.33Å; G353-T362 PolarHBondContact O-OG1 3.49Å; G353-T362 VanDerWaalsContact O-OG1 3.13Å; A354-T362 HydrophobicContact CB-CG2 4.2Å; A354-T362 PolarHBondContact N-OG1 3.06Å; F358-T362 PolarHBondContact O-N 3.04Å; F358-T362 PolarHBondContact O-OG1 3.41Å; L359-T362 PolarHBondContact O-N 2.87Å; L359-T362 VanDerWaalsContact O-N 3.16Å; T362-L364 PolarHBondContact O-N 3.42Å; T362-L364 VanDerWaalsContact O-N 3.08Å; T362-G365 PolarHBondContact O-N 3.48Å; T362-G365 VanDerWaalsContact O-N 3.1Å; T362-C366 PolarHBondContact O-SG 3.33Å; T362-C366 VanDerWaalsContact O-SG 3.41Å; T362-W374 HydrophobicContact CG2-CE3 4.46Å; T362-W374 HydrophobicContact CG2-CH2 4.25Å; T362-W374 HydrophobicContact CG2-CZ3 3.67Å; T362-A375 HydrophobicContact CG2-CB 3.65Å
363	L	97.1	Very high	94.8	Very high	35 Å²	35	23.2 Å²	23.2	18%	0.183	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-18	179.8	-69.7	-179.3	0	0	0	114.2	L359 A361 G365 C366 A375 F376	L359-L363 HydrophobicContact CD1-CD1 4.07Å; L359-L363 HydrophobicContact CD1-CD2 3.96Å; L359-L363 HydrophobicContact CD1-CG 3.78Å; L359-L363 HydrophobicContact CG-CD1 4.01Å; L359-L363 HydrophobicContact CG-CG 4.17Å; L359-L363 VanDerWaalsContact O-CG 3.29Å; L359-L363 WeakPolarHBondContact O-CG 3.38Å; L359-L363 PolarHBondContact O-N 3.39Å; A361-L363 PolarHBondContact O-N 2.87Å; L363-G365 VanDerWaalsContact C-N 3.26Å; L363-G365 PolarHBondContact O-N 3.13Å; L363-C366 PolarHBondContact O-N 3.25Å; L363-A375 HydrophobicContact CD2-CB 3.79Å; L363-F376 HydrophobicContact CD1-CE2 4.15Å; L363-F376 HydrophobicContact CD2-CD2 4.32Å; L363-F376 HydrophobicContact CD2-CE2 4.12Å
364	L	96.6	Very high	94.8	Very high	74 Å²	74	23.3 Å²	23.3	39%	0.387	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-27.4	176.7	-60.4	173.1	0	0	0	112.5	P346 R349 A350 A361 T362	P346-L364 HydrophobicContact CB-CB 4.28Å; P346-L364 HydrophobicContact CB-CD1 4.39Å; R349-L364 HydrophobicContact CB-CD1 3.93Å; A350-L364 HydrophobicContact CB-CB 4.35Å; A361-L364 VanDerWaalsContact O-CB 3.23Å; A361-L364 WeakPolarHBondContact O-CB 3.48Å; A361-L364 WeakPolarHBondContact O-CG 3.43Å; A361-L364 PolarHBondContact O-N 2.88Å; T362-L364 PolarHBondContact O-N 3.42Å; T362-L364 VanDerWaalsContact O-N 3.08Å
365	G	94.1	Very high	94.8	Very high	16 Å²	16	23 Å²	23	17%	0.165	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.6	-10.7	177.1	0	0	0	0	0	114.3	F273 T362 L363	F273-G365 VanDerWaalsContact CE1-CA 3.47Å; F273-G365 WeakPolarHBondContact CE1-O 3.39Å; T362-G365 PolarHBondContact O-N 3.48Å; T362-G365 VanDerWaalsContact O-N 3.1Å; L363-G365 VanDerWaalsContact C-N 3.26Å; L363-G365 PolarHBondContact O-N 3.13Å
366	C	95.2	Very high	94.9	Very high	11 Å²	11	23.4 Å²	23.4	7%	0.074	14%	0.142	C	C	.	.			trans	-84.2	137.3	-174.7	-63.6	0	0	0	0	112.1	T362 L363 D371 H372	T362-C366 PolarHBondContact O-SG 3.33Å; T362-C366 VanDerWaalsContact O-SG 3.41Å; L363-C366 PolarHBondContact O-N 3.25Å; C366-D371 HydrophobicContact CB-CB 3.67Å; C366-D371 PolarHBondContact SG-O 3.11Å; C366-D371 VanDerWaalsContact SG-O 3.35Å; C366-H372 VanDerWaalsContact C-CE1 3.43Å; C366-H372 VanDerWaalsContact CB-CE1 3.44Å; C366-H372 WeakPolarHBondContact CB-CE1 3.36Å; C366-H372 PolarHBondContact O-CE1 3.43Å
367	S	90.5	Very high	94.9	Very high	86 Å²	86	23.3 Å²	23.3	60%	0.601	14%	0.141	S	C	*	.			trans	-120.5	-44.6	-176.2	65.4	0	0	0	0	113.9	D371	S367-D371 PolarHBondContact N-OD2 3.18Å; S367-D371 PolarHBondContact OG-OD2 3.07Å
368	T	89.6	Confident	95	Very high	55 Å²	55	23.1 Å²	23.1	34%	0.337	14%	0.138	S	C	.	.	S	Bend	trans	-94.7	166.1	-177.2	67.1	0	0	0	0	112	E370 D371 H372	T368-E370 WeakPolarHBondContact CB-OE2 3.27Å; T368-E370 PolarHBondContact O-N 3.29Å; T368-E370 PolarHBondContact OG1-OE2 2.91Å; T368-D371 PolarHBondContact N-OD2 3.04Å; T368-D371 WeakPolarHBondContact O-CB 3.44Å; T368-D371 PolarHBondContact O-N 3.32Å; T368-D371 PolarHBondContact OG1-N 3.21Å; T368-D371 VanDerWaalsContact OG1-N 3.08Å; T368-D371 PolarHBondContact OG1-OD1 3.16Å; T368-D371 PolarHBondContact OG1-OD2 2.58Å; T368-H372 PolarHBondContact O-N 3.45Å; T368-H372 VanDerWaalsContact O-N 3.15Å; T368-H372 PolarHBondContact O-ND1 2.79Å
369	W	91.4	Very high	95	Very high	5 Å²	5	21.7 Å²	21.7	2%	0.019	13%	0.134	C	C	.	.	H	α-helix	trans	-56	-41.1	173.5	-177	94.3	0	0	0	111.6	H372 L373 F419 S423 F427 R437 P440 L441	W369-H372 PolarHBondContact O-N 3.16Å; W369-L373 HydrophobicContact CH2-CD2 3.59Å; W369-L373 HydrophobicContact CZ3-CB 4.28Å; W369-L373 HydrophobicContact CZ3-CD2 3.57Å; W369-L373 PolarHBondContact O-N 3Å; W369-F419 HydrophobicContact CD2-CZ 4.08Å; W369-F419 AromaticContact CE2-CE1 3.64Å; W369-F419 AromaticContact CE2-CZ 3.57Å; W369-F419 HydrophobicContact CG-CZ 4.5Å; W369-F419 HydrophobicContact CH2-CE1 4.13Å; W369-F419 HydrophobicContact CH2-CZ 4.48Å; W369-F419 AromaticContact CZ2-CE1 3.43Å; W369-F419 HydrophobicContact CZ2-CE1 3.43Å; W369-F419 VanDerWaalsContact CZ2-CE1 3.43Å; W369-F419 AromaticContact CZ2-CZ 3.82Å; W369-F419 HydrophobicContact CZ2-CZ 3.82Å; W369-F419 AromaticContact NE1-CE1 3.86Å; W369-F419 AromaticContact NE1-CZ 3.65Å; W369-S423 PolarHBondContact NE1-OG 3.34Å; W369-F427 VanDerWaalsContact CA-CZ 3.5Å; W369-F427 HydrophobicContact CB-CD1 4.26Å; W369-F427 HydrophobicContact CB-CD2 4.33Å; W369-F427 HydrophobicContact CB-CE1 4.21Å; W369-F427 HydrophobicContact CB-CE2 4.28Å; W369-F427 HydrophobicContact CB-CG 4.33Å; W369-F427 HydrophobicContact CB-CZ 4.23Å; W369-F427 AromaticContact CD1-CD2 3.61Å; W369-F427 AromaticContact CD1-CG 3.91Å; W369-F427 HydrophobicContact CG-CD2 4.33Å; W369-R437 VanDerWaalsContact CB-CZ 3.44Å; W369-R437 HydrophobicContact CD2-CG 4.07Å; W369-R437 HydrophobicContact CE3-CG 3.98Å; W369-R437 HydrophobicContact CH2-CB 3.78Å; W369-R437 HydrophobicContact CH2-CG 3.9Å; W369-R437 HydrophobicContact CZ2-CB 3.67Å; W369-R437 HydrophobicContact CZ2-CG 3.97Å; W369-R437 HydrophobicContact CZ3-CB 4.32Å; W369-R437 HydrophobicContact CZ3-CG 3.92Å; W369-P440 HydrophobicContact CH2-CG 4.17Å; W369-L441 HydrophobicContact CZ2-CD1 4.39Å
370	E	90.4	Very high	94.9	Very high	18 Å²	18	20.6 Å²	20.6	8%	0.084	13%	0.128	C	C	.	.	H	α-helix	trans	-65.8	-38.5	179.5	-61.8	71.5	-154.4	0	0	111.4	L144 L199 T368 H372 L373 W374 R437	L144-E370 HydrophobicContact CD2-CG 3.55Å; L199-E370 HydrophobicContact CD2-CB 4.06Å; T368-E370 WeakPolarHBondContact CB-OE2 3.27Å; T368-E370 PolarHBondContact O-N 3.29Å; T368-E370 PolarHBondContact OG1-OE2 2.91Å; E370-H372 VanDerWaalsContact C-N 3.3Å; E370-H372 PolarHBondContact O-N 2.91Å; E370-L373 PolarHBondContact O-N 3.12Å; E370-W374 WeakPolarHBondContact O-CB 3.35Å; E370-W374 PolarHBondContact O-N 2.94Å; E370-R437 IonicContact OE1-CZ 3.21Å; E370-R437 IonicContact OE1-NE 3.52Å; E370-R437 PolarHBondContact OE1-NE 2.96Å; E370-R437 IonicContact OE1-NH2 2.75Å; E370-R437 PolarHBondContact OE1-NH2 3.49Å; E370-R437 IonicContact OE2-NH2 3.5Å
371	D	93.8	Very high	94.8	Very high	19 Å²	19	17.3 Å²	17.3	10%	0.102	11%	0.107	C	C	.	.	H	α-helix	trans	-62	-38.6	173.1	-65.8	-23.9	0	0	0	112.2	R277 C366 S367 T368 W374 A375	R277-D371 IonicContact CZ-OD1 2.85Å; R277-D371 IonicContact NE-OD1 3.91Å; R277-D371 PolarHBondContact NE-OD1 3.32Å; R277-D371 IonicContact NH2-OD1 3.46Å; R277-D371 PolarHBondContact NH2-OD1 2.81Å; C366-D371 HydrophobicContact CB-CB 3.67Å; C366-D371 PolarHBondContact SG-O 3.11Å; C366-D371 VanDerWaalsContact SG-O 3.35Å; S367-D371 PolarHBondContact N-OD2 3.18Å; S367-D371 PolarHBondContact OG-OD2 3.07Å; T368-D371 PolarHBondContact N-OD2 3.04Å; T368-D371 WeakPolarHBondContact O-CB 3.44Å; T368-D371 PolarHBondContact O-N 3.32Å; T368-D371 PolarHBondContact OG1-N 3.21Å; T368-D371 VanDerWaalsContact OG1-N 3.08Å; T368-D371 PolarHBondContact OG1-OD1 3.16Å; T368-D371 PolarHBondContact OG1-OD2 2.58Å; D371-W374 PolarHBondContact O-N 3.29Å; D371-A375 WeakPolarHBondContact O-CB 3.38Å; D371-A375 PolarHBondContact O-N 3.18Å
372	H	95.4	Very high	94.6	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-71.7	-43.7	179.5	-70.8	69.3	0	0	0	110.5	C366 T368 W369 E370 W374 A375 F376 F419 H422 K426 F427	C366-H372 VanDerWaalsContact C-CE1 3.43Å; C366-H372 VanDerWaalsContact CB-CE1 3.44Å; C366-H372 WeakPolarHBondContact CB-CE1 3.36Å; C366-H372 PolarHBondContact O-CE1 3.43Å; T368-H372 PolarHBondContact O-N 3.45Å; T368-H372 VanDerWaalsContact O-N 3.15Å; T368-H372 PolarHBondContact O-ND1 2.79Å; W369-H372 PolarHBondContact O-N 3.16Å; E370-H372 VanDerWaalsContact C-N 3.3Å; E370-H372 PolarHBondContact O-N 2.91Å; H372-W374 VanDerWaalsContact C-N 3.27Å; H372-W374 PolarHBondContact O-N 3.17Å; H372-A375 PolarHBondContact O-N 3.23Å; H372-F376 VanDerWaalsContact O-CD2 3.25Å; H372-F376 WeakPolarHBondContact O-CD2 3.39Å; H372-F376 PolarHBondContact O-N 3.27Å; H372-F419 HydrophobicContact CB-CE2 3.9Å; H372-H422 AromaticContact CD2-NE2 3.1Å; H372-H422 PolarHBondContact CD2-NE2 2.97Å; H372-H422 AromaticContact CG-NE2 3.91Å; H372-H422 AromaticContact NE2-NE2 3.99Å; H372-K426 PolarHBondContact CE1-NZ 3.42Å; H372-K426 WeakPolarHBondContact NE2-CE 3.32Å; H372-K426 PolarHBondContact NE2-NZ 3.28Å; H372-F427 HydrophobicContact CB-CE2 4.16Å; H372-F427 HydrophobicContact CB-CZ 4.45Å; H372-F427 AromaticContact CE1-CZ 3.88Å; H372-F427 AromaticContact CG-CE2 3.91Å; H372-F427 AromaticContact CG-CZ 3.87Å; H372-F427 AromaticContact ND1-CZ 3.5Å
373	L	94	Very high	94.5	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-59.6	-41.6	173.8	-177.8	58.1	0	0	0	111	L195 L199 W369 E370 A375 F376 A377 F416 F419	L195-L373 HydrophobicContact CD1-CD2 4.18Å; L195-L373 HydrophobicContact CD2-CD1 4.36Å; L199-L373 HydrophobicContact CD1-CB 4.22Å; L199-L373 HydrophobicContact CD1-CD2 4.22Å; L199-L373 HydrophobicContact CD1-CG 3.9Å; L199-L373 HydrophobicContact CD2-CD2 4.49Å; W369-L373 HydrophobicContact CH2-CD2 3.59Å; W369-L373 HydrophobicContact CZ3-CB 4.28Å; W369-L373 HydrophobicContact CZ3-CD2 3.57Å; W369-L373 PolarHBondContact O-N 3Å; E370-L373 PolarHBondContact O-N 3.12Å; L373-A375 VanDerWaalsContact C-N 3.35Å; L373-A375 PolarHBondContact O-N 3.16Å; L373-F376 PolarHBondContact O-N 3.09Å; L373-A377 WeakPolarHBondContact O-CB 3.43Å; L373-A377 PolarHBondContact O-N 3.08Å; L373-F416 HydrophobicContact CD1-CE1 4.03Å; L373-F419 HydrophobicContact CB-CE1 4.1Å; L373-F419 HydrophobicContact CB-CE2 3.95Å; L373-F419 HydrophobicContact CB-CZ 3.62Å; L373-F419 HydrophobicContact CD1-CD1 3.79Å; L373-F419 HydrophobicContact CD1-CD2 4.43Å; L373-F419 HydrophobicContact CD1-CE1 3.76Å; L373-F419 HydrophobicContact CD1-CE2 4.42Å; L373-F419 HydrophobicContact CD1-CG 4.12Å; L373-F419 HydrophobicContact CD1-CZ 4.1Å; L373-F419 HydrophobicContact CG-CE1 4.38Å; L373-F419 HydrophobicContact CG-CZ 4.37Å; L373-F419 VanDerWaalsContact N-CE2 3.33Å
374	W	95.9	Very high	94.4	Very high	2 Å²	2	20.9 Å²	20.9	1%	0.008	12%	0.121	C	C	.	.	H	α-helix	trans	-60	-45.1	175.8	168.2	87.5	0	0	0	111.2	L199 E200 F273 I276 R277 A354 T362 E370 D371 H372 F376 A377 S378	L199-W374 HydrophobicContact CB-CB 4.06Å; L199-W374 VanDerWaalsContact CD1-CA 3.5Å; L199-W374 HydrophobicContact CD1-CB 3.8Å; L199-W374 HydrophobicContact CG-CB 4.47Å; E200-W374 PolarHBondContact OE1-NE1 3.45Å; F273-W374 HydrophobicContact CE2-CZ3 4.43Å; F273-W374 HydrophobicContact CZ-CZ3 4.03Å; I276-W374 HydrophobicContact CG2-CH2 4.4Å; I276-W374 HydrophobicContact CG2-CZ2 4.41Å; R277-W374 HydrophobicContact CB-CH2 4.35Å; A354-W374 HydrophobicContact CB-CH2 3.96Å; T362-W374 HydrophobicContact CG2-CE3 4.46Å; T362-W374 HydrophobicContact CG2-CH2 4.25Å; T362-W374 HydrophobicContact CG2-CZ3 3.67Å; E370-W374 WeakPolarHBondContact O-CB 3.35Å; E370-W374 PolarHBondContact O-N 2.94Å; D371-W374 PolarHBondContact O-N 3.29Å; H372-W374 VanDerWaalsContact C-N 3.27Å; H372-W374 PolarHBondContact O-N 3.17Å; W374-F376 PolarHBondContact O-N 3.35Å; W374-A377 PolarHBondContact O-N 2.75Å; W374-S378 WeakPolarHBondContact O-CB 3.27Å; W374-S378 PolarHBondContact O-N 2.7Å
375	A	97.5	Very high	94.2	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-62.7	-43.1	179.2	0	0	0	0	0	112.2	L359 T362 L363 D371 H372 L373 A379	L359-A375 HydrophobicContact CD1-CB 3.96Å; T362-A375 HydrophobicContact CG2-CB 3.65Å; L363-A375 HydrophobicContact CD2-CB 3.79Å; D371-A375 WeakPolarHBondContact O-CB 3.38Å; D371-A375 PolarHBondContact O-N 3.18Å; H372-A375 PolarHBondContact O-N 3.23Å; L373-A375 VanDerWaalsContact C-N 3.35Å; L373-A375 PolarHBondContact O-N 3.16Å; A375-A379 WeakPolarHBondContact O-CB 3.19Å; A375-A379 PolarHBondContact O-N 2.84Å
376	F	97.1	Very high	94.2	Very high	10 Å²	10	17.7 Å²	17.7	4%	0.044	10%	0.1	C	C	.	.	H	α-helix	trans	-64.5	-48.5	176	-86.7	-107.5	0	0	0	111.6	L359 L363 H372 L373 W374 S380 M415 R418 F419 H422	L359-F376 HydrophobicContact CD1-CD2 3.71Å; L359-F376 HydrophobicContact CD1-CE2 4.08Å; L359-F376 HydrophobicContact CD1-CG 4.07Å; L359-F376 HydrophobicContact CD2-CD1 3.85Å; L359-F376 HydrophobicContact CD2-CD2 4.12Å; L359-F376 HydrophobicContact CD2-CE1 3.73Å; L359-F376 HydrophobicContact CD2-CE2 4.04Å; L359-F376 HydrophobicContact CD2-CG 4.06Å; L359-F376 HydrophobicContact CD2-CZ 3.85Å; L359-F376 HydrophobicContact CG-CD2 4.49Å; L359-F376 HydrophobicContact CG-CE2 4.5Å; L363-F376 HydrophobicContact CD1-CE2 4.15Å; L363-F376 HydrophobicContact CD2-CD2 4.32Å; L363-F376 HydrophobicContact CD2-CE2 4.12Å; H372-F376 VanDerWaalsContact O-CD2 3.25Å; H372-F376 WeakPolarHBondContact O-CD2 3.39Å; H372-F376 PolarHBondContact O-N 3.27Å; L373-F376 PolarHBondContact O-N 3.09Å; W374-F376 PolarHBondContact O-N 3.35Å; F376-S380 PolarHBondContact O-N 3.26Å; F376-S380 PolarHBondContact O-OG 3.46Å; F376-M415 HydrophobicContact CB-CG 4.01Å; F376-M415 HydrophobicContact CB-SD 3.78Å; F376-M415 HydrophobicContact CD1-CG 4.34Å; F376-R418 HydrophobicContact CE1-CB 3.88Å; F376-F419 HydrophobicContact CB-CD2 4.26Å; F376-F419 HydrophobicContact CD1-CB 3.79Å; F376-F419 HydrophobicContact CD1-CD2 4.29Å; F376-F419 AromaticContact CD2-CD2 3.69Å; F376-F419 HydrophobicContact CD2-CD2 3.69Å; F376-F419 HydrophobicContact CD2-CE2 4.42Å; F376-F419 HydrophobicContact CE1-CB 4.08Å; F376-F419 AromaticContact CE2-CD2 3.98Å; F376-F419 HydrophobicContact CE2-CD2 3.98Å; F376-F419 HydrophobicContact CG-CB 4.11Å; F376-F419 AromaticContact CG-CD2 3.84Å; F376-F419 HydrophobicContact CG-CD2 3.84Å; F376-F419 HydrophobicContact CG-CG 4.39Å; F376-F419 HydrophobicContact CZ-CD2 4.41Å; F376-H422 HydrophobicContact CE2-CB 4.27Å; F376-H422 AromaticContact CE2-CD2 3.74Å; F376-H422 AromaticContact CE2-CG 3.92Å; F376-H422 HydrophobicContact CZ-CB 3.76Å; F376-H422 AromaticContact CZ-CG 3.84Å
377	A	95	Very high	94.1	Very high	0 Å²	0	20 Å²	20	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-65.8	-44.1	-179.5	0	0	0	0	0	112.3	L192 L195 V196 L373 W374 S380 C381	L192-A377 HydrophobicContact CD1-CB 3.89Å; L195-A377 HydrophobicContact CD2-CB 3.81Å; L195-A377 HydrophobicContact CG-CB 4.13Å; V196-A377 HydrophobicContact CG2-CB 3.76Å; L373-A377 WeakPolarHBondContact O-CB 3.43Å; L373-A377 PolarHBondContact O-N 3.08Å; W374-A377 PolarHBondContact O-N 2.75Å; A377-S380 PolarHBondContact O-N 2.82Å; A377-C381 PolarHBondContact O-N 2.83Å
378	S	95.6	Very high	94.2	Very high	11 Å²	11	15.9 Å²	15.9	8%	0.077	8%	0.083	C	C	.	.	H	α-helix	trans	-64.2	-43.2	178.3	-174.8	0	0	0	0	111.5	W374 S380 C381 E382	W374-S378 WeakPolarHBondContact O-CB 3.27Å; W374-S378 PolarHBondContact O-N 2.7Å; S378-S380 PolarHBondContact O-N 2.88Å; S378-C381 PolarHBondContact O-N 3.49Å; S378-E382 PolarHBondContact O-N 3.05Å
379	A	96.7	Very high	94.2	Very high	10 Å²	10	13.3 Å²	13.3	8%	0.083	7%	0.067	C	C	.	.	H	α-helix	trans	-60.1	-43.5	174.1	0	0	0	0	0	112.5	G357 L359 A375 E382 K383	G357-A379 VanDerWaalsContact O-CB 3.23Å; G357-A379 WeakPolarHBondContact O-CB 3.42Å; L359-A379 HydrophobicContact CB-CB 4.07Å; L359-A379 HydrophobicContact CD1-CB 4.42Å; A375-A379 WeakPolarHBondContact O-CB 3.19Å; A375-A379 PolarHBondContact O-N 2.84Å; A379-E382 PolarHBondContact O-N 3.15Å; A379-K383 WeakPolarHBondContact O-CB 2.93Å; A379-K383 PolarHBondContact O-N 3.42Å
380	S	95.7	Very high	94.1	Very high	2 Å²	2	14.7 Å²	14.7	1%	0.014	8%	0.076	C	C	.	.	H	α-helix	trans	-69.4	-38.1	177.3	-72.6	0	0	0	0	112.6	F376 A377 S378 K383 L384 E411 M415	F376-S380 PolarHBondContact O-N 3.26Å; F376-S380 PolarHBondContact O-OG 3.46Å; A377-S380 PolarHBondContact O-N 2.82Å; S378-S380 PolarHBondContact O-N 2.88Å; S380-K383 PolarHBondContact O-N 3.31Å; S380-L384 WeakPolarHBondContact O-CB 3.41Å; S380-L384 VanDerWaalsContact O-CG 3.29Å; S380-L384 WeakPolarHBondContact O-CG 3.49Å; S380-L384 PolarHBondContact O-N 2.94Å; S380-E411 PolarHBondContact OG-OE1 3.45Å; S380-M415 WeakPolarHBondContact OG-CB 3.42Å; S380-M415 VanDerWaalsContact OG-CG 3.27Å; S380-M415 WeakPolarHBondContact OG-CG 3.3Å
381	C	94.6	Very high	94.1	Very high	6 Å²	6	15.8 Å²	15.8	4%	0.041	8%	0.082	C	C	.	.	H	α-helix	trans	-57.4	-50.6	171	-87.7	0	0	0	0	111.6	L192 A377 S378 K383 L384 F385	L192-C381 HydrophobicContact CD2-CB 4.43Å; L192-C381 VanDerWaalsContact CG-SG 3.52Å; A377-C381 PolarHBondContact O-N 2.83Å; S378-C381 PolarHBondContact O-N 3.49Å; C381-K383 PolarHBondContact O-N 3.36Å; C381-L384 PolarHBondContact O-N 3.04Å; C381-F385 WeakPolarHBondContact O-CB 3.21Å; C381-F385 PolarHBondContact O-N 3.39Å
382	E	94	Very high	93.7	Very high	21 Å²	21	16.4 Å²	16.4	10%	0.098	9%	0.086	C	C	.	.	H	α-helix	trans	-63.7	-43	-178.9	-175	66	-161.1	0	0	110.9	R328 N332 S356 S378 A379 F385 I386	R328-E382 IonicContact CZ-OE1 2.76Å; R328-E382 IonicContact CZ-OE2 3.45Å; R328-E382 IonicContact NE-OE1 2.65Å; R328-E382 PolarHBondContact NE-OE1 2.94Å; R328-E382 VanDerWaalsContact NE-OE1 3.09Å; R328-E382 IonicContact NH2-OE1 2.85Å; R328-E382 PolarHBondContact NH2-OE1 3.15Å; R328-E382 IonicContact NH2-OE2 3.51Å; R328-E382 PolarHBondContact NH2-OE2 2.83Å; N332-E382 VanDerWaalsContact ND2-CG 3.28Å; N332-E382 WeakPolarHBondContact ND2-CG 3.34Å; N332-E382 PolarHBondContact ND2-OE1 2.98Å; S356-E382 WeakPolarHBondContact O-CG 3.29Å; S378-E382 PolarHBondContact O-N 3.05Å; A379-E382 PolarHBondContact O-N 3.15Å; E382-F385 PolarHBondContact O-N 3.41Å; E382-I386 HydrophobicContact CG-CG1 4.42Å; E382-I386 WeakPolarHBondContact O-CB 3.29Å; E382-I386 VanDerWaalsContact O-CG1 3.26Å; E382-I386 WeakPolarHBondContact O-CG1 3.46Å; E382-I386 PolarHBondContact O-N 3.3Å
383	K	94.2	Very high	93.3	Very high	91 Å²	91	20.7 Å²	20.7	40%	0.396	10%	0.102	S	C	.	.	H	α-helix	trans	-57.5	-51.4	174.7	177.8	179.8	171.3	-65	0	111.6	A379 S380 C381 F385 I386 D387 E411	A379-K383 WeakPolarHBondContact O-CB 2.93Å; A379-K383 PolarHBondContact O-N 3.42Å; S380-K383 PolarHBondContact O-N 3.31Å; C381-K383 PolarHBondContact O-N 3.36Å; K383-F385 VanDerWaalsContact C-N 3.29Å; K383-F385 PolarHBondContact O-N 2.93Å; K383-I386 PolarHBondContact O-N 3.21Å; K383-D387 WeakPolarHBondContact CG-OD2 3.5Å; K383-D387 IonicContact NZ-OD2 3.66Å; K383-D387 PolarHBondContact NZ-OD2 3.21Å; K383-D387 WeakPolarHBondContact O-CB 3.29Å; K383-D387 PolarHBondContact O-N 3.19Å; K383-E411 WeakPolarHBondContact CD-OE2 3.47Å; K383-E411 WeakPolarHBondContact CE-OE2 3.23Å; K383-E411 IonicContact NZ-OE2 3.8Å; K383-E411 PolarHBondContact NZ-OE2 3.48Å
384	L	94.8	Very high	92.9	Very high	2 Å²	2	27 Å²	27	1%	0.01	13%	0.133	C	C	.	.	H	α-helix	trans	-59.2	-42.9	-179.6	-74.2	171.1	0	0	0	111.7	F189 L192 S380 C381 D387 F388 F403 E411	F189-L384 HydrophobicContact CD2-CB 4Å; F189-L384 HydrophobicContact CD2-CD1 4.23Å; F189-L384 HydrophobicContact CE2-CB 4.26Å; L192-L384 HydrophobicContact CD2-CD1 4Å; S380-L384 WeakPolarHBondContact O-CB 3.41Å; S380-L384 VanDerWaalsContact O-CG 3.29Å; S380-L384 WeakPolarHBondContact O-CG 3.49Å; S380-L384 PolarHBondContact O-N 2.94Å; C381-L384 PolarHBondContact O-N 3.04Å; L384-D387 PolarHBondContact O-N 3.38Å; L384-F388 WeakPolarHBondContact O-CB 3.3Å; L384-F388 PolarHBondContact O-N 2.89Å; L384-F403 HydrophobicContact CB-CZ 4.28Å; L384-F403 HydrophobicContact CD2-CE1 4.06Å; L384-F403 HydrophobicContact CD2-CZ 3.6Å; L384-F403 VanDerWaalsContact O-CZ 3.32Å; L384-F403 WeakPolarHBondContact O-CZ 3.5Å; L384-E411 HydrophobicContact CD1-CB 4.25Å; L384-E411 HydrophobicContact CD1-CG 4.15Å; L384-E411 HydrophobicContact CD2-CB 3.75Å; L384-E411 HydrophobicContact CD2-CG 4.05Å; L384-E411 HydrophobicContact CG-CB 4.14Å; L384-E411 HydrophobicContact CG-CG 3.94Å
385	F	93.6	Very high	92.2	Very high	2 Å²	2	35.6 Å²	35.6	1%	0.009	17%	0.17	C	C	.	.	H	α-helix	trans	-64.8	-45.8	178.7	-179.7	-122.5	0	0	0	112.3	D175 I178 F179 M182 F189 L305 R328 C381 E382 K383 F388 L389	D175-F385 HydrophobicContact CB-CZ 4.27Å; D175-F385 WeakPolarHBondContact O-CZ 3.38Å; I178-F385 HydrophobicContact CG2-CE2 4.32Å; F179-F385 HydrophobicContact CB-CD2 4.31Å; F179-F385 HydrophobicContact CB-CE2 3.61Å; F179-F385 HydrophobicContact CB-CZ 3.95Å; F179-F385 HydrophobicContact CD2-CD1 4.32Å; F179-F385 AromaticContact CD2-CD2 3.7Å; F179-F385 HydrophobicContact CD2-CD2 3.7Å; F179-F385 HydrophobicContact CD2-CE1 4.35Å; F179-F385 AromaticContact CD2-CE2 3.76Å; F179-F385 HydrophobicContact CD2-CE2 3.76Å; F179-F385 AromaticContact CD2-CG 3.99Å; F179-F385 HydrophobicContact CD2-CG 3.99Å; F179-F385 HydrophobicContact CD2-CZ 4.07Å; F179-F385 HydrophobicContact CG-CD2 4.48Å; F179-F385 HydrophobicContact CG-CE2 4.19Å; M182-F385 HydrophobicContact SD-CD2 3.75Å; F189-F385 HydrophobicContact CE2-CB 4.28Å; F189-F385 HydrophobicContact CZ-CB 4.41Å; L305-F385 HydrophobicContact CD1-CE1 4.44Å; L305-F385 HydrophobicContact CD1-CZ 4.19Å; L305-F385 HydrophobicContact CD2-CD1 4.45Å; L305-F385 HydrophobicContact CD2-CE1 3.39Å; L305-F385 HydrophobicContact CD2-CZ 3.75Å; R328-F385 HydrophobicContact CG-CE1 4.05Å; C381-F385 WeakPolarHBondContact O-CB 3.21Å; C381-F385 PolarHBondContact O-N 3.39Å; E382-F385 PolarHBondContact O-N 3.41Å; K383-F385 VanDerWaalsContact C-N 3.29Å; K383-F385 PolarHBondContact O-N 2.93Å; F385-F388 PolarHBondContact O-N 3.35Å; F385-L389 HydrophobicContact CD1-CD1 3.88Å; F385-L389 HydrophobicContact CD2-CD1 4.32Å; F385-L389 HydrophobicContact CD2-CG 4.24Å; F385-L389 HydrophobicContact CE1-CD1 3.4Å; F385-L389 VanDerWaalsContact CE1-CD1 3.4Å; F385-L389 HydrophobicContact CE1-CG 4.28Å; F385-L389 HydrophobicContact CE2-CD1 3.89Å; F385-L389 HydrophobicContact CE2-CD2 4.21Å; F385-L389 HydrophobicContact CE2-CG 3.85Å; F385-L389 HydrophobicContact CG-CD1 4.32Å; F385-L389 HydrophobicContact CZ-CD1 3.42Å; F385-L389 VanDerWaalsContact CZ-CD1 3.42Å; F385-L389 HydrophobicContact CZ-CD2 4.2Å; F385-L389 HydrophobicContact CZ-CG 3.89Å; F385-L389 WeakPolarHBondContact O-CB 2.83Å; F385-L389 WeakPolarHBondContact O-CG 3.47Å; F385-L389 PolarHBondContact O-N 2.85Å
386	I	93.3	Very high	91.5	Very high	20 Å²	20	36.4 Å²	36.4	10%	0.103	18%	0.177	C	C	.	.	H	α-helix	trans	-66.3	-38.7	178	-64.7	-64.2	0	0	0	111.9	R328 N332 E382 K383 L389 T390	R328-I386 HydrophobicContact CG-CD1 3.8Å; N332-I386 HydrophobicContact CB-CD1 3.74Å; N332-I386 HydrophobicContact CB-CG1 4.17Å; E382-I386 HydrophobicContact CG-CG1 4.42Å; E382-I386 WeakPolarHBondContact O-CB 3.29Å; E382-I386 VanDerWaalsContact O-CG1 3.26Å; E382-I386 WeakPolarHBondContact O-CG1 3.46Å; E382-I386 PolarHBondContact O-N 3.3Å; K383-I386 PolarHBondContact O-N 3.21Å; I386-L389 HydrophobicContact CD1-CD1 4.4Å; I386-T390 VanDerWaalsContact O-CB 3.31Å; I386-T390 WeakPolarHBondContact O-CB 3.45Å; I386-T390 PolarHBondContact O-N 2.99Å; I386-T390 PolarHBondContact O-OG1 2.89Å
387	D	92.7	Very high	90.5	Very high	60 Å²	60	40.7 Å²	40.7	32%	0.321	21%	0.206	S	C	.	.	H	α-helix	trans	-63.3	-47.7	176	-72.8	-18.1	0	0	0	110.2	K383 L384 T390 L391 F403	K383-D387 WeakPolarHBondContact CG-OD2 3.5Å; K383-D387 IonicContact NZ-OD2 3.66Å; K383-D387 PolarHBondContact NZ-OD2 3.21Å; K383-D387 WeakPolarHBondContact O-CB 3.29Å; K383-D387 PolarHBondContact O-N 3.19Å; L384-D387 PolarHBondContact O-N 3.38Å; D387-T390 WeakPolarHBondContact O-CB 3.27Å; D387-T390 PolarHBondContact O-N 3.25Å; D387-L391 WeakPolarHBondContact O-CG 3.34Å; D387-L391 PolarHBondContact O-N 3.38Å; D387-F403 HydrophobicContact CB-CE2 3.72Å; D387-F403 HydrophobicContact CB-CZ 4.02Å
388	F	92	Very high	89.8	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-63	-46.6	177.4	-170.6	-105.1	0	0	0	112.4	L169 I178 Y181 M182 L384 F385 T390 L391 L392 T400 F403 L404	L169-F388 HydrophobicContact CD1-CE1 4.45Å; L169-F388 HydrophobicContact CD1-CZ 3.92Å; I178-F388 HydrophobicContact CG2-CD1 3.73Å; I178-F388 HydrophobicContact CG2-CE1 3.79Å; Y181-F388 HydrophobicContact CD1-CE1 4.42Å; Y181-F388 HydrophobicContact CD1-CZ 4.26Å; Y181-F388 HydrophobicContact CE1-CZ 4.28Å; M182-F388 HydrophobicContact CE-CB 3.76Å; M182-F388 HydrophobicContact CE-CD1 4.3Å; M182-F388 HydrophobicContact CE-CD2 4.48Å; M182-F388 HydrophobicContact CE-CG 3.96Å; M182-F388 HydrophobicContact CG-CD1 3.51Å; M182-F388 HydrophobicContact CG-CE1 3.58Å; M182-F388 HydrophobicContact CG-CG 4.06Å; M182-F388 HydrophobicContact CG-CZ 4.21Å; M182-F388 HydrophobicContact SD-CB 3.61Å; M182-F388 HydrophobicContact SD-CD1 3.33Å; M182-F388 WeakPolarHBondContact SD-CD1 3.41Å; M182-F388 HydrophobicContact SD-CD2 4.5Å; M182-F388 HydrophobicContact SD-CE1 4.07Å; M182-F388 HydrophobicContact SD-CG 3.58Å; M182-F388 VanDerWaalsContact SD-CG 3.58Å; L384-F388 WeakPolarHBondContact O-CB 3.3Å; L384-F388 PolarHBondContact O-N 2.89Å; F385-F388 PolarHBondContact O-N 3.35Å; F388-T390 VanDerWaalsContact C-N 3.25Å; F388-T390 PolarHBondContact O-N 3.42Å; F388-L391 PolarHBondContact O-N 3.38Å; F388-L392 HydrophobicContact CD1-CD1 3.64Å; F388-L392 HydrophobicContact CD1-CG 4.38Å; F388-L392 HydrophobicContact CE1-CD1 3.31Å; F388-L392 HydrophobicContact CE1-CG 4.14Å; F388-L392 HydrophobicContact CZ-CD1 4.01Å; F388-L392 HydrophobicContact CZ-CG 4.45Å; F388-L392 PolarHBondContact O-N 3.04Å; F388-T400 HydrophobicContact CD2-CG2 4.19Å; F388-T400 HydrophobicContact CE1-CG2 4.49Å; F388-T400 HydrophobicContact CE2-CG2 3.36Å; F388-T400 HydrophobicContact CZ-CG2 3.55Å; F388-F403 HydrophobicContact CB-CD1 4.2Å; F388-F403 HydrophobicContact CB-CE1 3.9Å; F388-F403 HydrophobicContact CB-CZ 4.15Å; F388-F403 HydrophobicContact CD2-CB 4.1Å; F388-F403 AromaticContact CD2-CD1 3.46Å; F388-F403 HydrophobicContact CD2-CD1 3.46Å; F388-F403 VanDerWaalsContact CD2-CD1 3.46Å; F388-F403 HydrophobicContact CD2-CE1 4.02Å; F388-F403 AromaticContact CD2-CG 3.85Å; F388-F403 HydrophobicContact CD2-CG 3.85Å; F388-F403 HydrophobicContact CE2-CB 4.45Å; F388-F403 HydrophobicContact CE2-CD1 4.24Å; F388-F403 HydrophobicContact CG-CD1 4.26Å; F388-F403 HydrophobicContact CG-CE1 4.39Å; F388-L404 HydrophobicContact CE2-CD2 3.71Å; F388-L404 HydrophobicContact CE2-CG 4.2Å; F388-L404 HydrophobicContact CZ-CD2 3.95Å
389	L	89.9	Confident	89.2	Confident	1 Å²	1	47.8 Å²	47.8	1%	0.005	25%	0.248	C	C	.	.	H	α-helix	trans	-55.7	-42.7	172.7	-80.5	175.5	0	0	0	111.2	D175 I178 R328 R329 F385 I386 L392 R393	D175-L389 HydrophobicContact CB-CD2 4.48Å; I178-L389 HydrophobicContact CB-CD2 4.12Å; I178-L389 HydrophobicContact CD1-CD2 3.59Å; I178-L389 HydrophobicContact CG1-CD2 4.46Å; I178-L389 HydrophobicContact CG2-CD2 3.8Å; R328-L389 HydrophobicContact CB-CD1 4.24Å; R328-L389 HydrophobicContact CG-CD1 4.13Å; R329-L389 HydrophobicContact CG-CB 4.45Å; F385-L389 HydrophobicContact CD1-CD1 3.88Å; F385-L389 HydrophobicContact CD2-CD1 4.32Å; F385-L389 HydrophobicContact CD2-CG 4.24Å; F385-L389 HydrophobicContact CE1-CD1 3.4Å; F385-L389 VanDerWaalsContact CE1-CD1 3.4Å; F385-L389 HydrophobicContact CE1-CG 4.28Å; F385-L389 HydrophobicContact CE2-CD1 3.89Å; F385-L389 HydrophobicContact CE2-CD2 4.21Å; F385-L389 HydrophobicContact CE2-CG 3.85Å; F385-L389 HydrophobicContact CG-CD1 4.32Å; F385-L389 HydrophobicContact CZ-CD1 3.42Å; F385-L389 VanDerWaalsContact CZ-CD1 3.42Å; F385-L389 HydrophobicContact CZ-CD2 4.2Å; F385-L389 HydrophobicContact CZ-CG 3.89Å; F385-L389 WeakPolarHBondContact O-CB 2.83Å; F385-L389 WeakPolarHBondContact O-CG 3.47Å; F385-L389 PolarHBondContact O-N 2.85Å; I386-L389 HydrophobicContact CD1-CD1 4.4Å; L389-L392 PolarHBondContact O-N 3.14Å; L389-R393 WeakPolarHBondContact O-CB 3.32Å; L389-R393 WeakPolarHBondContact O-CG 3.1Å; L389-R393 PolarHBondContact O-N 3.04Å
390	T	90.2	Very high	88.5	Confident	34 Å²	34	47.6 Å²	47.6	21%	0.209	25%	0.245	C	C	.	.	H	α-helix	trans	-63.4	-46	179.8	-63.3	0	0	0	0	111.4	R329 I386 D387 F388 L392 R393 M394	R329-T390 PolarHBondContact NE-OG1 3.22Å; R329-T390 VanDerWaalsContact NE-OG1 3.16Å; I386-T390 VanDerWaalsContact O-CB 3.31Å; I386-T390 WeakPolarHBondContact O-CB 3.45Å; I386-T390 PolarHBondContact O-N 2.99Å; I386-T390 PolarHBondContact O-OG1 2.89Å; D387-T390 WeakPolarHBondContact O-CB 3.27Å; D387-T390 PolarHBondContact O-N 3.25Å; F388-T390 VanDerWaalsContact C-N 3.25Å; F388-T390 PolarHBondContact O-N 3.42Å; T390-L392 PolarHBondContact O-N 3.33Å; T390-R393 PolarHBondContact O-N 2.9Å; T390-M394 HydrophobicContact CG2-CG 4.45Å; T390-M394 HydrophobicContact CG2-SD 3.89Å; T390-M394 WeakPolarHBondContact O-CB 3.41Å; T390-M394 VanDerWaalsContact O-CG 3.23Å; T390-M394 WeakPolarHBondContact O-CG 3.43Å; T390-M394 PolarHBondContact O-N 3.01Å
391	L	89.3	Confident	87.8	Confident	41 Å²	41	50.6 Å²	50.6	22%	0.215	27%	0.27	C	S	.	.	H	α-helix	trans	-60.6	-44.2	176.9	-69.1	174.6	0	0	0	112.3	D387 F388 M394 K395 A396 E399 F403	D387-L391 WeakPolarHBondContact O-CG 3.34Å; D387-L391 PolarHBondContact O-N 3.38Å; F388-L391 PolarHBondContact O-N 3.38Å; L391-M394 PolarHBondContact O-N 3.44Å; L391-K395 PolarHBondContact O-N 3.46Å; L391-A396 PolarHBondContact O-N 3.31Å; L391-A396 VanDerWaalsContact O-N 3.16Å; L391-E399 HydrophobicContact CD1-CB 4.42Å; L391-E399 HydrophobicContact CD2-CB 3.98Å; L391-F403 HydrophobicContact CD1-CB 4.11Å; L391-F403 HydrophobicContact CD1-CD2 3.55Å; L391-F403 HydrophobicContact CD1-CE2 4.34Å; L391-F403 HydrophobicContact CD1-CG 4.15Å
392	L	86.9	Confident	87.3	Confident	32 Å²	32	57 Å²	57	17%	0.168	30%	0.297	C	S	.	.	H	α-helix	trans	-61.6	-48.8	177.1	-84.5	174.7	0	0	0	112.4	L169 I178 F388 L389 T390 M394 K395 T400	L169-L392 HydrophobicContact CB-CD2 3.82Å; L169-L392 HydrophobicContact CD1-CD1 4.35Å; L169-L392 HydrophobicContact CD1-CD2 3.71Å; L169-L392 HydrophobicContact CD2-CD1 4.22Å; L169-L392 HydrophobicContact CD2-CD2 4.48Å; L169-L392 HydrophobicContact CG-CD2 4.19Å; I178-L392 HydrophobicContact CD1-CD1 4.09Å; I178-L392 HydrophobicContact CG1-CD1 4.2Å; I178-L392 HydrophobicContact CG2-CD1 3.58Å; F388-L392 HydrophobicContact CD1-CD1 3.64Å; F388-L392 HydrophobicContact CD1-CG 4.38Å; F388-L392 HydrophobicContact CE1-CD1 3.31Å; F388-L392 HydrophobicContact CE1-CG 4.14Å; F388-L392 HydrophobicContact CZ-CD1 4.01Å; F388-L392 HydrophobicContact CZ-CG 4.45Å; F388-L392 PolarHBondContact O-N 3.04Å; L389-L392 PolarHBondContact O-N 3.14Å; T390-L392 PolarHBondContact O-N 3.33Å; L392-M394 PolarHBondContact O-N 3.23Å; L392-K395 WeakPolarHBondContact O-CA 3.01Å; L392-K395 PolarHBondContact O-N 3.39Å; L392-T400 HydrophobicContact CD2-CG2 3.63Å; L392-T400 HydrophobicContact CG-CG2 3.86Å
393	R	86.4	Confident	87	Confident	89 Å²	89	56.7 Å²	56.7	34%	0.336	30%	0.296	S	S	.	.	H	α-helix	trans	-70.1	-23.2	-179.5	-59.6	-62.8	-177.9	-151.1	-1	112.1	G171 M173 D175 I178 L389 T390 K395	G171-R393 PolarHBondContact O-NH1 2.91Å; M173-R393 PolarHBondContact O-NH1 2.88Å; M173-R393 PolarHBondContact O-NH2 3.07Å; D175-R393 IonicContact OD1-CZ 3.77Å; D175-R393 IonicContact OD1-NH2 3.76Å; D175-R393 PolarHBondContact OD1-NH2 3.12Å; I178-R393 VanDerWaalsContact CD1-NH2 3.33Å; L389-R393 WeakPolarHBondContact O-CB 3.32Å; L389-R393 WeakPolarHBondContact O-CG 3.1Å; L389-R393 PolarHBondContact O-N 3.04Å; T390-R393 PolarHBondContact O-N 2.9Å; R393-K395 PolarHBondContact O-N 3.39Å
394	M	86.2	Confident	86.5	Confident	132 Å²	132	53.7 Å²	53.7	65%	0.65	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77	-1.7	168.7	-72.2	-179.3	70.5	0	0	113.6	T390 L391 L392 A396	T390-M394 HydrophobicContact CG2-CG 4.45Å; T390-M394 HydrophobicContact CG2-SD 3.89Å; T390-M394 WeakPolarHBondContact O-CB 3.41Å; T390-M394 VanDerWaalsContact O-CG 3.23Å; T390-M394 WeakPolarHBondContact O-CG 3.43Å; T390-M394 PolarHBondContact O-N 3.01Å; L391-M394 PolarHBondContact O-N 3.44Å; L392-M394 PolarHBondContact O-N 3.23Å; M394-A396 VanDerWaalsContact C-N 3.33Å; M394-A396 PolarHBondContact O-N 3.27Å
395	K	81.2	Confident	85.8	Confident	183 Å²	183	56.2 Å²	56.2	80%	0.796	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.5	48.1	-177.1	-60.2	-177.4	176.8	-178.4	0	111.9	L391 L392 R393 P397	L391-K395 PolarHBondContact O-N 3.46Å; L392-K395 WeakPolarHBondContact O-CA 3.01Å; L392-K395 PolarHBondContact O-N 3.39Å; R393-K395 PolarHBondContact O-N 3.39Å; K395-P397 WeakPolarHBondContact O-CD 3.22Å
396	A	81.8	Confident	85.4	Confident	18 Å²	18	62.6 Å²	62.6	15%	0.149	33%	0.327	C	S	.	.			trans	-106.5	73.9	-179.5	0	0	0	0	0	110.3	L391 M394 A398 E399 T400	L391-A396 PolarHBondContact O-N 3.31Å; L391-A396 VanDerWaalsContact O-N 3.16Å; M394-A396 VanDerWaalsContact C-N 3.33Å; M394-A396 PolarHBondContact O-N 3.27Å; A396-A398 PolarHBondContact O-N 2.99Å; A396-E399 WeakPolarHBondContact CA-OE2 3.46Å; A396-E399 HydrophobicContact CB-CB 4.08Å; A396-E399 HydrophobicContact CB-CG 4.3Å; A396-E399 WeakPolarHBondContact CB-OE2 3.42Å; A396-E399 PolarHBondContact O-N 3.24Å; A396-T400 WeakPolarHBondContact O-CB 3.25Å; A396-T400 PolarHBondContact O-N 3.28Å; A396-T400 PolarHBondContact O-OG1 3.39Å
397	P	76.5	Confident	85.2	Confident	100 Å²	100	63.2 Å²	63.2	65%	0.649	34%	0.336	S	S	*	.	H	α-helix	trans	-68.2	-32.6	-169.5	27.1	-36.1	0	0	0	113.2	K395 A401	K395-P397 WeakPolarHBondContact O-CD 3.22Å; P397-A401 WeakPolarHBondContact O-CB 3.28Å; P397-A401 PolarHBondContact O-N 2.96Å
398	A	79.4	Confident	85	Confident	58 Å²	58	60.3 Å²	60.3	48%	0.479	32%	0.32	S	S	.	.	H	α-helix	trans	-68.8	-40.5	178.5	0	0	0	0	0	111.2	A396 K402	A396-A398 PolarHBondContact O-N 2.99Å; A398-K402 WeakPolarHBondContact O-CG 3.23Å; A398-K402 PolarHBondContact O-N 3.41Å; A398-K402 VanDerWaalsContact O-N 3.09Å
399	E	83.5	Confident	84.8	Confident	101 Å²	101	63.8 Å²	63.8	47%	0.472	34%	0.335	S	S	.	.	H	α-helix	trans	-70.6	-40.4	176.9	-64.1	74.9	-171.1	0	0	111	L391 A396 A401 K402 F403	L391-E399 HydrophobicContact CD1-CB 4.42Å; L391-E399 HydrophobicContact CD2-CB 3.98Å; A396-E399 WeakPolarHBondContact CA-OE2 3.46Å; A396-E399 HydrophobicContact CB-CB 4.08Å; A396-E399 HydrophobicContact CB-CG 4.3Å; A396-E399 WeakPolarHBondContact CB-OE2 3.42Å; A396-E399 PolarHBondContact O-N 3.24Å; E399-A401 VanDerWaalsContact C-N 3.35Å; E399-A401 PolarHBondContact O-N 3.24Å; E399-K402 PolarHBondContact O-N 3.25Å; E399-F403 WeakPolarHBondContact O-CB 3.38Å; E399-F403 PolarHBondContact O-N 3.4Å
400	T	82.9	Confident	84.9	Confident	6 Å²	6	66.5 Å²	66.5	4%	0.037	36%	0.358	C	S	.	.	H	α-helix	trans	-60.3	-44.4	174.4	-56.3	0	0	0	0	111.1	L169 F388 L392 A396 F403	L169-T400 HydrophobicContact CD1-CG2 3.77Å; F388-T400 HydrophobicContact CD2-CG2 4.19Å; F388-T400 HydrophobicContact CE1-CG2 4.49Å; F388-T400 HydrophobicContact CE2-CG2 3.36Å; F388-T400 HydrophobicContact CZ-CG2 3.55Å; L392-T400 HydrophobicContact CD2-CG2 3.63Å; L392-T400 HydrophobicContact CG-CG2 3.86Å; A396-T400 WeakPolarHBondContact O-CB 3.25Å; A396-T400 PolarHBondContact O-N 3.28Å; A396-T400 PolarHBondContact O-OG1 3.39Å; T400-F403 WeakPolarHBondContact O-CB 3.24Å; T400-F403 PolarHBondContact O-N 3.47Å
401	A	81	Confident	85	Confident	65 Å²	65	65.8 Å²	65.8	54%	0.537	35%	0.352	S	S	.	.	H	α-helix	trans	-66.5	-38.9	177.9	0	0	0	0	0	112.5	P397 E399 F403	P397-A401 WeakPolarHBondContact O-CB 3.28Å; P397-A401 PolarHBondContact O-N 2.96Å; E399-A401 VanDerWaalsContact C-N 3.35Å; E399-A401 PolarHBondContact O-N 3.24Å; A401-F403 VanDerWaalsContact C-N 3.27Å; A401-F403 PolarHBondContact O-N 3.14Å
402	K	83.3	Confident	85	Confident	140 Å²	140	64 Å²	64	61%	0.609	34%	0.343	S	S	*	.	H	α-helix	trans	-69.4	-24.1	173.5	-74.4	180	179.5	-176.1	0	113.2	A398 E399 E406	A398-K402 WeakPolarHBondContact O-CG 3.23Å; A398-K402 PolarHBondContact O-N 3.41Å; A398-K402 VanDerWaalsContact O-N 3.09Å; E399-K402 PolarHBondContact O-N 3.25Å; K402-E406 WeakPolarHBondContact O-CB 3.4Å
403	F	88.5	Confident	85.2	Confident	15 Å²	15	67.1 Å²	67.1	7%	0.066	36%	0.355	C	S	.	.	H	α-helix	trans	-66.6	-43.6	-179.4	-171.9	-80.4	0	0	0	111.4	M182 L384 D387 F388 L391 E399 T400 A401 D405 E406 A407	M182-F403 HydrophobicContact CE-CE1 4Å; L384-F403 HydrophobicContact CB-CZ 4.28Å; L384-F403 HydrophobicContact CD2-CE1 4.06Å; L384-F403 HydrophobicContact CD2-CZ 3.6Å; L384-F403 VanDerWaalsContact O-CZ 3.32Å; L384-F403 WeakPolarHBondContact O-CZ 3.5Å; D387-F403 HydrophobicContact CB-CE2 3.72Å; D387-F403 HydrophobicContact CB-CZ 4.02Å; F388-F403 HydrophobicContact CB-CD1 4.2Å; F388-F403 HydrophobicContact CB-CE1 3.9Å; F388-F403 HydrophobicContact CB-CZ 4.15Å; F388-F403 HydrophobicContact CD2-CB 4.1Å; F388-F403 AromaticContact CD2-CD1 3.46Å; F388-F403 HydrophobicContact CD2-CD1 3.46Å; F388-F403 VanDerWaalsContact CD2-CD1 3.46Å; F388-F403 HydrophobicContact CD2-CE1 4.02Å; F388-F403 AromaticContact CD2-CG 3.85Å; F388-F403 HydrophobicContact CD2-CG 3.85Å; F388-F403 HydrophobicContact CE2-CB 4.45Å; F388-F403 HydrophobicContact CE2-CD1 4.24Å; F388-F403 HydrophobicContact CG-CD1 4.26Å; F388-F403 HydrophobicContact CG-CE1 4.39Å; L391-F403 HydrophobicContact CD1-CB 4.11Å; L391-F403 HydrophobicContact CD1-CD2 3.55Å; L391-F403 HydrophobicContact CD1-CE2 4.34Å; L391-F403 HydrophobicContact CD1-CG 4.15Å; E399-F403 WeakPolarHBondContact O-CB 3.38Å; E399-F403 PolarHBondContact O-N 3.4Å; T400-F403 WeakPolarHBondContact O-CB 3.24Å; T400-F403 PolarHBondContact O-N 3.47Å; A401-F403 VanDerWaalsContact C-N 3.27Å; A401-F403 PolarHBondContact O-N 3.14Å; F403-D405 PolarHBondContact O-N 3.1Å; F403-E406 PolarHBondContact O-N 3.18Å; F403-A407 HydrophobicContact CB-CB 4.37Å; F403-A407 HydrophobicContact CD1-CB 4.13Å; F403-A407 HydrophobicContact CD2-CB 3.47Å; F403-A407 VanDerWaalsContact CD2-CB 3.47Å; F403-A407 HydrophobicContact CE1-CB 4.29Å; F403-A407 HydrophobicContact CE2-CB 3.65Å; F403-A407 HydrophobicContact CG-CB 3.74Å; F403-A407 HydrophobicContact CZ-CB 4.07Å; F403-A407 WeakPolarHBondContact O-CB 3.35Å; F403-A407 PolarHBondContact O-N 2.95Å
404	L	83.1	Confident	85.5	Confident	28 Å²	28	66.1 Å²	66.1	15%	0.147	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.2	127.1	-179.5	-61.6	174.8	0	0	0	109.7	Y181 D186 F388 E406	Y181-L404 HydrophobicContact CE1-CD1 4.22Å; Y181-L404 HydrophobicContact CE1-CD2 4.37Å; D186-L404 HydrophobicContact CB-CD2 3.88Å; F388-L404 HydrophobicContact CE2-CD2 3.71Å; F388-L404 HydrophobicContact CE2-CG 4.2Å; F388-L404 HydrophobicContact CZ-CD2 3.95Å; L404-E406 PolarHBondContact O-N 3.4Å
405	D	79.6	Confident	85.9	Confident	56 Å²	56	59.8 Å²	59.8	30%	0.299	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.3	-50.3	-172.6	-65.6	-25.9	0	0	0	115.4	D186 N187 F403 F409	D186-D405 PolarHBondContact OD2-N 3.22Å; N187-D405 WeakPolarHBondContact CB-OD1 3.33Å; N187-D405 PolarHBondContact N-OD1 3.44Å; N187-D405 PolarHBondContact ND2-OD1 3.31Å; N187-D405 PolarHBondContact ND2-OD2 3.49Å; F403-D405 PolarHBondContact O-N 3.1Å; D405-F409 WeakPolarHBondContact O-CA 3.46Å; D405-F409 WeakPolarHBondContact O-CB 3.4Å; D405-F409 PolarHBondContact O-N 3.09Å
406	E	86.8	Confident	86.3	Confident	135 Å²	135	51.1 Å²	51.1	63%	0.631	29%	0.287	S	S	*	.	H	α-helix	trans	-66.4	-50.4	-172.4	-56.5	-177.7	-175.2	0	0	112.6	K402 F403 L404 A410	K402-E406 WeakPolarHBondContact O-CB 3.4Å; F403-E406 PolarHBondContact O-N 3.18Å; L404-E406 PolarHBondContact O-N 3.4Å; E406-A410 WeakPolarHBondContact O-CB 3.45Å; E406-A410 PolarHBondContact O-N 3.44Å; E406-A410 VanDerWaalsContact O-N 3.09Å
407	A	89.2	Confident	86.7	Confident	33 Å²	33	54.9 Å²	54.9	27%	0.273	30%	0.302	S	S	.	.	H	α-helix	trans	-71.1	-40.2	-179.6	0	0	0	0	0	110.9	F403 A410 E411	F403-A407 HydrophobicContact CB-CB 4.37Å; F403-A407 HydrophobicContact CD1-CB 4.13Å; F403-A407 HydrophobicContact CD2-CB 3.47Å; F403-A407 VanDerWaalsContact CD2-CB 3.47Å; F403-A407 HydrophobicContact CE1-CB 4.29Å; F403-A407 HydrophobicContact CE2-CB 3.65Å; F403-A407 HydrophobicContact CG-CB 3.74Å; F403-A407 HydrophobicContact CZ-CB 4.07Å; F403-A407 WeakPolarHBondContact O-CB 3.35Å; F403-A407 PolarHBondContact O-N 2.95Å; A407-A410 PolarHBondContact O-N 3.5Å; A407-E411 WeakPolarHBondContact O-CB 3.48Å; A407-E411 PolarHBondContact O-N 2.87Å
408	S	88.2	Confident	87.5	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-62.8	-41.4	176.3	-66.5	0	0	0	0	112.2	D186 Q412	D186-S408 VanDerWaalsContact CG-OG 3.32Å; D186-S408 VanDerWaalsContact OD1-CB 3.29Å; D186-S408 WeakPolarHBondContact OD1-CB 3.13Å; D186-S408 PolarHBondContact OD1-OG 2.98Å; D186-S408 WeakPolarHBondContact OD2-CB 3.49Å; D186-S408 PolarHBondContact OD2-OG 3.46Å; S408-Q412 VanDerWaalsContact O-CB 3.26Å; S408-Q412 WeakPolarHBondContact O-CB 3.24Å; S408-Q412 PolarHBondContact O-N 2.82Å
409	F	88	Confident	88.2	Confident	73 Å²	73	51.5 Å²	51.5	32%	0.32	26%	0.264	S	S	.	.	H	α-helix	trans	-64.2	-45.6	174.2	-175.7	-120.3	0	0	0	112.1	K188 D405 E411 Q412 K413	K188-F409 HydrophobicContact CD-CD2 4.1Å; K188-F409 HydrophobicContact CG-CB 4.01Å; K188-F409 HydrophobicContact CG-CD2 4.29Å; D405-F409 WeakPolarHBondContact O-CA 3.46Å; D405-F409 WeakPolarHBondContact O-CB 3.4Å; D405-F409 PolarHBondContact O-N 3.09Å; F409-E411 PolarHBondContact O-N 3.45Å; F409-Q412 PolarHBondContact O-N 2.89Å; F409-K413 WeakPolarHBondContact O-CB 3.42Å; F409-K413 PolarHBondContact O-N 3.15Å
410	A	91.4	Very high	88.4	Confident	58 Å²	58	49.7 Å²	49.7	48%	0.479	26%	0.257	S	S	.	.	H	α-helix	trans	-60.7	-44.9	178.8	0	0	0	0	0	111.7	E406 A407 D414	E406-A410 WeakPolarHBondContact O-CB 3.45Å; E406-A410 PolarHBondContact O-N 3.44Å; E406-A410 VanDerWaalsContact O-N 3.09Å; A407-A410 PolarHBondContact O-N 3.5Å; A410-D414 WeakPolarHBondContact O-CB 3.48Å; A410-D414 PolarHBondContact O-N 3.11Å
411	E	92.7	Very high	88.8	Confident	19 Å²	19	55 Å²	55	9%	0.089	29%	0.285	C	S	.	.	H	α-helix	trans	-65.2	-45.7	175.7	179	65.6	-147.5	0	0	112	S380 K383 L384 A407 F409 K413 D414 M415 R418	S380-E411 PolarHBondContact OG-OE1 3.45Å; K383-E411 WeakPolarHBondContact CD-OE2 3.47Å; K383-E411 WeakPolarHBondContact CE-OE2 3.23Å; K383-E411 IonicContact NZ-OE2 3.8Å; K383-E411 PolarHBondContact NZ-OE2 3.48Å; L384-E411 HydrophobicContact CD1-CB 4.25Å; L384-E411 HydrophobicContact CD1-CG 4.15Å; L384-E411 HydrophobicContact CD2-CB 3.75Å; L384-E411 HydrophobicContact CD2-CG 4.05Å; L384-E411 HydrophobicContact CG-CB 4.14Å; L384-E411 HydrophobicContact CG-CG 3.94Å; A407-E411 WeakPolarHBondContact O-CB 3.48Å; A407-E411 PolarHBondContact O-N 2.87Å; F409-E411 PolarHBondContact O-N 3.45Å; E411-K413 VanDerWaalsContact C-N 3.31Å; E411-K413 PolarHBondContact O-N 3.48Å; E411-D414 PolarHBondContact O-N 3.06Å; E411-M415 WeakPolarHBondContact O-CB 3.37Å; E411-M415 PolarHBondContact O-N 3.18Å; E411-R418 IonicContact OE1-NH2 3.55Å; E411-R418 PolarHBondContact OE1-NH2 2.92Å
412	Q	89.4	Confident	89.3	Confident	2 Å²	2	53.7 Å²	53.7	1%	0.009	27%	0.267	C	S	.	.	H	α-helix	trans	-57.9	-46.2	178.6	-173.8	-169.9	42	0	0	110.4	E191 S408 F409 M415 F416 N444	E191-Q412 PolarHBondContact OE2-NE2 3.01Å; S408-Q412 VanDerWaalsContact O-CB 3.26Å; S408-Q412 WeakPolarHBondContact O-CB 3.24Å; S408-Q412 PolarHBondContact O-N 2.82Å; F409-Q412 PolarHBondContact O-N 2.89Å; Q412-M415 PolarHBondContact O-N 3.27Å; Q412-F416 HydrophobicContact CG-CD2 3.86Å; Q412-F416 HydrophobicContact CG-CE2 3.7Å; Q412-F416 WeakPolarHBondContact O-CD2 3.31Å; Q412-F416 PolarHBondContact O-N 3.43Å; Q412-N444 PolarHBondContact NE2-OD1 3.35Å; Q412-N444 VanDerWaalsContact NE2-OD1 3.08Å
413	K	89.8	Confident	89.6	Confident	99 Å²	99	48 Å²	48	43%	0.43	25%	0.245	S	C	.	.	H	α-helix	trans	-62.2	-47.6	177.8	-175.7	176.4	-178.7	176	0	112.3	F409 E411 F416 Q417 L445	F409-K413 WeakPolarHBondContact O-CB 3.42Å; F409-K413 PolarHBondContact O-N 3.15Å; E411-K413 VanDerWaalsContact C-N 3.31Å; E411-K413 PolarHBondContact O-N 3.48Å; K413-F416 PolarHBondContact O-N 2.87Å; K413-Q417 WeakPolarHBondContact O-CB 3.31Å; K413-Q417 VanDerWaalsContact O-CG 3.28Å; K413-Q417 WeakPolarHBondContact O-CG 3.45Å; K413-Q417 PolarHBondContact O-N 3.22Å; K413-L445 HydrophobicContact CB-CD2 4.32Å; K413-L445 HydrophobicContact CG-CD2 3.97Å
414	D	92.9	Very high	89.4	Confident	67 Å²	67	50.4 Å²	50.4	36%	0.358	27%	0.267	S	S	.	.	H	α-helix	trans	-62.5	-44.3	177.6	175.6	73.9	0	0	0	111.8	A410 E411 F416 Q417 R418	A410-D414 WeakPolarHBondContact O-CB 3.48Å; A410-D414 PolarHBondContact O-N 3.11Å; E411-D414 PolarHBondContact O-N 3.06Å; D414-F416 PolarHBondContact O-N 3.18Å; D414-Q417 PolarHBondContact O-N 3.37Å; D414-R418 WeakPolarHBondContact O-CG 3.4Å; D414-R418 PolarHBondContact O-N 3.02Å; D414-R418 IonicContact OD1-NE 2.66Å; D414-R418 IonicContact OD2-CZ 3.74Å; D414-R418 IonicContact OD2-NE 2.74Å; D414-R418 PolarHBondContact OD2-NE 2.8Å; D414-R418 IonicContact OD2-NH2 3.62Å; D414-R418 PolarHBondContact OD2-NH2 3.02Å
415	M	93.8	Very high	89.6	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-56.6	-51.2	176.4	179.7	-78.9	-67.7	0	0	111.4	L192 F376 S380 E411 Q412 Q417 R418 F419	L192-M415 HydrophobicContact CD1-CE 3.58Å; F376-M415 HydrophobicContact CB-CG 4.01Å; F376-M415 HydrophobicContact CB-SD 3.78Å; F376-M415 HydrophobicContact CD1-CG 4.34Å; S380-M415 WeakPolarHBondContact OG-CB 3.42Å; S380-M415 VanDerWaalsContact OG-CG 3.27Å; S380-M415 WeakPolarHBondContact OG-CG 3.3Å; E411-M415 WeakPolarHBondContact O-CB 3.37Å; E411-M415 PolarHBondContact O-N 3.18Å; Q412-M415 PolarHBondContact O-N 3.27Å; M415-Q417 PolarHBondContact O-N 3.37Å; M415-R418 PolarHBondContact O-N 3.4Å; M415-F419 WeakPolarHBondContact O-CB 3.46Å; M415-F419 PolarHBondContact O-N 3.49Å; M415-F419 HydrophobicContact SD-CB 4.48Å
416	F	91.2	Very high	90	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-65.3	-37.9	179.1	-82.6	-64.9	0	0	0	112.4	L195 L373 Q412 K413 D414 F419 I420 L441 N444 L445	L195-F416 HydrophobicContact CD2-CE1 4.2Å; L195-F416 HydrophobicContact CD2-CZ 3.65Å; L373-F416 HydrophobicContact CD1-CE1 4.03Å; Q412-F416 HydrophobicContact CG-CD2 3.86Å; Q412-F416 HydrophobicContact CG-CE2 3.7Å; Q412-F416 WeakPolarHBondContact O-CD2 3.31Å; Q412-F416 PolarHBondContact O-N 3.43Å; K413-F416 PolarHBondContact O-N 2.87Å; D414-F416 PolarHBondContact O-N 3.18Å; F416-F419 PolarHBondContact O-N 2.95Å; F416-I420 WeakPolarHBondContact O-CB 3.22Å; F416-I420 WeakPolarHBondContact O-CD1 3.28Å; F416-I420 WeakPolarHBondContact O-CG1 3.49Å; F416-I420 PolarHBondContact O-N 3.18Å; F416-L441 HydrophobicContact CD1-CD2 3.62Å; F416-L441 HydrophobicContact CE1-CD2 3.95Å; F416-N444 HydrophobicContact CD2-CB 3.93Å; F416-N444 HydrophobicContact CE2-CB 3.24Å; F416-N444 HydrophobicContact CZ-CB 3.58Å; F416-N444 WeakPolarHBondContact CZ-ND2 3.35Å; F416-L445 HydrophobicContact CB-CD1 4.13Å; F416-L445 HydrophobicContact CB-CD2 3.87Å; F416-L445 HydrophobicContact CB-CG 4.02Å; F416-L445 HydrophobicContact CG-CG 4.45Å
417	Q	90	Very high	89.9	Confident	98 Å²	98	53.4 Å²	53.4	46%	0.458	28%	0.277	S	S	.	.	H	α-helix	trans	-62.1	-46.3	174.8	-75.2	177.4	-8.9	0	0	111.9	K413 D414 M415 F419 I420 L421	K413-Q417 WeakPolarHBondContact O-CB 3.31Å; K413-Q417 VanDerWaalsContact O-CG 3.28Å; K413-Q417 WeakPolarHBondContact O-CG 3.45Å; K413-Q417 PolarHBondContact O-N 3.22Å; D414-Q417 PolarHBondContact O-N 3.37Å; M415-Q417 PolarHBondContact O-N 3.37Å; Q417-F419 VanDerWaalsContact C-N 3.32Å; Q417-F419 PolarHBondContact O-N 3.43Å; Q417-I420 PolarHBondContact O-N 3.18Å; Q417-L421 PolarHBondContact O-N 3.14Å
418	R	93.4	Very high	89.1	Confident	87 Å²	87	55.6 Å²	55.6	33%	0.328	29%	0.29	S	S	.	.	H	α-helix	trans	-62.3	-40.6	174.4	-72.2	-172.7	-80.2	121.9	-5.1	111.6	F376 E411 D414 M415 L421 H422	F376-R418 HydrophobicContact CE1-CB 3.88Å; E411-R418 IonicContact OE1-NH2 3.55Å; E411-R418 PolarHBondContact OE1-NH2 2.92Å; D414-R418 WeakPolarHBondContact O-CG 3.4Å; D414-R418 PolarHBondContact O-N 3.02Å; D414-R418 IonicContact OD1-NE 2.66Å; D414-R418 IonicContact OD2-CZ 3.74Å; D414-R418 IonicContact OD2-NE 2.74Å; D414-R418 PolarHBondContact OD2-NE 2.8Å; D414-R418 IonicContact OD2-NH2 3.62Å; D414-R418 PolarHBondContact OD2-NH2 3.02Å; M415-R418 PolarHBondContact O-N 3.4Å; R418-L421 PolarHBondContact O-N 3.48Å; R418-H422 WeakPolarHBondContact O-CB 3.48Å; R418-H422 PolarHBondContact O-N 3.44Å
