A0A5K4EZG3_SCHMA Loading...

BCL domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4EZG3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 741 aa.

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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	37.9	Very low	36.8	Very low	235 Å²	235	129.3 Å²	129.3	100%	1.158	78%	0.783	S	S	*	*				0	118.2	0	-62.2	156.7	75	0	0	106.6
2	S	34.8	Very low	36.3	Very low	99 Å²	99	133 Å²	133	69%	0.692	79%	0.786	S	S	*	*			cis	-154.8	115.6	-10.2	-74.9	0	0	0	0	107
3	T	35.3	Very low	36	Very low	113 Å²	113	130.2 Å²	130.2	69%	0.693	78%	0.777	S	S	*	*				73	115.6	110	62.7	0	0	0	0	118.2
4	N	36.3	Very low	35.6	Very low	158 Å²	158	130.9 Å²	130.9	85%	0.845	78%	0.775	S	S	*	*			trans	72.6	152.2	132.5	-51	0.7	0	0	0	118.7
5	G	39.9	Very low	35.4	Very low	62 Å²	62	132.7 Å²	132.7	64%	0.639	78%	0.779	S	S	*	*			cis	-142.4	165.2	-6.1	0	0	0	0	0	109.6
6	T	35	Very low	35.2	Very low	127 Å²	127	130.6 Å²	130.6	78%	0.779	77%	0.773	S	S	*	*				80.9	142	58.7	-41.6	0	0	0	0	113
7	D	38.5	Very low	34.9	Very low	140 Å²	140	135.8 Å²	135.8	75%	0.749	78%	0.776	S	S	*	*			trans	74.7	137.6	-177	-59.3	-10.1	0	0	0	115.5
8	D	39.7	Very low	34.9	Very low	147 Å²	147	136.4 Å²	136.4	79%	0.786	78%	0.783	S	S	*	*			cis	-162.7	162.9	-4.6	-126.7	-27.6	0	0	0	113.5
9	G	34	Very low	34.7	Very low	65 Å²	65	132.9 Å²	132.9	67%	0.67	77%	0.767	S	S	*	*			trans	61.6	112.2	139.9	0	0	0	0	0	122.2
10	P	41.2	Very low	34.7	Very low	126 Å²	126	133.6 Å²	133.6	82%	0.818	77%	0.774	S	S	*	*			trans	-92.1	164.9	171.6	38.3	-35	0	0	0	113.4
11	L	31.8	Very low	34.5	Very low	150 Å²	150	135.7 Å²	135.7	79%	0.785	77%	0.774	S	S	*	*			trans	-164.7	144.9	151.6	-104.7	166	0	0	0	111.6
12	E	31	Very low	34	Very low	174 Å²	174	130.8 Å²	130.8	81%	0.813	76%	0.757	S	S	*	*			trans	8.6	145.8	145.2	-72.3	174	166.2	0	0	120
13	S	32.1	Very low	34	Very low	96 Å²	96	131.2 Å²	131.2	67%	0.671	76%	0.76	S	S	*	*			cis	-170.2	163.7	14	43.1	0	0	0	0	113.4
14	D	30.4	Very low	33.5	Very low	140 Å²	140	135.6 Å²	135.6	75%	0.749	77%	0.77	S	S	*	*			trans	67.9	131	139	-76.6	-10.5	0	0	0	124.7
15	L	32.2	Very low	33.2	Very low	159 Å²	159	136.4 Å²	136.4	83%	0.832	77%	0.77	S	S	*	*			trans	72.7	138.1	149.9	-60	159.5	0	0	0	117.7
16	S	33.1	Very low	32.8	Very low	98 Å²	98	139 Å²	139	69%	0.685	77%	0.774	S	S	*	*			cis	-162.5	155.3	-1.7	46.8	0	0	0	0	112.5
17	W	30.2	Very low	32.4	Very low	219 Å²	219	140.5 Å²	140.5	83%	0.83	78%	0.776	S	S	*	*			trans	4.2	137.4	155.2	-63	82.1	0	0	0	119.6
18	V	33.9	Very low	32.1	Very low	148 Å²	148	139.8 Å²	139.8	90%	0.897	78%	0.782	S	S	*	*				-142.6	155.3	79.5	163.6	0	0	0	0	112.7
19	S	31	Very low	31.6	Very low	69 Å²	69	139.9 Å²	139.9	48%	0.483	78%	0.782	S	S	.	*			trans	-131.7	146.6	-174.8	93.5	0	0	0	0	115.1
20	T	34.9	Very low	32	Very low	146 Å²	146	141.6 Å²	141.6	90%	0.896	78%	0.781	S	S	*	*			trans	-164.8	88.1	152.8	20.6	0	0	0	0	107.2
21	K	31.7	Very low	31.5	Very low	179 Å²	179	140.9 Å²	140.9	78%	0.778	78%	0.78	S	S	*	*				84.6	83.6	53.1	-149.1	-179.2	-167	-173.5	0	114.3
22	T	27.6	Very low	31.6	Very low	132 Å²	132	140.6 Å²	140.6	81%	0.81	78%	0.779	S	S	*	*			trans	-73.2	165.8	155.3	40.4	0	0	0	0	111.2
23	S	33.2	Very low	31.6	Very low	107 Å²	107	137.3 Å²	137.3	75%	0.748	78%	0.775	S	S	*	*			trans	-154.3	109.2	164	-75	0	0	0	0	112.6
24	F	26.4	Very low	31.7	Very low	205 Å²	205	138.3 Å²	138.3	90%	0.899	78%	0.782	S	S	*	*			trans	-112.2	139.6	153.7	-81.2	-90.4	0	0	0	107.3
25	M	29.8	Very low	31.7	Very low	175 Å²	175	138.2 Å²	138.2	86%	0.862	79%	0.787	S	S	*	*			trans	-177.1	109.5	153	-107.3	172.2	172.2	0	0	109.8
26	T	30.3	Very low	31.7	Very low	117 Å²	117	136.6 Å²	136.6	72%	0.718	79%	0.786	S	S	*	*				86.9	107.7	91.7	53.5	0	0	0	0	116.1
27	I	26.9	Very low	31.5	Very low	159 Å²	159	138.4 Å²	138.4	82%	0.815	79%	0.788	S	S	*	*			trans	18.7	126.7	139.2	-54.2	170.5	0	0	0	117.9
28	S	32	Very low	31.7	Very low	125 Å²	125	132.5 Å²	132.5	87%	0.874	79%	0.786	S	S	*	*			trans	-148.7	138.6	142.6	-73.3	0	0	0	0	108.7
29	D	30.2	Very low	31.4	Very low	148 Å²	148	132.5 Å²	132.5	79%	0.791	78%	0.781	S	S	*	*			trans	-113.5	-172.4	-172.2	-155.1	26.2	0	0	0	109.6
30	P	41.5	Very low	31.5	Very low	101 Å²	101	134.8 Å²	134.8	66%	0.656	80%	0.797	S	S	*	*				-122	155.2	-100.8	37.6	-22.4	0	0	0	114.8
31	S	32.3	Very low	31.3	Very low	112 Å²	112	133.3 Å²	133.3	78%	0.783	79%	0.792	S	S	*	*			trans	-169.6	161.7	151.8	40.5	0	0	0	0	114.7
32	D	33.3	Very low	31.4	Very low	143 Å²	143	132.9 Å²	132.9	77%	0.765	80%	0.798	S	S	*	*			trans	76.4	82.6	157.9	-59.9	-10.7	0	0	0	121
33	S	30.8	Very low	31.6	Very low	106 Å²	106	133.2 Å²	133.2	74%	0.741	79%	0.794	S	S	*	*				41.5	116.2	119.3	66.8	0	0	0	0	120.3
34	S	33.9	Very low	31.6	Very low	117 Å²	117	137.3 Å²	137.3	82%	0.818	80%	0.802	S	S	*	*				177.4	126.6	107.1	41	0	0	0	0	112.6
35	T	29.9	Very low	31.7	Very low	138 Å²	138	132.4 Å²	132.4	85%	0.847	79%	0.789	S	S	*	*			trans	-72.9	152	160.5	50.1	0	0	0	0	110
36	P	33.3	Very low	31.8	Very low	124 Å²	124	133.7 Å²	133.7	81%	0.805	79%	0.79	S	S	*	*				-136.4	150.8	114.3	35.7	-25.1	0	0	0	115
37	N	28.1	Very low	31.8	Very low	137 Å²	137	131.8 Å²	131.8	73%	0.733	79%	0.786	S	S	*	*			trans	-80.1	139.4	176.6	-171.5	14.6	0	0	0	110.9
38	A	33.9	Very low	32	Very low	95 Å²	95	129.5 Å²	129.5	79%	0.785	78%	0.784	S	S	*	*			trans	-152.6	102.2	169.3	0	0	0	0	0	111.8
39	N	28.3	Very low	32	Very low	148 Å²	148	131.1 Å²	131.1	79%	0.791	78%	0.783	S	S	*	*			trans	-77.3	135.4	170.5	-57	-37.8	0	0	0	110.2
40	S	34.1	Very low	32	Very low	117 Å²	117	133.3 Å²	133.3	82%	0.818	79%	0.785	S	S	*	*			trans	-148.2	109	156.9	60.5	0	0	0	0	110.8
41	S	29.9	Very low	31.4	Very low	114 Å²	114	135 Å²	135	80%	0.797	78%	0.783	S	S	*	*			trans	-63.3	149.9	166	52.7	0	0	0	0	111.7
42	L	33.5	Very low	31.3	Very low	171 Å²	171	134.3 Å²	134.3	90%	0.895	78%	0.778	S	S	*	*			trans	-157.6	134.3	136.7	-109.1	160.2	0	0	0	110.1
43	D	31.2	Very low	31.5	Very low	138 Å²	138	132.3 Å²	132.3	74%	0.738	77%	0.772	S	S	*	*			trans	-61.3	152.4	171.9	-73.2	-70.5	0	0	0	112
44	E	34	Very low	31.5	Very low	193 Å²	193	134 Å²	134	90%	0.902	77%	0.774	S	S	*	*				-153	150.2	116.8	-117.6	177.1	-169.3	0	0	112.4
45	T	29.5	Very low	31.5	Very low	103 Å²	103	133.4 Å²	133.4	63%	0.632	77%	0.769	S	S	*	*			trans	-124	128.9	-160.4	-69	0	0	0	0	112.1
46	F	30.6	Very low	31.4	Very low	202 Å²	202	137.1 Å²	137.1	89%	0.886	77%	0.774	S	S	*	*			trans	-150.4	97.7	154.7	-79.5	-74	0	0	0	109.3
47	A	31.6	Very low	31.2	Very low	76 Å²	76	141.7 Å²	141.7	63%	0.628	78%	0.775	S	S	*	*				73.3	97.7	92.3	0	0	0	0	0	114
48	S	31	Very low	31.4	Very low	112 Å²	112	142.4 Å²	142.4	78%	0.783	78%	0.779	S	S	*	*				83.8	125.6	93.3	-65.2	0	0	0	0	113.5
49	N	30.6	Very low	31.3	Very low	158 Å²	158	142.9 Å²	142.9	85%	0.845	78%	0.776	S	S	*	*				-157.3	160.3	61.9	-94.9	-28	0	0	0	114.5
50	K	30.7	Very low	31.4	Very low	194 Å²	194	141.3 Å²	141.3	84%	0.843	78%	0.777	S	S	*	*			trans	-104.2	168	166.1	-63.2	-179.2	173.2	-172.6	0	110.8
51	F	28.6	Very low	31.6	Very low	138 Å²	138	142.2 Å²	142.2	61%	0.605	78%	0.78	S	S	*	*			trans	-166.8	145.3	133.6	-107.7	-61.2	0	0	0	117.6	P434	F51-P434 HydrophobicContact CB-CG 3.96Å; F51-P434 HydrophobicContact CD1-CB 3.73Å; F51-P434 HydrophobicContact CD1-CG 3.1Å; F51-P434 HydrophobicContact CD2-CG 3.92Å; F51-P434 HydrophobicContact CE1-CB 3.88Å; F51-P434 HydrophobicContact CE1-CG 3.45Å; F51-P434 VanDerWaalsContact CE1-CG 3.45Å; F51-P434 HydrophobicContact CE2-CG 4.21Å; F51-P434 HydrophobicContact CG-CB 4.45Å; F51-P434 HydrophobicContact CG-CG 3.37Å; F51-P434 HydrophobicContact CZ-CG 4Å
52	S	30.9	Very low	31.7	Very low	96 Å²	96	145.4 Å²	145.4	67%	0.671	78%	0.78	S	S	*	*			trans	-169.5	-178.1	172.2	-29.4	0	0	0	0	107.7
53	P	37.5	Very low	31.9	Very low	101 Å²	101	142.9 Å²	142.9	66%	0.656	78%	0.776	S	S	*	*			cis	-129.6	-155.7	-14	43.1	-24.6	0	0	0	111.4
54	N	31.7	Very low	32.1	Very low	143 Å²	143	142.4 Å²	142.4	77%	0.765	77%	0.773	S	S	*	*			trans	155.3	133.8	140.9	-75.4	-24.7	0	0	0	110.4
55	S	32.2	Very low	32.4	Very low	103 Å²	103	142.1 Å²	142.1	72%	0.72	77%	0.772	S	S	*	*			cis	84.1	113.2	29.1	-171.1	0	0	0	0	116.5
56	F	29.3	Very low	32.9	Very low	216 Å²	216	144.9 Å²	144.9	95%	0.947	78%	0.782	S	S	*	*			trans	-142.7	147.7	160	-106.4	-81.6	0	0	0	113.3
57	R	29.1	Very low	33.3	Very low	220 Å²	220	144.4 Å²	144.4	83%	0.83	78%	0.783	S	S	*	*			trans	-94.3	158.5	-172.6	-71.3	167.9	152.6	-170.5	-6	114
58	N	31.6	Very low	33.8	Very low	153 Å²	153	147.4 Å²	147.4	82%	0.818	79%	0.788	S	S	*	*				168.7	155.7	125.3	-85.3	-28.6	0	0	0	110.3
59	S	32.6	Very low	34.2	Very low	104 Å²	104	149.4 Å²	149.4	73%	0.727	79%	0.79	S	S	*	*			cis	-166.3	157.6	-25.2	-99.5	0	0	0	0	110.2
60	S	29.5	Very low	34.7	Very low	115 Å²	115	148.3 Å²	148.3	80%	0.804	79%	0.785	S	S	*	*			trans	-87.2	171.1	173.2	-46.6	0	0	0	0	112.4
61	P	38.6	Very low	35	Very low	136 Å²	136	149 Å²	149	88%	0.883	78%	0.783	S	S	*	*				-147.8	-172.2	89.2	39.6	-21.1	0	0	0	115.5
62	K	31.7	Very low	35.6	Very low	182 Å²	182	149.2 Å²	149.2	79%	0.791	79%	0.79	S	S	*	*			trans	-131.6	154.3	-170.7	-170.7	-172	-177.1	-163.1	0	109.6
63	S	37.9	Very low	35.8	Very low	118 Å²	118	152 Å²	152	83%	0.825	80%	0.798	S	S	*	*			trans	-150.3	140.1	170.1	52.7	0	0	0	0	111.9
64	D	34.5	Very low	35.8	Very low	127 Å²	127	150.6 Å²	150.6	68%	0.679	80%	0.802	S	S	*	*			trans	-112.4	153	-172.6	-47.2	-75.2	0	0	0	111.9