419	F	93.5	Very high	88.1	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-67.4	-39.2	179.4	-179.7	-103.6	0	0	0	112.5	W369 H372 L373 F376 M415 F416 Q417 L421 H422 S423 L441	W369-F419 HydrophobicContact CD2-CZ 4.08Å; W369-F419 AromaticContact CE2-CE1 3.64Å; W369-F419 AromaticContact CE2-CZ 3.57Å; W369-F419 HydrophobicContact CG-CZ 4.5Å; W369-F419 HydrophobicContact CH2-CE1 4.13Å; W369-F419 HydrophobicContact CH2-CZ 4.48Å; W369-F419 AromaticContact CZ2-CE1 3.43Å; W369-F419 HydrophobicContact CZ2-CE1 3.43Å; W369-F419 VanDerWaalsContact CZ2-CE1 3.43Å; W369-F419 AromaticContact CZ2-CZ 3.82Å; W369-F419 HydrophobicContact CZ2-CZ 3.82Å; W369-F419 AromaticContact NE1-CE1 3.86Å; W369-F419 AromaticContact NE1-CZ 3.65Å; H372-F419 HydrophobicContact CB-CE2 3.9Å; L373-F419 HydrophobicContact CB-CE1 4.1Å; L373-F419 HydrophobicContact CB-CE2 3.95Å; L373-F419 HydrophobicContact CB-CZ 3.62Å; L373-F419 HydrophobicContact CD1-CD1 3.79Å; L373-F419 HydrophobicContact CD1-CD2 4.43Å; L373-F419 HydrophobicContact CD1-CE1 3.76Å; L373-F419 HydrophobicContact CD1-CE2 4.42Å; L373-F419 HydrophobicContact CD1-CG 4.12Å; L373-F419 HydrophobicContact CD1-CZ 4.1Å; L373-F419 HydrophobicContact CG-CE1 4.38Å; L373-F419 HydrophobicContact CG-CZ 4.37Å; L373-F419 VanDerWaalsContact N-CE2 3.33Å; F376-F419 HydrophobicContact CB-CD2 4.26Å; F376-F419 HydrophobicContact CD1-CB 3.79Å; F376-F419 HydrophobicContact CD1-CD2 4.29Å; F376-F419 AromaticContact CD2-CD2 3.69Å; F376-F419 HydrophobicContact CD2-CD2 3.69Å; F376-F419 HydrophobicContact CD2-CE2 4.42Å; F376-F419 HydrophobicContact CE1-CB 4.08Å; F376-F419 AromaticContact CE2-CD2 3.98Å; F376-F419 HydrophobicContact CE2-CD2 3.98Å; F376-F419 HydrophobicContact CG-CB 4.11Å; F376-F419 AromaticContact CG-CD2 3.84Å; F376-F419 HydrophobicContact CG-CD2 3.84Å; F376-F419 HydrophobicContact CG-CG 4.39Å; F376-F419 HydrophobicContact CZ-CD2 4.41Å; M415-F419 WeakPolarHBondContact O-CB 3.46Å; M415-F419 PolarHBondContact O-N 3.49Å; M415-F419 HydrophobicContact SD-CB 4.48Å; F416-F419 PolarHBondContact O-N 2.95Å; Q417-F419 VanDerWaalsContact C-N 3.32Å; Q417-F419 PolarHBondContact O-N 3.43Å; F419-L421 VanDerWaalsContact C-N 3.33Å; F419-L421 PolarHBondContact O-N 3.36Å; F419-H422 PolarHBondContact O-N 3.1Å; F419-S423 VanDerWaalsContact O-CB 3.26Å; F419-S423 WeakPolarHBondContact O-CB 3.37Å; F419-S423 PolarHBondContact O-N 3.06Å; F419-L441 HydrophobicContact CD1-CD2 3.69Å; F419-L441 HydrophobicContact CE1-CD2 3.94Å
420	I	88.6	Confident	87	Confident	63 Å²	63	59.6 Å²	59.6	32%	0.323	32%	0.322	S	S	.	.	H	α-helix	trans	-58.2	-46.2	175.6	-73.4	162.3	0	0	0	110.8	F416 Q417 S423 A424 L441 L445	F416-I420 WeakPolarHBondContact O-CB 3.22Å; F416-I420 WeakPolarHBondContact O-CD1 3.28Å; F416-I420 WeakPolarHBondContact O-CG1 3.49Å; F416-I420 PolarHBondContact O-N 3.18Å; Q417-I420 PolarHBondContact O-N 3.18Å; I420-S423 PolarHBondContact O-N 2.82Å; I420-A424 WeakPolarHBondContact O-CB 3.49Å; I420-A424 PolarHBondContact O-N 3.21Å; I420-L441 HydrophobicContact CG1-CD1 4.16Å; I420-L441 HydrophobicContact CG1-CD2 4.34Å; I420-L445 HydrophobicContact CD1-CD1 3.93Å
421	L	90.5	Very high	86	Confident	118 Å²	118	61.7 Å²	61.7	62%	0.618	33%	0.325	S	S	*	.	H	α-helix	trans	-62.8	-47.1	176.7	-66.3	173.1	0	0	0	111.3	Q417 R418 F419 S423 A424 E425	Q417-L421 PolarHBondContact O-N 3.14Å; R418-L421 PolarHBondContact O-N 3.48Å; F419-L421 VanDerWaalsContact C-N 3.33Å; F419-L421 PolarHBondContact O-N 3.36Å; L421-S423 VanDerWaalsContact C-N 3.32Å; L421-S423 PolarHBondContact O-N 2.81Å; L421-A424 PolarHBondContact O-N 3.31Å; L421-E425 PolarHBondContact O-N 3.14Å
422	H	92.2	Very high	84.9	Confident	36 Å²	36	62.5 Å²	62.5	17%	0.167	33%	0.33	C	S	.	.	H	α-helix	trans	-59.4	-42.8	177.1	179.4	68.5	0	0	0	112.6	H372 F376 R418 F419 E425 K426	H372-H422 AromaticContact CD2-NE2 3.1Å; H372-H422 PolarHBondContact CD2-NE2 2.97Å; H372-H422 AromaticContact CG-NE2 3.91Å; H372-H422 AromaticContact NE2-NE2 3.99Å; F376-H422 HydrophobicContact CE2-CB 4.27Å; F376-H422 AromaticContact CE2-CD2 3.74Å; F376-H422 AromaticContact CE2-CG 3.92Å; F376-H422 HydrophobicContact CZ-CB 3.76Å; F376-H422 AromaticContact CZ-CG 3.84Å; R418-H422 WeakPolarHBondContact O-CB 3.48Å; R418-H422 PolarHBondContact O-N 3.44Å; F419-H422 PolarHBondContact O-N 3.1Å; H422-E425 PolarHBondContact O-N 3.32Å; H422-K426 WeakPolarHBondContact O-CB 3.33Å; H422-K426 PolarHBondContact O-N 2.96Å
423	S	89.1	Confident	84.2	Confident	21 Å²	21	62.6 Å²	62.6	15%	0.147	33%	0.33	C	S	.	.	H	α-helix	trans	-64	-41.7	178.8	-178.8	0	0	0	0	111.5	W369 F419 I420 L421 E425 K426 F427	W369-S423 PolarHBondContact NE1-OG 3.34Å; F419-S423 VanDerWaalsContact O-CB 3.26Å; F419-S423 WeakPolarHBondContact O-CB 3.37Å; F419-S423 PolarHBondContact O-N 3.06Å; I420-S423 PolarHBondContact O-N 2.82Å; L421-S423 VanDerWaalsContact C-N 3.32Å; L421-S423 PolarHBondContact O-N 2.81Å; S423-E425 VanDerWaalsContact C-N 3.28Å; S423-E425 PolarHBondContact O-N 2.84Å; S423-K426 PolarHBondContact O-N 2.86Å; S423-F427 PolarHBondContact O-N 3.48Å
424	A	84.8	Confident	83.7	Confident	65 Å²	65	58.8 Å²	58.8	54%	0.537	32%	0.318	S	S	.	.	H	α-helix	trans	-63.9	-33.4	178.7	0	0	0	0	0	112.3	I420 L421 S428	I420-A424 WeakPolarHBondContact O-CB 3.49Å; I420-A424 PolarHBondContact O-N 3.21Å; L421-A424 PolarHBondContact O-N 3.31Å; A424-S428 PolarHBondContact O-OG 2.96Å
425	E	87.3	Confident	83.2	Confident	160 Å²	160	55.8 Å²	55.8	75%	0.748	30%	0.302	S	S	*	.	H	α-helix	trans	-79.3	-39.2	177.5	-69.1	175.6	177.1	0	0	113.2	L421 H422 S423	L421-E425 PolarHBondContact O-N 3.14Å; H422-E425 PolarHBondContact O-N 3.32Å; S423-E425 VanDerWaalsContact C-N 3.28Å; S423-E425 PolarHBondContact O-N 2.84Å
426	K	87.9	Confident	83	Confident	102 Å²	102	55.9 Å²	55.9	44%	0.443	30%	0.302	S	S	.	.	H	α-helix	trans	-93	-30.7	-170.5	-170.8	163.1	-176.2	163.7	0	114.4	H372 H422 S423	H372-K426 PolarHBondContact CE1-NZ 3.42Å; H372-K426 WeakPolarHBondContact NE2-CE 3.32Å; H372-K426 PolarHBondContact NE2-NZ 3.28Å; H422-K426 WeakPolarHBondContact O-CB 3.33Å; H422-K426 PolarHBondContact O-N 2.96Å; S423-K426 PolarHBondContact O-N 2.86Å
427	F	84.8	Confident	82.8	Confident	21 Å²	21	57.1 Å²	57.1	9%	0.092	31%	0.307	C	S	.	.			trans	-120	27.1	-170.9	-59.8	-76.3	0	0	0	113.4	W369 H372 S423 S429 E430	W369-F427 VanDerWaalsContact CA-CZ 3.5Å; W369-F427 HydrophobicContact CB-CD1 4.26Å; W369-F427 HydrophobicContact CB-CD2 4.33Å; W369-F427 HydrophobicContact CB-CE1 4.21Å; W369-F427 HydrophobicContact CB-CE2 4.28Å; W369-F427 HydrophobicContact CB-CG 4.33Å; W369-F427 HydrophobicContact CB-CZ 4.23Å; W369-F427 AromaticContact CD1-CD2 3.61Å; W369-F427 AromaticContact CD1-CG 3.91Å; W369-F427 HydrophobicContact CG-CD2 4.33Å; H372-F427 HydrophobicContact CB-CE2 4.16Å; H372-F427 HydrophobicContact CB-CZ 4.45Å; H372-F427 AromaticContact CE1-CZ 3.88Å; H372-F427 AromaticContact CG-CE2 3.91Å; H372-F427 AromaticContact CG-CZ 3.87Å; H372-F427 AromaticContact ND1-CZ 3.5Å; S423-F427 PolarHBondContact O-N 3.48Å; F427-S429 PolarHBondContact O-N 2.93Å; F427-E430 PolarHBondContact O-N 3.36Å
428	S	71.9	Confident	82.5	Confident	78 Å²	78	53.4 Å²	53.4	55%	0.545	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-6.7	-176.4	-23.9	0	0	0	0	115	A424	A424-S428 PolarHBondContact O-OG 2.96Å
429	S	66.8	Low	82	Confident	107 Å²	107	49.3 Å²	49.3	75%	0.748	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.8	-2.3	-179.8	62.7	0	0	0	0	114.4	F427 D431	F427-S429 PolarHBondContact O-N 2.93Å; S429-D431 PolarHBondContact O-N 3.21Å
430	E	65.8	Low	81.3	Confident	51 Å²	51	49.4 Å²	49.4	24%	0.238	28%	0.275	C	S	.	.			trans	-98.3	54.9	-177.8	-66.9	-171.8	177.7	0	0	112.1	F427 D432 T433 R437	F427-E430 PolarHBondContact O-N 3.36Å; E430-D432 VanDerWaalsContact C-N 3.33Å; E430-D432 PolarHBondContact O-N 3.33Å; E430-T433 PolarHBondContact O-OG1 3.38Å; E430-R437 IonicContact OE2-CZ 2.72Å; E430-R437 IonicContact OE2-NH1 3.68Å; E430-R437 PolarHBondContact OE2-NH1 3.09Å; E430-R437 IonicContact OE2-NH2 2.76Å; E430-R437 PolarHBondContact OE2-NH2 2.9Å
431	D	70.2	Confident	81.1	Confident	102 Å²	102	47 Å²	47	55%	0.545	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-28.4	-169.1	-64.8	-21.1	0	0	0	114	S429 W458	S429-D431 PolarHBondContact O-N 3.21Å; D431-W458 WeakPolarHBondContact O-CZ3 3.22Å
432	D	68.3	Low	80.7	Confident	35 Å²	35	42.9 Å²	42.9	19%	0.187	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-35.5	-175.3	65.5	-23.5	0	0	0	113.3	R137 L138 E430 L470	R137-D432 IonicContact CZ-OD1 2.65Å; R137-D432 IonicContact CZ-OD2 2.79Å; R137-D432 IonicContact NE-OD2 3.18Å; R137-D432 IonicContact NH2-OD1 2.69Å; R137-D432 PolarHBondContact NH2-OD1 3.13Å; R137-D432 IonicContact NH2-OD2 3.08Å; L138-D432 HydrophobicContact CD2-CB 4.12Å; L138-D432 WeakPolarHBondContact CD2-O 3.35Å; E430-D432 VanDerWaalsContact C-N 3.33Å; E430-D432 PolarHBondContact O-N 3.33Å; D432-L470 HydrophobicContact CB-CD2 4.32Å
433	T	75.5	Confident	80.2	Confident	4 Å²	4	41.2 Å²	41.2	3%	0.025	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.4	-13.4	-178.7	59.7	0	0	0	0	114.1	R137 L138 A141 E430 P435 Y436 R437	R137-T433 HydrophobicContact CB-CG2 4.27Å; L138-T433 HydrophobicContact CD2-CG2 4.47Å; A141-T433 HydrophobicContact CB-CG2 3.96Å; E430-T433 PolarHBondContact O-OG1 3.38Å; T433-P435 VanDerWaalsContact C-CD 3.44Å; T433-Y436 PolarHBondContact O-N 3.34Å; T433-R437 PolarHBondContact O-N 3.45Å; T433-R437 VanDerWaalsContact OG1-CZ 3.25Å; T433-R437 PolarHBondContact OG1-NH1 2.65Å
434	A	78.7	Confident	79.7	Confident	20 Å²	20	40.3 Å²	40.3	17%	0.165	23%	0.226	C	C	.	.	H	α-helix	trans	-53	-40.7	-177.1	0	0	0	0	0	115.8	Y436 R437 L438 W458	A434-Y436 VanDerWaalsContact C-N 3.34Å; A434-Y436 PolarHBondContact O-N 3.16Å; A434-R437 PolarHBondContact O-N 3.09Å; A434-L438 PolarHBondContact O-N 3.12Å; A434-W458 HydrophobicContact CB-CH2 3.16Å; A434-W458 HydrophobicContact CB-CZ2 3.35Å; A434-W458 HydrophobicContact CB-CZ3 3.85Å
435	P	83.9	Confident	79.5	Confident	3 Å²	3	39.4 Å²	39.4	2%	0.019	21%	0.212	C	C	.	.	H	α-helix	trans	-61.5	-39.1	179	20.2	-31.2	0	0	0	112.9	T433 R437 L438 L455 W458 L474	T433-P435 VanDerWaalsContact C-CD 3.44Å; P435-R437 VanDerWaalsContact C-N 3.3Å; P435-R437 PolarHBondContact O-N 3.12Å; P435-L438 WeakPolarHBondContact O-CB 3.29Å; P435-L438 WeakPolarHBondContact O-CG 3.26Å; P435-L438 PolarHBondContact O-N 2.87Å; P435-L455 HydrophobicContact CB-CD2 4.16Å; P435-L455 VanDerWaalsContact O-CD2 3.22Å; P435-L455 WeakPolarHBondContact O-CD2 3.2Å; P435-W458 HydrophobicContact CB-CB 4.22Å; P435-W458 HydrophobicContact CB-CD2 4.19Å; P435-W458 HydrophobicContact CB-CG 3.9Å; P435-W458 HydrophobicContact CG-CD2 4.39Å; P435-W458 HydrophobicContact CG-CE3 4.46Å; P435-W458 HydrophobicContact CG-CG 4.47Å; P435-L474 HydrophobicContact CB-CD1 3.75Å; P435-L474 HydrophobicContact CG-CD1 3.9Å
436	Y	87.6	Confident	79	Confident	2 Å²	2	33.9 Å²	33.9	1%	0.008	19%	0.186	C	C	.	.	H	α-helix	trans	-66.9	-33.3	180	-54	-83.5	0	0	0	112.2	L138 A141 E142 A145 T433 A434 L438 I439 F477	L138-Y436 HydrophobicContact CD2-CE2 3.71Å; A141-Y436 HydrophobicContact CB-CD2 4.16Å; A141-Y436 HydrophobicContact CB-CG 4.18Å; E142-Y436 HydrophobicContact CB-CD1 3.62Å; E142-Y436 HydrophobicContact CB-CE1 3.61Å; E142-Y436 HydrophobicContact CB-CG 4.45Å; E142-Y436 HydrophobicContact CG-CD1 3.92Å; E142-Y436 HydrophobicContact CG-CE1 3.78Å; A145-Y436 WeakPolarHBondContact CB-O 3.44Å; T433-Y436 PolarHBondContact O-N 3.34Å; A434-Y436 VanDerWaalsContact C-N 3.34Å; A434-Y436 PolarHBondContact O-N 3.16Å; Y436-L438 PolarHBondContact O-N 3.34Å; Y436-I439 PolarHBondContact O-N 3.28Å; Y436-F477 AromaticContact CD1-CD1 3.77Å; Y436-F477 HydrophobicContact CD1-CD1 3.77Å; Y436-F477 AromaticContact CD1-CD2 3.88Å; Y436-F477 HydrophobicContact CD1-CD2 3.88Å; Y436-F477 AromaticContact CD1-CE1 3.7Å; Y436-F477 HydrophobicContact CD1-CE1 3.7Å; Y436-F477 AromaticContact CD1-CE2 3.83Å; Y436-F477 HydrophobicContact CD1-CE2 3.83Å; Y436-F477 AromaticContact CD1-CG 3.85Å; Y436-F477 HydrophobicContact CD1-CG 3.85Å; Y436-F477 AromaticContact CD1-CZ 3.73Å; Y436-F477 HydrophobicContact CD1-CZ 3.73Å; Y436-F477 HydrophobicContact CE1-CB 3.98Å; Y436-F477 AromaticContact CE1-CD1 3.79Å; Y436-F477 HydrophobicContact CE1-CD1 3.79Å; Y436-F477 AromaticContact CE1-CD2 3.9Å; Y436-F477 HydrophobicContact CE1-CD2 3.9Å; Y436-F477 HydrophobicContact CE1-CE1 4.22Å; Y436-F477 HydrophobicContact CE1-CE2 4.33Å; Y436-F477 AromaticContact CE1-CG 3.61Å; Y436-F477 HydrophobicContact CE1-CG 3.61Å; Y436-F477 HydrophobicContact CE1-CZ 4.47Å; Y436-F477 HydrophobicContact CG-CE1 4.42Å
437	R	87.4	Confident	78.6	Confident	26 Å²	26	30 Å²	30	10%	0.098	17%	0.172	C	C	.	.	H	α-helix	trans	-70.9	-12.5	177.2	-70	170.4	173.7	168.7	-1	113.6	W369 E370 E430 T433 A434 P435 P440 L441	W369-R437 VanDerWaalsContact CB-CZ 3.44Å; W369-R437 HydrophobicContact CD2-CG 4.07Å; W369-R437 HydrophobicContact CE3-CG 3.98Å; W369-R437 HydrophobicContact CH2-CB 3.78Å; W369-R437 HydrophobicContact CH2-CG 3.9Å; W369-R437 HydrophobicContact CZ2-CB 3.67Å; W369-R437 HydrophobicContact CZ2-CG 3.97Å; W369-R437 HydrophobicContact CZ3-CB 4.32Å; W369-R437 HydrophobicContact CZ3-CG 3.92Å; E370-R437 IonicContact OE1-CZ 3.21Å; E370-R437 IonicContact OE1-NE 3.52Å; E370-R437 PolarHBondContact OE1-NE 2.96Å; E370-R437 IonicContact OE1-NH2 2.75Å; E370-R437 PolarHBondContact OE1-NH2 3.49Å; E370-R437 IonicContact OE2-NH2 3.5Å; E430-R437 IonicContact OE2-CZ 2.72Å; E430-R437 IonicContact OE2-NH1 3.68Å; E430-R437 PolarHBondContact OE2-NH1 3.09Å; E430-R437 IonicContact OE2-NH2 2.76Å; E430-R437 PolarHBondContact OE2-NH2 2.9Å; T433-R437 PolarHBondContact O-N 3.45Å; T433-R437 VanDerWaalsContact OG1-CZ 3.25Å; T433-R437 PolarHBondContact OG1-NH1 2.65Å; A434-R437 PolarHBondContact O-N 3.09Å; P435-R437 VanDerWaalsContact C-N 3.3Å; P435-R437 PolarHBondContact O-N 3.12Å; R437-P440 WeakPolarHBondContact O-CD 3.47Å; R437-P440 WeakPolarHBondContact O-CG 3.37Å; R437-L441 WeakPolarHBondContact O-CG 3.45Å
438	L	83.8	Confident	78.2	Confident	21 Å²	21	29.1 Å²	29.1	11%	0.11	17%	0.169	C	C	.	.	H	α-helix	trans	-71.5	-30.1	176.8	-60.4	-177.7	0	0	0	113.2	A434 P435 Y436 L441 F442 L451 M454 L455	A434-L438 PolarHBondContact O-N 3.12Å; P435-L438 WeakPolarHBondContact O-CB 3.29Å; P435-L438 WeakPolarHBondContact O-CG 3.26Å; P435-L438 PolarHBondContact O-N 2.87Å; Y436-L438 PolarHBondContact O-N 3.34Å; L438-L441 PolarHBondContact O-N 2.9Å; L438-F442 HydrophobicContact CB-CD2 4.08Å; L438-F442 HydrophobicContact CB-CE2 4.38Å; L438-F442 HydrophobicContact CD2-CD2 4.38Å; L438-F442 HydrophobicContact CD2-CE2 3.88Å; L438-F442 WeakPolarHBondContact O-CD2 3.42Å; L438-F442 PolarHBondContact O-N 3.24Å; L438-L451 HydrophobicContact CB-CD1 3.93Å; L438-M454 HydrophobicContact CD1-CB 4.09Å; L438-M454 HydrophobicContact CD1-CG 3.44Å; L438-M454 VanDerWaalsContact CD1-CG 3.44Å; L438-L455 HydrophobicContact CB-CD2 4.42Å; L438-L455 HydrophobicContact CD1-CD2 4.08Å; L438-L455 HydrophobicContact CD1-CG 4.39Å
439	I	84.2	Confident	78.3	Confident	1 Å²	1	29.3 Å²	29.3	1%	0.005	16%	0.163	C	C	.	.	H	α-helix	trans	-55	-58.1	-179	-61.4	-62.3	0	0	0	111.8	A145 L149 Y436 L441 F442 F443 L451 L455 F477 V481	A145-I439 HydrophobicContact CB-CB 4.33Å; A145-I439 HydrophobicContact CB-CG1 4.19Å; L149-I439 HydrophobicContact CB-CG2 4.24Å; L149-I439 HydrophobicContact CD1-CG2 4.5Å; Y436-I439 PolarHBondContact O-N 3.28Å; I439-L441 PolarHBondContact O-N 3.15Å; I439-F442 PolarHBondContact O-N 2.95Å; I439-F443 WeakPolarHBondContact O-CB 3.31Å; I439-F443 PolarHBondContact O-N 3.15Å; I439-L451 HydrophobicContact CD1-CD1 4.21Å; I439-L451 HydrophobicContact CD1-CD2 3.94Å; I439-L451 HydrophobicContact CD1-CG 4.46Å; I439-L455 HydrophobicContact CD1-CD1 4.02Å; I439-F477 HydrophobicContact CD1-CZ 4.25Å; I439-F477 HydrophobicContact CG1-CE1 4.38Å; I439-F477 HydrophobicContact CG1-CZ 3.74Å; I439-V481 HydrophobicContact CD1-CG1 3.82Å; I439-V481 HydrophobicContact CD1-CG2 3.93Å
440	P	78.1	Confident	79	Confident	2 Å²	2	30.1 Å²	30.1	1%	0.013	15%	0.154	C	C	.	.	H	α-helix	trans	-61.6	-30.1	-179.3	23.5	-34.5	0	0	0	112.6	W148 W369 R437 N444	W148-P440 HydrophobicContact CB-CB 4.39Å; W148-P440 HydrophobicContact CG-CB 4.02Å; W148-P440 HydrophobicContact CG-CG 4.46Å; W369-P440 HydrophobicContact CH2-CG 4.17Å; R437-P440 WeakPolarHBondContact O-CD 3.47Å; R437-P440 WeakPolarHBondContact O-CG 3.37Å; P440-N444 WeakPolarHBondContact O-CB 3.49Å; P440-N444 PolarHBondContact O-ND2 3.28Å
441	L	83.5	Confident	80	Confident	12 Å²	12	27.7 Å²	27.7	6%	0.063	14%	0.142	C	C	.	.	H	α-helix	trans	-72.7	-55.7	-180	-59.2	176.4	0	0	0	111.7	W369 F416 F419 I420 R437 L438 I439 L445	W369-L441 HydrophobicContact CZ2-CD1 4.39Å; F416-L441 HydrophobicContact CD1-CD2 3.62Å; F416-L441 HydrophobicContact CE1-CD2 3.95Å; F419-L441 HydrophobicContact CD1-CD2 3.69Å; F419-L441 HydrophobicContact CE1-CD2 3.94Å; I420-L441 HydrophobicContact CG1-CD1 4.16Å; I420-L441 HydrophobicContact CG1-CD2 4.34Å; R437-L441 WeakPolarHBondContact O-CG 3.45Å; L438-L441 PolarHBondContact O-N 2.9Å; I439-L441 PolarHBondContact O-N 3.15Å; L441-L445 WeakPolarHBondContact O-CB 3.49Å; L441-L445 VanDerWaalsContact O-CG 3.23Å; L441-L445 WeakPolarHBondContact O-CG 3.21Å; L441-L445 PolarHBondContact O-N 3.11Å
442	F	82.3	Confident	80.7	Confident	31 Å²	31	22.9 Å²	22.9	14%	0.136	12%	0.117	C	C	.	.	H	α-helix	trans	-77.7	-32.4	-172.4	-78.6	-107.3	0	0	0	112.7	L438 I439 L445 E446 A447 K450 L451 M454	L438-F442 HydrophobicContact CB-CD2 4.08Å; L438-F442 HydrophobicContact CB-CE2 4.38Å; L438-F442 HydrophobicContact CD2-CD2 4.38Å; L438-F442 HydrophobicContact CD2-CE2 3.88Å; L438-F442 WeakPolarHBondContact O-CD2 3.42Å; L438-F442 PolarHBondContact O-N 3.24Å; I439-F442 PolarHBondContact O-N 2.95Å; F442-L445 CarbonylContact O-C 3.58Å; F442-L445 PolarHBondContact O-N 3.17Å; F442-E446 PolarHBondContact O-N 3.22Å; F442-E446 VanDerWaalsContact O-N 3.09Å; F442-A447 HydrophobicContact CD1-CB 3.84Å; F442-A447 PolarHBondContact O-N 3.12Å; F442-K450 HydrophobicContact CD1-CB 4.07Å; F442-K450 HydrophobicContact CE1-CB 3.7Å; F442-L451 HydrophobicContact CB-CB 3.86Å; F442-L451 HydrophobicContact CB-CD1 3.83Å; F442-L451 HydrophobicContact CB-CD2 4.07Å; F442-L451 HydrophobicContact CB-CG 4.12Å; F442-L451 HydrophobicContact CD1-CB 4.09Å; F442-L451 HydrophobicContact CD2-CD1 4.32Å; F442-L451 HydrophobicContact CG-CB 4.15Å; F442-L451 HydrophobicContact CG-CD1 4.02Å; F442-M454 HydrophobicContact CZ-CB 4.45Å; F442-M454 HydrophobicContact CZ-CE 4.44Å; F442-M454 HydrophobicContact CZ-CG 4.38Å
443	F	81.3	Confident	81.5	Confident	2 Å²	2	23.9 Å²	23.9	1%	0.009	12%	0.122	C	C	.	.	H	α-helix	trans	-69.2	-41	-179.8	-161.1	-81.8	0	0	0	111.5	L149 L152 I153 R156 I439 E446 Y448 F485	L149-F443 HydrophobicContact CD1-CD2 3.53Å; L149-F443 HydrophobicContact CD1-CE2 3.32Å; L149-F443 HydrophobicContact CD1-CG 4.25Å; L149-F443 HydrophobicContact CD1-CZ 3.86Å; L152-F443 HydrophobicContact CB-CD1 3.9Å; L152-F443 HydrophobicContact CB-CE1 3.73Å; L152-F443 HydrophobicContact CD1-CB 4.32Å; L152-F443 HydrophobicContact CD1-CD1 3.57Å; L152-F443 HydrophobicContact CD1-CE1 4.29Å; L152-F443 HydrophobicContact CD1-CG 4.27Å; L152-F443 HydrophobicContact CG-CD1 4.35Å; I153-F443 HydrophobicContact CG1-CZ 4.19Å; R156-F443 VanDerWaalsContact CZ-CE1 3.49Å; R156-F443 PolarHBondContact NH2-O 3.37Å; R156-F443 VanDerWaalsContact NH2-O 3.07Å; I439-F443 WeakPolarHBondContact O-CB 3.31Å; I439-F443 PolarHBondContact O-N 3.15Å; F443-E446 PolarHBondContact O-N 3.2Å; F443-Y448 HydrophobicContact CD2-CD1 4.34Å; F443-Y448 AromaticContact CD2-CE1 3.49Å; F443-Y448 HydrophobicContact CD2-CE1 3.49Å; F443-Y448 VanDerWaalsContact CD2-CE1 3.49Å; F443-Y448 HydrophobicContact CE2-CD1 4.48Å; F443-Y448 AromaticContact CE2-CE1 3.56Å; F443-Y448 HydrophobicContact CE2-CE1 3.56Å; F443-Y448 HydrophobicContact CG-CE1 4.04Å; F443-Y448 HydrophobicContact CZ-CE1 4.18Å; F443-Y448 PolarHBondContact O-OH 3.26Å; F443-Y448 VanDerWaalsContact O-OH 3.11Å; F443-F485 AromaticContact CD2-CE1 3.82Å; F443-F485 HydrophobicContact CD2-CE1 3.82Å; F443-F485 AromaticContact CD2-CZ 3.86Å; F443-F485 HydrophobicContact CD2-CZ 3.86Å; F443-F485 AromaticContact CE2-CE1 3.64Å; F443-F485 HydrophobicContact CE2-CE1 3.64Å; F443-F485 HydrophobicContact CE2-CZ 4.11Å
444	N	79.3	Confident	82	Confident	2 Å²	2	27.5 Å²	27.5	1%	0.011	14%	0.14	C	C	.	.	H	α-helix	trans	-68.7	-36.4	173.8	-80.3	-73.2	0	0	0	112.5	L152 Q412 F416 P440 E446	L152-N444 WeakPolarHBondContact CD1-ND2 3.26Å; L152-N444 WeakPolarHBondContact CD2-OD1 3.34Å; Q412-N444 PolarHBondContact NE2-OD1 3.35Å; Q412-N444 VanDerWaalsContact NE2-OD1 3.08Å; F416-N444 HydrophobicContact CD2-CB 3.93Å; F416-N444 HydrophobicContact CE2-CB 3.24Å; F416-N444 HydrophobicContact CZ-CB 3.58Å; F416-N444 WeakPolarHBondContact CZ-ND2 3.35Å; P440-N444 WeakPolarHBondContact O-CB 3.49Å; P440-N444 PolarHBondContact O-ND2 3.28Å; N444-E446 PolarHBondContact O-N 2.97Å
445	L	80.1	Confident	82.4	Confident	46 Å²	46	26.6 Å²	26.6	24%	0.241	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.2	1.7	174.6	-70.3	175.9	0	0	0	113.9	K413 F416 I420 L441 F442 A447	K413-L445 HydrophobicContact CB-CD2 4.32Å; K413-L445 HydrophobicContact CG-CD2 3.97Å; F416-L445 HydrophobicContact CB-CD1 4.13Å; F416-L445 HydrophobicContact CB-CD2 3.87Å; F416-L445 HydrophobicContact CB-CG 4.02Å; F416-L445 HydrophobicContact CG-CG 4.45Å; I420-L445 HydrophobicContact CD1-CD1 3.93Å; L441-L445 WeakPolarHBondContact O-CB 3.49Å; L441-L445 VanDerWaalsContact O-CG 3.23Å; L441-L445 WeakPolarHBondContact O-CG 3.21Å; L441-L445 PolarHBondContact O-N 3.11Å; F442-L445 CarbonylContact O-C 3.58Å; F442-L445 PolarHBondContact O-N 3.17Å; L445-A447 HydrophobicContact CB-CB 4.42Å; L445-A447 PolarHBondContact O-N 3.28Å; L445-A447 VanDerWaalsContact O-N 3.15Å
446	E	76.6	Confident	82.4	Confident	44 Å²	44	27.9 Å²	27.9	21%	0.206	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.1	31.6	-177.7	-66.8	171.3	-173.3	0	0	113.9	R156 K188 F442 F443 N444 Y448	R156-E446 IonicContact NH2-OE1 3.76Å; K188-E446 IonicContact NZ-OE1 2.65Å; K188-E446 PolarHBondContact NZ-OE1 3.35Å; F442-E446 PolarHBondContact O-N 3.22Å; F442-E446 VanDerWaalsContact O-N 3.09Å; F443-E446 PolarHBondContact O-N 3.2Å; N444-E446 PolarHBondContact O-N 2.97Å; E446-Y448 VanDerWaalsContact C-CE2 3.42Å; E446-Y448 HydrophobicContact CB-CE2 3.73Å; E446-Y448 HydrophobicContact CG-CE2 4.1Å; E446-Y448 VanDerWaalsContact O-CD2 3.29Å; E446-Y448 WeakPolarHBondContact O-CD2 3.45Å; E446-Y448 WeakPolarHBondContact O-CE2 3.23Å; E446-Y448 PolarHBondContact O-N 3Å
447	A	79.9	Confident	82.4	Confident	19 Å²	19	29.1 Å²	29.1	16%	0.157	15%	0.148	C	C	.	.			trans	-97.9	46.3	-174.1	0	0	0	0	0	113	F442 L445 N449 K450 L451	F442-A447 HydrophobicContact CD1-CB 3.84Å; F442-A447 PolarHBondContact O-N 3.12Å; L445-A447 HydrophobicContact CB-CB 4.42Å; L445-A447 PolarHBondContact O-N 3.28Å; L445-A447 VanDerWaalsContact O-N 3.15Å; A447-N449 VanDerWaalsContact C-N 3.35Å; A447-N449 PolarHBondContact O-N 3.12Å; A447-K450 PolarHBondContact O-N 3.34Å; A447-L451 PolarHBondContact O-N 3.13Å; A447-L451 VanDerWaalsContact O-N 3.12Å
448	Y	76.8	Confident	82.2	Confident	4 Å²	4	29.9 Å²	29.9	2%	0.016	15%	0.15	C	C	.	.	H	α-helix	trans	-56.8	-43.3	-172.6	-55.3	-84.2	0	0	0	114	R156 F443 E446 K450 L451 F485 P513	R156-Y448 PolarHBondContact NH1-OH 3.35Å; R156-Y448 PolarHBondContact NH2-OH 3.39Å; F443-Y448 HydrophobicContact CD2-CD1 4.34Å; F443-Y448 AromaticContact CD2-CE1 3.49Å; F443-Y448 HydrophobicContact CD2-CE1 3.49Å; F443-Y448 VanDerWaalsContact CD2-CE1 3.49Å; F443-Y448 HydrophobicContact CE2-CD1 4.48Å; F443-Y448 AromaticContact CE2-CE1 3.56Å; F443-Y448 HydrophobicContact CE2-CE1 3.56Å; F443-Y448 HydrophobicContact CG-CE1 4.04Å; F443-Y448 HydrophobicContact CZ-CE1 4.18Å; F443-Y448 PolarHBondContact O-OH 3.26Å; F443-Y448 VanDerWaalsContact O-OH 3.11Å; E446-Y448 VanDerWaalsContact C-CE2 3.42Å; E446-Y448 HydrophobicContact CB-CE2 3.73Å; E446-Y448 HydrophobicContact CG-CE2 4.1Å; E446-Y448 VanDerWaalsContact O-CD2 3.29Å; E446-Y448 WeakPolarHBondContact O-CD2 3.45Å; E446-Y448 WeakPolarHBondContact O-CE2 3.23Å; E446-Y448 PolarHBondContact O-N 3Å; Y448-K450 PolarHBondContact O-N 3.41Å; Y448-K450 VanDerWaalsContact O-N 3.14Å; Y448-L451 PolarHBondContact O-N 2.91Å; Y448-F485 HydrophobicContact CD1-CD2 4.48Å; Y448-F485 AromaticContact CD1-CE2 3.88Å; Y448-F485 HydrophobicContact CD1-CE2 3.88Å; Y448-F485 AromaticContact CD1-CZ 3.97Å; Y448-F485 HydrophobicContact CD1-CZ 3.97Å; Y448-F485 HydrophobicContact CE1-CZ 4.4Å; Y448-P513 HydrophobicContact CD2-CB 3.06Å; Y448-P513 HydrophobicContact CD2-CG 3.57Å; Y448-P513 HydrophobicContact CE1-CG 4.47Å; Y448-P513 HydrophobicContact CE2-CB 3.1Å; Y448-P513 HydrophobicContact CE2-CG 3.1Å; Y448-P513 HydrophobicContact CG-CB 4.06Å; Y448-P513 HydrophobicContact CG-CG 4.43Å
449	N	73.8	Confident	82.2	Confident	81 Å²	81	29.8 Å²	29.8	43%	0.433	15%	0.149	S	C	.	.	H	α-helix	trans	-60.1	-24.6	179.2	65.3	-41.8	0	0	0	112.9	A447 L521	A447-N449 VanDerWaalsContact C-N 3.35Å; A447-N449 PolarHBondContact O-N 3.12Å; N449-L521 HydrophobicContact CB-CD2 4.26Å
450	K	82.4	Confident	82.2	Confident	125 Å²	125	39.9 Å²	39.9	54%	0.543	19%	0.187	S	C	.	.	H	α-helix	trans	-95.2	-22.5	176.2	-61.7	-179.5	179.9	178.2	0	112.8	F442 A447 Y448 M454	F442-K450 HydrophobicContact CD1-CB 4.07Å; F442-K450 HydrophobicContact CE1-CB 3.7Å; A447-K450 PolarHBondContact O-N 3.34Å; Y448-K450 PolarHBondContact O-N 3.41Å; Y448-K450 VanDerWaalsContact O-N 3.14Å; K450-M454 WeakPolarHBondContact O-CB 3.33Å; K450-M454 PolarHBondContact O-N 3.4Å
451	L	85.9	Confident	82.4	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-66.3	-49.8	-175.7	176.2	53.7	0	0	0	111.3	L438 I439 F442 A447 Y448 M454 L455 F485	L438-L451 HydrophobicContact CB-CD1 3.93Å; I439-L451 HydrophobicContact CD1-CD1 4.21Å; I439-L451 HydrophobicContact CD1-CD2 3.94Å; I439-L451 HydrophobicContact CD1-CG 4.46Å; F442-L451 HydrophobicContact CB-CB 3.86Å; F442-L451 HydrophobicContact CB-CD1 3.83Å; F442-L451 HydrophobicContact CB-CD2 4.07Å; F442-L451 HydrophobicContact CB-CG 4.12Å; F442-L451 HydrophobicContact CD1-CB 4.09Å; F442-L451 HydrophobicContact CD2-CD1 4.32Å; F442-L451 HydrophobicContact CG-CB 4.15Å; F442-L451 HydrophobicContact CG-CD1 4.02Å; A447-L451 PolarHBondContact O-N 3.13Å; A447-L451 VanDerWaalsContact O-N 3.12Å; Y448-L451 PolarHBondContact O-N 2.91Å; L451-M454 PolarHBondContact O-N 3.12Å; L451-L455 HydrophobicContact CD1-CD1 3.64Å; L451-L455 HydrophobicContact CD1-CG 3.78Å; L451-L455 HydrophobicContact CG-CD1 3.86Å; L451-L455 HydrophobicContact CG-CG 4.41Å; L451-L455 VanDerWaalsContact O-CB 3.31Å; L451-L455 WeakPolarHBondContact O-CB 3.3Å; L451-L455 VanDerWaalsContact O-CG 3.3Å; L451-L455 WeakPolarHBondContact O-CG 3.39Å; L451-L455 PolarHBondContact O-N 2.93Å; L451-F485 HydrophobicContact CD2-CE2 3.75Å; L451-F485 HydrophobicContact CD2-CZ 3.54Å; L451-F485 HydrophobicContact CG-CE2 4.48Å
452	L	85.2	Confident	82.3	Confident	1 Å²	1	47.7 Å²	47.7	1%	0.005	22%	0.218	C	C	.	.	H	α-helix	trans	-64.5	-44.8	-179.8	-65.6	-174.6	0	0	0	111.6	M454 L455 N456 V481 T482 F485 C524	L452-M454 VanDerWaalsContact C-N 3.34Å; L452-M454 PolarHBondContact O-N 3.21Å; L452-L455 PolarHBondContact O-N 3.43Å; L452-N456 WeakPolarHBondContact O-CB 3.5Å; L452-N456 PolarHBondContact O-N 3.4Å; L452-V481 HydrophobicContact CD2-CG1 4.2Å; L452-T482 WeakPolarHBondContact CD2-OG1 3.42Å; L452-F485 HydrophobicContact CD1-CD2 4.5Å; L452-F485 HydrophobicContact CD2-CD2 4.28Å; L452-F485 HydrophobicContact CD2-CE2 4.37Å; L452-F485 HydrophobicContact CG-CD2 4.4Å; L452-C524 HydrophobicContact CD1-CB 4.03Å
453	D	86	Confident	82.3	Confident	56 Å²	56	51.4 Å²	51.4	30%	0.299	24%	0.236	S	C	.	.	H	α-helix	trans	-55.1	-48	172.8	-78.3	-7.7	0	0	0	112	N456 S457 P522 D523	D453-N456 PolarHBondContact O-N 3.4Å; D453-S457 VanDerWaalsContact O-CB 3.27Å; D453-S457 WeakPolarHBondContact O-CB 3.42Å; D453-S457 PolarHBondContact O-N 2.96Å; D453-P522 VanDerWaalsContact OD1-C 3.28Å; D453-P522 WeakPolarHBondContact OD1-CB 3.34Å; D453-P522 WeakPolarHBondContact OD2-CB 3.45Å; D453-D523 VanDerWaalsContact OD1-CB 3.29Å; D453-D523 WeakPolarHBondContact OD1-CB 3.15Å; D453-D523 VanDerWaalsContact OD1-CG 3.22Å; D453-D523 PolarHBondContact OD1-N 2.87Å
454	M	85.3	Confident	82.1	Confident	80 Å²	80	53.5 Å²	53.5	39%	0.394	25%	0.249	S	C	.	.	H	α-helix	trans	-65.1	-50	-178.9	-170.5	65	70.5	0	0	110.6	L438 F442 K450 L451 L452 N456 S457 W458	L438-M454 HydrophobicContact CD1-CB 4.09Å; L438-M454 HydrophobicContact CD1-CG 3.44Å; L438-M454 VanDerWaalsContact CD1-CG 3.44Å; F442-M454 HydrophobicContact CZ-CB 4.45Å; F442-M454 HydrophobicContact CZ-CE 4.44Å; F442-M454 HydrophobicContact CZ-CG 4.38Å; K450-M454 WeakPolarHBondContact O-CB 3.33Å; K450-M454 PolarHBondContact O-N 3.4Å; L451-M454 PolarHBondContact O-N 3.12Å; L452-M454 VanDerWaalsContact C-N 3.34Å; L452-M454 PolarHBondContact O-N 3.21Å; M454-N456 VanDerWaalsContact C-N 3.29Å; M454-N456 PolarHBondContact O-N 2.95Å; M454-S457 PolarHBondContact O-N 3.06Å; M454-S457 VanDerWaalsContact O-N 3.15Å; M454-S457 PolarHBondContact O-OG 3.11Å; M454-W458 PolarHBondContact O-N 3.05Å; M454-W458 VanDerWaalsContact O-N 3.14Å
455	L	86.6	Confident	82.1	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-57.1	-40.9	176.4	-77.9	173.5	0	0	0	112.4	P435 L438 I439 L451 L452 W458 F477 V478 V481	P435-L455 HydrophobicContact CB-CD2 4.16Å; P435-L455 VanDerWaalsContact O-CD2 3.22Å; P435-L455 WeakPolarHBondContact O-CD2 3.2Å; L438-L455 HydrophobicContact CB-CD2 4.42Å; L438-L455 HydrophobicContact CD1-CD2 4.08Å; L438-L455 HydrophobicContact CD1-CG 4.39Å; I439-L455 HydrophobicContact CD1-CD1 4.02Å; L451-L455 HydrophobicContact CD1-CD1 3.64Å; L451-L455 HydrophobicContact CD1-CG 3.78Å; L451-L455 HydrophobicContact CG-CD1 3.86Å; L451-L455 HydrophobicContact CG-CG 4.41Å; L451-L455 VanDerWaalsContact O-CB 3.31Å; L451-L455 WeakPolarHBondContact O-CB 3.3Å; L451-L455 VanDerWaalsContact O-CG 3.3Å; L451-L455 WeakPolarHBondContact O-CG 3.39Å; L451-L455 PolarHBondContact O-N 2.93Å; L452-L455 PolarHBondContact O-N 3.43Å; L455-W458 WeakPolarHBondContact O-CB 3.2Å; L455-W458 PolarHBondContact O-N 3.26Å; L455-F477 HydrophobicContact CD2-CE1 4.01Å; L455-V478 HydrophobicContact CB-CG1 4.05Å; L455-V478 HydrophobicContact CB-CG2 3.86Å; L455-V478 HydrophobicContact CD2-CG2 4.46Å; L455-V481 HydrophobicContact CD1-CG1 4.12Å
456	N	85.1	Confident	81.9	Confident	31 Å²	31	67.1 Å²	67.1	17%	0.166	31%	0.311	C	S	.	.	H	α-helix	trans	-71.3	-37	178.1	-164.3	46.1	0	0	0	111.4	L452 D453 M454 W458 K459 D523 T527	L452-N456 WeakPolarHBondContact O-CB 3.5Å; L452-N456 PolarHBondContact O-N 3.4Å; D453-N456 PolarHBondContact O-N 3.4Å; M454-N456 VanDerWaalsContact C-N 3.29Å; M454-N456 PolarHBondContact O-N 2.95Å; N456-W458 PolarHBondContact O-N 2.97Å; N456-K459 WeakPolarHBondContact O-CB 3.48Å; N456-K459 WeakPolarHBondContact O-CG 3.26Å; N456-K459 PolarHBondContact O-N 2.82Å; N456-K459 WeakPolarHBondContact OD1-CE 3.44Å; N456-K459 PolarHBondContact OD1-NZ 2.91Å; N456-D523 HydrophobicContact CB-CB 4.29Å; N456-D523 PolarHBondContact ND2-OD2 3.46Å; N456-T527 HydrophobicContact CB-CG2 3.83Å
457	S	86.5	Confident	82	Confident	28 Å²	28	69 Å²	69	20%	0.196	32%	0.32	C	S	.	.	H	α-helix	trans	-64.3	-27	176.7	80.8	0	0	0	0	113.3	D453 M454 K459 R460	D453-S457 VanDerWaalsContact O-CB 3.27Å; D453-S457 WeakPolarHBondContact O-CB 3.42Å; D453-S457 PolarHBondContact O-N 2.96Å; M454-S457 PolarHBondContact O-N 3.06Å; M454-S457 VanDerWaalsContact O-N 3.15Å; M454-S457 PolarHBondContact O-OG 3.11Å; S457-K459 PolarHBondContact O-N 2.86Å; S457-K459 VanDerWaalsContact O-N 3.16Å; S457-R460 WeakPolarHBondContact O-CB 3.45Å; S457-R460 WeakPolarHBondContact O-CG 3.32Å; S457-R460 PolarHBondContact O-N 3.27Å
458	W	83.8	Confident	82	Confident	41 Å²	41	72.7 Å²	72.7	16%	0.155	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-58.2	-27.9	177	-91.4	95.6	0	0	0	113.2	D431 A434 P435 M454 L455 N456 R460 Y461 L474	D431-W458 WeakPolarHBondContact O-CZ3 3.22Å; A434-W458 HydrophobicContact CB-CH2 3.16Å; A434-W458 HydrophobicContact CB-CZ2 3.35Å; A434-W458 HydrophobicContact CB-CZ3 3.85Å; P435-W458 HydrophobicContact CB-CB 4.22Å; P435-W458 HydrophobicContact CB-CD2 4.19Å; P435-W458 HydrophobicContact CB-CG 3.9Å; P435-W458 HydrophobicContact CG-CD2 4.39Å; P435-W458 HydrophobicContact CG-CE3 4.46Å; P435-W458 HydrophobicContact CG-CG 4.47Å; M454-W458 PolarHBondContact O-N 3.05Å; M454-W458 VanDerWaalsContact O-N 3.14Å; L455-W458 WeakPolarHBondContact O-CB 3.2Å; L455-W458 PolarHBondContact O-N 3.26Å; N456-W458 PolarHBondContact O-N 2.97Å; W458-R460 PolarHBondContact O-N 3.22Å; W458-R460 VanDerWaalsContact O-N 3.12Å; W458-Y461 HydrophobicContact CD2-CD2 4.45Å; W458-Y461 HydrophobicContact CE3-CD2 4.13Å; W458-Y461 PolarHBondContact O-N 2.83Å; W458-L474 HydrophobicContact CB-CD2 4.15Å
459	K	83	Confident	82.1	Confident	19 Å²	19	74.2 Å²	74.2	8%	0.083	34%	0.344	C	S	.	.	G	3₁₀ helix	trans	-55.5	-30.7	174.9	-64.3	171	178.6	172.2	0	111.9	N456 S457 Y461 V462 W471 L474 H475	N456-K459 WeakPolarHBondContact O-CB 3.48Å; N456-K459 WeakPolarHBondContact O-CG 3.26Å; N456-K459 PolarHBondContact O-N 2.82Å; N456-K459 WeakPolarHBondContact OD1-CE 3.44Å; N456-K459 PolarHBondContact OD1-NZ 2.91Å; S457-K459 PolarHBondContact O-N 2.86Å; S457-K459 VanDerWaalsContact O-N 3.16Å; K459-Y461 PolarHBondContact O-N 2.87Å; K459-V462 PolarHBondContact O-N 3.16Å; K459-W471 HydrophobicContact CB-CH2 4.07Å; K459-W471 HydrophobicContact CB-CZ3 3.81Å; K459-W471 HydrophobicContact CG-CZ3 4.47Å; K459-W471 WeakPolarHBondContact O-CZ3 3.36Å; K459-L474 HydrophobicContact CG-CD2 3.8Å; K459-L474 HydrophobicContact CG-CG 4.34Å; K459-H475 WeakPolarHBondContact CD-NE2 3.45Å; K459-H475 WeakPolarHBondContact CE-NE2 3.49Å; K459-H475 PolarHBondContact NZ-CE1 3.4Å
460	R	85	Confident	82.5	Confident	213 Å²	213	71.1 Å²	71.1	80%	0.804	33%	0.328	S	S	*	.	G	3₁₀ helix	trans	-65.3	-20.5	179.8	-61	178.9	-176.7	179.2	3	114.1	S457 W458	S457-R460 WeakPolarHBondContact O-CB 3.45Å; S457-R460 WeakPolarHBondContact O-CG 3.32Å; S457-R460 PolarHBondContact O-N 3.27Å; W458-R460 PolarHBondContact O-N 3.22Å; W458-R460 VanDerWaalsContact O-N 3.12Å
461	Y	82.1	Confident	82.6	Confident	168 Å²	168	68.1 Å²	68.1	66%	0.659	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-96	-7	-179.8	-54.7	-68.1	0	0	0	113	W458 K459	W458-Y461 HydrophobicContact CD2-CD2 4.45Å; W458-Y461 HydrophobicContact CE3-CD2 4.13Å; W458-Y461 PolarHBondContact O-N 2.83Å; K459-Y461 PolarHBondContact O-N 2.87Å
462	V	82	Confident	82.7	Confident	10 Å²	10	68.3 Å²	68.3	6%	0.061	31%	0.314	C	S	.	.	S	Bend	trans	-97.8	123.5	178.9	-179.3	0	0	0	0	108.6	K459 P464 Q467 L470 W471 L474	K459-V462 PolarHBondContact O-N 3.16Å; V462-P464 VanDerWaalsContact O-CD 3.24Å; V462-P464 WeakPolarHBondContact O-CD 3.5Å; V462-Q467 HydrophobicContact CG1-CB 3.92Å; V462-L470 HydrophobicContact CG1-CB 4.39Å; V462-L470 HydrophobicContact CG1-CD2 4.2Å; V462-L470 HydrophobicContact CG1-CG 4.12Å; V462-L470 HydrophobicContact CG2-CD2 3.95Å; V462-L470 HydrophobicContact CG2-CG 4.13Å; V462-W471 HydrophobicContact CB-CE3 3.96Å; V462-W471 HydrophobicContact CG1-CB 3.93Å; V462-W471 HydrophobicContact CG1-CE3 3.89Å; V462-L474 HydrophobicContact CG2-CD2 4.13Å
463	Q	81.5	Confident	82.8	Confident	110 Å²	110	68.4 Å²	68.4	51%	0.514	32%	0.315	S	S	.	.			trans	-80.9	109.2	175.3	-67.2	-63.7	-14.8	0	0	109.3	H465 E466 Q467	Q463-H465 PolarHBondContact O-N 3.19Å; Q463-H465 VanDerWaalsContact O-N 3.11Å; Q463-E466 HydrophobicContact CB-CB 4.03Å; Q463-E466 HydrophobicContact CB-CG 4.26Å; Q463-E466 PolarHBondContact O-N 2.94Å; Q463-E466 VanDerWaalsContact O-N 3.16Å; Q463-Q467 PolarHBondContact O-N 3.42Å
464	P	78.2	Confident	83	Confident	45 Å²	45	65.7 Å²	65.7	29%	0.292	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-29.4	-168.6	-23.1	33.6	0	0	0	113.9	V462 I468 W471	V462-P464 VanDerWaalsContact O-CD 3.24Å; V462-P464 WeakPolarHBondContact O-CD 3.5Å; P464-I468 WeakPolarHBondContact O-CA 3.48Å; P464-I468 WeakPolarHBondContact O-CG1 3.47Å; P464-W471 HydrophobicContact CB-CD2 3.97Å; P464-W471 HydrophobicContact CB-CE3 4.24Å; P464-W471 HydrophobicContact CB-CG 4.2Å; P464-W471 HydrophobicContact CG-CD2 4.02Å; P464-W471 HydrophobicContact CG-CE3 3.83Å; P464-W471 HydrophobicContact CG-CH2 4.11Å; P464-W471 HydrophobicContact CG-CZ2 4.28Å; P464-W471 HydrophobicContact CG-CZ3 3.86Å
465	H	79.4	Confident	83.3	Confident	174 Å²	174	62.5 Å²	62.5	81%	0.806	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.7	-24.8	-178.1	-59.7	-52.6	0	0	0	113.8	Q463	Q463-H465 PolarHBondContact O-N 3.19Å; Q463-H465 VanDerWaalsContact O-N 3.11Å
466	E	76	Confident	83.6	Confident	161 Å²	161	62.5 Å²	62.5	75%	0.752	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.5	-32.5	-179.6	-62	178.7	176.9	0	0	111.5	Q463	Q463-E466 HydrophobicContact CB-CB 4.03Å; Q463-E466 HydrophobicContact CB-CG 4.26Å; Q463-E466 PolarHBondContact O-N 2.94Å; Q463-E466 VanDerWaalsContact O-N 3.16Å
467	Q	76.8	Confident	83.9	Confident	83 Å²	83	61 Å²	61	39%	0.388	28%	0.277	S	S	.	.			trans	-120	46.9	-173.9	-61.9	179.3	-22.4	0	0	110.9	V462 Q463 L469 L470 W471	V462-Q467 HydrophobicContact CG1-CB 3.92Å; Q463-Q467 PolarHBondContact O-N 3.42Å; Q467-L469 VanDerWaalsContact C-N 3.26Å; Q467-L469 PolarHBondContact O-N 3.2Å; Q467-L470 HydrophobicContact CB-CB 4.17Å; Q467-L470 PolarHBondContact O-N 3.11Å; Q467-L470 VanDerWaalsContact O-N 3.11Å; Q467-W471 WeakPolarHBondContact O-CB 3.42Å; Q467-W471 PolarHBondContact O-N 2.88Å
468	I	79.8	Confident	84.2	Confident	96 Å²	96	59.7 Å²	59.7	49%	0.492	27%	0.268	S	S	.	.	H	α-helix	trans	-51.1	-45	-174.1	-61.6	166.7	0	0	0	112	P464 W471 S472	P464-I468 WeakPolarHBondContact O-CA 3.48Å; P464-I468 WeakPolarHBondContact O-CG1 3.47Å; I468-W471 WeakPolarHBondContact O-CB 3.49Å; I468-W471 PolarHBondContact O-N 2.62Å; I468-S472 WeakPolarHBondContact O-CB 3.45Å; I468-S472 PolarHBondContact O-N 3.33Å
469	L	79.7	Confident	84.7	Confident	36 Å²	36	57.8 Å²	57.8	19%	0.188	26%	0.26	C	S	.	.	H	α-helix	trans	-67.3	-44.7	-178.8	-63.3	170.2	0	0	0	112.1	L80 T84 V135 Q467 W471 S472 N473	L80-L469 HydrophobicContact CB-CD1 3.62Å; L80-L469 HydrophobicContact CB-CD2 4.08Å; L80-L469 HydrophobicContact CD1-CD1 3.7Å; L80-L469 HydrophobicContact CG-CD1 4.14Å; T84-L469 WeakPolarHBondContact OG1-CD2 3.21Å; V135-L469 HydrophobicContact CG2-CD1 3.96Å; Q467-L469 VanDerWaalsContact C-N 3.26Å; Q467-L469 PolarHBondContact O-N 3.2Å; L469-W471 VanDerWaalsContact C-N 3.32Å; L469-S472 PolarHBondContact O-N 3.46Å; L469-N473 VanDerWaalsContact O-CB 3.25Å; L469-N473 WeakPolarHBondContact O-CB 3.22Å; L469-N473 PolarHBondContact O-N 3.36Å; L469-N473 PolarHBondContact O-ND2 3.4Å
470	L	82.2	Confident	85.2	Confident	17 Å²	17	56.9 Å²	56.9	9%	0.089	26%	0.256	C	S	.	.	H	α-helix	trans	-63.5	-42.1	176.5	176.6	59.8	0	0	0	110.5	L138 D432 V462 Q467 N473 L474	L138-L470 HydrophobicContact CD1-CB 4.3Å; L138-L470 HydrophobicContact CD1-CD1 3.72Å; L138-L470 HydrophobicContact CD2-CD1 3.6Å; L138-L470 HydrophobicContact CG-CD1 4.33Å; D432-L470 HydrophobicContact CB-CD2 4.32Å; V462-L470 HydrophobicContact CG1-CB 4.39Å; V462-L470 HydrophobicContact CG1-CD2 4.2Å; V462-L470 HydrophobicContact CG1-CG 4.12Å; V462-L470 HydrophobicContact CG2-CD2 3.95Å; V462-L470 HydrophobicContact CG2-CG 4.13Å; Q467-L470 HydrophobicContact CB-CB 4.17Å; Q467-L470 PolarHBondContact O-N 3.11Å; Q467-L470 VanDerWaalsContact O-N 3.11Å; L470-N473 PolarHBondContact O-N 2.85Å; L470-L474 WeakPolarHBondContact O-CB 3.5Å; L470-L474 PolarHBondContact O-N 3.42Å
471	W	85.3	Confident	85.5	Confident	61 Å²	61	46.8 Å²	46.8	23%	0.231	22%	0.218	C	C	.	.	H	α-helix	trans	-58.4	-52.4	176.3	179.4	-96	0	0	0	112	K459 V462 P464 Q467 I468 L469 L474 H475	K459-W471 HydrophobicContact CB-CH2 4.07Å; K459-W471 HydrophobicContact CB-CZ3 3.81Å; K459-W471 HydrophobicContact CG-CZ3 4.47Å; K459-W471 WeakPolarHBondContact O-CZ3 3.36Å; V462-W471 HydrophobicContact CB-CE3 3.96Å; V462-W471 HydrophobicContact CG1-CB 3.93Å; V462-W471 HydrophobicContact CG1-CE3 3.89Å; P464-W471 HydrophobicContact CB-CD2 3.97Å; P464-W471 HydrophobicContact CB-CE3 4.24Å; P464-W471 HydrophobicContact CB-CG 4.2Å; P464-W471 HydrophobicContact CG-CD2 4.02Å; P464-W471 HydrophobicContact CG-CE3 3.83Å; P464-W471 HydrophobicContact CG-CH2 4.11Å; P464-W471 HydrophobicContact CG-CZ2 4.28Å; P464-W471 HydrophobicContact CG-CZ3 3.86Å; Q467-W471 WeakPolarHBondContact O-CB 3.42Å; Q467-W471 PolarHBondContact O-N 2.88Å; I468-W471 WeakPolarHBondContact O-CB 3.49Å; I468-W471 PolarHBondContact O-N 2.62Å; L469-W471 VanDerWaalsContact C-N 3.32Å; W471-L474 PolarHBondContact O-N 3.49Å; W471-H475 AromaticContact CE2-CD2 3.6Å; W471-H475 AromaticContact CE2-NE2 3.39Å; W471-H475 AromaticContact CH2-NE2 3.69Å; W471-H475 AromaticContact CZ2-CD2 3.85Å; W471-H475 AromaticContact CZ2-NE2 3.13Å; W471-H475 WeakPolarHBondContact CZ2-NE2 3.23Å; W471-H475 AromaticContact NE1-CD2 3.74Å; W471-H475 AromaticContact NE1-NE2 3.81Å; W471-H475 PolarHBondContact O-CD2 3.01Å; W471-H475 PolarHBondContact O-N 2.93Å
472	S	87.5	Confident	85.9	Confident	4 Å²	4	38.8 Å²	38.8	3%	0.028	19%	0.187	C	C	.	.	H	α-helix	trans	-62.2	-45.4	179.7	-171.2	0	0	0	0	111.7	R88 I468 L469 L474 H475 R476	R88-S472 PolarHBondContact NH1-OG 3.06Å; I468-S472 WeakPolarHBondContact O-CB 3.45Å; I468-S472 PolarHBondContact O-N 3.33Å; L469-S472 PolarHBondContact O-N 3.46Å; S472-L474 PolarHBondContact O-N 2.74Å; S472-H475 PolarHBondContact O-N 2.63Å; S472-R476 PolarHBondContact O-N 3.4Å
473	N	87.9	Confident	86.2	Confident	3 Å²	3	38.3 Å²	38.3	2%	0.016	18%	0.184	C	C	.	.	H	α-helix	trans	-64	-40.7	177.5	-73.9	-28.3	0	0	0	112.6	L469 L470 R476 F477	L469-N473 VanDerWaalsContact O-CB 3.25Å; L469-N473 WeakPolarHBondContact O-CB 3.22Å; L469-N473 PolarHBondContact O-N 3.36Å; L469-N473 PolarHBondContact O-ND2 3.4Å; L470-N473 PolarHBondContact O-N 2.85Å; N473-R476 PolarHBondContact O-N 3.49Å; N473-R476 PolarHBondContact OD1-NH1 3.26Å; N473-F477 VanDerWaalsContact O-CB 3.26Å; N473-F477 WeakPolarHBondContact O-CB 3.26Å; N473-F477 PolarHBondContact O-N 3.49Å
474	L	89.2	Confident	86.6	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-65.8	-43.6	178.4	-177	62.8	0	0	0	110.9	P435 W458 K459 V462 L470 W471 S472 R476 F477 V478	P435-L474 HydrophobicContact CB-CD1 3.75Å; P435-L474 HydrophobicContact CG-CD1 3.9Å; W458-L474 HydrophobicContact CB-CD2 4.15Å; K459-L474 HydrophobicContact CG-CD2 3.8Å; K459-L474 HydrophobicContact CG-CG 4.34Å; V462-L474 HydrophobicContact CG2-CD2 4.13Å; L470-L474 WeakPolarHBondContact O-CB 3.5Å; L470-L474 PolarHBondContact O-N 3.42Å; W471-L474 PolarHBondContact O-N 3.49Å; S472-L474 PolarHBondContact O-N 2.74Å; L474-R476 PolarHBondContact O-N 3.37Å; L474-F477 PolarHBondContact O-N 3.37Å; L474-V478 HydrophobicContact CD1-CG2 3.82Å; L474-V478 HydrophobicContact CG-CG2 4.25Å; L474-V478 WeakPolarHBondContact O-CB 3.36Å; L474-V478 VanDerWaalsContact O-CG2 3.23Å; L474-V478 WeakPolarHBondContact O-CG2 3.32Å; L474-V478 PolarHBondContact O-N 2.88Å
475	H	91.4	Very high	86.9	Confident	12 Å²	12	31 Å²	31	6%	0.056	15%	0.146	C	C	.	.	H	α-helix	trans	-60.1	-45	174.3	-91.4	-98.7	0	0	0	112.2	K459 W471 S472 C479 G530 Y531 L534	K459-H475 WeakPolarHBondContact CD-NE2 3.45Å; K459-H475 WeakPolarHBondContact CE-NE2 3.49Å; K459-H475 PolarHBondContact NZ-CE1 3.4Å; W471-H475 AromaticContact CE2-CD2 3.6Å; W471-H475 AromaticContact CE2-NE2 3.39Å; W471-H475 AromaticContact CH2-NE2 3.69Å; W471-H475 AromaticContact CZ2-CD2 3.85Å; W471-H475 AromaticContact CZ2-NE2 3.13Å; W471-H475 WeakPolarHBondContact CZ2-NE2 3.23Å; W471-H475 AromaticContact NE1-CD2 3.74Å; W471-H475 AromaticContact NE1-NE2 3.81Å; W471-H475 PolarHBondContact O-CD2 3.01Å; W471-H475 PolarHBondContact O-N 2.93Å; S472-H475 PolarHBondContact O-N 2.63Å; H475-C479 VanDerWaalsContact O-CB 3.24Å; H475-C479 WeakPolarHBondContact O-CB 3.46Å; H475-C479 PolarHBondContact O-N 3.26Å; H475-C479 VanDerWaalsContact O-N 3.1Å; H475-G530 PolarHBondContact CE1-O 3.31Å; H475-G530 PolarHBondContact ND1-O 2.84Å; H475-Y531 HydrophobicContact CB-CD2 4.06Å; H475-L534 HydrophobicContact CB-CD2 3.97Å
476	R	93	Very high	87	Confident	0 Å²	0	22.9 Å²	22.9	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-57.7	-56.1	173.2	-176.7	-162.3	63	-117.2	-3.7	110.5	R88 E142 S472 N473 L474 V478 C479 H480 Y531	R88-R476 HydrophobicContact CG-CG 4.4Å; E142-R476 IonicContact OE1-CZ 2.85Å; E142-R476 IonicContact OE1-NE 3.88Å; E142-R476 IonicContact OE1-NH2 3.73Å; E142-R476 PolarHBondContact OE1-NH2 3.36Å; E142-R476 IonicContact OE2-CZ 3.3Å; E142-R476 IonicContact OE2-NH2 2.88Å; E142-R476 PolarHBondContact OE2-NH2 2.81Å; S472-R476 PolarHBondContact O-N 3.4Å; N473-R476 PolarHBondContact O-N 3.49Å; N473-R476 PolarHBondContact OD1-NH1 3.26Å; L474-R476 PolarHBondContact O-N 3.37Å; R476-V478 PolarHBondContact O-N 3.4Å; R476-C479 PolarHBondContact O-N 3.44Å; R476-H480 VanDerWaalsContact CG-CE1 3.48Å; R476-H480 WeakPolarHBondContact CG-CE1 3.11Å; R476-H480 WeakPolarHBondContact CG-ND1 3.37Å; R476-H480 PolarHBondContact O-N 2.86Å; R476-H480 PolarHBondContact O-ND1 3.25Å; R476-Y531 HydrophobicContact CB-CD2 4.48Å; R476-Y531 HydrophobicContact CB-CE2 3.82Å; R476-Y531 HydrophobicContact CG-CE2 4.31Å
477	F	92.8	Very high	87.3	Confident	1 Å²	1	16 Å²	16	0%	0.004	8%	0.076	C	C	.	.	H	α-helix	trans	-56.5	-51.7	-174.5	174.7	-110.3	0	0	0	111.6	E142 A145 W146 Y436 I439 L455 N473 L474 C479 H480 V481	E142-F477 HydrophobicContact CG-CD2 3.75Å; E142-F477 HydrophobicContact CG-CE2 4.1Å; A145-F477 HydrophobicContact CB-CE2 4.11Å; A145-F477 HydrophobicContact CB-CZ 3.97Å; W146-F477 HydrophobicContact CD2-CE2 4.44Å; W146-F477 AromaticContact CE2-CD2 3.86Å; W146-F477 AromaticContact CE2-CE2 3.85Å; W146-F477 HydrophobicContact CH2-CD2 4.24Å; W146-F477 HydrophobicContact CH2-CE2 4.25Å; W146-F477 AromaticContact CZ2-CD2 3.51Å; W146-F477 HydrophobicContact CZ2-CD2 3.51Å; W146-F477 AromaticContact CZ2-CE2 3.76Å; W146-F477 HydrophobicContact CZ2-CE2 3.76Å; Y436-F477 AromaticContact CD1-CD1 3.77Å; Y436-F477 HydrophobicContact CD1-CD1 3.77Å; Y436-F477 AromaticContact CD1-CD2 3.88Å; Y436-F477 HydrophobicContact CD1-CD2 3.88Å; Y436-F477 AromaticContact CD1-CE1 3.7Å; Y436-F477 HydrophobicContact CD1-CE1 3.7Å; Y436-F477 AromaticContact CD1-CE2 3.83Å; Y436-F477 HydrophobicContact CD1-CE2 3.83Å; Y436-F477 AromaticContact CD1-CG 3.85Å; Y436-F477 HydrophobicContact CD1-CG 3.85Å; Y436-F477 AromaticContact CD1-CZ 3.73Å; Y436-F477 HydrophobicContact CD1-CZ 3.73Å; Y436-F477 HydrophobicContact CE1-CB 3.98Å; Y436-F477 AromaticContact CE1-CD1 3.79Å; Y436-F477 HydrophobicContact CE1-CD1 3.79Å; Y436-F477 AromaticContact CE1-CD2 3.9Å; Y436-F477 HydrophobicContact CE1-CD2 3.9Å; Y436-F477 HydrophobicContact CE1-CE1 4.22Å; Y436-F477 HydrophobicContact CE1-CE2 4.33Å; Y436-F477 AromaticContact CE1-CG 3.61Å; Y436-F477 HydrophobicContact CE1-CG 3.61Å; Y436-F477 HydrophobicContact CE1-CZ 4.47Å; Y436-F477 HydrophobicContact CG-CE1 4.42Å; I439-F477 HydrophobicContact CD1-CZ 4.25Å; I439-F477 HydrophobicContact CG1-CE1 4.38Å; I439-F477 HydrophobicContact CG1-CZ 3.74Å; L455-F477 HydrophobicContact CD2-CE1 4.01Å; N473-F477 VanDerWaalsContact O-CB 3.26Å; N473-F477 WeakPolarHBondContact O-CB 3.26Å; N473-F477 PolarHBondContact O-N 3.49Å; L474-F477 PolarHBondContact O-N 3.37Å; F477-C479 PolarHBondContact O-N 3.43Å; F477-H480 PolarHBondContact O-N 3.49Å; F477-V481 HydrophobicContact CD2-CG2 4.26Å; F477-V481 HydrophobicContact CE1-CG2 4.16Å; F477-V481 HydrophobicContact CE2-CG2 3.88Å; F477-V481 HydrophobicContact CZ-CG2 3.84Å; F477-V481 WeakPolarHBondContact O-CG2 3.35Å; F477-V481 PolarHBondContact O-N 3.01Å