65	E	40.1	Very low	36	Very low	187 Å²	187	151.8 Å²	151.8	87%	0.874	81%	0.808	S	S	*	*			trans	177.6	111.9	155	-102.7	165.3	179.9	0	0	107
66	L	40.2	Very low	36.3	Very low	161 Å²	161	156.1 Å²	156.1	84%	0.843	81%	0.814	S	S	*	*				64.5	105.8	75	-69.2	-179.9	0	0	0	115.5
67	E	39.6	Very low	36.8	Very low	192 Å²	192	153.3 Å²	153.3	90%	0.897	81%	0.809	S	S	*	*				177.6	165.7	113.8	-97.5	-172.7	176.6	0	0	112.9
68	D	41.3	Very low	37.2	Very low	140 Å²	140	152.9 Å²	152.9	75%	0.749	81%	0.813	S	S	*	*			trans	-80.9	162.3	-164.6	-55.7	-67	0	0	0	115.6
69	N	39.6	Very low	37.3	Very low	153 Å²	153	153.8 Å²	153.8	82%	0.818	81%	0.812	S	S	*	*				162.1	112.7	114.1	-84	-68.9	0	0	0	113.7
70	D	41.1	Very low	37.3	Very low	136 Å²	136	157.1 Å²	157.1	73%	0.727	82%	0.816	S	S	*	*			trans	24.2	135.2	136.9	-96.8	-5.8	0	0	0	124.7
71	Y	37.4	Very low	37.2	Very low	209 Å²	209	159.8 Å²	159.8	82%	0.82	82%	0.816	S	S	*	*			trans	77.1	127	145.4	-84.5	-76.3	0	0	0	124.6
72	D	41.6	Very low	36.8	Very low	141 Å²	141	158 Å²	158	75%	0.754	80%	0.803	S	S	*	*			trans	102.3	150.8	142.6	-142	6.3	0	0	0	119.4
73	N	35.9	Very low	36.7	Very low	156 Å²	156	158.3 Å²	158.3	83%	0.834	80%	0.804	S	S	*	*			trans	-76.5	148.4	-149.3	-69.6	-86.8	0	0	0	115.2
74	G	36.7	Very low	36.4	Very low	71 Å²	71	160.7 Å²	160.7	73%	0.732	80%	0.802	S	S	*	*			trans	-168.4	113.3	164.9	0	0	0	0	0	112.2	K76	G74-K76 PolarHBondContact O-N 2.8Å
75	D	34.9	Very low	36.1	Very low	167 Å²	167	163.1 Å²	163.1	89%	0.893	81%	0.806	S	S	*	*			trans	-52.5	125.8	172.3	-73.4	-52.2	0	0	0	111.4
76	K	39.9	Very low	35.9	Very low	194 Å²	194	161.5 Å²	161.5	84%	0.843	80%	0.796	S	S	*	*			trans	-145.2	124	151.6	-72.8	-161.6	177.4	175.6	0	110.7	G74 K78	G74-K76 PolarHBondContact O-N 2.8Å; K76-K78 PolarHBondContact O-N 3.42Å
77	D	38.4	Very low	35.6	Very low	157 Å²	157	160.9 Å²	160.9	84%	0.84	79%	0.787	S	S	*	*			trans	-57.6	131.1	179.6	-49.4	-83.9	0	0	0	111.5	E79	D77-E79 VanDerWaalsContact C-N 3.33Å; D77-E79 PolarHBondContact O-N 2.9Å
78	K	38.2	Very low	35.8	Very low	211 Å²	211	156.7 Å²	156.7	92%	0.917	77%	0.774	S	S	*	*			trans	-89.1	82	161.7	-72.6	-172.7	179.9	179.3	0	107.9	K76 E80	K76-K78 PolarHBondContact O-N 3.42Å; K78-E80 VanDerWaalsContact C-N 3.34Å; K78-E80 PolarHBondContact O-N 2.87Å
79	E	34.1	Very low	35.9	Very low	172 Å²	172	151.4 Å²	151.4	80%	0.804	75%	0.753	S	S	*	*			trans	-66.4	94.5	172	-158.7	172.9	-143.1	0	0	108.6	D77 Q81	D77-E79 VanDerWaalsContact C-N 3.33Å; D77-E79 PolarHBondContact O-N 2.9Å; E79-Q81 PolarHBondContact O-N 3.29Å
80	E	31.8	Very low	36.4	Very low	174 Å²	174	144.6 Å²	144.6	81%	0.813	72%	0.716	S	S	*	*			trans	-67	102.7	176.4	-173.2	167.8	-145	0	0	108.1	K78 V82	K78-E80 VanDerWaalsContact C-N 3.34Å; K78-E80 PolarHBondContact O-N 2.87Å; E80-V82 VanDerWaalsContact C-N 3.27Å; E80-V82 PolarHBondContact O-N 3.36Å
81	Q	27.9	Very low	36.8	Very low	171 Å²	171	140.1 Å²	140.1	80%	0.799	69%	0.694	S	S	*	*			trans	-67.3	86.1	-178.1	-74.7	-162.5	18.8	0	0	111.4	E79 K83	E79-Q81 PolarHBondContact O-N 3.29Å; Q81-K83 VanDerWaalsContact C-N 3.32Å; Q81-K83 PolarHBondContact O-N 3.16Å
82	V	30	Very low	37.6	Very low	99 Å²	99	130.2 Å²	130.2	60%	0.6	66%	0.655	S	S	*	*			trans	-63.4	95.2	161.9	179.7	0	0	0	0	107.5	E80 H84	E80-V82 VanDerWaalsContact C-N 3.27Å; E80-V82 PolarHBondContact O-N 3.36Å; V82-H84 VanDerWaalsContact C-N 3.3Å; V82-H84 PolarHBondContact O-N 3.34Å
83	K	30.7	Very low	38.2	Very low	188 Å²	188	125 Å²	125	82%	0.817	63%	0.628	S	S	*	*			trans	-59.6	96.3	164.6	-84.2	-174.4	175.3	179.5	0	108.1	Q81 K85	Q81-K83 VanDerWaalsContact C-N 3.32Å; Q81-K83 PolarHBondContact O-N 3.16Å; K83-K85 VanDerWaalsContact C-N 3.34Å; K83-K85 PolarHBondContact O-N 3.32Å
84	H	29.8	Very low	39.1	Very low	168 Å²	168	118.3 Å²	118.3	78%	0.778	59%	0.591	S	S	*	*			trans	-61.5	95.5	170.1	-71.1	-70.1	0	0	0	109.1	V82 K86	V82-H84 VanDerWaalsContact C-N 3.3Å; V82-H84 PolarHBondContact O-N 3.34Å; H84-K86 PolarHBondContact O-N 2.87Å
85	K	29.8	Very low	40	Very low	179 Å²	179	117 Å²	117	78%	0.778	57%	0.574	S	S	*	*			trans	-63	97.2	173.8	-157	172.5	-176	179.7	0	107.1	K83 K87	K83-K85 VanDerWaalsContact C-N 3.34Å; K83-K85 PolarHBondContact O-N 3.32Å; K85-K87 PolarHBondContact O-N 3.47Å
86	K	34.3	Very low	41.1	Very low	153 Å²	153	109.9 Å²	109.9	67%	0.665	54%	0.536	S	S	*	.	P	Polyproline II helix	trans	-46.5	124.2	178.1	-102.4	179.3	166.4	-177.9	0	108.3	H84 T88 D671	H84-K86 PolarHBondContact O-N 2.87Å; K86-T88 PolarHBondContact O-N 3.17Å; K86-D671 IonicContact NZ-OD1 3.07Å; K86-D671 PolarHBondContact NZ-OD1 3.44Å; K86-D671 IonicContact NZ-OD2 3.06Å; K86-D671 PolarHBondContact NZ-OD2 3.43Å
87	K	35.4	Very low	41.7	Very low	148 Å²	148	108 Å²	108	64%	0.643	53%	0.531	S	S	*	.	P	Polyproline II helix	trans	-65.8	116	-177.3	-72.3	-172.8	175.7	-175.7	0	110.4	K85 Q126	K85-K87 PolarHBondContact O-N 3.47Å; K87-Q126 PolarHBondContact NZ-O 3.32Å
88	T	42.7	Very low	41.9	Very low	104 Å²	104	107.2 Å²	107.2	64%	0.638	52%	0.52	S	S	*	.	P	Polyproline II helix	trans	-72.1	132.2	176.5	-18.4	0	0	0	0	110.9	K86 M569	K86-T88 PolarHBondContact O-N 3.17Å; T88-M569 HydrophobicContact CG2-CE 3.96Å
89	G	44.8	Very low	41.6	Very low	28 Å²	28	101.4 Å²	101.4	29%	0.289	51%	0.506	S	S	.	.			trans	-166.6	150.8	176.9	0	0	0	0	0	111.7
90	I	49	Very low	41.5	Very low	10 Å²	10	97.3 Å²	97.3	5%	0.051	50%	0.501	C	S	.	.			trans	-83.6	117.8	-175.4	-52.1	-177.4	0	0	0	109.8	L92 E565 I566 M569 Y570	I90-L92 HydrophobicContact CG2-CD1 4.25Å; I90-L92 HydrophobicContact CG2-CD2 3.68Å; I90-L92 HydrophobicContact CG2-CG 3.76Å; I90-E565 HydrophobicContact CB-CG 4.34Å; I90-E565 HydrophobicContact CD1-CG 4.07Å; I90-E565 HydrophobicContact CG1-CG 3.93Å; I90-E565 HydrophobicContact CG2-CG 3.67Å; I90-I566 HydrophobicContact CD1-CB 4.46Å; I90-I566 HydrophobicContact CD1-CG1 3.59Å; I90-M569 HydrophobicContact CD1-CE 4.46Å; I90-M569 HydrophobicContact CD1-SD 4.41Å; I90-M569 HydrophobicContact CG1-CE 3.54Å; I90-M569 HydrophobicContact CG1-SD 3.85Å; I90-Y570 HydrophobicContact CD1-CE2 4.34Å
91	T	50.8	Low	41.3	Very low	42 Å²	42	95.9 Å²	95.9	26%	0.258	50%	0.499	S	S	.	.			trans	-93.8	110.5	171.7	-61	0	0	0	0	109.9	I121 H667	T91-I121 HydrophobicContact CG2-CG2 4.06Å; T91-H667 PolarHBondContact O-N 3.47Å
92	L	53.7	Low	41.4	Very low	2 Å²	2	95.2 Å²	95.2	1%	0.01	50%	0.5	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	128.6	174.9	-58.6	176.5	0	0	0	109.3	I90 I122 L468 I562 R665	I90-L92 HydrophobicContact CG2-CD1 4.25Å; I90-L92 HydrophobicContact CG2-CD2 3.68Å; I90-L92 HydrophobicContact CG2-CG 3.76Å; L92-I122 HydrophobicContact CB-CD1 4.04Å; L92-L468 HydrophobicContact CB-CD2 4.42Å; L92-L468 HydrophobicContact CD1-CD1 3.68Å; L92-L468 HydrophobicContact CD1-CD2 3.63Å; L92-L468 HydrophobicContact CD1-CG 3.8Å; L92-I562 HydrophobicContact CD1-CD1 4.34Å; L92-I562 HydrophobicContact CD1-CG1 4.43Å; L92-I562 HydrophobicContact CD1-CG2 3.93Å; L92-I562 HydrophobicContact CD2-CD1 4.49Å; L92-I562 HydrophobicContact CD2-CG1 3.95Å; L92-I562 HydrophobicContact CD2-CG2 4.34Å; L92-R665 WeakPolarHBondContact CA-O 3.2Å
93	V	53.5	Low	41.2	Very low	31 Å²	31	98.7 Å²	98.7	19%	0.188	51%	0.507	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	128.2	-176.9	176.7	0	0	0	0	109.4	V119 R665 H667	V93-V119 HydrophobicContact CG1-CG1 4.35Å; V93-R665 PolarHBondContact N-O 3.22Å; V93-R665 PolarHBondContact O-N 3.19Å; V93-H667 HydrophobicContact CG2-CB 3.87Å
94	Y	54.7	Low	41.3	Very low	16 Å²	16	98.9 Å²	98.9	6%	0.063	51%	0.508	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	121.2	169	-178.2	-93.4	0	0	0	109.8	P96 I120 V470 S472 F663 L664	Y94-P96 HydrophobicContact CD1-CG 4.48Å; Y94-P96 HydrophobicContact CE1-CB 4.02Å; Y94-P96 HydrophobicContact CE1-CG 3.86Å; Y94-I120 HydrophobicContact CG-CD1 4.33Å; Y94-V470 HydrophobicContact CD2-CG1 3.56Å; Y94-V470 HydrophobicContact CE2-CG1 3.85Å; Y94-V470 HydrophobicContact CG-CG1 4.28Å; Y94-S472 WeakPolarHBondContact CE1-OG 3.42Å; Y94-S472 WeakPolarHBondContact CE2-OG 3.22Å; Y94-S472 PolarHBondContact OH-OG 2.8Å; Y94-F663 WeakPolarHBondContact CA-O 3.46Å; Y94-F663 HydrophobicContact CD2-CB 3.64Å; Y94-F663 HydrophobicContact CE2-CB 3.38Å; Y94-F663 AromaticContact CE2-CD2 3.69Å; Y94-F663 HydrophobicContact CE2-CD2 3.69Å; Y94-F663 AromaticContact CE2-CG 3.85Å; Y94-F663 HydrophobicContact CE2-CG 3.85Å; Y94-F663 HydrophobicContact CG-CB 4.43Å; Y94-F663 AromaticContact CZ-CD2 3.88Å; Y94-L664 HydrophobicContact CD2-CD2 4.26Å
95	A	56.6	Low	41.2	Very low	43 Å²	43	96.3 Å²	96.3	36%	0.355	51%	0.509	S	S	.	.			trans	-133.1	99.3	178.7	0	0	0	0	0	110.2	F663	A95-F663 PolarHBondContact N-O 3.46Å; A95-F663 WeakPolarHBondContact O-CD1 3.21Å
96	P	56.9	Low	41.2	Very low	17 Å²	17	92.7 Å²	92.7	11%	0.11	51%	0.506	C	S	.	.			trans	-73.9	139.1	173.6	32.1	-31.6	0	0	0	110	Y94 K98 L115 F663	Y94-P96 HydrophobicContact CD1-CG 4.48Å; Y94-P96 HydrophobicContact CE1-CB 4.02Å; Y94-P96 HydrophobicContact CE1-CG 3.86Å; P96-K98 PolarHBondContact O-N 2.84Å; P96-L115 HydrophobicContact CB-CD2 4.38Å; P96-L115 HydrophobicContact CG-CD2 4.5Å; P96-F663 HydrophobicContact CB-CD1 4.42Å; P96-F663 HydrophobicContact CB-CE1 4.39Å