478	V	92.2	Very high	87.4	Confident	0 Å²	0	12.2 Å²	12.2	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-63.7	-41.2	-178.6	-178.5	0	0	0	0	111.2	L455 L474 R476 H480 V481 T482 T527	L455-V478 HydrophobicContact CB-CG1 4.05Å; L455-V478 HydrophobicContact CB-CG2 3.86Å; L455-V478 HydrophobicContact CD2-CG2 4.46Å; L474-V478 HydrophobicContact CD1-CG2 3.82Å; L474-V478 HydrophobicContact CG-CG2 4.25Å; L474-V478 WeakPolarHBondContact O-CB 3.36Å; L474-V478 VanDerWaalsContact O-CG2 3.23Å; L474-V478 WeakPolarHBondContact O-CG2 3.32Å; L474-V478 PolarHBondContact O-N 2.88Å; R476-V478 PolarHBondContact O-N 3.4Å; V478-H480 PolarHBondContact O-N 2.93Å; V478-V481 PolarHBondContact O-N 3.49Å; V478-T482 WeakPolarHBondContact O-CB 3.49Å; V478-T482 PolarHBondContact O-N 3.34Å; V478-T482 PolarHBondContact O-OG1 3.42Å; V478-T527 HydrophobicContact CG1-CG2 3.38Å
479	C	93.7	Very high	87	Confident	0 Å²	0	8.2 Å²	8.2	0%	0	4%	0.037	C	C	.	.	H	α-helix	trans	-59.9	-44.9	174.8	-178.5	0	0	0	0	112.1	H475 R476 F477 T482 I483 Y531	H475-C479 VanDerWaalsContact O-CB 3.24Å; H475-C479 WeakPolarHBondContact O-CB 3.46Å; H475-C479 PolarHBondContact O-N 3.26Å; H475-C479 VanDerWaalsContact O-N 3.1Å; R476-C479 PolarHBondContact O-N 3.44Å; F477-C479 PolarHBondContact O-N 3.43Å; C479-T482 WeakPolarHBondContact O-CB 3.34Å; C479-T482 PolarHBondContact O-N 3.4Å; C479-I483 VanDerWaalsContact O-CG1 3.32Å; C479-I483 WeakPolarHBondContact O-CG1 3.43Å; C479-I483 PolarHBondContact O-N 3.44Å; C479-Y531 HydrophobicContact CB-CD1 3.95Å; C479-Y531 HydrophobicContact CB-CG 3.83Å; C479-Y531 VanDerWaalsContact SG-CD1 3.57Å
480	H	93.7	Very high	86.4	Confident	1 Å²	1	13 Å²	13	1%	0.005	5%	0.053	C	C	.	.	H	α-helix	trans	-70.6	-34.3	179.5	-69.7	77.1	0	0	0	112.3	F91 F111 W146 R476 F477 V478 T482 I483 V484 Y547	F91-H480 HydrophobicContact CD1-CB 4.41Å; F91-H480 AromaticContact CD1-CD2 3.61Å; F91-H480 AromaticContact CD1-CG 3.81Å; F91-H480 AromaticContact CD1-NE2 3.88Å; F111-H480 HydrophobicContact CE2-CB 4.24Å; F111-H480 AromaticContact CZ-CD2 3.72Å; W146-H480 HydrophobicContact CH2-CB 3.74Å; W146-H480 HydrophobicContact CZ2-CB 4.03Å; R476-H480 VanDerWaalsContact CG-CE1 3.48Å; R476-H480 WeakPolarHBondContact CG-CE1 3.11Å; R476-H480 WeakPolarHBondContact CG-ND1 3.37Å; R476-H480 PolarHBondContact O-N 2.86Å; R476-H480 PolarHBondContact O-ND1 3.25Å; F477-H480 PolarHBondContact O-N 3.49Å; V478-H480 PolarHBondContact O-N 2.93Å; H480-T482 VanDerWaalsContact C-N 3.34Å; H480-I483 PolarHBondContact O-N 2.91Å; H480-V484 WeakPolarHBondContact O-CB 3.5Å; H480-V484 VanDerWaalsContact O-CG2 3.26Å; H480-V484 WeakPolarHBondContact O-CG2 3.48Å; H480-V484 PolarHBondContact O-N 2.75Å; H480-Y547 AromaticContact CE1-CE1 3.56Å; H480-Y547 AromaticContact CE1-CZ 3.71Å; H480-Y547 PolarHBondContact CE1-OH 2.89Å; H480-Y547 AromaticContact NE2-CE1 3.46Å; H480-Y547 WeakPolarHBondContact NE2-CE1 3.27Å; H480-Y547 AromaticContact NE2-CZ 3.59Å; H480-Y547 PolarHBondContact NE2-OH 3.2Å
481	V	91.4	Very high	85.6	Confident	0 Å²	0	12.6 Å²	12.6	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-61.8	-45.6	171.1	170.7	0	0	0	0	110.3	W146 I439 L452 L455 F477 V478 I483 V484 F485	W146-V481 HydrophobicContact CH2-CG2 3.63Å; W146-V481 HydrophobicContact CZ2-CG2 4.41Å; W146-V481 HydrophobicContact CZ3-CG2 3.95Å; I439-V481 HydrophobicContact CD1-CG1 3.82Å; I439-V481 HydrophobicContact CD1-CG2 3.93Å; L452-V481 HydrophobicContact CD2-CG1 4.2Å; L455-V481 HydrophobicContact CD1-CG1 4.12Å; F477-V481 HydrophobicContact CD2-CG2 4.26Å; F477-V481 HydrophobicContact CE1-CG2 4.16Å; F477-V481 HydrophobicContact CE2-CG2 3.88Å; F477-V481 HydrophobicContact CZ-CG2 3.84Å; F477-V481 WeakPolarHBondContact O-CG2 3.35Å; F477-V481 PolarHBondContact O-N 3.01Å; V478-V481 PolarHBondContact O-N 3.49Å; V481-I483 PolarHBondContact O-N 3.3Å; V481-V484 PolarHBondContact O-N 3.2Å; V481-F485 HydrophobicContact CG1-CE1 4.22Å; V481-F485 HydrophobicContact CG1-CE2 4.23Å; V481-F485 HydrophobicContact CG1-CZ 4.04Å; V481-F485 WeakPolarHBondContact O-CG 3.4Å; V481-F485 PolarHBondContact O-N 3.48Å
482	T	90	Very high	84.1	Confident	0 Å²	0	13.1 Å²	13.1	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-56.3	-48.5	174.2	-66.4	0	0	0	0	110.9	L452 V478 C479 H480 F485 H486 Y518 C524 T527 I528	L452-T482 WeakPolarHBondContact CD2-OG1 3.42Å; V478-T482 WeakPolarHBondContact O-CB 3.49Å; V478-T482 PolarHBondContact O-N 3.34Å; V478-T482 PolarHBondContact O-OG1 3.42Å; C479-T482 WeakPolarHBondContact O-CB 3.34Å; C479-T482 PolarHBondContact O-N 3.4Å; H480-T482 VanDerWaalsContact C-N 3.34Å; T482-F485 WeakPolarHBondContact O-CB 3.11Å; T482-F485 PolarHBondContact O-N 3.21Å; T482-H486 PolarHBondContact O-N 2.97Å; T482-Y518 WeakPolarHBondContact CG2-OH 3.44Å; T482-Y518 PolarHBondContact O-OH 3.18Å; T482-C524 HydrophobicContact CG2-CB 4.43Å; T482-T527 VanDerWaalsContact CG2-OG1 3.29Å; T482-T527 WeakPolarHBondContact CG2-OG1 3.28Å; T482-T527 PolarHBondContact OG1-OG1 3.44Å; T482-I528 HydrophobicContact CG2-CD1 3.93Å; T482-I528 HydrophobicContact CG2-CG1 3.81Å
483	I	89.7	Confident	82.6	Confident	1 Å²	1	18.7 Å²	18.7	1%	0.005	9%	0.093	C	C	.	.	H	α-helix	trans	-63.6	-43.9	177.4	-68.3	165.4	0	0	0	112.2	L95 C479 H480 V481 F485 H486 Q487 Y547 F550	L95-I483 HydrophobicContact CD1-CG2 3.58Å; L95-I483 HydrophobicContact CD2-CD1 4.26Å; L95-I483 HydrophobicContact CD2-CG2 4.46Å; C479-I483 VanDerWaalsContact O-CG1 3.32Å; C479-I483 WeakPolarHBondContact O-CG1 3.43Å; C479-I483 PolarHBondContact O-N 3.44Å; H480-I483 PolarHBondContact O-N 2.91Å; V481-I483 PolarHBondContact O-N 3.3Å; I483-F485 VanDerWaalsContact C-N 3.25Å; I483-F485 PolarHBondContact O-N 3.16Å; I483-H486 VanDerWaalsContact O-CB 3.31Å; I483-H486 WeakPolarHBondContact O-CB 3.4Å; I483-H486 PolarHBondContact O-N 2.9Å; I483-H486 VanDerWaalsContact O-N 3.13Å; I483-Q487 WeakPolarHBondContact O-CG 3.46Å; I483-Q487 PolarHBondContact O-N 3.47Å; I483-Y547 HydrophobicContact CD1-CD1 3.75Å; I483-Y547 HydrophobicContact CD1-CE1 3.97Å; I483-F550 HydrophobicContact CD1-CD2 3.7Å; I483-F550 HydrophobicContact CD1-CE2 3.85Å; I483-F550 HydrophobicContact CD1-CG 4.15Å; I483-F550 HydrophobicContact CD1-CZ 4.4Å; I483-F550 HydrophobicContact CG1-CB 4.37Å; I483-F550 HydrophobicContact CG1-CD1 4.04Å; I483-F550 HydrophobicContact CG1-CD2 3.9Å; I483-F550 HydrophobicContact CG1-CE1 4.34Å; I483-F550 HydrophobicContact CG1-CE2 4.22Å; I483-F550 HydrophobicContact CG1-CG 3.82Å; I483-F550 HydrophobicContact CG1-CZ 4.43Å; I483-F550 HydrophobicContact CG2-CD1 4.06Å; I483-F550 HydrophobicContact CG2-CE1 3.6Å; I483-F550 HydrophobicContact CG2-CE2 4.26Å; I483-F550 HydrophobicContact CG2-CZ 3.71Å
484	V	88.9	Confident	80.8	Confident	0 Å²	0	19.2 Å²	19.2	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-59.3	-41.1	176.3	169.4	0	0	0	0	110.3	I104 V108 F111 W146 L149 I153 H480 V481 Q487 L488	I104-V484 HydrophobicContact CG2-CG1 4.14Å; V108-V484 HydrophobicContact CG2-CB 4.46Å; V108-V484 HydrophobicContact CG2-CG1 3.75Å; V108-V484 HydrophobicContact CG2-CG2 3.78Å; F111-V484 HydrophobicContact CD2-CG2 4.49Å; F111-V484 HydrophobicContact CE2-CG2 3.86Å; W146-V484 HydrophobicContact CZ3-CG2 4.28Å; L149-V484 HydrophobicContact CD2-CB 4.44Å; L149-V484 HydrophobicContact CD2-CG1 3.82Å; L149-V484 HydrophobicContact CG-CG1 4.48Å; I153-V484 HydrophobicContact CD1-CG1 4.23Å; H480-V484 WeakPolarHBondContact O-CB 3.5Å; H480-V484 VanDerWaalsContact O-CG2 3.26Å; H480-V484 WeakPolarHBondContact O-CG2 3.48Å; H480-V484 PolarHBondContact O-N 2.75Å; V481-V484 PolarHBondContact O-N 3.2Å; V484-Q487 PolarHBondContact O-N 3.47Å; V484-L488 HydrophobicContact CG1-CD1 4.19Å; V484-L488 WeakPolarHBondContact O-CG 3.03Å; V484-L488 PolarHBondContact O-N 2.87Å
485	F	84	Confident	79	Confident	0 Å²	0	19.6 Å²	19.6	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-63.4	-47.3	174	-73.1	5.4	0	0	0	111.1	L149 F443 Y448 L451 L452 V481 T482 I483 Q487 L488 Y489 Y518	L149-F485 HydrophobicContact CD1-CE1 4.11Å; F443-F485 AromaticContact CD2-CE1 3.82Å; F443-F485 HydrophobicContact CD2-CE1 3.82Å; F443-F485 AromaticContact CD2-CZ 3.86Å; F443-F485 HydrophobicContact CD2-CZ 3.86Å; F443-F485 AromaticContact CE2-CE1 3.64Å; F443-F485 HydrophobicContact CE2-CE1 3.64Å; F443-F485 HydrophobicContact CE2-CZ 4.11Å; Y448-F485 HydrophobicContact CD1-CD2 4.48Å; Y448-F485 AromaticContact CD1-CE2 3.88Å; Y448-F485 HydrophobicContact CD1-CE2 3.88Å; Y448-F485 AromaticContact CD1-CZ 3.97Å; Y448-F485 HydrophobicContact CD1-CZ 3.97Å; Y448-F485 HydrophobicContact CE1-CZ 4.4Å; L451-F485 HydrophobicContact CD2-CE2 3.75Å; L451-F485 HydrophobicContact CD2-CZ 3.54Å; L451-F485 HydrophobicContact CG-CE2 4.48Å; L452-F485 HydrophobicContact CD1-CD2 4.5Å; L452-F485 HydrophobicContact CD2-CD2 4.28Å; L452-F485 HydrophobicContact CD2-CE2 4.37Å; L452-F485 HydrophobicContact CG-CD2 4.4Å; V481-F485 HydrophobicContact CG1-CE1 4.22Å; V481-F485 HydrophobicContact CG1-CE2 4.23Å; V481-F485 HydrophobicContact CG1-CZ 4.04Å; V481-F485 WeakPolarHBondContact O-CG 3.4Å; V481-F485 PolarHBondContact O-N 3.48Å; T482-F485 WeakPolarHBondContact O-CB 3.11Å; T482-F485 PolarHBondContact O-N 3.21Å; I483-F485 VanDerWaalsContact C-N 3.25Å; I483-F485 PolarHBondContact O-N 3.16Å; F485-Q487 PolarHBondContact O-N 3.48Å; F485-L488 HydrophobicContact CD1-CD1 4.17Å; F485-L488 WeakPolarHBondContact O-CA 3.43Å; F485-L488 WeakPolarHBondContact O-CB 3.34Å; F485-L488 PolarHBondContact O-N 3.19Å; F485-Y489 VanDerWaalsContact O-CD2 3.26Å; F485-Y489 WeakPolarHBondContact O-CD2 3.41Å; F485-Y489 PolarHBondContact O-N 2.78Å; F485-Y518 HydrophobicContact CB-CE2 4.1Å
486	H	82.8	Confident	76.8	Confident	4 Å²	4	20 Å²	20	2%	0.019	10%	0.102	C	C	.	.	H	α-helix	trans	-50.9	-44.4	175.5	-175.9	65.1	0	0	0	112.6	T482 I483 Y489 R490 Y518 F519 F550	T482-H486 PolarHBondContact O-N 2.97Å; I483-H486 VanDerWaalsContact O-CB 3.31Å; I483-H486 WeakPolarHBondContact O-CB 3.4Å; I483-H486 PolarHBondContact O-N 2.9Å; I483-H486 VanDerWaalsContact O-N 3.13Å; H486-Y489 PolarHBondContact O-N 3.09Å; H486-R490 VanDerWaalsContact CE1-CZ 3.49Å; H486-R490 PolarHBondContact CE1-NE 3.33Å; H486-R490 PolarHBondContact NE2-NE 3.27Å; H486-R490 PolarHBondContact NE2-NH1 3.01Å; H486-R490 PolarHBondContact O-N 2.85Å; H486-Y518 VanDerWaalsContact CA-CE2 3.46Å; H486-Y518 HydrophobicContact CB-CD1 4.22Å; H486-Y518 HydrophobicContact CB-CD2 4.19Å; H486-Y518 HydrophobicContact CB-CE1 3.78Å; H486-Y518 HydrophobicContact CB-CE2 3.75Å; H486-Y518 HydrophobicContact CB-CG 4.39Å; H486-Y518 AromaticContact CG-CE1 3.85Å; H486-Y518 VanDerWaalsContact N-CE2 3.31Å; H486-Y518 AromaticContact ND1-CD1 3.1Å; H486-Y518 WeakPolarHBondContact ND1-CD1 3.45Å; H486-Y518 AromaticContact ND1-CE1 3.32Å; H486-Y518 VanDerWaalsContact ND1-CE1 3.32Å; H486-Y518 WeakPolarHBondContact ND1-CE1 3.18Å; H486-Y518 AromaticContact ND1-CG 3.59Å; H486-Y518 AromaticContact ND1-CZ 3.98Å; H486-F519 AromaticContact CE1-CZ 3.93Å; H486-F550 AromaticContact CD2-CD1 3.77Å
487	Q	81.7	Confident	74.6	Confident	17 Å²	17	25 Å²	25	8%	0.079	13%	0.132	C	C	.	.	H	α-helix	trans	-66.8	-41.9	176.9	-60.4	-58	-5.2	0	0	112.3	I104 I483 V484 F485 Y489 R490 A491	I104-Q487 HydrophobicContact CD1-CB 3.78Å; I104-Q487 HydrophobicContact CG1-CB 3.97Å; I483-Q487 WeakPolarHBondContact O-CG 3.46Å; I483-Q487 PolarHBondContact O-N 3.47Å; V484-Q487 PolarHBondContact O-N 3.47Å; F485-Q487 PolarHBondContact O-N 3.48Å; Q487-Y489 VanDerWaalsContact C-N 3.33Å; Q487-Y489 PolarHBondContact O-N 3.49Å; Q487-R490 PolarHBondContact O-N 2.88Å; Q487-R490 VanDerWaalsContact O-N 3.12Å; Q487-A491 PolarHBondContact O-N 2.97Å
488	L	78.1	Confident	72.5	Confident	3 Å²	3	31.3 Å²	31.3	2%	0.016	16%	0.162	C	C	.	.	H	α-helix	trans	-60.4	-40.4	175.6	-70.9	169.6	0	0	0	112.3	I104 I153 V484 F485 R490 A491 F514	I104-L488 HydrophobicContact CD1-CD2 3.81Å; I104-L488 HydrophobicContact CD1-CG 4.18Å; I104-L488 HydrophobicContact CG2-CD2 3.93Å; I104-L488 HydrophobicContact CG2-CG 4.18Å; I153-L488 HydrophobicContact CD1-CD1 3.86Å; I153-L488 HydrophobicContact CD1-CD2 4.1Å; I153-L488 HydrophobicContact CD1-CG 4.43Å; I153-L488 HydrophobicContact CG1-CD1 4.04Å; I153-L488 HydrophobicContact CG1-CD2 4.05Å; I153-L488 HydrophobicContact CG2-CD2 3.9Å; V484-L488 HydrophobicContact CG1-CD1 4.19Å; V484-L488 WeakPolarHBondContact O-CG 3.03Å; V484-L488 PolarHBondContact O-N 2.87Å; F485-L488 HydrophobicContact CD1-CD1 4.17Å; F485-L488 WeakPolarHBondContact O-CA 3.43Å; F485-L488 WeakPolarHBondContact O-CB 3.34Å; F485-L488 PolarHBondContact O-N 3.19Å; L488-R490 VanDerWaalsContact C-N 3.27Å; L488-R490 PolarHBondContact O-N 3.43Å; L488-A491 PolarHBondContact O-N 2.93Å; L488-F514 HydrophobicContact CB-CE1 3.93Å; L488-F514 HydrophobicContact CB-CZ 4.16Å; L488-F514 HydrophobicContact CD1-CZ 4.39Å
489	Y	72.1	Confident	70.4	Confident	12 Å²	12	31.9 Å²	31.9	5%	0.047	17%	0.166	C	C	.	.	H	α-helix	trans	-66.1	-27.1	176.2	-86.9	-96.7	0	0	0	113	F485 H486 Q487 S495 P513 F514 C516 Y518 L521	F485-Y489 VanDerWaalsContact O-CD2 3.26Å; F485-Y489 WeakPolarHBondContact O-CD2 3.41Å; F485-Y489 PolarHBondContact O-N 2.78Å; H486-Y489 PolarHBondContact O-N 3.09Å; Q487-Y489 VanDerWaalsContact C-N 3.33Å; Q487-Y489 PolarHBondContact O-N 3.49Å; Y489-S495 WeakPolarHBondContact O-CB 3.36Å; Y489-S495 PolarHBondContact O-OG 3.2Å; Y489-P513 PolarHBondContact OH-O 3.2Å; Y489-F514 HydrophobicContact CD1-CB 4.18Å; Y489-F514 AromaticContact CD1-CD1 3.99Å; Y489-F514 HydrophobicContact CD1-CD1 3.99Å; Y489-F514 AromaticContact CD2-CD1 3.46Å; Y489-F514 HydrophobicContact CD2-CD1 3.46Å; Y489-F514 VanDerWaalsContact CD2-CD1 3.46Å; Y489-F514 AromaticContact CD2-CE1 3.83Å; Y489-F514 HydrophobicContact CD2-CE1 3.83Å; Y489-F514 VanDerWaalsContact CE1-CA 3.47Å; Y489-F514 HydrophobicContact CE1-CB 4.22Å; Y489-F514 AromaticContact CE1-CD1 3.94Å; Y489-F514 HydrophobicContact CE1-CD1 3.94Å; Y489-F514 AromaticContact CE2-CD1 3.38Å; Y489-F514 HydrophobicContact CE2-CD1 3.38Å; Y489-F514 AromaticContact CE2-CE1 3.66Å; Y489-F514 HydrophobicContact CE2-CE1 3.66Å; Y489-F514 AromaticContact CG-CD1 3.75Å; Y489-F514 HydrophobicContact CG-CD1 3.75Å; Y489-F514 AromaticContact CZ-CD1 3.6Å; Y489-C516 WeakPolarHBondContact CD1-O 3.35Å; Y489-C516 WeakPolarHBondContact CE1-O 3.22Å; Y489-Y518 AromaticContact CD2-CD2 3.78Å; Y489-Y518 HydrophobicContact CD2-CD2 3.78Å; Y489-Y518 HydrophobicContact CE2-CD2 4.29Å; Y489-Y518 HydrophobicContact CG-CD2 4.1Å; Y489-L521 HydrophobicContact CE2-CD1 3.77Å
490	R	68.1	Low	68.5	Low	136 Å²	136	35.7 Å²	35.7	51%	0.513	19%	0.187	S	C	.	.	H	α-helix	trans	-89.6	-20.5	177.6	-77.7	-174.2	167.9	176.5	0.7	114.1	H486 Q487 L488	H486-R490 VanDerWaalsContact CE1-CZ 3.49Å; H486-R490 PolarHBondContact CE1-NE 3.33Å; H486-R490 PolarHBondContact NE2-NE 3.27Å; H486-R490 PolarHBondContact NE2-NH1 3.01Å; H486-R490 PolarHBondContact O-N 2.85Å; Q487-R490 PolarHBondContact O-N 2.88Å; Q487-R490 VanDerWaalsContact O-N 3.12Å; L488-R490 VanDerWaalsContact C-N 3.27Å; L488-R490 PolarHBondContact O-N 3.43Å
491	A	63.5	Low	66.7	Low	10 Å²	10	43.7 Å²	43.7	8%	0.083	22%	0.224	C	C	.	.			trans	-58.3	127.4	-176.1	0	0	0	0	0	110.8	I104 Q487 L488 N493 M494 S495	I104-A491 HydrophobicContact CD1-CB 4.08Å; Q487-A491 PolarHBondContact O-N 2.97Å; L488-A491 PolarHBondContact O-N 2.93Å; A491-N493 PolarHBondContact O-N 3.19Å; A491-M494 HydrophobicContact CB-CB 4.31Å; A491-M494 PolarHBondContact O-N 3.09Å; A491-S495 WeakPolarHBondContact O-CB 3.49Å; A491-S495 PolarHBondContact O-N 3.02Å
492	P	55.1	Low	64.9	Low	71 Å²	71	49.4 Å²	49.4	46%	0.461	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.1	-34.8	-173	-26.2	31.8	0	0	0	113.9	N102	N102-P492 WeakPolarHBondContact ND2-CD 3.36Å
493	N	54.8	Low	63.1	Low	122 Å²	122	53.8 Å²	53.8	65%	0.652	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-11.2	-175.7	-59.1	-3.7	0	0	0	113.2	L160 A491	L160-N493 HydrophobicContact CD1-CB 4.22Å; L160-N493 WeakPolarHBondContact CD1-O 3.32Å; A491-N493 PolarHBondContact O-N 3.19Å
494	M	52	Low	61.5	Low	14 Å²	14	59.4 Å²	59.4	7%	0.069	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.7	-15.9	-179.2	-68	-70.9	-163.2	0	0	112.6	R156 Q157 L160 A491 F514	R156-M494 HydrophobicContact CB-CE 3.92Å; Q157-M494 HydrophobicContact CG-CE 3.97Å; L160-M494 HydrophobicContact CD1-CE 3.95Å; L160-M494 HydrophobicContact CD1-SD 3.83Å; A491-M494 HydrophobicContact CB-CB 4.31Å; A491-M494 PolarHBondContact O-N 3.09Å; M494-F514 HydrophobicContact CB-CD2 4.4Å; M494-F514 WeakPolarHBondContact O-CB 3.44Å
495	S	49.6	Very low	59.7	Low	8 Å²	8	64.8 Å²	64.8	6%	0.056	32%	0.321	C	S	.	.			trans	-91.4	124.4	-175.5	-165.1	0	0	0	0	112.4	Y489 A491 V497 H498	Y489-S495 WeakPolarHBondContact O-CB 3.36Å; Y489-S495 PolarHBondContact O-OG 3.2Å; A491-S495 WeakPolarHBondContact O-CB 3.49Å; A491-S495 PolarHBondContact O-N 3.02Å; S495-V497 PolarHBondContact O-N 2.94Å; S495-H498 PolarHBondContact O-N 3.31Å
496	P	46.2	Very low	58.1	Low	20 Å²	20	68.9 Å²	68.9	13%	0.13	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-13.3	176.1	10.6	-6.1	0	0	0	113.3	H498 A499 R504 L507 F514	P496-H498 VanDerWaalsContact C-N 3.29Å; P496-H498 PolarHBondContact O-N 3.4Å; P496-A499 PolarHBondContact O-N 3.07Å; P496-R504 HydrophobicContact CB-CG 4.38Å; P496-R504 PolarHBondContact O-NE 2.77Å; P496-R504 PolarHBondContact O-NH2 3.25Å; P496-L507 HydrophobicContact CB-CD1 4.3Å; P496-F514 WeakPolarHBondContact CD-O 3.39Å; P496-F514 WeakPolarHBondContact CG-O 3.21Å
497	V	46.7	Very low	56.5	Low	106 Å²	106	69.6 Å²	69.6	64%	0.642	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-33.3	-178.2	-177.5	0	0	0	0	111.2	S495	S495-V497 PolarHBondContact O-N 2.94Å
498	H	48.2	Very low	55	Low	133 Å²	133	75.4 Å²	75.4	62%	0.616	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.7	-8.8	179	-62.7	-61.6	0	0	0	114	S495 P496	S495-H498 PolarHBondContact O-N 3.31Å; P496-H498 VanDerWaalsContact C-N 3.29Å; P496-H498 PolarHBondContact O-N 3.4Å
499	A	49.1	Very low	53.5	Low	11 Å²	11	82.2 Å²	82.2	9%	0.091	40%	0.403	C	S	.	.			trans	-72	132.2	178.7	0	0	0	0	0	112	P496 E503 R504 L507	P496-A499 PolarHBondContact O-N 3.07Å; A499-E503 VanDerWaalsContact CA-OE2 3.28Å; A499-E503 WeakPolarHBondContact CA-OE2 3.4Å; A499-E503 HydrophobicContact CB-CB 3.52Å; A499-R504 HydrophobicContact CB-CG 3.73Å; A499-R504 PolarHBondContact O-NE 2.69Å; A499-L507 HydrophobicContact CB-CD1 3.65Å
500	N	53.3	Low	52.3	Low	81 Å²	81	86 Å²	86	43%	0.433	42%	0.423	S	S	.	.			trans	-64.1	168.4	166.1	61.7	44.2	0	0	0	111	N502 E503 R504	N500-N502 PolarHBondContact O-N 3.2Å; N500-N502 VanDerWaalsContact O-N 3.15Å; N500-N502 PolarHBondContact OD1-N 2.99Å; N500-E503 VanDerWaalsContact CG-OE2 3.23Å; N500-E503 PolarHBondContact N-OE2 3.11Å; N500-E503 PolarHBondContact ND2-OE1 3.49Å; N500-E503 PolarHBondContact ND2-OE2 3.48Å; N500-E503 PolarHBondContact O-N 2.62Å; N500-E503 WeakPolarHBondContact OD1-CB 3.19Å; N500-E503 VanDerWaalsContact OD1-CD 3.3Å; N500-E503 VanDerWaalsContact OD1-CG 3.23Å; N500-E503 WeakPolarHBondContact OD1-CG 3.35Å; N500-E503 PolarHBondContact OD1-N 3.18Å; N500-E503 PolarHBondContact OD1-OE2 2.67Å; N500-R504 PolarHBondContact O-N 2.97Å
501	E	55.1	Low	51.2	Low	169 Å²	169	81.3 Å²	81.3	79%	0.79	42%	0.417	S	S	*	.	H	α-helix	trans	-54.9	-37	-175.4	-75.4	-177.1	158.7	0	0	113.4	E505	E501-E505 PolarHBondContact O-N 2.8Å; E501-E505 VanDerWaalsContact O-N 3.09Å
502	N	53.3	Low	50.6	Low	120 Å²	120	81.5 Å²	81.5	64%	0.642	42%	0.418	S	S	*	.	H	α-helix	trans	-69.4	-39.7	176.8	-73.7	-23.8	0	0	0	112.2	N500 E505 N506	N500-N502 PolarHBondContact O-N 3.2Å; N500-N502 VanDerWaalsContact O-N 3.15Å; N500-N502 PolarHBondContact OD1-N 2.99Å; N502-E505 PolarHBondContact O-N 3.27Å; N502-N506 PolarHBondContact O-N 3.3Å; N502-N506 PolarHBondContact O-ND2 3.45Å
503	E	52.9	Low	50.4	Low	91 Å²	91	79.3 Å²	79.3	43%	0.425	40%	0.404	S	S	.	.	H	α-helix	trans	-69	-36.7	176.4	-74.7	157.4	-168.7	0	0	111.6	A499 N500 N506 L507	A499-E503 VanDerWaalsContact CA-OE2 3.28Å; A499-E503 WeakPolarHBondContact CA-OE2 3.4Å; A499-E503 HydrophobicContact CB-CB 3.52Å; N500-E503 VanDerWaalsContact CG-OE2 3.23Å; N500-E503 PolarHBondContact N-OE2 3.11Å; N500-E503 PolarHBondContact ND2-OE1 3.49Å; N500-E503 PolarHBondContact ND2-OE2 3.48Å; N500-E503 PolarHBondContact O-N 2.62Å; N500-E503 WeakPolarHBondContact OD1-CB 3.19Å; N500-E503 VanDerWaalsContact OD1-CD 3.3Å; N500-E503 VanDerWaalsContact OD1-CG 3.23Å; N500-E503 WeakPolarHBondContact OD1-CG 3.35Å; N500-E503 PolarHBondContact OD1-N 3.18Å; N500-E503 PolarHBondContact OD1-OE2 2.67Å; E503-N506 PolarHBondContact O-N 3.06Å; E503-L507 WeakPolarHBondContact O-CB 3.26Å; E503-L507 WeakPolarHBondContact O-CD1 3.33Å; E503-L507 VanDerWaalsContact O-CG 3.3Å; E503-L507 WeakPolarHBondContact O-CG 3.46Å; E503-L507 PolarHBondContact O-N 2.84Å
504	R	55.9	Low	50.5	Low	119 Å²	119	73.9 Å²	73.9	45%	0.449	37%	0.374	S	S	.	.	H	α-helix	trans	-63.6	-42.4	172.8	-74.7	-175.8	177.2	173.4	1.9	112.2	P496 A499 N500 N506 L507 H508	P496-R504 HydrophobicContact CB-CG 4.38Å; P496-R504 PolarHBondContact O-NE 2.77Å; P496-R504 PolarHBondContact O-NH2 3.25Å; A499-R504 HydrophobicContact CB-CG 3.73Å; A499-R504 PolarHBondContact O-NE 2.69Å; N500-R504 PolarHBondContact O-N 2.97Å; R504-N506 VanDerWaalsContact C-N 3.32Å; R504-N506 PolarHBondContact O-N 3.34Å; R504-L507 PolarHBondContact O-N 3.09Å; R504-H508 WeakPolarHBondContact O-CB 3.36Å; R504-H508 PolarHBondContact O-N 2.97Å
505	E	50.6	Low	50.5	Low	114 Å²	114	76.5 Å²	76.5	53%	0.533	39%	0.394	S	S	.	.	H	α-helix	trans	-62.3	-39.3	173.6	-99.6	-159.7	-172.9	0	0	112.2	E501 N502 K509	E501-E505 PolarHBondContact O-N 2.8Å; E501-E505 VanDerWaalsContact O-N 3.09Å; N502-E505 PolarHBondContact O-N 3.27Å; E505-K509 WeakPolarHBondContact O-CB 3.25Å; E505-K509 VanDerWaalsContact O-CG 3.25Å; E505-K509 WeakPolarHBondContact O-CG 3.43Å; E505-K509 PolarHBondContact O-N 3Å; E505-K509 IonicContact OE2-NZ 3.67Å; E505-K509 PolarHBondContact OE2-NZ 2.96Å
506	N	50.5	Low	50.9	Low	86 Å²	86	78.5 Å²	78.5	46%	0.46	41%	0.408	S	S	.	.	H	α-helix	trans	-69.7	-43	176.9	-71.4	-28.1	0	0	0	111.6	N502 E503 R504 H508 K509 I510	N502-N506 PolarHBondContact O-N 3.3Å; N502-N506 PolarHBondContact O-ND2 3.45Å; E503-N506 PolarHBondContact O-N 3.06Å; R504-N506 VanDerWaalsContact C-N 3.32Å; R504-N506 PolarHBondContact O-N 3.34Å; N506-H508 VanDerWaalsContact C-N 3.31Å; N506-H508 PolarHBondContact O-N 3.41Å; N506-K509 PolarHBondContact O-N 3.47Å; N506-K509 VanDerWaalsContact O-N 3.11Å; N506-I510 WeakPolarHBondContact O-CB 3.36Å; N506-I510 WeakPolarHBondContact O-CD1 3.44Å; N506-I510 WeakPolarHBondContact O-CG1 3.42Å; N506-I510 PolarHBondContact O-N 3.45Å
507	L	50.5	Low	51.9	Low	19 Å²	19	82.7 Å²	82.7	10%	0.099	43%	0.429	C	S	.	.	H	α-helix	trans	-60.6	-39.1	174.9	-76.5	159.9	0	0	0	111.9	P496 A499 E503 R504 G511 S512	P496-L507 HydrophobicContact CB-CD1 4.3Å; A499-L507 HydrophobicContact CB-CD1 3.65Å; E503-L507 WeakPolarHBondContact O-CB 3.26Å; E503-L507 WeakPolarHBondContact O-CD1 3.33Å; E503-L507 VanDerWaalsContact O-CG 3.3Å; E503-L507 WeakPolarHBondContact O-CG 3.46Å; E503-L507 PolarHBondContact O-N 2.84Å; R504-L507 PolarHBondContact O-N 3.09Å; L507-G511 PolarHBondContact O-N 3.35Å; L507-S512 VanDerWaalsContact O-CB 3.23Å; L507-S512 WeakPolarHBondContact O-CB 3.36Å; L507-S512 PolarHBondContact O-N 3.23Å
508	H	49.9	Very low	53.1	Low	138 Å²	138	78 Å²	78	64%	0.639	40%	0.4	S	S	*	.	H	α-helix	trans	-67.2	-38.8	172.3	-98.4	-70.8	0	0	0	112.9	R504 N506 G511	R504-H508 WeakPolarHBondContact O-CB 3.36Å; R504-H508 PolarHBondContact O-N 2.97Å; N506-H508 VanDerWaalsContact C-N 3.31Å; N506-H508 PolarHBondContact O-N 3.41Å; H508-G511 PolarHBondContact O-N 2.99Å
509	K	47.2	Very low	54.4	Low	146 Å²	146	74.4 Å²	74.4	64%	0.635	38%	0.382	S	S	*	.	H	α-helix	trans	-70.6	-30.3	177.4	-76.6	167.8	-170.7	153.8	0	113	E505 N506 G511	E505-K509 WeakPolarHBondContact O-CB 3.25Å; E505-K509 VanDerWaalsContact O-CG 3.25Å; E505-K509 WeakPolarHBondContact O-CG 3.43Å; E505-K509 PolarHBondContact O-N 3Å; E505-K509 IonicContact OE2-NZ 3.67Å; E505-K509 PolarHBondContact OE2-NZ 2.96Å; N506-K509 PolarHBondContact O-N 3.47Å; N506-K509 VanDerWaalsContact O-N 3.11Å; K509-G511 PolarHBondContact O-N 3.21Å
510	I	46.5	Very low	55.6	Low	92 Å²	92	77.3 Å²	77.3	47%	0.472	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-6.2	176.6	-63.8	160.5	0	0	0	111.4	N506	N506-I510 WeakPolarHBondContact O-CB 3.36Å; N506-I510 WeakPolarHBondContact O-CD1 3.44Å; N506-I510 WeakPolarHBondContact O-CG1 3.42Å; N506-I510 PolarHBondContact O-N 3.45Å
511	G	44.4	Very low	56.5	Low	37 Å²	37	74 Å²	74	38%	0.381	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.8	28.3	-177.6	0	0	0	0	0	112.5	L507 H508 K509 P513	L507-G511 PolarHBondContact O-N 3.35Å; H508-G511 PolarHBondContact O-N 2.99Å; K509-G511 PolarHBondContact O-N 3.21Å; G511-P513 VanDerWaalsContact O-CD 3.26Å; G511-P513 WeakPolarHBondContact O-CD 3.43Å
512	S	50.1	Low	57.6	Low	15 Å²	15	68.4 Å²	68.4	11%	0.105	36%	0.363	C	S	.	.			trans	-60.8	116.1	-175	-178	0	0	0	0	110.9	L507 F514	L507-S512 VanDerWaalsContact O-CB 3.23Å; L507-S512 WeakPolarHBondContact O-CB 3.36Å; L507-S512 PolarHBondContact O-N 3.23Å; S512-F514 PolarHBondContact O-N 2.76Å; S512-F514 VanDerWaalsContact O-N 3.1Å; S512-F514 WeakPolarHBondContact OG-CD2 3.27Å; S512-F514 PolarHBondContact OG-N 2.75Å
513	P	51.5	Low	58.9	Low	25 Å²	25	66 Å²	66	16%	0.162	35%	0.35	C	S	.	.	G	3₁₀ helix	trans	-66.5	-10.5	177.2	33	-42	0	0	0	112.8	Y448 Y489 G511 S515	Y448-P513 HydrophobicContact CD2-CB 3.06Å; Y448-P513 HydrophobicContact CD2-CG 3.57Å; Y448-P513 HydrophobicContact CE1-CG 4.47Å; Y448-P513 HydrophobicContact CE2-CB 3.1Å; Y448-P513 HydrophobicContact CE2-CG 3.1Å; Y448-P513 HydrophobicContact CG-CB 4.06Å; Y448-P513 HydrophobicContact CG-CG 4.43Å; Y489-P513 PolarHBondContact OH-O 3.2Å; G511-P513 VanDerWaalsContact O-CD 3.26Å; G511-P513 WeakPolarHBondContact O-CD 3.43Å; P513-S515 PolarHBondContact O-N 3.18Å
514	F	56.7	Low	60.3	Low	7 Å²	7	61.7 Å²	61.7	3%	0.031	33%	0.33	C	S	.	.	G	3₁₀ helix	trans	-83	14.8	-174.4	-52.9	-64.4	0	0	0	113.3	L488 Y489 M494 P496 S512	L488-F514 HydrophobicContact CB-CE1 3.93Å; L488-F514 HydrophobicContact CB-CZ 4.16Å; L488-F514 HydrophobicContact CD1-CZ 4.39Å; Y489-F514 HydrophobicContact CD1-CB 4.18Å; Y489-F514 AromaticContact CD1-CD1 3.99Å; Y489-F514 HydrophobicContact CD1-CD1 3.99Å; Y489-F514 AromaticContact CD2-CD1 3.46Å; Y489-F514 HydrophobicContact CD2-CD1 3.46Å; Y489-F514 VanDerWaalsContact CD2-CD1 3.46Å; Y489-F514 AromaticContact CD2-CE1 3.83Å; Y489-F514 HydrophobicContact CD2-CE1 3.83Å; Y489-F514 VanDerWaalsContact CE1-CA 3.47Å; Y489-F514 HydrophobicContact CE1-CB 4.22Å; Y489-F514 AromaticContact CE1-CD1 3.94Å; Y489-F514 HydrophobicContact CE1-CD1 3.94Å; Y489-F514 AromaticContact CE2-CD1 3.38Å; Y489-F514 HydrophobicContact CE2-CD1 3.38Å; Y489-F514 AromaticContact CE2-CE1 3.66Å; Y489-F514 HydrophobicContact CE2-CE1 3.66Å; Y489-F514 AromaticContact CG-CD1 3.75Å; Y489-F514 HydrophobicContact CG-CD1 3.75Å; Y489-F514 AromaticContact CZ-CD1 3.6Å; M494-F514 HydrophobicContact CB-CD2 4.4Å; M494-F514 WeakPolarHBondContact O-CB 3.44Å; P496-F514 WeakPolarHBondContact CD-O 3.39Å; P496-F514 WeakPolarHBondContact CG-O 3.21Å; S512-F514 PolarHBondContact O-N 2.76Å; S512-F514 VanDerWaalsContact O-N 3.1Å; S512-F514 WeakPolarHBondContact OG-CD2 3.27Å; S512-F514 PolarHBondContact OG-N 2.75Å
515	S	51.9	Low	61.8	Low	69 Å²	69	58.5 Å²	58.5	48%	0.483	32%	0.321	S	S	.	.	G	3₁₀ helix	trans	-79.1	-10.4	-179.2	57.6	0	0	0	0	115.9	P513	P513-S515 PolarHBondContact O-N 3.18Å
516	C	58.6	Low	63.6	Low	51 Å²	51	54.3 Å²	54.3	35%	0.345	31%	0.308	S	S	.	.	S	Bend	trans	-104.1	159.9	178.6	57.8	0	0	0	0	112.2	Y489 Y518	Y489-C516 WeakPolarHBondContact CD1-O 3.35Å; Y489-C516 WeakPolarHBondContact CE1-O 3.22Å; C516-Y518 PolarHBondContact O-N 3.01Å
517	D	66.7	Low	65.5	Low	108 Å²	108	50.2 Å²	50.2	58%	0.578	29%	0.287	S	S	*	.			trans	-62.1	130.6	169.3	179.2	26.2	0	0	0	109.2	F519 S520	D517-F519 PolarHBondContact O-N 2.81Å; D517-S520 VanDerWaalsContact O-CB 3.27Å; D517-S520 WeakPolarHBondContact O-CB 3.49Å; D517-S520 PolarHBondContact O-N 3.42Å; D517-S520 PolarHBondContact O-OG 2.76Å
518	Y	72.6	Confident	67.5	Low	8 Å²	8	49.3 Å²	49.3	3%	0.031	28%	0.282	C	S	.	.	G	3₁₀ helix	trans	-56.6	-39.8	-177.3	168.3	-96.4	0	0	0	111.9	T482 F485 H486 Y489 C516 S520 L521 C524	T482-Y518 WeakPolarHBondContact CG2-OH 3.44Å; T482-Y518 PolarHBondContact O-OH 3.18Å; F485-Y518 HydrophobicContact CB-CE2 4.1Å; H486-Y518 VanDerWaalsContact CA-CE2 3.46Å; H486-Y518 HydrophobicContact CB-CD1 4.22Å; H486-Y518 HydrophobicContact CB-CD2 4.19Å; H486-Y518 HydrophobicContact CB-CE1 3.78Å; H486-Y518 HydrophobicContact CB-CE2 3.75Å; H486-Y518 HydrophobicContact CB-CG 4.39Å; H486-Y518 AromaticContact CG-CE1 3.85Å; H486-Y518 VanDerWaalsContact N-CE2 3.31Å; H486-Y518 AromaticContact ND1-CD1 3.1Å; H486-Y518 WeakPolarHBondContact ND1-CD1 3.45Å; H486-Y518 AromaticContact ND1-CE1 3.32Å; H486-Y518 VanDerWaalsContact ND1-CE1 3.32Å; H486-Y518 WeakPolarHBondContact ND1-CE1 3.18Å; H486-Y518 AromaticContact ND1-CG 3.59Å; H486-Y518 AromaticContact ND1-CZ 3.98Å; Y489-Y518 AromaticContact CD2-CD2 3.78Å; Y489-Y518 HydrophobicContact CD2-CD2 3.78Å; Y489-Y518 HydrophobicContact CE2-CD2 4.29Å; Y489-Y518 HydrophobicContact CG-CD2 4.1Å; C516-Y518 PolarHBondContact O-N 3.01Å; Y518-S520 PolarHBondContact O-N 3.08Å; Y518-L521 HydrophobicContact CD2-CD1 3.92Å; Y518-L521 HydrophobicContact CE2-CD1 4.2Å; Y518-L521 VanDerWaalsContact O-CB 3.3Å; Y518-L521 WeakPolarHBondContact O-CB 3.47Å; Y518-L521 WeakPolarHBondContact O-CG 3.49Å; Y518-L521 PolarHBondContact O-N 3.26Å; Y518-C524 HydrophobicContact CE1-CB 4.36Å
519	F	75.2	Confident	69.5	Low	56 Å²	56	45.1 Å²	45.1	25%	0.246	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-72.7	-5	178.9	-64.3	-64.5	0	0	0	114	H486 D517 I525 F550 P552	H486-F519 AromaticContact CE1-CZ 3.93Å; D517-F519 PolarHBondContact O-N 2.81Å; F519-I525 HydrophobicContact CD1-CG1 4.37Å; F519-F550 WeakPolarHBondContact CE1-O 3.38Å; F519-P552 HydrophobicContact CD1-CB 4.4Å; F519-P552 HydrophobicContact CD1-CG 3.6Å; F519-P552 HydrophobicContact CE1-CB 4.34Å; F519-P552 HydrophobicContact CE1-CG 3.72Å; F519-P552 HydrophobicContact CG-CG 4.09Å; F519-P552 HydrophobicContact CZ-CB 4.46Å; F519-P552 HydrophobicContact CZ-CG 4.32Å
520	S	73.7	Confident	71.6	Confident	73 Å²	73	38.7 Å²	38.7	51%	0.51	24%	0.237	S	C	.	.	G	3₁₀ helix	trans	-84.7	-10.3	169.4	77	0	0	0	0	113.1	D517 Y518	D517-S520 VanDerWaalsContact O-CB 3.27Å; D517-S520 WeakPolarHBondContact O-CB 3.49Å; D517-S520 PolarHBondContact O-N 3.42Å; D517-S520 PolarHBondContact O-OG 2.76Å; Y518-S520 PolarHBondContact O-N 3.08Å
521	L	73.7	Confident	73.8	Confident	11 Å²	11	34.3 Å²	34.3	6%	0.058	22%	0.215	C	C	.	.	S	Bend	trans	-66.3	134.2	175.8	-70.6	175	0	0	0	110.4	N449 Y489 Y518 C524	N449-L521 HydrophobicContact CB-CD2 4.26Å; Y489-L521 HydrophobicContact CE2-CD1 3.77Å; Y518-L521 HydrophobicContact CD2-CD1 3.92Å; Y518-L521 HydrophobicContact CE2-CD1 4.2Å; Y518-L521 VanDerWaalsContact O-CB 3.3Å; Y518-L521 WeakPolarHBondContact O-CB 3.47Å; Y518-L521 WeakPolarHBondContact O-CG 3.49Å; Y518-L521 PolarHBondContact O-N 3.26Å; L521-C524 HydrophobicContact CB-CB 4.25Å; L521-C524 PolarHBondContact O-SG 3.01Å
522	P	76.6	Confident	76.2	Confident	51 Å²	51	32.5 Å²	32.5	33%	0.331	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.6	140.7	172.4	-29.2	38.3	0	0	0	112.8	D453 C524	D453-P522 VanDerWaalsContact OD1-C 3.28Å; D453-P522 WeakPolarHBondContact OD1-CB 3.34Å; D453-P522 WeakPolarHBondContact OD2-CB 3.45Å; P522-C524 PolarHBondContact O-N 2.67Å
523	D	81.1	Confident	78.2	Confident	69 Å²	69	36.3 Å²	36.3	37%	0.369	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.1	2.5	178.1	-76.4	-4.1	0	0	0	118.1	D453 N456 I525 G526 T527	D453-D523 VanDerWaalsContact OD1-CB 3.29Å; D453-D523 WeakPolarHBondContact OD1-CB 3.15Å; D453-D523 VanDerWaalsContact OD1-CG 3.22Å; D453-D523 PolarHBondContact OD1-N 2.87Å; N456-D523 HydrophobicContact CB-CB 4.29Å; N456-D523 PolarHBondContact ND2-OD2 3.46Å; D523-I525 VanDerWaalsContact C-N 3.32Å; D523-I525 PolarHBondContact O-N 3.42Å; D523-G526 PolarHBondContact O-N 3.1Å; D523-T527 WeakPolarHBondContact O-CG2 3.34Å; D523-T527 PolarHBondContact O-N 3.21Å; D523-T527 PolarHBondContact O-OG1 3.45Å
524	C	83.4	Confident	80.2	Confident	2 Å²	2	36 Å²	36	1%	0.014	21%	0.213	C	C	.	.	H	α-helix	trans	-59.9	-37.2	-177.4	66.3	0	0	0	0	114.1	L452 T482 Y518 L521 P522 T527	L452-C524 HydrophobicContact CD1-CB 4.03Å; T482-C524 HydrophobicContact CG2-CB 4.43Å; Y518-C524 HydrophobicContact CE1-CB 4.36Å; L521-C524 HydrophobicContact CB-CB 4.25Å; L521-C524 PolarHBondContact O-SG 3.01Å; P522-C524 PolarHBondContact O-N 2.67Å; C524-T527 PolarHBondContact O-OG1 3.06Å
525	I	87.2	Confident	81.9	Confident	51 Å²	51	35.7 Å²	35.7	26%	0.262	21%	0.211	S	C	.	.	H	α-helix	trans	-72.8	-42.3	175.5	-63	172.1	0	0	0	109.8	F519 D523 T527 I528 Q529 L551 P552	F519-I525 HydrophobicContact CD1-CG1 4.37Å; D523-I525 VanDerWaalsContact C-N 3.32Å; D523-I525 PolarHBondContact O-N 3.42Å; I525-T527 VanDerWaalsContact C-N 3.33Å; I525-T527 PolarHBondContact O-N 3.16Å; I525-I528 PolarHBondContact O-N 3.16Å; I525-Q529 HydrophobicContact CG2-CG 4.1Å; I525-Q529 VanDerWaalsContact CG2-NE2 3.29Å; I525-Q529 WeakPolarHBondContact O-CB 3.22Å; I525-Q529 VanDerWaalsContact O-CG 3.28Å; I525-Q529 WeakPolarHBondContact O-CG 3.47Å; I525-Q529 PolarHBondContact O-N 2.81Å; I525-L551 HydrophobicContact CG2-CD2 4.07Å; I525-P552 HydrophobicContact CD1-CG 3.59Å; I525-P552 HydrophobicContact CG1-CG 3.91Å
526	G	87.9	Confident	83.8	Confident	26 Å²	26	33.9 Å²	33.9	27%	0.268	20%	0.201	S	C	.	.	H	α-helix	trans	-65.9	-31.7	-178.3	0	0	0	0	0	113.5	D523 G530	D523-G526 PolarHBondContact O-N 3.1Å; G526-G530 PolarHBondContact O-N 3.4Å
527	T	90.2	Very high	85.3	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-69.5	-42	176	54.9	0	0	0	0	112.1	N456 V478 T482 D523 C524 I525 Y531	N456-T527 HydrophobicContact CB-CG2 3.83Å; V478-T527 HydrophobicContact CG1-CG2 3.38Å; T482-T527 VanDerWaalsContact CG2-OG1 3.29Å; T482-T527 WeakPolarHBondContact CG2-OG1 3.28Å; T482-T527 PolarHBondContact OG1-OG1 3.44Å; D523-T527 WeakPolarHBondContact O-CG2 3.34Å; D523-T527 PolarHBondContact O-N 3.21Å; D523-T527 PolarHBondContact O-OG1 3.45Å; C524-T527 PolarHBondContact O-OG1 3.06Å; I525-T527 VanDerWaalsContact C-N 3.33Å; I525-T527 PolarHBondContact O-N 3.16Å; T527-Y531 PolarHBondContact O-N 3.42Å
528	I	92.3	Very high	86.3	Confident	1 Å²	1	33 Å²	33	1%	0.005	20%	0.202	C	C	.	.	H	α-helix	trans	-67	-50.1	174.9	-63.4	165.1	0	0	0	110	T482 I525 G530 Y531 L532 F550 L551	T482-I528 HydrophobicContact CG2-CD1 3.93Å; T482-I528 HydrophobicContact CG2-CG1 3.81Å; I525-I528 PolarHBondContact O-N 3.16Å; I528-G530 VanDerWaalsContact C-N 3.32Å; I528-G530 PolarHBondContact O-N 3.3Å; I528-Y531 PolarHBondContact O-N 3.1Å; I528-L532 HydrophobicContact CG2-CD1 3.98Å; I528-L532 HydrophobicContact CG2-CG 4.31Å; I528-L532 WeakPolarHBondContact O-CG 3.42Å; I528-L532 PolarHBondContact O-N 3.46Å; I528-F550 HydrophobicContact CD1-CB 3.75Å; I528-L551 HydrophobicContact CB-CD2 4.03Å; I528-L551 HydrophobicContact CG2-CD2 3.75Å; I528-L551 HydrophobicContact CG2-CG 3.98Å
529	Q	91.6	Very high	87.1	Confident	50 Å²	50	40.6 Å²	40.6	23%	0.234	24%	0.235	C	C	.	.	H	α-helix	trans	-53.7	-48.4	177.2	-77	172	-16.9	0	0	111.5	I525 Y531 L532 D533 L551 F559	I525-Q529 HydrophobicContact CG2-CG 4.1Å; I525-Q529 VanDerWaalsContact CG2-NE2 3.29Å; I525-Q529 WeakPolarHBondContact O-CB 3.22Å; I525-Q529 VanDerWaalsContact O-CG 3.28Å; I525-Q529 WeakPolarHBondContact O-CG 3.47Å; I525-Q529 PolarHBondContact O-N 2.81Å; Q529-Y531 PolarHBondContact O-N 3.34Å; Q529-L532 CarbonylContact O-C 3.43Å; Q529-L532 WeakPolarHBondContact O-CA 3.39Å; Q529-L532 WeakPolarHBondContact O-CB 3.26Å; Q529-L532 PolarHBondContact O-N 3.37Å; Q529-D533 VanDerWaalsContact O-CG 3.28Å; Q529-D533 PolarHBondContact O-N 3.49Å; Q529-L551 HydrophobicContact CG-CD2 3.99Å; Q529-F559 HydrophobicContact CG-CE1 4.03Å; Q529-F559 HydrophobicContact CG-CE2 4.31Å; Q529-F559 HydrophobicContact CG-CZ 3.88Å
530	G	91.1	Very high	87.8	Confident	10 Å²	10	39.5 Å²	39.5	10%	0.103	23%	0.231	C	C	.	.	H	α-helix	trans	-61.6	-31.3	179.6	0	0	0	0	0	113.4	H475 G526 I528 L534	H475-G530 PolarHBondContact CE1-O 3.31Å; H475-G530 PolarHBondContact ND1-O 2.84Å; G526-G530 PolarHBondContact O-N 3.4Å; I528-G530 VanDerWaalsContact C-N 3.32Å; I528-G530 PolarHBondContact O-N 3.3Å; G530-L534 PolarHBondContact O-N 3.31Å
531	Y	94.2	Very high	88.6	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-76.1	-37	173.8	-176.3	-118.1	0	0	0	111.9	R88 H475 R476 C479 T527 I528 Q529 D533 L534 L535 Y547	R88-Y531 WeakPolarHBondContact CD-OH 3.4Å; R88-Y531 WeakPolarHBondContact CG-OH 3.4Å; H475-Y531 HydrophobicContact CB-CD2 4.06Å; R476-Y531 HydrophobicContact CB-CD2 4.48Å; R476-Y531 HydrophobicContact CB-CE2 3.82Å; R476-Y531 HydrophobicContact CG-CE2 4.31Å; C479-Y531 HydrophobicContact CB-CD1 3.95Å; C479-Y531 HydrophobicContact CB-CG 3.83Å; C479-Y531 VanDerWaalsContact SG-CD1 3.57Å; T527-Y531 PolarHBondContact O-N 3.42Å; I528-Y531 PolarHBondContact O-N 3.1Å; Q529-Y531 PolarHBondContact O-N 3.34Å; Y531-D533 VanDerWaalsContact C-N 3.33Å; Y531-D533 PolarHBondContact O-N 2.95Å; Y531-L534 HydrophobicContact CD2-CD2 4.16Å; Y531-L534 HydrophobicContact CE2-CD2 4.3Å; Y531-L534 WeakPolarHBondContact O-CB 3.3Å; Y531-L534 PolarHBondContact O-N 2.72Å; Y531-L535 HydrophobicContact CD1-CD1 4.02Å; Y531-L535 HydrophobicContact CD1-CG 4.4Å; Y531-L535 HydrophobicContact CE1-CD1 3.72Å; Y531-L535 HydrophobicContact CE1-CD2 4.4Å; Y531-L535 HydrophobicContact CE1-CG 4.15Å; Y531-L535 HydrophobicContact CE2-CD2 4.41Å; Y531-L535 WeakPolarHBondContact O-CG 3.48Å; Y531-L535 PolarHBondContact O-N 3.33Å; Y531-Y547 HydrophobicContact CD1-CD1 4.03Å; Y531-Y547 HydrophobicContact CD1-CD2 4.39Å; Y531-Y547 HydrophobicContact CD1-CE1 4.33Å; Y531-Y547 HydrophobicContact CD1-CG 4.07Å; Y531-Y547 AromaticContact CE1-CD1 3.79Å; Y531-Y547 HydrophobicContact CE1-CD1 3.79Å; Y531-Y547 AromaticContact CE1-CD2 3.76Å; Y531-Y547 HydrophobicContact CE1-CD2 3.76Å; Y531-Y547 AromaticContact CE1-CE1 3.7Å; Y531-Y547 HydrophobicContact CE1-CE1 3.7Å; Y531-Y547 AromaticContact CE1-CE2 3.68Å; Y531-Y547 HydrophobicContact CE1-CE2 3.68Å; Y531-Y547 AromaticContact CE1-CG 3.82Å; Y531-Y547 HydrophobicContact CE1-CG 3.82Å; Y531-Y547 AromaticContact CE1-CZ 3.64Å
532	L	94.6	Very high	89.4	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-60.7	-41.5	171.8	-68.9	173.7	0	0	0	111.7	I528 Q529 L534 L535 A536 Y544 A548 L551	I528-L532 HydrophobicContact CG2-CD1 3.98Å; I528-L532 HydrophobicContact CG2-CG 4.31Å; I528-L532 WeakPolarHBondContact O-CG 3.42Å; I528-L532 PolarHBondContact O-N 3.46Å; Q529-L532 CarbonylContact O-C 3.43Å; Q529-L532 WeakPolarHBondContact O-CA 3.39Å; Q529-L532 WeakPolarHBondContact O-CB 3.26Å; Q529-L532 PolarHBondContact O-N 3.37Å; L532-L534 VanDerWaalsContact C-N 3.28Å; L532-L534 PolarHBondContact O-N 3.02Å; L532-L535 PolarHBondContact O-N 2.95Å; L532-A536 WeakPolarHBondContact O-CB 3.21Å; L532-A536 PolarHBondContact O-N 2.77Å; L532-Y544 HydrophobicContact CB-CD2 4.33Å; L532-Y544 HydrophobicContact CB-CE2 3.68Å; L532-Y544 HydrophobicContact CD2-CD1 4.32Å; L532-Y544 HydrophobicContact CD2-CD2 3.94Å; L532-Y544 HydrophobicContact CD2-CE1 4.33Å; L532-Y544 HydrophobicContact CD2-CE2 3.95Å; L532-Y544 HydrophobicContact CD2-CG 4.13Å; L532-Y544 HydrophobicContact CG-CE2 4.35Å; L532-Y544 WeakPolarHBondContact O-CE2 3.36Å; L532-A548 HydrophobicContact CD1-CB 4.34Å; L532-A548 HydrophobicContact CD2-CB 4.34Å; L532-L551 HydrophobicContact CD1-CD1 3.64Å; L532-L551 HydrophobicContact CD1-CG 4.2Å
533	D	92.7	Very high	90.2	Very high	94 Å²	94	38.3 Å²	38.3	50%	0.503	22%	0.215	S	C	.	.	H	α-helix	trans	-59.6	-39.5	175.2	-66.1	-25.5	0	0	0	111.8	Q529 Y531 A536 A537	Q529-D533 VanDerWaalsContact O-CG 3.28Å; Q529-D533 PolarHBondContact O-N 3.49Å; Y531-D533 VanDerWaalsContact C-N 3.33Å; Y531-D533 PolarHBondContact O-N 2.95Å; D533-A536 PolarHBondContact O-N 2.81Å; D533-A537 WeakPolarHBondContact O-CB 3.18Å; D533-A537 PolarHBondContact O-N 3.41Å
534	L	91.5	Very high	90.8	Very high	19 Å²	19	35.3 Å²	35.3	10%	0.099	20%	0.199	C	C	.	.	H	α-helix	trans	-65	-47.7	174.7	-177.3	75.3	0	0	0	111.2	H475 G530 Y531 L532 A536 A537 E538	H475-L534 HydrophobicContact CB-CD2 3.97Å; G530-L534 PolarHBondContact O-N 3.31Å; Y531-L534 HydrophobicContact CD2-CD2 4.16Å; Y531-L534 HydrophobicContact CE2-CD2 4.3Å; Y531-L534 WeakPolarHBondContact O-CB 3.3Å; Y531-L534 PolarHBondContact O-N 2.72Å; L532-L534 VanDerWaalsContact C-N 3.28Å; L532-L534 PolarHBondContact O-N 3.02Å; L534-A536 VanDerWaalsContact C-N 3.28Å; L534-A536 PolarHBondContact O-N 3.05Å; L534-A537 PolarHBondContact O-N 3.49Å; L534-E538 WeakPolarHBondContact O-CG 3.38Å; L534-E538 PolarHBondContact O-N 3.03Å
535	L	93.1	Very high	91.2	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-61.3	-37.7	176.5	-67.3	179.9	0	0	0	111.7	Y531 L532 E538 K539 E540 L543 Y544 Y547	Y531-L535 HydrophobicContact CD1-CD1 4.02Å; Y531-L535 HydrophobicContact CD1-CG 4.4Å; Y531-L535 HydrophobicContact CE1-CD1 3.72Å; Y531-L535 HydrophobicContact CE1-CD2 4.4Å; Y531-L535 HydrophobicContact CE1-CG 4.15Å; Y531-L535 HydrophobicContact CE2-CD2 4.41Å; Y531-L535 WeakPolarHBondContact O-CG 3.48Å; Y531-L535 PolarHBondContact O-N 3.33Å; L532-L535 PolarHBondContact O-N 2.95Å; L535-E538 CarbonylContact O-C 3.56Å; L535-E538 PolarHBondContact O-N 3.23Å; L535-K539 PolarHBondContact O-N 3.44Å; L535-E540 HydrophobicContact CB-CB 4.15Å; L535-E540 HydrophobicContact CD2-CB 3.89Å; L535-E540 HydrophobicContact CD2-CG 3.99Å; L535-E540 PolarHBondContact O-N 2.81Å; L535-L543 HydrophobicContact CD1-CB 4.17Å; L535-L543 HydrophobicContact CD2-CB 4.4Å; L535-L543 HydrophobicContact CD2-CD1 4.37Å; L535-Y544 HydrophobicContact CB-CD2 4.17Å; L535-Y547 HydrophobicContact CD1-CD2 3.67Å; L535-Y547 HydrophobicContact CD1-CE2 4.27Å; L535-Y547 HydrophobicContact CD1-CG 4.33Å
536	A	92.6	Very high	91.4	Very high	31 Å²	31	34.6 Å²	34.6	26%	0.256	19%	0.194	S	C	.	.	H	α-helix	trans	-65.8	-45.6	176	0	0	0	0	0	111.9	L532 D533 L534 E538 K539 Y544 F563	L532-A536 WeakPolarHBondContact O-CB 3.21Å; L532-A536 PolarHBondContact O-N 2.77Å; D533-A536 PolarHBondContact O-N 2.81Å; L534-A536 VanDerWaalsContact C-N 3.28Å; L534-A536 PolarHBondContact O-N 3.05Å; A536-E538 VanDerWaalsContact C-N 3.26Å; A536-E538 PolarHBondContact O-N 3.49Å; A536-K539 PolarHBondContact O-N 3.11Å; A536-K539 VanDerWaalsContact O-N 3.09Å; A536-Y544 HydrophobicContact CB-CD2 4.36Å; A536-Y544 HydrophobicContact CB-CE2 4.01Å; A536-F563 HydrophobicContact CB-CD2 3.79Å; A536-F563 HydrophobicContact CB-CE2 4.02Å
537	A	89.6	Confident	91.6	Very high	83 Å²	83	33.4 Å²	33.4	69%	0.686	18%	0.182	S	C	*	.	H	α-helix	trans	-60.9	-35.8	176.5	0	0	0	0	0	112.6	D533 L534 K539	D533-A537 WeakPolarHBondContact O-CB 3.18Å; D533-A537 PolarHBondContact O-N 3.41Å; L534-A537 PolarHBondContact O-N 3.49Å; A537-K539 VanDerWaalsContact C-N 3.34Å
538	E	87.3	Confident	91.7	Very high	59 Å²	59	33.4 Å²	33.4	28%	0.276	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-1.6	177.7	-64.9	-177	-160.7	0	0	113.7	R88 L534 L535 A536 E540	R88-E538 IonicContact CZ-OE2 3.34Å; R88-E538 IonicContact NH1-OE1 2.78Å; R88-E538 PolarHBondContact NH1-OE1 3.45Å; R88-E538 IonicContact NH1-OE2 3.73Å; R88-E538 PolarHBondContact NH1-OE2 2.82Å; R88-E538 IonicContact NH2-OE2 3.97Å; R88-E538 PolarHBondContact NH2-OE2 3.49Å; L534-E538 WeakPolarHBondContact O-CG 3.38Å; L534-E538 PolarHBondContact O-N 3.03Å; L535-E538 CarbonylContact O-C 3.56Å; L535-E538 PolarHBondContact O-N 3.23Å; A536-E538 VanDerWaalsContact C-N 3.26Å; A536-E538 PolarHBondContact O-N 3.49Å; E538-E540 VanDerWaalsContact C-N 3.34Å; E538-E540 HydrophobicContact CB-CG 4.06Å; E538-E540 PolarHBondContact O-N 3.37Å
539	K	88.8	Confident	91.6	Very high	166 Å²	166	36.3 Å²	36.3	72%	0.722	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.1	38.1	-179.2	-55.3	-174.7	175.9	-167.9	0	114.2	L535 A536 A537 I541	L535-K539 PolarHBondContact O-N 3.44Å; A536-K539 PolarHBondContact O-N 3.11Å; A536-K539 VanDerWaalsContact O-N 3.09Å; A537-K539 VanDerWaalsContact C-N 3.34Å; K539-I541 VanDerWaalsContact C-N 3.3Å; K539-I541 PolarHBondContact O-N 3.09Å
540	E	90.5	Very high	91.4	Very high	34 Å²	34	34.6 Å²	34.6	16%	0.159	19%	0.191	C	C	.	.			trans	-79.6	72.3	179.6	-67.9	-75.8	-167.5	0	0	111.6	R88 L535 E538 L542 L543 Y544	R88-E540 IonicContact CZ-OE1 3.47Å; R88-E540 IonicContact NH2-OE1 2.78Å; R88-E540 PolarHBondContact NH2-OE1 3.39Å; L535-E540 HydrophobicContact CB-CB 4.15Å; L535-E540 HydrophobicContact CD2-CB 3.89Å; L535-E540 HydrophobicContact CD2-CG 3.99Å; L535-E540 PolarHBondContact O-N 2.81Å; E538-E540 VanDerWaalsContact C-N 3.34Å; E538-E540 HydrophobicContact CB-CG 4.06Å; E538-E540 PolarHBondContact O-N 3.37Å; E540-L542 PolarHBondContact O-N 3.4Å; E540-L543 HydrophobicContact CB-CB 4.42Å; E540-L543 PolarHBondContact O-N 3.12Å; E540-Y544 PolarHBondContact O-N 2.97Å; E540-Y544 VanDerWaalsContact O-N 3.14Å
541	I	91.3	Very high	91.2	Very high	22 Å²	22	34.4 Å²	34.4	11%	0.113	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61	-28.1	-174.2	65.7	177.4	0	0	0	114.2	K539 P545 F563 I567 D572 M575 C576	K539-I541 VanDerWaalsContact C-N 3.3Å; K539-I541 PolarHBondContact O-N 3.09Å; I541-P545 WeakPolarHBondContact O-CD 3.29Å; I541-F563 HydrophobicContact CG2-CZ 4.15Å; I541-I567 HydrophobicContact CB-CD1 4.5Å; I541-I567 HydrophobicContact CG2-CD1 3.9Å; I541-I567 HydrophobicContact CG2-CG1 4.26Å; I541-D572 HydrophobicContact CD1-CB 3.67Å; I541-M575 HydrophobicContact CD1-SD 4.19Å; I541-C576 HydrophobicContact CB-CB 4.49Å
542	L	90.7	Very high	90.6	Very high	83 Å²	83	35.3 Å²	35.3	44%	0.435	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-32.4	-177.2	-66	-178.6	0	0	0	112.4	E540 H546 M575 V579	E540-L542 PolarHBondContact O-N 3.4Å; L542-H546 PolarHBondContact O-CE1 2.9Å; L542-H546 PolarHBondContact O-ND1 2.89Å; L542-M575 HydrophobicContact CD2-CG 3.73Å; L542-M575 HydrophobicContact CD2-SD 3.64Å; L542-M575 HydrophobicContact CG-SD 4.36Å; L542-V579 HydrophobicContact CD2-CG2 3.77Å
543	L	91.9	Very high	89.4	Confident	4 Å²	4	46.4 Å²	46.4	2%	0.021	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-34.6	-177	-67.8	177	0	0	0	111.8	R88 Y92 L535 E540 H546 Y547	R88-L543 HydrophobicContact CB-CD1 4.43Å; Y92-L543 HydrophobicContact CD1-CD2 3.68Å; Y92-L543 HydrophobicContact CD2-CD2 4.28Å; Y92-L543 HydrophobicContact CE1-CD2 4.49Å; Y92-L543 HydrophobicContact CG-CD2 3.57Å; L535-L543 HydrophobicContact CD1-CB 4.17Å; L535-L543 HydrophobicContact CD2-CB 4.4Å; L535-L543 HydrophobicContact CD2-CD1 4.37Å; E540-L543 HydrophobicContact CB-CB 4.42Å; E540-L543 PolarHBondContact O-N 3.12Å; L543-H546 WeakPolarHBondContact O-CB 3.5Å; L543-H546 PolarHBondContact O-N 2.8Å; L543-H546 VanDerWaalsContact O-N 3.09Å; L543-Y547 HydrophobicContact CB-CD2 4.36Å; L543-Y547 HydrophobicContact CB-CE2 4.23Å; L543-Y547 HydrophobicContact CD2-CE2 4.48Å; L543-Y547 VanDerWaalsContact O-CD2 3.31Å; L543-Y547 WeakPolarHBondContact O-CD2 3.44Å; L543-Y547 PolarHBondContact O-N 2.71Å
544	Y	94.2	Very high	88.7	Confident	7 Å²	7	43.6 Å²	43.6	3%	0.027	23%	0.229	C	C	.	.	H	α-helix	trans	-51.4	-50.1	-172.5	-170.4	-78.8	0	0	0	113.9	L532 L535 A536 E540 H546 Y547 A548 F559 V560 F563	L532-Y544 HydrophobicContact CB-CD2 4.33Å; L532-Y544 HydrophobicContact CB-CE2 3.68Å; L532-Y544 HydrophobicContact CD2-CD1 4.32Å; L532-Y544 HydrophobicContact CD2-CD2 3.94Å; L532-Y544 HydrophobicContact CD2-CE1 4.33Å; L532-Y544 HydrophobicContact CD2-CE2 3.95Å; L532-Y544 HydrophobicContact CD2-CG 4.13Å; L532-Y544 HydrophobicContact CG-CE2 4.35Å; L532-Y544 WeakPolarHBondContact O-CE2 3.36Å; L535-Y544 HydrophobicContact CB-CD2 4.17Å; A536-Y544 HydrophobicContact CB-CD2 4.36Å; A536-Y544 HydrophobicContact CB-CE2 4.01Å; E540-Y544 PolarHBondContact O-N 2.97Å; E540-Y544 VanDerWaalsContact O-N 3.14Å; Y544-H546 VanDerWaalsContact C-N 3.32Å; Y544-H546 PolarHBondContact O-N 2.9Å; Y544-Y547 PolarHBondContact O-N 3.37Å; Y544-A548 HydrophobicContact CD1-CB 4.45Å; Y544-A548 HydrophobicContact CE1-CB 4.34Å; Y544-A548 PolarHBondContact O-N 3.41Å; Y544-F559 PolarHBondContact OH-O 3.25Å; Y544-V560 HydrophobicContact CE1-CG2 4.16Å; Y544-F563 HydrophobicContact CD1-CB 4.1Å; Y544-F563 AromaticContact CD1-CD1 3.36Å; Y544-F563 HydrophobicContact CD1-CD1 3.36Å; Y544-F563 HydrophobicContact CD1-CD2 4.47Å; Y544-F563 AromaticContact CD1-CE1 3.86Å; Y544-F563 HydrophobicContact CD1-CE1 3.86Å; Y544-F563 AromaticContact CD1-CG 3.71Å; Y544-F563 HydrophobicContact CD1-CG 3.71Å; Y544-F563 HydrophobicContact CD2-CD1 4.08Å; Y544-F563 AromaticContact CD2-CD2 3.81Å; Y544-F563 HydrophobicContact CD2-CD2 3.81Å; Y544-F563 HydrophobicContact CD2-CE1 4.2Å; Y544-F563 AromaticContact CD2-CE2 3.97Å; Y544-F563 HydrophobicContact CD2-CE2 3.97Å; Y544-F563 AromaticContact CD2-CG 3.87Å; Y544-F563 HydrophobicContact CD2-CG 3.87Å; Y544-F563 HydrophobicContact CD2-CZ 4.14Å; Y544-F563 HydrophobicContact CE1-CB 3.53Å; Y544-F563 AromaticContact CE1-CD1 3.76Å; Y544-F563 HydrophobicContact CE1-CD1 3.76Å; Y544-F563 HydrophobicContact CE1-CD2 4.49Å; Y544-F563 AromaticContact CE1-CG 3.66Å; Y544-F563 HydrophobicContact CE1-CG 3.66Å; Y544-F563 HydrophobicContact CE2-CB 4.05Å; Y544-F563 HydrophobicContact CE2-CD1 4.41Å; Y544-F563 AromaticContact CE2-CD2 3.84Å; Y544-F563 HydrophobicContact CE2-CD2 3.84Å; Y544-F563 HydrophobicContact CE2-CE2 4.43Å; Y544-F563 AromaticContact CE2-CG 3.82Å; Y544-F563 HydrophobicContact CE2-CG 3.82Å; Y544-F563 AromaticContact CG-CD1 3.55Å; Y544-F563 HydrophobicContact CG-CD1 3.55Å; Y544-F563 HydrophobicContact CG-CD2 4.14Å; Y544-F563 AromaticContact CG-CE1 3.61Å; Y544-F563 HydrophobicContact CG-CE1 3.61Å; Y544-F563 HydrophobicContact CG-CE2 4.21Å; Y544-F563 AromaticContact CG-CG 3.81Å; Y544-F563 HydrophobicContact CG-CG 3.81Å; Y544-F563 AromaticContact CG-CZ 3.95Å; Y544-F563 HydrophobicContact CG-CZ 3.95Å; Y544-F563 VanDerWaalsContact CZ-CB 3.5Å; Y544-F563 AromaticContact CZ-CG 3.71Å
545	P	92.7	Very high	88.2	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-63.2	-35.6	-179.2	-22.4	35.5	0	0	0	113.6	I541 Y547 A548 V549 V579 I580 L585	I541-P545 WeakPolarHBondContact O-CD 3.29Å; P545-Y547 PolarHBondContact O-N 3.42Å; P545-A548 PolarHBondContact O-N 3.36Å; P545-V549 PolarHBondContact O-N 3.46Å; P545-V579 HydrophobicContact CB-CG1 3.96Å; P545-V579 HydrophobicContact CG-CB 4.26Å; P545-V579 HydrophobicContact CG-CG1 3.9Å; P545-I580 HydrophobicContact CB-CG1 3.7Å; P545-I580 HydrophobicContact CG-CD1 4.49Å; P545-I580 HydrophobicContact CG-CG1 3.65Å; P545-L585 HydrophobicContact CB-CD1 4.35Å
546	H	91	Very high	87.9	Confident	38 Å²	38	46 Å²	46	18%	0.176	25%	0.245	C	C	.	.	H	α-helix	trans	-65.3	-25.7	179.9	-63.4	114.7	0	0	0	113.1	Y92 L542 L543 Y544 V549 F550 V579 C583	Y92-H546 HydrophobicContact CD2-CB 3.83Å; Y92-H546 HydrophobicContact CE2-CB 3.38Å; Y92-H546 AromaticContact CE2-CD2 3.5Å; Y92-H546 VanDerWaalsContact CE2-CD2 3.5Å; Y92-H546 WeakPolarHBondContact CE2-CD2 3.28Å; Y92-H546 AromaticContact CE2-CG 3.19Å; Y92-H546 AromaticContact CE2-ND1 3.56Å; Y92-H546 AromaticContact CZ-CD2 3.56Å; Y92-H546 AromaticContact CZ-CE1 3.51Å; Y92-H546 AromaticContact CZ-CG 3.52Å; Y92-H546 AromaticContact CZ-ND1 3.48Å; Y92-H546 AromaticContact CZ-NE2 3.61Å; Y92-H546 PolarHBondContact OH-CD2 3.41Å; Y92-H546 PolarHBondContact OH-CE1 3.08Å; Y92-H546 PolarHBondContact OH-NE2 3.03Å; L542-H546 PolarHBondContact O-CE1 2.9Å; L542-H546 PolarHBondContact O-ND1 2.89Å; L543-H546 WeakPolarHBondContact O-CB 3.5Å; L543-H546 PolarHBondContact O-N 2.8Å; L543-H546 VanDerWaalsContact O-N 3.09Å; Y544-H546 VanDerWaalsContact C-N 3.32Å; Y544-H546 PolarHBondContact O-N 2.9Å; H546-V549 WeakPolarHBondContact O-CG1 3.47Å; H546-F550 WeakPolarHBondContact O-CE2 3.33Å; H546-V579 WeakPolarHBondContact CE1-CG1 3.24Å; H546-C583 PolarHBondContact CD2-SG 2.85Å
547	Y	92.7	Very high	87.8	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-93.1	-29.1	174.3	-70.5	-78.1	0	0	0	112.4	L95 H480 I483 Y531 L535 L543 Y544 P545 V549 F550	L95-Y547 HydrophobicContact CD2-CE1 4.22Å; H480-Y547 AromaticContact CE1-CE1 3.56Å; H480-Y547 AromaticContact CE1-CZ 3.71Å; H480-Y547 PolarHBondContact CE1-OH 2.89Å; H480-Y547 AromaticContact NE2-CE1 3.46Å; H480-Y547 WeakPolarHBondContact NE2-CE1 3.27Å; H480-Y547 AromaticContact NE2-CZ 3.59Å; H480-Y547 PolarHBondContact NE2-OH 3.2Å; I483-Y547 HydrophobicContact CD1-CD1 3.75Å; I483-Y547 HydrophobicContact CD1-CE1 3.97Å; Y531-Y547 HydrophobicContact CD1-CD1 4.03Å; Y531-Y547 HydrophobicContact CD1-CD2 4.39Å; Y531-Y547 HydrophobicContact CD1-CE1 4.33Å; Y531-Y547 HydrophobicContact CD1-CG 4.07Å; Y531-Y547 AromaticContact CE1-CD1 3.79Å; Y531-Y547 HydrophobicContact CE1-CD1 3.79Å; Y531-Y547 AromaticContact CE1-CD2 3.76Å; Y531-Y547 HydrophobicContact CE1-CD2 3.76Å; Y531-Y547 AromaticContact CE1-CE1 3.7Å; Y531-Y547 HydrophobicContact CE1-CE1 3.7Å; Y531-Y547 AromaticContact CE1-CE2 3.68Å; Y531-Y547 HydrophobicContact CE1-CE2 3.68Å; Y531-Y547 AromaticContact CE1-CG 3.82Å; Y531-Y547 HydrophobicContact CE1-CG 3.82Å; Y531-Y547 AromaticContact CE1-CZ 3.64Å; L535-Y547 HydrophobicContact CD1-CD2 3.67Å; L535-Y547 HydrophobicContact CD1-CE2 4.27Å; L535-Y547 HydrophobicContact CD1-CG 4.33Å; L543-Y547 HydrophobicContact CB-CD2 4.36Å; L543-Y547 HydrophobicContact CB-CE2 4.23Å; L543-Y547 HydrophobicContact CD2-CE2 4.48Å; L543-Y547 VanDerWaalsContact O-CD2 3.31Å; L543-Y547 WeakPolarHBondContact O-CD2 3.44Å; L543-Y547 PolarHBondContact O-N 2.71Å; Y544-Y547 PolarHBondContact O-N 3.37Å; P545-Y547 PolarHBondContact O-N 3.42Å; Y547-V549 PolarHBondContact O-N 2.98Å; Y547-F550 WeakPolarHBondContact O-CD2 3.4Å; Y547-F550 PolarHBondContact O-N 3.07Å
548	A	92.3	Very high	87.7	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-63.8	-27.4	179.9	0	0	0	0	0	113.2	L532 Y544 P545 F550 L551 H556 V560	L532-A548 HydrophobicContact CD1-CB 4.34Å; L532-A548 HydrophobicContact CD2-CB 4.34Å; Y544-A548 HydrophobicContact CD1-CB 4.45Å; Y544-A548 HydrophobicContact CE1-CB 4.34Å; Y544-A548 PolarHBondContact O-N 3.41Å; P545-A548 PolarHBondContact O-N 3.36Å; A548-F550 PolarHBondContact O-N 3.35Å; A548-F550 VanDerWaalsContact O-N 3.12Å; A548-L551 WeakPolarHBondContact O-CB 3.47Å; A548-L551 PolarHBondContact O-N 3.43Å; A548-H556 WeakPolarHBondContact O-CB 3.4Å; A548-V560 HydrophobicContact CB-CG2 3.46Å; A548-V560 VanDerWaalsContact CB-CG2 3.46Å
549	V	88.9	Confident	87.8	Confident	63 Å²	63	44.5 Å²	44.5	38%	0.382	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-20.7	176.8	77.3	0	0	0	0	114	P545 H546 Y547 L551 L585	P545-V549 PolarHBondContact O-N 3.46Å; H546-V549 WeakPolarHBondContact O-CG1 3.47Å; Y547-V549 PolarHBondContact O-N 2.98Å; V549-L551 VanDerWaalsContact C-N 3.34Å; V549-L585 HydrophobicContact CB-CD2 4.14Å; V549-L585 HydrophobicContact CG2-CD2 3.98Å
550	F	87.4	Confident	88	Confident	14 Å²	14	36.6 Å²	36.6	6%	0.061	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-8.8	178.3	-64	-75.1	0	0	0	113.9	L95 I483 H486 F519 I528 H546 Y547 A548	L95-F550 HydrophobicContact CD1-CZ 4.14Å; L95-F550 HydrophobicContact CD2-CE2 3.62Å; L95-F550 HydrophobicContact CD2-CZ 3.78Å; L95-F550 HydrophobicContact CG-CZ 4.23Å; I483-F550 HydrophobicContact CD1-CD2 3.7Å; I483-F550 HydrophobicContact CD1-CE2 3.85Å; I483-F550 HydrophobicContact CD1-CG 4.15Å; I483-F550 HydrophobicContact CD1-CZ 4.4Å; I483-F550 HydrophobicContact CG1-CB 4.37Å; I483-F550 HydrophobicContact CG1-CD1 4.04Å; I483-F550 HydrophobicContact CG1-CD2 3.9Å; I483-F550 HydrophobicContact CG1-CE1 4.34Å; I483-F550 HydrophobicContact CG1-CE2 4.22Å; I483-F550 HydrophobicContact CG1-CG 3.82Å; I483-F550 HydrophobicContact CG1-CZ 4.43Å; I483-F550 HydrophobicContact CG2-CD1 4.06Å; I483-F550 HydrophobicContact CG2-CE1 3.6Å; I483-F550 HydrophobicContact CG2-CE2 4.26Å; I483-F550 HydrophobicContact CG2-CZ 3.71Å; H486-F550 AromaticContact CD2-CD1 3.77Å; F519-F550 WeakPolarHBondContact CE1-O 3.38Å; I528-F550 HydrophobicContact CD1-CB 3.75Å; H546-F550 WeakPolarHBondContact O-CE2 3.33Å; Y547-F550 WeakPolarHBondContact O-CD2 3.4Å; Y547-F550 PolarHBondContact O-N 3.07Å; A548-F550 PolarHBondContact O-N 3.35Å; A548-F550 VanDerWaalsContact O-N 3.12Å
551	L	86.5	Confident	88.1	Confident	5 Å²	5	35 Å²	35	3%	0.026	18%	0.179	C	C	.	.	S	Bend	trans	-73.8	155.6	172.7	-66.3	172.5	0	0	0	111.3	I525 I528 Q529 L532 A548 V549 H556 F559	I525-L551 HydrophobicContact CG2-CD2 4.07Å; I528-L551 HydrophobicContact CB-CD2 4.03Å; I528-L551 HydrophobicContact CG2-CD2 3.75Å; I528-L551 HydrophobicContact CG2-CG 3.98Å; Q529-L551 HydrophobicContact CG-CD2 3.99Å; L532-L551 HydrophobicContact CD1-CD1 3.64Å; L532-L551 HydrophobicContact CD1-CG 4.2Å; A548-L551 WeakPolarHBondContact O-CB 3.47Å; A548-L551 PolarHBondContact O-N 3.43Å; V549-L551 VanDerWaalsContact C-N 3.34Å; L551-H556 HydrophobicContact CB-CB 4.06Å; L551-H556 HydrophobicContact CD1-CB 4.4Å; L551-F559 HydrophobicContact CD1-CB 4.06Å; L551-F559 HydrophobicContact CD1-CD2 3.72Å; L551-F559 HydrophobicContact CD1-CG 3.96Å
552	P	81.9	Confident	88	Confident	20 Å²	20	37.6 Å²	37.6	13%	0.13	19%	0.193	C	C	.	.	P	Polyproline II helix	trans	-52.4	150.6	176.2	-22.3	28.4	0	0	0	113	F519 I525 G554 S555 H556	F519-P552 HydrophobicContact CD1-CB 4.4Å; F519-P552 HydrophobicContact CD1-CG 3.6Å; F519-P552 HydrophobicContact CE1-CB 4.34Å; F519-P552 HydrophobicContact CE1-CG 3.72Å; F519-P552 HydrophobicContact CG-CG 4.09Å; F519-P552 HydrophobicContact CZ-CB 4.46Å; F519-P552 HydrophobicContact CZ-CG 4.32Å; I525-P552 HydrophobicContact CD1-CG 3.59Å; I525-P552 HydrophobicContact CG1-CG 3.91Å; P552-G554 PolarHBondContact O-N 3.47Å; P552-S555 PolarHBondContact O-N 2.99Å; P552-H556 PolarHBondContact O-ND1 3.49Å; P552-H556 VanDerWaalsContact O-ND1 3.16Å
553	R	70.5	Confident	88.1	Confident	232 Å²	232	34.2 Å²	34.2	88%	0.875	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.1	128.8	176.1	-68.1	-176.7	176.3	179.1	-1.6	110	S555	R553-S555 VanDerWaalsContact C-N 3.33Å; R553-S555 PolarHBondContact O-N 3.25Å
554	G	77.6	Confident	88.1	Confident	36 Å²	36	34 Å²	34	37%	0.371	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	88.4	-32.8	-174.9	0	0	0	0	0	115.1	P552 V557	P552-G554 PolarHBondContact O-N 3.47Å; G554-V557 PolarHBondContact O-N 3.01Å
555	S	81.6	Confident	87.9	Confident	44 Å²	44	37.7 Å²	37.7	31%	0.308	19%	0.188	S	C	.	.	H	α-helix	trans	-69.5	-44.6	176.9	-65.6	0	0	0	0	111.5	P552 R553 V557 N558 F559	P552-S555 PolarHBondContact O-N 2.99Å; R553-S555 VanDerWaalsContact C-N 3.33Å; R553-S555 PolarHBondContact O-N 3.25Å; S555-V557 PolarHBondContact O-N 3.45Å; S555-V557 VanDerWaalsContact O-N 3.13Å; S555-N558 PolarHBondContact O-N 2.86Å; S555-F559 VanDerWaalsContact O-CD2 3.25Å; S555-F559 WeakPolarHBondContact O-CD2 3.33Å; S555-F559 PolarHBondContact O-N 3.03Å
556	H	86	Confident	87.7	Confident	24 Å²	24	43.6 Å²	43.6	11%	0.111	22%	0.219	C	C	.	.	H	α-helix	trans	-56.6	-29.6	178.3	57.3	-97.2	0	0	0	113.2	A548 L551 P552 N558 F559 V560	A548-H556 WeakPolarHBondContact O-CB 3.4Å; L551-H556 HydrophobicContact CB-CB 4.06Å; L551-H556 HydrophobicContact CD1-CB 4.4Å; P552-H556 PolarHBondContact O-ND1 3.49Å; P552-H556 VanDerWaalsContact O-ND1 3.16Å; H556-N558 PolarHBondContact O-N 3.04Å; H556-F559 PolarHBondContact O-N 3.2Å; H556-V560 VanDerWaalsContact O-CB 3.31Å; H556-V560 WeakPolarHBondContact O-CB 3.23Å; H556-V560 WeakPolarHBondContact O-CG2 3.29Å; H556-V560 PolarHBondContact O-N 2.97Å
557	V	89.7	Confident	87.7	Confident	4 Å²	4	42.3 Å²	42.3	2%	0.024	21%	0.214	C	C	.	.	H	α-helix	trans	-59.2	-50.2	-179.2	178.4	0	0	0	0	110.4	G554 S555 A561 E589 I590 A593	G554-V557 PolarHBondContact O-N 3.01Å; S555-V557 PolarHBondContact O-N 3.45Å; S555-V557 VanDerWaalsContact O-N 3.13Å; V557-A561 WeakPolarHBondContact O-CB 3.34Å; V557-A561 PolarHBondContact O-N 3.43Å; V557-E589 HydrophobicContact CG1-CG 3.93Å; V557-E589 HydrophobicContact CG2-CG 4.18Å; V557-I590 HydrophobicContact CG1-CG1 4.27Å; V557-A593 HydrophobicContact CG1-CB 3.69Å
558	N	88.6	Confident	87.3	Confident	82 Å²	82	46.1 Å²	46.1	44%	0.439	25%	0.245	S	C	.	.	H	α-helix	trans	-67.6	-44.4	-179.5	-67.3	-26	0	0	0	111.5	S555 H556 V560 A561 D562	S555-N558 PolarHBondContact O-N 2.86Å; H556-N558 PolarHBondContact O-N 3.04Å; N558-V560 PolarHBondContact O-N 3.27Å; N558-A561 PolarHBondContact O-N 2.84Å; N558-D562 VanDerWaalsContact O-CG 3.3Å; N558-D562 PolarHBondContact O-N 3.4Å
559	F	89.3	Confident	87.1	Confident	57 Å²	57	47.7 Å²	47.7	25%	0.25	26%	0.256	C	S	.	.	H	α-helix	trans	-63.2	-39.3	178.8	-78.6	-76.7	0	0	0	113.3	Q529 Y544 L551 S555 H556 F563	Q529-F559 HydrophobicContact CG-CE1 4.03Å; Q529-F559 HydrophobicContact CG-CE2 4.31Å; Q529-F559 HydrophobicContact CG-CZ 3.88Å; Y544-F559 PolarHBondContact OH-O 3.25Å; L551-F559 HydrophobicContact CD1-CB 4.06Å; L551-F559 HydrophobicContact CD1-CD2 3.72Å; L551-F559 HydrophobicContact CD1-CG 3.96Å; S555-F559 VanDerWaalsContact O-CD2 3.25Å; S555-F559 WeakPolarHBondContact O-CD2 3.33Å; S555-F559 PolarHBondContact O-N 3.03Å; H556-F559 PolarHBondContact O-N 3.2Å; F559-F563 WeakPolarHBondContact O-CB 3.41Å; F559-F563 PolarHBondContact O-N 3.38Å
560	V	92.5	Very high	86.9	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-74.9	-35.6	177.1	179.4	0	0	0	0	110.5	Y544 A548 H556 N558 F563 L564 I580 L585 I590	Y544-V560 HydrophobicContact CE1-CG2 4.16Å; A548-V560 HydrophobicContact CB-CG2 3.46Å; A548-V560 VanDerWaalsContact CB-CG2 3.46Å; H556-V560 VanDerWaalsContact O-CB 3.31Å; H556-V560 WeakPolarHBondContact O-CB 3.23Å; H556-V560 WeakPolarHBondContact O-CG2 3.29Å; H556-V560 PolarHBondContact O-N 2.97Å; N558-V560 PolarHBondContact O-N 3.27Å; V560-F563 PolarHBondContact O-N 3.33Å; V560-L564 HydrophobicContact CG1-CD1 4.19Å; V560-L564 HydrophobicContact CG1-CG 4.26Å; V560-L564 VanDerWaalsContact O-CB 3.31Å; V560-L564 WeakPolarHBondContact O-CB 3.39Å; V560-L564 WeakPolarHBondContact O-CG 3.4Å; V560-L564 PolarHBondContact O-N 3.17Å; V560-I580 HydrophobicContact CG1-CD1 3.49Å; V560-I580 VanDerWaalsContact CG1-CD1 3.49Å; V560-I580 HydrophobicContact CG1-CG1 4.08Å; V560-L585 HydrophobicContact CG2-CD1 4.36Å; V560-I590 HydrophobicContact CB-CD1 4.21Å; V560-I590 HydrophobicContact CB-CG1 4.49Å; V560-I590 HydrophobicContact CB-CG2 4.39Å; V560-I590 HydrophobicContact CG1-CD1 3.95Å; V560-I590 HydrophobicContact CG1-CG1 4.48Å; V560-I590 HydrophobicContact CG1-CG2 3.9Å
561	A	92.5	Very high	86.9	Confident	0 Å²	0	53 Å²	53	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-62.7	-47.4	175.7	0	0	0	0	0	112.2	V557 N558 F563 L564 Y565 A593 V594	V557-A561 WeakPolarHBondContact O-CB 3.34Å; V557-A561 PolarHBondContact O-N 3.43Å; N558-A561 PolarHBondContact O-N 2.84Å; A561-F563 VanDerWaalsContact C-N 3.35Å; A561-F563 PolarHBondContact O-N 3.29Å; A561-L564 PolarHBondContact O-N 3.37Å; A561-Y565 PolarHBondContact O-N 2.91Å; A561-A593 HydrophobicContact CB-CB 3.91Å; A561-V594 VanDerWaalsContact CA-CG2 3.46Å; A561-V594 HydrophobicContact CB-CB 4.4Å; A561-V594 HydrophobicContact CB-CG2 3.6Å; A561-V594 WeakPolarHBondContact O-CG2 3.49Å
562	D	90.3	Very high	87.2	Confident	77 Å²	77	56 Å²	56	41%	0.412	30%	0.295	S	S	.	.	H	α-helix	trans	-64.2	-41.4	178.4	-66	-17.1	0	0	0	111	N558 Y565 D566 N597	N558-D562 VanDerWaalsContact O-CG 3.3Å; N558-D562 PolarHBondContact O-N 3.4Å; D562-Y565 WeakPolarHBondContact O-CB 3.02Å; D562-Y565 PolarHBondContact O-N 3.33Å; D562-D566 PolarHBondContact O-N 3.29Å; D562-N597 PolarHBondContact OD1-ND2 2.89Å
563	F	92.3	Very high	87.6	Confident	11 Å²	11	56 Å²	56	5%	0.048	29%	0.292	C	S	.	.	H	α-helix	trans	-63.2	-45.1	174.8	176.8	-110.1	0	0	0	113	A536 I541 Y544 F559 V560 A561 Y565 D566 I567	A536-F563 HydrophobicContact CB-CD2 3.79Å; A536-F563 HydrophobicContact CB-CE2 4.02Å; I541-F563 HydrophobicContact CG2-CZ 4.15Å; Y544-F563 HydrophobicContact CD1-CB 4.1Å; Y544-F563 AromaticContact CD1-CD1 3.36Å; Y544-F563 HydrophobicContact CD1-CD1 3.36Å; Y544-F563 HydrophobicContact CD1-CD2 4.47Å; Y544-F563 AromaticContact CD1-CE1 3.86Å; Y544-F563 HydrophobicContact CD1-CE1 3.86Å; Y544-F563 AromaticContact CD1-CG 3.71Å; Y544-F563 HydrophobicContact CD1-CG 3.71Å; Y544-F563 HydrophobicContact CD2-CD1 4.08Å; Y544-F563 AromaticContact CD2-CD2 3.81Å; Y544-F563 HydrophobicContact CD2-CD2 3.81Å; Y544-F563 HydrophobicContact CD2-CE1 4.2Å; Y544-F563 AromaticContact CD2-CE2 3.97Å; Y544-F563 HydrophobicContact CD2-CE2 3.97Å; Y544-F563 AromaticContact CD2-CG 3.87Å; Y544-F563 HydrophobicContact CD2-CG 3.87Å; Y544-F563 HydrophobicContact CD2-CZ 4.14Å; Y544-F563 HydrophobicContact CE1-CB 3.53Å; Y544-F563 AromaticContact CE1-CD1 3.76Å; Y544-F563 HydrophobicContact CE1-CD1 3.76Å; Y544-F563 HydrophobicContact CE1-CD2 4.49Å; Y544-F563 AromaticContact CE1-CG 3.66Å; Y544-F563 HydrophobicContact CE1-CG 3.66Å; Y544-F563 HydrophobicContact CE2-CB 4.05Å; Y544-F563 HydrophobicContact CE2-CD1 4.41Å; Y544-F563 AromaticContact CE2-CD2 3.84Å; Y544-F563 HydrophobicContact CE2-CD2 3.84Å; Y544-F563 HydrophobicContact CE2-CE2 4.43Å; Y544-F563 AromaticContact CE2-CG 3.82Å; Y544-F563 HydrophobicContact CE2-CG 3.82Å; Y544-F563 AromaticContact CG-CD1 3.55Å; Y544-F563 HydrophobicContact CG-CD1 3.55Å; Y544-F563 HydrophobicContact CG-CD2 4.14Å; Y544-F563 AromaticContact CG-CE1 3.61Å; Y544-F563 HydrophobicContact CG-CE1 3.61Å; Y544-F563 HydrophobicContact CG-CE2 4.21Å; Y544-F563 AromaticContact CG-CG 3.81Å; Y544-F563 HydrophobicContact CG-CG 3.81Å; Y544-F563 AromaticContact CG-CZ 3.95Å; Y544-F563 HydrophobicContact CG-CZ 3.95Å; Y544-F563 VanDerWaalsContact CZ-CB 3.5Å; Y544-F563 AromaticContact CZ-CG 3.71Å; F559-F563 WeakPolarHBondContact O-CB 3.41Å; F559-F563 PolarHBondContact O-N 3.38Å; V560-F563 PolarHBondContact O-N 3.33Å; A561-F563 VanDerWaalsContact C-N 3.35Å; A561-F563 PolarHBondContact O-N 3.29Å; F563-Y565 PolarHBondContact O-N 2.58Å; F563-D566 PolarHBondContact O-N 3.46Å; F563-I567 HydrophobicContact CD1-CD1 4.45Å; F563-I567 HydrophobicContact CE1-CD1 4.02Å; F563-I567 HydrophobicContact CZ-CD1 4.39Å
564	L	92	Very high	88.5	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-61.6	-33.2	177.5	-84	178.1	0	0	0	112.7	V560 A561 I567 C576 L577 I580 I590 V594 F637	V560-L564 HydrophobicContact CG1-CD1 4.19Å; V560-L564 HydrophobicContact CG1-CG 4.26Å; V560-L564 VanDerWaalsContact O-CB 3.31Å; V560-L564 WeakPolarHBondContact O-CB 3.39Å; V560-L564 WeakPolarHBondContact O-CG 3.4Å; V560-L564 PolarHBondContact O-N 3.17Å; A561-L564 PolarHBondContact O-N 3.37Å; L564-I567 HydrophobicContact CD2-CD1 4.09Å; L564-I567 PolarHBondContact O-N 2.77Å; L564-C576 HydrophobicContact CD2-CB 3.9Å; L564-C576 VanDerWaalsContact CD2-SG 3.57Å; L564-L577 HydrophobicContact CD1-CD2 3.97Å; L564-L577 HydrophobicContact CD2-CD2 4.44Å; L564-I580 HydrophobicContact CD1-CD1 3.62Å; L564-I580 HydrophobicContact CD2-CD1 3.82Å; L564-I580 HydrophobicContact CG-CD1 3.89Å; L564-I590 HydrophobicContact CD1-CG2 3.44Å; L564-I590 VanDerWaalsContact CD1-CG2 3.44Å; L564-V594 HydrophobicContact CB-CG2 4.11Å; L564-V594 HydrophobicContact CD1-CG2 4.19Å; L564-F637 HydrophobicContact CB-CE1 4.18Å
565	Y	90.2	Very high	89.2	Confident	85 Å²	85	54 Å²	54	33%	0.333	28%	0.282	S	S	.	.	H	α-helix	trans	-65.6	-38.9	176	173.8	-106.4	0	0	0	112	A561 D562 F563 I567 V598	A561-Y565 PolarHBondContact O-N 2.91Å; D562-Y565 WeakPolarHBondContact O-CB 3.02Å; D562-Y565 PolarHBondContact O-N 3.33Å; F563-Y565 PolarHBondContact O-N 2.58Å; Y565-I567 PolarHBondContact O-N 3.35Å; Y565-V598 HydrophobicContact CD2-CG2 3.22Å; Y565-V598 HydrophobicContact CE2-CB 4.42Å; Y565-V598 HydrophobicContact CE2-CG1 4.25Å; Y565-V598 HydrophobicContact CE2-CG2 3.3Å; Y565-V598 HydrophobicContact CG-CG2 4.07Å
566	D	89.1	Confident	89.7	Confident	123 Å²	123	51.9 Å²	51.9	66%	0.658	27%	0.267	S	S	*	.	H	α-helix	trans	-70.9	-12	-180	-75.1	-17.6	0	0	0	114	D562 F563 A568	D562-D566 PolarHBondContact O-N 3.29Å; F563-D566 PolarHBondContact O-N 3.46Å; D566-A568 PolarHBondContact O-N 3.46Å
567	I	89.4	Confident	90	Very high	12 Å²	12	51.6 Å²	51.6	6%	0.062	27%	0.267	C	S	.	.			trans	-75.8	110.1	176.1	-56.4	176.7	0	0	0	110.5	I541 F563 L564 Y565 D572 R573 C576	I541-I567 HydrophobicContact CB-CD1 4.5Å; I541-I567 HydrophobicContact CG2-CD1 3.9Å; I541-I567 HydrophobicContact CG2-CG1 4.26Å; F563-I567 HydrophobicContact CD1-CD1 4.45Å; F563-I567 HydrophobicContact CE1-CD1 4.02Å; F563-I567 HydrophobicContact CZ-CD1 4.39Å; L564-I567 HydrophobicContact CD2-CD1 4.09Å; L564-I567 PolarHBondContact O-N 2.77Å; Y565-I567 PolarHBondContact O-N 3.35Å; I567-D572 HydrophobicContact CG2-CB 3.58Å; I567-R573 HydrophobicContact CG2-CB 4.17Å; I567-R573 PolarHBondContact O-NH2 3.11Å; I567-C576 HydrophobicContact CD1-CB 3.81Å
568	A	84.9	Confident	90	Very high	79 Å²	79	54 Å²	54	65%	0.653	28%	0.283	S	S	*	.			trans	-75.6	-37.3	-176.5	0	0	0	0	0	114.8	D566 R633	D566-A568 PolarHBondContact O-N 3.46Å; A568-R633 PolarHBondContact O-NH2 3Å
569	S	87.7	Confident	90.2	Very high	34 Å²	34	50.7 Å²	50.7	24%	0.238	27%	0.266	C	S	.	.			trans	-80.9	134.5	180	161.2	0	0	0	0	110.7	E571 D572 R573	S569-E571 VanDerWaalsContact C-N 3.31Å; S569-E571 PolarHBondContact OG-N 3.44Å; S569-E571 PolarHBondContact OG-OE2 2.85Å; S569-D572 WeakPolarHBondContact CB-OD2 3.43Å; S569-D572 PolarHBondContact OG-N 3.34Å; S569-R573 WeakPolarHBondContact O-CB 3.17Å; S569-R573 PolarHBondContact O-N 3.16Å; S569-R573 VanDerWaalsContact O-N 3.08Å
570	D	84.6	Confident	90.3	Very high	55 Å²	55	48 Å²	48	29%	0.294	25%	0.254	S	S	.	.	H	α-helix	trans	-72.3	-28.6	176.3	-68.5	-25	0	0	0	111.5	R573 K574 R633	D570-R573 IonicContact OD1-CZ 2.89Å; D570-R573 IonicContact OD1-NH1 3.98Å; D570-R573 PolarHBondContact OD1-NH1 2.66Å; D570-R573 IonicContact OD1-NH2 3.66Å; D570-K574 VanDerWaalsContact O-CG 3.29Å; D570-K574 WeakPolarHBondContact O-CG 3.36Å; D570-K574 PolarHBondContact O-N 3.15Å; D570-R633 IonicContact OD1-CZ 2.79Å; D570-R633 IonicContact OD1-NE 2.87Å; D570-R633 IonicContact OD1-NH2 3.25Å; D570-R633 PolarHBondContact OD1-NH2 3.14Å; D570-R633 IonicContact OD2-NH2 3.92Å
571	E	88.9	Confident	90.1	Very high	134 Å²	134	54.4 Å²	54.4	63%	0.626	28%	0.284	S	S	*	.	H	α-helix	trans	-65.3	-50	172.5	-63.6	74.4	-161.9	0	0	111.4	S569 R573 K574 M575	S569-E571 VanDerWaalsContact C-N 3.31Å; S569-E571 PolarHBondContact OG-N 3.44Å; S569-E571 PolarHBondContact OG-OE2 2.85Å; E571-R573 VanDerWaalsContact C-N 3.28Å; E571-R573 PolarHBondContact O-N 3.3Å; E571-K574 PolarHBondContact O-N 3.22Å; E571-M575 PolarHBondContact O-N 3.31Å
572	D	91.2	Very high	89.9	Confident	67 Å²	67	60.5 Å²	60.5	36%	0.358	32%	0.317	S	S	.	.	H	α-helix	trans	-61.8	-38.9	177.9	-70.1	-16.6	0	0	0	111.2	I541 I567 S569 M575 C576	I541-D572 HydrophobicContact CD1-CB 3.67Å; I567-D572 HydrophobicContact CG2-CB 3.58Å; S569-D572 WeakPolarHBondContact CB-OD2 3.43Å; S569-D572 PolarHBondContact OG-N 3.34Å; D572-M575 WeakPolarHBondContact O-CB 3.3Å; D572-M575 PolarHBondContact O-N 3.01Å; D572-C576 WeakPolarHBondContact O-CB 3.49Å; D572-C576 PolarHBondContact O-N 3.27Å
573	R	90.4	Very high	89.7	Confident	20 Å²	20	57.7 Å²	57.7	8%	0.075	30%	0.303	C	S	.	.	H	α-helix	trans	-63.6	-44.8	175.6	-176.3	-171.7	-66	140.7	12.2	111.9	I567 S569 D570 E571 M575 C576 L577 F637	I567-R573 HydrophobicContact CG2-CB 4.17Å; I567-R573 PolarHBondContact O-NH2 3.11Å; S569-R573 WeakPolarHBondContact O-CB 3.17Å; S569-R573 PolarHBondContact O-N 3.16Å; S569-R573 VanDerWaalsContact O-N 3.08Å; D570-R573 IonicContact OD1-CZ 2.89Å; D570-R573 IonicContact OD1-NH1 3.98Å; D570-R573 PolarHBondContact OD1-NH1 2.66Å; D570-R573 IonicContact OD1-NH2 3.66Å; E571-R573 VanDerWaalsContact C-N 3.28Å; E571-R573 PolarHBondContact O-N 3.3Å; R573-M575 VanDerWaalsContact C-N 3.29Å; R573-M575 PolarHBondContact O-N 3.25Å; R573-C576 PolarHBondContact O-N 2.95Å; R573-L577 HydrophobicContact CG-CD1 4.28Å; R573-L577 WeakPolarHBondContact O-CB 3.24Å; R573-L577 WeakPolarHBondContact O-CG 3.4Å; R573-L577 PolarHBondContact O-N 2.91Å; R573-F637 HydrophobicContact CG-CE1 3.83Å; R573-F637 HydrophobicContact CG-CZ 4.4Å
574	K	89.8	Confident	89.4	Confident	139 Å²	139	65.9 Å²	65.9	60%	0.604	34%	0.341	S	S	*	.	H	α-helix	trans	-61	-41.2	175.7	-76.5	171.8	-177	174.1	0	111.3	D570 E571 L577 S578	D570-K574 VanDerWaalsContact O-CG 3.29Å; D570-K574 WeakPolarHBondContact O-CG 3.36Å; D570-K574 PolarHBondContact O-N 3.15Å; E571-K574 PolarHBondContact O-N 3.22Å; K574-L577 PolarHBondContact O-N 3.49Å; K574-S578 PolarHBondContact O-N 3.34Å; K574-S578 VanDerWaalsContact O-N 3.09Å
575	M	92	Very high	89.1	Confident	87 Å²	87	66.5 Å²	66.5	43%	0.429	34%	0.344	S	S	.	.	H	α-helix	trans	-62.1	-49.6	175.5	-167.1	179.3	-63	0	0	110.8	I541 L542 E571 D572 R573 L577 S578 V579	I541-M575 HydrophobicContact CD1-SD 4.19Å; L542-M575 HydrophobicContact CD2-CG 3.73Å; L542-M575 HydrophobicContact CD2-SD 3.64Å; L542-M575 HydrophobicContact CG-SD 4.36Å; E571-M575 PolarHBondContact O-N 3.31Å; D572-M575 WeakPolarHBondContact O-CB 3.3Å; D572-M575 PolarHBondContact O-N 3.01Å; R573-M575 VanDerWaalsContact C-N 3.29Å; R573-M575 PolarHBondContact O-N 3.25Å; M575-L577 VanDerWaalsContact C-N 3.34Å; M575-L577 PolarHBondContact O-N 3.43Å; M575-S578 PolarHBondContact O-N 3.45Å; M575-S578 VanDerWaalsContact O-N 3.16Å; M575-S578 PolarHBondContact O-OG 2.99Å; M575-V579 WeakPolarHBondContact O-CG2 3.39Å; M575-V579 PolarHBondContact O-N 2.87Å; M575-V579 VanDerWaalsContact O-N 3.12Å
576	C	92.7	Very high	89	Confident	0 Å²	0	65.9 Å²	65.9	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-58.8	-42.3	177.1	-169.3	0	0	0	0	112.3	I541 L564 I567 D572 R573 S578 V579 I580	I541-C576 HydrophobicContact CB-CB 4.49Å; L564-C576 HydrophobicContact CD2-CB 3.9Å; L564-C576 VanDerWaalsContact CD2-SG 3.57Å; I567-C576 HydrophobicContact CD1-CB 3.81Å; D572-C576 WeakPolarHBondContact O-CB 3.49Å; D572-C576 PolarHBondContact O-N 3.27Å; R573-C576 PolarHBondContact O-N 2.95Å; C576-S578 VanDerWaalsContact C-N 3.34Å; C576-S578 PolarHBondContact O-N 3.49Å; C576-V579 WeakPolarHBondContact O-CB 3.46Å; C576-V579 PolarHBondContact O-N 3.32Å; C576-V579 VanDerWaalsContact O-N 3.13Å; C576-I580 VanDerWaalsContact O-CG1 3.27Å; C576-I580 WeakPolarHBondContact O-CG1 3.46Å; C576-I580 PolarHBondContact O-N 3.09Å
577	L	91.7	Very high	89.1	Confident	18 Å²	18	61.2 Å²	61.2	9%	0.094	32%	0.323	C	S	.	.	H	α-helix	trans	-61	-41	176.2	-74.7	170.1	0	0	0	112.3	L564 R573 K574 M575 V579 I580 E581 V587	L564-L577 HydrophobicContact CD1-CD2 3.97Å; L564-L577 HydrophobicContact CD2-CD2 4.44Å; R573-L577 HydrophobicContact CG-CD1 4.28Å; R573-L577 WeakPolarHBondContact O-CB 3.24Å; R573-L577 WeakPolarHBondContact O-CG 3.4Å; R573-L577 PolarHBondContact O-N 2.91Å; K574-L577 PolarHBondContact O-N 3.49Å; M575-L577 VanDerWaalsContact C-N 3.34Å; M575-L577 PolarHBondContact O-N 3.43Å; L577-V579 VanDerWaalsContact C-N 3.26Å; L577-V579 PolarHBondContact O-N 3.15Å; L577-I580 HydrophobicContact CD2-CD1 4.4Å; L577-I580 PolarHBondContact O-N 3.47Å; L577-E581 PolarHBondContact O-N 3.47Å; L577-V587 HydrophobicContact CD2-CG1 4Å
578	S	90.9	Very high	89.1	Confident	53 Å²	53	62.1 Å²	62.1	37%	0.371	33%	0.329	S	S	.	.	H	α-helix	trans	-63.2	-33.8	174.9	74.9	0	0	0	0	112.5	K574 M575 C576 N582	K574-S578 PolarHBondContact O-N 3.34Å; K574-S578 VanDerWaalsContact O-N 3.09Å; M575-S578 PolarHBondContact O-N 3.45Å; M575-S578 VanDerWaalsContact O-N 3.16Å; M575-S578 PolarHBondContact O-OG 2.99Å; C576-S578 VanDerWaalsContact C-N 3.34Å; C576-S578 PolarHBondContact O-N 3.49Å; S578-N582 PolarHBondContact O-N 3.39Å; S578-N582 VanDerWaalsContact O-N 3.12Å; S578-N582 PolarHBondContact O-ND2 3.42Å
579	V	91.5	Very high	89.4	Confident	13 Å²	13	62.2 Å²	62.2	8%	0.079	32%	0.316	C	S	.	.	H	α-helix	trans	-72.2	-42.2	175.8	179.2	0	0	0	0	111	L542 P545 H546 M575 C576 L577 E581 N582 C583	L542-V579 HydrophobicContact CD2-CG2 3.77Å; P545-V579 HydrophobicContact CB-CG1 3.96Å; P545-V579 HydrophobicContact CG-CB 4.26Å; P545-V579 HydrophobicContact CG-CG1 3.9Å; H546-V579 WeakPolarHBondContact CE1-CG1 3.24Å; M575-V579 WeakPolarHBondContact O-CG2 3.39Å; M575-V579 PolarHBondContact O-N 2.87Å; M575-V579 VanDerWaalsContact O-N 3.12Å; C576-V579 WeakPolarHBondContact O-CB 3.46Å; C576-V579 PolarHBondContact O-N 3.32Å; C576-V579 VanDerWaalsContact O-N 3.13Å; L577-V579 VanDerWaalsContact C-N 3.26Å; L577-V579 PolarHBondContact O-N 3.15Å; V579-E581 VanDerWaalsContact C-N 3.27Å; V579-E581 PolarHBondContact O-N 3.1Å; V579-N582 PolarHBondContact O-N 3.18Å; V579-C583 PolarHBondContact O-N 2.95Å; V579-C583 PolarHBondContact O-SG 3.34Å
580	I	91.4	Very high	89.7	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-57.9	-43.2	175.7	-68.1	165.8	0	0	0	110.4	P545 V560 L564 C576 L577 C583 L585 V587 I590	P545-I580 HydrophobicContact CB-CG1 3.7Å; P545-I580 HydrophobicContact CG-CD1 4.49Å; P545-I580 HydrophobicContact CG-CG1 3.65Å; V560-I580 HydrophobicContact CG1-CD1 3.49Å; V560-I580 VanDerWaalsContact CG1-CD1 3.49Å; V560-I580 HydrophobicContact CG1-CG1 4.08Å; L564-I580 HydrophobicContact CD1-CD1 3.62Å; L564-I580 HydrophobicContact CD2-CD1 3.82Å; L564-I580 HydrophobicContact CG-CD1 3.89Å; C576-I580 VanDerWaalsContact O-CG1 3.27Å; C576-I580 WeakPolarHBondContact O-CG1 3.46Å; C576-I580 PolarHBondContact O-N 3.09Å; L577-I580 HydrophobicContact CD2-CD1 4.4Å; L577-I580 PolarHBondContact O-N 3.47Å; I580-C583 PolarHBondContact O-N 3.01Å; I580-L585 HydrophobicContact CG2-CB 3.62Å; I580-L585 HydrophobicContact CG2-CD1 4.2Å; I580-L585 PolarHBondContact O-N 3.4Å; I580-V587 HydrophobicContact CG2-CG2 3.92Å; I580-I590 HydrophobicContact CG2-CD1 3.6Å
581	E	89.7	Confident	90.1	Very high	135 Å²	135	58 Å²	58	63%	0.631	29%	0.291	S	S	*	.	H	α-helix	trans	-61.6	-44.9	175.9	-168.8	172.8	-167.1	0	0	111.8	L577 V579 C583 E584 V587	L577-E581 PolarHBondContact O-N 3.47Å; V579-E581 VanDerWaalsContact C-N 3.27Å; V579-E581 PolarHBondContact O-N 3.1Å; E581-C583 VanDerWaalsContact C-N 3.26Å; E581-C583 PolarHBondContact O-N 2.89Å; E581-E584 PolarHBondContact O-N 3.14Å; E581-E584 VanDerWaalsContact O-N 3.12Å; E581-V587 HydrophobicContact CB-CG2 3.88Å; E581-V587 HydrophobicContact CG-CG2 4.33Å
582	N	88.3	Confident	90.2	Very high	128 Å²	128	56.4 Å²	56.4	68%	0.684	28%	0.279	S	S	*	.	H	α-helix	trans	-65.5	-26.4	176.3	-68.2	-23.7	0	0	0	113.5	S578 V579 E584	S578-N582 PolarHBondContact O-N 3.39Å; S578-N582 VanDerWaalsContact O-N 3.12Å; S578-N582 PolarHBondContact O-ND2 3.42Å; V579-N582 PolarHBondContact O-N 3.18Å; N582-E584 PolarHBondContact O-N 3.36Å
583	C	85.8	Confident	90.3	Very high	18 Å²	18	53.9 Å²	53.9	12%	0.122	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	4.3	175.7	-63.5	0	0	0	0	113.4	H546 V579 I580 E581 L585	H546-C583 PolarHBondContact CD2-SG 2.85Å; V579-C583 PolarHBondContact O-N 2.95Å; V579-C583 PolarHBondContact O-SG 3.34Å; I580-C583 PolarHBondContact O-N 3.01Å; E581-C583 VanDerWaalsContact C-N 3.26Å; E581-C583 PolarHBondContact O-N 2.89Å; C583-L585 HydrophobicContact CB-CD1 4.24Å; C583-L585 HydrophobicContact CB-CG 4.03Å; C583-L585 PolarHBondContact O-N 3.24Å; C583-L585 VanDerWaalsContact O-N 3.14Å
584	E	84.3	Confident	90.5	Very high	184 Å²	184	53 Å²	53	86%	0.86	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.4	23.2	-174	-53.3	-173.6	160	0	0	113.9	E581 N582	E581-E584 PolarHBondContact O-N 3.14Å; E581-E584 VanDerWaalsContact O-N 3.12Å; N582-E584 PolarHBondContact O-N 3.36Å
585	L	86.6	Confident	90.7	Very high	12 Å²	12	46.3 Å²	46.3	6%	0.063	24%	0.235	C	C	.	.			trans	-76.7	146.4	172.4	-68	176.8	0	0	0	109.8	P545 V549 V560 I580 C583 V587 I590	P545-L585 HydrophobicContact CB-CD1 4.35Å; V549-L585 HydrophobicContact CB-CD2 4.14Å; V549-L585 HydrophobicContact CG2-CD2 3.98Å; V560-L585 HydrophobicContact CG2-CD1 4.36Å; I580-L585 HydrophobicContact CG2-CB 3.62Å; I580-L585 HydrophobicContact CG2-CD1 4.2Å; I580-L585 PolarHBondContact O-N 3.4Å; C583-L585 HydrophobicContact CB-CD1 4.24Å; C583-L585 HydrophobicContact CB-CG 4.03Å; C583-L585 PolarHBondContact O-N 3.24Å; C583-L585 VanDerWaalsContact O-N 3.14Å; L585-V587 VanDerWaalsContact C-N 3.33Å; L585-V587 PolarHBondContact O-N 2.99Å; L585-I590 HydrophobicContact CB-CD1 3.93Å
586	N	88.4	Confident	90.7	Very high	73 Å²	73	45 Å²	45	39%	0.39	23%	0.228	S	C	.	.			trans	-72.3	85.5	-178.1	-171	-11.2	0	0	0	111.3	V588 E589 I590	N586-V588 PolarHBondContact O-N 2.94Å; N586-V588 WeakPolarHBondContact OD1-CB 3.2Å; N586-V588 PolarHBondContact OD1-N 3.33Å; N586-E589 HydrophobicContact CB-CB 3.98Å; N586-E589 VanDerWaalsContact CG-CB 3.45Å; N586-E589 WeakPolarHBondContact ND2-CB 3.44Å; N586-E589 PolarHBondContact ND2-OE2 2.95Å; N586-E589 PolarHBondContact O-N 3.38Å; N586-E589 VanDerWaalsContact O-N 3.15Å; N586-E589 PolarHBondContact OD1-N 3.39Å; N586-E589 VanDerWaalsContact OD1-N 3.14Å; N586-I590 WeakPolarHBondContact O-CG1 3.5Å; N586-I590 PolarHBondContact O-N 3.22Å
587	V	90.4	Very high	90.7	Very high	24 Å²	24	46.9 Å²	46.9	15%	0.145	24%	0.238	C	C	.	.	H	α-helix	trans	-54.5	-37.2	-179.7	-169.5	0	0	0	0	111.2	L577 I580 E581 L585 I590 C591 I641	L577-V587 HydrophobicContact CD2-CG1 4Å; I580-V587 HydrophobicContact CG2-CG2 3.92Å; E581-V587 HydrophobicContact CB-CG2 3.88Å; E581-V587 HydrophobicContact CG-CG2 4.33Å; L585-V587 VanDerWaalsContact C-N 3.33Å; L585-V587 PolarHBondContact O-N 2.99Å; V587-I590 PolarHBondContact O-N 3.32Å; V587-C591 WeakPolarHBondContact O-CB 3.5Å; V587-C591 PolarHBondContact O-N 2.93Å; V587-C591 PolarHBondContact O-SG 3.5Å; V587-I641 HydrophobicContact CG1-CD1 3.54Å
588	V	90.9	Very high	90.8	Very high	31 Å²	31	46.2 Å²	46.2	19%	0.188	24%	0.235	C	C	.	.	H	α-helix	trans	-63.1	-49.3	-179.6	179.2	0	0	0	0	110.6	N586 R592 I641 D643 L644	N586-V588 PolarHBondContact O-N 2.94Å; N586-V588 WeakPolarHBondContact OD1-CB 3.2Å; N586-V588 PolarHBondContact OD1-N 3.33Å; V588-R592 WeakPolarHBondContact O-CG 3.44Å; V588-R592 PolarHBondContact O-N 2.95Å; V588-R592 VanDerWaalsContact O-N 3.15Å; V588-I641 HydrophobicContact CG2-CG2 4.4Å; V588-D643 HydrophobicContact CG2-CB 4.46Å; V588-L644 HydrophobicContact CB-CD2 4.39Å; V588-L644 HydrophobicContact CG1-CD2 3.43Å; V588-L644 VanDerWaalsContact CG1-CD2 3.43Å; V588-L644 HydrophobicContact CG1-CG 4.07Å
589	E	91.1	Very high	90.9	Very high	82 Å²	82	43.7 Å²	43.7	38%	0.383	22%	0.217	S	C	.	.	H	α-helix	trans	-68.5	-39.8	179.1	-169	-178.5	174.6	0	0	112.2	V557 N586 R592 A593	V557-E589 HydrophobicContact CG1-CG 3.93Å; V557-E589 HydrophobicContact CG2-CG 4.18Å; N586-E589 HydrophobicContact CB-CB 3.98Å; N586-E589 VanDerWaalsContact CG-CB 3.45Å; N586-E589 WeakPolarHBondContact ND2-CB 3.44Å; N586-E589 PolarHBondContact ND2-OE2 2.95Å; N586-E589 PolarHBondContact O-N 3.38Å; N586-E589 VanDerWaalsContact O-N 3.15Å; N586-E589 PolarHBondContact OD1-N 3.39Å; N586-E589 VanDerWaalsContact OD1-N 3.14Å; E589-R592 PolarHBondContact O-N 2.78Å; E589-A593 WeakPolarHBondContact O-CB 3.29Å; E589-A593 PolarHBondContact O-N 3.01Å
590	I	92.5	Very high	90.9	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-61.3	-51.2	176.2	-70.6	165	0	0	0	110.7	V557 V560 L564 I580 L585 N586 V587 R592 A593 V594	V557-I590 HydrophobicContact CG1-CG1 4.27Å; V560-I590 HydrophobicContact CB-CD1 4.21Å; V560-I590 HydrophobicContact CB-CG1 4.49Å; V560-I590 HydrophobicContact CB-CG2 4.39Å; V560-I590 HydrophobicContact CG1-CD1 3.95Å; V560-I590 HydrophobicContact CG1-CG1 4.48Å; V560-I590 HydrophobicContact CG1-CG2 3.9Å; L564-I590 HydrophobicContact CD1-CG2 3.44Å; L564-I590 VanDerWaalsContact CD1-CG2 3.44Å; I580-I590 HydrophobicContact CG2-CD1 3.6Å; L585-I590 HydrophobicContact CB-CD1 3.93Å; N586-I590 WeakPolarHBondContact O-CG1 3.5Å; N586-I590 PolarHBondContact O-N 3.22Å; V587-I590 PolarHBondContact O-N 3.32Å; I590-R592 VanDerWaalsContact C-N 3.29Å; I590-R592 PolarHBondContact O-N 3.44Å; I590-A593 WeakPolarHBondContact O-CB 3.25Å; I590-A593 PolarHBondContact O-N 3.48Å; I590-A593 VanDerWaalsContact O-N 3.12Å; I590-V594 HydrophobicContact CG2-CG2 4.45Å; I590-V594 VanDerWaalsContact O-CG2 3.3Å; I590-V594 WeakPolarHBondContact O-CG2 3.29Å; I590-V594 PolarHBondContact O-N 3.48Å
591	C	92.9	Very high	90.9	Very high	0 Å²	0	53 Å²	53	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-63.9	-34	180	-76.2	0	0	0	0	112.7	V587 V595 F637 L638 I641 L644	V587-C591 WeakPolarHBondContact O-CB 3.5Å; V587-C591 PolarHBondContact O-N 2.93Å; V587-C591 PolarHBondContact O-SG 3.5Å; C591-V595 PolarHBondContact O-N 3.44Å; C591-F637 HydrophobicContact CB-CB 4.41Å; C591-L638 HydrophobicContact CB-CD2 4.32Å; C591-I641 HydrophobicContact CB-CD1 4.07Å; C591-I641 VanDerWaalsContact SG-CD1 3.52Å; C591-L644 HydrophobicContact CB-CD1 3.55Å
592	R	92.4	Very high	91.1	Very high	100 Å²	100	48 Å²	48	38%	0.377	24%	0.244	S	C	.	.	H	α-helix	trans	-62.1	-48.3	170.6	-76.3	175.6	179.6	137.4	8.4	111.4	V588 E589 I590 V594 V595 Q596 L644 D647	V588-R592 WeakPolarHBondContact O-CG 3.44Å; V588-R592 PolarHBondContact O-N 2.95Å; V588-R592 VanDerWaalsContact O-N 3.15Å; E589-R592 PolarHBondContact O-N 2.78Å; I590-R592 VanDerWaalsContact C-N 3.29Å; I590-R592 PolarHBondContact O-N 3.44Å; R592-V594 VanDerWaalsContact C-N 3.35Å; R592-V594 PolarHBondContact O-N 2.71Å; R592-V595 PolarHBondContact O-N 3.22Å; R592-Q596 WeakPolarHBondContact O-CB 3.4Å; R592-Q596 PolarHBondContact O-N 3.04Å; R592-L644 HydrophobicContact CG-CD2 3.78Å; R592-D647 IonicContact CZ-OD1 3.87Å; R592-D647 IonicContact CZ-OD2 2.99Å; R592-D647 VanDerWaalsContact NE-CG 3.28Å; R592-D647 IonicContact NE-OD1 2.75Å; R592-D647 PolarHBondContact NE-OD1 3.3Å; R592-D647 IonicContact NE-OD2 2.62Å; R592-D647 PolarHBondContact NE-OD2 2.87Å; R592-D647 IonicContact NH2-OD1 3.76Å; R592-D647 IonicContact NH2-OD2 3.66Å; R592-D647 PolarHBondContact NH2-OD2 2.88Å
593	A	93	Very high	91.3	Very high	14 Å²	14	42.4 Å²	42.4	12%	0.116	21%	0.214	C	C	.	.	H	α-helix	trans	-61.3	-41.9	179.4	0	0	0	0	0	111.8	V557 A561 E589 I590 V595 Q596 N597	V557-A593 HydrophobicContact CG1-CB 3.69Å; A561-A593 HydrophobicContact CB-CB 3.91Å; E589-A593 WeakPolarHBondContact O-CB 3.29Å; E589-A593 PolarHBondContact O-N 3.01Å; I590-A593 WeakPolarHBondContact O-CB 3.25Å; I590-A593 PolarHBondContact O-N 3.48Å; I590-A593 VanDerWaalsContact O-N 3.12Å; A593-V595 PolarHBondContact O-N 2.94Å; A593-Q596 PolarHBondContact O-N 3.3Å; A593-N597 VanDerWaalsContact O-CB 3.3Å; A593-N597 WeakPolarHBondContact O-CB 3.3Å; A593-N597 PolarHBondContact O-N 3.49Å; A593-N597 PolarHBondContact O-OD1 2.73Å
594	V	93.9	Very high	91.5	Very high	1 Å²	1	42 Å²	42	1%	0.006	21%	0.211	C	C	.	.	H	α-helix	trans	-54.1	-53.9	175.1	176.1	0	0	0	0	110.6	A561 L564 I590 R592 Q596 N597 V598 F637	A561-V594 VanDerWaalsContact CA-CG2 3.46Å; A561-V594 HydrophobicContact CB-CB 4.4Å; A561-V594 HydrophobicContact CB-CG2 3.6Å; A561-V594 WeakPolarHBondContact O-CG2 3.49Å; L564-V594 HydrophobicContact CB-CG2 4.11Å; L564-V594 HydrophobicContact CD1-CG2 4.19Å; I590-V594 HydrophobicContact CG2-CG2 4.45Å; I590-V594 VanDerWaalsContact O-CG2 3.3Å; I590-V594 WeakPolarHBondContact O-CG2 3.29Å; I590-V594 PolarHBondContact O-N 3.48Å; R592-V594 VanDerWaalsContact C-N 3.35Å; R592-V594 PolarHBondContact O-N 2.71Å; V594-Q596 VanDerWaalsContact C-N 3.34Å; V594-Q596 PolarHBondContact O-N 3.18Å; V594-N597 PolarHBondContact O-N 3Å; V594-V598 VanDerWaalsContact O-CG2 3.26Å; V594-V598 WeakPolarHBondContact O-CG2 3.49Å; V594-V598 PolarHBondContact O-N 3.37Å; V594-F637 HydrophobicContact CB-CD1 4.5Å; V594-F637 HydrophobicContact CB-CG 4.47Å; V594-F637 HydrophobicContact CG1-CD1 4.05Å; V594-F637 HydrophobicContact CG1-CD2 3.66Å; V594-F637 HydrophobicContact CG1-CE1 3.9Å; V594-F637 HydrophobicContact CG1-CE2 3.54Å; V594-F637 HydrophobicContact CG1-CG 3.93Å; V594-F637 HydrophobicContact CG1-CZ 3.66Å; V594-F637 HydrophobicContact CG2-CD1 4.49Å; V594-F637 HydrophobicContact CG2-CE1 4.46Å
595	V	94.1	Very high	91.8	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-64.5	-41.7	-176.5	176.1	0	0	0	0	111.5	C591 R592 A593 V598 I599 S634 F637 L638 Q651 M655	C591-V595 PolarHBondContact O-N 3.44Å; R592-V595 PolarHBondContact O-N 3.22Å; A593-V595 PolarHBondContact O-N 2.94Å; V595-V598 PolarHBondContact O-N 3.1Å; V595-I599 HydrophobicContact CG1-CD1 3.75Å; V595-I599 HydrophobicContact CG1-CG1 4.48Å; V595-I599 WeakPolarHBondContact O-CB 3.23Å; V595-I599 WeakPolarHBondContact O-CD1 3.49Å; V595-I599 VanDerWaalsContact O-CG1 3.27Å; V595-I599 WeakPolarHBondContact O-CG1 3.48Å; V595-I599 PolarHBondContact O-N 3.32Å; V595-S634 WeakPolarHBondContact CG2-O 3.26Å; V595-F637 HydrophobicContact CG2-CB 4.08Å; V595-L638 HydrophobicContact CB-CD1 4.42Å; V595-L638 HydrophobicContact CG1-CD1 4.28Å; V595-L638 HydrophobicContact CG2-CD1 4.04Å; V595-L638 HydrophobicContact CG2-CD2 4.03Å; V595-L638 HydrophobicContact CG2-CG 3.82Å; V595-Q651 HydrophobicContact CG1-CB 4.23Å; V595-Q651 HydrophobicContact CG1-CG 4.09Å; V595-M655 HydrophobicContact CG1-CE 3.77Å
596	Q	92.9	Very high	92	Very high	59 Å²	59	36.4 Å²	36.4	28%	0.276	19%	0.193	S	C	.	.	H	α-helix	trans	-64.3	-45.7	178.4	-168.6	59.7	48.6	0	0	111.8	R592 A593 V594 V598 I599 D600	R592-Q596 WeakPolarHBondContact O-CB 3.4Å; R592-Q596 PolarHBondContact O-N 3.04Å; A593-Q596 PolarHBondContact O-N 3.3Å; V594-Q596 VanDerWaalsContact C-N 3.34Å; V594-Q596 PolarHBondContact O-N 3.18Å; Q596-V598 VanDerWaalsContact C-N 3.33Å; Q596-V598 PolarHBondContact O-N 2.72Å; Q596-I599 PolarHBondContact O-N 3.26Å; Q596-D600 VanDerWaalsContact NE2-CG 3.27Å; Q596-D600 PolarHBondContact NE2-OD1 3.19Å; Q596-D600 PolarHBondContact NE2-OD2 3.43Å; Q596-D600 PolarHBondContact O-N 3.44Å
597	N	92.7	Very high	92.1	Very high	40 Å²	40	38.9 Å²	38.9	21%	0.214	20%	0.2	C	C	.	.	H	α-helix	trans	-59.5	-43.2	176.9	-70.2	2.4	0	0	0	111.1	D562 A593 V594 D600 N601	D562-N597 PolarHBondContact OD1-ND2 2.89Å; A593-N597 VanDerWaalsContact O-CB 3.3Å; A593-N597 WeakPolarHBondContact O-CB 3.3Å; A593-N597 PolarHBondContact O-N 3.49Å; A593-N597 PolarHBondContact O-OD1 2.73Å; V594-N597 PolarHBondContact O-N 3Å; N597-D600 PolarHBondContact O-N 2.94Å; N597-N601 WeakPolarHBondContact O-CB 3.13Å; N597-N601 PolarHBondContact O-N 3.49Å; N597-N601 PolarHBondContact O-ND2 2.84Å; N597-N601 VanDerWaalsContact O-ND2 3.08Å
598	V	93.6	Very high	92	Very high	4 Å²	4	39.1 Å²	39.1	2%	0.024	20%	0.203	C	C	.	.	H	α-helix	trans	-62.3	-44.8	176.9	174.6	0	0	0	0	111.6	Y565 V594 V595 Q596 L602 V631	Y565-V598 HydrophobicContact CD2-CG2 3.22Å; Y565-V598 HydrophobicContact CE2-CB 4.42Å; Y565-V598 HydrophobicContact CE2-CG1 4.25Å; Y565-V598 HydrophobicContact CE2-CG2 3.3Å; Y565-V598 HydrophobicContact CG-CG2 4.07Å; V594-V598 VanDerWaalsContact O-CG2 3.26Å; V594-V598 WeakPolarHBondContact O-CG2 3.49Å; V594-V598 PolarHBondContact O-N 3.37Å; V595-V598 PolarHBondContact O-N 3.1Å; Q596-V598 VanDerWaalsContact C-N 3.33Å; Q596-V598 PolarHBondContact O-N 2.72Å; V598-L602 HydrophobicContact CG1-CD1 3.84Å; V598-L602 HydrophobicContact CG1-CG 4.36Å; V598-L602 VanDerWaalsContact O-CB 3.27Å; V598-L602 WeakPolarHBondContact O-CB 3.33Å; V598-L602 WeakPolarHBondContact O-CG 3.46Å; V598-L602 PolarHBondContact O-N 3.38Å; V598-V631 HydrophobicContact CG1-CG2 4.16Å
599	I	93.5	Very high	92	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-62.6	-47.2	179.1	-74.6	166.7	0	0	0	111	V595 Q596 L603 V631 L654 M655	V595-I599 HydrophobicContact CG1-CD1 3.75Å; V595-I599 HydrophobicContact CG1-CG1 4.48Å; V595-I599 WeakPolarHBondContact O-CB 3.23Å; V595-I599 WeakPolarHBondContact O-CD1 3.49Å; V595-I599 VanDerWaalsContact O-CG1 3.27Å; V595-I599 WeakPolarHBondContact O-CG1 3.48Å; V595-I599 PolarHBondContact O-N 3.32Å; Q596-I599 PolarHBondContact O-N 3.26Å; I599-L603 HydrophobicContact CG2-CD1 4.38Å; I599-L603 VanDerWaalsContact O-CB 3.31Å; I599-L603 WeakPolarHBondContact O-CB 3.48Å; I599-L603 PolarHBondContact O-N 2.89Å; I599-V631 HydrophobicContact CG1-CG1 4.42Å; I599-L654 HydrophobicContact CD1-CD2 4.2Å; I599-L654 HydrophobicContact CG2-CD2 3.72Å; I599-M655 HydrophobicContact CD1-CE 3.66Å; I599-M655 HydrophobicContact CD1-CG 4.12Å; I599-M655 HydrophobicContact CG1-CE 3.91Å; I599-M655 HydrophobicContact CG1-CG 4.33Å
600	D	91.1	Very high	91.9	Very high	84 Å²	84	34.8 Å²	34.8	45%	0.449	18%	0.181	S	C	.	.	H	α-helix	trans	-74.3	-28.5	-175.4	-68.8	-24.3	0	0	0	112.7	Q596 N597 R658	Q596-D600 VanDerWaalsContact NE2-CG 3.27Å; Q596-D600 PolarHBondContact NE2-OD1 3.19Å; Q596-D600 PolarHBondContact NE2-OD2 3.43Å; Q596-D600 PolarHBondContact O-N 3.44Å; N597-D600 PolarHBondContact O-N 2.94Å; D600-R658 IonicContact OD1-NH1 3.56Å; D600-R658 IonicContact OD1-NH2 2.86Å
601	N	91.3	Very high	91.6	Very high	125 Å²	125	37 Å²	37	67%	0.668	20%	0.199	S	C	*	.	H	α-helix	trans	-82.1	-33.5	177.2	-71.3	-28.2	0	0	0	113.5	N597	N597-N601 WeakPolarHBondContact O-CB 3.13Å; N597-N601 PolarHBondContact O-N 3.49Å; N597-N601 PolarHBondContact O-ND2 2.84Å; N597-N601 VanDerWaalsContact O-ND2 3.08Å
602	L	93.1	Very high	91.3	Very high	30 Å²	30	37.9 Å²	37.9	16%	0.157	20%	0.204	C	C	.	.	H	α-helix	trans	-105.3	-22.9	-171	-57.2	-170.3	0	0	0	114.4	V598 Q627 E630 V631	V598-L602 HydrophobicContact CG1-CD1 3.84Å; V598-L602 HydrophobicContact CG1-CG 4.36Å; V598-L602 VanDerWaalsContact O-CB 3.27Å; V598-L602 WeakPolarHBondContact O-CB 3.33Å; V598-L602 WeakPolarHBondContact O-CG 3.46Å; V598-L602 PolarHBondContact O-N 3.38Å; L602-Q627 HydrophobicContact CB-CB 4.37Å; L602-Q627 HydrophobicContact CD2-CG 4.21Å; L602-E630 HydrophobicContact CD1-CB 3.87Å; L602-V631 HydrophobicContact CB-CG2 3.69Å; L602-V631 HydrophobicContact CD1-CG2 4.04Å; L602-V631 HydrophobicContact CG-CG2 4.44Å
603	L	92.1	Very high	90.8	Very high	9 Å²	9	34.2 Å²	34.2	5%	0.047	20%	0.195	C	C	.	.	S	Bend	trans	-99.2	148.3	174.3	-61.4	-177	0	0	0	111.2	I599 P623 V631 R658 F659	I599-L603 HydrophobicContact CG2-CD1 4.38Å; I599-L603 VanDerWaalsContact O-CB 3.31Å; I599-L603 WeakPolarHBondContact O-CB 3.48Å; I599-L603 PolarHBondContact O-N 2.89Å; L603-P623 HydrophobicContact CD2-CB 4.48Å; L603-P623 HydrophobicContact CD2-CG 4.29Å; L603-V631 HydrophobicContact CD1-CG1 4.11Å; L603-V631 HydrophobicContact CD2-CG2 4.12Å; L603-V631 HydrophobicContact CG-CG1 4.34Å; L603-V631 HydrophobicContact CG-CG2 4.05Å; L603-R658 HydrophobicContact CD1-CB 3.99Å; L603-R658 HydrophobicContact CD1-CG 4.47Å; L603-F659 HydrophobicContact CD2-CD1 4.44Å; L603-F659 HydrophobicContact CD2-CE1 3.72Å; L603-F659 HydrophobicContact CD2-CZ 4.22Å
604	P	91	Very high	90.2	Very high	11 Å²	11	37.3 Å²	37.3	7%	0.071	21%	0.212	C	C	.	.	P	Polyproline II helix	trans	-61	156.9	174.3	-21.7	33.4	0	0	0	112	I609 A620 P621 L662	P604-I609 HydrophobicContact CB-CD1 4.01Å; P604-I609 HydrophobicContact CB-CG1 3.81Å; P604-I609 HydrophobicContact CG-CD1 4.39Å; P604-I609 HydrophobicContact CG-CG1 4.37Å; P604-I609 WeakPolarHBondContact O-CD1 2.99Å; P604-A620 HydrophobicContact CB-CB 4Å; P604-A620 HydrophobicContact CG-CB 4.26Å; P604-P621 HydrophobicContact CB-CG 4.49Å; P604-P621 HydrophobicContact CG-CG 4.25Å; P604-P621 WeakPolarHBondContact CG-O 3.4Å; P604-L662 HydrophobicContact CG-CD1 4.42Å
605	S	90.7	Very high	89.5	Confident	60 Å²	60	41.3 Å²	41.3	42%	0.42	24%	0.237	S	C	.	.	P	Polyproline II helix	trans	-54.7	142.4	176.5	81.4	0	0	0	0	111.1	F607 S608 I609	S605-F607 PolarHBondContact O-N 3.43Å; S605-S608 PolarHBondContact N-OG 3.18Å; S605-S608 PolarHBondContact O-N 3.22Å; S605-S608 VanDerWaalsContact O-N 3.14Å; S605-S608 PolarHBondContact O-OG 3.02Å; S605-S608 WeakPolarHBondContact OG-CB 3.33Å; S605-S608 PolarHBondContact OG-N 3.47Å; S605-S608 VanDerWaalsContact OG-N 3.12Å; S605-S608 PolarHBondContact OG-OG 3.31Å; S605-I609 WeakPolarHBondContact O-CG1 3.41Å; S605-I609 PolarHBondContact O-N 3.39Å; S605-I609 VanDerWaalsContact O-N 3.16Å
606	P	90.6	Very high	88.5	Confident	17 Å²	17	44.6 Å²	44.6	11%	0.11	27%	0.271	C	S	.	.	H	α-helix	trans	-57.3	-36.6	178.8	22.4	-33	0	0	0	111.4	S608 I609 I610 I801	P606-S608 PolarHBondContact O-N 3Å; P606-I609 PolarHBondContact O-N 3.48Å; P606-I610 WeakPolarHBondContact O-CB 3.39Å; P606-I610 WeakPolarHBondContact O-CD1 3.35Å; P606-I610 WeakPolarHBondContact O-CG1 3.49Å; P606-I610 PolarHBondContact O-N 2.89Å; P606-I801 HydrophobicContact CB-CG2 3.65Å; P606-I801 HydrophobicContact CG-CG2 3.86Å