97	E	52.1	Low	41.1	Very low	156 Å²	156	94 Å²	94	73%	0.729	51%	0.514	S	S	*	.			trans	-63.1	130.3	174.4	-68.7	-169.4	153.4	0	0	110.6	S99 L115	E97-S99 PolarHBondContact O-N 3.42Å; E97-S99 VanDerWaalsContact O-N 3.13Å; E97-L115 WeakPolarHBondContact O-CD2 3.11Å
98	K	43	Very low	40.7	Very low	139 Å²	139	94.5 Å²	94.5	60%	0.604	52%	0.524	S	S	*	.			trans	-66.7	110.9	169.2	-77	167.3	173.3	148.8	0	107.4	P96 A100 E117	P96-K98 PolarHBondContact O-N 2.84Å; K98-A100 PolarHBondContact O-N 3.37Å; K98-E117 VanDerWaalsContact CE-OE1 3.3Å; K98-E117 WeakPolarHBondContact CE-OE1 3.23Å; K98-E117 WeakPolarHBondContact CE-OE2 3.37Å; K98-E117 IonicContact NZ-OE1 3.6Å; K98-E117 PolarHBondContact NZ-OE1 3.5Å; K98-E117 IonicContact NZ-OE2 2.66Å; K98-E117 PolarHBondContact NZ-OE2 3.16Å
99	S	32.8	Very low	39.9	Very low	89 Å²	89	95 Å²	95	62%	0.622	53%	0.532	S	S	*	.			trans	-53.3	106.8	177.9	54.1	0	0	0	0	110.2	E97 N101	E97-S99 PolarHBondContact O-N 3.42Å; E97-S99 VanDerWaalsContact O-N 3.13Å; S99-N101 PolarHBondContact O-N 3.37Å
100	A	30.5	Very low	39.1	Very low	86 Å²	86	101.5 Å²	101.5	71%	0.711	56%	0.558	S	S	*	*			trans	-61.8	119.6	173.4	0	0	0	0	0	108.2	K98 I102	K98-A100 PolarHBondContact O-N 3.37Å; A100-I102 VanDerWaalsContact C-N 3.31Å; A100-I102 PolarHBondContact O-N 3Å
101	N	28.5	Very low	38.1	Very low	145 Å²	145	106.3 Å²	106.3	78%	0.775	59%	0.588	S	S	*	*			trans	-68.2	85.1	-177.6	-73.5	-47.6	0	0	0	111	S99 F103	S99-N101 PolarHBondContact O-N 3.37Å; N101-F103 PolarHBondContact O-N 3.01Å
102	I	29.2	Very low	37	Very low	157 Å²	157	109.6 Å²	109.6	81%	0.805	61%	0.61	S	S	*	*			trans	-89	62.9	162.1	-50.6	-177	0	0	0	108	A100 K104	A100-I102 VanDerWaalsContact C-N 3.31Å; A100-I102 PolarHBondContact O-N 3Å; I102-K104 PolarHBondContact O-N 3.48Å
103	F	27.1	Very low	35.8	Very low	172 Å²	172	114.8 Å²	114.8	75%	0.754	65%	0.646	S	S	*	*			trans	-86.8	97.1	168.2	-122.9	-83.6	0	0	0	108	N101	N101-F103 PolarHBondContact O-N 3.01Å
104	K	32.3	Very low	34.6	Very low	192 Å²	192	121.4 Å²	121.4	84%	0.835	68%	0.675	S	S	*	*			trans	-109.9	104	159.5	-90.5	-169.7	174.6	-177.2	0	109.3	I102	I102-K104 PolarHBondContact O-N 3.48Å
105	S	27.5	Very low	33.6	Very low	114 Å²	114	125.2 Å²	125.2	80%	0.797	70%	0.696	S	S	*	*	S	Bend	trans	60.8	83.8	150	-51.6	0	0	0	0	119.2
106	S	30.6	Very low	32.5	Very low	103 Å²	103	128.8 Å²	128.8	72%	0.72	71%	0.709	S	S	*	*				-157.6	146.6	116.4	60	0	0	0	0	110.5
107	E	30.6	Very low	31.1	Very low	180 Å²	180	133.6 Å²	133.6	84%	0.841	73%	0.73	S	S	*	*			trans	-80.3	164.1	-169.6	-63.2	171.9	129.5	0	0	112.9
108	N	28	Very low	30.2	Very low	159 Å²	159	131 Å²	131	85%	0.85	72%	0.716	S	S	*	*			trans	80.8	66.5	168	-54.1	-38.3	0	0	0	119.3
109	S	26.7	Very low	29.7	Very low	114 Å²	114	129 Å²	129	80%	0.797	72%	0.716	S	S	*	*				-163.9	117	121.8	-168.7	0	0	0	0	111.3	V111	S109-V111 PolarHBondContact O-N 3.45Å
110	I	26.5	Very low	29.7	Very low	165 Å²	165	125.8 Å²	125.8	85%	0.846	69%	0.691	S	S	*	*			trans	-92.9	95.5	-178.4	-58.9	170.5	0	0	0	109.7
111	V	28.5	Very low	29.9	Very low	110 Å²	110	125.6 Å²	125.6	67%	0.667	68%	0.678	S	S	*	*			trans	-140.7	104.2	156.7	-175.1	0	0	0	0	109.1	S109 S113	S109-V111 PolarHBondContact O-N 3.45Å; V111-S113 PolarHBondContact O-N 3.48Å; V111-S113 VanDerWaalsContact O-N 3.1Å
112	P	27.4	Very low	30.2	Very low	111 Å²	111	119.2 Å²	119.2	72%	0.721	64%	0.644	S	S	*	*			trans	-75.4	98.7	170	30.2	-31.2	0	0	0	109	Q114	P112-Q114 PolarHBondContact O-N 2.92Å
113	S	28.4	Very low	30.3	Very low	112 Å²	112	120.5 Å²	120.5	78%	0.783	64%	0.638	S	S	*	*			trans	-60.9	104.2	171.6	-67.6	0	0	0	0	110	V111 L115	V111-S113 PolarHBondContact O-N 3.48Å; V111-S113 VanDerWaalsContact O-N 3.1Å; S113-L115 PolarHBondContact O-N 3.25Å
114	Q	29.3	Very low	30.5	Very low	169 Å²	169	114.1 Å²	114.1	79%	0.79	62%	0.615	S	S	*	*			trans	-67.5	105.6	177.1	-68.1	-147.7	-26	0	0	110.4	P112 N116	P112-Q114 PolarHBondContact O-N 2.92Å; Q114-N116 VanDerWaalsContact C-N 3.28Å; Q114-N116 PolarHBondContact O-N 3Å
115	L	33.3	Very low	30.4	Very low	97 Å²	97	110.4 Å²	110.4	51%	0.508	60%	0.604	S	S	.	*			trans	-74.6	82.6	174.4	-167.7	76.2	0	0	0	109.1	P96 E97 S113 E117	P96-L115 HydrophobicContact CB-CD2 4.38Å; P96-L115 HydrophobicContact CG-CD2 4.5Å; E97-L115 WeakPolarHBondContact O-CD2 3.11Å; S113-L115 PolarHBondContact O-N 3.25Å; L115-E117 PolarHBondContact O-N 3.3Å; L115-E117 VanDerWaalsContact O-N 3.11Å
116	N	32.4	Very low	30.6	Very low	117 Å²	117	111.4 Å²	111.4	63%	0.626	60%	0.596	S	S	*	*			trans	-63.8	113.4	-178.5	-73.1	-2.8	0	0	0	111.1	Q114 K118	Q114-N116 VanDerWaalsContact C-N 3.28Å; Q114-N116 PolarHBondContact O-N 3Å; N116-K118 PolarHBondContact O-N 2.78Å
117	E	28.9	Very low	30.4	Very low	119 Å²	119	109 Å²	109	56%	0.556	59%	0.588	S	S	*	*			trans	-65.2	86.6	179.4	-161.6	160.4	-146.4	0	0	110.4	K98 L115 V119	K98-E117 VanDerWaalsContact CE-OE1 3.3Å; K98-E117 WeakPolarHBondContact CE-OE1 3.23Å; K98-E117 WeakPolarHBondContact CE-OE2 3.37Å; K98-E117 IonicContact NZ-OE1 3.6Å; K98-E117 PolarHBondContact NZ-OE1 3.5Å; K98-E117 IonicContact NZ-OE2 2.66Å; K98-E117 PolarHBondContact NZ-OE2 3.16Å; L115-E117 PolarHBondContact O-N 3.3Å; L115-E117 VanDerWaalsContact O-N 3.11Å; E117-V119 PolarHBondContact O-N 3.18Å
118	K	33.5	Very low	30.2	Very low	100 Å²	100	107 Å²	107	44%	0.435	58%	0.582	S	S	.	*			trans	-84.1	92.8	179	-80.4	-168.7	-178.1	-177.6	0	111.4	N116 I120 V471	N116-K118 PolarHBondContact O-N 2.78Å; K118-I120 PolarHBondContact O-N 3.36Å; K118-I120 VanDerWaalsContact O-N 3.16Å; K118-V471 PolarHBondContact NZ-O 3.22Å
119	V	32	Very low	30.1	Very low	97 Å²	97	106.7 Å²	106.7	59%	0.588	58%	0.58	S	S	*	*			trans	-64.6	112.8	162.2	-179.8	0	0	0	0	108.7	V93 E117 I121	V93-V119 HydrophobicContact CG1-CG1 4.35Å; E117-V119 PolarHBondContact O-N 3.18Å; V119-I121 HydrophobicContact CG1-CG1 4.18Å
120	I	33.4	Very low	30	Very low	22 Å²	22	105.2 Å²	105.2	11%	0.113	56%	0.564	C	S	.	*			trans	-95.8	131.8	170.6	-59.5	178.3	0	0	0	107.3	Y94 K118 I122 R469 V470 V471	Y94-I120 HydrophobicContact CG-CD1 4.33Å; K118-I120 PolarHBondContact O-N 3.36Å; K118-I120 VanDerWaalsContact O-N 3.16Å; I120-I122 HydrophobicContact CG2-CD1 4.34Å; I120-I122 HydrophobicContact CG2-CG1 4.17Å; I120-R469 WeakPolarHBondContact CG2-O 3.27Å; I120-V470 HydrophobicContact CD1-CG1 4.1Å; I120-V471 HydrophobicContact CD1-CB 4.31Å; I120-V471 HydrophobicContact CD1-CG2 4.29Å; I120-V471 VanDerWaalsContact CD1-N 3.32Å
121	I	33.9	Very low	30.1	Very low	83 Å²	83	104.6 Å²	104.6	43%	0.426	56%	0.562	S	S	.	*			trans	-116.2	108.9	172.9	-59.4	175.4	0	0	0	107.2	T91 V119 R123	T91-I121 HydrophobicContact CG2-CG2 4.06Å; V119-I121 HydrophobicContact CG1-CG1 4.18Å; I121-R123 HydrophobicContact CG2-CG 4.18Å
122	I	34.6	Very low	29.9	Very low	11 Å²	11	104.7 Å²	104.7	6%	0.056	55%	0.551	C	S	.	*			trans	-83.7	132.3	173.8	-70.7	142.8	0	0	0	108.8	L92 I120 D467 L468	L92-I122 HydrophobicContact CB-CD1 4.04Å; I120-I122 HydrophobicContact CG2-CD1 4.34Å; I120-I122 HydrophobicContact CG2-CG1 4.17Å; I122-D467 WeakPolarHBondContact CG2-O 3.46Å; I122-L468 HydrophobicContact CD1-CB 4.37Å; I122-L468 HydrophobicContact CD1-CD2 3.51Å; I122-L468 HydrophobicContact CD1-CG 3.88Å
123	R	30.8	Very low	30	Very low	183 Å²	183	106 Å²	106	69%	0.691	56%	0.557	S	S	*	*			trans	-128.8	140.7	176.1	-66.3	-172.9	175.2	92	-2.5	108.9	I121 D125	I121-R123 HydrophobicContact CG2-CG 4.18Å; R123-D125 PolarHBondContact O-N 3.47Å
124	S	31.8	Very low	29.9	Very low	39 Å²	39	108.3 Å²	108.3	27%	0.273	56%	0.555	S	S	.	*			trans	-72.5	118.4	169.8	-179.9	0	0	0	0	109.3
125	D	30.7	Very low	29.7	Very low	114 Å²	114	106.8 Å²	106.8	61%	0.61	55%	0.553	S	S	*	*			trans	-94.1	105.5	170.3	-166.6	10.5	0	0	0	110.1	R123 G127 N465	R123-D125 PolarHBondContact O-N 3.47Å; D125-G127 PolarHBondContact OD1-N 2.84Å; D125-N465 PolarHBondContact O-ND2 2.86Å; D125-N465 VanDerWaalsContact O-ND2 3.12Å
126	Q	31.1	Very low	29.6	Very low	134 Å²	134	109.1 Å²	109.1	63%	0.626	57%	0.566	S	S	*	*			trans	-98.1	110.8	150.4	-83.9	-170.5	-14.6	0	0	107.2	K87	K87-Q126 PolarHBondContact NZ-O 3.32Å
127	G	27.6	Very low	29.5	Very low	54 Å²	54	109.5 Å²	109.5	56%	0.557	57%	0.573	S	S	*	*			trans	-57.3	156.4	-172	0	0	0	0	0	114	D125 D129	D125-G127 PolarHBondContact OD1-N 2.84Å; G127-D129 PolarHBondContact O-N 2.8Å
128	I	25.4	Very low	29.3	Very low	136 Å²	136	109.9 Å²	109.9	70%	0.697	58%	0.578	S	S	*	*			trans	-74.2	115.9	-178.8	-60.5	172.3	0	0	0	109.4	N130	I128-N130 WeakPolarHBondContact CG2-OD1 3.27Å; I128-N130 PolarHBondContact O-N 2.83Å
129	D	25.1	Very low	29.2	Very low	153 Å²	153	110.3 Å²	110.3	82%	0.818	59%	0.591	S	S	*	*			trans	-68.3	84.5	163.5	-78.2	-21.2	0	0	0	109.4	G127 N131	G127-D129 PolarHBondContact O-N 2.8Å; D129-N131 PolarHBondContact O-N 3.36Å
130	N	26.3	Very low	29	Very low	84 Å²	84	114 Å²	114	45%	0.449	60%	0.599	S	S	.	*			trans	-73.1	71.3	170.8	-82.3	-44.1	0	0	0	110.5	I128 Y132	I128-N130 WeakPolarHBondContact CG2-OD1 3.27Å; I128-N130 PolarHBondContact O-N 2.83Å; N130-Y132 HydrophobicContact CB-CD2 4.3Å; N130-Y132 HydrophobicContact CB-CE1 4.25Å; N130-Y132 HydrophobicContact CB-CE2 3.86Å; N130-Y132 VanDerWaalsContact CG-OH 3.27Å; N130-Y132 PolarHBondContact ND2-OH 3.2Å; N130-Y132 PolarHBondContact O-N 3Å; N130-Y132 PolarHBondContact OD1-OH 3.23Å
131	N	27.8	Very low	28.9	Very low	151 Å²	151	121.1 Å²	121.1	81%	0.807	63%	0.632	S	S	*	*			trans	-71.5	87.3	157.3	-90.1	-37.6	0	0	0	108.3	D129 T133	D129-N131 PolarHBondContact O-N 3.36Å; N131-T133 PolarHBondContact O-N 3.07Å; N131-T133 VanDerWaalsContact O-N 3.16Å
132	Y	24.9	Very low	28.7	Very low	112 Å²	112	123.8 Å²	123.8	44%	0.439	65%	0.647	S	S	.	*			trans	-73.3	103.5	169.6	-68.2	-46.9	0	0	0	109.9	N130 R741	N130-Y132 HydrophobicContact CB-CD2 4.3Å; N130-Y132 HydrophobicContact CB-CE1 4.25Å; N130-Y132 HydrophobicContact CB-CE2 3.86Å; N130-Y132 VanDerWaalsContact CG-OH 3.27Å; N130-Y132 PolarHBondContact ND2-OH 3.2Å; N130-Y132 PolarHBondContact O-N 3Å; N130-Y132 PolarHBondContact OD1-OH 3.23Å; Y132-R741 VanDerWaalsContact CE1-NH1 3.27Å; Y132-R741 VanDerWaalsContact CZ-CZ 3.48Å; Y132-R741 PolarHBondContact OH-NH1 2.86Å; Y132-R741 VanDerWaalsContact OH-NH1 3.16Å
133	T	29	Very low	28.6	Very low	138 Å²	138	126.5 Å²	126.5	85%	0.847	68%	0.678	S	S	*	*			trans	-80.9	124.9	154.7	-43.6	0	0	0	0	107.9	N131	N131-T133 PolarHBondContact O-N 3.07Å; N131-T133 VanDerWaalsContact O-N 3.16Å
134	E	25.4	Very low	28.5	Very low	161 Å²	161	126.3 Å²	126.3	75%	0.752	69%	0.688	S	S	*	*			trans	-64.2	136.4	-178.2	-164.5	171.3	-159.3	0	0	111.5
135	N	27	Very low	28.4	Very low	138 Å²	138	127.6 Å²	127.6	74%	0.738	71%	0.707	S	S	*	*			trans	155.5	154.4	134.4	-77.7	-50	0	0	0	113.9
136	D	30.4	Very low	28.1	Very low	145 Å²	145	127.4 Å²	127.4	78%	0.775	72%	0.715	S	S	*	*			trans	78.7	81.5	164.1	-59.8	-31.4	0	0	0	122.3
137	T	30.5	Very low	28	Very low	126 Å²	126	127.1 Å²	127.1	77%	0.773	72%	0.723	S	S	*	*				75	89.8	116.5	-49.6	0	0	0	0	120.9
138	L	24.6	Very low	28.1	Very low	126 Å²	126	131.1 Å²	131.1	66%	0.66	74%	0.737	S	S	*	*			trans	-42	154.3	146.8	-99.6	151.3	0	0	0	114
139	P	31.3	Very low	28.1	Very low	109 Å²	109	128.9 Å²	128.9	71%	0.708	74%	0.738	S	S	*	*				-157.9	144.3	76.9	39.7	-18.3	0	0	0	121
140	K	26.9	Very low	28.2	Very low	176 Å²	176	127.7 Å²	127.7	77%	0.765	74%	0.742	S	S	*	*				43.5	129.9	124.5	-52.8	173.4	-178.7	175	0	122.2
141	E	31.2	Very low	28.4	Very low	170 Å²	170	127.8 Å²	127.8	79%	0.794	75%	0.749	S	S	*	*				171.3	162.3	120.2	-91.5	-143.1	104.3	0	0	108.7
142	N	31.4	Very low	28.3	Very low	140 Å²	140	128.1 Å²	128.1	75%	0.749	75%	0.748	S	S	*	*			cis	-171.1	143.7	-38.7	-107	-16.2	0	0	0	105.9
143	G	31.2	Very low	28.5	Very low	68 Å²	68	129.8 Å²	129.8	70%	0.701	76%	0.764	S	S	*	*			trans	147.2	70.1	167.4	0	0	0	0	0	121.5
144	I	29	Very low	28.7	Very low	179 Å²	179	130.7 Å²	130.7	92%	0.918	76%	0.759	S	S	*	*				36.7	127.7	122.8	-41.9	158.9	0	0	0	118.7
145	G	29.2	Very low	29	Very low	65 Å²	65	129.6 Å²	129.6	67%	0.67	76%	0.757	S	S	*	*			cis	169.1	172.9	-0.9	0	0	0	0	0	115.6
146	S	25.6	Very low	29.1	Very low	111 Å²	111	129.7 Å²	129.7	78%	0.776	76%	0.757	S	S	*	*			trans	35.5	125.4	159.5	64.9	0	0	0	0	122.8
147	T	28.7	Very low	29	Very low	127 Å²	127	131.4 Å²	131.4	78%	0.779	75%	0.753	S	S	*	*				-162.8	122	106.9	5.6	0	0	0	0	115
148	T	30.1	Very low	29	Very low	139 Å²	139	128.6 Å²	128.6	85%	0.853	74%	0.739	S	S	*	*			trans	55.2	130.6	147	49.9	0	0	0	0	123
149	A	25.4	Very low	29.2	Very low	89 Å²	89	126.4 Å²	126.4	74%	0.736	73%	0.734	S	S	*	*			trans	-94.5	149	-178.6	0	0	0	0	0	114.3
150	S	26.6	Very low	29.2	Very low	127 Å²	127	128 Å²	128	89%	0.888	73%	0.73	S	S	*	*			trans	-154.6	15.3	168.9	-165.7	0	0	0	0	115.6
151	S	30	Very low	29.6	Very low	86 Å²	86	125.9 Å²	125.9	60%	0.601	72%	0.723	S	S	*	*			trans	-130.6	22.6	-166.8	-141.4	0	0	0	0	116.3	N153	S151-N153 PolarHBondContact O-N 3.45Å
152	M	27.1	Very low	29.6	Very low	159 Å²	159	122.5 Å²	122.5	78%	0.783	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.2	-0.1	-173	-81.7	-173.7	176.2	0	0	116.3
153	N	28.7	Very low	29.4	Very low	147 Å²	147	121.1 Å²	121.1	79%	0.786	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.6	-11.5	-172.9	-73.4	-2	0	0	0	116.1	S151	S151-N153 PolarHBondContact O-N 3.45Å
154	E	32.5	Very low	29.5	Very low	156 Å²	156	120.9 Å²	120.9	73%	0.729	69%	0.69	S	S	*	*	S	Bend	trans	-86.5	-25	-179.4	-77.1	-175.2	133	0	0	114.3	L156 Y157	E154-L156 PolarHBondContact O-N 3.31Å; E154-Y157 PolarHBondContact O-N 3.32Å
155	I	31.7	Very low	29.9	Very low	138 Å²	138	118.6 Å²	118.6	71%	0.708	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.9	-19	-170.2	-63.5	170.2	0	0	0	112.7	Y157	I155-Y157 VanDerWaalsContact C-N 3.33Å; I155-Y157 PolarHBondContact O-N 2.82Å
156	L	28.4	Very low	29.9	Very low	141 Å²	141	120.9 Å²	120.9	74%	0.738	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.4	-15.4	179.1	-88.9	158.3	0	0	0	114.4	E154	E154-L156 PolarHBondContact O-N 3.31Å
157	Y	29.5	Very low	30.3	Very low	180 Å²	180	121.4 Å²	121.4	71%	0.706	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.5	-35	-179.2	-101	-97.5	0	0	0	114.1	E154 I155 S159 K160	E154-Y157 PolarHBondContact O-N 3.32Å; I155-Y157 VanDerWaalsContact C-N 3.33Å; I155-Y157 PolarHBondContact O-N 2.82Å; Y157-S159 PolarHBondContact O-N 3.48Å; Y157-S159 VanDerWaalsContact O-N 3.11Å; Y157-K160 PolarHBondContact O-N 2.85Å; Y157-K160 VanDerWaalsContact O-N 3.17Å
158	S	30.4	Very low	31.2	Very low	68 Å²	68	119.9 Å²	119.9	48%	0.476	65%	0.651	S	S	.	*	H	α-helix	trans	-67.7	-10.1	179.7	-61.9	0	0	0	0	115	K160 N162	S158-K160 VanDerWaalsContact C-N 3.27Å; S158-K160 PolarHBondContact O-N 3.28Å; S158-N162 PolarHBondContact O-ND2 2.93Å; S158-N162 VanDerWaalsContact O-ND2 3.15Å
159	S	28.8	Very low	31.9	Very low	79 Å²	79	117.1 Å²	117.1	55%	0.552	63%	0.628	S	S	*	*	H	α-helix	trans	-71.9	-21.7	173.9	-159.6	0	0	0	0	112.6	Y157	Y157-S159 PolarHBondContact O-N 3.48Å; Y157-S159 VanDerWaalsContact O-N 3.11Å
160	K	30.8	Very low	32.7	Very low	144 Å²	144	118.5 Å²	118.5	63%	0.626	62%	0.619	S	S	*	*	H	α-helix	trans	-78.9	-32.7	178.3	-72.9	-179.2	175.7	176.3	0	113.5	Y157 S158 N162 L163 S164	Y157-K160 PolarHBondContact O-N 2.85Å; Y157-K160 VanDerWaalsContact O-N 3.17Å; S158-K160 VanDerWaalsContact C-N 3.27Å; S158-K160 PolarHBondContact O-N 3.28Å; K160-N162 VanDerWaalsContact C-N 3.29Å; K160-N162 PolarHBondContact O-N 3.21Å; K160-L163 WeakPolarHBondContact O-CB 3.12Å; K160-L163 PolarHBondContact O-N 3.44Å; K160-L163 VanDerWaalsContact O-N 3.16Å; K160-S164 PolarHBondContact O-N 2.9Å
161	E	35.4	Very low	33.9	Very low	131 Å²	131	116.6 Å²	116.6	61%	0.612	60%	0.596	S	S	*	*	H	α-helix	trans	-71.1	-20.2	178.3	-69.9	-176.3	128.4	0	0	114.1	S164	E161-S164 PolarHBondContact O-OG 2.85Å
162	N	31.5	Very low	34.9	Very low	99 Å²	99	115.5 Å²	115.5	53%	0.529	58%	0.583	S	S	.	*	H	α-helix	trans	-85.1	-16.8	172.7	-67.4	-65.6	0	0	0	112.3	S158 K160	S158-N162 PolarHBondContact O-ND2 2.93Å; S158-N162 VanDerWaalsContact O-ND2 3.15Å; K160-N162 VanDerWaalsContact C-N 3.29Å; K160-N162 PolarHBondContact O-N 3.21Å
163	L	27.4	Very low	35.9	Very low	111 Å²	111	112.6 Å²	112.6	58%	0.581	57%	0.57	S	S	*	*	H	α-helix	trans	-78.6	-27.1	172.9	-100.9	149.7	0	0	0	112.7	K160	K160-L163 WeakPolarHBondContact O-CB 3.12Å; K160-L163 PolarHBondContact O-N 3.44Å; K160-L163 VanDerWaalsContact O-N 3.16Å
164	S	32.6	Very low	37	Very low	63 Å²	63	109.9 Å²	109.9	44%	0.441	55%	0.551	S	S	.	*	H	α-helix	trans	-71	-39.5	172.7	52.7	0	0	0	0	112.4	K160 E161 L166 N167 D168	K160-S164 PolarHBondContact O-N 2.9Å; E161-S164 PolarHBondContact O-OG 2.85Å; S164-L166 VanDerWaalsContact C-N 3.33Å; S164-L166 PolarHBondContact O-N 2.94Å; S164-N167 WeakPolarHBondContact O-CA 3.32Å; S164-N167 WeakPolarHBondContact O-CB 3.46Å; S164-N167 PolarHBondContact O-N 3.48Å; S164-D168 PolarHBondContact O-N 2.99Å
165	K	36.5	Very low	37.8	Very low	130 Å²	130	105.2 Å²	105.2	57%	0.565	53%	0.529	S	S	*	.	H	α-helix	trans	-62	-34.9	-179.2	-69.8	-178.7	179	177.3	0	114.3	N167 D168 E169	K165-N167 PolarHBondContact O-N 3.46Å; K165-D168 PolarHBondContact O-N 3.3Å; K165-E169 PolarHBondContact O-N 3.12Å
166	L	29.9	Very low	38.7	Very low	114 Å²	114	100 Å²	100	60%	0.597	50%	0.502	S	S	*	.	H	α-helix	trans	-65.7	-24.9	172.8	-81.6	164	0	0	0	112.8	S164	S164-L166 VanDerWaalsContact C-N 3.33Å; S164-L166 PolarHBondContact O-N 2.94Å
167	N	34.8	Very low	39.4	Very low	122 Å²	122	97 Å²	97	65%	0.652	49%	0.487	S	S	*	.	H	α-helix	trans	-77.6	-36.1	177.2	-143.3	49.7	0	0	0	110.8	S164 K165 H170 E171	S164-N167 WeakPolarHBondContact O-CA 3.32Å; S164-N167 WeakPolarHBondContact O-CB 3.46Å; S164-N167 PolarHBondContact O-N 3.48Å; K165-N167 PolarHBondContact O-N 3.46Å; N167-H170 PolarHBondContact O-N 3.4Å; N167-E171 PolarHBondContact O-N 3.02Å
168	D	46.5	Very low	40.2	Very low	95 Å²	95	93.6 Å²	93.6	51%	0.508	48%	0.481	S	S	.	.	H	α-helix	trans	-65.4	-40.4	176.6	-55.7	-36.5	0	0	0	112	S164 K165 H170 E171 L172	S164-D168 PolarHBondContact O-N 2.99Å; K165-D168 PolarHBondContact O-N 3.3Å; D168-H170 PolarHBondContact O-N 3.04Å; D168-E171 PolarHBondContact O-N 3.22Å; D168-E171 VanDerWaalsContact O-N 3.12Å; D168-L172 PolarHBondContact O-N 2.74Å
169	E	46	Very low	41	Very low	80 Å²	80	91.7 Å²	91.7	37%	0.374	47%	0.468	S	S	.	.	H	α-helix	trans	-61.4	-41.9	176.3	-71	178.6	166.5	0	0	112.2	K165 E171 L172 I173	K165-E169 PolarHBondContact O-N 3.12Å; E169-E171 PolarHBondContact O-N 2.75Å; E169-L172 PolarHBondContact O-N 2.92Å; E169-I173 WeakPolarHBondContact O-CG1 3.43Å; E169-I173 PolarHBondContact O-N 3Å