607	F	90.3	Very high	87.6	Confident	126 Å²	126	49.2 Å²	49.2	55%	0.553	29%	0.29	S	S	*	.	H	α-helix	trans	-62.5	-43.1	178.1	-60.2	-69.4	0	0	0	113.3	S605 A611 I801	S605-F607 PolarHBondContact O-N 3.43Å; F607-A611 VanDerWaalsContact O-CB 3.32Å; F607-A611 WeakPolarHBondContact O-CB 3.29Å; F607-A611 PolarHBondContact O-N 2.94Å; F607-I801 HydrophobicContact CE2-CD1 4.4Å; F607-I801 HydrophobicContact CZ-CD1 3.95Å; F607-I801 HydrophobicContact CZ-CG1 4.18Å
608	S	89.3	Confident	86.7	Confident	28 Å²	28	55.6 Å²	55.6	20%	0.196	32%	0.318	C	S	.	.	H	α-helix	trans	-65.4	-41.3	176	49.4	0	0	0	0	111.8	S605 P606 A611 D612	S605-S608 PolarHBondContact N-OG 3.18Å; S605-S608 PolarHBondContact O-N 3.22Å; S605-S608 VanDerWaalsContact O-N 3.14Å; S605-S608 PolarHBondContact O-OG 3.02Å; S605-S608 WeakPolarHBondContact OG-CB 3.33Å; S605-S608 PolarHBondContact OG-N 3.47Å; S605-S608 VanDerWaalsContact OG-N 3.12Å; S605-S608 PolarHBondContact OG-OG 3.31Å; P606-S608 PolarHBondContact O-N 3Å; S608-A611 PolarHBondContact O-N 3.41Å; S608-D612 PolarHBondContact O-N 2.99Å
609	I	89.2	Confident	85.8	Confident	1 Å²	1	59.7 Å²	59.7	1%	0.005	35%	0.347	C	S	.	.	H	α-helix	trans	-65.5	-43.8	-179.5	-62	174	0	0	0	110.7	P604 S605 P606 D612 A613 R658 L661 L662	P604-I609 HydrophobicContact CB-CD1 4.01Å; P604-I609 HydrophobicContact CB-CG1 3.81Å; P604-I609 HydrophobicContact CG-CD1 4.39Å; P604-I609 HydrophobicContact CG-CG1 4.37Å; P604-I609 WeakPolarHBondContact O-CD1 2.99Å; S605-I609 WeakPolarHBondContact O-CG1 3.41Å; S605-I609 PolarHBondContact O-N 3.39Å; S605-I609 VanDerWaalsContact O-N 3.16Å; P606-I609 PolarHBondContact O-N 3.48Å; I609-D612 PolarHBondContact O-N 3.46Å; I609-A613 WeakPolarHBondContact O-CB 3.33Å; I609-A613 PolarHBondContact O-N 3.13Å; I609-R658 HydrophobicContact CD1-CB 4.2Å; I609-R658 HydrophobicContact CD1-CG 4.2Å; I609-L661 HydrophobicContact CG2-CB 3.22Å; I609-L661 HydrophobicContact CG2-CD1 3.75Å; I609-L661 HydrophobicContact CG2-CG 4.07Å; I609-L662 HydrophobicContact CD1-CD1 4.25Å; I609-L662 HydrophobicContact CD1-CG 4.36Å; I609-L662 HydrophobicContact CG1-CD2 4.16Å; I609-L662 HydrophobicContact CG1-CG 4.45Å; I609-L662 HydrophobicContact CG2-CD2 4.43Å; I609-L662 HydrophobicContact CG2-CG 4.39Å
610	I	89.1	Confident	85	Confident	22 Å²	22	60.4 Å²	60.4	11%	0.113	35%	0.353	C	S	.	.	H	α-helix	trans	-63.7	-44.2	176.6	-66.7	160.4	0	0	0	110.3	P606 D612 A613 V614 Q804 E805 A808	P606-I610 WeakPolarHBondContact O-CB 3.39Å; P606-I610 WeakPolarHBondContact O-CD1 3.35Å; P606-I610 WeakPolarHBondContact O-CG1 3.49Å; P606-I610 PolarHBondContact O-N 2.89Å; I610-D612 VanDerWaalsContact C-N 3.34Å; I610-D612 PolarHBondContact O-N 3.12Å; I610-A613 PolarHBondContact O-N 2.91Å; I610-V614 HydrophobicContact CG2-CG2 4.32Å; I610-V614 WeakPolarHBondContact O-CB 3.42Å; I610-V614 VanDerWaalsContact O-CG2 3.28Å; I610-V614 WeakPolarHBondContact O-CG2 3.28Å; I610-V614 PolarHBondContact O-N 3.28Å; I610-Q804 HydrophobicContact CD1-CB 3.82Å; I610-E805 HydrophobicContact CD1-CG 3.88Å; I610-E805 HydrophobicContact CG1-CG 4.14Å; I610-A808 HydrophobicContact CG2-CB 4.3Å
611	A	87.7	Confident	84.7	Confident	45 Å²	45	61 Å²	61	37%	0.372	36%	0.362	S	S	.	.	H	α-helix	trans	-60.8	-42.7	178.7	0	0	0	0	0	111.9	F607 S608 V614 T615	F607-A611 VanDerWaalsContact O-CB 3.32Å; F607-A611 WeakPolarHBondContact O-CB 3.29Å; F607-A611 PolarHBondContact O-N 2.94Å; S608-A611 PolarHBondContact O-N 3.41Å; A611-V614 PolarHBondContact O-N 3.18Å; A611-T615 WeakPolarHBondContact O-CB 3.17Å; A611-T615 WeakPolarHBondContact O-CG2 3.38Å; A611-T615 PolarHBondContact O-N 2.99Å; A611-T615 PolarHBondContact O-OG1 3.48Å
612	D	86.4	Confident	84.5	Confident	20 Å²	20	60.8 Å²	60.8	11%	0.107	36%	0.36	C	S	.	.	H	α-helix	trans	-62.9	-45.5	175.7	-77.5	15.7	0	0	0	111.9	S608 I609 I610 V614 T615 G616 K617 S619 A620	S608-D612 PolarHBondContact O-N 2.99Å; I609-D612 PolarHBondContact O-N 3.46Å; I610-D612 VanDerWaalsContact C-N 3.34Å; I610-D612 PolarHBondContact O-N 3.12Å; D612-V614 VanDerWaalsContact C-N 3.28Å; D612-V614 PolarHBondContact O-N 3.41Å; D612-T615 PolarHBondContact O-N 3.37Å; D612-G616 WeakPolarHBondContact O-CA 3.48Å; D612-G616 PolarHBondContact O-N 3.45Å; D612-K617 VanDerWaalsContact CA-O 3.31Å; D612-K617 WeakPolarHBondContact CA-O 3.47Å; D612-K617 WeakPolarHBondContact CB-O 3.34Å; D612-S619 WeakPolarHBondContact OD1-CB 3.44Å; D612-S619 PolarHBondContact OD1-N 3.43Å; D612-S619 VanDerWaalsContact OD1-N 3.08Å; D612-S619 PolarHBondContact OD1-OG 3.32Å; D612-S619 PolarHBondContact OD2-N 2.91Å; D612-A620 VanDerWaalsContact OD2-CB 3.22Å; D612-A620 WeakPolarHBondContact OD2-CB 3.45Å; D612-A620 PolarHBondContact OD2-N 3.17Å
613	A	82.1	Confident	84.3	Confident	23 Å²	23	59.8 Å²	59.8	19%	0.19	36%	0.355	C	S	.	.	H	α-helix	trans	-63.9	-32.5	179	0	0	0	0	0	113	I609 I610 L661 A808	I609-A613 WeakPolarHBondContact O-CB 3.33Å; I609-A613 PolarHBondContact O-N 3.13Å; I610-A613 PolarHBondContact O-N 2.91Å; A613-L661 HydrophobicContact CB-CD2 3.77Å; A613-A808 HydrophobicContact CB-CB 4.39Å
614	V	80.1	Confident	84.2	Confident	79 Å²	79	63 Å²	63	48%	0.479	38%	0.375	S	S	.	.	H	α-helix	trans	-84.8	-36	-180	173.7	0	0	0	0	112.4	I610 A611 D612	I610-V614 HydrophobicContact CG2-CG2 4.32Å; I610-V614 WeakPolarHBondContact O-CB 3.42Å; I610-V614 VanDerWaalsContact O-CG2 3.28Å; I610-V614 WeakPolarHBondContact O-CG2 3.28Å; I610-V614 PolarHBondContact O-N 3.28Å; A611-V614 PolarHBondContact O-N 3.18Å; D612-V614 VanDerWaalsContact C-N 3.28Å; D612-V614 PolarHBondContact O-N 3.41Å
615	T	78.8	Confident	84.2	Confident	84 Å²	84	67.5 Å²	67.5	52%	0.515	41%	0.407	S	S	.	.	H	α-helix	trans	-95	-14.9	-174.8	62.9	0	0	0	0	113.9	A611 D612 K617	A611-T615 WeakPolarHBondContact O-CB 3.17Å; A611-T615 WeakPolarHBondContact O-CG2 3.38Å; A611-T615 PolarHBondContact O-N 2.99Å; A611-T615 PolarHBondContact O-OG1 3.48Å; D612-T615 PolarHBondContact O-N 3.37Å; T615-K617 PolarHBondContact O-N 3.08Å; T615-K617 PolarHBondContact OG1-N 3.21Å
616	G	72.9	Confident	84.3	Confident	70 Å²	70	71.3 Å²	71.3	72%	0.722	42%	0.418	S	S	*	.			trans	67	10.6	-171.4	0	0	0	0	0	113.7	D612	D612-G616 WeakPolarHBondContact O-CA 3.48Å; D612-G616 PolarHBondContact O-N 3.45Å
617	K	73.7	Confident	84.4	Confident	155 Å²	155	73.5 Å²	73.5	67%	0.674	43%	0.427	S	S	*	.			trans	-96.5	121.1	177	-64.1	-179.3	179	179.1	0	108.5	D612 T615 S619	D612-K617 VanDerWaalsContact CA-O 3.31Å; D612-K617 WeakPolarHBondContact CA-O 3.47Å; D612-K617 WeakPolarHBondContact CB-O 3.34Å; T615-K617 PolarHBondContact O-N 3.08Å; T615-K617 PolarHBondContact OG1-N 3.21Å; K617-S619 PolarHBondContact O-N 3.43Å; K617-S619 VanDerWaalsContact O-N 3.11Å
618	E	74.9	Confident	84.5	Confident	174 Å²	174	68.3 Å²	68.3	81%	0.813	41%	0.406	S	S	*	.			trans	-80	87.7	179.2	-62.4	178.8	166.5	0	0	110
619	S	73.2	Confident	84.7	Confident	90 Å²	90	70.8 Å²	70.8	63%	0.629	42%	0.42	S	S	*	.			trans	-106.5	-23.3	179.5	76.6	0	0	0	0	113.8	D612 K617	D612-S619 WeakPolarHBondContact OD1-CB 3.44Å; D612-S619 PolarHBondContact OD1-N 3.43Å; D612-S619 VanDerWaalsContact OD1-N 3.08Å; D612-S619 PolarHBondContact OD1-OG 3.32Å; D612-S619 PolarHBondContact OD2-N 2.91Å; K617-S619 PolarHBondContact O-N 3.43Å; K617-S619 VanDerWaalsContact O-N 3.11Å
620	A	78.5	Confident	84.8	Confident	15 Å²	15	73 Å²	73	12%	0.124	43%	0.43	C	S	.	.	S	Bend	trans	-74.7	133.7	176.6	0	0	0	0	0	110.7	P604 D612 L622	P604-A620 HydrophobicContact CB-CB 4Å; P604-A620 HydrophobicContact CG-CB 4.26Å; D612-A620 VanDerWaalsContact OD2-CB 3.22Å; D612-A620 WeakPolarHBondContact OD2-CB 3.45Å; D612-A620 PolarHBondContact OD2-N 3.17Å; A620-L622 PolarHBondContact O-N 2.62Å
621	P	82.9	Confident	85	Confident	98 Å²	98	72 Å²	72	64%	0.636	42%	0.424	S	S	*	.	P	Polyproline II helix	trans	-64.2	125.7	176.9	25.4	-32.2	0	0	0	110	P604	P604-P621 HydrophobicContact CB-CG 4.49Å; P604-P621 HydrophobicContact CG-CG 4.25Å; P604-P621 WeakPolarHBondContact CG-O 3.4Å
622	L	87.6	Confident	85.3	Confident	119 Å²	119	70 Å²	70	62%	0.623	41%	0.408	S	S	*	.	P	Polyproline II helix	trans	-71	129.1	176.5	-162.6	73.5	0	0	0	109.5	A620 L662 M664	A620-L622 PolarHBondContact O-N 2.62Å; L622-L662 HydrophobicContact CD1-CB 4.39Å; L622-M664 HydrophobicContact CD1-CG 4.4Å; L622-M664 HydrophobicContact CD1-SD 4.13Å
623	P	88.6	Confident	85.5	Confident	9 Å²	9	72.3 Å²	72.3	6%	0.058	42%	0.415	C	S	.	.	P	Polyproline II helix	trans	-66.5	138.5	178.7	28	-34.2	0	0	0	110.3	L603 Q627 V628 L662 M664	L603-P623 HydrophobicContact CD2-CB 4.48Å; L603-P623 HydrophobicContact CD2-CG 4.29Å; P623-Q627 HydrophobicContact CB-CB 4.14Å; P623-V628 HydrophobicContact CB-CG2 4.25Å; P623-V628 HydrophobicContact CG-CG2 4.11Å; P623-L662 HydrophobicContact CG-CD1 4.18Å; P623-M664 HydrophobicContact CG-CE 4.13Å; P623-M664 HydrophobicContact CG-SD 3.51Å; P623-M664 VanDerWaalsContact CG-SD 3.51Å
624	T	91.1	Very high	86	Confident	77 Å²	77	71.3 Å²	71.3	47%	0.472	41%	0.407	S	S	.	.	P	Polyproline II helix	trans	-63.5	157.7	174.7	62.2	0	0	0	0	111.2	Q626 Q627 V628	T624-Q626 PolarHBondContact O-N 3.47Å; T624-Q626 VanDerWaalsContact O-N 3.15Å; T624-Q627 WeakPolarHBondContact O-CB 3.46Å; T624-Q627 PolarHBondContact O-N 3.4Å; T624-Q627 WeakPolarHBondContact OG1-CG 3.39Å; T624-Q627 PolarHBondContact OG1-N 3.4Å; T624-Q627 PolarHBondContact OG1-OE1 3.05Å; T624-V628 WeakPolarHBondContact O-CG2 3.36Å; T624-V628 PolarHBondContact O-N 2.88Å
625	S	91.4	Very high	86.5	Confident	105 Å²	105	67.6 Å²	67.6	73%	0.734	38%	0.384	S	S	*	.	H	α-helix	trans	-55.8	-34.2	177.7	-54	0	0	0	0	112.9	V629	S625-V629 WeakPolarHBondContact O-CG2 3.04Å; S625-V629 PolarHBondContact O-N 3.33Å
626	Q	91.2	Very high	86.9	Confident	141 Å²	141	65.8 Å²	65.8	66%	0.659	37%	0.371	S	S	*	.	H	α-helix	trans	-68	-44.5	175.9	-173.4	177.4	-3.2	0	0	111.9	T624 V628 V629 E630	T624-Q626 PolarHBondContact O-N 3.47Å; T624-Q626 VanDerWaalsContact O-N 3.15Å; Q626-V628 VanDerWaalsContact C-N 3.29Å; Q626-V628 PolarHBondContact O-N 2.96Å; Q626-V629 PolarHBondContact O-N 3.34Å; Q626-E630 PolarHBondContact O-N 3.05Å
627	Q	92.8	Very high	87.7	Confident	62 Å²	62	62.8 Å²	62.8	29%	0.29	34%	0.338	S	S	.	.	H	α-helix	trans	-60.9	-39.7	177.4	-72.9	169.7	-49	0	0	112	L602 P623 T624 E630 V631	L602-Q627 HydrophobicContact CB-CB 4.37Å; L602-Q627 HydrophobicContact CD2-CG 4.21Å; P623-Q627 HydrophobicContact CB-CB 4.14Å; T624-Q627 WeakPolarHBondContact O-CB 3.46Å; T624-Q627 PolarHBondContact O-N 3.4Å; T624-Q627 WeakPolarHBondContact OG1-CG 3.39Å; T624-Q627 PolarHBondContact OG1-N 3.4Å; T624-Q627 PolarHBondContact OG1-OE1 3.05Å; Q627-E630 PolarHBondContact O-N 3.35Å; Q627-V631 VanDerWaalsContact O-CG2 3.31Å; Q627-V631 WeakPolarHBondContact O-CG2 3.46Å; Q627-V631 PolarHBondContact O-N 3.47Å
628	V	93.7	Very high	88.4	Confident	18 Å²	18	55.4 Å²	55.4	11%	0.109	31%	0.306	C	S	.	.	H	α-helix	trans	-60.2	-47.8	175.4	174.8	0	0	0	0	111.2	P623 T624 Q626 E630 V631 V632 F659 M664 A667	P623-V628 HydrophobicContact CB-CG2 4.25Å; P623-V628 HydrophobicContact CG-CG2 4.11Å; T624-V628 WeakPolarHBondContact O-CG2 3.36Å; T624-V628 PolarHBondContact O-N 2.88Å; Q626-V628 VanDerWaalsContact C-N 3.29Å; Q626-V628 PolarHBondContact O-N 2.96Å; V628-E630 VanDerWaalsContact C-N 3.27Å; V628-E630 PolarHBondContact O-N 3.39Å; V628-V631 PolarHBondContact O-N 3.26Å; V628-V632 WeakPolarHBondContact O-CG2 3.32Å; V628-V632 PolarHBondContact O-N 3.33Å; V628-F659 HydrophobicContact CG1-CE1 4.2Å; V628-F659 HydrophobicContact CG1-CZ 4.18Å; V628-F659 HydrophobicContact CG2-CE1 4.21Å; V628-M664 HydrophobicContact CG2-CE 3.33Å; V628-M664 HydrophobicContact CG2-SD 4.25Å; V628-A667 HydrophobicContact CG1-CB 3.48Å; V628-A667 VanDerWaalsContact CG1-CB 3.48Å
629	V	92.4	Very high	88.8	Confident	80 Å²	80	49.5 Å²	49.5	49%	0.485	28%	0.278	S	S	.	.	H	α-helix	trans	-59.3	-42.3	179.2	172.6	0	0	0	0	110.5	S625 Q626 V632 R633	S625-V629 WeakPolarHBondContact O-CG2 3.04Å; S625-V629 PolarHBondContact O-N 3.33Å; Q626-V629 PolarHBondContact O-N 3.34Å; V629-V632 PolarHBondContact O-N 2.87Å; V629-R633 WeakPolarHBondContact O-CB 3.33Å; V629-R633 PolarHBondContact O-N 2.85Å
630	E	91	Very high	89.1	Confident	47 Å²	47	48.8 Å²	48.8	22%	0.22	27%	0.273	C	S	.	.	H	α-helix	trans	-69.5	-40.8	-179	-98.2	50.8	121.5	0	0	113.1	L602 Q626 Q627 V628 R633 S634	L602-E630 HydrophobicContact CD1-CB 3.87Å; Q626-E630 PolarHBondContact O-N 3.05Å; Q627-E630 PolarHBondContact O-N 3.35Å; V628-E630 VanDerWaalsContact C-N 3.27Å; V628-E630 PolarHBondContact O-N 3.39Å; E630-R633 PolarHBondContact O-N 3.11Å; E630-S634 PolarHBondContact O-N 3.37Å
631	V	94	Very high	89.3	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-61.1	-45.4	173.1	171.5	0	0	0	0	110.9	V598 I599 L602 L603 Q627 V628 S634 M655 F659	V598-V631 HydrophobicContact CG1-CG2 4.16Å; I599-V631 HydrophobicContact CG1-CG1 4.42Å; L602-V631 HydrophobicContact CB-CG2 3.69Å; L602-V631 HydrophobicContact CD1-CG2 4.04Å; L602-V631 HydrophobicContact CG-CG2 4.44Å; L603-V631 HydrophobicContact CD1-CG1 4.11Å; L603-V631 HydrophobicContact CD2-CG2 4.12Å; L603-V631 HydrophobicContact CG-CG1 4.34Å; L603-V631 HydrophobicContact CG-CG2 4.05Å; Q627-V631 VanDerWaalsContact O-CG2 3.31Å; Q627-V631 WeakPolarHBondContact O-CG2 3.46Å; Q627-V631 PolarHBondContact O-N 3.47Å; V628-V631 PolarHBondContact O-N 3.26Å; V631-S634 PolarHBondContact O-N 3.18Å; V631-S634 PolarHBondContact O-OG 3.49Å; V631-M655 HydrophobicContact CG1-CE 4.22Å; V631-M655 HydrophobicContact CG1-CG 4Å; V631-M655 HydrophobicContact CG1-SD 3.98Å; V631-M655 VanDerWaalsContact O-CE 3.29Å; V631-M655 WeakPolarHBondContact O-CE 3.45Å; V631-F659 HydrophobicContact CB-CZ 4.11Å; V631-F659 HydrophobicContact CG1-CE2 4.18Å; V631-F659 HydrophobicContact CG1-CZ 3.77Å
632	V	93.6	Very high	89.2	Confident	3 Å²	3	48.3 Å²	48.3	2%	0.018	27%	0.267	C	S	.	.	H	α-helix	trans	-70.1	-36.7	179.7	-179.7	0	0	0	0	111.4	V628 V629 S634 L635 F659 E670 V671 R674	V628-V632 WeakPolarHBondContact O-CG2 3.32Å; V628-V632 PolarHBondContact O-N 3.33Å; V629-V632 PolarHBondContact O-N 2.87Å; V632-S634 VanDerWaalsContact C-N 3.26Å; V632-S634 PolarHBondContact O-N 2.94Å; V632-L635 WeakPolarHBondContact O-CB 3.23Å; V632-L635 PolarHBondContact O-N 3.33Å; V632-F659 HydrophobicContact CG2-CE2 3.82Å; V632-F659 HydrophobicContact CG2-CZ 4.15Å; V632-E670 HydrophobicContact CG1-CG 3.88Å; V632-V671 HydrophobicContact CG1-CG2 4.42Å; V632-V671 HydrophobicContact CG2-CG2 3.8Å; V632-R674 HydrophobicContact CG1-CG 3.79Å
633	R	90.9	Very high	89	Confident	70 Å²	70	48.5 Å²	48.5	26%	0.264	27%	0.269	S	S	.	.	H	α-helix	trans	-64.5	-30.2	176.4	-172.3	178.1	179.9	-179.1	-6.6	112.1	A568 D570 V629 E630 L635 L636	A568-R633 PolarHBondContact O-NH2 3Å; D570-R633 IonicContact OD1-CZ 2.79Å; D570-R633 IonicContact OD1-NE 2.87Å; D570-R633 IonicContact OD1-NH2 3.25Å; D570-R633 PolarHBondContact OD1-NH2 3.14Å; D570-R633 IonicContact OD2-NH2 3.92Å; V629-R633 WeakPolarHBondContact O-CB 3.33Å; V629-R633 PolarHBondContact O-N 2.85Å; E630-R633 PolarHBondContact O-N 3.11Å; R633-L635 PolarHBondContact O-N 3.44Å; R633-L635 VanDerWaalsContact O-N 3.17Å; R633-L636 HydrophobicContact CG-CD1 3.84Å; R633-L636 VanDerWaalsContact O-CB 3.28Å; R633-L636 WeakPolarHBondContact O-CB 3.33Å; R633-L636 VanDerWaalsContact O-CG 3.27Å; R633-L636 WeakPolarHBondContact O-CG 3.47Å; R633-L636 PolarHBondContact O-N 3.3Å
634	S	92	Very high	88.9	Confident	2 Å²	2	48 Å²	48	1%	0.014	27%	0.266	C	S	.	.	H	α-helix	trans	-62.1	-23.4	-179.9	80.7	0	0	0	0	113.1	V595 E630 V631 V632 L636 F637 M655	V595-S634 WeakPolarHBondContact CG2-O 3.26Å; E630-S634 PolarHBondContact O-N 3.37Å; V631-S634 PolarHBondContact O-N 3.18Å; V631-S634 PolarHBondContact O-OG 3.49Å; V632-S634 VanDerWaalsContact C-N 3.26Å; V632-S634 PolarHBondContact O-N 2.94Å; S634-L636 PolarHBondContact O-N 3.47Å; S634-F637 WeakPolarHBondContact O-CB 3.41Å; S634-F637 VanDerWaalsContact O-CD2 3.3Å; S634-F637 WeakPolarHBondContact O-CD2 3.42Å; S634-F637 PolarHBondContact O-N 2.86Å; S634-M655 WeakPolarHBondContact OG-CE 3.4Å
635	L	91.4	Very high	88.6	Confident	1 Å²	1	48.8 Å²	48.8	1%	0.005	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-26.4	172.4	-70.3	172.2	0	0	0	113.3	V632 R633 F637 L638 Q639 Q651 A652 M655 V671	V632-L635 WeakPolarHBondContact O-CB 3.23Å; V632-L635 PolarHBondContact O-N 3.33Å; R633-L635 PolarHBondContact O-N 3.44Å; R633-L635 VanDerWaalsContact O-N 3.17Å; L635-F637 PolarHBondContact O-N 2.93Å; L635-L638 PolarHBondContact O-N 3.46Å; L635-Q639 WeakPolarHBondContact O-CG 3.37Å; L635-Q639 PolarHBondContact O-N 2.97Å; L635-Q651 HydrophobicContact CD2-CB 4.11Å; L635-A652 HydrophobicContact CD1-CB 4.46Å; L635-A652 HydrophobicContact CD2-CB 4.45Å; L635-M655 HydrophobicContact CD1-CE 4.49Å; L635-M655 HydrophobicContact CD1-SD 3.76Å; L635-M655 HydrophobicContact CD2-CE 3.59Å; L635-M655 HydrophobicContact CD2-SD 3.76Å; L635-M655 HydrophobicContact CG-CE 3.68Å; L635-M655 HydrophobicContact CG-SD 3.6Å; L635-M655 VanDerWaalsContact CG-SD 3.6Å; L635-V671 HydrophobicContact CD1-CG1 3.98Å
636	L	88.2	Confident	88.4	Confident	46 Å²	46	47 Å²	47	24%	0.241	24%	0.239	C	C	.	.	H	α-helix	trans	-61.2	-27.1	178.5	-63.4	176.6	0	0	0	113	R633 S634 L638 Q639 S640	R633-L636 HydrophobicContact CG-CD1 3.84Å; R633-L636 VanDerWaalsContact O-CB 3.28Å; R633-L636 WeakPolarHBondContact O-CB 3.33Å; R633-L636 VanDerWaalsContact O-CG 3.27Å; R633-L636 WeakPolarHBondContact O-CG 3.47Å; R633-L636 PolarHBondContact O-N 3.3Å; S634-L636 PolarHBondContact O-N 3.47Å; L636-L638 PolarHBondContact O-N 3.07Å; L636-Q639 PolarHBondContact O-N 3.33Å; L636-S640 PolarHBondContact O-OG 3.1Å; L636-S640 VanDerWaalsContact O-OG 3.11Å
637	F	88.3	Confident	88.3	Confident	6 Å²	6	41.8 Å²	41.8	3%	0.026	22%	0.216	C	C	.	.	H	α-helix	trans	-62.8	-30.7	175.6	-73.5	-84.3	0	0	0	112	L564 R573 C591 V594 V595 S634 L635	L564-F637 HydrophobicContact CB-CE1 4.18Å; R573-F637 HydrophobicContact CG-CE1 3.83Å; R573-F637 HydrophobicContact CG-CZ 4.4Å; C591-F637 HydrophobicContact CB-CB 4.41Å; V594-F637 HydrophobicContact CB-CD1 4.5Å; V594-F637 HydrophobicContact CB-CG 4.47Å; V594-F637 HydrophobicContact CG1-CD1 4.05Å; V594-F637 HydrophobicContact CG1-CD2 3.66Å; V594-F637 HydrophobicContact CG1-CE1 3.9Å; V594-F637 HydrophobicContact CG1-CE2 3.54Å; V594-F637 HydrophobicContact CG1-CG 3.93Å; V594-F637 HydrophobicContact CG1-CZ 3.66Å; V594-F637 HydrophobicContact CG2-CD1 4.49Å; V594-F637 HydrophobicContact CG2-CE1 4.46Å; V595-F637 HydrophobicContact CG2-CB 4.08Å; S634-F637 WeakPolarHBondContact O-CB 3.41Å; S634-F637 VanDerWaalsContact O-CD2 3.3Å; S634-F637 WeakPolarHBondContact O-CD2 3.42Å; S634-F637 PolarHBondContact O-N 2.86Å; L635-F637 PolarHBondContact O-N 2.93Å
638	L	89.3	Confident	88.2	Confident	1 Å²	1	39 Å²	39	1%	0.005	20%	0.203	C	C	.	.	H	α-helix	trans	-88.7	-29.7	-179.2	-52.3	177.5	0	0	0	112.2	C591 V595 L635 L636 S640 I641 L644 D647 A648 Q651	C591-L638 HydrophobicContact CB-CD2 4.32Å; V595-L638 HydrophobicContact CB-CD1 4.42Å; V595-L638 HydrophobicContact CG1-CD1 4.28Å; V595-L638 HydrophobicContact CG2-CD1 4.04Å; V595-L638 HydrophobicContact CG2-CD2 4.03Å; V595-L638 HydrophobicContact CG2-CG 3.82Å; L635-L638 PolarHBondContact O-N 3.46Å; L636-L638 PolarHBondContact O-N 3.07Å; L638-S640 VanDerWaalsContact C-N 3.25Å; L638-S640 PolarHBondContact O-N 3.4Å; L638-I641 PolarHBondContact O-N 3.25Å; L638-L644 HydrophobicContact CB-CB 4.19Å; L638-L644 HydrophobicContact CD2-CB 4.25Å; L638-L644 HydrophobicContact CD2-CD1 3.71Å; L638-L644 HydrophobicContact CD2-CD2 4.45Å; L638-L644 HydrophobicContact CD2-CG 4.38Å; L638-D647 HydrophobicContact CD1-CB 4.45Å; L638-A648 HydrophobicContact CB-CB 3.79Å; L638-A648 HydrophobicContact CD1-CB 4.29Å; L638-Q651 HydrophobicContact CD1-CB 4.01Å; L638-Q651 HydrophobicContact CD1-CG 3.87Å
639	Q	83.4	Confident	88.1	Confident	50 Å²	50	38.1 Å²	38.1	23%	0.234	20%	0.198	C	C	.	.	H	α-helix	trans	-68.2	-25.9	-176.3	-65.2	179.8	23.6	0	0	113.9	L635 L636 I641 R674 F679	L635-Q639 WeakPolarHBondContact O-CG 3.37Å; L635-Q639 PolarHBondContact O-N 2.97Å; L636-Q639 PolarHBondContact O-N 3.33Å; Q639-I641 VanDerWaalsContact C-N 3.28Å; Q639-I641 PolarHBondContact O-N 2.68Å; Q639-R674 PolarHBondContact NE2-O 2.94Å; Q639-R674 PolarHBondContact OE1-O 3.04Å; Q639-F679 HydrophobicContact CB-CE2 4.03Å; Q639-F679 HydrophobicContact CB-CZ 4.08Å; Q639-F679 HydrophobicContact CG-CE2 3.83Å; Q639-F679 HydrophobicContact CG-CZ 4.34Å; Q639-F679 WeakPolarHBondContact O-CZ 3.39Å
640	S	77.8	Confident	88	Confident	75 Å²	75	35.3 Å²	35.3	52%	0.524	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75	-19.2	-176.4	-50.4	0	0	0	0	112.8	L636 L638	L636-S640 PolarHBondContact O-OG 3.1Å; L636-S640 VanDerWaalsContact O-OG 3.11Å; L638-S640 VanDerWaalsContact C-N 3.25Å; L638-S640 PolarHBondContact O-N 3.4Å
641	I	83.7	Confident	88.2	Confident	24 Å²	24	34.5 Å²	34.5	12%	0.123	18%	0.178	C	C	.	.			trans	-116.4	116.9	-168.4	-61.6	167.2	0	0	0	109.2	V587 V588 C591 L638 Q639 D643 L644	V587-I641 HydrophobicContact CG1-CD1 3.54Å; V588-I641 HydrophobicContact CG2-CG2 4.4Å; C591-I641 HydrophobicContact CB-CD1 4.07Å; C591-I641 VanDerWaalsContact SG-CD1 3.52Å; L638-I641 PolarHBondContact O-N 3.25Å; Q639-I641 VanDerWaalsContact C-N 3.28Å; Q639-I641 PolarHBondContact O-N 2.68Å; I641-D643 HydrophobicContact CG2-CB 4.38Å; I641-D643 PolarHBondContact O-N 2.95Å; I641-L644 HydrophobicContact CB-CB 4.24Å; I641-L644 HydrophobicContact CB-CD1 3.92Å; I641-L644 HydrophobicContact CB-CG 4.13Å; I641-L644 HydrophobicContact CD1-CD1 3.68Å; I641-L644 HydrophobicContact CG1-CD1 4.37Å; I641-L644 HydrophobicContact CG2-CB 4.39Å; I641-L644 HydrophobicContact CG2-CD1 4.1Å; I641-L644 HydrophobicContact CG2-CG 3.96Å; I641-L644 PolarHBondContact O-N 3.38Å
642	P	81.3	Confident	88.2	Confident	78 Å²	78	34.5 Å²	34.5	51%	0.506	18%	0.178	S	C	.	.	G	3₁₀ helix	trans	-54.9	-35.8	-177.4	-28.5	35.8	0	0	0	114.9	L644 R645	P642-L644 VanDerWaalsContact C-N 3.27Å; P642-L644 PolarHBondContact O-N 3.38Å; P642-R645 VanDerWaalsContact O-CD 3.22Å; P642-R645 WeakPolarHBondContact O-CD 3.34Å; P642-R645 WeakPolarHBondContact O-CG 3.41Å; P642-R645 PolarHBondContact O-N 3.35Å
643	D	83.1	Confident	88.3	Confident	123 Å²	123	34.4 Å²	34.4	66%	0.658	18%	0.178	S	C	*	.	G	3₁₀ helix	trans	-72.7	-19.6	-178.1	-59.5	-27.3	0	0	0	113	V588 I641	V588-D643 HydrophobicContact CG2-CB 4.46Å; I641-D643 HydrophobicContact CG2-CB 4.38Å; I641-D643 PolarHBondContact O-N 2.95Å
644	L	86.5	Confident	88.5	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.17	C	C	.	.	G	3₁₀ helix	trans	-94.7	9.4	-179.7	-66.9	178.5	0	0	0	113.4	V588 C591 R592 L638 I641 P642 F646 D647 A648	V588-L644 HydrophobicContact CB-CD2 4.39Å; V588-L644 HydrophobicContact CG1-CD2 3.43Å; V588-L644 VanDerWaalsContact CG1-CD2 3.43Å; V588-L644 HydrophobicContact CG1-CG 4.07Å; C591-L644 HydrophobicContact CB-CD1 3.55Å; R592-L644 HydrophobicContact CG-CD2 3.78Å; L638-L644 HydrophobicContact CB-CB 4.19Å; L638-L644 HydrophobicContact CD2-CB 4.25Å; L638-L644 HydrophobicContact CD2-CD1 3.71Å; L638-L644 HydrophobicContact CD2-CD2 4.45Å; L638-L644 HydrophobicContact CD2-CG 4.38Å; I641-L644 HydrophobicContact CB-CB 4.24Å; I641-L644 HydrophobicContact CB-CD1 3.92Å; I641-L644 HydrophobicContact CB-CG 4.13Å; I641-L644 HydrophobicContact CD1-CD1 3.68Å; I641-L644 HydrophobicContact CG1-CD1 4.37Å; I641-L644 HydrophobicContact CG2-CB 4.39Å; I641-L644 HydrophobicContact CG2-CD1 4.1Å; I641-L644 HydrophobicContact CG2-CG 3.96Å; I641-L644 PolarHBondContact O-N 3.38Å; P642-L644 VanDerWaalsContact C-N 3.27Å; P642-L644 PolarHBondContact O-N 3.38Å; L644-F646 VanDerWaalsContact C-N 3.31Å; L644-F646 PolarHBondContact O-N 3Å; L644-D647 HydrophobicContact CB-CB 4.4Å; L644-D647 HydrophobicContact CD2-CB 4.1Å; L644-D647 WeakPolarHBondContact CD2-OD2 3.39Å; L644-D647 WeakPolarHBondContact O-CB 3.23Å; L644-D647 PolarHBondContact O-N 3.36Å; L644-A648 PolarHBondContact O-N 3.23Å
645	R	84.7	Confident	88.6	Confident	93 Å²	93	32 Å²	32	35%	0.351	17%	0.17	S	C	.	.	H	α-helix	trans	-60.4	-40.4	-179.2	-73	170.7	-176.1	179.2	4.4	112.7	P642 A648 I649 F679	P642-R645 VanDerWaalsContact O-CD 3.22Å; P642-R645 WeakPolarHBondContact O-CD 3.34Å; P642-R645 WeakPolarHBondContact O-CG 3.41Å; P642-R645 PolarHBondContact O-N 3.35Å; R645-A648 WeakPolarHBondContact O-CB 3.4Å; R645-A648 PolarHBondContact O-N 3.38Å; R645-I649 PolarHBondContact O-N 3.01Å; R645-F679 HydrophobicContact CB-CB 4.49Å; R645-F679 HydrophobicContact CB-CD1 4.48Å; R645-F679 HydrophobicContact CB-CD2 4.38Å; R645-F679 HydrophobicContact CB-CG 4.23Å; R645-F679 HydrophobicContact CG-CD1 3.8Å; R645-F679 HydrophobicContact CG-CD2 4.23Å; R645-F679 HydrophobicContact CG-CE1 3.88Å; R645-F679 HydrophobicContact CG-CE2 4.26Å; R645-F679 HydrophobicContact CG-CG 4.01Å; R645-F679 HydrophobicContact CG-CZ 4.11Å
646	F	86.4	Confident	88.8	Confident	66 Å²	66	32 Å²	32	29%	0.289	17%	0.17	S	C	.	.	H	α-helix	trans	-72.8	-39.2	177.5	-179.3	-105	0	0	0	111.8	L644 A648 I649 S650 C700 R703	L644-F646 VanDerWaalsContact C-N 3.31Å; L644-F646 PolarHBondContact O-N 3Å; F646-A648 VanDerWaalsContact C-N 3.27Å; F646-A648 PolarHBondContact O-N 3.41Å; F646-I649 PolarHBondContact O-N 3.36Å; F646-I649 VanDerWaalsContact O-N 3.14Å; F646-S650 PolarHBondContact O-N 3.14Å; F646-S650 PolarHBondContact O-OG 2.99Å; F646-C700 HydrophobicContact CD2-CB 4.36Å; F646-C700 VanDerWaalsContact CE2-CA 3.45Å; F646-C700 HydrophobicContact CE2-CB 3.68Å; F646-C700 WeakPolarHBondContact CE2-SG 3.45Å; F646-C700 VanDerWaalsContact CZ-CA 3.48Å; F646-C700 HydrophobicContact CZ-CB 3.95Å; F646-R703 HydrophobicContact CE2-CB 3.97Å; F646-R703 HydrophobicContact CE2-CG 4.37Å; F646-R703 HydrophobicContact CZ-CB 3.89Å; F646-R703 HydrophobicContact CZ-CG 3.78Å
647	D	88.8	Confident	89.1	Confident	33 Å²	33	30.2 Å²	30.2	18%	0.176	16%	0.16	C	C	.	.	H	α-helix	trans	-57.2	-41.7	171.3	-66.6	-91.9	0	0	0	111.4	R592 L638 L644 I649 S650 Q651	R592-D647 IonicContact CZ-OD1 3.87Å; R592-D647 IonicContact CZ-OD2 2.99Å; R592-D647 VanDerWaalsContact NE-CG 3.28Å; R592-D647 IonicContact NE-OD1 2.75Å; R592-D647 PolarHBondContact NE-OD1 3.3Å; R592-D647 IonicContact NE-OD2 2.62Å; R592-D647 PolarHBondContact NE-OD2 2.87Å; R592-D647 IonicContact NH2-OD1 3.76Å; R592-D647 IonicContact NH2-OD2 3.66Å; R592-D647 PolarHBondContact NH2-OD2 2.88Å; L638-D647 HydrophobicContact CD1-CB 4.45Å; L644-D647 HydrophobicContact CB-CB 4.4Å; L644-D647 HydrophobicContact CD2-CB 4.1Å; L644-D647 WeakPolarHBondContact CD2-OD2 3.39Å; L644-D647 WeakPolarHBondContact O-CB 3.23Å; L644-D647 PolarHBondContact O-N 3.36Å; D647-I649 VanDerWaalsContact C-N 3.3Å; D647-I649 PolarHBondContact O-N 2.9Å; D647-S650 PolarHBondContact O-N 3Å; D647-Q651 WeakPolarHBondContact O-CB 3.37Å; D647-Q651 VanDerWaalsContact O-CG 3.31Å; D647-Q651 WeakPolarHBondContact O-CG 3.21Å; D647-Q651 PolarHBondContact O-N 2.75Å
648	A	90.9	Very high	89.4	Confident	2 Å²	2	30.6 Å²	30.6	2%	0.017	16%	0.161	C	C	.	.	H	α-helix	trans	-59.5	-39.6	176.6	0	0	0	0	0	112.4	L638 L644 R645 F646 A652 F679	L638-A648 HydrophobicContact CB-CB 3.79Å; L638-A648 HydrophobicContact CD1-CB 4.29Å; L644-A648 PolarHBondContact O-N 3.23Å; R645-A648 WeakPolarHBondContact O-CB 3.4Å; R645-A648 PolarHBondContact O-N 3.38Å; F646-A648 VanDerWaalsContact C-N 3.27Å; F646-A648 PolarHBondContact O-N 3.41Å; A648-A652 WeakPolarHBondContact O-CB 3.32Å; A648-A652 PolarHBondContact O-N 3.01Å; A648-F679 HydrophobicContact CB-CD2 4.28Å; A648-F679 HydrophobicContact CB-CE2 4.38Å
649	I	91.6	Very high	89.7	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-67.2	-46.2	175.5	-63.9	170	0	0	0	110.2	R645 F646 D647 A652 C653 F679 V680 A683 L704 Y707	R645-I649 PolarHBondContact O-N 3.01Å; F646-I649 PolarHBondContact O-N 3.36Å; F646-I649 VanDerWaalsContact O-N 3.14Å; D647-I649 VanDerWaalsContact C-N 3.3Å; D647-I649 PolarHBondContact O-N 2.9Å; I649-A652 PolarHBondContact O-N 3.18Å; I649-C653 PolarHBondContact O-N 3Å; I649-C653 PolarHBondContact O-SG 2.95Å; I649-F679 HydrophobicContact CD1-CB 4.49Å; I649-V680 HydrophobicContact CD1-CG2 4.3Å; I649-A683 HydrophobicContact CD1-CB 3.92Å; I649-L704 HydrophobicContact CD1-CD2 4.04Å; I649-L704 HydrophobicContact CG2-CD2 4.49Å; I649-Y707 HydrophobicContact CG2-CD2 3.92Å; I649-Y707 HydrophobicContact CG2-CG 4.15Å
650	S	91.9	Very high	90.2	Very high	22 Å²	22	28.2 Å²	28.2	15%	0.154	15%	0.15	C	C	.	.	H	α-helix	trans	-62.7	-43.7	-179.4	-64.7	0	0	0	0	112.2	F646 D647 C653 L654	F646-S650 PolarHBondContact O-N 3.14Å; F646-S650 PolarHBondContact O-OG 2.99Å; D647-S650 PolarHBondContact O-N 3Å; S650-C653 WeakPolarHBondContact O-CB 3.23Å; S650-C653 PolarHBondContact O-N 2.94Å; S650-L654 PolarHBondContact O-N 3.4Å
651	Q	93.5	Very high	90.9	Very high	30 Å²	30	24.9 Å²	24.9	14%	0.14	13%	0.126	C	C	.	.	H	α-helix	trans	-70	-37.7	177.1	-68.4	-63.9	-14.8	0	0	111.8	V595 L635 L638 D647 C653 L654 M655	V595-Q651 HydrophobicContact CG1-CB 4.23Å; V595-Q651 HydrophobicContact CG1-CG 4.09Å; L635-Q651 HydrophobicContact CD2-CB 4.11Å; L638-Q651 HydrophobicContact CD1-CB 4.01Å; L638-Q651 HydrophobicContact CD1-CG 3.87Å; D647-Q651 WeakPolarHBondContact O-CB 3.37Å; D647-Q651 VanDerWaalsContact O-CG 3.31Å; D647-Q651 WeakPolarHBondContact O-CG 3.21Å; D647-Q651 PolarHBondContact O-N 2.75Å; Q651-C653 VanDerWaalsContact C-N 3.33Å; Q651-C653 PolarHBondContact O-N 3.42Å; Q651-L654 PolarHBondContact O-N 3.26Å; Q651-M655 VanDerWaalsContact O-CG 3.29Å; Q651-M655 WeakPolarHBondContact O-CG 3.37Å; Q651-M655 PolarHBondContact O-N 2.89Å
652	A	94.6	Very high	91.2	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-60.9	-41.3	171.9	0	0	0	0	0	112	L635 A648 I649 M655 A656 V671 V675 Y707	L635-A652 HydrophobicContact CD1-CB 4.46Å; L635-A652 HydrophobicContact CD2-CB 4.45Å; A648-A652 WeakPolarHBondContact O-CB 3.32Å; A648-A652 PolarHBondContact O-N 3.01Å; I649-A652 PolarHBondContact O-N 3.18Å; A652-M655 PolarHBondContact O-N 3.48Å; A652-A656 VanDerWaalsContact O-CB 3.25Å; A652-A656 WeakPolarHBondContact O-CB 3.36Å; A652-A656 PolarHBondContact O-N 3.43Å; A652-V671 HydrophobicContact CB-CG1 3.66Å; A652-V671 WeakPolarHBondContact O-CG1 3.49Å; A652-V675 HydrophobicContact CB-CG2 3.6Å; A652-Y707 HydrophobicContact CB-CE2 4.45Å
653	C	95.2	Very high	91.7	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-60.6	-47.8	173.8	-65.1	0	0	0	0	111.1	I649 S650 Q651 M655 A656 R657 E706 Y707 L710	I649-C653 PolarHBondContact O-N 3Å; I649-C653 PolarHBondContact O-SG 2.95Å; S650-C653 WeakPolarHBondContact O-CB 3.23Å; S650-C653 PolarHBondContact O-N 2.94Å; Q651-C653 VanDerWaalsContact C-N 3.33Å; Q651-C653 PolarHBondContact O-N 3.42Å; C653-M655 PolarHBondContact O-N 3.48Å; C653-A656 PolarHBondContact O-N 2.82Å; C653-R657 WeakPolarHBondContact O-CG 3.25Å; C653-R657 PolarHBondContact O-N 2.99Å; C653-E706 HydrophobicContact CB-CG 4.23Å; C653-Y707 VanDerWaalsContact SG-CA 3.59Å; C653-L710 HydrophobicContact CB-CD1 4.23Å
654	L	94.7	Very high	92.1	Very high	22 Å²	22	21 Å²	21	12%	0.115	10%	0.098	C	C	.	.	H	α-helix	trans	-57.1	-51.6	177.3	-173.4	164.4	0	0	0	112	I599 S650 Q651 A656 R657 R658	I599-L654 HydrophobicContact CD1-CD2 4.2Å; I599-L654 HydrophobicContact CG2-CD2 3.72Å; S650-L654 PolarHBondContact O-N 3.4Å; Q651-L654 PolarHBondContact O-N 3.26Å; L654-A656 PolarHBondContact O-N 3.3Å; L654-R657 PolarHBondContact O-N 3.32Å; L654-R658 HydrophobicContact CD2-CG 4.32Å; L654-R658 PolarHBondContact O-N 3.32Å; L654-R658 VanDerWaalsContact O-N 3.09Å
655	M	95.4	Very high	92.3	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-58.7	-47	178.2	-68.4	178	-172.6	0	0	111.4	V595 I599 V631 S634 L635 Q651 A652 C653 R657 R658 F659 V671	V595-M655 HydrophobicContact CG1-CE 3.77Å; I599-M655 HydrophobicContact CD1-CE 3.66Å; I599-M655 HydrophobicContact CD1-CG 4.12Å; I599-M655 HydrophobicContact CG1-CE 3.91Å; I599-M655 HydrophobicContact CG1-CG 4.33Å; V631-M655 HydrophobicContact CG1-CE 4.22Å; V631-M655 HydrophobicContact CG1-CG 4Å; V631-M655 HydrophobicContact CG1-SD 3.98Å; V631-M655 VanDerWaalsContact O-CE 3.29Å; V631-M655 WeakPolarHBondContact O-CE 3.45Å; S634-M655 WeakPolarHBondContact OG-CE 3.4Å; L635-M655 HydrophobicContact CD1-CE 4.49Å; L635-M655 HydrophobicContact CD1-SD 3.76Å; L635-M655 HydrophobicContact CD2-CE 3.59Å; L635-M655 HydrophobicContact CD2-SD 3.76Å; L635-M655 HydrophobicContact CG-CE 3.68Å; L635-M655 HydrophobicContact CG-SD 3.6Å; L635-M655 VanDerWaalsContact CG-SD 3.6Å; Q651-M655 VanDerWaalsContact O-CG 3.29Å; Q651-M655 WeakPolarHBondContact O-CG 3.37Å; Q651-M655 PolarHBondContact O-N 2.89Å; A652-M655 PolarHBondContact O-N 3.48Å; C653-M655 PolarHBondContact O-N 3.48Å; M655-R657 PolarHBondContact O-N 3.16Å; M655-R658 PolarHBondContact O-N 3.25Å; M655-F659 HydrophobicContact CB-CD2 4.33Å; M655-F659 HydrophobicContact CB-CE2 4.13Å; M655-F659 WeakPolarHBondContact O-CB 3.09Å; M655-F659 WeakPolarHBondContact O-CD2 3.43Å; M655-F659 WeakPolarHBondContact O-CG 3.35Å; M655-F659 PolarHBondContact O-N 3.4Å; M655-V671 HydrophobicContact CB-CG1 4.33Å; M655-V671 HydrophobicContact CB-CG2 3.87Å; M655-V671 HydrophobicContact SD-CG2 4.35Å
656	A	95.5	Very high	92.6	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-62.9	-41.3	178.9	0	0	0	0	0	112.1	A652 C653 L654 R658 F659 L660 F672 L710	A652-A656 VanDerWaalsContact O-CB 3.25Å; A652-A656 WeakPolarHBondContact O-CB 3.36Å; A652-A656 PolarHBondContact O-N 3.43Å; C653-A656 PolarHBondContact O-N 2.82Å; L654-A656 PolarHBondContact O-N 3.3Å; A656-R658 PolarHBondContact O-N 2.94Å; A656-F659 PolarHBondContact O-N 2.72Å; A656-L660 VanDerWaalsContact O-CB 3.31Å; A656-L660 WeakPolarHBondContact O-CB 3.4Å; A656-L660 WeakPolarHBondContact O-CG 3.49Å; A656-L660 PolarHBondContact O-N 2.96Å; A656-F672 HydrophobicContact CB-CE1 4.22Å; A656-F672 HydrophobicContact CB-CE2 3.7Å; A656-F672 HydrophobicContact CB-CZ 3.33Å; A656-L710 HydrophobicContact CB-CD1 4.08Å
657	R	95.1	Very high	92.9	Very high	9 Å²	9	19 Å²	19	3%	0.034	10%	0.103	C	C	.	.	H	α-helix	trans	-57.1	-50.6	175	-73.3	-164.4	-53.8	-84.5	1.8	111.2	C653 L654 M655 L660 L661 E706 L710 E805 L809	C653-R657 WeakPolarHBondContact O-CG 3.25Å; C653-R657 PolarHBondContact O-N 2.99Å; L654-R657 PolarHBondContact O-N 3.32Å; M655-R657 PolarHBondContact O-N 3.16Å; R657-L660 PolarHBondContact O-N 3.21Å; R657-L661 WeakPolarHBondContact O-CG 3.42Å; R657-L661 PolarHBondContact O-N 3.48Å; R657-E706 WeakPolarHBondContact CD-OE1 3.37Å; R657-E706 WeakPolarHBondContact CG-OE1 3.43Å; R657-E706 IonicContact CZ-OE1 3.91Å; R657-E706 IonicContact NE-OE1 3.31Å; R657-E706 IonicContact NH1-OE1 3.17Å; R657-E706 PolarHBondContact NH1-OE1 3.49Å; R657-E706 IonicContact NH1-OE2 2.71Å; R657-L710 HydrophobicContact CG-CD1 3.91Å; R657-L710 HydrophobicContact CG-CD2 4.47Å; R657-E805 IonicContact CZ-OE2 3.2Å; R657-E805 VanDerWaalsContact CZ-OE2 3.28Å; R657-E805 IonicContact NE-OE2 2.78Å; R657-E805 PolarHBondContact NE-OE2 2.96Å; R657-E805 IonicContact NH2-OE2 2.97Å; R657-E805 PolarHBondContact NH2-OE2 3.14Å; R657-L809 HydrophobicContact CB-CD1 3.83Å; R657-L809 HydrophobicContact CG-CD1 3.7Å
658	R	94.1	Very high	93.2	Very high	14 Å²	14	17.4 Å²	17.4	5%	0.053	9%	0.094	C	C	.	.	H	α-helix	trans	-64.4	-44.8	-179.4	-68.5	-172	-178.9	180	9.7	111.8	D600 L603 I609 L654 M655 A656 L660 L661 L662 E805	D600-R658 IonicContact OD1-NH1 3.56Å; D600-R658 IonicContact OD1-NH2 2.86Å; L603-R658 HydrophobicContact CD1-CB 3.99Å; L603-R658 HydrophobicContact CD1-CG 4.47Å; I609-R658 HydrophobicContact CD1-CB 4.2Å; I609-R658 HydrophobicContact CD1-CG 4.2Å; L654-R658 HydrophobicContact CD2-CG 4.32Å; L654-R658 PolarHBondContact O-N 3.32Å; L654-R658 VanDerWaalsContact O-N 3.09Å; M655-R658 PolarHBondContact O-N 3.25Å; A656-R658 PolarHBondContact O-N 2.94Å; R658-L660 PolarHBondContact O-N 2.91Å; R658-L661 PolarHBondContact O-N 2.93Å; R658-L662 WeakPolarHBondContact O-CG 3.46Å; R658-L662 PolarHBondContact O-N 3.43Å; R658-E805 IonicContact NE-OE1 2.8Å
659	F	94.8	Very high	93.3	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-63.7	-40.9	177.3	-72.2	-45.4	0	0	0	113	L603 V628 V631 V632 M655 A656 L662 Q663 M664 A667 A668 V671	L603-F659 HydrophobicContact CD2-CD1 4.44Å; L603-F659 HydrophobicContact CD2-CE1 3.72Å; L603-F659 HydrophobicContact CD2-CZ 4.22Å; V628-F659 HydrophobicContact CG1-CE1 4.2Å; V628-F659 HydrophobicContact CG1-CZ 4.18Å; V628-F659 HydrophobicContact CG2-CE1 4.21Å; V631-F659 HydrophobicContact CB-CZ 4.11Å; V631-F659 HydrophobicContact CG1-CE2 4.18Å; V631-F659 HydrophobicContact CG1-CZ 3.77Å; V632-F659 HydrophobicContact CG2-CE2 3.82Å; V632-F659 HydrophobicContact CG2-CZ 4.15Å; M655-F659 HydrophobicContact CB-CD2 4.33Å; M655-F659 HydrophobicContact CB-CE2 4.13Å; M655-F659 WeakPolarHBondContact O-CB 3.09Å; M655-F659 WeakPolarHBondContact O-CD2 3.43Å; M655-F659 WeakPolarHBondContact O-CG 3.35Å; M655-F659 PolarHBondContact O-N 3.4Å; A656-F659 PolarHBondContact O-N 2.72Å; F659-L662 CarbonylContact O-C 3.57Å; F659-L662 PolarHBondContact O-N 3.2Å; F659-L662 VanDerWaalsContact O-N 3.14Å; F659-Q663 PolarHBondContact O-N 3.42Å; F659-Q663 VanDerWaalsContact O-N 3.14Å; F659-M664 HydrophobicContact CB-CB 4.23Å; F659-M664 HydrophobicContact CD1-CB 4.26Å; F659-M664 HydrophobicContact CD1-SD 4.18Å; F659-M664 PolarHBondContact O-N 3.06Å; F659-A667 HydrophobicContact CB-CB 4.21Å; F659-A667 HydrophobicContact CD1-CB 3.75Å; F659-A667 HydrophobicContact CD2-CB 3.86Å; F659-A667 HydrophobicContact CE1-CB 4.02Å; F659-A667 HydrophobicContact CE2-CB 4.13Å; F659-A667 HydrophobicContact CG-CB 3.68Å; F659-A667 HydrophobicContact CZ-CB 4.2Å; F659-A668 HydrophobicContact CB-CB 4.07Å; F659-V671 HydrophobicContact CD2-CG2 3.85Å; F659-V671 HydrophobicContact CE2-CG2 3.71Å
660	L	93.7	Very high	93.3	Very high	2 Å²	2	22.8 Å²	22.8	1%	0.01	12%	0.124	C	C	.	.	H	α-helix	trans	-67.7	-38.4	177.5	-71	174.2	0	0	0	112.1	A656 R657 R658 L662 Q663 F665 A668 L710 Y713 L809	A656-L660 VanDerWaalsContact O-CB 3.31Å; A656-L660 WeakPolarHBondContact O-CB 3.4Å; A656-L660 WeakPolarHBondContact O-CG 3.49Å; A656-L660 PolarHBondContact O-N 2.96Å; R657-L660 PolarHBondContact O-N 3.21Å; R658-L660 PolarHBondContact O-N 2.91Å; L660-L662 PolarHBondContact O-N 3.01Å; L660-Q663 PolarHBondContact O-N 2.92Å; L660-F665 HydrophobicContact CD2-CD1 3.68Å; L660-F665 HydrophobicContact CD2-CE1 4.1Å; L660-A668 HydrophobicContact CD2-CB 3.71Å; L660-A668 HydrophobicContact CG-CB 3.78Å; L660-L710 HydrophobicContact CD1-CD2 3.85Å; L660-Y713 HydrophobicContact CD1-CD1 4.05Å; L660-Y713 HydrophobicContact CD2-CD1 3.9Å; L660-Y713 HydrophobicContact CD2-CE1 3.81Å; L660-L809 HydrophobicContact CB-CD2 3.59Å
661	L	93	Very high	93.4	Very high	4 Å²	4	21.7 Å²	21.7	2%	0.021	12%	0.116	C	C	.	.	H	α-helix	trans	-65.8	-24.6	171.4	-71.3	169.7	0	0	0	112.8	I609 A613 R657 R658 Q663 E805 A808 L809 R812	I609-L661 HydrophobicContact CG2-CB 3.22Å; I609-L661 HydrophobicContact CG2-CD1 3.75Å; I609-L661 HydrophobicContact CG2-CG 4.07Å; A613-L661 HydrophobicContact CB-CD2 3.77Å; R657-L661 WeakPolarHBondContact O-CG 3.42Å; R657-L661 PolarHBondContact O-N 3.48Å; R658-L661 PolarHBondContact O-N 2.93Å; L661-Q663 VanDerWaalsContact C-N 3.32Å; L661-E805 HydrophobicContact CD1-CB 4.11Å; L661-E805 HydrophobicContact CD1-CG 4.22Å; L661-A808 HydrophobicContact CD2-CB 3.79Å; L661-L809 HydrophobicContact CB-CD2 4.48Å; L661-L809 HydrophobicContact CD1-CG 4.39Å; L661-L809 HydrophobicContact CD2-CD2 3.71Å; L661-L809 HydrophobicContact CD2-CG 3.75Å; L661-L809 HydrophobicContact CG-CD2 3.62Å; L661-L809 HydrophobicContact CG-CG 3.77Å; L661-R812 PolarHBondContact O-NH1 3.15Å
662	L	91.2	Very high	93.3	Very high	21 Å²	21	21.2 Å²	21.2	11%	0.11	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.2	4.4	171.7	-67.3	170.5	0	0	0	113.3	P604 I609 L622 P623 R658 F659 L660 M664	P604-L662 HydrophobicContact CG-CD1 4.42Å; I609-L662 HydrophobicContact CD1-CD1 4.25Å; I609-L662 HydrophobicContact CD1-CG 4.36Å; I609-L662 HydrophobicContact CG1-CD2 4.16Å; I609-L662 HydrophobicContact CG1-CG 4.45Å; I609-L662 HydrophobicContact CG2-CD2 4.43Å; I609-L662 HydrophobicContact CG2-CG 4.39Å; L622-L662 HydrophobicContact CD1-CB 4.39Å; P623-L662 HydrophobicContact CG-CD1 4.18Å; R658-L662 WeakPolarHBondContact O-CG 3.46Å; R658-L662 PolarHBondContact O-N 3.43Å; F659-L662 CarbonylContact O-C 3.57Å; F659-L662 PolarHBondContact O-N 3.2Å; F659-L662 VanDerWaalsContact O-N 3.14Å; L660-L662 PolarHBondContact O-N 3.01Å; L662-M664 HydrophobicContact CB-CG 3.87Å; L662-M664 HydrophobicContact CB-SD 4.14Å; L662-M664 HydrophobicContact CD1-SD 4.4Å; L662-M664 PolarHBondContact O-N 3.04Å
663	Q	90.1	Very high	93.1	Very high	90 Å²	90	24.8 Å²	24.8	42%	0.421	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.5	24.1	-174	-53.2	-175	88.9	0	0	114.6	F659 L660 L661 F665 R812	F659-Q663 PolarHBondContact O-N 3.42Å; F659-Q663 VanDerWaalsContact O-N 3.14Å; L660-Q663 PolarHBondContact O-N 2.92Å; L661-Q663 VanDerWaalsContact C-N 3.32Å; Q663-F665 VanDerWaalsContact C-N 3.34Å; Q663-F665 HydrophobicContact CB-CE2 3.95Å; Q663-F665 HydrophobicContact CB-CZ 4.3Å; Q663-F665 WeakPolarHBondContact O-CD2 3.35Å; Q663-F665 WeakPolarHBondContact O-CE2 3.45Å; Q663-F665 PolarHBondContact O-N 2.96Å; Q663-R812 VanDerWaalsContact CG-CZ 3.44Å
664	M	91.9	Very high	92.8	Very high	34 Å²	34	28.7 Å²	28.7	17%	0.167	15%	0.154	C	C	.	.			trans	-91.9	66.7	179.2	-56.2	-172.8	78.8	0	0	110.4	L622 P623 V628 F659 L662 S666 A667 A668	L622-M664 HydrophobicContact CD1-CG 4.4Å; L622-M664 HydrophobicContact CD1-SD 4.13Å; P623-M664 HydrophobicContact CG-CE 4.13Å; P623-M664 HydrophobicContact CG-SD 3.51Å; P623-M664 VanDerWaalsContact CG-SD 3.51Å; V628-M664 HydrophobicContact CG2-CE 3.33Å; V628-M664 HydrophobicContact CG2-SD 4.25Å; F659-M664 HydrophobicContact CB-CB 4.23Å; F659-M664 HydrophobicContact CD1-CB 4.26Å; F659-M664 HydrophobicContact CD1-SD 4.18Å; F659-M664 PolarHBondContact O-N 3.06Å; L662-M664 HydrophobicContact CB-CG 3.87Å; L662-M664 HydrophobicContact CB-SD 4.14Å; L662-M664 HydrophobicContact CD1-SD 4.4Å; L662-M664 PolarHBondContact O-N 3.04Å; M664-S666 VanDerWaalsContact C-N 3.31Å; M664-S666 PolarHBondContact O-N 3.49Å; M664-A667 HydrophobicContact CB-CB 3.96Å; M664-A667 WeakPolarHBondContact O-CB 3.4Å; M664-A667 PolarHBondContact O-N 2.87Å; M664-A667 VanDerWaalsContact O-N 3.14Å; M664-A668 PolarHBondContact O-N 3.24Å
665	F	91.1	Very high	92.5	Very high	27 Å²	27	28 Å²	28	12%	0.118	15%	0.15	C	C	.	.	H	α-helix	trans	-61.7	-35.3	-173.8	-55.8	-78.5	0	0	0	113.8	L660 Q663 A668 S669 Y713 Y717 M816	L660-F665 HydrophobicContact CD2-CD1 3.68Å; L660-F665 HydrophobicContact CD2-CE1 4.1Å; Q663-F665 VanDerWaalsContact C-N 3.34Å; Q663-F665 HydrophobicContact CB-CE2 3.95Å; Q663-F665 HydrophobicContact CB-CZ 4.3Å; Q663-F665 WeakPolarHBondContact O-CD2 3.35Å; Q663-F665 WeakPolarHBondContact O-CE2 3.45Å; Q663-F665 PolarHBondContact O-N 2.96Å; F665-A668 PolarHBondContact O-N 3.31Å; F665-S669 WeakPolarHBondContact O-CB 3.44Å; F665-S669 PolarHBondContact O-N 2.97Å; F665-Y713 HydrophobicContact CD1-CE1 4.19Å; F665-Y713 AromaticContact CE1-CE1 3.93Å; F665-Y713 HydrophobicContact CE1-CE1 3.93Å; F665-Y717 HydrophobicContact CB-CD1 3.73Å; F665-Y717 HydrophobicContact CB-CE1 3.58Å; F665-Y717 HydrophobicContact CB-CG 4.37Å; F665-Y717 HydrophobicContact CD1-CD1 4.21Å; F665-Y717 AromaticContact CD1-CD2 3.88Å; F665-Y717 HydrophobicContact CD1-CD2 3.88Å; F665-Y717 HydrophobicContact CD1-CE1 4.3Å; F665-Y717 AromaticContact CD1-CE2 3.93Å; F665-Y717 HydrophobicContact CD1-CE2 3.93Å; F665-Y717 HydrophobicContact CD1-CG 4.01Å; F665-Y717 AromaticContact CD2-CE1 3.81Å; F665-Y717 HydrophobicContact CD2-CE1 3.81Å; F665-Y717 AromaticContact CD2-CE2 3.76Å; F665-Y717 HydrophobicContact CD2-CE2 3.76Å; F665-Y717 AromaticContact CD2-CZ 3.39Å; F665-Y717 WeakPolarHBondContact CD2-OH 3.44Å; F665-Y717 HydrophobicContact CE1-CD2 4Å; F665-Y717 AromaticContact CE1-CE2 3.94Å; F665-Y717 HydrophobicContact CE1-CE2 3.94Å; F665-Y717 AromaticContact CE2-CE2 3.76Å; F665-Y717 HydrophobicContact CE2-CE2 3.76Å; F665-Y717 AromaticContact CE2-CZ 3.78Å; F665-Y717 AromaticContact CG-CD1 3.9Å; F665-Y717 HydrophobicContact CG-CD1 3.9Å; F665-Y717 HydrophobicContact CG-CD2 4.15Å; F665-Y717 AromaticContact CG-CE1 3.63Å; F665-Y717 HydrophobicContact CG-CE1 3.63Å; F665-Y717 AromaticContact CG-CE2 3.85Å; F665-Y717 HydrophobicContact CG-CE2 3.85Å; F665-Y717 HydrophobicContact CG-CG 4.17Å; F665-Y717 AromaticContact CG-CZ 3.61Å; F665-Y717 HydrophobicContact CZ-CD2 4.36Å; F665-Y717 AromaticContact CZ-CE2 3.85Å; F665-Y717 HydrophobicContact CZ-CE2 3.85Å; F665-M816 HydrophobicContact CE1-CE 3.75Å; F665-M816 HydrophobicContact CZ-CE 3.61Å; F665-M816 HydrophobicContact CZ-SD 4.07Å
666	S	91.3	Very high	92	Very high	84 Å²	84	32.7 Å²	32.7	59%	0.587	17%	0.172	S	C	*	.	H	α-helix	trans	-64.3	-41.3	175.3	50.2	0	0	0	0	111.9	M664 S669 E670	M664-S666 VanDerWaalsContact C-N 3.31Å; M664-S666 PolarHBondContact O-N 3.49Å; S666-S669 PolarHBondContact O-N 2.93Å; S666-E670 WeakPolarHBondContact O-CB 2.86Å; S666-E670 PolarHBondContact O-N 3.26Å
667	A	93.3	Very high	91.4	Very high	4 Å²	4	36.8 Å²	36.8	3%	0.033	20%	0.197	C	C	.	.	H	α-helix	trans	-64.6	-45.3	176.4	0	0	0	0	0	111.5	V628 F659 M664 S669 E670 V671	V628-A667 HydrophobicContact CG1-CB 3.48Å; V628-A667 VanDerWaalsContact CG1-CB 3.48Å; F659-A667 HydrophobicContact CB-CB 4.21Å; F659-A667 HydrophobicContact CD1-CB 3.75Å; F659-A667 HydrophobicContact CD2-CB 3.86Å; F659-A667 HydrophobicContact CE1-CB 4.02Å; F659-A667 HydrophobicContact CE2-CB 4.13Å; F659-A667 HydrophobicContact CG-CB 3.68Å; F659-A667 HydrophobicContact CZ-CB 4.2Å; M664-A667 HydrophobicContact CB-CB 3.96Å; M664-A667 WeakPolarHBondContact O-CB 3.4Å; M664-A667 PolarHBondContact O-N 2.87Å; M664-A667 VanDerWaalsContact O-N 3.14Å; A667-S669 VanDerWaalsContact C-N 3.32Å; A667-S669 PolarHBondContact O-N 3.2Å; A667-E670 PolarHBondContact O-N 2.94Å; A667-V671 WeakPolarHBondContact O-CG2 3.43Å; A667-V671 PolarHBondContact O-N 3.35Å
668	A	94.1	Very high	90.8	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-60.3	-41.3	175.3	0	0	0	0	0	112.1	F659 L660 M664 F665 V671 F672	F659-A668 HydrophobicContact CB-CB 4.07Å; L660-A668 HydrophobicContact CD2-CB 3.71Å; L660-A668 HydrophobicContact CG-CB 3.78Å; M664-A668 PolarHBondContact O-N 3.24Å; F665-A668 PolarHBondContact O-N 3.31Å; A668-V671 WeakPolarHBondContact O-CB 3.33Å; A668-V671 PolarHBondContact O-N 2.96Å; A668-F672 WeakPolarHBondContact O-CD2 3.27Å
669	S	92.5	Very high	90.3	Very high	41 Å²	41	40 Å²	40	29%	0.287	22%	0.215	S	C	.	.	H	α-helix	trans	-64.8	-38.5	175.4	-170.7	0	0	0	0	112.5	F665 S666 A667 F672 S673	F665-S669 WeakPolarHBondContact O-CB 3.44Å; F665-S669 PolarHBondContact O-N 2.97Å; S666-S669 PolarHBondContact O-N 2.93Å; A667-S669 VanDerWaalsContact C-N 3.32Å; A667-S669 PolarHBondContact O-N 3.2Å; S669-F672 PolarHBondContact O-N 3.45Å; S669-S673 PolarHBondContact O-N 3.22Å; S669-S673 VanDerWaalsContact O-N 3.14Å
670	E	92.7	Very high	89.8	Confident	74 Å²	74	40.6 Å²	40.6	35%	0.346	22%	0.219	S	C	.	.	H	α-helix	trans	-69.5	-32.5	178.3	-176	61.9	-173.9	0	0	111.8	V632 S666 A667 F672 S673 R674	V632-E670 HydrophobicContact CG1-CG 3.88Å; S666-E670 WeakPolarHBondContact O-CB 2.86Å; S666-E670 PolarHBondContact O-N 3.26Å; A667-E670 PolarHBondContact O-N 2.94Å; E670-F672 VanDerWaalsContact C-N 3.3Å; E670-F672 PolarHBondContact O-N 3.09Å; E670-S673 VanDerWaalsContact CD-OG 3.28Å; E670-S673 PolarHBondContact O-N 2.94Å; E670-S673 PolarHBondContact O-OG 2.99Å; E670-S673 PolarHBondContact OE2-OG 2.85Å; E670-R674 WeakPolarHBondContact O-CG 3.43Å; E670-R674 PolarHBondContact O-N 3.46Å; E670-R674 IonicContact OE1-CZ 2.75Å; E670-R674 VanDerWaalsContact OE1-CZ 3.3Å; E670-R674 IonicContact OE1-NE 2.8Å; E670-R674 PolarHBondContact OE1-NE 3.43Å; E670-R674 IonicContact OE1-NH2 3.2Å; E670-R674 PolarHBondContact OE1-NH2 3.38Å