170	H	41.7	Very low	41.6	Very low	118 Å²	118	89.3 Å²	89.3	55%	0.546	45%	0.449	S	S	.	.	H	α-helix	trans	-68.5	-26.2	176.7	-159.2	-40.7	0	0	0	112	N167 D168 K174	N167-H170 PolarHBondContact O-N 3.4Å; D168-H170 PolarHBondContact O-N 3.04Å; H170-K174 WeakPolarHBondContact O-CD 3.45Å; H170-K174 WeakPolarHBondContact O-CG 3.34Å; H170-K174 PolarHBondContact O-N 2.96Å
171	E	51.1	Low	41.8	Very low	88 Å²	88	87.8 Å²	87.8	41%	0.411	45%	0.448	S	S	.	.	H	α-helix	trans	-78.5	-38.3	176.3	-157.5	62.7	-165.3	0	0	112.1	N167 D168 E169 I173 K174 Q175	N167-E171 PolarHBondContact O-N 3.02Å; D168-E171 PolarHBondContact O-N 3.22Å; D168-E171 VanDerWaalsContact O-N 3.12Å; E169-E171 PolarHBondContact O-N 2.75Å; E171-I173 VanDerWaalsContact C-N 3.34Å; E171-I173 PolarHBondContact O-N 2.85Å; E171-K174 WeakPolarHBondContact O-CB 3.49Å; E171-K174 PolarHBondContact O-N 2.94Å; E171-K174 WeakPolarHBondContact OE2-CD 3.47Å; E171-K174 IonicContact OE2-NZ 2.7Å; E171-K174 PolarHBondContact OE2-NZ 3.37Å; E171-Q175 VanDerWaalsContact O-CG 3.32Å; E171-Q175 WeakPolarHBondContact O-CG 3.44Å; E171-Q175 PolarHBondContact O-N 3.11Å
172	L	51.4	Low	42.1	Very low	62 Å²	62	85.6 Å²	85.6	33%	0.325	44%	0.443	S	S	.	.	H	α-helix	trans	-59.5	-41.9	171.9	-73.1	173.5	0	0	0	112.3	D168 E169 K174 Q175 L176	D168-L172 PolarHBondContact O-N 2.74Å; E169-L172 PolarHBondContact O-N 2.92Å; L172-K174 VanDerWaalsContact C-N 3.35Å; L172-K174 PolarHBondContact O-N 2.89Å; L172-Q175 PolarHBondContact O-N 3.48Å; L172-L176 WeakPolarHBondContact O-CG 3.25Å; L172-L176 PolarHBondContact O-N 3.48Å
173	I	48	Very low	42.5	Very low	98 Å²	98	82.3 Å²	82.3	50%	0.503	43%	0.425	S	S	.	.	H	α-helix	trans	-66	-36.8	176.8	-65.3	171.3	0	0	0	111.4	E169 E171 N177	E169-I173 WeakPolarHBondContact O-CG1 3.43Å; E169-I173 PolarHBondContact O-N 3Å; E171-I173 VanDerWaalsContact C-N 3.34Å; E171-I173 PolarHBondContact O-N 2.85Å; I173-N177 VanDerWaalsContact O-CG 3.31Å; I173-N177 PolarHBondContact O-N 3.08Å; I173-N177 VanDerWaalsContact O-N 3.16Å; I173-N177 PolarHBondContact O-ND2 2.87Å
174	K	51.5	Low	42.9	Very low	90 Å²	90	82.8 Å²	82.8	39%	0.391	42%	0.421	S	S	.	.	H	α-helix	trans	-68.2	-40.3	172.3	-74.1	163.3	178.1	167.4	0	112.3	H170 E171 L172 N177 N178	H170-K174 WeakPolarHBondContact O-CD 3.45Å; H170-K174 WeakPolarHBondContact O-CG 3.34Å; H170-K174 PolarHBondContact O-N 2.96Å; E171-K174 WeakPolarHBondContact O-CB 3.49Å; E171-K174 PolarHBondContact O-N 2.94Å; E171-K174 WeakPolarHBondContact OE2-CD 3.47Å; E171-K174 IonicContact OE2-NZ 2.7Å; E171-K174 PolarHBondContact OE2-NZ 3.37Å; L172-K174 VanDerWaalsContact C-N 3.35Å; L172-K174 PolarHBondContact O-N 2.89Å; K174-N177 PolarHBondContact O-N 3.27Å; K174-N178 WeakPolarHBondContact O-CB 3.1Å; K174-N178 PolarHBondContact O-N 2.87Å
175	Q	50.5	Low	42.9	Very low	59 Å²	59	85.1 Å²	85.1	28%	0.276	43%	0.428	S	S	.	.	H	α-helix	trans	-61.3	-46.6	177.5	-74.7	173.2	12	0	0	110.5	E171 L172 N177 N178 S179 N647	E171-Q175 VanDerWaalsContact O-CG 3.32Å; E171-Q175 WeakPolarHBondContact O-CG 3.44Å; E171-Q175 PolarHBondContact O-N 3.11Å; L172-Q175 PolarHBondContact O-N 3.48Å; Q175-N177 PolarHBondContact O-N 3.42Å; Q175-N178 PolarHBondContact O-N 3.15Å; Q175-S179 WeakPolarHBondContact O-CB 3.32Å; Q175-S179 PolarHBondContact O-N 3.3Å; Q175-S179 PolarHBondContact O-OG 3.17Å; Q175-N647 PolarHBondContact OE1-ND2 2.98Å
176	L	49.1	Very low	42.9	Very low	27 Å²	27	83.8 Å²	83.8	14%	0.141	43%	0.427	C	S	.	.	H	α-helix	trans	-53	-52.4	171.6	-76.6	161.1	0	0	0	111.9	L172 N178 S179 N180 Y592 I646	L172-L176 WeakPolarHBondContact O-CG 3.25Å; L172-L176 PolarHBondContact O-N 3.48Å; L176-N178 PolarHBondContact O-N 3.34Å; L176-S179 PolarHBondContact O-N 3.07Å; L176-N180 VanDerWaalsContact O-CG 3.3Å; L176-N180 PolarHBondContact O-N 3.12Å; L176-N180 PolarHBondContact O-OD1 2.79Å; L176-Y592 HydrophobicContact CD2-CD1 3.72Å; L176-Y592 HydrophobicContact CD2-CE1 3.74Å; L176-I646 HydrophobicContact CD2-CG2 3.7Å; L176-I646 HydrophobicContact CG-CG2 4.17Å
177	N	44	Very low	43.1	Very low	79 Å²	79	80 Å²	80	42%	0.422	41%	0.41	S	S	.	.	H	α-helix	trans	-67.2	-35.3	-178	-69.5	-22.1	0	0	0	113.6	I173 K174 Q175	I173-N177 VanDerWaalsContact O-CG 3.31Å; I173-N177 PolarHBondContact O-N 3.08Å; I173-N177 VanDerWaalsContact O-N 3.16Å; I173-N177 PolarHBondContact O-ND2 2.87Å; K174-N177 PolarHBondContact O-N 3.27Å; Q175-N177 PolarHBondContact O-N 3.42Å
178	N	47.1	Very low	42.9	Very low	108 Å²	108	81.8 Å²	81.8	58%	0.578	41%	0.412	S	S	*	.	H	α-helix	trans	-74.7	-39.1	178	-75.9	-14.9	0	0	0	112	K174 Q175 L176 N180 N181 V182	K174-N178 WeakPolarHBondContact O-CB 3.1Å; K174-N178 PolarHBondContact O-N 2.87Å; Q175-N178 PolarHBondContact O-N 3.15Å; L176-N178 PolarHBondContact O-N 3.34Å; N178-N180 VanDerWaalsContact C-N 3.3Å; N178-N180 PolarHBondContact O-N 3.42Å; N178-N181 PolarHBondContact O-N 3.13Å; N178-V182 PolarHBondContact O-N 2.74Å
179	S	46.4	Very low	42.4	Very low	29 Å²	29	84 Å²	84	20%	0.203	42%	0.419	C	S	.	.	H	α-helix	trans	-61.1	-38.7	176.7	-67.2	0	0	0	0	112.2	Q175 L176 N181 V182 L183 Y592	Q175-S179 WeakPolarHBondContact O-CB 3.32Å; Q175-S179 PolarHBondContact O-N 3.3Å; Q175-S179 PolarHBondContact O-OG 3.17Å; L176-S179 PolarHBondContact O-N 3.07Å; S179-N181 VanDerWaalsContact C-N 3.27Å; S179-N181 PolarHBondContact O-N 3.48Å; S179-V182 PolarHBondContact O-N 2.76Å; S179-V182 VanDerWaalsContact O-N 3.08Å; S179-L183 WeakPolarHBondContact O-CB 3.34Å; S179-L183 PolarHBondContact O-N 3.39Å; S179-Y592 WeakPolarHBondContact CB-OH 3.47Å
180	N	41	Very low	42.1	Very low	28 Å²	28	85.4 Å²	85.4	15%	0.15	43%	0.426	C	S	.	.	H	α-helix	trans	-54.8	-40.9	176.3	-69.7	-4.6	0	0	0	112.5	L176 N178 V182 Y184	L176-N180 VanDerWaalsContact O-CG 3.3Å; L176-N180 PolarHBondContact O-N 3.12Å; L176-N180 PolarHBondContact O-OD1 2.79Å; N178-N180 VanDerWaalsContact C-N 3.3Å; N178-N180 PolarHBondContact O-N 3.42Å; N180-V182 PolarHBondContact O-N 2.86Å; N180-Y184 WeakPolarHBondContact O-CD2 3.27Å
181	N	36.3	Very low	41.7	Very low	113 Å²	113	85.5 Å²	85.5	60%	0.604	43%	0.425	S	S	*	.	H	α-helix	trans	-72.5	-24.4	179.3	-77.7	-29.7	0	0	0	114.1	N178 S179 N185	N178-N181 PolarHBondContact O-N 3.13Å; S179-N181 VanDerWaalsContact C-N 3.27Å; S179-N181 PolarHBondContact O-N 3.48Å; N181-N185 PolarHBondContact O-ND2 3.49Å
182	V	41.1	Very low	40.9	Very low	84 Å²	84	85.1 Å²	85.1	51%	0.509	43%	0.432	S	S	.	.	H	α-helix	trans	-86.7	-34.1	177.6	-179.5	0	0	0	0	111	N178 S179 N180 N185 N186	N178-V182 PolarHBondContact O-N 2.74Å; S179-V182 PolarHBondContact O-N 2.76Å; S179-V182 VanDerWaalsContact O-N 3.08Å; N180-V182 PolarHBondContact O-N 2.86Å; V182-N185 PolarHBondContact O-N 2.91Å; V182-N186 PolarHBondContact O-N 2.88Å
183	L	38.8	Very low	40.1	Very low	30 Å²	30	86.6 Å²	86.6	16%	0.157	45%	0.448	C	S	.	.	H	α-helix	trans	-66.8	-37.6	-175.8	-92.7	162.8	0	0	0	114.3	S179 N185 N186 S187 L588 Y592	S179-L183 WeakPolarHBondContact O-CB 3.34Å; S179-L183 PolarHBondContact O-N 3.39Å; L183-N185 PolarHBondContact O-N 3.38Å; L183-N185 VanDerWaalsContact O-N 3.15Å; L183-N186 PolarHBondContact O-N 3.41Å; L183-S187 WeakPolarHBondContact O-CB 3.33Å; L183-S187 PolarHBondContact O-N 3.22Å; L183-S187 PolarHBondContact O-OG 2.91Å; L183-L588 HydrophobicContact CD1-CD2 4.16Å; L183-L588 HydrophobicContact CD1-CG 4.49Å; L183-L588 HydrophobicContact CD2-CD2 3.49Å; L183-L588 VanDerWaalsContact CD2-CD2 3.49Å; L183-L588 HydrophobicContact CG-CD2 4.5Å; L183-Y592 HydrophobicContact CD1-CD2 4.32Å; L183-Y592 HydrophobicContact CD1-CE2 3.37Å; L183-Y592 WeakPolarHBondContact CD1-OH 3.23Å
184	Y	35.9	Very low	39.4	Very low	122 Å²	122	88 Å²	88	48%	0.478	46%	0.457	S	S	.	.	H	α-helix	trans	-58.4	-27.5	176.3	-86.4	-65.9	0	0	0	113.6	N180 G398	N180-Y184 WeakPolarHBondContact O-CD2 3.27Å; Y184-G398 PolarHBondContact OH-O 2.93Å
185	N	34	Very low	38.5	Very low	112 Å²	112	91.6 Å²	91.6	60%	0.599	48%	0.48	S	S	*	.	H	α-helix	trans	-86.8	-40.1	179.2	-61.2	-47.5	0	0	0	112.1	N181 V182 L183	N181-N185 PolarHBondContact O-ND2 3.49Å; V182-N185 PolarHBondContact O-N 2.91Å; L183-N185 PolarHBondContact O-N 3.38Å; L183-N185 VanDerWaalsContact O-N 3.15Å
186	N	36.1	Very low	37.6	Very low	102 Å²	102	92.4 Å²	92.4	55%	0.545	50%	0.504	S	S	.	.	H	α-helix	trans	-83.8	-31.1	-173.8	-69.7	2.4	0	0	0	114	V182 L183 F188 E190	V182-N186 PolarHBondContact O-N 2.88Å; L183-N186 PolarHBondContact O-N 3.41Å; N186-F188 VanDerWaalsContact C-N 3.3Å; N186-F188 PolarHBondContact O-N 3.4Å; N186-E190 PolarHBondContact O-N 2.83Å
187	S	33.5	Very low	36.8	Very low	34 Å²	34	99.1 Å²	99.1	24%	0.238	54%	0.538	C	S	.	.	H	α-helix	trans	-66.7	-31.1	-179.5	-68	0	0	0	0	112.8	L183 E189 F191	L183-S187 WeakPolarHBondContact O-CB 3.33Å; L183-S187 PolarHBondContact O-N 3.22Å; L183-S187 PolarHBondContact O-OG 2.91Å; S187-E189 PolarHBondContact O-N 3.41Å; S187-F191 VanDerWaalsContact O-CD2 3.22Å; S187-F191 WeakPolarHBondContact O-CD2 3.46Å; S187-F191 PolarHBondContact O-N 3.41Å
188	F	31.3	Very low	36.1	Very low	159 Å²	159	99.7 Å²	99.7	70%	0.697	55%	0.549	S	S	*	.	H	α-helix	trans	-66.9	-35.4	-178.7	-167.2	-100.6	0	0	0	113	N186 S192	N186-F188 VanDerWaalsContact C-N 3.3Å; N186-F188 PolarHBondContact O-N 3.4Å; F188-S192 WeakPolarHBondContact O-CB 3.12Å; F188-S192 PolarHBondContact O-OG 2.82Å