671	V	94.2	Very high	89.2	Confident	0 Å²	0	46 Å²	46	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-55	-47.8	171.3	166.1	0	0	0	0	111.1	V632 L635 A652 M655 F659 A667 A668 R674 V675	V632-V671 HydrophobicContact CG1-CG2 4.42Å; V632-V671 HydrophobicContact CG2-CG2 3.8Å; L635-V671 HydrophobicContact CD1-CG1 3.98Å; A652-V671 HydrophobicContact CB-CG1 3.66Å; A652-V671 WeakPolarHBondContact O-CG1 3.49Å; M655-V671 HydrophobicContact CB-CG1 4.33Å; M655-V671 HydrophobicContact CB-CG2 3.87Å; M655-V671 HydrophobicContact SD-CG2 4.35Å; F659-V671 HydrophobicContact CD2-CG2 3.85Å; F659-V671 HydrophobicContact CE2-CG2 3.71Å; A667-V671 WeakPolarHBondContact O-CG2 3.43Å; A667-V671 PolarHBondContact O-N 3.35Å; A668-V671 WeakPolarHBondContact O-CB 3.33Å; A668-V671 PolarHBondContact O-N 2.96Å; V671-R674 PolarHBondContact O-N 3.33Å; V671-V675 PolarHBondContact O-N 3.22Å
672	F	91.5	Very high	88.5	Confident	20 Å²	20	48.7 Å²	48.7	9%	0.088	26%	0.256	C	S	.	.	H	α-helix	trans	-73.1	-26.6	-179	-62	-58.3	0	0	0	113.6	A656 A668 S669 E670 R674 Y707 L710 R711 S714	A656-F672 HydrophobicContact CB-CE1 4.22Å; A656-F672 HydrophobicContact CB-CE2 3.7Å; A656-F672 HydrophobicContact CB-CZ 3.33Å; A668-F672 WeakPolarHBondContact O-CD2 3.27Å; S669-F672 PolarHBondContact O-N 3.45Å; E670-F672 VanDerWaalsContact C-N 3.3Å; E670-F672 PolarHBondContact O-N 3.09Å; F672-R674 PolarHBondContact O-N 3.09Å; F672-Y707 HydrophobicContact CD1-CD2 4.09Å; F672-Y707 AromaticContact CD1-CE2 3.5Å; F672-Y707 HydrophobicContact CD1-CE2 3.5Å; F672-Y707 VanDerWaalsContact CD1-CE2 3.5Å; F672-Y707 AromaticContact CD1-CZ 3.78Å; F672-Y707 AromaticContact CE1-CD2 3.82Å; F672-Y707 HydrophobicContact CE1-CD2 3.82Å; F672-Y707 AromaticContact CE1-CE2 3.72Å; F672-Y707 HydrophobicContact CE1-CE2 3.72Å; F672-L710 HydrophobicContact CE1-CB 4.42Å; F672-L710 HydrophobicContact CE2-CB 4.08Å; F672-L710 HydrophobicContact CZ-CB 3.49Å; F672-L710 VanDerWaalsContact CZ-CB 3.49Å; F672-L710 HydrophobicContact CZ-CD1 4.49Å; F672-R711 HydrophobicContact CB-CG 4.41Å; F672-R711 HydrophobicContact CD1-CB 4.27Å; F672-R711 HydrophobicContact CD2-CB 4.39Å; F672-R711 HydrophobicContact CE1-CB 4.43Å; F672-R711 HydrophobicContact CG-CB 4.27Å; F672-R711 HydrophobicContact CG-CG 4.27Å; F672-S714 WeakPolarHBondContact CE2-OG 3.23Å
673	S	89.9	Confident	87.9	Confident	75 Å²	75	48.5 Å²	48.5	52%	0.524	26%	0.258	S	S	.	.	H	α-helix	trans	-67.6	-28.4	174.6	79.6	0	0	0	0	111.9	S669 E670	S669-S673 PolarHBondContact O-N 3.22Å; S669-S673 VanDerWaalsContact O-N 3.14Å; E670-S673 VanDerWaalsContact CD-OG 3.28Å; E670-S673 PolarHBondContact O-N 2.94Å; E670-S673 PolarHBondContact O-OG 2.99Å; E670-S673 PolarHBondContact OE2-OG 2.85Å
674	R	88	Confident	87.1	Confident	82 Å²	82	48.5 Å²	48.5	31%	0.309	26%	0.264	S	S	.	.	H	α-helix	trans	-80.4	-28.9	178.7	-63.4	-58	179.3	96.9	4.8	114	V632 Q639 E670 V671 F672 H676	V632-R674 HydrophobicContact CG1-CG 3.79Å; Q639-R674 PolarHBondContact NE2-O 2.94Å; Q639-R674 PolarHBondContact OE1-O 3.04Å; E670-R674 WeakPolarHBondContact O-CG 3.43Å; E670-R674 PolarHBondContact O-N 3.46Å; E670-R674 IonicContact OE1-CZ 2.75Å; E670-R674 VanDerWaalsContact OE1-CZ 3.3Å; E670-R674 IonicContact OE1-NE 2.8Å; E670-R674 PolarHBondContact OE1-NE 3.43Å; E670-R674 IonicContact OE1-NH2 3.2Å; E670-R674 PolarHBondContact OE1-NH2 3.38Å; V671-R674 PolarHBondContact O-N 3.33Å; F672-R674 PolarHBondContact O-N 3.09Å; R674-H676 PolarHBondContact O-N 3.08Å
675	V	88.4	Confident	86	Confident	8 Å²	8	54.6 Å²	54.6	5%	0.048	29%	0.289	C	S	.	.	S	Bend	trans	-72.9	119.1	-177.8	178.7	0	0	0	0	110.1	A652 V671 V677 F679 V680 Y707	A652-V675 HydrophobicContact CB-CG2 3.6Å; V671-V675 PolarHBondContact O-N 3.22Å; V675-V677 PolarHBondContact O-N 3.31Å; V675-F679 HydrophobicContact CG1-CD2 4.49Å; V675-V680 HydrophobicContact CG1-CG2 4.42Å; V675-Y707 HydrophobicContact CB-CE2 4.3Å; V675-Y707 HydrophobicContact CG1-CE2 4.15Å; V675-Y707 HydrophobicContact CG2-CE2 4.26Å
676	H	85	Confident	84.8	Confident	97 Å²	97	60.7 Å²	60.7	45%	0.449	31%	0.312	S	S	.	.			trans	-61.9	131.4	-178.7	-164.5	-88.6	0	0	0	111.4	R674 D678 F679	R674-H676 PolarHBondContact O-N 3.08Å; H676-D678 IonicContact CE1-OD2 2.78Å; H676-D678 PolarHBondContact CE1-OD2 3.42Å; H676-D678 WeakPolarHBondContact ND1-CB 3.36Å; H676-D678 PolarHBondContact ND1-N 2.9Å; H676-D678 IonicContact ND1-OD2 3.51Å; H676-D678 PolarHBondContact O-N 3.05Å; H676-D678 VanDerWaalsContact O-N 3.09Å; H676-F679 HydrophobicContact CB-CD1 3.93Å; H676-F679 HydrophobicContact CB-CD2 4.31Å; H676-F679 HydrophobicContact CB-CE1 3.89Å; H676-F679 HydrophobicContact CB-CE2 4.3Å; H676-F679 HydrophobicContact CB-CG 4.14Å; H676-F679 HydrophobicContact CB-CZ 4.08Å; H676-F679 WeakPolarHBondContact O-CB 3.48Å; H676-F679 PolarHBondContact O-N 2.93Å
677	V	83.4	Confident	83.5	Confident	87 Å²	87	64.3 Å²	64.3	53%	0.527	32%	0.322	S	S	.	.	H	α-helix	trans	-56.7	-33.7	-174.7	178.7	0	0	0	0	112.3	V675 F679 V680 K681	V675-V677 PolarHBondContact O-N 3.31Å; V677-F679 VanDerWaalsContact C-N 3.26Å; V677-F679 PolarHBondContact O-N 3.08Å; V677-V680 PolarHBondContact O-N 2.95Å; V677-K681 HydrophobicContact CG1-CD 4.22Å; V677-K681 PolarHBondContact O-N 3.04Å
678	D	83.7	Confident	82	Confident	71 Å²	71	65.5 Å²	65.5	38%	0.38	33%	0.33	S	S	.	.	H	α-helix	trans	-69.7	-21.2	179.7	-64.7	-19.9	0	0	0	113.6	H676 K681 N682	H676-D678 IonicContact CE1-OD2 2.78Å; H676-D678 PolarHBondContact CE1-OD2 3.42Å; H676-D678 WeakPolarHBondContact ND1-CB 3.36Å; H676-D678 PolarHBondContact ND1-N 2.9Å; H676-D678 IonicContact ND1-OD2 3.51Å; H676-D678 PolarHBondContact O-N 3.05Å; H676-D678 VanDerWaalsContact O-N 3.09Å; D678-K681 PolarHBondContact O-N 2.94Å; D678-K681 IonicContact OD1-NZ 2.64Å; D678-N682 WeakPolarHBondContact O-CB 3.3Å; D678-N682 PolarHBondContact O-N 3.15Å; D678-N682 PolarHBondContact O-ND2 3.19Å; D678-N682 VanDerWaalsContact O-ND2 3.08Å
679	F	83.7	Confident	80.4	Confident	18 Å²	18	71 Å²	71	8%	0.079	37%	0.368	C	S	.	.	H	α-helix	trans	-65.5	-47.1	178	-67.4	3.1	0	0	0	110.2	Q639 R645 A648 I649 V675 H676 V677 N682 A683	Q639-F679 HydrophobicContact CB-CE2 4.03Å; Q639-F679 HydrophobicContact CB-CZ 4.08Å; Q639-F679 HydrophobicContact CG-CE2 3.83Å; Q639-F679 HydrophobicContact CG-CZ 4.34Å; Q639-F679 WeakPolarHBondContact O-CZ 3.39Å; R645-F679 HydrophobicContact CB-CB 4.49Å; R645-F679 HydrophobicContact CB-CD1 4.48Å; R645-F679 HydrophobicContact CB-CD2 4.38Å; R645-F679 HydrophobicContact CB-CG 4.23Å; R645-F679 HydrophobicContact CG-CD1 3.8Å; R645-F679 HydrophobicContact CG-CD2 4.23Å; R645-F679 HydrophobicContact CG-CE1 3.88Å; R645-F679 HydrophobicContact CG-CE2 4.26Å; R645-F679 HydrophobicContact CG-CG 4.01Å; R645-F679 HydrophobicContact CG-CZ 4.11Å; A648-F679 HydrophobicContact CB-CD2 4.28Å; A648-F679 HydrophobicContact CB-CE2 4.38Å; I649-F679 HydrophobicContact CD1-CB 4.49Å; V675-F679 HydrophobicContact CG1-CD2 4.49Å; H676-F679 HydrophobicContact CB-CD1 3.93Å; H676-F679 HydrophobicContact CB-CD2 4.31Å; H676-F679 HydrophobicContact CB-CE1 3.89Å; H676-F679 HydrophobicContact CB-CE2 4.3Å; H676-F679 HydrophobicContact CB-CG 4.14Å; H676-F679 HydrophobicContact CB-CZ 4.08Å; H676-F679 WeakPolarHBondContact O-CB 3.48Å; H676-F679 PolarHBondContact O-N 2.93Å; V677-F679 VanDerWaalsContact C-N 3.26Å; V677-F679 PolarHBondContact O-N 3.08Å; F679-N682 PolarHBondContact O-N 2.78Å; F679-A683 WeakPolarHBondContact O-CB 3.46Å; F679-A683 PolarHBondContact O-N 3.16Å
680	V	82.7	Confident	79.1	Confident	14 Å²	14	71.5 Å²	71.5	9%	0.085	37%	0.372	C	S	.	.	H	α-helix	trans	-65.1	-45.1	176.8	-174.3	0	0	0	0	110.5	I649 V675 V677 N682 A683 V684 L704 Y707	I649-V680 HydrophobicContact CD1-CG2 4.3Å; V675-V680 HydrophobicContact CG1-CG2 4.42Å; V677-V680 PolarHBondContact O-N 2.95Å; V680-N682 VanDerWaalsContact C-N 3.28Å; V680-N682 PolarHBondContact O-N 3.48Å; V680-A683 PolarHBondContact O-N 2.99Å; V680-V684 WeakPolarHBondContact O-CG2 3.47Å; V680-V684 PolarHBondContact O-N 3.39Å; V680-L704 HydrophobicContact CG1-CD2 4.16Å; V680-Y707 HydrophobicContact CG1-CD1 4.46Å; V680-Y707 HydrophobicContact CG1-CE1 4.46Å; V680-Y707 HydrophobicContact CG2-CD1 4.13Å; V680-Y707 HydrophobicContact CG2-CE1 3.6Å
681	K	82.8	Confident	77.7	Confident	115 Å²	115	74.5 Å²	74.5	50%	0.5	39%	0.39	S	S	.	.	H	α-helix	trans	-61.1	-35.1	178.4	-72.1	176.6	179.3	166	0	113.2	V677 D678 K685	V677-K681 HydrophobicContact CG1-CD 4.22Å; V677-K681 PolarHBondContact O-N 3.04Å; D678-K681 PolarHBondContact O-N 2.94Å; D678-K681 IonicContact OD1-NZ 2.64Å; K681-K685 WeakPolarHBondContact O-CG 3.4Å
682	N	78	Confident	76	Confident	61 Å²	61	82.9 Å²	82.9	33%	0.326	43%	0.429	S	S	.	.	H	α-helix	trans	-81.8	-36.9	-179	-69.5	-24.4	0	0	0	111.9	D678 F679 V680 V684 K685	D678-N682 WeakPolarHBondContact O-CB 3.3Å; D678-N682 PolarHBondContact O-N 3.15Å; D678-N682 PolarHBondContact O-ND2 3.19Å; D678-N682 VanDerWaalsContact O-ND2 3.08Å; F679-N682 PolarHBondContact O-N 2.78Å; V680-N682 VanDerWaalsContact C-N 3.28Å; V680-N682 PolarHBondContact O-N 3.48Å; N682-V684 VanDerWaalsContact C-N 3.26Å; N682-V684 PolarHBondContact O-N 3.03Å; N682-K685 PolarHBondContact O-N 3.47Å
683	A	77.4	Confident	75	Confident	16 Å²	16	84.5 Å²	84.5	13%	0.132	44%	0.438	C	S	.	.	H	α-helix	trans	-58.7	-38.9	175.6	0	0	0	0	0	111.8	I649 F679 V680 K685 Y686 W697 L704	I649-A683 HydrophobicContact CD1-CB 3.92Å; F679-A683 WeakPolarHBondContact O-CB 3.46Å; F679-A683 PolarHBondContact O-N 3.16Å; V680-A683 PolarHBondContact O-N 2.99Å; A683-K685 PolarHBondContact O-N 3.07Å; A683-Y686 PolarHBondContact O-N 3.13Å; A683-W697 WeakPolarHBondContact O-CZ3 3.37Å; A683-L704 HydrophobicContact CB-CD1 4.15Å; A683-L704 HydrophobicContact CB-CD2 3.89Å; A683-L704 HydrophobicContact CB-CG 4.49Å
684	V	73.5	Confident	74.5	Confident	91 Å²	91	85.1 Å²	85.1	55%	0.552	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-23.9	176.8	175.4	0	0	0	0	113.1	V680 N682 L704	V680-V684 WeakPolarHBondContact O-CG2 3.47Å; V680-V684 PolarHBondContact O-N 3.39Å; N682-V684 VanDerWaalsContact C-N 3.26Å; N682-V684 PolarHBondContact O-N 3.03Å; V684-L704 HydrophobicContact CG2-CD1 3.97Å
685	K	70.2	Confident	74.1	Confident	162 Å²	162	86.1 Å²	86.1	70%	0.704	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-14.4	-176.3	-69	175.5	-177.1	174.8	0	113.9	K681 N682 A683 M687	K681-K685 WeakPolarHBondContact O-CG 3.4Å; N682-K685 PolarHBondContact O-N 3.47Å; A683-K685 PolarHBondContact O-N 3.07Å; K685-M687 PolarHBondContact O-N 3.29Å; K685-M687 VanDerWaalsContact O-N 3.17Å
686	Y	65	Low	73.8	Confident	154 Å²	154	88.7 Å²	88.7	60%	0.604	47%	0.467	S	S	*	.			trans	-84	93.5	-173.4	-162.8	-92.4	0	0	0	110	A683 W697	A683-Y686 PolarHBondContact O-N 3.13Å; Y686-W697 WeakPolarHBondContact O-CH2 3.45Å; Y686-W697 WeakPolarHBondContact O-CZ3 3.28Å
687	M	62.8	Low	73.7	Confident	161 Å²	161	86.3 Å²	86.3	79%	0.793	45%	0.454	S	S	*	.			trans	-87.3	126.2	170.1	-169	160.5	-178.1	0	0	109.1	K685	K685-M687 PolarHBondContact O-N 3.29Å; K685-M687 VanDerWaalsContact O-N 3.17Å
688	P	62.8	Low	73.9	Confident	29 Å²	29	84.8 Å²	84.8	19%	0.188	44%	0.44	C	S	.	.			trans	-57.8	141.3	178.9	22.9	-35.5	0	0	0	112.4	D693 W697	P688-D693 HydrophobicContact CB-CB 3.19Å; P688-D693 WeakPolarHBondContact CB-O 3.05Å; P688-W697 HydrophobicContact CB-CB 4.35Å; P688-W697 HydrophobicContact CG-CB 3.62Å; P688-W697 HydrophobicContact CG-CG 3.78Å
689	S	60.5	Low	74.2	Confident	114 Å²	114	83.8 Å²	83.8	80%	0.797	44%	0.437	S	S	*	.	S	Bend	trans	-95.7	-12.3	177.9	37	0	0	0	0	114.1
690	S	65.3	Low	74.3	Confident	53 Å²	53	83.6 Å²	83.6	37%	0.371	44%	0.437	S	S	.	.	S	Bend	trans	-136.3	163.7	-179.6	74.9	0	0	0	0	112.2	E692 D693 E694	S690-E692 VanDerWaalsContact C-N 3.34Å; S690-E692 PolarHBondContact O-N 3.2Å; S690-D693 PolarHBondContact N-OD2 2.78Å; S690-D693 WeakPolarHBondContact O-CB 3.45Å; S690-D693 PolarHBondContact O-N 3.43Å; S690-D693 VanDerWaalsContact O-N 3.16Å; S690-D693 PolarHBondContact OG-OD2 3.34Å; S690-E694 PolarHBondContact O-N 2.95Å
691	D	62.6	Low	74.6	Confident	137 Å²	137	86.1 Å²	86.1	73%	0.733	45%	0.448	S	S	*	.	S	Bend	trans	-65.1	-33.6	179.9	-66.2	-14.1	0	0	0	112.4	D693 E694	D691-D693 PolarHBondContact O-N 3.41Å; D691-E694 WeakPolarHBondContact O-CB 3.34Å; D691-E694 PolarHBondContact O-N 3.16Å
692	E	59.8	Low	75	Confident	176 Å²	176	80.7 Å²	80.7	82%	0.822	43%	0.425	S	S	*	.	H	α-helix	trans	-64.1	-30.9	174.6	-70.3	-175.5	172.1	0	0	111.7	S690 E694	S690-E692 VanDerWaalsContact C-N 3.34Å; S690-E692 PolarHBondContact O-N 3.2Å; E692-E694 VanDerWaalsContact C-N 3.27Å; E692-E694 PolarHBondContact O-N 3.35Å
693	D	69.7	Low	75.7	Confident	53 Å²	53	79 Å²	79	28%	0.283	41%	0.413	S	S	.	.	H	α-helix	trans	-77	-14.5	174.7	-55.5	-49.4	0	0	0	111.8	P688 S690 D691 W697	P688-D693 HydrophobicContact CB-CB 3.19Å; P688-D693 WeakPolarHBondContact CB-O 3.05Å; S690-D693 PolarHBondContact N-OD2 2.78Å; S690-D693 WeakPolarHBondContact O-CB 3.45Å; S690-D693 PolarHBondContact O-N 3.43Å; S690-D693 VanDerWaalsContact O-N 3.16Å; S690-D693 PolarHBondContact OG-OD2 3.34Å; D691-D693 PolarHBondContact O-N 3.41Å; D693-W697 VanDerWaalsContact O-CB 3.25Å; D693-W697 WeakPolarHBondContact O-CB 3.38Å; D693-W697 PolarHBondContact O-N 3.39Å
694	E	78.8	Confident	76.3	Confident	89 Å²	89	78.8 Å²	78.8	42%	0.416	41%	0.41	S	S	.	.	H	α-helix	trans	-68.8	-44.7	-178.4	-161.8	-163.7	135.6	0	0	111.9	S690 D691 E692 W697 K698	S690-E694 PolarHBondContact O-N 2.95Å; D691-E694 WeakPolarHBondContact O-CB 3.34Å; D691-E694 PolarHBondContact O-N 3.16Å; E692-E694 VanDerWaalsContact C-N 3.27Å; E692-E694 PolarHBondContact O-N 3.35Å; E694-W697 WeakPolarHBondContact O-CB 3.49Å; E694-W697 PolarHBondContact O-N 2.66Å; E694-K698 WeakPolarHBondContact O-CG 3.34Å; E694-K698 PolarHBondContact O-N 2.65Å; E694-K698 WeakPolarHBondContact OE1-CE 3.26Å; E694-K698 IonicContact OE1-NZ 2.88Å; E694-K698 PolarHBondContact OE1-NZ 3.23Å
695	D	80.9	Confident	77.1	Confident	102 Å²	102	76.4 Å²	76.4	55%	0.545	39%	0.391	S	S	.	.	H	α-helix	trans	-68.7	-38.5	178.4	-73.1	-21.4	0	0	0	111.4	W697 K698 V699	D695-W697 VanDerWaalsContact C-N 3.26Å; D695-W697 PolarHBondContact O-N 3.23Å; D695-K698 PolarHBondContact O-N 2.89Å; D695-K698 IonicContact OD1-NZ 3.66Å; D695-K698 PolarHBondContact OD1-NZ 3.13Å; D695-V699 PolarHBondContact O-N 3Å
696	A	80.4	Confident	78.3	Confident	62 Å²	62	68.9 Å²	68.9	51%	0.512	36%	0.359	S	S	.	.	H	α-helix	trans	-61.2	-37.7	171.1	0	0	0	0	0	111.7	V699 C700	A696-V699 PolarHBondContact O-N 2.97Å; A696-C700 PolarHBondContact O-N 2.78Å
697	W	84.3	Confident	79.6	Confident	48 Å²	48	61.8 Å²	61.8	18%	0.182	33%	0.331	C	S	.	.	H	α-helix	trans	-68.1	-38.6	176.2	179.9	-114.9	0	0	0	113	A683 Y686 P688 D693 E694 D695 V699 C700 Q701	A683-W697 WeakPolarHBondContact O-CZ3 3.37Å; Y686-W697 WeakPolarHBondContact O-CH2 3.45Å; Y686-W697 WeakPolarHBondContact O-CZ3 3.28Å; P688-W697 HydrophobicContact CB-CB 4.35Å; P688-W697 HydrophobicContact CG-CB 3.62Å; P688-W697 HydrophobicContact CG-CG 3.78Å; D693-W697 VanDerWaalsContact O-CB 3.25Å; D693-W697 WeakPolarHBondContact O-CB 3.38Å; D693-W697 PolarHBondContact O-N 3.39Å; E694-W697 WeakPolarHBondContact O-CB 3.49Å; E694-W697 PolarHBondContact O-N 2.66Å; D695-W697 VanDerWaalsContact C-N 3.26Å; D695-W697 PolarHBondContact O-N 3.23Å; W697-V699 VanDerWaalsContact C-N 3.32Å; W697-V699 PolarHBondContact O-N 3.48Å; W697-C700 HydrophobicContact CE3-CB 3.81Å; W697-C700 HydrophobicContact CZ3-CB 4.16Å; W697-C700 CarbonylContact O-C 3.56Å; W697-C700 WeakPolarHBondContact O-CA 3.5Å; W697-C700 VanDerWaalsContact O-CB 3.29Å; W697-C700 WeakPolarHBondContact O-CB 3.45Å; W697-C700 PolarHBondContact O-N 3.46Å; W697-Q701 HydrophobicContact CD2-CG 4.1Å; W697-Q701 HydrophobicContact CG-CG 4.43Å; W697-Q701 HydrophobicContact CZ2-CG 3.85Å; W697-Q701 VanDerWaalsContact NE1-NE2 3.11Å; W697-Q701 WeakPolarHBondContact O-CG 3.31Å; W697-Q701 PolarHBondContact O-N 3.02Å
698	K	88	Confident	81	Confident	54 Å²	54	56.7 Å²	56.7	24%	0.235	31%	0.307	C	S	.	.	H	α-helix	trans	-58.4	-44.5	173.9	-70.9	168.9	-167.4	150.4	0	111.6	E694 D695 C700 Q701 N702 H795	E694-K698 WeakPolarHBondContact O-CG 3.34Å; E694-K698 PolarHBondContact O-N 2.65Å; E694-K698 WeakPolarHBondContact OE1-CE 3.26Å; E694-K698 IonicContact OE1-NZ 2.88Å; E694-K698 PolarHBondContact OE1-NZ 3.23Å; D695-K698 PolarHBondContact O-N 2.89Å; D695-K698 IonicContact OD1-NZ 3.66Å; D695-K698 PolarHBondContact OD1-NZ 3.13Å; K698-C700 VanDerWaalsContact C-N 3.31Å; K698-C700 PolarHBondContact O-N 3.2Å; K698-Q701 PolarHBondContact O-N 3Å; K698-N702 PolarHBondContact O-N 3.19Å; K698-H795 HydrophobicContact CB-CB 3.96Å; K698-H795 HydrophobicContact CG-CB 4.28Å
699	V	88.2	Confident	82.5	Confident	51 Å²	51	55.9 Å²	55.9	31%	0.309	30%	0.302	S	S	.	.	H	α-helix	trans	-61.2	-42.5	173.6	177.7	0	0	0	0	110.4	D695 A696 W697 Q701 N702 R703 E797	D695-V699 PolarHBondContact O-N 3Å; A696-V699 PolarHBondContact O-N 2.97Å; W697-V699 VanDerWaalsContact C-N 3.32Å; W697-V699 PolarHBondContact O-N 3.48Å; V699-Q701 PolarHBondContact O-N 3.45Å; V699-N702 PolarHBondContact O-N 2.99Å; V699-R703 HydrophobicContact CG1-CG 4.43Å; V699-R703 WeakPolarHBondContact O-CG 3.34Å; V699-R703 PolarHBondContact O-N 3.36Å; V699-E797 HydrophobicContact CG2-CG 4.35Å
700	C	87.4	Confident	84.1	Confident	13 Å²	13	50.4 Å²	50.4	9%	0.088	26%	0.264	C	S	.	.	H	α-helix	trans	-59.5	-47	176.1	-174.8	0	0	0	0	112.9	F646 A696 W697 K698 N702 R703 L704	F646-C700 HydrophobicContact CD2-CB 4.36Å; F646-C700 VanDerWaalsContact CE2-CA 3.45Å; F646-C700 HydrophobicContact CE2-CB 3.68Å; F646-C700 WeakPolarHBondContact CE2-SG 3.45Å; F646-C700 VanDerWaalsContact CZ-CA 3.48Å; F646-C700 HydrophobicContact CZ-CB 3.95Å; A696-C700 PolarHBondContact O-N 2.78Å; W697-C700 HydrophobicContact CE3-CB 3.81Å; W697-C700 HydrophobicContact CZ3-CB 4.16Å; W697-C700 CarbonylContact O-C 3.56Å; W697-C700 WeakPolarHBondContact O-CA 3.5Å; W697-C700 VanDerWaalsContact O-CB 3.29Å; W697-C700 WeakPolarHBondContact O-CB 3.45Å; W697-C700 PolarHBondContact O-N 3.46Å; K698-C700 VanDerWaalsContact C-N 3.31Å; K698-C700 PolarHBondContact O-N 3.2Å; C700-N702 PolarHBondContact O-N 3.17Å; C700-R703 PolarHBondContact O-N 3.36Å; C700-L704 WeakPolarHBondContact O-CB 3.35Å; C700-L704 WeakPolarHBondContact O-CG 3.18Å; C700-L704 PolarHBondContact O-N 2.79Å
701	Q	88.4	Confident	85.4	Confident	68 Å²	68	52 Å²	52	32%	0.318	26%	0.261	S	S	.	.	H	α-helix	trans	-60.3	-45.4	177.8	-71.3	177.4	-54.7	0	0	111.6	W697 K698 V699 L704 R705 H795	W697-Q701 HydrophobicContact CD2-CG 4.1Å; W697-Q701 HydrophobicContact CG-CG 4.43Å; W697-Q701 HydrophobicContact CZ2-CG 3.85Å; W697-Q701 VanDerWaalsContact NE1-NE2 3.11Å; W697-Q701 WeakPolarHBondContact O-CG 3.31Å; W697-Q701 PolarHBondContact O-N 3.02Å; K698-Q701 PolarHBondContact O-N 3Å; V699-Q701 PolarHBondContact O-N 3.45Å; Q701-L704 PolarHBondContact O-N 2.65Å; Q701-R705 WeakPolarHBondContact O-CB 3.44Å; Q701-R705 PolarHBondContact O-N 2.69Å; Q701-H795 PolarHBondContact OE1-NE2 3.22Å; Q701-H795 VanDerWaalsContact OE1-NE2 3.15Å
702	N	91.9	Very high	86.8	Confident	1 Å²	1	47.6 Å²	47.6	1%	0.005	24%	0.237	C	C	.	.	H	α-helix	trans	-61	-44.9	175.7	-78.4	-16.3	0	0	0	112.1	K698 V699 C700 R705 E706 A794 H795 E797	K698-N702 PolarHBondContact O-N 3.19Å; V699-N702 PolarHBondContact O-N 2.99Å; C700-N702 PolarHBondContact O-N 3.17Å; N702-R705 PolarHBondContact O-N 2.72Å; N702-E706 VanDerWaalsContact O-CB 3.28Å; N702-E706 WeakPolarHBondContact O-CB 3.41Å; N702-E706 PolarHBondContact O-N 2.95Å; N702-A794 PolarHBondContact OD1-N 3.43Å; N702-H795 PolarHBondContact ND2-O 2.71Å; N702-H795 PolarHBondContact OD1-N 3.45Å; N702-H795 VanDerWaalsContact OD1-N 3.16Å; N702-E797 WeakPolarHBondContact CB-OE1 3.16Å; N702-E797 PolarHBondContact ND2-OE1 3.25Å
703	R	91.6	Very high	88.4	Confident	24 Å²	24	39.4 Å²	39.4	9%	0.091	20%	0.198	C	C	.	.	H	α-helix	trans	-66.1	-38.3	177.6	-66.5	-63.8	175.3	-72.1	-0.1	112.7	F646 V699 C700 E706 Y707 E797 R802	F646-R703 HydrophobicContact CE2-CB 3.97Å; F646-R703 HydrophobicContact CE2-CG 4.37Å; F646-R703 HydrophobicContact CZ-CB 3.89Å; F646-R703 HydrophobicContact CZ-CG 3.78Å; V699-R703 HydrophobicContact CG1-CG 4.43Å; V699-R703 WeakPolarHBondContact O-CG 3.34Å; V699-R703 PolarHBondContact O-N 3.36Å; C700-R703 PolarHBondContact O-N 3.36Å; R703-E706 PolarHBondContact O-N 3.06Å; R703-Y707 VanDerWaalsContact O-CB 3.3Å; R703-Y707 WeakPolarHBondContact O-CB 3.43Å; R703-Y707 PolarHBondContact O-N 3.5Å; R703-E797 IonicContact CZ-OE1 3.6Å; R703-E797 IonicContact CZ-OE2 2.88Å; R703-E797 VanDerWaalsContact CZ-OE2 3.25Å; R703-E797 IonicContact NH1-OE1 3.28Å; R703-E797 PolarHBondContact NH1-OE1 3.44Å; R703-E797 IonicContact NH1-OE2 2.76Å; R703-E797 PolarHBondContact NH1-OE2 3.48Å; R703-E797 IonicContact NH2-OE2 3.85Å; R703-E797 PolarHBondContact NH2-OE2 2.91Å; R703-R802 VanDerWaalsContact CZ-CD 3.44Å; R703-R802 VanDerWaalsContact CZ-NE 3.3Å; R703-R802 VanDerWaalsContact NH1-NE 3.16Å
704	L	90.2	Very high	89.5	Confident	12 Å²	12	37.2 Å²	37.2	6%	0.063	19%	0.187	C	C	.	.	H	α-helix	trans	-67.2	-41.1	176	-74.2	172.2	0	0	0	111.9	I649 V680 A683 V684 C700 Q701 Y707 N708	I649-L704 HydrophobicContact CD1-CD2 4.04Å; I649-L704 HydrophobicContact CG2-CD2 4.49Å; V680-L704 HydrophobicContact CG1-CD2 4.16Å; A683-L704 HydrophobicContact CB-CD1 4.15Å; A683-L704 HydrophobicContact CB-CD2 3.89Å; A683-L704 HydrophobicContact CB-CG 4.49Å; V684-L704 HydrophobicContact CG2-CD1 3.97Å; C700-L704 WeakPolarHBondContact O-CB 3.35Å; C700-L704 WeakPolarHBondContact O-CG 3.18Å; C700-L704 PolarHBondContact O-N 2.79Å; Q701-L704 PolarHBondContact O-N 2.65Å; L704-Y707 PolarHBondContact O-N 2.98Å; L704-N708 PolarHBondContact O-N 3.16Å; L704-N708 PolarHBondContact O-ND2 3.33Å
705	R	91.1	Very high	90.1	Very high	41 Å²	41	37.1 Å²	37.1	16%	0.155	19%	0.189	C	C	.	.	H	α-helix	trans	-62.6	-48.3	174.3	-174.9	172.4	177.4	-157	-13.1	110.7	Q701 N702 Y707 N708 C709 D787 E789 V792	Q701-R705 WeakPolarHBondContact O-CB 3.44Å; Q701-R705 PolarHBondContact O-N 2.69Å; N702-R705 PolarHBondContact O-N 2.72Å; R705-Y707 PolarHBondContact O-N 2.77Å; R705-N708 PolarHBondContact O-N 2.9Å; R705-C709 PolarHBondContact O-N 2.88Å; R705-C709 PolarHBondContact O-SG 2.98Å; R705-D787 PolarHBondContact NE-O 3.49Å; R705-D787 PolarHBondContact NH2-O 2.65Å; R705-D787 VanDerWaalsContact NH2-O 3.13Å; R705-E789 PolarHBondContact NH2-O 3.12Å; R705-V792 PolarHBondContact NE-O 3.35Å; R705-V792 PolarHBondContact NH1-O 3.3Å; R705-V792 PolarHBondContact NH2-O 2.87Å
706	E	93.7	Very high	90.7	Very high	4 Å²	4	32.3 Å²	32.3	2%	0.019	16%	0.164	C	C	.	.	H	α-helix	trans	-56.4	-48.8	175.1	-176.7	-175.9	172.1	0	0	112	C653 R657 N702 R703 N708 C709 L710 L791 R802 M806	C653-E706 HydrophobicContact CB-CG 4.23Å; R657-E706 WeakPolarHBondContact CD-OE1 3.37Å; R657-E706 WeakPolarHBondContact CG-OE1 3.43Å; R657-E706 IonicContact CZ-OE1 3.91Å; R657-E706 IonicContact NE-OE1 3.31Å; R657-E706 IonicContact NH1-OE1 3.17Å; R657-E706 PolarHBondContact NH1-OE1 3.49Å; R657-E706 IonicContact NH1-OE2 2.71Å; N702-E706 VanDerWaalsContact O-CB 3.28Å; N702-E706 WeakPolarHBondContact O-CB 3.41Å; N702-E706 PolarHBondContact O-N 2.95Å; R703-E706 PolarHBondContact O-N 3.06Å; E706-N708 VanDerWaalsContact C-N 3.29Å; E706-N708 PolarHBondContact O-N 3.31Å; E706-C709 PolarHBondContact O-N 3.3Å; E706-C709 VanDerWaalsContact O-N 3.16Å; E706-L710 HydrophobicContact CG-CD1 3.83Å; E706-L710 HydrophobicContact CG-CG 4.24Å; E706-L710 WeakPolarHBondContact O-CG 3.47Å; E706-L710 PolarHBondContact O-N 2.98Å; E706-L791 HydrophobicContact CG-CD2 3.87Å; E706-R802 IonicContact OE2-CZ 3.96Å; E706-R802 IonicContact OE2-NE 3.77Å; E706-R802 PolarHBondContact OE2-NE 3.23Å; E706-R802 IonicContact OE2-NH2 3.26Å; E706-R802 PolarHBondContact OE2-NH2 2.95Å; E706-M806 HydrophobicContact CG-SD 4.46Å
707	Y	93.7	Very high	91.4	Very high	5 Å²	5	32 Å²	32	2%	0.02	15%	0.149	C	C	.	.	H	α-helix	trans	-54.3	-46.6	177.3	-178.6	-89.1	0	0	0	111.6	I649 A652 C653 F672 V675 V680 R703 L704 R705 R711	I649-Y707 HydrophobicContact CG2-CD2 3.92Å; I649-Y707 HydrophobicContact CG2-CG 4.15Å; A652-Y707 HydrophobicContact CB-CE2 4.45Å; C653-Y707 VanDerWaalsContact SG-CA 3.59Å; F672-Y707 HydrophobicContact CD1-CD2 4.09Å; F672-Y707 AromaticContact CD1-CE2 3.5Å; F672-Y707 HydrophobicContact CD1-CE2 3.5Å; F672-Y707 VanDerWaalsContact CD1-CE2 3.5Å; F672-Y707 AromaticContact CD1-CZ 3.78Å; F672-Y707 AromaticContact CE1-CD2 3.82Å; F672-Y707 HydrophobicContact CE1-CD2 3.82Å; F672-Y707 AromaticContact CE1-CE2 3.72Å; F672-Y707 HydrophobicContact CE1-CE2 3.72Å; V675-Y707 HydrophobicContact CB-CE2 4.3Å; V675-Y707 HydrophobicContact CG1-CE2 4.15Å; V675-Y707 HydrophobicContact CG2-CE2 4.26Å; V680-Y707 HydrophobicContact CG1-CD1 4.46Å; V680-Y707 HydrophobicContact CG1-CE1 4.46Å; V680-Y707 HydrophobicContact CG2-CD1 4.13Å; V680-Y707 HydrophobicContact CG2-CE1 3.6Å; R703-Y707 VanDerWaalsContact O-CB 3.3Å; R703-Y707 WeakPolarHBondContact O-CB 3.43Å; R703-Y707 PolarHBondContact O-N 3.5Å; L704-Y707 PolarHBondContact O-N 2.98Å; R705-Y707 PolarHBondContact O-N 2.77Å; Y707-R711 WeakPolarHBondContact O-CB 3.39Å; Y707-R711 PolarHBondContact O-N 3.49Å
708	N	91.3	Very high	91.8	Very high	55 Å²	55	31 Å²	31	29%	0.294	15%	0.15	S	C	.	.	H	α-helix	trans	-64	-46.9	177.6	-72.7	-36.3	0	0	0	111.4	L704 R705 E706 L710 R711 E712	L704-N708 PolarHBondContact O-N 3.16Å; L704-N708 PolarHBondContact O-ND2 3.33Å; R705-N708 PolarHBondContact O-N 2.9Å; E706-N708 VanDerWaalsContact C-N 3.29Å; E706-N708 PolarHBondContact O-N 3.31Å; N708-L710 PolarHBondContact O-N 3.33Å; N708-R711 PolarHBondContact O-N 3.23Å; N708-R711 PolarHBondContact OD1-NH2 3.47Å; N708-E712 WeakPolarHBondContact O-CB 3.38Å; N708-E712 VanDerWaalsContact O-CG 3.25Å; N708-E712 WeakPolarHBondContact O-CG 3.36Å; N708-E712 PolarHBondContact O-N 3.36Å
709	C	93.7	Very high	92	Very high	11 Å²	11	29 Å²	29	7%	0.074	14%	0.144	C	C	.	.	H	α-helix	trans	-57.7	-46.6	177.9	-69.6	0	0	0	0	112.6	R705 E706 Y713 W790 L791	R705-C709 PolarHBondContact O-N 2.88Å; R705-C709 PolarHBondContact O-SG 2.98Å; E706-C709 PolarHBondContact O-N 3.3Å; E706-C709 VanDerWaalsContact O-N 3.16Å; C709-Y713 WeakPolarHBondContact O-CB 3.28Å; C709-Y713 PolarHBondContact O-N 2.95Å; C709-W790 HydrophobicContact CB-CG 4.4Å; C709-W790 PolarHBondContact O-NE1 3.26Å; C709-L791 HydrophobicContact CB-CD2 3.88Å; C709-L791 HydrophobicContact CB-CG 4.17Å
710	L	94.6	Very high	92.4	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-70.8	-35.4	-179.1	-63.7	174.7	0	0	0	112.4	C653 A656 R657 L660 F672 E706 N708 S714 L791 L809	C653-L710 HydrophobicContact CB-CD1 4.23Å; A656-L710 HydrophobicContact CB-CD1 4.08Å; R657-L710 HydrophobicContact CG-CD1 3.91Å; R657-L710 HydrophobicContact CG-CD2 4.47Å; L660-L710 HydrophobicContact CD1-CD2 3.85Å; F672-L710 HydrophobicContact CE1-CB 4.42Å; F672-L710 HydrophobicContact CE2-CB 4.08Å; F672-L710 HydrophobicContact CZ-CB 3.49Å; F672-L710 VanDerWaalsContact CZ-CB 3.49Å; F672-L710 HydrophobicContact CZ-CD1 4.49Å; E706-L710 HydrophobicContact CG-CD1 3.83Å; E706-L710 HydrophobicContact CG-CG 4.24Å; E706-L710 WeakPolarHBondContact O-CG 3.47Å; E706-L710 PolarHBondContact O-N 2.98Å; N708-L710 PolarHBondContact O-N 3.33Å; L710-S714 PolarHBondContact O-N 2.88Å; L710-S714 PolarHBondContact O-OG 3Å; L710-L791 HydrophobicContact CD2-CD1 3.85Å; L710-L791 HydrophobicContact CD2-CD2 3.83Å; L710-L791 HydrophobicContact CD2-CG 4.33Å; L710-L791 HydrophobicContact CG-CD2 3.99Å; L710-L809 HydrophobicContact CD2-CD1 4.2Å
711	R	93	Very high	92.6	Very high	85 Å²	85	32 Å²	32	32%	0.321	15%	0.148	S	C	.	.	H	α-helix	trans	-69.7	-44.3	175.1	-173.1	-177.1	67.6	-178.1	-5.2	111.6	F672 Y707 N708 Y713 S714 N715	F672-R711 HydrophobicContact CB-CG 4.41Å; F672-R711 HydrophobicContact CD1-CB 4.27Å; F672-R711 HydrophobicContact CD2-CB 4.39Å; F672-R711 HydrophobicContact CE1-CB 4.43Å; F672-R711 HydrophobicContact CG-CB 4.27Å; F672-R711 HydrophobicContact CG-CG 4.27Å; Y707-R711 WeakPolarHBondContact O-CB 3.39Å; Y707-R711 PolarHBondContact O-N 3.49Å; N708-R711 PolarHBondContact O-N 3.23Å; N708-R711 PolarHBondContact OD1-NH2 3.47Å; R711-Y713 VanDerWaalsContact C-N 3.26Å; R711-Y713 PolarHBondContact O-N 3.28Å; R711-S714 PolarHBondContact O-N 3.37Å; R711-N715 WeakPolarHBondContact O-CB 3.28Å; R711-N715 VanDerWaalsContact O-CG 3.23Å; R711-N715 PolarHBondContact O-N 3.38Å
712	E	91.9	Very high	92.8	Very high	46 Å²	46	32.1 Å²	32.1	22%	0.215	15%	0.151	C	C	.	.	H	α-helix	trans	-57.1	-43.2	174	-77.1	178.3	170	0	0	110.8	N708 N715 A716 Q781	N708-E712 WeakPolarHBondContact O-CB 3.38Å; N708-E712 VanDerWaalsContact O-CG 3.25Å; N708-E712 WeakPolarHBondContact O-CG 3.36Å; N708-E712 PolarHBondContact O-N 3.36Å; E712-N715 PolarHBondContact O-N 2.76Å; E712-A716 WeakPolarHBondContact O-CB 3.36Å; E712-A716 PolarHBondContact O-N 2.97Å; E712-Q781 PolarHBondContact OE1-NE2 2.85Å
713	Y	94.2	Very high	92.9	Very high	3 Å²	3	32.1 Å²	32.1	1%	0.012	15%	0.151	C	C	.	.	H	α-helix	trans	-60.4	-49	174.8	-174	-90.3	0	0	0	113.1	L660 F665 C709 R711 N715 A716 Y717 I782 W790 C813 M816 V817	L660-Y713 HydrophobicContact CD1-CD1 4.05Å; L660-Y713 HydrophobicContact CD2-CD1 3.9Å; L660-Y713 HydrophobicContact CD2-CE1 3.81Å; F665-Y713 HydrophobicContact CD1-CE1 4.19Å; F665-Y713 AromaticContact CE1-CE1 3.93Å; F665-Y713 HydrophobicContact CE1-CE1 3.93Å; C709-Y713 WeakPolarHBondContact O-CB 3.28Å; C709-Y713 PolarHBondContact O-N 2.95Å; R711-Y713 VanDerWaalsContact C-N 3.26Å; R711-Y713 PolarHBondContact O-N 3.28Å; Y713-N715 VanDerWaalsContact C-N 3.29Å; Y713-N715 PolarHBondContact O-N 3.14Å; Y713-A716 PolarHBondContact O-N 2.98Å; Y713-Y717 WeakPolarHBondContact O-CB 3.18Å; Y713-Y717 PolarHBondContact O-N 3.26Å; Y713-I782 HydrophobicContact CD2-CD1 3.93Å; Y713-I782 HydrophobicContact CD2-CG2 4.42Å; Y713-W790 HydrophobicContact CD2-CH2 4.11Å; Y713-W790 AromaticContact CD2-CZ2 3.68Å; Y713-W790 HydrophobicContact CD2-CZ2 3.68Å; Y713-W790 HydrophobicContact CG-CH2 4.5Å; Y713-W790 AromaticContact CG-CZ2 3.86Å; Y713-W790 HydrophobicContact CG-CZ2 3.86Å; Y713-C813 HydrophobicContact CD2-CB 4.21Å; Y713-C813 HydrophobicContact CE2-CB 3.44Å; Y713-C813 VanDerWaalsContact CE2-CB 3.44Å; Y713-C813 VanDerWaalsContact CZ-SG 3.5Å; Y713-C813 PolarHBondContact OH-SG 2.79Å; Y713-M816 WeakPolarHBondContact OH-CE 3.43Å; Y713-V817 HydrophobicContact CD2-CG2 4.23Å; Y713-V817 HydrophobicContact CE2-CG2 3.6Å
714	S	92.4	Very high	93	Very high	8 Å²	8	32.7 Å²	32.7	6%	0.056	16%	0.159	C	C	.	.	H	α-helix	trans	-58.9	-41.2	176.5	-61.5	0	0	0	0	112	F672 L710 R711 S718	F672-S714 WeakPolarHBondContact CE2-OG 3.23Å; L710-S714 PolarHBondContact O-N 2.88Å; L710-S714 PolarHBondContact O-OG 3Å; R711-S714 PolarHBondContact O-N 3.37Å; S714-S718 PolarHBondContact O-N 3.23Å
715	N	92	Very high	93	Very high	86 Å²	86	35 Å²	35	46%	0.46	17%	0.171	S	C	.	.	H	α-helix	trans	-66.3	-44.4	177.6	-70.6	-12.6	0	0	0	112	R711 E712 Y713 Y717 S718 A719	R711-N715 WeakPolarHBondContact O-CB 3.28Å; R711-N715 VanDerWaalsContact O-CG 3.23Å; R711-N715 PolarHBondContact O-N 3.38Å; E712-N715 PolarHBondContact O-N 2.76Å; Y713-N715 VanDerWaalsContact C-N 3.29Å; Y713-N715 PolarHBondContact O-N 3.14Å; N715-Y717 VanDerWaalsContact C-N 3.34Å; N715-Y717 PolarHBondContact O-N 2.81Å; N715-S718 PolarHBondContact O-N 3.28Å; N715-A719 PolarHBondContact O-N 3.41Å
716	A	93.8	Very high	92.9	Very high	1 Å²	1	33.6 Å²	33.6	1%	0.008	17%	0.167	C	C	.	.	H	α-helix	trans	-63.7	-40.9	177.7	0	0	0	0	0	111.9	E712 Y713 S718 A719 F720 M779 I782	E712-A716 WeakPolarHBondContact O-CB 3.36Å; E712-A716 PolarHBondContact O-N 2.97Å; Y713-A716 PolarHBondContact O-N 2.98Å; A716-S718 VanDerWaalsContact C-N 3.34Å; A716-A719 PolarHBondContact O-N 3.19Å; A716-F720 PolarHBondContact O-N 2.82Å; A716-M779 HydrophobicContact CB-CG 4.19Å; A716-I782 HydrophobicContact CB-CD1 3.36Å
717	Y	93.6	Very high	92.7	Very high	55 Å²	55	35.5 Å²	35.5	22%	0.216	18%	0.175	C	C	.	.	H	α-helix	trans	-64.2	-39	174.3	-173.4	-85.6	0	0	0	111.9	F665 Y713 N715 F720 R721 M816 M820	F665-Y717 HydrophobicContact CB-CD1 3.73Å; F665-Y717 HydrophobicContact CB-CE1 3.58Å; F665-Y717 HydrophobicContact CB-CG 4.37Å; F665-Y717 HydrophobicContact CD1-CD1 4.21Å; F665-Y717 AromaticContact CD1-CD2 3.88Å; F665-Y717 HydrophobicContact CD1-CD2 3.88Å; F665-Y717 HydrophobicContact CD1-CE1 4.3Å; F665-Y717 AromaticContact CD1-CE2 3.93Å; F665-Y717 HydrophobicContact CD1-CE2 3.93Å; F665-Y717 HydrophobicContact CD1-CG 4.01Å; F665-Y717 AromaticContact CD2-CE1 3.81Å; F665-Y717 HydrophobicContact CD2-CE1 3.81Å; F665-Y717 AromaticContact CD2-CE2 3.76Å; F665-Y717 HydrophobicContact CD2-CE2 3.76Å; F665-Y717 AromaticContact CD2-CZ 3.39Å; F665-Y717 WeakPolarHBondContact CD2-OH 3.44Å; F665-Y717 HydrophobicContact CE1-CD2 4Å; F665-Y717 AromaticContact CE1-CE2 3.94Å; F665-Y717 HydrophobicContact CE1-CE2 3.94Å; F665-Y717 AromaticContact CE2-CE2 3.76Å; F665-Y717 HydrophobicContact CE2-CE2 3.76Å; F665-Y717 AromaticContact CE2-CZ 3.78Å; F665-Y717 AromaticContact CG-CD1 3.9Å; F665-Y717 HydrophobicContact CG-CD1 3.9Å; F665-Y717 HydrophobicContact CG-CD2 4.15Å; F665-Y717 AromaticContact CG-CE1 3.63Å; F665-Y717 HydrophobicContact CG-CE1 3.63Å; F665-Y717 AromaticContact CG-CE2 3.85Å; F665-Y717 HydrophobicContact CG-CE2 3.85Å; F665-Y717 HydrophobicContact CG-CG 4.17Å; F665-Y717 AromaticContact CG-CZ 3.61Å; F665-Y717 HydrophobicContact CZ-CD2 4.36Å; F665-Y717 AromaticContact CZ-CE2 3.85Å; F665-Y717 HydrophobicContact CZ-CE2 3.85Å; Y713-Y717 WeakPolarHBondContact O-CB 3.18Å; Y713-Y717 PolarHBondContact O-N 3.26Å; N715-Y717 VanDerWaalsContact C-N 3.34Å; N715-Y717 PolarHBondContact O-N 2.81Å; Y717-F720 WeakPolarHBondContact O-CB 3.26Å; Y717-F720 PolarHBondContact O-N 3.27Å; Y717-R721 PolarHBondContact O-N 3.35Å; Y717-M816 HydrophobicContact CD2-CE 3.9Å; Y717-M816 HydrophobicContact CE2-CE 3.92Å; Y717-M820 HydrophobicContact CD2-CE 4.09Å; Y717-M820 HydrophobicContact CD2-SD 4.49Å; Y717-M820 HydrophobicContact CE2-CE 3.76Å
718	S	92.3	Very high	92.3	Very high	29 Å²	29	38.5 Å²	38.5	20%	0.203	20%	0.196	C	C	.	.	H	α-helix	trans	-64.6	-45.6	174.1	-163.2	0	0	0	0	111.7	S714 N715 A716 F720 R721 D722	S714-S718 PolarHBondContact O-N 3.23Å; N715-S718 PolarHBondContact O-N 3.28Å; A716-S718 VanDerWaalsContact C-N 3.34Å; S718-F720 VanDerWaalsContact C-N 3.29Å; S718-F720 PolarHBondContact O-N 3.01Å; S718-R721 PolarHBondContact O-N 3.3Å; S718-R721 VanDerWaalsContact O-N 3.14Å; S718-R721 PolarHBondContact OG-NH2 3.3Å; S718-D722 PolarHBondContact O-N 3.4Å
719	A	93.9	Very high	91.9	Very high	11 Å²	11	41.8 Å²	41.8	9%	0.091	21%	0.214	C	C	.	.	H	α-helix	trans	-59.1	-40.5	177.1	0	0	0	0	0	111.9	N715 A716 D722 W723 I774 A775	N715-A719 PolarHBondContact O-N 3.41Å; A716-A719 PolarHBondContact O-N 3.19Å; A719-D722 PolarHBondContact O-N 3.17Å; A719-W723 WeakPolarHBondContact O-CB 3.38Å; A719-W723 PolarHBondContact O-N 3.1Å; A719-I774 HydrophobicContact CB-CG2 4.15Å; A719-A775 HydrophobicContact CB-CB 4.07Å
720	F	95	Very high	91.3	Very high	25 Å²	25	46.4 Å²	46.4	11%	0.11	23%	0.233	C	C	.	.	H	α-helix	trans	-58.4	-48.6	172.8	-179	-113	0	0	0	113.1	A716 Y717 S718 D722 W723 S724 M779 M820 F823 M824	A716-F720 PolarHBondContact O-N 2.82Å; Y717-F720 WeakPolarHBondContact O-CB 3.26Å; Y717-F720 PolarHBondContact O-N 3.27Å; S718-F720 VanDerWaalsContact C-N 3.29Å; S718-F720 PolarHBondContact O-N 3.01Å; F720-D722 VanDerWaalsContact C-N 3.31Å; F720-D722 PolarHBondContact O-N 2.94Å; F720-W723 AromaticContact CD2-CE3 3.91Å; F720-W723 HydrophobicContact CD2-CE3 3.91Å; F720-W723 HydrophobicContact CD2-CZ3 4.19Å; F720-W723 AromaticContact CE2-CE3 3.79Å; F720-W723 HydrophobicContact CE2-CE3 3.79Å; F720-W723 AromaticContact CE2-CZ3 3.6Å; F720-W723 HydrophobicContact CE2-CZ3 3.6Å; F720-W723 HydrophobicContact CZ-CZ3 4.27Å; F720-W723 PolarHBondContact O-N 2.93Å; F720-S724 WeakPolarHBondContact O-CB 3.48Å; F720-S724 PolarHBondContact O-N 3.11Å; F720-M779 HydrophobicContact CB-CE 3.24Å; F720-M779 HydrophobicContact CD1-CE 4.39Å; F720-M779 HydrophobicContact CD2-CE 3.33Å; F720-M779 HydrophobicContact CE2-CE 4.3Å; F720-M779 HydrophobicContact CG-CE 3.37Å; F720-M820 HydrophobicContact CD1-CE 4.1Å; F720-M820 HydrophobicContact CD1-CG 4.39Å; F720-M820 HydrophobicContact CD1-SD 3.93Å; F720-M820 HydrophobicContact CD2-CB 4.18Å; F720-M820 HydrophobicContact CD2-CG 4.47Å; F720-M820 HydrophobicContact CE1-CE 3.97Å; F720-M820 HydrophobicContact CE1-CG 4.03Å; F720-M820 HydrophobicContact CE1-SD 4.08Å; F720-M820 HydrophobicContact CE2-CB 3.88Å; F720-M820 HydrophobicContact CE2-CG 4.1Å; F720-M820 HydrophobicContact CG-SD 4.2Å; F720-M820 HydrophobicContact CZ-CB 4.16Å; F720-M820 HydrophobicContact CZ-CG 3.88Å; F720-M820 HydrophobicContact CZ-SD 4.47Å; F720-F823 HydrophobicContact CE2-CD1 4.26Å; F720-F823 HydrophobicContact CZ-CD1 4.17Å; F720-M824 HydrophobicContact CD2-CG 4.02Å; F720-M824 HydrophobicContact CD2-SD 3.66Å; F720-M824 HydrophobicContact CE2-CG 3.77Å; F720-M824 HydrophobicContact CE2-SD 4.03Å
721	R	92.8	Very high	90.8	Very high	103 Å²	103	50.5 Å²	50.5	39%	0.389	25%	0.251	S	S	.	.	H	α-helix	trans	-63.3	-41.9	-179.7	173.9	-179	53.2	-162.3	-10.5	110.6	Y717 S718 S724 D725	Y717-R721 PolarHBondContact O-N 3.35Å; S718-R721 PolarHBondContact O-N 3.3Å; S718-R721 VanDerWaalsContact O-N 3.14Å; S718-R721 PolarHBondContact OG-NH2 3.3Å; R721-S724 PolarHBondContact O-N 3.45Å; R721-D725 WeakPolarHBondContact O-CB 3.31Å; R721-D725 PolarHBondContact O-N 2.72Å
722	D	92.6	Very high	90.1	Very high	70 Å²	70	47.8 Å²	47.8	37%	0.374	24%	0.244	S	C	.	.	H	α-helix	trans	-62.7	-44.5	176.9	-62.3	-21.2	0	0	0	110.5	S718 A719 F720 D725 M726 Y771	S718-D722 PolarHBondContact O-N 3.4Å; A719-D722 PolarHBondContact O-N 3.17Å; F720-D722 VanDerWaalsContact C-N 3.31Å; F720-D722 PolarHBondContact O-N 2.94Å; D722-D725 PolarHBondContact O-N 2.96Å; D722-M726 WeakPolarHBondContact O-CB 3.37Å; D722-M726 WeakPolarHBondContact O-CG 3.29Å; D722-M726 PolarHBondContact O-N 3.43Å; D722-Y771 HydrophobicContact CB-CD1 3.83Å; D722-Y771 HydrophobicContact CB-CE1 3.87Å
723	W	94.8	Very high	89.1	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-60.1	-47.1	171.6	168.6	76.2	0	0	0	112.3	A719 F720 D725 M726 F727 F772 A775 F823 M824 M828	A719-W723 WeakPolarHBondContact O-CB 3.38Å; A719-W723 PolarHBondContact O-N 3.1Å; F720-W723 AromaticContact CD2-CE3 3.91Å; F720-W723 HydrophobicContact CD2-CE3 3.91Å; F720-W723 HydrophobicContact CD2-CZ3 4.19Å; F720-W723 AromaticContact CE2-CE3 3.79Å; F720-W723 HydrophobicContact CE2-CE3 3.79Å; F720-W723 AromaticContact CE2-CZ3 3.6Å; F720-W723 HydrophobicContact CE2-CZ3 3.6Å; F720-W723 HydrophobicContact CZ-CZ3 4.27Å; F720-W723 PolarHBondContact O-N 2.93Å; W723-D725 VanDerWaalsContact C-N 3.32Å; W723-D725 PolarHBondContact O-N 3.08Å; W723-M726 PolarHBondContact O-N 3.39Å; W723-F727 HydrophobicContact CZ2-CB 4.42Å; W723-F727 HydrophobicContact CZ2-CD2 4.33Å; W723-F727 HydrophobicContact CZ2-CG 4.22Å; W723-F727 VanDerWaalsContact O-CB 3.27Å; W723-F727 WeakPolarHBondContact O-CB 3.49Å; W723-F727 PolarHBondContact O-N 3.1Å; W723-F772 VanDerWaalsContact CD1-CA 3.47Å; W723-F772 AromaticContact NE1-CD2 3.99Å; W723-A775 HydrophobicContact CB-CB 4.23Å; W723-F823 AromaticContact CH2-CD1 3.93Å; W723-F823 HydrophobicContact CH2-CD1 3.93Å; W723-F823 AromaticContact CH2-CE1 3.69Å; W723-F823 HydrophobicContact CH2-CE1 3.69Å; W723-F823 AromaticContact CZ3-CD1 3.87Å; W723-F823 HydrophobicContact CZ3-CD1 3.87Å; W723-F823 AromaticContact CZ3-CE1 3.68Å; W723-F823 HydrophobicContact CZ3-CE1 3.68Å; W723-M824 HydrophobicContact CD2-CE 4.28Å; W723-M824 HydrophobicContact CD2-CG 4.16Å; W723-M824 HydrophobicContact CE3-CG 3.68Å; W723-M824 HydrophobicContact CE3-SD 4.33Å; W723-M824 HydrophobicContact CH2-CB 4.03Å; W723-M824 HydrophobicContact CH2-CG 3.58Å; W723-M824 HydrophobicContact CZ2-CB 4.24Å; W723-M824 HydrophobicContact CZ2-CG 4.04Å; W723-M824 HydrophobicContact CZ3-CB 4.33Å; W723-M824 HydrophobicContact CZ3-CG 3.39Å; W723-M828 HydrophobicContact CZ2-CG 4.18Å
724	S	92.5	Very high	87.6	Confident	36 Å²	36	60.2 Å²	60.2	25%	0.252	30%	0.296	S	S	.	.	H	α-helix	trans	-63.4	-38.3	-178	-176.3	0	0	0	0	111.8	F720 R721 S728	F720-S724 WeakPolarHBondContact O-CB 3.48Å; F720-S724 PolarHBondContact O-N 3.11Å; R721-S724 PolarHBondContact O-N 3.45Å; S724-S728 WeakPolarHBondContact O-CB 3.38Å; S724-S728 PolarHBondContact O-N 3.36Å; S724-S728 PolarHBondContact O-OG 2.88Å
725	D	91.2	Very high	85.7	Confident	61 Å²	61	62 Å²	62	33%	0.326	31%	0.311	S	S	.	.	H	α-helix	trans	-66.9	-47.4	174.3	-178	62.3	0	0	0	111.3	R721 D722 W723 F727 S728 N729 K730	R721-D725 WeakPolarHBondContact O-CB 3.31Å; R721-D725 PolarHBondContact O-N 2.72Å; D722-D725 PolarHBondContact O-N 2.96Å; W723-D725 VanDerWaalsContact C-N 3.32Å; W723-D725 PolarHBondContact O-N 3.08Å; D725-F727 VanDerWaalsContact C-N 3.33Å; D725-F727 PolarHBondContact O-N 3.47Å; D725-S728 PolarHBondContact O-N 2.82Å; D725-N729 WeakPolarHBondContact O-CB 3.46Å; D725-N729 PolarHBondContact O-N 3.41Å; D725-N729 PolarHBondContact OD1-ND2 3.31Å; D725-K730 PolarHBondContact O-N 3.33Å; D725-K730 WeakPolarHBondContact OD2-CE 3.5Å; D725-K730 IonicContact OD2-NZ 3.77Å
726	M	88.8	Confident	83.9	Confident	12 Å²	12	65.4 Å²	65.4	6%	0.059	32%	0.324	C	S	.	.	H	α-helix	trans	-57.7	-45.5	174.5	-71.7	-66.2	-45.9	0	0	111.7	D722 W723 K730 W764 D767 Y771	D722-M726 WeakPolarHBondContact O-CB 3.37Å; D722-M726 WeakPolarHBondContact O-CG 3.29Å; D722-M726 PolarHBondContact O-N 3.43Å; W723-M726 PolarHBondContact O-N 3.39Å; M726-K730 HydrophobicContact CE-CB 4.37Å; M726-K730 HydrophobicContact CE-CD 4.07Å; M726-K730 HydrophobicContact SD-CD 3.46Å; M726-K730 WeakPolarHBondContact SD-CD 3.4Å; M726-K730 VanDerWaalsContact SD-CE 3.59Å; M726-K730 HydrophobicContact SD-CG 4.34Å; M726-K730 PolarHBondContact SD-NZ 2.8Å; M726-W764 PolarHBondContact O-NE1 3.3Å; M726-D767 HydrophobicContact CE-CB 3.69Å; M726-Y771 HydrophobicContact CB-CD2 4.35Å; M726-Y771 HydrophobicContact CE-CD2 4.49Å; M726-Y771 HydrophobicContact CE-CE2 4.27Å; M726-Y771 HydrophobicContact CG-CD1 4.45Å; M726-Y771 HydrophobicContact CG-CD2 3.6Å; M726-Y771 HydrophobicContact CG-CE1 4.49Å; M726-Y771 HydrophobicContact CG-CE2 3.68Å; M726-Y771 HydrophobicContact CG-CG 4.03Å; M726-Y771 HydrophobicContact SD-CD2 4.31Å; M726-Y771 HydrophobicContact SD-CE2 3.87Å
727	F	89.3	Confident	81.7	Confident	43 Å²	43	70.1 Å²	70.1	19%	0.189	36%	0.356	C	S	.	.	H	α-helix	trans	-68.6	-41.4	-178.3	-177.9	-98.9	0	0	0	112.8	W723 D725 W764 T768 M828	W723-F727 HydrophobicContact CZ2-CB 4.42Å; W723-F727 HydrophobicContact CZ2-CD2 4.33Å; W723-F727 HydrophobicContact CZ2-CG 4.22Å; W723-F727 VanDerWaalsContact O-CB 3.27Å; W723-F727 WeakPolarHBondContact O-CB 3.49Å; W723-F727 PolarHBondContact O-N 3.1Å; D725-F727 VanDerWaalsContact C-N 3.33Å; D725-F727 PolarHBondContact O-N 3.47Å; F727-W764 HydrophobicContact CD2-CH2 4.4Å; F727-W764 HydrophobicContact CD2-CZ2 4.08Å; F727-W764 HydrophobicContact CE2-CH2 4.46Å; F727-T768 HydrophobicContact CB-CG2 4.35Å; F727-T768 HydrophobicContact CD2-CG2 3.88Å; F727-M828 HydrophobicContact CD2-SD 4.24Å; F727-M828 HydrophobicContact CE2-SD 4.19Å
728	S	84.9	Confident	79.4	Confident	68 Å²	68	71.6 Å²	71.6	48%	0.476	37%	0.374	S	S	.	.	H	α-helix	trans	-90.8	-47.3	-171.9	-51	0	0	0	0	112.9	S724 D725	S724-S728 WeakPolarHBondContact O-CB 3.38Å; S724-S728 PolarHBondContact O-N 3.36Å; S724-S728 PolarHBondContact O-OG 2.88Å; D725-S728 PolarHBondContact O-N 2.82Å
729	N	82	Confident	77.3	Confident	125 Å²	125	76.3 Å²	76.3	67%	0.668	40%	0.402	S	S	*	.	H	α-helix	trans	-99	-24.6	-166.9	-64.2	-30.3	0	0	0	113.3	D725	D725-N729 WeakPolarHBondContact O-CB 3.46Å; D725-N729 PolarHBondContact O-N 3.41Å; D725-N729 PolarHBondContact OD1-ND2 3.31Å
730	K	81.5	Confident	75.1	Confident	108 Å²	108	81.3 Å²	81.3	47%	0.47	43%	0.431	S	S	.	.	S	Bend	trans	-101.6	9.5	-176.8	-52	-161.9	-157.6	161.5	0	114.1	D725 M726 P732	D725-K730 PolarHBondContact O-N 3.33Å; D725-K730 WeakPolarHBondContact OD2-CE 3.5Å; D725-K730 IonicContact OD2-NZ 3.77Å; M726-K730 HydrophobicContact CE-CB 4.37Å; M726-K730 HydrophobicContact CE-CD 4.07Å; M726-K730 HydrophobicContact SD-CD 3.46Å; M726-K730 WeakPolarHBondContact SD-CD 3.4Å; M726-K730 VanDerWaalsContact SD-CE 3.59Å; M726-K730 HydrophobicContact SD-CG 4.34Å; M726-K730 PolarHBondContact SD-NZ 2.8Å; K730-P732 WeakPolarHBondContact O-CD 3.41Å
731	K	83.9	Confident	73.1	Confident	86 Å²	86	89.4 Å²	89.4	37%	0.374	46%	0.462	S	S	.	.	P	Polyproline II helix	trans	-71	120.9	179.3	-172.8	173.5	-175.7	173.7	0	111	W764	K731-W764 HydrophobicContact CB-CD2 4.46Å; K731-W764 HydrophobicContact CB-CZ2 3.89Å; K731-W764 HydrophobicContact CD-CH2 3.91Å; K731-W764 HydrophobicContact CD-CZ2 3.81Å; K731-W764 HydrophobicContact CG-CD2 4.24Å; K731-W764 HydrophobicContact CG-CE3 4.46Å; K731-W764 HydrophobicContact CG-CH2 4Å; K731-W764 HydrophobicContact CG-CZ2 3.7Å; K731-W764 HydrophobicContact CG-CZ3 4.36Å
732	P	79.4	Confident	71.3	Confident	27 Å²	27	89.9 Å²	89.9	18%	0.175	47%	0.472	C	S	.	.	P	Polyproline II helix	trans	-64	149.1	177.1	-22.6	34.7	0	0	0	112.5	K730 R734 A760 M761 W764	K730-P732 WeakPolarHBondContact O-CD 3.41Å; P732-R734 PolarHBondContact O-N 2.99Å; P732-A760 HydrophobicContact CB-CB 4.34Å; P732-A760 HydrophobicContact CG-CB 3.98Å; P732-M761 HydrophobicContact CB-SD 4.43Å; P732-M761 HydrophobicContact CG-SD 4.39Å; P732-W764 HydrophobicContact CG-CB 4.01Å; P732-W764 HydrophobicContact CG-CG 4.45Å
733	E	70.3	Confident	69.7	Low	158 Å²	158	91.6 Å²	91.6	74%	0.738	50%	0.496	S	S	*	.	P	Polyproline II helix	trans	-61.2	135.6	176.1	-68.8	-174.5	166.2	0	0	111.7	R757	E733-R757 WeakPolarHBondContact O-CD 3.43Å
734	R	62.2	Low	68.3	Low	152 Å²	152	95 Å²	95	57%	0.574	53%	0.531	S	S	*	.	P	Polyproline II helix	trans	-69.5	141.9	174.9	-77.2	-175.3	175.7	170.3	-0.1	110	P732 E736 C737	P732-R734 PolarHBondContact O-N 2.99Å; R734-E736 PolarHBondContact O-N 3.32Å; R734-C737 PolarHBondContact O-N 3.28Å
735	A	53.5	Low	67.1	Low	45 Å²	45	97.3 Å²	97.3	37%	0.372	54%	0.539	S	S	.	.	G	3₁₀ helix	trans	-49.6	-29.8	174.7	0	0	0	0	0	113.6	C737 S738 R757	A735-C737 PolarHBondContact O-N 2.66Å; A735-S738 PolarHBondContact O-N 3.45Å; A735-R757 VanDerWaalsContact CB-NH2 3.3Å
736	E	53.7	Low	66.3	Low	158 Å²	158	98 Å²	98	74%	0.738	55%	0.547	S	S	*	.	G	3₁₀ helix	trans	-67.2	-18.4	-179.3	-64.5	172.2	175.5	0	0	113.6	R734	R734-E736 PolarHBondContact O-N 3.32Å
737	C	46.7	Very low	65.7	Low	101 Å²	101	102.2 Å²	102.2	68%	0.682	57%	0.574	S	S	*	*	G	3₁₀ helix	trans	-88	-11.2	179	-88.8	0	0	0	0	114.5	R734 A735 T739	R734-C737 PolarHBondContact O-N 3.28Å; A735-C737 PolarHBondContact O-N 2.66Å; C737-T739 VanDerWaalsContact C-N 3.29Å; C737-T739 PolarHBondContact O-N 3.5Å
738	S	46.7	Very low	65.1	Low	86 Å²	86	103.9 Å²	103.9	60%	0.601	59%	0.591	S	S	*	*			trans	-91.4	61.2	176.1	-166	0	0	0	0	110.8	A735 V740	A735-S738 PolarHBondContact O-N 3.45Å; S738-V740 PolarHBondContact O-N 3.08Å
739	T	46.7	Very low	64.7	Low	127 Å²	127	105.4 Å²	105.4	78%	0.779	59%	0.591	S	S	*	*			trans	-82.8	5.5	170.6	49.8	0	0	0	0	113	C737 Y741	C737-T739 VanDerWaalsContact C-N 3.29Å; C737-T739 PolarHBondContact O-N 3.5Å; T739-Y741 PolarHBondContact O-N 3.17Å
740	V	49.5	Very low	64.2	Low	116 Å²	116	105.2 Å²	105.2	70%	0.703	58%	0.581	S	S	*	*			trans	-96.7	90	170.7	-171.8	0	0	0	0	107.7	S738 D742	S738-V740 PolarHBondContact O-N 3.08Å; V740-D742 PolarHBondContact O-N 3.28Å
741	Y	51.3	Low	64.1	Low	195 Å²	195	104.8 Å²	104.8	77%	0.765	58%	0.581	S	S	*	*			trans	-58.1	102.7	164.7	-122	-87.3	0	0	0	107.7	T739 A743	T739-Y741 PolarHBondContact O-N 3.17Å; Y741-A743 VanDerWaalsContact C-N 3.33Å; Y741-A743 PolarHBondContact O-N 3.33Å
742	D	55.2	Low	64.1	Low	113 Å²	113	104.3 Å²	104.3	60%	0.604	58%	0.58	S	S	*	*			trans	-71.8	94.3	173	-149.6	1.6	0	0	0	106.8	V740 G744 M745	V740-D742 PolarHBondContact O-N 3.28Å; D742-G744 PolarHBondContact O-N 3.08Å; D742-M745 PolarHBondContact O-N 3.22Å
743	A	60.1	Low	64.1	Low	106 Å²	106	105.5 Å²	105.5	88%	0.876	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.9	-2.3	-168	0	0	0	0	0	114.3	Y741	Y741-A743 VanDerWaalsContact C-N 3.33Å; Y741-A743 PolarHBondContact O-N 3.33Å
744	G	64.3	Low	64.6	Low	71 Å²	71	100.8 Å²	100.8	73%	0.732	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.9	-6.8	172.5	0	0	0	0	0	115.7	D742 P746	D742-G744 PolarHBondContact O-N 3.08Å; G744-P746 WeakPolarHBondContact O-CD 3.38Å
745	M	67	Low	65.6	Low	86 Å²	86	99.9 Å²	99.9	42%	0.424	56%	0.562	S	S	.	*	S	Bend	trans	-84.5	123.6	-176.9	-113.4	-151.5	-86.6	0	0	112.5	D742 M749	D742-M745 PolarHBondContact O-N 3.22Å; M745-M749 HydrophobicContact CG-CB 4.27Å; M745-M749 HydrophobicContact SD-CB 3.88Å
746	P	74.8	Confident	67.1	Low	74 Å²	74	102.4 Å²	102.4	48%	0.481	57%	0.565	S	S	.	*			trans	-58.7	142.7	172.5	-22.8	32.8	0	0	0	112	G744 S748 M749 W750	G744-P746 WeakPolarHBondContact O-CD 3.38Å; P746-S748 PolarHBondContact O-N 3.46Å; P746-M749 HydrophobicContact CB-CG 4.27Å; P746-M749 HydrophobicContact CG-CG 4.19Å; P746-M749 WeakPolarHBondContact O-CA 3.41Å; P746-M749 WeakPolarHBondContact O-CB 3.37Å; P746-M749 PolarHBondContact O-N 3.1Å; P746-W750 PolarHBondContact O-N 2.97Å; P746-W750 VanDerWaalsContact O-N 3.11Å
747	T	76.3	Confident	68.4	Low	102 Å²	102	97.9 Å²	97.9	63%	0.626	54%	0.542	S	S	*	.	H	α-helix	trans	-52.2	-33.3	178.9	-48.5	0	0	0	0	113.4	W750 Q751	T747-W750 PolarHBondContact O-N 3.47Å; T747-Q751 WeakPolarHBondContact O-CG 3.49Å; T747-Q751 PolarHBondContact O-N 3.43Å
748	S	77.5	Confident	70.2	Confident	78 Å²	78	95.7 Å²	95.7	55%	0.545	53%	0.527	S	S	.	.	H	α-helix	trans	-64.6	-40.2	175.3	55.2	0	0	0	0	112.8	P746 Q751 Q752	P746-S748 PolarHBondContact O-N 3.46Å; S748-Q751 PolarHBondContact O-N 3.49Å; S748-Q752 WeakPolarHBondContact O-CB 3.48Å; S748-Q752 PolarHBondContact O-N 3.3Å
749	M	75.2	Confident	72.2	Confident	99 Å²	99	96 Å²	96	49%	0.488	52%	0.519	S	S	.	.	H	α-helix	trans	-68.3	-39.1	176.1	-66.9	-66	-65.9	0	0	110.9	M745 P746 Q752 T753	M745-M749 HydrophobicContact CG-CB 4.27Å; M745-M749 HydrophobicContact SD-CB 3.88Å; P746-M749 HydrophobicContact CB-CG 4.27Å; P746-M749 HydrophobicContact CG-CG 4.19Å; P746-M749 WeakPolarHBondContact O-CA 3.41Å; P746-M749 WeakPolarHBondContact O-CB 3.37Å; P746-M749 PolarHBondContact O-N 3.1Å; M749-Q752 PolarHBondContact O-N 3Å; M749-T753 WeakPolarHBondContact O-CB 3.32Å; M749-T753 WeakPolarHBondContact O-CG2 3.44Å; M749-T753 PolarHBondContact O-N 3Å; M749-T753 PolarHBondContact O-OG1 3.3Å
750	W	72.1	Confident	74.1	Confident	121 Å²	121	91.8 Å²	91.8	46%	0.458	50%	0.497	S	S	.	.	H	α-helix	trans	-62.9	-45.3	173.8	-178	86.7	0	0	0	112.2	P746 T747 Q752 T753 E754	P746-W750 PolarHBondContact O-N 2.97Å; P746-W750 VanDerWaalsContact O-N 3.11Å; T747-W750 PolarHBondContact O-N 3.47Å; W750-Q752 VanDerWaalsContact C-N 3.27Å; W750-Q752 PolarHBondContact O-N 3.47Å; W750-T753 VanDerWaalsContact CA-OG1 3.27Å; W750-T753 WeakPolarHBondContact CA-OG1 3.39Å; W750-T753 PolarHBondContact O-N 2.68Å; W750-T753 PolarHBondContact O-OG1 2.88Å; W750-E754 HydrophobicContact CH2-CG 4.48Å; W750-E754 WeakPolarHBondContact O-CB 3.38Å; W750-E754 PolarHBondContact O-N 2.89Å
751	Q	80.8	Confident	75.9	Confident	99 Å²	99	88.2 Å²	88.2	46%	0.463	47%	0.474	S	S	.	.	H	α-helix	trans	-65.3	-32.1	176.7	-74.1	179.4	-10.4	0	0	113	T747 S748 R755	T747-Q751 WeakPolarHBondContact O-CG 3.49Å; T747-Q751 PolarHBondContact O-N 3.43Å; S748-Q751 PolarHBondContact O-N 3.49Å; Q751-R755 WeakPolarHBondContact O-CB 3.27Å; Q751-R755 PolarHBondContact O-N 2.86Å; Q751-R755 VanDerWaalsContact O-N 3.14Å
752	Q	82.1	Confident	77.6	Confident	76 Å²	76	85 Å²	85	36%	0.355	47%	0.465	S	S	.	.	H	α-helix	trans	-72.2	-46.7	176.7	-177.2	63	19.3	0	0	110.9	S748 M749 W750 E754 R755 E756	S748-Q752 WeakPolarHBondContact O-CB 3.48Å; S748-Q752 PolarHBondContact O-N 3.3Å; M749-Q752 PolarHBondContact O-N 3Å; W750-Q752 VanDerWaalsContact C-N 3.27Å; W750-Q752 PolarHBondContact O-N 3.47Å; Q752-E754 VanDerWaalsContact C-N 3.33Å; Q752-E754 PolarHBondContact O-N 3.4Å; Q752-R755 WeakPolarHBondContact O-CB 3.25Å; Q752-R755 PolarHBondContact O-N 3.46Å; Q752-R755 VanDerWaalsContact OE1-NH1 3.15Å; Q752-E756 WeakPolarHBondContact CG-OE1 3.1Å; Q752-E756 PolarHBondContact NE2-OE1 3.28Å; Q752-E756 WeakPolarHBondContact O-CB 3.47Å; Q752-E756 WeakPolarHBondContact O-CG 3.4Å; Q752-E756 PolarHBondContact O-N 3.01Å
753	T	79.7	Confident	79.3	Confident	52 Å²	52	87.3 Å²	87.3	32%	0.319	47%	0.466	S	S	.	.	H	α-helix	trans	-62.1	-38.6	175.7	43.7	0	0	0	0	112	M749 W750 E756 R757	M749-T753 WeakPolarHBondContact O-CB 3.32Å; M749-T753 WeakPolarHBondContact O-CG2 3.44Å; M749-T753 PolarHBondContact O-N 3Å; M749-T753 PolarHBondContact O-OG1 3.3Å; W750-T753 VanDerWaalsContact CA-OG1 3.27Å; W750-T753 WeakPolarHBondContact CA-OG1 3.39Å; W750-T753 PolarHBondContact O-N 2.68Å; W750-T753 PolarHBondContact O-OG1 2.88Å; T753-E756 PolarHBondContact O-N 3.24Å; T753-R757 VanDerWaalsContact O-CB 3.31Å; T753-R757 WeakPolarHBondContact O-CB 3.46Å; T753-R757 PolarHBondContact O-N 2.96Å
754	E	80.4	Confident	80.8	Confident	60 Å²	60	83.2 Å²	83.2	28%	0.28	43%	0.428	S	S	.	.	H	α-helix	trans	-67.4	-38.3	175.2	-174.5	59.3	-165.6	0	0	112.4	W750 Q752 R757 S758	W750-E754 HydrophobicContact CH2-CG 4.48Å; W750-E754 WeakPolarHBondContact O-CB 3.38Å; W750-E754 PolarHBondContact O-N 2.89Å; Q752-E754 VanDerWaalsContact C-N 3.33Å; Q752-E754 PolarHBondContact O-N 3.4Å; E754-R757 PolarHBondContact O-N 3.08Å; E754-R757 IonicContact OE1-CZ 3.46Å; E754-R757 IonicContact OE1-NE 2.72Å; E754-R757 PolarHBondContact OE1-NE 2.95Å; E754-R757 IonicContact OE1-NH2 2.66Å; E754-R757 PolarHBondContact OE1-NH2 2.88Å; E754-R757 IonicContact OE2-CZ 3.67Å; E754-R757 IonicContact OE2-NE 2.95Å; E754-R757 PolarHBondContact OE2-NE 3.39Å; E754-R757 IonicContact OE2-NH2 3.64Å; E754-S758 PolarHBondContact O-N 3.28Å
755	R	83.7	Confident	82	Confident	133 Å²	133	83.6 Å²	83.6	50%	0.502	41%	0.413	S	S	.	.	H	α-helix	trans	-63.8	-45	171.6	-95.6	-175	-86	144.2	-6.4	111.9	Q751 Q752 R757 S758 Q759	Q751-R755 WeakPolarHBondContact O-CB 3.27Å; Q751-R755 PolarHBondContact O-N 2.86Å; Q751-R755 VanDerWaalsContact O-N 3.14Å; Q752-R755 WeakPolarHBondContact O-CB 3.25Å; Q752-R755 PolarHBondContact O-N 3.46Å; Q752-R755 VanDerWaalsContact OE1-NH1 3.15Å; R755-R757 VanDerWaalsContact C-N 3.31Å; R755-R757 PolarHBondContact O-N 3.29Å; R755-S758 PolarHBondContact O-N 3.36Å; R755-Q759 WeakPolarHBondContact O-CB 3.4Å; R755-Q759 WeakPolarHBondContact O-CG 3.37Å; R755-Q759 PolarHBondContact O-N 2.91Å
756	E	84.8	Confident	83.1	Confident	97 Å²	97	82 Å²	82	45%	0.453	41%	0.414	S	S	.	.	H	α-helix	trans	-61.4	-41.2	176.6	-74.8	167.8	-171.3	0	0	111.3	Q752 T753 Q759 A760	Q752-E756 WeakPolarHBondContact CG-OE1 3.1Å; Q752-E756 PolarHBondContact NE2-OE1 3.28Å; Q752-E756 WeakPolarHBondContact O-CB 3.47Å; Q752-E756 WeakPolarHBondContact O-CG 3.4Å; Q752-E756 PolarHBondContact O-N 3.01Å; T753-E756 PolarHBondContact O-N 3.24Å; E756-Q759 PolarHBondContact O-N 2.8Å; E756-A760 VanDerWaalsContact O-CB 3.26Å; E756-A760 WeakPolarHBondContact O-CB 3.47Å; E756-A760 PolarHBondContact O-N 3.24Å
757	R	81.4	Confident	83.9	Confident	64 Å²	64	82.1 Å²	82.1	24%	0.242	41%	0.41	C	S	.	.	H	α-helix	trans	-63.2	-44.6	175	-166.3	-168.3	68.3	67	9	112	E733 A735 T753 E754 R755 A760 M761	E733-R757 WeakPolarHBondContact O-CD 3.43Å; A735-R757 VanDerWaalsContact CB-NH2 3.3Å; T753-R757 VanDerWaalsContact O-CB 3.31Å; T753-R757 WeakPolarHBondContact O-CB 3.46Å; T753-R757 PolarHBondContact O-N 2.96Å; E754-R757 PolarHBondContact O-N 3.08Å; E754-R757 IonicContact OE1-CZ 3.46Å; E754-R757 IonicContact OE1-NE 2.72Å; E754-R757 PolarHBondContact OE1-NE 2.95Å; E754-R757 IonicContact OE1-NH2 2.66Å; E754-R757 PolarHBondContact OE1-NH2 2.88Å; E754-R757 IonicContact OE2-CZ 3.67Å; E754-R757 IonicContact OE2-NE 2.95Å; E754-R757 PolarHBondContact OE2-NE 3.39Å; E754-R757 IonicContact OE2-NH2 3.64Å; R755-R757 VanDerWaalsContact C-N 3.31Å; R755-R757 PolarHBondContact O-N 3.29Å; R757-A760 PolarHBondContact O-N 3.42Å; R757-M761 WeakPolarHBondContact O-CB 3.35Å; R757-M761 PolarHBondContact O-N 2.94Å
758	S	85.1	Confident	84.6	Confident	54 Å²	54	77.3 Å²	77.3	38%	0.378	38%	0.381	S	S	.	.	H	α-helix	trans	-63.1	-45.3	176.2	-167	0	0	0	0	111.7	E754 R755 M761 E762	E754-S758 PolarHBondContact O-N 3.28Å; R755-S758 PolarHBondContact O-N 3.36Å; S758-M761 PolarHBondContact O-N 3.12Å; S758-E762 PolarHBondContact O-N 2.98Å
759	Q	88.2	Confident	85.4	Confident	93 Å²	93	76.8 Å²	76.8	44%	0.435	37%	0.371	S	S	.	.	H	α-helix	trans	-64.4	-39.6	176.5	-72.6	178	6.7	0	0	112	R755 E756 M761 E762 R763	R755-Q759 WeakPolarHBondContact O-CB 3.4Å; R755-Q759 WeakPolarHBondContact O-CG 3.37Å; R755-Q759 PolarHBondContact O-N 2.91Å; E756-Q759 PolarHBondContact O-N 2.8Å; Q759-M761 VanDerWaalsContact C-N 3.33Å; Q759-E762 PolarHBondContact O-N 3Å; Q759-R763 WeakPolarHBondContact O-CB 3.28Å; Q759-R763 VanDerWaalsContact O-CG 3.31Å; Q759-R763 WeakPolarHBondContact O-CG 3.38Å; Q759-R763 PolarHBondContact O-N 2.9Å
760	A	87.3	Confident	86.2	Confident	38 Å²	38	75.5 Å²	75.5	31%	0.314	37%	0.369	S	S	.	.	H	α-helix	trans	-63	-40.4	174.4	0	0	0	0	0	111.3	P732 E756 R757 R763 W764	P732-A760 HydrophobicContact CB-CB 4.34Å; P732-A760 HydrophobicContact CG-CB 3.98Å; E756-A760 VanDerWaalsContact O-CB 3.26Å; E756-A760 WeakPolarHBondContact O-CB 3.47Å; E756-A760 PolarHBondContact O-N 3.24Å; R757-A760 PolarHBondContact O-N 3.42Å; A760-R763 PolarHBondContact O-N 3.09Å; A760-W764 VanDerWaalsContact O-CB 3.29Å; A760-W764 WeakPolarHBondContact O-CB 3.4Å; A760-W764 PolarHBondContact O-N 2.85Å
761	M	86.3	Confident	87.3	Confident	42 Å²	42	73.7 Å²	73.7	21%	0.207	36%	0.363	C	S	.	.	H	α-helix	trans	-66.1	-41.7	176.7	-166.5	71.2	-164	0	0	112.2	P732 R757 S758 Q759 W764 N765	P732-M761 HydrophobicContact CB-SD 4.43Å; P732-M761 HydrophobicContact CG-SD 4.39Å; R757-M761 WeakPolarHBondContact O-CB 3.35Å; R757-M761 PolarHBondContact O-N 2.94Å; S758-M761 PolarHBondContact O-N 3.12Å; Q759-M761 VanDerWaalsContact C-N 3.33Å; M761-W764 HydrophobicContact CE-CE3 3.49Å; M761-W764 VanDerWaalsContact CE-CE3 3.49Å; M761-W764 HydrophobicContact CE-CZ3 3.41Å; M761-W764 VanDerWaalsContact CE-CZ3 3.41Å; M761-W764 PolarHBondContact O-N 3.09Å; M761-W764 HydrophobicContact SD-CE3 4.05Å; M761-N765 WeakPolarHBondContact O-CB 3.25Å; M761-N765 VanDerWaalsContact O-CG 3.28Å; M761-N765 PolarHBondContact O-N 2.71Å; M761-N765 PolarHBondContact O-ND2 3.15Å
762	E	88.5	Confident	87.9	Confident	127 Å²	127	69 Å²	69	59%	0.593	34%	0.341	S	S	*	.	H	α-helix	trans	-62.9	-45.8	174.5	-76.7	175.5	-173.3	0	0	112	S758 Q759 N765 A766	S758-E762 PolarHBondContact O-N 2.98Å; Q759-E762 PolarHBondContact O-N 3Å; E762-N765 PolarHBondContact O-N 3.19Å; E762-A766 PolarHBondContact O-N 2.97Å
763	R	89.4	Confident	88.6	Confident	162 Å²	162	70.5 Å²	70.5	61%	0.611	35%	0.348	S	S	*	.	H	α-helix	trans	-61.1	-47.1	175	-72.6	175.6	-171.8	165.5	5.5	111.5	Q759 A760 N765 A766 D767	Q759-R763 WeakPolarHBondContact O-CB 3.28Å; Q759-R763 VanDerWaalsContact O-CG 3.31Å; Q759-R763 WeakPolarHBondContact O-CG 3.38Å; Q759-R763 PolarHBondContact O-N 2.9Å; A760-R763 PolarHBondContact O-N 3.09Å; R763-N765 VanDerWaalsContact C-N 3.33Å; R763-N765 PolarHBondContact O-N 3.18Å; R763-A766 PolarHBondContact O-N 2.85Å; R763-D767 WeakPolarHBondContact O-CB 3.3Å; R763-D767 VanDerWaalsContact O-CG 3.3Å; R763-D767 PolarHBondContact O-N 3.04Å
764	W	91.4	Very high	89.3	Confident	20 Å²	20	72 Å²	72	8%	0.076	35%	0.353	C	S	.	.	H	α-helix	trans	-58.6	-43.5	177	174.4	78.2	0	0	0	112	M726 F727 K731 P732 A760 M761 T768	M726-W764 PolarHBondContact O-NE1 3.3Å; F727-W764 HydrophobicContact CD2-CH2 4.4Å; F727-W764 HydrophobicContact CD2-CZ2 4.08Å; F727-W764 HydrophobicContact CE2-CH2 4.46Å; K731-W764 HydrophobicContact CB-CD2 4.46Å; K731-W764 HydrophobicContact CB-CZ2 3.89Å; K731-W764 HydrophobicContact CD-CH2 3.91Å; K731-W764 HydrophobicContact CD-CZ2 3.81Å; K731-W764 HydrophobicContact CG-CD2 4.24Å; K731-W764 HydrophobicContact CG-CE3 4.46Å; K731-W764 HydrophobicContact CG-CH2 4Å; K731-W764 HydrophobicContact CG-CZ2 3.7Å; K731-W764 HydrophobicContact CG-CZ3 4.36Å; P732-W764 HydrophobicContact CG-CB 4.01Å; P732-W764 HydrophobicContact CG-CG 4.45Å; A760-W764 VanDerWaalsContact O-CB 3.29Å; A760-W764 WeakPolarHBondContact O-CB 3.4Å; A760-W764 PolarHBondContact O-N 2.85Å; M761-W764 HydrophobicContact CE-CE3 3.49Å; M761-W764 VanDerWaalsContact CE-CE3 3.49Å; M761-W764 HydrophobicContact CE-CZ3 3.41Å; M761-W764 VanDerWaalsContact CE-CZ3 3.41Å; M761-W764 PolarHBondContact O-N 3.09Å; M761-W764 HydrophobicContact SD-CE3 4.05Å; W764-T768 HydrophobicContact CZ2-CG2 4.49Å; W764-T768 PolarHBondContact NE1-OG1 3.07Å; W764-T768 WeakPolarHBondContact O-CB 3.3Å; W764-T768 PolarHBondContact O-N 3.44Å; W764-T768 PolarHBondContact O-OG1 3.23Å
765	N	89.4	Confident	90	Very high	78 Å²	78	69.2 Å²	69.2	42%	0.417	34%	0.34	S	S	.	.	H	α-helix	trans	-61.4	-45.7	175.9	-76.6	-31.1	0	0	0	111.7	M761 E762 R763 L769	M761-N765 WeakPolarHBondContact O-CB 3.25Å; M761-N765 VanDerWaalsContact O-CG 3.28Å; M761-N765 PolarHBondContact O-N 2.71Å; M761-N765 PolarHBondContact O-ND2 3.15Å; E762-N765 PolarHBondContact O-N 3.19Å; R763-N765 VanDerWaalsContact C-N 3.33Å; R763-N765 PolarHBondContact O-N 3.18Å; N765-L769 WeakPolarHBondContact O-CB 3.38Å; N765-L769 PolarHBondContact O-N 3.24Å
766	A	90.9	Very high	90.5	Very high	54 Å²	54	63.8 Å²	63.8	45%	0.446	32%	0.32	S	S	.	.	H	α-helix	trans	-65.3	-45.7	180	0	0	0	0	0	112.2	E762 R763 L769 T770	E762-A766 PolarHBondContact O-N 2.97Å; R763-A766 PolarHBondContact O-N 2.85Å; A766-L769 PolarHBondContact O-N 3.14Å; A766-T770 PolarHBondContact O-N 3.42Å; A766-T770 PolarHBondContact O-OG1 2.79Å
767	D	91.6	Very high	91	Very high	75 Å²	75	64.9 Å²	64.9	40%	0.401	33%	0.329	S	S	.	.	H	α-helix	trans	-64.5	-49.8	177.4	-67.4	-17.7	0	0	0	110	M726 R763 L769 T770 Y771	M726-D767 HydrophobicContact CE-CB 3.69Å; R763-D767 WeakPolarHBondContact O-CB 3.3Å; R763-D767 VanDerWaalsContact O-CG 3.3Å; R763-D767 PolarHBondContact O-N 3.04Å; D767-L769 VanDerWaalsContact C-N 3.27Å; D767-L769 PolarHBondContact O-N 2.75Å; D767-T770 WeakPolarHBondContact O-CA 3.03Å; D767-T770 WeakPolarHBondContact O-CB 3.5Å; D767-T770 PolarHBondContact O-N 2.99Å; D767-Y771 HydrophobicContact CB-CD2 4.46Å; D767-Y771 HydrophobicContact CB-CE2 4.47Å; D767-Y771 WeakPolarHBondContact O-CD2 3.44Å; D767-Y771 PolarHBondContact O-N 2.76Å
768	T	92	Very high	91.6	Very high	2 Å²	2	63.4 Å²	63.4	1%	0.012	33%	0.327	C	S	.	.	H	α-helix	trans	-56.9	-41.4	179.2	-61.2	0	0	0	0	111.7	F727 W764 F772 M828	F727-T768 HydrophobicContact CB-CG2 4.35Å; F727-T768 HydrophobicContact CD2-CG2 3.88Å; W764-T768 HydrophobicContact CZ2-CG2 4.49Å; W764-T768 PolarHBondContact NE1-OG1 3.07Å; W764-T768 WeakPolarHBondContact O-CB 3.3Å; W764-T768 PolarHBondContact O-N 3.44Å; W764-T768 PolarHBondContact O-OG1 3.23Å; T768-F772 WeakPolarHBondContact O-CB 3.11Å; T768-F772 PolarHBondContact O-N 3.01Å; T768-M828 HydrophobicContact CG2-CE 4.08Å; T768-M828 HydrophobicContact CG2-SD 3.84Å
769	L	92.7	Very high	92	Very high	67 Å²	67	60.9 Å²	60.9	35%	0.351	31%	0.309	S	S	.	.	H	α-helix	trans	-64	-42	174.9	-176.8	63.3	0	0	0	111.6	N765 A766 D767 F772 E773 M828	N765-L769 WeakPolarHBondContact O-CB 3.38Å; N765-L769 PolarHBondContact O-N 3.24Å; A766-L769 PolarHBondContact O-N 3.14Å; D767-L769 VanDerWaalsContact C-N 3.27Å; D767-L769 PolarHBondContact O-N 2.75Å; L769-F772 HydrophobicContact CD1-CD1 4.32Å; L769-F772 WeakPolarHBondContact O-CB 3.48Å; L769-F772 PolarHBondContact O-N 2.68Å; L769-E773 HydrophobicContact CD1-CG 4.48Å; L769-E773 WeakPolarHBondContact O-CG 3.43Å; L769-E773 PolarHBondContact O-N 2.94Å; L769-M828 HydrophobicContact CD1-CE 4.23Å
770	T	93.3	Very high	92.2	Very high	71 Å²	71	60.6 Å²	60.6	44%	0.436	30%	0.304	S	S	.	.	H	α-helix	trans	-62.7	-49.3	177.8	-54.4	0	0	0	0	111.5	A766 D767 F772 E773 I774	A766-T770 PolarHBondContact O-N 3.42Å; A766-T770 PolarHBondContact O-OG1 2.79Å; D767-T770 WeakPolarHBondContact O-CA 3.03Å; D767-T770 WeakPolarHBondContact O-CB 3.5Å; D767-T770 PolarHBondContact O-N 2.99Å; T770-F772 VanDerWaalsContact C-N 3.29Å; T770-F772 PolarHBondContact O-N 2.69Å; T770-E773 PolarHBondContact O-N 3.23Å; T770-I774 HydrophobicContact CG2-CD1 4.08Å; T770-I774 VanDerWaalsContact O-CG1 3.3Å; T770-I774 WeakPolarHBondContact O-CG1 3.43Å; T770-I774 PolarHBondContact O-N 3.26Å; T770-I774 VanDerWaalsContact O-N 3.08Å
771	Y	93.8	Very high	92.4	Very high	84 Å²	84	61.8 Å²	61.8	33%	0.329	30%	0.303	S	S	.	.	H	α-helix	trans	-63	-37.3	176.2	-78.6	-82.6	0	0	0	111.8	D722 M726 D767 I774 A775	D722-Y771 HydrophobicContact CB-CD1 3.83Å; D722-Y771 HydrophobicContact CB-CE1 3.87Å; M726-Y771 HydrophobicContact CB-CD2 4.35Å; M726-Y771 HydrophobicContact CE-CD2 4.49Å; M726-Y771 HydrophobicContact CE-CE2 4.27Å; M726-Y771 HydrophobicContact CG-CD1 4.45Å; M726-Y771 HydrophobicContact CG-CD2 3.6Å; M726-Y771 HydrophobicContact CG-CE1 4.49Å; M726-Y771 HydrophobicContact CG-CE2 3.68Å; M726-Y771 HydrophobicContact CG-CG 4.03Å; M726-Y771 HydrophobicContact SD-CD2 4.31Å; M726-Y771 HydrophobicContact SD-CE2 3.87Å; D767-Y771 HydrophobicContact CB-CD2 4.46Å; D767-Y771 HydrophobicContact CB-CE2 4.47Å; D767-Y771 WeakPolarHBondContact O-CD2 3.44Å; D767-Y771 PolarHBondContact O-N 2.76Å; Y771-I774 PolarHBondContact O-N 2.9Å; Y771-A775 VanDerWaalsContact O-CB 3.27Å; Y771-A775 WeakPolarHBondContact O-CB 3.45Å; Y771-A775 PolarHBondContact O-N 3.4Å
772	F	95.1	Very high	92.7	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-61.1	-48.6	174.9	168.7	-91.3	0	0	0	111.3	W723 T768 L769 T770 I774 A775 E776 M824 Y825 M828	W723-F772 VanDerWaalsContact CD1-CA 3.47Å; W723-F772 AromaticContact NE1-CD2 3.99Å; T768-F772 WeakPolarHBondContact O-CB 3.11Å; T768-F772 PolarHBondContact O-N 3.01Å; L769-F772 HydrophobicContact CD1-CD1 4.32Å; L769-F772 WeakPolarHBondContact O-CB 3.48Å; L769-F772 PolarHBondContact O-N 2.68Å; T770-F772 VanDerWaalsContact C-N 3.29Å; T770-F772 PolarHBondContact O-N 2.69Å; F772-I774 VanDerWaalsContact C-N 3.33Å; F772-I774 PolarHBondContact O-N 3.38Å; F772-A775 PolarHBondContact O-N 3.23Å; F772-E776 HydrophobicContact CE1-CB 4.41Å; F772-E776 WeakPolarHBondContact CE1-OE2 3.49Å; F772-E776 HydrophobicContact CZ-CB 4.44Å; F772-E776 WeakPolarHBondContact O-CB 3.37Å; F772-E776 PolarHBondContact O-N 2.56Å; F772-M824 HydrophobicContact CD2-CB 4.13Å; F772-M824 HydrophobicContact CD2-CE 3.51Å; F772-M824 HydrophobicContact CE2-CB 3.8Å; F772-M824 HydrophobicContact CE2-CE 3.89Å; F772-M824 HydrophobicContact CG-CE 4.27Å; F772-Y825 HydrophobicContact CE2-CD1 4.02Å; F772-Y825 HydrophobicContact CE2-CE1 4.31Å; F772-Y825 AromaticContact CZ-CD1 3.69Å; F772-Y825 HydrophobicContact CZ-CD1 3.69Å; F772-Y825 AromaticContact CZ-CE1 3.73Å; F772-Y825 HydrophobicContact CZ-CE1 3.73Å; F772-M828 HydrophobicContact CB-CE 4.2Å; F772-M828 HydrophobicContact CD2-CB 4.19Å; F772-M828 HydrophobicContact CD2-CG 3.46Å; F772-M828 VanDerWaalsContact CD2-CG 3.46Å; F772-M828 HydrophobicContact CE2-CB 4.03Å; F772-M828 HydrophobicContact CE2-CG 3.78Å; F772-M828 HydrophobicContact CG-CE 4.26Å; F772-M828 HydrophobicContact CG-CG 3.99Å
773	E	94.8	Very high	92.8	Very high	107 Å²	107	54.4 Å²	54.4	50%	0.5	27%	0.268	S	S	.	.	H	α-helix	trans	-63	-38.9	179.9	-73.7	175.8	174.3	0	0	111.9	L769 T770 L777	L769-E773 HydrophobicContact CD1-CG 4.48Å; L769-E773 WeakPolarHBondContact O-CG 3.43Å; L769-E773 PolarHBondContact O-N 2.94Å; T770-E773 PolarHBondContact O-N 3.23Å; E773-L777 VanDerWaalsContact O-CB 3.23Å; E773-L777 WeakPolarHBondContact O-CB 3.41Å; E773-L777 PolarHBondContact O-N 3.41Å
774	I	94.8	Very high	92.6	Very high	85 Å²	85	51.5 Å²	51.5	44%	0.436	26%	0.264	S	S	.	.	H	α-helix	trans	-66.2	-48.9	176	-64.9	165.8	0	0	0	110.9	A719 T770 Y771 F772 E776 L777 T778	A719-I774 HydrophobicContact CB-CG2 4.15Å; T770-I774 HydrophobicContact CG2-CD1 4.08Å; T770-I774 VanDerWaalsContact O-CG1 3.3Å; T770-I774 WeakPolarHBondContact O-CG1 3.43Å; T770-I774 PolarHBondContact O-N 3.26Å; T770-I774 VanDerWaalsContact O-N 3.08Å; Y771-I774 PolarHBondContact O-N 2.9Å; F772-I774 VanDerWaalsContact C-N 3.33Å; F772-I774 PolarHBondContact O-N 3.38Å; I774-E776 VanDerWaalsContact C-N 3.35Å; I774-L777 PolarHBondContact O-N 3.18Å; I774-T778 WeakPolarHBondContact O-CB 3.39Å; I774-T778 WeakPolarHBondContact O-CG2 3.32Å; I774-T778 PolarHBondContact O-N 3.32Å; I774-T778 PolarHBondContact O-OG1 3.08Å
775	A	95.5	Very high	92	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-64.3	-40.9	179	0	0	0	0	0	111.4	A719 W723 Y771 F772 T778 M779 M824	A719-A775 HydrophobicContact CB-CB 4.07Å; W723-A775 HydrophobicContact CB-CB 4.23Å; Y771-A775 VanDerWaalsContact O-CB 3.27Å; Y771-A775 WeakPolarHBondContact O-CB 3.45Å; Y771-A775 PolarHBondContact O-N 3.4Å; F772-A775 PolarHBondContact O-N 3.23Å; A775-T778 PolarHBondContact O-OG1 3.26Å; A775-T778 VanDerWaalsContact O-OG1 3.06Å; A775-M779 VanDerWaalsContact O-CB 3.29Å; A775-M779 WeakPolarHBondContact O-CB 3.28Å; A775-M779 VanDerWaalsContact O-CG 3.29Å; A775-M779 WeakPolarHBondContact O-CG 3.08Å; A775-M779 PolarHBondContact O-N 3.15Å; A775-M824 HydrophobicContact CB-CE 3.51Å; A775-M824 HydrophobicContact CB-SD 4.2Å
776	E	95	Very high	91.1	Very high	19 Å²	19	52.2 Å²	52.2	9%	0.089	28%	0.278	C	S	.	.	H	α-helix	trans	-61.2	-52.2	175.8	178.8	-173.7	-170.1	0	0	110.9	F772 I774 T778 M779 R780 L821 M824 Y825 K833	F772-E776 HydrophobicContact CE1-CB 4.41Å; F772-E776 WeakPolarHBondContact CE1-OE2 3.49Å; F772-E776 HydrophobicContact CZ-CB 4.44Å; F772-E776 WeakPolarHBondContact O-CB 3.37Å; F772-E776 PolarHBondContact O-N 2.56Å; I774-E776 VanDerWaalsContact C-N 3.35Å; E776-T778 VanDerWaalsContact C-N 3.34Å; E776-T778 PolarHBondContact O-N 3Å; E776-M779 PolarHBondContact O-N 3.42Å; E776-R780 HydrophobicContact CG-CG 4.25Å; E776-R780 WeakPolarHBondContact O-CB 3.35Å; E776-R780 VanDerWaalsContact O-CG 3.31Å; E776-R780 WeakPolarHBondContact O-CG 3.47Å; E776-R780 PolarHBondContact O-N 3.49Å; E776-L821 HydrophobicContact CG-CD2 4.33Å; E776-M824 HydrophobicContact CB-CE 4.37Å; E776-Y825 HydrophobicContact CG-CE1 3.97Å; E776-Y825 WeakPolarHBondContact CG-OH 3.49Å; E776-Y825 VanDerWaalsContact OE1-CE1 3.32Å; E776-Y825 WeakPolarHBondContact OE1-CE1 3.24Å; E776-Y825 PolarHBondContact OE1-OH 2.89Å; E776-K833 VanDerWaalsContact CD-NZ 3.25Å; E776-K833 VanDerWaalsContact OE1-CD 3.27Å; E776-K833 WeakPolarHBondContact OE1-CD 3.45Å; E776-K833 IonicContact OE1-NZ 3.02Å; E776-K833 PolarHBondContact OE1-NZ 2.89Å; E776-K833 IonicContact OE2-NZ 2.71Å; E776-K833 PolarHBondContact OE2-NZ 3.31Å
777	L	94	Very high	90.2	Very high	121 Å²	121	55.4 Å²	55.4	63%	0.634	29%	0.287	S	S	*	.	H	α-helix	trans	-57.6	-49.6	-178	-177.7	74.1	0	0	0	110.9	E773 I774 R780 Q781	E773-L777 VanDerWaalsContact O-CB 3.23Å; E773-L777 WeakPolarHBondContact O-CB 3.41Å; E773-L777 PolarHBondContact O-N 3.41Å; I774-L777 PolarHBondContact O-N 3.18Å; L777-R780 PolarHBondContact O-N 3.27Å; L777-Q781 WeakPolarHBondContact O-CB 3.15Å; L777-Q781 PolarHBondContact O-N 3.37Å
778	T	93.8	Very high	89.7	Confident	32 Å²	32	54.1 Å²	54.1	20%	0.196	29%	0.292	C	S	.	.	H	α-helix	trans	-66.4	-38	-178.1	52.3	0	0	0	0	112.5	I774 A775 E776 Q781 I782	I774-T778 WeakPolarHBondContact O-CB 3.39Å; I774-T778 WeakPolarHBondContact O-CG2 3.32Å; I774-T778 PolarHBondContact O-N 3.32Å; I774-T778 PolarHBondContact O-OG1 3.08Å; A775-T778 PolarHBondContact O-OG1 3.26Å; A775-T778 VanDerWaalsContact O-OG1 3.06Å; E776-T778 VanDerWaalsContact C-N 3.34Å; E776-T778 PolarHBondContact O-N 3Å; T778-Q781 WeakPolarHBondContact O-CB 3.36Å; T778-I782 PolarHBondContact O-N 3Å
779	M	94.2	Very high	89.4	Confident	2 Å²	2	57.6 Å²	57.6	1%	0.01	31%	0.308	C	S	.	.	H	α-helix	trans	-70.2	-43.5	174.9	-78.6	-161.1	-167.7	0	0	113.4	A716 F720 A775 E776 Q781 I782 L783 V817 M820 L821 M824	A716-M779 HydrophobicContact CB-CG 4.19Å; F720-M779 HydrophobicContact CB-CE 3.24Å; F720-M779 HydrophobicContact CD1-CE 4.39Å; F720-M779 HydrophobicContact CD2-CE 3.33Å; F720-M779 HydrophobicContact CE2-CE 4.3Å; F720-M779 HydrophobicContact CG-CE 3.37Å; A775-M779 VanDerWaalsContact O-CB 3.29Å; A775-M779 WeakPolarHBondContact O-CB 3.28Å; A775-M779 VanDerWaalsContact O-CG 3.29Å; A775-M779 WeakPolarHBondContact O-CG 3.08Å; A775-M779 PolarHBondContact O-N 3.15Å; E776-M779 PolarHBondContact O-N 3.42Å; M779-Q781 PolarHBondContact O-N 3.13Å; M779-I782 WeakPolarHBondContact O-CB 3.34Å; M779-I782 PolarHBondContact O-N 3.49Å; M779-I782 VanDerWaalsContact O-N 3.15Å; M779-L783 PolarHBondContact O-N 3.25Å; M779-V817 HydrophobicContact CB-CG1 3.84Å; M779-V817 HydrophobicContact CG-CG1 4.08Å; M779-V817 HydrophobicContact SD-CG1 4.19Å; M779-M820 HydrophobicContact CE-CB 3.7Å; M779-M820 HydrophobicContact CE-CG 4.35Å; M779-M820 HydrophobicContact CE-SD 3.86Å; M779-M820 HydrophobicContact SD-CB 3.73Å; M779-L821 HydrophobicContact CB-CD1 4Å; M779-L821 HydrophobicContact CB-CD2 3.66Å; M779-L821 HydrophobicContact CB-CG 3.78Å; M779-L821 HydrophobicContact CG-CD2 4.43Å; M779-L821 HydrophobicContact CG-CG 4.48Å; M779-L821 HydrophobicContact SD-CD2 4.01Å; M779-L821 HydrophobicContact SD-CG 3.79Å; M779-M824 HydrophobicContact CE-SD 4.18Å; M779-M824 HydrophobicContact SD-SD 4.17Å
780	R	92.5	Very high	89.4	Confident	86 Å²	86	54.9 Å²	54.9	33%	0.325	29%	0.293	S	S	.	.	H	α-helix	trans	-62.6	-35.2	176.8	-73.8	-172.1	73.9	-139.4	-1.2	111.4	E776 L777 I782 L783 I784 L821 Y825	E776-R780 HydrophobicContact CG-CG 4.25Å; E776-R780 WeakPolarHBondContact O-CB 3.35Å; E776-R780 VanDerWaalsContact O-CG 3.31Å; E776-R780 WeakPolarHBondContact O-CG 3.47Å; E776-R780 PolarHBondContact O-N 3.49Å; L777-R780 PolarHBondContact O-N 3.27Å; R780-I782 VanDerWaalsContact C-N 3.26Å; R780-I782 PolarHBondContact O-N 3.1Å; R780-L783 PolarHBondContact O-N 3.28Å; R780-L783 VanDerWaalsContact O-N 3.15Å; R780-I784 HydrophobicContact CB-CD1 4.46Å; R780-I784 WeakPolarHBondContact O-CG1 3.14Å; R780-I784 PolarHBondContact O-N 2.86Å; R780-L821 HydrophobicContact CG-CD1 4.07Å; R780-L821 HydrophobicContact CG-CD2 4.3Å; R780-Y825 WeakPolarHBondContact CD-OH 3.45Å
781	Q	90.7	Very high	89.3	Confident	63 Å²	63	51.8 Å²	51.8	29%	0.294	27%	0.274	S	S	.	.	H	α-helix	trans	-58.3	-37.7	175.3	-171.4	178	-24.8	0	0	112.4	E712 L777 T778 M779 G785 T786	E712-Q781 PolarHBondContact OE1-NE2 2.85Å; L777-Q781 WeakPolarHBondContact O-CB 3.15Å; L777-Q781 PolarHBondContact O-N 3.37Å; T778-Q781 WeakPolarHBondContact O-CB 3.36Å; M779-Q781 PolarHBondContact O-N 3.13Å; Q781-G785 WeakPolarHBondContact O-CA 3.11Å; Q781-G785 PolarHBondContact O-N 2.96Å; Q781-T786 HydrophobicContact CG-CG2 3.45Å; Q781-T786 VanDerWaalsContact CG-CG2 3.45Å
782	I	92.5	Very high	89.2	Confident	3 Å²	3	50.3 Å²	50.3	2%	0.015	27%	0.274	C	S	.	.	H	α-helix	trans	-65.1	-39.4	176.7	-65.9	162.3	0	0	0	111.5	Y713 A716 T778 M779 R780 W790 V817	Y713-I782 HydrophobicContact CD2-CD1 3.93Å; Y713-I782 HydrophobicContact CD2-CG2 4.42Å; A716-I782 HydrophobicContact CB-CD1 3.36Å; T778-I782 PolarHBondContact O-N 3Å; M779-I782 WeakPolarHBondContact O-CB 3.34Å; M779-I782 PolarHBondContact O-N 3.49Å; M779-I782 VanDerWaalsContact O-N 3.15Å; R780-I782 VanDerWaalsContact C-N 3.26Å; R780-I782 PolarHBondContact O-N 3.1Å; I782-W790 HydrophobicContact CG2-CD2 4.1Å; I782-W790 HydrophobicContact CG2-CG 4.03Å; I782-V817 HydrophobicContact CD1-CG2 4.33Å; I782-V817 HydrophobicContact CG2-CG2 4.48Å
783	L	90.9	Very high	89	Confident	11 Å²	11	52 Å²	52	6%	0.058	28%	0.283	C	S	.	.	H	α-helix	trans	-75.1	-39.3	-178.7	-62.1	-178.8	0	0	0	112.5	M779 R780 I814 V817 L821 L837 V840 L848	M779-L783 PolarHBondContact O-N 3.25Å; R780-L783 PolarHBondContact O-N 3.28Å; R780-L783 VanDerWaalsContact O-N 3.15Å; L783-I814 HydrophobicContact CD2-CG2 3.9Å; L783-V817 HydrophobicContact CD1-CG1 4.3Å; L783-V817 HydrophobicContact CD2-CB 4.43Å; L783-V817 HydrophobicContact CD2-CG1 4.1Å; L783-V817 HydrophobicContact CG-CG1 4Å; L783-L821 HydrophobicContact CD1-CD1 3.65Å; L783-L837 HydrophobicContact CD1-CD1 3.39Å; L783-V840 HydrophobicContact CB-CG1 4.08Å; L783-L848 HydrophobicContact CB-CD1 4.27Å; L783-L848 HydrophobicContact CD2-CD1 4.4Å
784	I	86.4	Confident	88.8	Confident	102 Å²	102	49.7 Å²	49.7	52%	0.523	28%	0.282	S	S	.	.	H	α-helix	trans	-78.3	-34.8	-178	-63.1	168.3	0	0	0	110.9	R780 V840	R780-I784 HydrophobicContact CB-CD1 4.46Å; R780-I784 WeakPolarHBondContact O-CG1 3.14Å; R780-I784 PolarHBondContact O-N 2.86Å; I784-V840 HydrophobicContact CG1-CG1 4.25Å
785	G	78.3	Confident	88.5	Confident	22 Å²	22	48.7 Å²	48.7	23%	0.227	28%	0.275	C	S	.	.			trans	75.5	133.4	-170.9	0	0	0	0	0	111.8	Q781 G788	Q781-G785 WeakPolarHBondContact O-CA 3.11Å; Q781-G785 PolarHBondContact O-N 2.96Å; G785-G788 WeakPolarHBondContact CA-O 3.5Å
786	T	71.2	Confident	88.1	Confident	91 Å²	91	58.1 Å²	58.1	56%	0.558	32%	0.319	S	S	*	.	S	Bend	trans	-90.8	-29.6	174.5	42.6	0	0	0	0	112.9	Q781	Q781-T786 HydrophobicContact CG-CG2 3.45Å; Q781-T786 VanDerWaalsContact CG-CG2 3.45Å
787	D	71.5	Confident	87.7	Confident	120 Å²	120	58.2 Å²	58.2	64%	0.642	32%	0.32	S	S	*	.	S	Bend	trans	-141.9	68	-174.5	-166.5	16.7	0	0	0	108.9	R705	R705-D787 PolarHBondContact NE-O 3.49Å; R705-D787 PolarHBondContact NH2-O 2.65Å; R705-D787 VanDerWaalsContact NH2-O 3.13Å
788	G	80.1	Confident	87.3	Confident	48 Å²	48	60 Å²	60	50%	0.495	33%	0.33	S	S	.	.	S	Bend	trans	75.4	-172.3	-172	0	0	0	0	0	113.8	G785	G785-G788 WeakPolarHBondContact CA-O 3.5Å
789	E	86.9	Confident	87.1	Confident	76 Å²	76	61.7 Å²	61.7	36%	0.355	34%	0.338	S	S	.	.	S	Bend	trans	-62.9	142.9	-179.2	-63.3	-173.9	-157.4	0	0	112.8	R705 L791 V792 R810	R705-E789 PolarHBondContact NH2-O 3.12Å; E789-L791 PolarHBondContact O-N 2.83Å; E789-V792 HydrophobicContact CB-CB 4.13Å; E789-V792 HydrophobicContact CB-CG2 4.06Å; E789-V792 PolarHBondContact O-N 3.46Å; E789-R810 IonicContact OE2-CZ 3.51Å; E789-R810 IonicContact OE2-NH1 3.35Å; E789-R810 PolarHBondContact OE2-NH1 2.88Å; E789-R810 IonicContact OE2-NH2 2.76Å; E789-R810 PolarHBondContact OE2-NH2 3.41Å
790	W	91.7	Very high	86.9	Confident	9 Å²	9	65.3 Å²	65.3	3%	0.034	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	125.8	-178.2	-177.4	82.6	0	0	0	112.7	C709 Y713 I782 R810 C813 I814	C709-W790 HydrophobicContact CB-CG 4.4Å; C709-W790 PolarHBondContact O-NE1 3.26Å; Y713-W790 HydrophobicContact CD2-CH2 4.11Å; Y713-W790 AromaticContact CD2-CZ2 3.68Å; Y713-W790 HydrophobicContact CD2-CZ2 3.68Å; Y713-W790 HydrophobicContact CG-CH2 4.5Å; Y713-W790 AromaticContact CG-CZ2 3.86Å; Y713-W790 HydrophobicContact CG-CZ2 3.86Å; I782-W790 HydrophobicContact CG2-CD2 4.1Å; I782-W790 HydrophobicContact CG2-CG 4.03Å; W790-R810 HydrophobicContact CE3-CG 3.95Å; W790-R810 HydrophobicContact CZ3-CG 4.03Å; W790-R810 WeakPolarHBondContact O-CD 2.78Å; W790-R810 PolarHBondContact O-NH1 2.97Å; W790-C813 HydrophobicContact CH2-CB 3.54Å; W790-C813 HydrophobicContact CZ3-CB 3.78Å; W790-I814 HydrophobicContact CE3-CD1 3.97Å; W790-I814 HydrophobicContact CE3-CG1 4.09Å; W790-I814 HydrophobicContact CZ3-CG1 4.4Å
791	L	92.1	Very high	86.9	Confident	6 Å²	6	63.9 Å²	63.9	3%	0.031	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	56.7	42.3	-175.6	-70	-176	0	0	0	114.8	E706 C709 L710 E789 M806 L809 R810	E706-L791 HydrophobicContact CG-CD2 3.87Å; C709-L791 HydrophobicContact CB-CD2 3.88Å; C709-L791 HydrophobicContact CB-CG 4.17Å; L710-L791 HydrophobicContact CD2-CD1 3.85Å; L710-L791 HydrophobicContact CD2-CD2 3.83Å; L710-L791 HydrophobicContact CD2-CG 4.33Å; L710-L791 HydrophobicContact CG-CD2 3.99Å; E789-L791 PolarHBondContact O-N 2.83Å; L791-M806 HydrophobicContact CD2-SD 4.4Å; L791-L809 HydrophobicContact CD1-CB 3.82Å; L791-L809 HydrophobicContact CD1-CD1 3.97Å; L791-R810 HydrophobicContact CB-CG 4.03Å; L791-R810 WeakPolarHBondContact O-CD 3.42Å
792	V	90.9	Very high	87.1	Confident	54 Å²	54	61 Å²	61	33%	0.327	35%	0.345	S	S	.	.			trans	-121.6	130.6	167.1	169	0	0	0	0	108.5	R705 E789 R810	R705-V792 PolarHBondContact NE-O 3.35Å; R705-V792 PolarHBondContact NH1-O 3.3Å; R705-V792 PolarHBondContact NH2-O 2.87Å; E789-V792 HydrophobicContact CB-CB 4.13Å; E789-V792 HydrophobicContact CB-CG2 4.06Å; E789-V792 PolarHBondContact O-N 3.46Å; V792-R810 VanDerWaalsContact CG2-CZ 3.48Å
793	D	91.6	Very high	87.1	Confident	35 Å²	35	66 Å²	66	19%	0.187	36%	0.363	C	S	.	.			trans	-64.9	147	178.8	-70.1	-30.4	0	0	0	111.4	H795 R802 M806	D793-H795 WeakPolarHBondContact CB-O 3.2Å; D793-R802 VanDerWaalsContact CG-NH1 3.29Å; D793-R802 IonicContact OD1-CZ 3.76Å; D793-R802 IonicContact OD1-NH1 2.76Å; D793-R802 PolarHBondContact OD1-NH1 3.49Å; D793-R802 VanDerWaalsContact OD1-NH1 3.07Å; D793-R802 IonicContact OD1-NH2 3.9Å; D793-R802 PolarHBondContact OD1-NH2 2.65Å; D793-R802 IonicContact OD2-CZ 3.45Å; D793-R802 IonicContact OD2-NH1 2.73Å; D793-R802 PolarHBondContact OD2-NH1 2.7Å; D793-R802 IonicContact OD2-NH2 3.34Å; D793-M806 WeakPolarHBondContact OD2-CE 3.43Å
794	A	89.3	Confident	87.2	Confident	59 Å²	59	69.8 Å²	69.8	49%	0.488	38%	0.381	S	S	.	.	S	Bend	trans	-80.7	-28.6	170.7	0	0	0	0	0	111.6	N702	N702-A794 PolarHBondContact OD1-N 3.43Å
795	H	89.5	Confident	87.6	Confident	64 Å²	64	65 Å²	65	30%	0.296	36%	0.356	S	S	.	.	S	Bend	trans	-124.8	140.8	-178.6	-54.2	-73.2	0	0	0	110.4	K698 Q701 N702 D793 E797	K698-H795 HydrophobicContact CB-CB 3.96Å; K698-H795 HydrophobicContact CG-CB 4.28Å; Q701-H795 PolarHBondContact OE1-NE2 3.22Å; Q701-H795 VanDerWaalsContact OE1-NE2 3.15Å; N702-H795 PolarHBondContact ND2-O 2.71Å; N702-H795 PolarHBondContact OD1-N 3.45Å; N702-H795 VanDerWaalsContact OD1-N 3.16Å; D793-H795 WeakPolarHBondContact CB-O 3.2Å; H795-E797 PolarHBondContact O-N 3.16Å
796	E	87.4	Confident	88.3	Confident	198 Å²	198	64.2 Å²	64.2	93%	0.925	35%	0.347	S	S	*	.			trans	-67.1	130.3	177.7	-64.4	-173.3	164.2	0	0	111
797	E	85.8	Confident	89.3	Confident	20 Å²	20	63.1 Å²	63.1	9%	0.093	34%	0.34	C	S	.	.			trans	-127	140.2	176.7	-80.2	-176.9	-143	0	0	111.4	V699 N702 R703 H795 D799 R802 R803	V699-E797 HydrophobicContact CG2-CG 4.35Å; N702-E797 WeakPolarHBondContact CB-OE1 3.16Å; N702-E797 PolarHBondContact ND2-OE1 3.25Å; R703-E797 IonicContact CZ-OE1 3.6Å; R703-E797 IonicContact CZ-OE2 2.88Å; R703-E797 VanDerWaalsContact CZ-OE2 3.25Å; R703-E797 IonicContact NH1-OE1 3.28Å; R703-E797 PolarHBondContact NH1-OE1 3.44Å; R703-E797 IonicContact NH1-OE2 2.76Å; R703-E797 PolarHBondContact NH1-OE2 3.48Å; R703-E797 IonicContact NH2-OE2 3.85Å; R703-E797 PolarHBondContact NH2-OE2 2.91Å; H795-E797 PolarHBondContact O-N 3.16Å; E797-D799 PolarHBondContact O-N 3Å; E797-D799 VanDerWaalsContact O-N 3.15Å; E797-R802 IonicContact OE2-NH1 3.07Å; E797-R803 PolarHBondContact O-NH2 3.26Å
798	D	86	Confident	90.4	Very high	159 Å²	159	57.6 Å²	57.6	85%	0.85	31%	0.311	S	S	*	.			trans	-74.4	1.2	-177.8	-71.6	-29.4	0	0	0	115.5	T800	D798-T800 PolarHBondContact O-N 2.77Å
799	D	88.6	Confident	91	Very high	67 Å²	67	55.3 Å²	55.3	36%	0.358	29%	0.288	S	S	.	.			trans	-73.1	86.6	177.6	-170.8	-15.3	0	0	0	111.8	E797 I801 R802 R803	E797-D799 PolarHBondContact O-N 3Å; E797-D799 VanDerWaalsContact O-N 3.15Å; D799-I801 VanDerWaalsContact C-N 3.31Å; D799-I801 PolarHBondContact O-N 3.22Å; D799-I801 PolarHBondContact OD1-N 3.3Å; D799-R802 HydrophobicContact CB-CB 4.06Å; D799-R802 WeakPolarHBondContact OD1-CB 3.3Å; D799-R802 PolarHBondContact OD1-N 3.11Å; D799-R802 VanDerWaalsContact OD2-CB 3.25Å; D799-R802 WeakPolarHBondContact OD2-CB 3.37Å; D799-R803 WeakPolarHBondContact O-CB 3.31Å; D799-R803 PolarHBondContact O-N 3.45Å; D799-R803 VanDerWaalsContact O-N 3.08Å
800	T	91	Very high	91.3	Very high	79 Å²	79	52.9 Å²	52.9	49%	0.485	28%	0.275	S	S	.	.	H	α-helix	trans	-62.6	-34.4	-178.3	59.5	0	0	0	0	113.3	D798 Q804	D798-T800 PolarHBondContact O-N 2.77Å; T800-Q804 VanDerWaalsContact O-CG 3.23Å; T800-Q804 WeakPolarHBondContact O-CG 3.37Å; T800-Q804 PolarHBondContact O-N 3.31Å
801	I	92	Very high	91.3	Very high	55 Å²	55	57.4 Å²	57.4	28%	0.282	30%	0.295	S	S	.	.	H	α-helix	trans	-71.9	-50.6	-177.6	-62.3	176.6	0	0	0	109.2	P606 F607 D799 R803 Q804 E805	P606-I801 HydrophobicContact CB-CG2 3.65Å; P606-I801 HydrophobicContact CG-CG2 3.86Å; F607-I801 HydrophobicContact CE2-CD1 4.4Å; F607-I801 HydrophobicContact CZ-CD1 3.95Å; F607-I801 HydrophobicContact CZ-CG1 4.18Å; D799-I801 VanDerWaalsContact C-N 3.31Å; D799-I801 PolarHBondContact O-N 3.22Å; D799-I801 PolarHBondContact OD1-N 3.3Å; I801-R803 VanDerWaalsContact C-N 3.26Å; I801-R803 PolarHBondContact O-N 2.89Å; I801-Q804 PolarHBondContact O-N 2.64Å; I801-Q804 VanDerWaalsContact O-N 3.09Å; I801-E805 WeakPolarHBondContact O-CG 2.8Å; I801-E805 PolarHBondContact O-N 3.44Å
802	R	94.2	Very high	91.2	Very high	2 Å²	2	60 Å²	60	1%	0.008	31%	0.305	C	S	.	.	H	α-helix	trans	-55.1	-44.2	175.3	174	178.4	168.6	-84.9	-7	111.4	R703 E706 D793 E797 D799 Q804 E805 M806	R703-R802 VanDerWaalsContact CZ-CD 3.44Å; R703-R802 VanDerWaalsContact CZ-NE 3.3Å; R703-R802 VanDerWaalsContact NH1-NE 3.16Å; E706-R802 IonicContact OE2-CZ 3.96Å; E706-R802 IonicContact OE2-NE 3.77Å; E706-R802 PolarHBondContact OE2-NE 3.23Å; E706-R802 IonicContact OE2-NH2 3.26Å; E706-R802 PolarHBondContact OE2-NH2 2.95Å; D793-R802 VanDerWaalsContact CG-NH1 3.29Å; D793-R802 IonicContact OD1-CZ 3.76Å; D793-R802 IonicContact OD1-NH1 2.76Å; D793-R802 PolarHBondContact OD1-NH1 3.49Å; D793-R802 VanDerWaalsContact OD1-NH1 3.07Å; D793-R802 IonicContact OD1-NH2 3.9Å; D793-R802 PolarHBondContact OD1-NH2 2.65Å; D793-R802 IonicContact OD2-CZ 3.45Å; D793-R802 IonicContact OD2-NH1 2.73Å; D793-R802 PolarHBondContact OD2-NH1 2.7Å; D793-R802 IonicContact OD2-NH2 3.34Å; E797-R802 IonicContact OE2-NH1 3.07Å; D799-R802 HydrophobicContact CB-CB 4.06Å; D799-R802 WeakPolarHBondContact OD1-CB 3.3Å; D799-R802 PolarHBondContact OD1-N 3.11Å; D799-R802 VanDerWaalsContact OD2-CB 3.25Å; D799-R802 WeakPolarHBondContact OD2-CB 3.37Å; R802-Q804 VanDerWaalsContact C-N 3.35Å; R802-Q804 PolarHBondContact O-N 2.97Å; R802-E805 PolarHBondContact O-N 3.31Å; R802-M806 HydrophobicContact CG-CE 4.23Å; R802-M806 HydrophobicContact CG-SD 4.49Å; R802-M806 PolarHBondContact NH2-SD 3.17Å; R802-M806 WeakPolarHBondContact O-CG 3.44Å; R802-M806 PolarHBondContact O-N 2.89Å
803	R	93.3	Very high	91.3	Very high	108 Å²	108	57.6 Å²	57.6	41%	0.408	29%	0.29	S	S	.	.	H	α-helix	trans	-61	-42.9	177.8	-165.3	-172.3	-61.7	156.9	-7.6	112.1	E797 D799 I801 M806 V807	E797-R803 PolarHBondContact O-NH2 3.26Å; D799-R803 WeakPolarHBondContact O-CB 3.31Å; D799-R803 PolarHBondContact O-N 3.45Å; D799-R803 VanDerWaalsContact O-N 3.08Å; I801-R803 VanDerWaalsContact C-N 3.26Å; I801-R803 PolarHBondContact O-N 2.89Å; R803-M806 PolarHBondContact O-N 3.26Å; R803-V807 WeakPolarHBondContact O-CG2 3.45Å; R803-V807 PolarHBondContact O-N 3.08Å
804	Q	93.5	Very high	91.3	Very high	91 Å²	91	56 Å²	56	43%	0.425	28%	0.281	S	S	.	.	H	α-helix	trans	-65.2	-41.2	176.3	-71.8	171.7	13.5	0	0	112.2	I610 T800 I801 R802 V807 A808	I610-Q804 HydrophobicContact CD1-CB 3.82Å; T800-Q804 VanDerWaalsContact O-CG 3.23Å; T800-Q804 WeakPolarHBondContact O-CG 3.37Å; T800-Q804 PolarHBondContact O-N 3.31Å; I801-Q804 PolarHBondContact O-N 2.64Å; I801-Q804 VanDerWaalsContact O-N 3.09Å; R802-Q804 VanDerWaalsContact C-N 3.35Å; R802-Q804 PolarHBondContact O-N 2.97Å; Q804-V807 PolarHBondContact O-N 3.45Å; Q804-A808 WeakPolarHBondContact O-CB 3.33Å; Q804-A808 PolarHBondContact O-N 3.47Å
805	E	93.8	Very high	91.5	Very high	2 Å²	2	53.2 Å²	53.2	1%	0.009	26%	0.258	C	S	.	.	H	α-helix	trans	-59.2	-46.7	174.2	-68.7	179.2	144	0	0	111.2	I610 R657 R658 L661 I801 R802 A808 L809	I610-E805 HydrophobicContact CD1-CG 3.88Å; I610-E805 HydrophobicContact CG1-CG 4.14Å; R657-E805 IonicContact CZ-OE2 3.2Å; R657-E805 VanDerWaalsContact CZ-OE2 3.28Å; R657-E805 IonicContact NE-OE2 2.78Å; R657-E805 PolarHBondContact NE-OE2 2.96Å; R657-E805 IonicContact NH2-OE2 2.97Å; R657-E805 PolarHBondContact NH2-OE2 3.14Å; R658-E805 IonicContact NE-OE1 2.8Å; L661-E805 HydrophobicContact CD1-CB 4.11Å; L661-E805 HydrophobicContact CD1-CG 4.22Å; I801-E805 WeakPolarHBondContact O-CG 2.8Å; I801-E805 PolarHBondContact O-N 3.44Å; R802-E805 PolarHBondContact O-N 3.31Å; E805-A808 PolarHBondContact O-N 3.4Å; E805-L809 WeakPolarHBondContact O-CG 3.34Å; E805-L809 PolarHBondContact O-N 2.96Å
806	M	94	Very high	91.6	Very high	6 Å²	6	51.9 Å²	51.9	3%	0.03	25%	0.253	C	S	.	.	H	α-helix	trans	-64.2	-41.2	178.2	-69.7	-169.1	-58.4	0	0	112.7	E706 L791 D793 R802 R803 L809 R810	E706-M806 HydrophobicContact CG-SD 4.46Å; L791-M806 HydrophobicContact CD2-SD 4.4Å; D793-M806 WeakPolarHBondContact OD2-CE 3.43Å; R802-M806 HydrophobicContact CG-CE 4.23Å; R802-M806 HydrophobicContact CG-SD 4.49Å; R802-M806 PolarHBondContact NH2-SD 3.17Å; R802-M806 WeakPolarHBondContact O-CG 3.44Å; R802-M806 PolarHBondContact O-N 2.89Å; R803-M806 PolarHBondContact O-N 3.26Å; M806-L809 PolarHBondContact O-N 3.19Å; M806-R810 WeakPolarHBondContact O-CG 3.15Å; M806-R810 PolarHBondContact O-N 3.11Å
807	V	92.7	Very high	91.9	Very high	67 Å²	67	42.7 Å²	42.7	41%	0.406	21%	0.21	S	C	.	.	H	α-helix	trans	-64.3	-41.3	175.2	170.4	0	0	0	0	111.1	R803 Q804 R810 K811	R803-V807 WeakPolarHBondContact O-CG2 3.45Å; R803-V807 PolarHBondContact O-N 3.08Å; Q804-V807 PolarHBondContact O-N 3.45Å; V807-R810 PolarHBondContact O-N 3.41Å; V807-K811 WeakPolarHBondContact O-CG 3.27Å; V807-K811 PolarHBondContact O-N 3.18Å
808	A	92.8	Very high	92.2	Very high	5 Å²	5	41.7 Å²	41.7	4%	0.041	21%	0.205	C	C	.	.	H	α-helix	trans	-64	-41.2	175.8	0	0	0	0	0	111.6	I610 A613 L661 Q804 E805 K811 R812	I610-A808 HydrophobicContact CG2-CB 4.3Å; A613-A808 HydrophobicContact CB-CB 4.39Å; L661-A808 HydrophobicContact CD2-CB 3.79Å; Q804-A808 WeakPolarHBondContact O-CB 3.33Å; Q804-A808 PolarHBondContact O-N 3.47Å; E805-A808 PolarHBondContact O-N 3.4Å; A808-K811 PolarHBondContact O-N 3.03Å; A808-R812 PolarHBondContact O-N 3.44Å
809	L	93.9	Very high	92.4	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-60.9	-47.6	173.1	-77	169	0	0	0	111.4	R657 L660 L661 L710 L791 E805 M806 K811 R812 C813	R657-L809 HydrophobicContact CB-CD1 3.83Å; R657-L809 HydrophobicContact CG-CD1 3.7Å; L660-L809 HydrophobicContact CB-CD2 3.59Å; L661-L809 HydrophobicContact CB-CD2 4.48Å; L661-L809 HydrophobicContact CD1-CG 4.39Å; L661-L809 HydrophobicContact CD2-CD2 3.71Å; L661-L809 HydrophobicContact CD2-CG 3.75Å; L661-L809 HydrophobicContact CG-CD2 3.62Å; L661-L809 HydrophobicContact CG-CG 3.77Å; L710-L809 HydrophobicContact CD2-CD1 4.2Å; L791-L809 HydrophobicContact CD1-CB 3.82Å; L791-L809 HydrophobicContact CD1-CD1 3.97Å; E805-L809 WeakPolarHBondContact O-CG 3.34Å; E805-L809 PolarHBondContact O-N 2.96Å; M806-L809 PolarHBondContact O-N 3.19Å; L809-K811 PolarHBondContact O-N 3.24Å; L809-R812 PolarHBondContact O-N 3.35Å; L809-R812 VanDerWaalsContact O-N 3.07Å; L809-C813 WeakPolarHBondContact O-CB 3.48Å; L809-C813 PolarHBondContact O-N 3.4Å; L809-C813 PolarHBondContact O-SG 2.98Å; L809-C813 VanDerWaalsContact O-SG 3.4Å
810	R	93.5	Very high	92.7	Very high	24 Å²	24	34.5 Å²	34.5	9%	0.091	17%	0.166	C	C	.	.	H	α-helix	trans	-55	-48.3	176.6	-77.7	177.1	58.7	111.9	-14.2	112.3	E789 W790 L791 V792 M806 V807 R812 I814 L851	E789-R810 IonicContact OE2-CZ 3.51Å; E789-R810 IonicContact OE2-NH1 3.35Å; E789-R810 PolarHBondContact OE2-NH1 2.88Å; E789-R810 IonicContact OE2-NH2 2.76Å; E789-R810 PolarHBondContact OE2-NH2 3.41Å; W790-R810 HydrophobicContact CE3-CG 3.95Å; W790-R810 HydrophobicContact CZ3-CG 4.03Å; W790-R810 WeakPolarHBondContact O-CD 2.78Å; W790-R810 PolarHBondContact O-NH1 2.97Å; L791-R810 HydrophobicContact CB-CG 4.03Å; L791-R810 WeakPolarHBondContact O-CD 3.42Å; V792-R810 VanDerWaalsContact CG2-CZ 3.48Å; M806-R810 WeakPolarHBondContact O-CG 3.15Å; M806-R810 PolarHBondContact O-N 3.11Å; V807-R810 PolarHBondContact O-N 3.41Å; R810-R812 PolarHBondContact O-N 3.47Å; R810-I814 HydrophobicContact CB-CD1 4.25Å; R810-I814 HydrophobicContact CG-CD1 4.24Å; R810-I814 WeakPolarHBondContact O-CB 3.29Å; R810-I814 PolarHBondContact O-N 2.87Å; R810-L851 HydrophobicContact CB-CD1 4.11Å; R810-L851 HydrophobicContact CB-CD2 4.14Å
811	K	91.6	Very high	92.8	Very high	104 Å²	104	30.8 Å²	30.8	45%	0.452	14%	0.143	S	C	.	.	H	α-helix	trans	-63.9	-21.7	178.7	-73	-177.6	176.8	-176.9	0	114.2	V807 A808 L809 P815 L851	V807-K811 WeakPolarHBondContact O-CG 3.27Å; V807-K811 PolarHBondContact O-N 3.18Å; A808-K811 PolarHBondContact O-N 3.03Å; L809-K811 PolarHBondContact O-N 3.24Å; K811-P815 WeakPolarHBondContact O-CD 3.3Å; K811-P815 WeakPolarHBondContact O-CG 3.45Å; K811-L851 HydrophobicContact CG-CD2 4.01Å
812	R	90.2	Very high	92.8	Very high	62 Å²	62	28.2 Å²	28.2	23%	0.234	13%	0.13	C	C	.	.	H	α-helix	trans	-97.3	-52.4	179.6	-170.4	-177.6	-164.6	144.1	10.2	112.5	L661 Q663 A808 L809 R810 M816	L661-R812 PolarHBondContact O-NH1 3.15Å; Q663-R812 VanDerWaalsContact CG-CZ 3.44Å; A808-R812 PolarHBondContact O-N 3.44Å; L809-R812 PolarHBondContact O-N 3.35Å; L809-R812 VanDerWaalsContact O-N 3.07Å; R810-R812 PolarHBondContact O-N 3.47Å; R812-M816 WeakPolarHBondContact O-CB 3.48Å; R812-M816 PolarHBondContact O-N 2.96Å
813	C	92.1	Very high	92.6	Very high	2 Å²	2	32.4 Å²	32.4	1%	0.014	15%	0.148	C	C	.	.	H	α-helix	trans	-71.8	-40.6	-170.3	-69.8	0	0	0	0	112.7	Y713 W790 L809 M816 V817	Y713-C813 HydrophobicContact CD2-CB 4.21Å; Y713-C813 HydrophobicContact CE2-CB 3.44Å; Y713-C813 VanDerWaalsContact CE2-CB 3.44Å; Y713-C813 VanDerWaalsContact CZ-SG 3.5Å; Y713-C813 PolarHBondContact OH-SG 2.79Å; W790-C813 HydrophobicContact CH2-CB 3.54Å; W790-C813 HydrophobicContact CZ3-CB 3.78Å; L809-C813 WeakPolarHBondContact O-CB 3.48Å; L809-C813 PolarHBondContact O-N 3.4Å; L809-C813 PolarHBondContact O-SG 2.98Å; L809-C813 VanDerWaalsContact O-SG 3.4Å; C813-M816 PolarHBondContact O-N 3.29Å; C813-V817 VanDerWaalsContact O-CG2 3.31Å; C813-V817 WeakPolarHBondContact O-CG2 3.35Å; C813-V817 PolarHBondContact O-N 2.86Å
814	I	92.9	Very high	92.7	Very high	2 Å²	2	27.2 Å²	27.2	1%	0.01	13%	0.129	C	C	.	.	H	α-helix	trans	-67	-49.9	-178.5	-74.2	165.2	0	0	0	111.1	L783 W790 R810 M816 V817 A818 L848 L851 F852	L783-I814 HydrophobicContact CD2-CG2 3.9Å; W790-I814 HydrophobicContact CE3-CD1 3.97Å; W790-I814 HydrophobicContact CE3-CG1 4.09Å; W790-I814 HydrophobicContact CZ3-CG1 4.4Å; R810-I814 HydrophobicContact CB-CD1 4.25Å; R810-I814 HydrophobicContact CG-CD1 4.24Å; R810-I814 WeakPolarHBondContact O-CB 3.29Å; R810-I814 PolarHBondContact O-N 2.87Å; I814-M816 VanDerWaalsContact C-N 3.26Å; I814-M816 PolarHBondContact O-N 2.76Å; I814-V817 PolarHBondContact O-N 3.32Å; I814-A818 WeakPolarHBondContact O-CB 3.47Å; I814-A818 PolarHBondContact O-N 3.49Å; I814-L848 HydrophobicContact CD1-CD2 4.17Å; I814-L848 HydrophobicContact CG2-CB 4.46Å; I814-L848 HydrophobicContact CG2-CD2 4.38Å; I814-L851 HydrophobicContact CB-CD1 4.15Å; I814-L851 HydrophobicContact CD1-CD1 3.28Å; I814-L851 HydrophobicContact CG1-CD1 4.27Å; I814-L851 HydrophobicContact CG2-CD1 4.18Å; I814-F852 HydrophobicContact CG2-CE2 4.09Å; I814-F852 HydrophobicContact CG2-CZ 4.47Å
815	P	91.8	Very high	92.6	Very high	1 Å²	1	23 Å²	23	1%	0.006	11%	0.109	C	C	.	.	H	α-helix	trans	-57.4	-39	172.6	-29.1	38.4	0	0	0	113.4	K811 A818 D819 F852	K811-P815 WeakPolarHBondContact O-CD 3.3Å; K811-P815 WeakPolarHBondContact O-CG 3.45Å; P815-A818 PolarHBondContact O-N 2.81Å; P815-D819 WeakPolarHBondContact O-CB 3.38Å; P815-D819 PolarHBondContact O-N 3.38Å; P815-F852 HydrophobicContact CB-CD1 3.75Å; P815-F852 HydrophobicContact CB-CE1 3.68Å; P815-F852 HydrophobicContact CB-CG 4.32Å; P815-F852 HydrophobicContact CB-CZ 4.19Å; P815-F852 HydrophobicContact CG-CD1 3.89Å; P815-F852 HydrophobicContact CG-CD2 4.14Å; P815-F852 HydrophobicContact CG-CE1 4.04Å; P815-F852 HydrophobicContact CG-CE2 4.26Å; P815-F852 HydrophobicContact CG-CG 3.94Å; P815-F852 HydrophobicContact CG-CZ 4.22Å
816	M	91.5	Very high	92.4	Very high	36 Å²	36	25.5 Å²	25.5	18%	0.177	12%	0.121	C	C	.	.	H	α-helix	trans	-65.9	-43.6	178.8	-167.9	179.5	91.4	0	0	112.9	F665 Y713 Y717 R812 C813 I814 A818 D819 M820	F665-M816 HydrophobicContact CE1-CE 3.75Å; F665-M816 HydrophobicContact CZ-CE 3.61Å; F665-M816 HydrophobicContact CZ-SD 4.07Å; Y713-M816 WeakPolarHBondContact OH-CE 3.43Å; Y717-M816 HydrophobicContact CD2-CE 3.9Å; Y717-M816 HydrophobicContact CE2-CE 3.92Å; R812-M816 WeakPolarHBondContact O-CB 3.48Å; R812-M816 PolarHBondContact O-N 2.96Å; C813-M816 PolarHBondContact O-N 3.29Å; I814-M816 VanDerWaalsContact C-N 3.26Å; I814-M816 PolarHBondContact O-N 2.76Å; M816-A818 VanDerWaalsContact C-N 3.32Å; M816-D819 PolarHBondContact O-N 2.9Å; M816-M820 HydrophobicContact CE-CE 3.58Å; M816-M820 HydrophobicContact CE-SD 4.2Å; M816-M820 HydrophobicContact CG-CE 3.79Å; M816-M820 HydrophobicContact CG-SD 4.32Å; M816-M820 WeakPolarHBondContact O-CB 3.38Å; M816-M820 VanDerWaalsContact O-CG 3.24Å; M816-M820 WeakPolarHBondContact O-CG 3.43Å; M816-M820 PolarHBondContact O-N 3.1Å; M816-M820 HydrophobicContact SD-CE 4.04Å