189	E	34.9	Very low	35.8	Very low	141 Å²	141	102.2 Å²	102.2	66%	0.659	56%	0.562	S	S	*	*	H	α-helix	trans	-78.4	-38.6	-179.6	-61.2	-167.2	164.9	0	0	112.7	S187 S193	S187-E189 PolarHBondContact O-N 3.41Å; E189-S193 PolarHBondContact O-OG 3.41Å
190	E	39.6	Very low	35.2	Very low	111 Å²	111	104.2 Å²	104.2	52%	0.519	59%	0.587	S	S	.	*	H	α-helix	trans	-75.3	-32.2	-175.5	-144.3	-178.4	-157.8	0	0	113.4	N186 R637	N186-E190 PolarHBondContact O-N 2.83Å; E190-R637 IonicContact OE1-CZ 3.69Å; E190-R637 IonicContact OE1-NH2 3.54Å; E190-R637 PolarHBondContact OE1-NH2 2.98Å; E190-R637 IonicContact OE2-CZ 2.93Å; E190-R637 IonicContact OE2-NH2 2.93Å; E190-R637 PolarHBondContact OE2-NH2 3.02Å
191	F	34.5	Very low	35.1	Very low	120 Å²	120	111.7 Å²	111.7	53%	0.526	62%	0.618	S	S	.	*	H	α-helix	trans	-78	-26.9	174.3	-73.6	-64.3	0	0	0	113.5	S187 S193	S187-F191 VanDerWaalsContact O-CD2 3.22Å; S187-F191 WeakPolarHBondContact O-CD2 3.46Å; S187-F191 PolarHBondContact O-N 3.41Å; F191-S193 PolarHBondContact O-N 3.42Å
192	S	33.7	Very low	35	Very low	80 Å²	80	112.1 Å²	112.1	56%	0.559	62%	0.621	S	S	*	*	H	α-helix	trans	-70.3	-20.3	176.8	-63.1	0	0	0	0	113.4	F188	F188-S192 WeakPolarHBondContact O-CB 3.12Å; F188-S192 PolarHBondContact O-OG 2.82Å
193	S	34.5	Very low	34.9	Very low	93 Å²	93	115.9 Å²	115.9	65%	0.65	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.7	-3.8	-168.7	-61.4	0	0	0	0	115.2	E189 F191	E189-S193 PolarHBondContact O-OG 3.41Å; F191-S193 PolarHBondContact O-N 3.42Å
194	N	34.3	Very low	34.6	Very low	128 Å²	128	118.3 Å²	118.3	68%	0.684	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.4	8.4	-171	-77.7	-46.1	0	0	0	115.9
195	N	32.8	Very low	34.8	Very low	165 Å²	165	118.6 Å²	118.6	88%	0.882	67%	0.666	S	S	*	*			trans	-99.5	64.3	171.3	-86	-14.5	0	0	0	111.5
196	G	29.8	Very low	35	Very low	76 Å²	76	119.3 Å²	119.3	78%	0.784	67%	0.67	S	S	*	*			trans	-106.1	91.6	176.8	0	0	0	0	0	112.5
197	I	32.5	Very low	35.1	Very low	167 Å²	167	120.5 Å²	120.5	86%	0.856	68%	0.676	S	S	*	*			trans	-72.6	130.6	178.3	-67.5	170.6	0	0	0	110.6
198	S	31.2	Very low	35.4	Very low	92 Å²	92	125.4 Å²	125.4	64%	0.643	70%	0.7	S	S	*	*			trans	-78.7	123.6	166.3	54.3	0	0	0	0	111.1
199	D	38.8	Very low	35.6	Very low	161 Å²	161	124.3 Å²	124.3	86%	0.861	70%	0.701	S	S	*	*				176.3	137.9	122.7	-91.5	-19.2	0	0	0	114
200	G	35.6	Very low	35.7	Very low	70 Å²	70	122.2 Å²	122.2	72%	0.722	70%	0.702	S	S	*	*				83.8	68.9	126.7	0	0	0	0	0	122
201	K	38.3	Very low	35.5	Very low	186 Å²	186	123.1 Å²	123.1	81%	0.809	71%	0.711	S	S	*	*			trans	63.6	128.9	133	-78.6	-177.9	173.5	178	0	123.4
202	D	34.6	Very low	35.5	Very low	122 Å²	122	123 Å²	123	65%	0.652	72%	0.715	S	S	*	*			trans	76.1	108.3	130.1	-60.8	-22.4	0	0	0	122
203	L	37.6	Very low	35.6	Very low	162 Å²	162	125.3 Å²	125.3	85%	0.848	72%	0.722	S	S	*	*			trans	68	147.5	138.7	-52.9	167.7	0	0	0	119.2
204	S	33.9	Very low	35.6	Very low	81 Å²	81	127.5 Å²	127.5	57%	0.566	73%	0.726	S	S	*	*			cis	-163.9	167.9	-26.2	56.8	0	0	0	0	108.5
205	D	39.9	Very low	35.5	Very low	128 Å²	128	128.2 Å²	128.2	68%	0.684	73%	0.729	S	S	*	*			trans	75.4	103.6	155	-47.5	-40.1	0	0	0	121.1
206	N	38.2	Very low	35.4	Very low	127 Å²	127	124.5 Å²	124.5	68%	0.679	72%	0.716	S	S	*	*				89.2	108.1	117.4	-65.8	8.6	0	0	0	122.1
207	D	38.3	Very low	35.6	Very low	128 Å²	128	127.5 Å²	127.5	68%	0.684	71%	0.714	S	S	*	*				89.1	118.7	113.7	-58.5	-18.1	0	0	0	121.9
208	D	39.9	Very low	35.7	Very low	136 Å²	136	126.9 Å²	126.9	73%	0.727	71%	0.712	S	S	*	*				98.1	89.7	126.4	-82.2	-20.6	0	0	0	122.6
209	N	35.2	Very low	35.7	Very low	137 Å²	137	129.7 Å²	129.7	73%	0.733	72%	0.72	S	S	*	*				85	153	101.1	-150.8	-7.6	0	0	0	120.7
210	S	36.4	Very low	35.5	Very low	97 Å²	97	127.6 Å²	127.6	68%	0.678	72%	0.718	S	S	*	*			trans	72.7	97.4	164.6	-176.1	0	0	0	0	117.9
211	N	34.8	Very low	35.3	Very low	129 Å²	129	133.3 Å²	133.3	69%	0.69	72%	0.723	S	S	*	*				91	135.7	66.9	-96	-19.3	0	0	0	116.5
212	N	35.4	Very low	35	Very low	118 Å²	118	134.6 Å²	134.6	63%	0.631	73%	0.725	S	S	*	*			trans	83.5	101.4	144.2	-65	-18.6	0	0	0	122.1
213	N	34.8	Very low	34.7	Very low	129 Å²	129	135.3 Å²	135.3	69%	0.69	73%	0.728	S	S	*	*				82.7	135.6	111	-62	-15	0	0	0	122.6
214	N	34.7	Very low	34.3	Very low	138 Å²	138	135.6 Å²	135.6	74%	0.738	73%	0.731	S	S	*	*			trans	101.1	112.2	139	-71.3	-12	0	0	0	121.8
215	L	33.1	Very low	34	Very low	143 Å²	143	137.2 Å²	137.2	75%	0.749	74%	0.742	S	S	*	*				77.9	123.2	129.9	-91.3	84.4	0	0	0	122.8
216	S	31.3	Very low	33.5	Very low	87 Å²	87	136.1 Å²	136.1	61%	0.608	74%	0.744	S	S	*	*			trans	68.3	119.7	132.3	67.3	0	0	0	0	121.4
217	D	33.9	Very low	33.1	Very low	140 Å²	140	135.1 Å²	135.1	75%	0.749	75%	0.747	S	S	*	*			trans	56.6	106.8	130.3	-45.3	-17.8	0	0	0	119.1
218	N	33.6	Very low	32.7	Very low	153 Å²	153	136.7 Å²	136.7	82%	0.818	75%	0.754	S	S	*	*				177.1	160.8	94	-94.4	-73.8	0	0	0	112.8
219	D	32.1	Very low	32.1	Very low	152 Å²	152	137.1 Å²	137.1	81%	0.813	76%	0.755	S	S	*	*			trans	-55.6	136.9	176.8	-65.4	-69.8	0	0	0	114.3
220	S	34.3	Very low	31.6	Very low	116 Å²	116	135.4 Å²	135.4	81%	0.811	75%	0.754	S	S	*	*				174	146.8	105.8	46.2	0	0	0	0	114.1
221	K	31.2	Very low	31.3	Very low	190 Å²	190	136.5 Å²	136.5	83%	0.826	76%	0.757	S	S	*	*			trans	-18.1	129.2	165.9	-65.6	166.1	175.4	170.5	0	116
222	Y	30.9	Very low	30.9	Very low	214 Å²	214	138.2 Å²	138.2	84%	0.839	76%	0.761	S	S	*	*				-165.3	152.7	99.1	-113.3	-82.7	0	0	0	111.9
223	N	28.8	Very low	31	Very low	136 Å²	136	137.5 Å²	137.5	73%	0.727	76%	0.763	S	S	*	*			trans	-71.1	146.2	-173	-47.6	-45.9	0	0	0	113
224	N	29.6	Very low	30.7	Very low	169 Å²	169	137.8 Å²	137.8	90%	0.904	77%	0.769	S	S	*	*				-160.6	155.1	126.4	-107.6	-19.1	0	0	0	113
225	S	26.8	Very low	30.2	Very low	114 Å²	114	138.7 Å²	138.7	80%	0.797	77%	0.773	S	S	*	*			trans	-110.8	143.9	-158	-44.9	0	0	0	0	114.5
226	S	31.3	Very low	30.2	Very low	105 Å²	105	138.9 Å²	138.9	73%	0.734	78%	0.78	S	S	*	*			trans	-171.9	103.4	153.2	47.8	0	0	0	0	107.9
227	S	28.9	Very low	30	Very low	107 Å²	107	138.3 Å²	138.3	75%	0.748	78%	0.776	S	S	*	*				65.1	129.7	90.2	73.9	0	0	0	0	111.8
228	I	29.6	Very low	29.8	Very low	160 Å²	160	140.1 Å²	140.1	82%	0.821	79%	0.785	S	S	*	*			cis	-158.7	146.6	40.1	-76.4	179.4	0	0	0	105.5
229	L	28.2	Very low	29.6	Very low	145 Å²	145	135.8 Å²	135.8	76%	0.759	76%	0.762	S	S	*	*			cis	-164.6	155.5	-8.8	168.2	67.7	0	0	0	107.9	T231	L229-T231 HydrophobicContact CD1-CG2 4.05Å; L229-T231 HydrophobicContact CG-CG2 4.46Å
230	S	23.7	Very low	29.3	Very low	101 Å²	101	134.5 Å²	134.5	71%	0.706	76%	0.755	S	S	*	*			trans	-146.6	137	163.7	171.9	0	0	0	0	108.3
231	T	30.4	Very low	29.2	Very low	120 Å²	120	136.7 Å²	136.7	74%	0.736	75%	0.752	S	S	*	*			trans	-133	98.6	174.6	50.9	0	0	0	0	110.9	L229	L229-T231 HydrophobicContact CD1-CG2 4.05Å; L229-T231 HydrophobicContact CG-CG2 4.46Å
232	Q	27.3	Very low	29	Very low	165 Å²	165	133.6 Å²	133.6	77%	0.771	74%	0.744	S	S	*	*			trans	-79.5	-157.1	159	-77.7	-93.7	19.8	0	0	108.7
233	P	35.7	Very low	28.9	Very low	103 Å²	103	130.1 Å²	130.1	67%	0.669	74%	0.74	S	S	*	*				-131.7	-144.7	-103.6	40.9	-19.3	0	0	0	112.1
234	V	29.9	Very low	28.8	Very low	135 Å²	135	128.4 Å²	128.4	82%	0.818	74%	0.739	S	S	*	*			trans	120.4	135.7	153.4	177.6	0	0	0	0	116.9
235	L	24.6	Very low	28.6	Very low	157 Å²	157	125.9 Å²	125.9	82%	0.822	74%	0.735	S	S	*	*			trans	-82.7	159.5	178.5	-59.5	156	0	0	0	112.7
236	T	31.7	Very low	28.7	Very low	148 Å²	148	126.4 Å²	126.4	91%	0.908	73%	0.733	S	S	*	*			trans	-167.3	140.7	132.5	18.5	0	0	0	0	111.5
237	S	26.6	Very low	28.4	Very low	75 Å²	75	129.3 Å²	129.3	52%	0.524	74%	0.739	S	S	.	*			trans	-89.8	158.2	172.3	49.6	0	0	0	0	112.1	E431	S237-E431 VanDerWaalsContact CB-OE1 3.25Å; S237-E431 WeakPolarHBondContact CB-OE1 3.03Å; S237-E431 PolarHBondContact OG-OE1 2.83Å
238	L	31.1	Very low	28.3	Very low	177 Å²	177	129.3 Å²	129.3	93%	0.927	74%	0.739	S	S	*	*			trans	-162.9	144.4	147.2	-109.8	149	0	0	0	112.7
239	N	28.1	Very low	28.2	Very low	63 Å²	63	129.4 Å²	129.4	34%	0.337	74%	0.738	S	S	.	*			trans	-88	163.1	-155.5	-140.2	-27.7	0	0	0	115	H430 E431	N239-H430 PolarHBondContact OD1-CE1 2.74Å; N239-E431 PolarHBondContact ND2-OE2 2.8Å
240	N	27.7	Very low	28.3	Very low	124 Å²	124	129.8 Å²	129.8	66%	0.663	74%	0.736	S	S	*	*			trans	46.1	133.4	152.6	-66.5	-31.2	0	0	0	120.3
241	H	31.7	Very low	28.6	Very low	163 Å²	163	129.2 Å²	129.2	76%	0.755	73%	0.732	S	S	*	*				-171.8	163.9	56.7	-124.9	-60.1	0	0	0	112.3
242	N	26.8	Very low	28.8	Very low	124 Å²	124	131.3 Å²	131.3	66%	0.663	73%	0.731	S	S	*	*			trans	-40.5	146.7	167.3	-44.7	-23.6	0	0	0	115.5
243	D	28.2	Very low	28.9	Very low	142 Å²	142	129 Å²	129	76%	0.759	73%	0.728	S	S	*	*				165.1	145.2	92.4	-100.8	-43.1	0	0	0	113.9
244	S	27.7	Very low	28.6	Very low	100 Å²	100	131.4 Å²	131.4	70%	0.699	74%	0.735	S	S	*	*			trans	58.5	111.5	154.2	71.7	0	0	0	0	119
245	S	25.4	Very low	28.6	Very low	116 Å²	116	130 Å²	130	81%	0.811	73%	0.731	S	S	*	*				82.9	156	85	-67.8	0	0	0	0	116.4
246	V	28.5	Very low	29	Very low	125 Å²	125	130.9 Å²	130.9	76%	0.758	73%	0.728	S	S	*	*			trans	90.5	87.9	164.3	-164.3	0	0	0	0	118.1
247	L	25	Very low	29	Very low	166 Å²	166	130.3 Å²	130.3	87%	0.869	72%	0.715	S	S	*	*				34.7	125	117	-56.2	168.3	0	0	0	120.4
248	S	26.4	Very low	29.2	Very low	107 Å²	107	132.7 Å²	132.7	75%	0.748	72%	0.721	S	S	*	*				173.3	106.7	124.9	-173.8	0	0	0	0	108.9
249	M	27.9	Very low	29.2	Very low	161 Å²	161	131.1 Å²	131.1	79%	0.793	71%	0.712	S	S	*	*				51.9	109.5	91.5	-64.5	-176.7	73.4	0	0	115.5
250	E	30.2	Very low	29.3	Very low	154 Å²	154	133.8 Å²	133.8	72%	0.72	73%	0.727	S	S	*	*				176.1	121.2	109.2	-88.6	-162.6	111.8	0	0	107.7	K252	E250-K252 IonicContact OE1-NZ 2.86Å; E250-K252 PolarHBondContact OE1-NZ 3.22Å
251	S	29.1	Very low	29.5	Very low	89 Å²	89	133.7 Å²	133.7	62%	0.622	73%	0.726	S	S	*	*				76.5	105.9	50.3	-56.8	0	0	0	0	114.9
252	K	34.3	Very low	29.6	Very low	163 Å²	163	132.8 Å²	132.8	71%	0.709	73%	0.727	S	S	*	*			trans	172.8	102.3	138.5	-89.8	141.4	-156.7	144.4	0	109.7	E250	E250-K252 IonicContact OE1-NZ 2.86Å; E250-K252 PolarHBondContact OE1-NZ 3.22Å
253	T	29.3	Very low	30.1	Very low	116 Å²	116	133.4 Å²	133.4	71%	0.712	73%	0.73	S	S	*	*				77.7	120.9	70	60.4	0	0	0	0	115.8
254	L	30.1	Very low	30.3	Very low	155 Å²	155	132.2 Å²	132.2	81%	0.812	72%	0.724	S	S	*	*				161.5	106.1	128.8	-85	152.1	0	0	0	108.2
255	S	30.1	Very low	30.5	Very low	106 Å²	106	134.2 Å²	134.2	74%	0.741	73%	0.727	S	S	*	*				72.4	128.8	88.2	-56.4	0	0	0	0	112.4
256	K	33.4	Very low	30.8	Very low	174 Å²	174	134.4 Å²	134.4	76%	0.757	72%	0.718	S	S	*	*				-159.7	143.8	51.9	-104.1	-163.5	176.2	-128.7	0	110.5
257	E	31.3	Very low	31.1	Very low	137 Å²	137	133.9 Å²	133.9	64%	0.64	71%	0.712	S	S	*	*				59.5	138.4	91.6	-76.6	-170.1	137.7	0	0	115.1
258	I	30.6	Very low	31.4	Very low	125 Å²	125	131.9 Å²	131.9	64%	0.641	70%	0.702	S	S	*	*			cis	-174.2	151.6	-9	-134	171.4	0	0	0	108.7
259	L	32.2	Very low	31.7	Very low	143 Å²	143	133 Å²	133	75%	0.749	70%	0.7	S	S	*	*			trans	57	159.2	161.1	-66	171.3	0	0	0	118.4
260	N	28.5	Very low	31.9	Very low	119 Å²	119	133.7 Å²	133.7	64%	0.636	70%	0.701	S	S	*	*			cis	173.7	158.6	-31.7	-124.7	52.6	0	0	0	105.2
261	D	33	Very low	31.9	Very low	122 Å²	122	130.2 Å²	130.2	65%	0.652	69%	0.693	S	S	*	*			trans	73.2	107.1	153.6	-47.8	-21.9	0	0	0	120.7
262	D	33.6	Very low	32	Very low	145 Å²	145	136.8 Å²	136.8	78%	0.775	71%	0.706	S	S	*	*				80.1	130	127.6	-59.6	-15.2	0	0	0	125
263	D	36.1	Very low	31.6	Very low	137 Å²	137	133.6 Å²	133.6	73%	0.733	71%	0.71	S	S	*	*			trans	87.7	110.1	139	-85.6	0.9	0	0	0	124.1
264	N	33.2	Very low	31.3	Very low	117 Å²	117	135.1 Å²	135.1	63%	0.626	71%	0.714	S	S	*	*			trans	81.9	118.7	130.8	-76.9	-55.2	0	0	0	122.2
265	N	32.3	Very low	31.1	Very low	142 Å²	142	135 Å²	135	76%	0.759	72%	0.715	S	S	*	*			trans	63.3	144	149.4	-61	-30	0	0	0	117.6
266	N	32.2	Very low	30.9	Very low	119 Å²	119	135.6 Å²	135.6	64%	0.636	71%	0.713	S	S	*	*			cis	-154.8	169.8	8.8	-145.8	23.4	0	0	0	110.9
267	D	34.2	Very low	30.4	Very low	115 Å²	115	134.7 Å²	134.7	62%	0.615	72%	0.716	S	S	*	*			trans	70.7	112.1	145.4	-68.6	-25.3	0	0	0	122.6
268	N	32.2	Very low	30.2	Very low	124 Å²	124	133.8 Å²	133.8	66%	0.663	72%	0.724	S	S	*	*				106.8	116.4	121.4	-73.1	-25.9	0	0	0	122.4
269	N	30.8	Very low	30	Very low	131 Å²	131	133.5 Å²	133.5	70%	0.701	73%	0.728	S	S	*	*			trans	72.6	122.9	137.3	-62.6	-21.6	0	0	0	118.3
270	Q	33.7	Very low	29.9	Very low	175 Å²	175	134.2 Å²	134.2	82%	0.818	73%	0.732	S	S	*	*			cis	-160.5	137.1	27.3	-99.7	149.6	-4.1	0	0	108.6
271	S	29.4	Very low	29.9	Very low	81 Å²	81	136.3 Å²	136.3	57%	0.566	74%	0.739	S	S	*	*				70.3	130.8	83.3	-125.6	0	0	0	0	114.3
272	Y	30.6	Very low	29.7	Very low	226 Å²	226	137 Å²	137	89%	0.886	74%	0.742	S	S	*	*			cis	-136.6	158.6	13.4	-86.9	-84.8	0	0	0	112.6
273	A	26.6	Very low	29.7	Very low	97 Å²	97	137 Å²	137	80%	0.802	74%	0.742	S	S	*	*			trans	-121.8	169.2	-176.8	0	0	0	0	0	113.5
274	N	24.2	Very low	29.3	Very low	148 Å²	148	137.1 Å²	137.1	79%	0.791	74%	0.743	S	S	*	*			trans	-78.1	163.8	179.4	-59.5	-42.9	0	0	0	113.8
275	N	24.5	Very low	29.2	Very low	153 Å²	153	139.3 Å²	139.3	82%	0.818	75%	0.753	S	S	*	*			trans	79.1	140.2	140.4	-82.5	8.6	0	0	0	123.4
276	T	26.1	Very low	29.1	Very low	117 Å²	117	137.5 Å²	137.5	72%	0.718	75%	0.747	S	S	*	*			trans	85.5	103.4	144.2	-53.6	0	0	0	0	121.2
277	I	23.3	Very low	29.1	Very low	156 Å²	156	138.3 Å²	138.3	80%	0.8	75%	0.751	S	S	*	*				15.4	125	129.8	-55	170.5	0	0	0	118.3
278	S	26.9	Very low	28.9	Very low	118 Å²	118	138.2 Å²	138.2	83%	0.825	76%	0.755	S	S	*	*			trans	-148.3	153.5	136.6	75.2	0	0	0	0	112
279	V	25.8	Very low	28.8	Very low	118 Å²	118	137.7 Å²	137.7	72%	0.715	76%	0.756	S	S	*	*			trans	-84.1	152.6	-174.7	177.8	0	0	0	0	110.9
280	N	31.6	Very low	28.8	Very low	158 Å²	158	138.3 Å²	138.3	85%	0.845	76%	0.759	S	S	*	*			trans	-162.3	161.1	142.2	-94.5	-23.1	0	0	0	112
281	E	28.5	Very low	28.6	Very low	164 Å²	164	136.6 Å²	136.6	77%	0.766	75%	0.751	S	S	*	*			trans	-93.9	170.5	-157.1	-67.2	165.5	121.8	0	0	116.3
282	D	27.7	Very low	28.8	Very low	136 Å²	136	138.9 Å²	138.9	73%	0.727	76%	0.757	S	S	*	*			trans	90.5	138.5	146.7	-66.6	-24.2	0	0	0	124.2
283	N	33.2	Very low	28.8	Very low	145 Å²	145	135 Å²	135	78%	0.775	75%	0.747	S	S	*	*			trans	86.5	85.2	156.4	-58.2	-46.1	0	0	0	120.8
284	D	28.8	Very low	28.9	Very low	140 Å²	140	137.4 Å²	137.4	75%	0.749	74%	0.741	S	S	*	*				43.6	124.8	107.3	-129.7	7.8	0	0	0	120
285	I	31.6	Very low	29.1	Very low	163 Å²	163	137.3 Å²	137.3	84%	0.836	74%	0.736	S	S	*	*				-176.8	147.5	118	-91.2	156.4	0	0	0	111.2
286	T	29.3	Very low	29.3	Very low	104 Å²	104	135.8 Å²	135.8	64%	0.638	73%	0.726	S	S	*	*			trans	-82.5	166	-168.7	54.5	0	0	0	0	115.9
287	D	32	Very low	29.6	Very low	135 Å²	135	135.5 Å²	135.5	72%	0.722	72%	0.724	S	S	*	*				149.6	150.7	126.6	-80.4	0.4	0	0	0	111.4
288	T	30.5	Very low	29.8	Very low	114 Å²	114	136.4 Å²	136.4	70%	0.699	72%	0.723	S	S	*	*			cis	-161	162.3	-26.2	31.2	0	0	0	0	104.4
289	V	30.4	Very low	29.8	Very low	113 Å²	113	137 Å²	137	69%	0.685	72%	0.717	S	S	*	*				175.9	118.8	75.4	163.6	0	0	0	0	108.4
290	L	31.2	Very low	29.9	Very low	144 Å²	144	137.5 Å²	137.5	75%	0.754	72%	0.72	S	S	*	*			trans	44.2	153.1	132.1	-51.3	-179.5	0	0	0	122.9
291	Q	29.7	Very low	29.8	Very low	139 Å²	139	135 Å²	135	65%	0.65	72%	0.715	S	S	*	*			cis	177	165.4	-20.8	-164.5	88.6	0.3	0	0	107.9
292	N	31.9	Very low	29.7	Very low	129 Å²	129	132.3 Å²	132.3	69%	0.69	71%	0.714	S	S	*	*			trans	81.9	139.4	157.9	-46.7	-46.5	0	0	0	117.9
293	H	30.9	Very low	29.7	Very low	145 Å²	145	132.9 Å²	132.9	67%	0.671	72%	0.716	S	S	*	*			cis	-158.5	160.8	-19.8	-124.9	-74.7	0	0	0	108.7
294	E	28.9	Very low	29.3	Very low	146 Å²	146	132.3 Å²	132.3	68%	0.682	71%	0.713	S	S	*	*			trans	-16.8	161.1	148.5	-77.3	165.5	136.4	0	0	118.8
295	E	29.5	Very low	29.5	Very low	147 Å²	147	135.1 Å²	135.1	69%	0.687	72%	0.721	S	S	*	*			cis	-167.6	156.1	29.2	-140.6	-179.3	162.8	0	0	113.8
296	I	27.6	Very low	29.2	Very low	121 Å²	121	133.4 Å²	133.4	62%	0.621	72%	0.719	S	S	*	*			trans	72.9	126.6	135.1	-99.7	175.2	0	0	0	124.6
297	T	32	Very low	29.2	Very low	110 Å²	110	137.2 Å²	137.2	68%	0.675	73%	0.729	S	S	*	*			trans	64.6	147.3	151.2	57.8	0	0	0	0	120.5
298	K	28.3	Very low	29	Very low	176 Å²	176	137.7 Å²	137.7	77%	0.765	73%	0.727	S	S	*	*			cis	169.5	146.3	-19	-111.5	-178	-169.8	170.9	0	104
299	N	26.7	Very low	28.9	Very low	130 Å²	130	143.6 Å²	143.6	70%	0.695	74%	0.738	S	S	*	*			trans	80.9	109.7	154.8	-57	-6.9	0	0	0	120.9
300	T	26.6	Very low	28.6	Very low	129 Å²	129	144 Å²	144	79%	0.791	74%	0.741	S	S	*	*				82.8	148.7	126.9	56.6	0	0	0	0	122.4
301	S	30.1	Very low	28.5	Very low	104 Å²	104	142.6 Å²	142.6	73%	0.727	74%	0.744	S	S	*	*			trans	68.1	93.1	165.2	56.6	0	0	0	0	119.8
302	S	26.3	Very low	28.6	Very low	109 Å²	109	142.5 Å²	142.5	76%	0.762	75%	0.752	S	S	*	*				59	137.5	109.8	-54	0	0	0	0	122.6
303	I	27.7	Very low	28.3	Very low	147 Å²	147	144.2 Å²	144.2	75%	0.754	76%	0.761	S	S	*	*			trans	91	119.7	145.6	-74.9	162.6	0	0	0	118.3
304	D	25.7	Very low	28.1	Very low	133 Å²	133	147 Å²	147	71%	0.711	77%	0.771	S	S	*	*			trans	48.2	113.7	153.1	-54.8	-10.4	0	0	0	121.4
305	Q	32.3	Very low	28	Very low	200 Å²	200	144.9 Å²	144.9	94%	0.935	77%	0.773	S	S	*	*				-161.3	120.9	116.1	-108.3	143.7	82.3	0	0	112.7
306	T	25.1	Very low	28	Very low	127 Å²	127	145.3 Å²	145.3	78%	0.779	79%	0.785	S	S	*	*			trans	-79.5	128.5	155.4	46	0	0	0	0	109
307	E	29.2	Very low	27.9	Very low	183 Å²	183	146.4 Å²	146.4	86%	0.855	79%	0.791	S	S	*	*				178.3	148.9	126.1	-100.8	172.6	175.3	0	0	113
308	E	28.3	Very low	27.9	Very low	146 Å²	146	146.6 Å²	146.6	68%	0.682	80%	0.797	S	S	*	*			trans	54.2	112.2	143.2	-164.9	170.3	-130.1	0	0	120.8
309	Y	28.2	Very low	28	Very low	237 Å²	237	142.9 Å²	142.9	93%	0.929	79%	0.793	S	S	*	*				-152.3	91.5	126.8	-87.9	-56.4	0	0	0	111.8
310	T	25.4	Very low	28.4	Very low	122 Å²	122	142.1 Å²	142.1	75%	0.748	80%	0.795	S	S	*	*			trans	-88.8	107.4	164	47.9	0	0	0	0	110.9
311	S	29	Very low	28.7	Very low	115 Å²	115	140.5 Å²	140.5	80%	0.804	79%	0.789	S	S	*	*			trans	-178.5	131.4	157.4	-80.5	0	0	0	0	106.7
312	T	30.5	Very low	28.7	Very low	136 Å²	136	142.5 Å²	142.5	83%	0.834	79%	0.792	S	S	*	*				-161	126.3	52.3	-55.1	0	0	0	0	110.5
313	L	25	Very low	29	Very low	165 Å²	165	145.4 Å²	145.4	86%	0.864	79%	0.793	S	S	*	*			trans	-90.4	129.7	163.5	-81.7	169.5	0	0	0	109.9
314	K	27.7	Very low	28.9	Very low	203 Å²	203	143.2 Å²	143.2	88%	0.883	79%	0.79	S	S	*	*				164.5	157.3	124.2	-93.6	172.7	179	179.1	0	114.5
315	S	26.7	Very low	29.3	Very low	103 Å²	103	144.2 Å²	144.2	72%	0.72	79%	0.794	S	S	*	*			trans	89.9	82.7	151.2	-169.7	0	0	0	0	119.4