817	V	93.7	Very high	92.2	Very high	4 Å²	4	26.8 Å²	26.8	2%	0.024	13%	0.131	C	C	.	.	H	α-helix	trans	-62.8	-42.6	175.7	168.4	0	0	0	0	110.6	Y713 M779 I782 L783 C813 I814 M820 L821	Y713-V817 HydrophobicContact CD2-CG2 4.23Å; Y713-V817 HydrophobicContact CE2-CG2 3.6Å; M779-V817 HydrophobicContact CB-CG1 3.84Å; M779-V817 HydrophobicContact CG-CG1 4.08Å; M779-V817 HydrophobicContact SD-CG1 4.19Å; I782-V817 HydrophobicContact CD1-CG2 4.33Å; I782-V817 HydrophobicContact CG2-CG2 4.48Å; L783-V817 HydrophobicContact CD1-CG1 4.3Å; L783-V817 HydrophobicContact CD2-CB 4.43Å; L783-V817 HydrophobicContact CD2-CG1 4.1Å; L783-V817 HydrophobicContact CG-CG1 4Å; C813-V817 VanDerWaalsContact O-CG2 3.31Å; C813-V817 WeakPolarHBondContact O-CG2 3.35Å; C813-V817 PolarHBondContact O-N 2.86Å; I814-V817 PolarHBondContact O-N 3.32Å; V817-M820 PolarHBondContact O-N 3.23Å; V817-L821 HydrophobicContact CG1-CD1 4.3Å; V817-L821 WeakPolarHBondContact O-CG 3.26Å; V817-L821 PolarHBondContact O-N 3.3Å
818	A	92.8	Very high	92.1	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-60.5	-46.5	176.1	0	0	0	0	0	111.1	I814 P815 M816 M820 L821 V822 I841 F852 W860	I814-A818 WeakPolarHBondContact O-CB 3.47Å; I814-A818 PolarHBondContact O-N 3.49Å; P815-A818 PolarHBondContact O-N 2.81Å; M816-A818 VanDerWaalsContact C-N 3.32Å; A818-M820 VanDerWaalsContact C-N 3.35Å; A818-M820 PolarHBondContact O-N 2.84Å; A818-L821 PolarHBondContact O-N 3.22Å; A818-V822 WeakPolarHBondContact O-CG2 3.38Å; A818-V822 PolarHBondContact O-N 2.88Å; A818-I841 HydrophobicContact CB-CD1 3.86Å; A818-F852 HydrophobicContact CB-CE1 4.1Å; A818-F852 HydrophobicContact CB-CZ 3.73Å; A818-W860 VanDerWaalsContact C-CZ3 3.41Å; A818-W860 HydrophobicContact CB-CE3 4.5Å; A818-W860 HydrophobicContact CB-CH2 3.58Å; A818-W860 HydrophobicContact CB-CZ3 3.46Å; A818-W860 VanDerWaalsContact CB-CZ3 3.46Å; A818-W860 WeakPolarHBondContact O-CH2 3.43Å; A818-W860 WeakPolarHBondContact O-CZ3 3.49Å
819	D	91.2	Very high	91.9	Very high	47 Å²	47	32.3 Å²	32.3	25%	0.251	15%	0.149	S	C	.	.	H	α-helix	trans	-61.5	-41.2	177.2	-88	-30.3	0	0	0	112.5	P815 M816 V822 F823 R863	P815-D819 WeakPolarHBondContact O-CB 3.38Å; P815-D819 PolarHBondContact O-N 3.38Å; M816-D819 PolarHBondContact O-N 2.9Å; D819-V822 PolarHBondContact O-N 3.14Å; D819-F823 WeakPolarHBondContact O-CB 3.34Å; D819-F823 PolarHBondContact O-N 3.24Å; D819-R863 IonicContact OD1-CZ 3.54Å; D819-R863 IonicContact OD1-NH1 2.72Å; D819-R863 PolarHBondContact OD1-NH1 3.13Å; D819-R863 IonicContact OD1-NH2 3.81Å
820	M	93.6	Very high	91.6	Very high	28 Å²	28	34.1 Å²	34.1	14%	0.138	16%	0.158	C	C	.	.	H	α-helix	trans	-64	-43.9	176.2	-72.5	172.4	172.9	0	0	112	Y717 F720 M779 M816 V817 A818 V822 F823 M824	Y717-M820 HydrophobicContact CD2-CE 4.09Å; Y717-M820 HydrophobicContact CD2-SD 4.49Å; Y717-M820 HydrophobicContact CE2-CE 3.76Å; F720-M820 HydrophobicContact CD1-CE 4.1Å; F720-M820 HydrophobicContact CD1-CG 4.39Å; F720-M820 HydrophobicContact CD1-SD 3.93Å; F720-M820 HydrophobicContact CD2-CB 4.18Å; F720-M820 HydrophobicContact CD2-CG 4.47Å; F720-M820 HydrophobicContact CE1-CE 3.97Å; F720-M820 HydrophobicContact CE1-CG 4.03Å; F720-M820 HydrophobicContact CE1-SD 4.08Å; F720-M820 HydrophobicContact CE2-CB 3.88Å; F720-M820 HydrophobicContact CE2-CG 4.1Å; F720-M820 HydrophobicContact CG-SD 4.2Å; F720-M820 HydrophobicContact CZ-CB 4.16Å; F720-M820 HydrophobicContact CZ-CG 3.88Å; F720-M820 HydrophobicContact CZ-SD 4.47Å; M779-M820 HydrophobicContact CE-CB 3.7Å; M779-M820 HydrophobicContact CE-CG 4.35Å; M779-M820 HydrophobicContact CE-SD 3.86Å; M779-M820 HydrophobicContact SD-CB 3.73Å; M816-M820 HydrophobicContact CE-CE 3.58Å; M816-M820 HydrophobicContact CE-SD 4.2Å; M816-M820 HydrophobicContact CG-CE 3.79Å; M816-M820 HydrophobicContact CG-SD 4.32Å; M816-M820 WeakPolarHBondContact O-CB 3.38Å; M816-M820 VanDerWaalsContact O-CG 3.24Å; M816-M820 WeakPolarHBondContact O-CG 3.43Å; M816-M820 PolarHBondContact O-N 3.1Å; M816-M820 HydrophobicContact SD-CE 4.04Å; V817-M820 PolarHBondContact O-N 3.23Å; A818-M820 VanDerWaalsContact C-N 3.35Å; A818-M820 PolarHBondContact O-N 2.84Å; M820-V822 PolarHBondContact O-N 3.12Å; M820-F823 WeakPolarHBondContact O-CB 3.3Å; M820-F823 PolarHBondContact O-N 3.45Å; M820-M824 VanDerWaalsContact O-CG 3.25Å; M820-M824 WeakPolarHBondContact O-CG 3.28Å; M820-M824 PolarHBondContact O-N 2.77Å
821	L	93.8	Very high	91.2	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-60.5	-45	174.9	-79.1	172.4	0	0	0	111.6	E776 M779 R780 L783 V817 A818 F823 M824 Y825 L837	E776-L821 HydrophobicContact CG-CD2 4.33Å; M779-L821 HydrophobicContact CB-CD1 4Å; M779-L821 HydrophobicContact CB-CD2 3.66Å; M779-L821 HydrophobicContact CB-CG 3.78Å; M779-L821 HydrophobicContact CG-CD2 4.43Å; M779-L821 HydrophobicContact CG-CG 4.48Å; M779-L821 HydrophobicContact SD-CD2 4.01Å; M779-L821 HydrophobicContact SD-CG 3.79Å; R780-L821 HydrophobicContact CG-CD1 4.07Å; R780-L821 HydrophobicContact CG-CD2 4.3Å; L783-L821 HydrophobicContact CD1-CD1 3.65Å; V817-L821 HydrophobicContact CG1-CD1 4.3Å; V817-L821 WeakPolarHBondContact O-CG 3.26Å; V817-L821 PolarHBondContact O-N 3.3Å; A818-L821 PolarHBondContact O-N 3.22Å; L821-F823 VanDerWaalsContact C-N 3.32Å; L821-F823 PolarHBondContact O-N 3.3Å; L821-M824 WeakPolarHBondContact O-CB 3.47Å; L821-M824 PolarHBondContact O-N 3.27Å; L821-Y825 HydrophobicContact CB-CD2 4.48Å; L821-Y825 HydrophobicContact CB-CE2 4.14Å; L821-Y825 HydrophobicContact CD2-CE2 4.47Å; L821-Y825 WeakPolarHBondContact O-CB 3.41Å; L821-Y825 WeakPolarHBondContact O-CD2 3.18Å; L821-Y825 PolarHBondContact O-N 2.93Å; L821-L837 HydrophobicContact CB-CD2 3.64Å; L821-L837 HydrophobicContact CD1-CD1 3.77Å; L821-L837 HydrophobicContact CD1-CD2 4.21Å
822	V	91.4	Very high	90.8	Very high	1 Å²	1	33.5 Å²	33.5	1%	0.006	16%	0.159	C	C	.	.	H	α-helix	trans	-60	-45	175.8	173.4	0	0	0	0	110.9	A818 D819 M820 M824 Y825 Q826 V834 L837 W860 R863	A818-V822 WeakPolarHBondContact O-CG2 3.38Å; A818-V822 PolarHBondContact O-N 2.88Å; D819-V822 PolarHBondContact O-N 3.14Å; M820-V822 PolarHBondContact O-N 3.12Å; V822-M824 VanDerWaalsContact C-N 3.34Å; V822-M824 PolarHBondContact O-N 2.82Å; V822-Y825 PolarHBondContact O-N 3.35Å; V822-Q826 HydrophobicContact CG1-CG 4.26Å; V822-Q826 WeakPolarHBondContact O-CB 3.47Å; V822-Q826 VanDerWaalsContact O-CG 3.29Å; V822-Q826 WeakPolarHBondContact O-CG 3.2Å; V822-Q826 PolarHBondContact O-N 3.05Å; V822-V834 HydrophobicContact CG2-CG1 4.26Å; V822-L837 HydrophobicContact CG2-CD2 3.88Å; V822-W860 HydrophobicContact CB-CH2 4.46Å; V822-W860 HydrophobicContact CB-CZ3 4.45Å; V822-W860 HydrophobicContact CG2-CE3 4.15Å; V822-W860 HydrophobicContact CG2-CH2 3.12Å; V822-W860 HydrophobicContact CG2-CZ2 3.63Å; V822-W860 HydrophobicContact CG2-CZ3 3.41Å; V822-W860 VanDerWaalsContact CG2-CZ3 3.41Å; V822-R863 HydrophobicContact CG1-CB 4.15Å
823	F	91.5	Very high	90.7	Very high	90 Å²	90	33 Å²	33	40%	0.395	16%	0.159	S	C	.	.	H	α-helix	trans	-60.1	-43.7	176.7	172.8	-104.1	0	0	0	112.1	F720 W723 D819 M820 L821 S827	F720-F823 HydrophobicContact CE2-CD1 4.26Å; F720-F823 HydrophobicContact CZ-CD1 4.17Å; W723-F823 AromaticContact CH2-CD1 3.93Å; W723-F823 HydrophobicContact CH2-CD1 3.93Å; W723-F823 AromaticContact CH2-CE1 3.69Å; W723-F823 HydrophobicContact CH2-CE1 3.69Å; W723-F823 AromaticContact CZ3-CD1 3.87Å; W723-F823 HydrophobicContact CZ3-CD1 3.87Å; W723-F823 AromaticContact CZ3-CE1 3.68Å; W723-F823 HydrophobicContact CZ3-CE1 3.68Å; D819-F823 WeakPolarHBondContact O-CB 3.34Å; D819-F823 PolarHBondContact O-N 3.24Å; M820-F823 WeakPolarHBondContact O-CB 3.3Å; M820-F823 PolarHBondContact O-N 3.45Å; L821-F823 VanDerWaalsContact C-N 3.32Å; L821-F823 PolarHBondContact O-N 3.3Å; F823-S827 VanDerWaalsContact O-CB 3.26Å; F823-S827 WeakPolarHBondContact O-CB 3.35Å; F823-S827 PolarHBondContact O-N 2.65Å; F823-S827 PolarHBondContact O-OG 3.24Å
824	M	93.7	Very high	90.4	Very high	0 Å²	0	33 Å²	33	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-61.4	-48	175.8	-71.2	173.6	64.1	0	0	111.6	F720 W723 F772 A775 E776 M779 M820 L821 V822 S827 M828	F720-M824 HydrophobicContact CD2-CG 4.02Å; F720-M824 HydrophobicContact CD2-SD 3.66Å; F720-M824 HydrophobicContact CE2-CG 3.77Å; F720-M824 HydrophobicContact CE2-SD 4.03Å; W723-M824 HydrophobicContact CD2-CE 4.28Å; W723-M824 HydrophobicContact CD2-CG 4.16Å; W723-M824 HydrophobicContact CE3-CG 3.68Å; W723-M824 HydrophobicContact CE3-SD 4.33Å; W723-M824 HydrophobicContact CH2-CB 4.03Å; W723-M824 HydrophobicContact CH2-CG 3.58Å; W723-M824 HydrophobicContact CZ2-CB 4.24Å; W723-M824 HydrophobicContact CZ2-CG 4.04Å; W723-M824 HydrophobicContact CZ3-CB 4.33Å; W723-M824 HydrophobicContact CZ3-CG 3.39Å; F772-M824 HydrophobicContact CD2-CB 4.13Å; F772-M824 HydrophobicContact CD2-CE 3.51Å; F772-M824 HydrophobicContact CE2-CB 3.8Å; F772-M824 HydrophobicContact CE2-CE 3.89Å; F772-M824 HydrophobicContact CG-CE 4.27Å; A775-M824 HydrophobicContact CB-CE 3.51Å; A775-M824 HydrophobicContact CB-SD 4.2Å; E776-M824 HydrophobicContact CB-CE 4.37Å; M779-M824 HydrophobicContact CE-SD 4.18Å; M779-M824 HydrophobicContact SD-SD 4.17Å; M820-M824 VanDerWaalsContact O-CG 3.25Å; M820-M824 WeakPolarHBondContact O-CG 3.28Å; M820-M824 PolarHBondContact O-N 2.77Å; L821-M824 WeakPolarHBondContact O-CB 3.47Å; L821-M824 PolarHBondContact O-N 3.27Å; V822-M824 VanDerWaalsContact C-N 3.34Å; V822-M824 PolarHBondContact O-N 2.82Å; M824-S827 PolarHBondContact O-N 3.31Å; M824-M828 WeakPolarHBondContact O-CB 3.43Å; M824-M828 WeakPolarHBondContact O-CG 3.41Å; M824-M828 PolarHBondContact O-N 3.33Å
825	Y	92.2	Very high	90	Very high	3 Å²	3	35.4 Å²	35.4	1%	0.012	17%	0.171	C	C	.	.	H	α-helix	trans	-62.5	-43.1	179.1	-67.2	-32.3	0	0	0	112.4	F772 E776 R780 L821 V822 K829 Q830 K833 V834 L837	F772-Y825 HydrophobicContact CE2-CD1 4.02Å; F772-Y825 HydrophobicContact CE2-CE1 4.31Å; F772-Y825 AromaticContact CZ-CD1 3.69Å; F772-Y825 HydrophobicContact CZ-CD1 3.69Å; F772-Y825 AromaticContact CZ-CE1 3.73Å; F772-Y825 HydrophobicContact CZ-CE1 3.73Å; E776-Y825 HydrophobicContact CG-CE1 3.97Å; E776-Y825 WeakPolarHBondContact CG-OH 3.49Å; E776-Y825 VanDerWaalsContact OE1-CE1 3.32Å; E776-Y825 WeakPolarHBondContact OE1-CE1 3.24Å; E776-Y825 PolarHBondContact OE1-OH 2.89Å; R780-Y825 WeakPolarHBondContact CD-OH 3.45Å; L821-Y825 HydrophobicContact CB-CD2 4.48Å; L821-Y825 HydrophobicContact CB-CE2 4.14Å; L821-Y825 HydrophobicContact CD2-CE2 4.47Å; L821-Y825 WeakPolarHBondContact O-CB 3.41Å; L821-Y825 WeakPolarHBondContact O-CD2 3.18Å; L821-Y825 PolarHBondContact O-N 2.93Å; V822-Y825 PolarHBondContact O-N 3.35Å; Y825-K829 WeakPolarHBondContact O-CA 3.44Å; Y825-K829 PolarHBondContact O-N 3.21Å; Y825-Q830 HydrophobicContact CD1-CB 4.25Å; Y825-Q830 PolarHBondContact O-N 3.28Å; Y825-K833 HydrophobicContact CD1-CB 3.89Å; Y825-K833 HydrophobicContact CD1-CD 3.9Å; Y825-K833 HydrophobicContact CD2-CB 4.03Å; Y825-K833 HydrophobicContact CE1-CB 3.74Å; Y825-K833 HydrophobicContact CE1-CD 3.42Å; Y825-K833 VanDerWaalsContact CE1-CD 3.42Å; Y825-K833 HydrophobicContact CE1-CG 4.26Å; Y825-K833 HydrophobicContact CE2-CB 3.84Å; Y825-K833 HydrophobicContact CG-CB 4.05Å; Y825-V834 HydrophobicContact CD2-CG2 4.03Å; Y825-V834 HydrophobicContact CG-CG2 4.26Å; Y825-L837 HydrophobicContact CD2-CD2 4.35Å; Y825-L837 HydrophobicContact CE2-CB 4.37Å; Y825-L837 HydrophobicContact CE2-CD2 4.03Å
826	Q	90	Very high	89.7	Confident	53 Å²	53	37.3 Å²	37.3	25%	0.248	19%	0.187	C	C	.	.	H	α-helix	trans	-64.2	-41.6	175	-72.7	177.5	-28.6	0	0	112	V822 K829 C867	V822-Q826 HydrophobicContact CG1-CG 4.26Å; V822-Q826 WeakPolarHBondContact O-CB 3.47Å; V822-Q826 VanDerWaalsContact O-CG 3.29Å; V822-Q826 WeakPolarHBondContact O-CG 3.2Å; V822-Q826 PolarHBondContact O-N 3.05Å; Q826-K829 PolarHBondContact O-N 3.26Å; Q826-C867 PolarHBondContact NE2-SG 3.37Å; Q826-C867 VanDerWaalsContact NE2-SG 3.39Å
827	S	89.7	Confident	89.7	Confident	34 Å²	34	35.7 Å²	35.7	24%	0.238	18%	0.179	C	C	.	.	H	α-helix	trans	-67.9	-37.7	-179.4	-62.1	0	0	0	0	112.7	F823 M824	F823-S827 VanDerWaalsContact O-CB 3.26Å; F823-S827 WeakPolarHBondContact O-CB 3.35Å; F823-S827 PolarHBondContact O-N 2.65Å; F823-S827 PolarHBondContact O-OG 3.24Å; M824-S827 PolarHBondContact O-N 3.31Å
828	M	90.2	Very high	89.4	Confident	46 Å²	46	36.3 Å²	36.3	23%	0.227	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.8	3	178.5	-64.9	-64.5	-73.6	0	0	113.6	W723 F727 T768 L769 F772 M824 Q830	W723-M828 HydrophobicContact CZ2-CG 4.18Å; F727-M828 HydrophobicContact CD2-SD 4.24Å; F727-M828 HydrophobicContact CE2-SD 4.19Å; T768-M828 HydrophobicContact CG2-CE 4.08Å; T768-M828 HydrophobicContact CG2-SD 3.84Å; L769-M828 HydrophobicContact CD1-CE 4.23Å; F772-M828 HydrophobicContact CB-CE 4.2Å; F772-M828 HydrophobicContact CD2-CB 4.19Å; F772-M828 HydrophobicContact CD2-CG 3.46Å; F772-M828 VanDerWaalsContact CD2-CG 3.46Å; F772-M828 HydrophobicContact CE2-CB 4.03Å; F772-M828 HydrophobicContact CE2-CG 3.78Å; F772-M828 HydrophobicContact CG-CE 4.26Å; F772-M828 HydrophobicContact CG-CG 3.99Å; M824-M828 WeakPolarHBondContact O-CB 3.43Å; M824-M828 WeakPolarHBondContact O-CG 3.41Å; M824-M828 PolarHBondContact O-N 3.33Å; M828-Q830 VanDerWaalsContact C-N 3.3Å; M828-Q830 HydrophobicContact CB-CG 4.3Å; M828-Q830 PolarHBondContact O-N 3.34Å
829	K	88.3	Confident	89.2	Confident	141 Å²	141	42.5 Å²	42.5	61%	0.613	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	57	37	-178.2	-52.4	-175.8	175.7	-170.5	0	114.3	Y825 Q826 Y831	Y825-K829 WeakPolarHBondContact O-CA 3.44Å; Y825-K829 PolarHBondContact O-N 3.21Å; Q826-K829 PolarHBondContact O-N 3.26Å; K829-Y831 HydrophobicContact CB-CE2 3.79Å; K829-Y831 HydrophobicContact CG-CE2 4.33Å; K829-Y831 PolarHBondContact O-N 2.88Å
830	Q	87.2	Confident	89.1	Confident	39 Å²	39	41.9 Å²	41.9	18%	0.182	21%	0.21	C	C	.	.			trans	-101.1	63.6	175.8	-63.5	-173.2	-2.5	0	0	109.7	Y825 M828 D832 K833	Y825-Q830 HydrophobicContact CD1-CB 4.25Å; Y825-Q830 PolarHBondContact O-N 3.28Å; M828-Q830 VanDerWaalsContact C-N 3.3Å; M828-Q830 HydrophobicContact CB-CG 4.3Å; M828-Q830 PolarHBondContact O-N 3.34Å; Q830-D832 VanDerWaalsContact C-N 3.29Å; Q830-D832 VanDerWaalsContact C-OD1 3.32Å; Q830-D832 PolarHBondContact O-N 3.46Å; Q830-K833 HydrophobicContact CB-CD 4.1Å; Q830-K833 HydrophobicContact CB-CG 4.26Å; Q830-K833 PolarHBondContact O-N 3.31Å
831	Y	86.5	Confident	88.9	Confident	30 Å²	30	40.9 Å²	40.9	12%	0.118	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-29.3	-171.3	-56	-66.7	0	0	0	113.1	K829 K833 V834 C867 Q870 C871	K829-Y831 HydrophobicContact CB-CE2 3.79Å; K829-Y831 HydrophobicContact CG-CE2 4.33Å; K829-Y831 PolarHBondContact O-N 2.88Å; Y831-K833 VanDerWaalsContact C-N 3.28Å; Y831-K833 PolarHBondContact O-N 3.44Å; Y831-V834 WeakPolarHBondContact O-CB 3.24Å; Y831-V834 WeakPolarHBondContact O-CG2 3.43Å; Y831-V834 PolarHBondContact O-N 3.14Å; Y831-C867 HydrophobicContact CD1-CB 4.18Å; Y831-Q870 HydrophobicContact CD1-CB 3.9Å; Y831-Q870 HydrophobicContact CD1-CG 4.32Å; Y831-Q870 HydrophobicContact CD2-CB 3.74Å; Y831-Q870 HydrophobicContact CE1-CB 3.8Å; Y831-Q870 HydrophobicContact CE1-CG 3.84Å; Y831-Q870 HydrophobicContact CE2-CB 3.63Å; Y831-Q870 HydrophobicContact CE2-CG 4.29Å; Y831-Q870 HydrophobicContact CG-CB 3.87Å; Y831-C871 WeakPolarHBondContact CB-SG 3.37Å
832	D	83.1	Confident	88.7	Confident	84 Å²	84	43.8 Å²	43.8	45%	0.449	23%	0.23	S	C	.	.	H	α-helix	trans	-58.7	-37.9	175.6	62.4	-48.8	0	0	0	112.4	Q830 V834 L835	Q830-D832 VanDerWaalsContact C-N 3.29Å; Q830-D832 VanDerWaalsContact C-OD1 3.32Å; Q830-D832 PolarHBondContact O-N 3.46Å; D832-V834 PolarHBondContact O-N 3.03Å; D832-L835 PolarHBondContact O-N 3.14Å
833	K	87.4	Confident	88.6	Confident	53 Å²	53	47.1 Å²	47.1	23%	0.23	25%	0.247	C	C	.	.	H	α-helix	trans	-68.7	-21.5	-178.9	-63.7	-169.1	174.8	179.7	0	114	E776 Y825 Q830 Y831 L835 A836 L837	E776-K833 VanDerWaalsContact CD-NZ 3.25Å; E776-K833 VanDerWaalsContact OE1-CD 3.27Å; E776-K833 WeakPolarHBondContact OE1-CD 3.45Å; E776-K833 IonicContact OE1-NZ 3.02Å; E776-K833 PolarHBondContact OE1-NZ 2.89Å; E776-K833 IonicContact OE2-NZ 2.71Å; E776-K833 PolarHBondContact OE2-NZ 3.31Å; Y825-K833 HydrophobicContact CD1-CB 3.89Å; Y825-K833 HydrophobicContact CD1-CD 3.9Å; Y825-K833 HydrophobicContact CD2-CB 4.03Å; Y825-K833 HydrophobicContact CE1-CB 3.74Å; Y825-K833 HydrophobicContact CE1-CD 3.42Å; Y825-K833 VanDerWaalsContact CE1-CD 3.42Å; Y825-K833 HydrophobicContact CE1-CG 4.26Å; Y825-K833 HydrophobicContact CE2-CB 3.84Å; Y825-K833 HydrophobicContact CG-CB 4.05Å; Q830-K833 HydrophobicContact CB-CD 4.1Å; Q830-K833 HydrophobicContact CB-CG 4.26Å; Q830-K833 PolarHBondContact O-N 3.31Å; Y831-K833 VanDerWaalsContact C-N 3.28Å; Y831-K833 PolarHBondContact O-N 3.44Å; K833-L835 VanDerWaalsContact C-N 3.28Å; K833-L835 PolarHBondContact O-N 2.94Å; K833-A836 PolarHBondContact O-N 3.38Å; K833-L837 PolarHBondContact O-N 2.86Å
834	V	86.6	Confident	88.4	Confident	1 Å²	1	48.3 Å²	48.3	1%	0.006	25%	0.254	C	S	.	.	H	α-helix	trans	-67.5	-32	179.7	-169.2	0	0	0	0	111	V822 Y825 Y831 D832 S838 L864 C867	V822-V834 HydrophobicContact CG2-CG1 4.26Å; Y825-V834 HydrophobicContact CD2-CG2 4.03Å; Y825-V834 HydrophobicContact CG-CG2 4.26Å; Y831-V834 WeakPolarHBondContact O-CB 3.24Å; Y831-V834 WeakPolarHBondContact O-CG2 3.43Å; Y831-V834 PolarHBondContact O-N 3.14Å; D832-V834 PolarHBondContact O-N 3.03Å; V834-S838 PolarHBondContact O-N 3.41Å; V834-S838 VanDerWaalsContact O-N 3.1Å; V834-S838 PolarHBondContact O-OG 2.7Å; V834-L864 HydrophobicContact CB-CD2 4.41Å; V834-L864 HydrophobicContact CG1-CD2 3.49Å; V834-L864 VanDerWaalsContact CG1-CD2 3.49Å; V834-C867 HydrophobicContact CB-CB 4.28Å; V834-C867 HydrophobicContact CG1-CB 4.33Å; V834-C867 HydrophobicContact CG2-CB 4.23Å
835	L	83.9	Confident	87.9	Confident	53 Å²	53	53.1 Å²	53.1	28%	0.277	29%	0.288	S	S	.	.	H	α-helix	trans	-68.4	-48.3	174.1	-177	70.3	0	0	0	111.3	D832 K833 L837 S838 E839 F879	D832-L835 PolarHBondContact O-N 3.14Å; K833-L835 VanDerWaalsContact C-N 3.28Å; K833-L835 PolarHBondContact O-N 2.94Å; L835-L837 PolarHBondContact O-N 3.13Å; L835-S838 WeakPolarHBondContact O-CA 3.36Å; L835-S838 WeakPolarHBondContact O-CB 3.25Å; L835-S838 PolarHBondContact O-N 3.41Å; L835-E839 PolarHBondContact O-N 2.84Å; L835-F879 HydrophobicContact CD1-CD1 3.89Å; L835-F879 HydrophobicContact CD1-CE1 4.4Å; L835-F879 HydrophobicContact CD2-CB 3.62Å; L835-F879 HydrophobicContact CD2-CD1 3.58Å; L835-F879 HydrophobicContact CD2-CG 4.05Å; L835-F879 HydrophobicContact CG-CD1 4.39Å
836	A	86.1	Confident	87.2	Confident	40 Å²	40	53.7 Å²	53.7	33%	0.331	30%	0.295	S	S	.	.	H	α-helix	trans	-58.6	-36.5	176.8	0	0	0	0	0	111.6	K833 S838 E839 V840	K833-A836 PolarHBondContact O-N 3.38Å; A836-S838 VanDerWaalsContact C-N 3.33Å; A836-E839 PolarHBondContact O-N 3.25Å; A836-V840 WeakPolarHBondContact O-CG2 3.45Å; A836-V840 PolarHBondContact O-N 2.95Å
837	L	90	Very high	87.1	Confident	3 Å²	3	55.6 Å²	55.6	2%	0.016	30%	0.302	C	S	.	.	H	α-helix	trans	-64.4	-37	172.7	-177.7	58.6	0	0	0	112.5	L783 L821 V822 Y825 K833 L835 V840 I841 W860	L783-L837 HydrophobicContact CD1-CD1 3.39Å; L821-L837 HydrophobicContact CB-CD2 3.64Å; L821-L837 HydrophobicContact CD1-CD1 3.77Å; L821-L837 HydrophobicContact CD1-CD2 4.21Å; V822-L837 HydrophobicContact CG2-CD2 3.88Å; Y825-L837 HydrophobicContact CD2-CD2 4.35Å; Y825-L837 HydrophobicContact CE2-CB 4.37Å; Y825-L837 HydrophobicContact CE2-CD2 4.03Å; K833-L837 PolarHBondContact O-N 2.86Å; L835-L837 PolarHBondContact O-N 3.13Å; L837-V840 PolarHBondContact O-N 2.76Å; L837-I841 HydrophobicContact CD1-CD1 4.37Å; L837-I841 HydrophobicContact CG-CD1 4.12Å; L837-I841 WeakPolarHBondContact O-CG1 3.42Å; L837-I841 PolarHBondContact O-N 2.85Å; L837-W860 HydrophobicContact CD2-CH2 3.53Å; L837-W860 HydrophobicContact CD2-CZ2 3.83Å; L837-W860 HydrophobicContact CG-CH2 3.94Å; L837-W860 HydrophobicContact CG-CZ2 3.88Å
838	S	88.6	Confident	87.1	Confident	17 Å²	17	54.6 Å²	54.6	12%	0.119	29%	0.294	C	S	.	.	H	α-helix	trans	-70.6	-34.4	178.5	-59.7	0	0	0	0	112.7	V834 L835 A836 V840 I841 A842 W860 L864	V834-S838 PolarHBondContact O-N 3.41Å; V834-S838 VanDerWaalsContact O-N 3.1Å; V834-S838 PolarHBondContact O-OG 2.7Å; L835-S838 WeakPolarHBondContact O-CA 3.36Å; L835-S838 WeakPolarHBondContact O-CB 3.25Å; L835-S838 PolarHBondContact O-N 3.41Å; A836-S838 VanDerWaalsContact C-N 3.33Å; S838-V840 VanDerWaalsContact C-N 3.33Å; S838-I841 PolarHBondContact O-N 2.65Å; S838-A842 WeakPolarHBondContact O-CB 3.3Å; S838-A842 PolarHBondContact O-N 3.08Å; S838-W860 PolarHBondContact OG-NE1 3.04Å; S838-L864 WeakPolarHBondContact OG-CD1 3.46Å; S838-L864 WeakPolarHBondContact OG-CD2 3.46Å
839	E	88.4	Confident	87.1	Confident	129 Å²	129	55.6 Å²	55.6	60%	0.603	30%	0.296	S	S	*	.	H	α-helix	trans	-60.5	-43.9	170.4	-67.7	179.2	170.5	0	0	110.9	L835 A836 I841 A842 D843	L835-E839 PolarHBondContact O-N 2.84Å; A836-E839 PolarHBondContact O-N 3.25Å; E839-I841 PolarHBondContact O-N 2.87Å; E839-A842 PolarHBondContact O-N 2.7Å; E839-D843 WeakPolarHBondContact O-CB 3.2Å; E839-D843 PolarHBondContact O-N 2.94Å
840	V	89.5	Confident	87.2	Confident	34 Å²	34	54.6 Å²	54.6	21%	0.206	29%	0.294	C	S	.	.	H	α-helix	trans	-62.6	-40.9	176.4	174.7	0	0	0	0	111.8	L783 I784 A836 L837 S838 L848	L783-V840 HydrophobicContact CB-CG1 4.08Å; I784-V840 HydrophobicContact CG1-CG1 4.25Å; A836-V840 WeakPolarHBondContact O-CG2 3.45Å; A836-V840 PolarHBondContact O-N 2.95Å; L837-V840 PolarHBondContact O-N 2.76Å; S838-V840 VanDerWaalsContact C-N 3.33Å; V840-L848 HydrophobicContact CG1-CD1 4.2Å
841	I	89.5	Confident	87.4	Confident	7 Å²	7	53.9 Å²	53.9	4%	0.036	29%	0.291	C	S	.	.	H	α-helix	trans	-71.8	-38.4	-179.5	-67.6	165.8	0	0	0	112	A818 L837 S838 E839 D843 Y849 F852 W860	A818-I841 HydrophobicContact CB-CD1 3.86Å; L837-I841 HydrophobicContact CD1-CD1 4.37Å; L837-I841 HydrophobicContact CG-CD1 4.12Å; L837-I841 WeakPolarHBondContact O-CG1 3.42Å; L837-I841 PolarHBondContact O-N 2.85Å; S838-I841 PolarHBondContact O-N 2.65Å; E839-I841 PolarHBondContact O-N 2.87Å; I841-D843 VanDerWaalsContact C-N 3.3Å; I841-Y849 PolarHBondContact O-N 3.32Å; I841-F852 HydrophobicContact CD1-CZ 4.12Å; I841-F852 HydrophobicContact CG1-CZ 4.43Å; I841-F852 HydrophobicContact CG2-CD2 4.4Å; I841-F852 HydrophobicContact CG2-CE2 3.81Å; I841-F852 HydrophobicContact CG2-CZ 4.14Å; I841-W860 HydrophobicContact CD1-CD2 4.41Å; I841-W860 HydrophobicContact CD1-CH2 3.36Å; I841-W860 HydrophobicContact CD1-CZ2 3.17Å; I841-W860 HydrophobicContact CD1-CZ3 4.11Å
842	A	89.3	Confident	87.6	Confident	62 Å²	62	53.3 Å²	53.3	51%	0.512	29%	0.289	S	S	.	.	H	α-helix	trans	-82.7	-7.1	-179.2	0	0	0	0	0	113.4	S838 E839 E844	S838-A842 WeakPolarHBondContact O-CB 3.3Å; S838-A842 PolarHBondContact O-N 3.08Å; E839-A842 PolarHBondContact O-N 2.7Å; A842-E844 PolarHBondContact O-N 3.21Å
843	D	89.1	Confident	87.8	Confident	71 Å²	71	54.6 Å²	54.6	38%	0.38	29%	0.292	S	S	.	.			trans	-60.3	133.2	-177.7	-178.3	66.7	0	0	0	112.1	E839 I841 S845 G846 K847	E839-D843 WeakPolarHBondContact O-CB 3.2Å; E839-D843 PolarHBondContact O-N 2.94Å; I841-D843 VanDerWaalsContact C-N 3.3Å; D843-S845 VanDerWaalsContact C-N 3.31Å; D843-S845 PolarHBondContact O-N 2.91Å; D843-S845 WeakPolarHBondContact OD2-CA 3.49Å; D843-S845 WeakPolarHBondContact OD2-CB 3.28Å; D843-S845 PolarHBondContact OD2-N 3.18Å; D843-S845 PolarHBondContact OD2-OG 3.4Å; D843-G846 PolarHBondContact OD2-N 2.84Å; D843-K847 WeakPolarHBondContact O-CA 3.29Å; D843-K847 PolarHBondContact O-N 2.69Å
844	E	87.6	Confident	87.9	Confident	114 Å²	114	61.1 Å²	61.1	53%	0.533	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-15.4	-176.1	-80.1	-63.9	145.4	0	0	113.3	A842 K847 Y849	A842-E844 PolarHBondContact O-N 3.21Å; E844-K847 VanDerWaalsContact O-CE 3.29Å; E844-K847 WeakPolarHBondContact O-CE 3.4Å; E844-K847 VanDerWaalsContact O-CG 3.31Å; E844-K847 WeakPolarHBondContact O-CG 3.48Å; E844-K847 WeakPolarHBondContact OE2-CE 3.21Å; E844-Y849 PolarHBondContact OE1-OH 3.2Å
845	S	82.4	Confident	87.9	Confident	101 Å²	101	64.4 Å²	64.4	71%	0.706	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-40.1	176.9	79.6	0	0	0	0	111.4	D843	D843-S845 VanDerWaalsContact C-N 3.31Å; D843-S845 PolarHBondContact O-N 2.91Å; D843-S845 WeakPolarHBondContact OD2-CA 3.49Å; D843-S845 WeakPolarHBondContact OD2-CB 3.28Å; D843-S845 PolarHBondContact OD2-N 3.18Å; D843-S845 PolarHBondContact OD2-OG 3.4Å
846	G	77.8	Confident	88.1	Confident	16 Å²	16	64.8 Å²	64.8	17%	0.165	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.1	-20.7	178.7	0	0	0	0	0	115.4	D843 L848	D843-G846 PolarHBondContact OD2-N 2.84Å; G846-L848 PolarHBondContact O-N 3.04Å
847	K	87.4	Confident	88.2	Confident	93 Å²	93	64.8 Å²	64.8	40%	0.404	34%	0.338	S	S	.	.			trans	48.7	35.7	179.1	-59	-178.3	179.4	173.8	0	114.1	D843 E844 Y849 Q850	D843-K847 WeakPolarHBondContact O-CA 3.29Å; D843-K847 PolarHBondContact O-N 2.69Å; E844-K847 VanDerWaalsContact O-CE 3.29Å; E844-K847 WeakPolarHBondContact O-CE 3.4Å; E844-K847 VanDerWaalsContact O-CG 3.31Å; E844-K847 WeakPolarHBondContact O-CG 3.48Å; E844-K847 WeakPolarHBondContact OE2-CE 3.21Å; K847-Y849 HydrophobicContact CB-CE1 4.13Å; K847-Y849 HydrophobicContact CG-CE1 4.28Å; K847-Y849 PolarHBondContact O-N 3.02Å; K847-Y849 VanDerWaalsContact O-N 3.13Å; K847-Q850 HydrophobicContact CB-CG 4.24Å; K847-Q850 WeakPolarHBondContact O-CB 3.32Å; K847-Q850 PolarHBondContact O-N 3Å
848	L	90.2	Very high	88.2	Confident	12 Å²	12	71.5 Å²	71.5	6%	0.063	37%	0.367	C	S	.	.	G	3₁₀ helix	trans	-58.2	-32.7	-175.1	-61.8	-179	0	0	0	111.9	L783 I814 V840 G846 Q850 L851 F852	L783-L848 HydrophobicContact CB-CD1 4.27Å; L783-L848 HydrophobicContact CD2-CD1 4.4Å; I814-L848 HydrophobicContact CD1-CD2 4.17Å; I814-L848 HydrophobicContact CG2-CB 4.46Å; I814-L848 HydrophobicContact CG2-CD2 4.38Å; V840-L848 HydrophobicContact CG1-CD1 4.2Å; G846-L848 PolarHBondContact O-N 3.04Å; L848-Q850 PolarHBondContact O-N 3.38Å; L848-L851 HydrophobicContact CD2-CD1 4.44Å; L848-L851 WeakPolarHBondContact O-CB 3.47Å; L848-L851 PolarHBondContact O-N 3.01Å; L848-F852 VanDerWaalsContact O-CD2 3.3Å; L848-F852 WeakPolarHBondContact O-CD2 3.33Å
849	Y	90	Very high	88.2	Confident	67 Å²	67	72.9 Å²	72.9	26%	0.263	38%	0.377	S	S	.	.	G	3₁₀ helix	trans	-53	-25.1	175.3	67.1	-96.8	0	0	0	114.5	I841 E844 K847 L851 F852	I841-Y849 PolarHBondContact O-N 3.32Å; E844-Y849 PolarHBondContact OE1-OH 3.2Å; K847-Y849 HydrophobicContact CB-CE1 4.13Å; K847-Y849 HydrophobicContact CG-CE1 4.28Å; K847-Y849 PolarHBondContact O-N 3.02Å; K847-Y849 VanDerWaalsContact O-N 3.13Å; Y849-L851 PolarHBondContact O-N 2.92Å; Y849-F852 PolarHBondContact O-N 3.32Å
850	Q	91.2	Very high	88.1	Confident	121 Å²	121	67.2 Å²	67.2	57%	0.565	35%	0.35	S	S	*	.	G	3₁₀ helix	trans	-73.4	-16.2	178.2	-61.6	-171.3	0.9	0	0	113.5	K847 L848	K847-Q850 HydrophobicContact CB-CG 4.24Å; K847-Q850 WeakPolarHBondContact O-CB 3.32Å; K847-Q850 PolarHBondContact O-N 3Å; L848-Q850 PolarHBondContact O-N 3.38Å
851	L	90.7	Very high	88	Confident	24 Å²	24	71.5 Å²	71.5	13%	0.126	37%	0.366	C	S	.	.	G	3₁₀ helix	trans	-84.6	-15.9	178.7	-60.1	175.2	0	0	0	112.7	R810 K811 I814 L848 Y849	R810-L851 HydrophobicContact CB-CD1 4.11Å; R810-L851 HydrophobicContact CB-CD2 4.14Å; K811-L851 HydrophobicContact CG-CD2 4.01Å; I814-L851 HydrophobicContact CB-CD1 4.15Å; I814-L851 HydrophobicContact CD1-CD1 3.28Å; I814-L851 HydrophobicContact CG1-CD1 4.27Å; I814-L851 HydrophobicContact CG2-CD1 4.18Å; L848-L851 HydrophobicContact CD2-CD1 4.44Å; L848-L851 WeakPolarHBondContact O-CB 3.47Å; L848-L851 PolarHBondContact O-N 3.01Å; Y849-L851 PolarHBondContact O-N 2.92Å
852	F	90.9	Very high	88	Confident	17 Å²	17	75.9 Å²	75.9	8%	0.075	39%	0.39	C	S	.	.	S	Bend	trans	-85.9	142.6	179.4	-68.1	-109.4	0	0	0	110.9	I814 P815 A818 I841 L848 Y849 Q856 L857 W860	I814-F852 HydrophobicContact CG2-CE2 4.09Å; I814-F852 HydrophobicContact CG2-CZ 4.47Å; P815-F852 HydrophobicContact CB-CD1 3.75Å; P815-F852 HydrophobicContact CB-CE1 3.68Å; P815-F852 HydrophobicContact CB-CG 4.32Å; P815-F852 HydrophobicContact CB-CZ 4.19Å; P815-F852 HydrophobicContact CG-CD1 3.89Å; P815-F852 HydrophobicContact CG-CD2 4.14Å; P815-F852 HydrophobicContact CG-CE1 4.04Å; P815-F852 HydrophobicContact CG-CE2 4.26Å; P815-F852 HydrophobicContact CG-CG 3.94Å; P815-F852 HydrophobicContact CG-CZ 4.22Å; A818-F852 HydrophobicContact CB-CE1 4.1Å; A818-F852 HydrophobicContact CB-CZ 3.73Å; I841-F852 HydrophobicContact CD1-CZ 4.12Å; I841-F852 HydrophobicContact CG1-CZ 4.43Å; I841-F852 HydrophobicContact CG2-CD2 4.4Å; I841-F852 HydrophobicContact CG2-CE2 3.81Å; I841-F852 HydrophobicContact CG2-CZ 4.14Å; L848-F852 VanDerWaalsContact O-CD2 3.3Å; L848-F852 WeakPolarHBondContact O-CD2 3.33Å; Y849-F852 PolarHBondContact O-N 3.32Å; F852-Q856 HydrophobicContact CB-CB 4.42Å; F852-Q856 HydrophobicContact CD1-CB 4.16Å; F852-L857 HydrophobicContact CB-CD1 4.27Å; F852-L857 HydrophobicContact CB-CD2 3.67Å; F852-L857 HydrophobicContact CB-CG 3.6Å; F852-L857 HydrophobicContact CD1-CD2 4.25Å; F852-L857 HydrophobicContact CD2-CD2 4.43Å; F852-L857 HydrophobicContact CG-CD2 3.89Å; F852-L857 HydrophobicContact CG-CG 4.35Å; F852-W860 HydrophobicContact CE1-CE3 4.46Å
853	E	87.8	Confident	87.8	Confident	112 Å²	112	76.6 Å²	76.6	52%	0.523	38%	0.379	S	S	.	.			trans	-68.6	153.4	165	-63.8	-168.7	163.7	0	0	111	S855 Q856 L857	E853-S855 VanDerWaalsContact CB-OG 3.29Å; E853-S855 WeakPolarHBondContact CB-OG 3.43Å; E853-S855 PolarHBondContact O-N 2.74Å; E853-S855 PolarHBondContact OE2-OG 3.22Å; E853-S855 VanDerWaalsContact OE2-OG 3.07Å; E853-Q856 HydrophobicContact CB-CB 4.44Å; E853-Q856 HydrophobicContact CB-CG 4.13Å; E853-Q856 WeakPolarHBondContact O-CB 3.29Å; E853-Q856 PolarHBondContact O-N 2.94Å; E853-L857 PolarHBondContact O-N 3.48Å
854	K	88.6	Confident	87.7	Confident	190 Å²	190	74.5 Å²	74.5	83%	0.826	37%	0.368	S	S	*	.	H	α-helix	trans	-58.3	-32.6	176.2	-68.1	-174.7	178.3	-179	0	112.7	K858	K854-K858 WeakPolarHBondContact O-CB 3.11Å; K854-K858 PolarHBondContact O-N 3.38Å
855	S	87.9	Confident	87.7	Confident	70 Å²	70	73.6 Å²	73.6	49%	0.49	37%	0.37	S	S	.	.	H	α-helix	trans	-62.5	-47	173.6	48.6	0	0	0	0	111.5	E853 K858 S859	E853-S855 VanDerWaalsContact CB-OG 3.29Å; E853-S855 WeakPolarHBondContact CB-OG 3.43Å; E853-S855 PolarHBondContact O-N 2.74Å; E853-S855 PolarHBondContact OE2-OG 3.22Å; E853-S855 VanDerWaalsContact OE2-OG 3.07Å; S855-K858 PolarHBondContact O-N 3.49Å; S855-S859 PolarHBondContact O-N 3.08Å
856	Q	87.7	Confident	87.9	Confident	61 Å²	61	73.2 Å²	73.2	29%	0.285	36%	0.357	S	S	.	.	H	α-helix	trans	-65.7	-45.7	178.7	-66.6	172.9	-37	0	0	111.2	F852 E853 K858 S859 W860	F852-Q856 HydrophobicContact CB-CB 4.42Å; F852-Q856 HydrophobicContact CD1-CB 4.16Å; E853-Q856 HydrophobicContact CB-CB 4.44Å; E853-Q856 HydrophobicContact CB-CG 4.13Å; E853-Q856 WeakPolarHBondContact O-CB 3.29Å; E853-Q856 PolarHBondContact O-N 2.94Å; Q856-K858 VanDerWaalsContact C-N 3.28Å; Q856-K858 PolarHBondContact O-N 2.81Å; Q856-S859 PolarHBondContact O-N 3.07Å; Q856-W860 WeakPolarHBondContact O-CB 3.4Å; Q856-W860 PolarHBondContact O-N 3.25Å
857	L	88.8	Confident	88.3	Confident	40 Å²	40	72.6 Å²	72.6	21%	0.209	35%	0.351	C	S	.	.	H	α-helix	trans	-60.3	-39.1	175.1	-70.8	175.3	0	0	0	111.9	F852 E853 W860 F861	F852-L857 HydrophobicContact CB-CD1 4.27Å; F852-L857 HydrophobicContact CB-CD2 3.67Å; F852-L857 HydrophobicContact CB-CG 3.6Å; F852-L857 HydrophobicContact CD1-CD2 4.25Å; F852-L857 HydrophobicContact CD2-CD2 4.43Å; F852-L857 HydrophobicContact CG-CD2 3.89Å; F852-L857 HydrophobicContact CG-CG 4.35Å; E853-L857 PolarHBondContact O-N 3.48Å; L857-W860 VanDerWaalsContact O-CB 3.29Å; L857-W860 WeakPolarHBondContact O-CB 3.49Å; L857-W860 PolarHBondContact O-N 2.98Å; L857-F861 HydrophobicContact CB-CE2 4.42Å; L857-F861 WeakPolarHBondContact O-CD2 3.38Å; L857-F861 PolarHBondContact O-N 2.97Å
858	K	89.9	Confident	88.2	Confident	143 Å²	143	70 Å²	70	62%	0.622	34%	0.344	S	S	*	.	H	α-helix	trans	-62	-49.5	175.2	-173.9	-178.7	176.7	-174.5	0	111.4	K854 S855 Q856 W860 F861 D862	K854-K858 WeakPolarHBondContact O-CB 3.11Å; K854-K858 PolarHBondContact O-N 3.38Å; S855-K858 PolarHBondContact O-N 3.49Å; Q856-K858 VanDerWaalsContact C-N 3.28Å; Q856-K858 PolarHBondContact O-N 2.81Å; K858-W860 PolarHBondContact O-N 2.91Å; K858-F861 PolarHBondContact O-N 2.64Å; K858-D862 PolarHBondContact O-N 3.32Å
859	S	87.2	Confident	88.1	Confident	47 Å²	47	75.5 Å²	75.5	33%	0.329	37%	0.368	S	S	.	.	H	α-helix	trans	-59.8	-33.8	175.3	-177.9	0	0	0	0	112.1	S855 Q856 D862 R863	S855-S859 PolarHBondContact O-N 3.08Å; Q856-S859 PolarHBondContact O-N 3.07Å; S859-D862 PolarHBondContact O-N 3.32Å; S859-R863 WeakPolarHBondContact O-CG 3.29Å; S859-R863 PolarHBondContact O-N 2.81Å
860	W	87.5	Confident	88	Confident	10 Å²	10	74.8 Å²	74.8	4%	0.038	37%	0.367	C	S	.	.	H	α-helix	trans	-63.6	-49.1	175.5	-172.2	-88.7	0	0	0	111.6	A818 V822 L837 S838 I841 F852 Q856 L857 K858 D862 R863 L864	A818-W860 VanDerWaalsContact C-CZ3 3.41Å; A818-W860 HydrophobicContact CB-CE3 4.5Å; A818-W860 HydrophobicContact CB-CH2 3.58Å; A818-W860 HydrophobicContact CB-CZ3 3.46Å; A818-W860 VanDerWaalsContact CB-CZ3 3.46Å; A818-W860 WeakPolarHBondContact O-CH2 3.43Å; A818-W860 WeakPolarHBondContact O-CZ3 3.49Å; V822-W860 HydrophobicContact CB-CH2 4.46Å; V822-W860 HydrophobicContact CB-CZ3 4.45Å; V822-W860 HydrophobicContact CG2-CE3 4.15Å; V822-W860 HydrophobicContact CG2-CH2 3.12Å; V822-W860 HydrophobicContact CG2-CZ2 3.63Å; V822-W860 HydrophobicContact CG2-CZ3 3.41Å; V822-W860 VanDerWaalsContact CG2-CZ3 3.41Å; L837-W860 HydrophobicContact CD2-CH2 3.53Å; L837-W860 HydrophobicContact CD2-CZ2 3.83Å; L837-W860 HydrophobicContact CG-CH2 3.94Å; L837-W860 HydrophobicContact CG-CZ2 3.88Å; S838-W860 PolarHBondContact OG-NE1 3.04Å; I841-W860 HydrophobicContact CD1-CD2 4.41Å; I841-W860 HydrophobicContact CD1-CH2 3.36Å; I841-W860 HydrophobicContact CD1-CZ2 3.17Å; I841-W860 HydrophobicContact CD1-CZ3 4.11Å; F852-W860 HydrophobicContact CE1-CE3 4.46Å; Q856-W860 WeakPolarHBondContact O-CB 3.4Å; Q856-W860 PolarHBondContact O-N 3.25Å; L857-W860 VanDerWaalsContact O-CB 3.29Å; L857-W860 WeakPolarHBondContact O-CB 3.49Å; L857-W860 PolarHBondContact O-N 2.98Å; K858-W860 PolarHBondContact O-N 2.91Å; W860-D862 VanDerWaalsContact C-N 3.29Å; W860-D862 PolarHBondContact O-N 2.7Å; W860-R863 PolarHBondContact O-N 2.9Å; W860-L864 WeakPolarHBondContact O-CG 3.32Å; W860-L864 PolarHBondContact O-N 2.89Å
861	F	87.6	Confident	87.6	Confident	123 Å²	123	69.2 Å²	69.2	54%	0.539	34%	0.341	S	S	.	.	H	α-helix	trans	-61.3	-36.8	176.2	-73.3	-62	0	0	0	112.6	L857 K858 L864 T865	L857-F861 HydrophobicContact CB-CE2 4.42Å; L857-F861 WeakPolarHBondContact O-CD2 3.38Å; L857-F861 PolarHBondContact O-N 2.97Å; K858-F861 PolarHBondContact O-N 2.64Å; F861-L864 HydrophobicContact CD1-CD1 4.07Å; F861-L864 HydrophobicContact CE1-CD1 4.5Å; F861-L864 PolarHBondContact O-N 2.75Å; F861-T865 WeakPolarHBondContact O-CB 3.12Å; F861-T865 PolarHBondContact O-N 2.88Å; F861-T865 PolarHBondContact O-OG1 2.78Å
862	D	88.2	Confident	87.4	Confident	100 Å²	100	71.8 Å²	71.8	54%	0.535	36%	0.355	S	S	.	.	H	α-helix	trans	-63	-45.5	174.8	-65.7	-26.3	0	0	0	110.8	K858 S859 W860 T865 E866	K858-D862 PolarHBondContact O-N 3.32Å; S859-D862 PolarHBondContact O-N 3.32Å; W860-D862 VanDerWaalsContact C-N 3.29Å; W860-D862 PolarHBondContact O-N 2.7Å; D862-T865 PolarHBondContact O-N 3.17Å; D862-E866 PolarHBondContact O-N 3.23Å; D862-E866 VanDerWaalsContact O-N 3.11Å
863	R	85.6	Confident	87.2	Confident	77 Å²	77	78 Å²	78	29%	0.291	38%	0.384	S	S	.	.	H	α-helix	trans	-65.6	-37.6	175.9	-70.6	-175.5	-167.7	164.6	10.5	113	D819 V822 S859 W860 T865 E866 C867	D819-R863 IonicContact OD1-CZ 3.54Å; D819-R863 IonicContact OD1-NH1 2.72Å; D819-R863 PolarHBondContact OD1-NH1 3.13Å; D819-R863 IonicContact OD1-NH2 3.81Å; V822-R863 HydrophobicContact CG1-CB 4.15Å; S859-R863 WeakPolarHBondContact O-CG 3.29Å; S859-R863 PolarHBondContact O-N 2.81Å; W860-R863 PolarHBondContact O-N 2.9Å; R863-T865 VanDerWaalsContact C-N 3.34Å; R863-E866 PolarHBondContact O-N 2.8Å; R863-C867 PolarHBondContact O-N 3.28Å; R863-C867 PolarHBondContact O-SG 3.49Å
864	L	86.1	Confident	86.9	Confident	26 Å²	26	77.8 Å²	77.8	14%	0.136	38%	0.383	C	S	.	.	H	α-helix	trans	-61.2	-44.7	174.1	-79.4	172.2	0	0	0	111.7	V834 S838 W860 F861 E866 C867 S868	V834-L864 HydrophobicContact CB-CD2 4.41Å; V834-L864 HydrophobicContact CG1-CD2 3.49Å; V834-L864 VanDerWaalsContact CG1-CD2 3.49Å; S838-L864 WeakPolarHBondContact OG-CD1 3.46Å; S838-L864 WeakPolarHBondContact OG-CD2 3.46Å; W860-L864 WeakPolarHBondContact O-CG 3.32Å; W860-L864 PolarHBondContact O-N 2.89Å; F861-L864 HydrophobicContact CD1-CD1 4.07Å; F861-L864 HydrophobicContact CE1-CD1 4.5Å; F861-L864 PolarHBondContact O-N 2.75Å; L864-E866 VanDerWaalsContact C-N 3.29Å; L864-E866 PolarHBondContact O-N 2.79Å; L864-C867 PolarHBondContact O-N 3.05Å; L864-S868 PolarHBondContact O-N 2.97Å; L864-S868 PolarHBondContact O-OG 2.92Å
865	T	87.8	Confident	86.6	Confident	95 Å²	95	71 Å²	71	58%	0.583	37%	0.366	S	S	*	.	H	α-helix	trans	-61	-41.7	179	-54.8	0	0	0	0	110.8	F861 D862 R863 S868 F869	F861-T865 WeakPolarHBondContact O-CB 3.12Å; F861-T865 PolarHBondContact O-N 2.88Å; F861-T865 PolarHBondContact O-OG1 2.78Å; D862-T865 PolarHBondContact O-N 3.17Å; R863-T865 VanDerWaalsContact C-N 3.34Å; T865-S868 PolarHBondContact O-N 2.79Å; T865-F869 WeakPolarHBondContact O-CB 3.34Å; T865-F869 PolarHBondContact O-N 2.82Å
866	E	86.7	Confident	86.3	Confident	94 Å²	94	69.6 Å²	69.6	44%	0.439	35%	0.353	S	S	.	.	H	α-helix	trans	-62.2	-46.6	174.3	-177	58.3	-144.9	0	0	111.8	D862 R863 L864 S868 F869 Q870	D862-E866 PolarHBondContact O-N 3.23Å; D862-E866 VanDerWaalsContact O-N 3.11Å; R863-E866 PolarHBondContact O-N 2.8Å; L864-E866 VanDerWaalsContact C-N 3.29Å; L864-E866 PolarHBondContact O-N 2.79Å; E866-S868 PolarHBondContact O-N 2.68Å; E866-F869 WeakPolarHBondContact O-CB 3.26Å; E866-F869 PolarHBondContact O-N 3.14Å; E866-F869 VanDerWaalsContact O-N 3.14Å; E866-Q870 WeakPolarHBondContact O-CG 3.29Å; E866-Q870 PolarHBondContact O-N 3.38Å; E866-Q870 PolarHBondContact OE1-NE2 2.83Å
867	C	86.7	Confident	86.2	Confident	3 Å²	3	68.4 Å²	68.4	2%	0.02	35%	0.348	C	S	.	.	H	α-helix	trans	-62.3	-42.7	177.4	-66.7	0	0	0	0	112.2	Q826 Y831 V834 R863 L864 F869 Q870 C871	Q826-C867 PolarHBondContact NE2-SG 3.37Å; Q826-C867 VanDerWaalsContact NE2-SG 3.39Å; Y831-C867 HydrophobicContact CD1-CB 4.18Å; V834-C867 HydrophobicContact CB-CB 4.28Å; V834-C867 HydrophobicContact CG1-CB 4.33Å; V834-C867 HydrophobicContact CG2-CB 4.23Å; R863-C867 PolarHBondContact O-N 3.28Å; R863-C867 PolarHBondContact O-SG 3.49Å; L864-C867 PolarHBondContact O-N 3.05Å; C867-F869 VanDerWaalsContact C-N 3.28Å; C867-F869 PolarHBondContact O-N 2.96Å; C867-Q870 PolarHBondContact O-N 2.98Å; C867-C871 PolarHBondContact O-N 3.32Å; C867-C871 PolarHBondContact O-SG 3.43Å
868	S	85.8	Confident	85.8	Confident	39 Å²	39	68.7 Å²	68.7	27%	0.273	35%	0.354	S	S	.	.	H	α-helix	trans	-60.8	-36.9	173.7	-72.1	0	0	0	0	112	L864 T865 E866 C871 L872 S878	L864-S868 PolarHBondContact O-N 2.97Å; L864-S868 PolarHBondContact O-OG 2.92Å; T865-S868 PolarHBondContact O-N 2.79Å; E866-S868 PolarHBondContact O-N 2.68Å; S868-C871 PolarHBondContact O-N 3.16Å; S868-L872 WeakPolarHBondContact O-CG 3.4Å; S868-L872 PolarHBondContact O-N 2.94Å; S868-L872 VanDerWaalsContact O-N 3.16Å; S868-S878 WeakPolarHBondContact CB-O 3.11Å; S868-S878 PolarHBondContact OG-O 3.4Å
869	F	87.9	Confident	85.2	Confident	127 Å²	127	67.4 Å²	67.4	56%	0.557	35%	0.349	S	S	*	.	H	α-helix	trans	-66	-40.1	174.6	-174.3	-97.2	0	0	0	112.1	T865 E866 C867 L872 H873	T865-F869 WeakPolarHBondContact O-CB 3.34Å; T865-F869 PolarHBondContact O-N 2.82Å; E866-F869 WeakPolarHBondContact O-CB 3.26Å; E866-F869 PolarHBondContact O-N 3.14Å; E866-F869 VanDerWaalsContact O-N 3.14Å; C867-F869 VanDerWaalsContact C-N 3.28Å; C867-F869 PolarHBondContact O-N 2.96Å; F869-L872 WeakPolarHBondContact O-CB 3.38Å; F869-L872 PolarHBondContact O-N 3.45Å; F869-H873 PolarHBondContact O-N 3.13Å
870	Q	86.8	Confident	84.6	Confident	52 Å²	52	65.8 Å²	65.8	24%	0.243	34%	0.339	C	S	.	.	H	α-helix	trans	-65.3	-40.5	174.6	-63	-61.2	-28.1	0	0	112.2	Y831 E866 C867 L872 H873 E874	Y831-Q870 HydrophobicContact CD1-CB 3.9Å; Y831-Q870 HydrophobicContact CD1-CG 4.32Å; Y831-Q870 HydrophobicContact CD2-CB 3.74Å; Y831-Q870 HydrophobicContact CE1-CB 3.8Å; Y831-Q870 HydrophobicContact CE1-CG 3.84Å; Y831-Q870 HydrophobicContact CE2-CB 3.63Å; Y831-Q870 HydrophobicContact CE2-CG 4.29Å; Y831-Q870 HydrophobicContact CG-CB 3.87Å; E866-Q870 WeakPolarHBondContact O-CG 3.29Å; E866-Q870 PolarHBondContact O-N 3.38Å; E866-Q870 PolarHBondContact OE1-NE2 2.83Å; C867-Q870 PolarHBondContact O-N 2.98Å; Q870-L872 VanDerWaalsContact C-N 3.3Å; Q870-L872 PolarHBondContact O-N 3.04Å; Q870-H873 WeakPolarHBondContact O-CB 3.35Å; Q870-H873 PolarHBondContact O-N 3.29Å; Q870-E874 PolarHBondContact O-N 2.92Å
871	C	83.7	Confident	84.2	Confident	4 Å²	4	70.4 Å²	70.4	3%	0.027	36%	0.364	C	S	.	.	H	α-helix	trans	-56	-43.7	172.3	-70.4	0	0	0	0	112.1	Y831 C867 S868 H873 E874 G875 L876 D877	Y831-C871 WeakPolarHBondContact CB-SG 3.37Å; C867-C871 PolarHBondContact O-N 3.32Å; C867-C871 PolarHBondContact O-SG 3.43Å; S868-C871 PolarHBondContact O-N 3.16Å; C871-H873 VanDerWaalsContact C-N 3.31Å; C871-H873 PolarHBondContact O-N 3.38Å; C871-E874 PolarHBondContact O-N 2.87Å; C871-G875 PolarHBondContact O-N 3.24Å; C871-L876 HydrophobicContact CB-CB 4.35Å; C871-L876 WeakPolarHBondContact O-CB 3.46Å; C871-L876 PolarHBondContact O-N 3.43Å; C871-D877 WeakPolarHBondContact CB-O 3.17Å
872	L	86.6	Confident	83.7	Confident	78 Å²	78	69 Å²	69	41%	0.408	37%	0.367	S	S	.	.	H	α-helix	trans	-63.3	-37.9	176.4	-68.3	170.5	0	0	0	111.8	S868 F869 Q870 E874 G875 Y883	S868-L872 WeakPolarHBondContact O-CG 3.4Å; S868-L872 PolarHBondContact O-N 2.94Å; S868-L872 VanDerWaalsContact O-N 3.16Å; F869-L872 WeakPolarHBondContact O-CB 3.38Å; F869-L872 PolarHBondContact O-N 3.45Å; Q870-L872 VanDerWaalsContact C-N 3.3Å; Q870-L872 PolarHBondContact O-N 3.04Å; L872-E874 VanDerWaalsContact C-N 3.28Å; L872-E874 PolarHBondContact O-N 3.36Å; L872-G875 PolarHBondContact O-N 2.97Å; L872-G875 VanDerWaalsContact O-N 3.15Å; L872-Y883 WeakPolarHBondContact CD2-OH 3.4Å
873	H	85.4	Confident	83.1	Confident	148 Å²	148	71.2 Å²	71.2	69%	0.685	37%	0.369	S	S	*	.	H	α-helix	trans	-67.5	-28.2	176.1	-165.8	-73.3	0	0	0	112.5	F869 Q870 C871 G875	F869-H873 PolarHBondContact O-N 3.13Å; Q870-H873 WeakPolarHBondContact O-CB 3.35Å; Q870-H873 PolarHBondContact O-N 3.29Å; C871-H873 VanDerWaalsContact C-N 3.31Å; C871-H873 PolarHBondContact O-N 3.38Å; H873-G875 VanDerWaalsContact C-N 3.27Å
874	E	82.1	Confident	82.1	Confident	107 Å²	107	78.8 Å²	78.8	50%	0.5	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	1.8	173.6	-66.9	-173	168	0	0	113.6	Q870 C871 L872	Q870-E874 PolarHBondContact O-N 2.92Å; C871-E874 PolarHBondContact O-N 2.87Å; L872-E874 VanDerWaalsContact C-N 3.28Å; L872-E874 PolarHBondContact O-N 3.36Å
875	G	82.3	Confident	80.6	Confident	46 Å²	46	89.3 Å²	89.3	47%	0.474	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.6	16.9	177.6	0	0	0	0	0	114.5	C871 L872 H873 Y883	C871-G875 PolarHBondContact O-N 3.24Å; L872-G875 PolarHBondContact O-N 2.97Å; L872-G875 VanDerWaalsContact O-N 3.15Å; H873-G875 VanDerWaalsContact C-N 3.27Å; G875-Y883 VanDerWaalsContact O-CD2 3.29Å; G875-Y883 WeakPolarHBondContact O-CD2 3.31Å; G875-Y883 WeakPolarHBondContact O-CE2 3.47Å
876	L	82.7	Confident	78.2	Confident	42 Å²	42	96.3 Å²	96.3	22%	0.22	47%	0.468	C	S	.	.	B	Isolated β-bridge	trans	-92.5	170.5	170.3	-56.9	168.6	0	0	0	109.8	C871 P882 Y883	C871-L876 HydrophobicContact CB-CB 4.35Å; C871-L876 WeakPolarHBondContact O-CB 3.46Å; C871-L876 PolarHBondContact O-N 3.43Å; L876-P882 HydrophobicContact CD2-CG 4.33Å; L876-Y883 WeakPolarHBondContact O-CE2 3.43Å; L876-Y883 PolarHBondContact O-OH 3.48Å; L876-Y883 VanDerWaalsContact O-OH 3.13Å
877	D	84.5	Confident	77.8	Confident	35 Å²	35	96.4 Å²	96.4	19%	0.187	47%	0.469	C	S	.	.			trans	-73.4	177	166.6	73	11.3	0	0	0	111.5	C871 F879 G880 L881 Y883	C871-D877 WeakPolarHBondContact CB-O 3.17Å; D877-F879 PolarHBondContact O-N 3.36Å; D877-F879 WeakPolarHBondContact OD1-CA 3.35Å; D877-F879 WeakPolarHBondContact OD1-CB 3.5Å; D877-F879 PolarHBondContact OD1-N 2.88Å; D877-G880 PolarHBondContact O-N 3.46Å; D877-G880 PolarHBondContact OD1-N 3.27Å; D877-L881 PolarHBondContact N-O 2.7Å; D877-L881 PolarHBondContact OD1-N 3.27Å; D877-Y883 HydrophobicContact CB-CD1 4.45Å; D877-Y883 HydrophobicContact CB-CE1 4.01Å
878	S	80.7	Confident	77.3	Confident	46 Å²	46	101.3 Å²	101.3	32%	0.322	49%	0.493	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-11.3	-179.9	53.3	0	0	0	0	114.3	S868	S868-S878 WeakPolarHBondContact CB-O 3.11Å; S868-S878 PolarHBondContact OG-O 3.4Å
879	F	77	Confident	76.8	Confident	117 Å²	117	104.8 Å²	104.8	51%	0.513	51%	0.505	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.4	4.2	-179.5	-58.1	-69.1	0	0	0	112.5	L835 D877 L881	L835-F879 HydrophobicContact CD1-CD1 3.89Å; L835-F879 HydrophobicContact CD1-CE1 4.4Å; L835-F879 HydrophobicContact CD2-CB 3.62Å; L835-F879 HydrophobicContact CD2-CD1 3.58Å; L835-F879 HydrophobicContact CD2-CG 4.05Å; L835-F879 HydrophobicContact CG-CD1 4.39Å; D877-F879 PolarHBondContact O-N 3.36Å; D877-F879 WeakPolarHBondContact OD1-CA 3.35Å; D877-F879 WeakPolarHBondContact OD1-CB 3.5Å; D877-F879 PolarHBondContact OD1-N 2.88Å; F879-L881 VanDerWaalsContact C-N 3.31Å
880	G	74.8	Confident	76.2	Confident	13 Å²	13	103.5 Å²	103.5	13%	0.134	50%	0.502	C	S	.	.	S	Bend	trans	78.3	11.8	-179.4	0	0	0	0	0	114.2	D877	D877-G880 PolarHBondContact O-N 3.46Å; D877-G880 PolarHBondContact OD1-N 3.27Å
881	L	78.3	Confident	75.5	Confident	107 Å²	107	106.7 Å²	106.7	56%	0.56	52%	0.518	S	S	*	.			trans	-89	143.2	176	-63.4	170.1	0	0	0	110.4	D877 F879 Y883	D877-L881 PolarHBondContact N-O 2.7Å; D877-L881 PolarHBondContact OD1-N 3.27Å; F879-L881 VanDerWaalsContact C-N 3.31Å; L881-Y883 PolarHBondContact O-N 3.24Å
882	P	78.2	Confident	75	Confident	93 Å²	93	113.5 Å²	113.5	60%	0.604	55%	0.551	S	S	*	*	B	Isolated β-bridge	trans	-60.5	133.3	170.9	-18.1	29.3	0	0	0	109.6	L876 R884	L876-P882 HydrophobicContact CD2-CG 4.33Å; P882-R884 PolarHBondContact O-N 3.31Å
883	Y	74.7	Confident	74.1	Confident	146 Å²	146	116.1 Å²	116.1	57%	0.573	56%	0.561	S	S	*	*			trans	-53	109.7	171.3	-70.6	-79.8	0	0	0	109.2	L872 G875 L876 D877 L881 R885	L872-Y883 WeakPolarHBondContact CD2-OH 3.4Å; G875-Y883 VanDerWaalsContact O-CD2 3.29Å; G875-Y883 WeakPolarHBondContact O-CD2 3.31Å; G875-Y883 WeakPolarHBondContact O-CE2 3.47Å; L876-Y883 WeakPolarHBondContact O-CE2 3.43Å; L876-Y883 PolarHBondContact O-OH 3.48Å; L876-Y883 VanDerWaalsContact O-OH 3.13Å; D877-Y883 HydrophobicContact CB-CD1 4.45Å; D877-Y883 HydrophobicContact CB-CE1 4.01Å; L881-Y883 PolarHBondContact O-N 3.24Å; Y883-R885 PolarHBondContact O-N 3.45Å
884	R	64.9	Low	73.3	Confident	236 Å²	236	113.6 Å²	113.6	89%	0.891	55%	0.552	S	S	*	*			trans	-60.9	113.8	169.3	-76.9	-173.2	-176.3	-178.7	2.9	106.3	P882 L886	P882-R884 PolarHBondContact O-N 3.31Å; R884-L886 PolarHBondContact O-N 3.12Å
885	R	54.1	Low	72.5	Confident	248 Å²	248	114.2 Å²	114.2	94%	0.936	56%	0.556	S	S	*	*			trans	-56.3	106.8	161.4	-75.8	-174.7	-177.2	179.7	1.4	106.2	Y883	Y883-R885 PolarHBondContact O-N 3.45Å
886	L	38.5	Very low	71.6	Confident	241 Å²	241	120.4 Å²	120.4	100%	1.262	56%	0.564	S	S	*	*			trans	-59.6	0	163.1	-88.8	162.1	0	0	0	109.8	R884	R884-L886 PolarHBondContact O-N 3.12Å

Retrieved 886 of 886 residues in 779.8 ms (Link to these results)

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