316	V	29.7	Very low	29.2	Very low	155 Å²	155	141.8 Å²	141.8	94%	0.939	79%	0.788	S	S	*	*				-134.5	113.5	115	-176.4	0	0	0	0	108.7
317	L	25.6	Very low	29.4	Very low	144 Å²	144	139.7 Å²	139.7	75%	0.754	78%	0.778	S	S	*	*			trans	-107.7	141	174.5	-102.6	152.6	0	0	0	108.8
318	S	31.2	Very low	29.3	Very low	115 Å²	115	138.2 Å²	138.2	80%	0.804	78%	0.776	S	S	*	*			trans	165.7	97.3	146.1	-75	0	0	0	0	108.9
319	S	30.1	Very low	29.3	Very low	97 Å²	97	140.3 Å²	140.3	68%	0.678	79%	0.786	S	S	*	*				77.2	153.6	62.6	-64.1	0	0	0	0	114.3
320	P	36.9	Very low	29.5	Very low	115 Å²	115	136.7 Å²	136.7	75%	0.747	78%	0.778	S	S	*	*			cis	-149.2	-158.4	-33.6	41.9	-22.4	0	0	0	114.5
321	S	31.1	Very low	29.5	Very low	95 Å²	95	141.7 Å²	141.7	66%	0.664	78%	0.784	S	S	*	*			trans	93.1	141.9	153	85.3	0	0	0	0	118
322	N	30.5	Very low	29.4	Very low	145 Å²	145	145.1 Å²	145.1	78%	0.775	79%	0.785	S	S	*	*			cis	-154.4	144.8	-15.5	-80.9	-28.8	0	0	0	105.4
323	H	32.9	Very low	29.2	Very low	171 Å²	171	147.1 Å²	147.1	79%	0.792	79%	0.789	S	S	*	*				-172.5	128	62.7	-112.2	-92	0	0	0	104.9
324	S	26.4	Very low	29.3	Very low	100 Å²	100	147 Å²	147	70%	0.699	79%	0.789	S	S	*	*				73.2	99.4	57.9	-164	0	0	0	0	116.1
325	I	32.9	Very low	29.3	Very low	155 Å²	155	143.3 Å²	143.3	80%	0.795	78%	0.783	S	S	*	*			trans	168.2	103	132.2	-82.7	155.4	0	0	0	106.2
326	D	30.1	Very low	29.3	Very low	148 Å²	148	145.4 Å²	145.4	79%	0.791	79%	0.787	S	S	*	*				74.4	125.9	73	-153	38.1	0	0	0	112.2
327	S	29.1	Very low	29.4	Very low	84 Å²	84	147.6 Å²	147.6	59%	0.587	79%	0.786	S	S	*	*			cis	-165.6	158.9	-18.1	30.6	0	0	0	0	111.9
328	D	27.5	Very low	29.5	Very low	152 Å²	152	145.5 Å²	145.5	81%	0.813	78%	0.784	S	S	*	*			trans	38.7	106.1	149.4	-55.9	-24.7	0	0	0	123.4
329	Q	29.8	Very low	29.3	Very low	190 Å²	190	144.9 Å²	144.9	89%	0.888	78%	0.779	S	S	*	*			trans	-178.6	142.5	141.2	-102.5	167.4	10.2	0	0	108.8
330	E	30.6	Very low	29.2	Very low	160 Å²	160	148.4 Å²	148.4	75%	0.748	79%	0.789	S	S	*	*			cis	-154.9	144.7	-11.1	-171.3	-179.7	160.6	0	0	108.5	K332	E330-K332 PolarHBondContact O-N 3.43Å
331	Y	25.9	Very low	29	Very low	227 Å²	227	152.6 Å²	152.6	89%	0.89	80%	0.795	S	S	*	*			trans	-80.2	106.9	176	-75.6	-104.8	0	0	0	111.7
332	K	27.8	Very low	29.1	Very low	187 Å²	187	153.1 Å²	153.1	81%	0.813	80%	0.796	S	S	*	*			trans	-170.3	118.6	153.1	-115.2	168.6	-177.3	179.3	0	113.8	E330	E330-K332 PolarHBondContact O-N 3.43Å
333	L	26.2	Very low	28.9	Very low	178 Å²	178	151.6 Å²	151.6	93%	0.932	79%	0.788	S	S	*	*				174.8	71.7	129.3	-93	170.5	0	0	0	109
334	L	25.8	Very low	28.8	Very low	162 Å²	162	150.5 Å²	150.5	85%	0.848	79%	0.787	S	S	*	*			trans	-107	152.3	161.4	-102.4	157.7	0	0	0	107.7
335	T	28.3	Very low	29.1	Very low	126 Å²	126	153.2 Å²	153.2	77%	0.773	79%	0.794	S	S	*	*			trans	68.7	97.8	-174.8	72.5	0	0	0	0	116.8
336	D	26.3	Very low	29.1	Very low	148 Å²	148	150.6 Å²	150.6	79%	0.791	78%	0.782	S	S	*	*				-163.4	88.5	120.1	-109.3	-17.7	0	0	0	112.7
337	H	31.8	Very low	29.1	Very low	201 Å²	201	149.9 Å²	149.9	93%	0.931	78%	0.776	S	S	*	*			trans	-143.2	90.4	146.7	-94	-57.9	0	0	0	109.6
338	S	27.6	Very low	29.3	Very low	100 Å²	100	150.6 Å²	150.6	70%	0.699	79%	0.788	S	S	*	*			trans	-47.8	158.4	175.3	179.1	0	0	0	0	115.4
339	S	26.8	Very low	29.6	Very low	102 Å²	102	151.2 Å²	151.2	71%	0.713	79%	0.786	S	S	*	*			trans	77.3	80.1	157.6	-57.1	0	0	0	0	118.5
340	I	29.5	Very low	29.6	Very low	170 Å²	170	149.8 Å²	149.8	87%	0.872	78%	0.781	S	S	*	*				-169.2	109	106.1	-85.2	146.6	0	0	0	108.9
341	K	31.4	Very low	29.5	Very low	204 Å²	204	150.6 Å²	150.6	89%	0.887	79%	0.79	S	S	*	*			trans	-127.2	142.6	157.7	-93	-174	177.9	179	0	105
342	P	33.6	Very low	29.8	Very low	105 Å²	105	144 Å²	144	68%	0.682	78%	0.777	S	S	*	*				-148.2	160.8	89.6	37.7	-20.4	0	0	0	116.9
343	N	27.2	Very low	30	Very low	113 Å²	113	143.7 Å²	143.7	60%	0.604	78%	0.779	S	S	*	*			trans	57.8	83.7	145.5	-63	-15.6	0	0	0	120.3
344	L	30.9	Very low	30.5	Very low	149 Å²	149	138.7 Å²	138.7	78%	0.78	76%	0.758	S	S	*	*	S	Bend	trans	-102.9	-4.4	146.9	-94.3	155.1	0	0	0	113.6	N346 I347	L344-N346 PolarHBondContact O-N 3.16Å; L344-I347 HydrophobicContact CD2-CD1 4.08Å
345	N	32.9	Very low	31.1	Very low	156 Å²	156	137.8 Å²	137.8	83%	0.834	75%	0.754	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.8	3.7	-178.6	-83.2	24.8	0	0	0	115.7
346	N	32.2	Very low	32	Very low	101 Å²	101	137.8 Å²	137.8	54%	0.54	75%	0.75	S	S	.	*	T	Hydrogen-bonded Turn	trans	-110.1	-1.9	179.4	-73.9	3.9	0	0	0	114.2	L344 A348 Q349	L344-N346 PolarHBondContact O-N 3.16Å; N346-A348 VanDerWaalsContact C-N 3.28Å; N346-A348 PolarHBondContact O-N 3.39Å; N346-Q349 PolarHBondContact O-N 2.96Å
347	I	30.8	Very low	32.8	Very low	132 Å²	132	137.3 Å²	137.3	68%	0.677	74%	0.743	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.2	0.2	-172	-58.3	-176.3	0	0	0	112.7	L344 Q349	L344-I347 HydrophobicContact CD2-CD1 4.08Å; I347-Q349 VanDerWaalsContact C-N 3.33Å
348	A	32.3	Very low	33.1	Very low	100 Å²	100	132.4 Å²	132.4	83%	0.826	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.5	0.3	169.2	0	0	0	0	0	114.1	N346	N346-A348 VanDerWaalsContact C-N 3.28Å; N346-A348 PolarHBondContact O-N 3.39Å
349	Q	33.5	Very low	33.6	Very low	165 Å²	165	131.3 Å²	131.3	77%	0.771	72%	0.716	S	S	*	*	S	Bend	trans	-142.1	63.1	-176.5	-71	-171.4	-17.1	0	0	113.1	N346 I347	N346-Q349 PolarHBondContact O-N 2.96Å; I347-Q349 VanDerWaalsContact C-N 3.33Å
350	M	30.4	Very low	34.4	Very low	160 Å²	160	133.7 Å²	133.7	79%	0.788	71%	0.713	S	S	*	*			trans	-163.3	71.9	159.7	-115	161.9	-83	0	0	112.1	S352	M350-S352 PolarHBondContact O-N 3.08Å
351	N	28.7	Very low	34.8	Very low	177 Å²	177	129 Å²	129	95%	0.947	69%	0.693	S	S	*	*			trans	-85.5	79.6	167.2	-86.2	-18.6	0	0	0	110.3
352	S	32.1	Very low	35	Very low	87 Å²	87	123.7 Å²	123.7	61%	0.608	68%	0.677	S	S	*	*	S	Bend	trans	-179.6	147	161.5	45.9	0	0	0	0	110.8	M350	M350-S352 PolarHBondContact O-N 3.08Å
353	E	31.8	Very low	35.2	Very low	182 Å²	182	123.9 Å²	123.9	85%	0.85	67%	0.672	S	S	*	*	S	Bend	trans	71.4	128.3	173.3	-105.1	70.6	-159.7	0	0	119.3
354	S	36.7	Very low	35.8	Very low	72 Å²	72	123.8 Å²	123.8	50%	0.503	67%	0.672	S	S	.	*			trans	83.1	68.6	154.7	-155.6	0	0	0	0	120.8	D356	S354-D356 VanDerWaalsContact C-N 3.28Å; S354-D356 PolarHBondContact O-N 2.81Å
355	D	39.3	Very low	36.2	Very low	143 Å²	143	121.4 Å²	121.4	77%	0.765	66%	0.659	S	S	*	*	H	α-helix	trans	-68.1	-16.5	169.9	-71.5	-55.7	0	0	0	115.3	T359	D355-T359 PolarHBondContact O-OG1 2.84Å
356	D	46.5	Very low	36.3	Very low	127 Å²	127	117.2 Å²	117.2	68%	0.679	64%	0.641	S	S	*	*	H	α-helix	trans	-80.9	-19.1	-172.1	-79.5	-26.2	0	0	0	114.8	S354 T359	S354-D356 VanDerWaalsContact C-N 3.28Å; S354-D356 PolarHBondContact O-N 2.81Å; D356-T359 PolarHBondContact O-OG1 2.89Å
357	E	41.9	Very low	36.7	Very low	137 Å²	137	117 Å²	117	64%	0.64	64%	0.64	S	S	*	*	H	α-helix	trans	-92.8	-37.4	-177.5	-169.3	164.5	-160.1	0	0	112.3	K360 T361	E357-K360 PolarHBondContact O-N 3.27Å; E357-T361 WeakPolarHBondContact O-CB 3.21Å; E357-T361 PolarHBondContact O-N 3.11Å; E357-T361 PolarHBondContact O-OG1 2.89Å
358	V	39.6	Very low	37.1	Very low	98 Å²	98	117.2 Å²	117.2	59%	0.594	64%	0.638	S	S	*	*	H	α-helix	trans	-64.3	-43.3	175	-177.9	0	0	0	0	110.4	T361 V362	V358-T361 PolarHBondContact O-N 3.07Å; V358-V362 HydrophobicContact CG1-CG2 4.39Å; V358-V362 WeakPolarHBondContact O-CG2 3.46Å; V358-V362 PolarHBondContact O-N 2.91Å
359	T	38.2	Very low	37.2	Very low	77 Å²	77	120.1 Å²	120.1	47%	0.472	63%	0.629	S	S	.	*	H	α-helix	trans	-62.5	-43.9	177.2	43.9	0	0	0	0	112.6	D355 D356 T361 L363	D355-T359 PolarHBondContact O-OG1 2.84Å; D356-T359 PolarHBondContact O-OG1 2.89Å; T359-T361 PolarHBondContact O-N 3.36Å; T359-L363 WeakPolarHBondContact O-CB 3.39Å; T359-L363 WeakPolarHBondContact O-CG 3.45Å; T359-L363 PolarHBondContact O-N 2.95Å
360	K	43.8	Very low	37.7	Very low	152 Å²	152	118.5 Å²	118.5	66%	0.661	62%	0.62	S	S	*	*	H	α-helix	trans	-61.8	-40.4	172.9	-82.2	176.3	-179.6	164.1	0	113	E357 L363 N364	E357-K360 PolarHBondContact O-N 3.27Å; K360-L363 PolarHBondContact O-N 2.99Å; K360-N364 WeakPolarHBondContact O-CB 3.31Å; K360-N364 PolarHBondContact O-N 3.24Å
361	T	38.1	Very low	38.4	Very low	73 Å²	73	118.8 Å²	118.8	45%	0.448	62%	0.616	S	S	.	*	H	α-helix	trans	-68.2	-43.5	-179.2	-53.2	0	0	0	0	111.2	E357 V358 T359 N364 I365	E357-T361 WeakPolarHBondContact O-CB 3.21Å; E357-T361 PolarHBondContact O-N 3.11Å; E357-T361 PolarHBondContact O-OG1 2.89Å; V358-T361 PolarHBondContact O-N 3.07Å; T359-T361 PolarHBondContact O-N 3.36Å; T361-N364 PolarHBondContact O-N 3.39Å; T361-I365 HydrophobicContact CG2-CD1 4.04Å; T361-I365 VanDerWaalsContact O-CG1 3.31Å; T361-I365 WeakPolarHBondContact O-CG1 3.35Å; T361-I365 PolarHBondContact O-N 2.88Å
362	V	35.4	Very low	38.7	Very low	91 Å²	91	113.7 Å²	113.7	55%	0.552	59%	0.592	S	S	*	*	H	α-helix	trans	-63.9	-40.8	175.5	171	0	0	0	0	111.9	V358 I365 S366	V358-V362 HydrophobicContact CG1-CG2 4.39Å; V358-V362 WeakPolarHBondContact O-CG2 3.46Å; V358-V362 PolarHBondContact O-N 2.91Å; V362-I365 PolarHBondContact O-N 3.12Å; V362-S366 WeakPolarHBondContact O-CB 3.27Å; V362-S366 PolarHBondContact O-N 2.74Å
363	L	37.9	Very low	38.8	Very low	110 Å²	110	112.8 Å²	112.8	58%	0.576	58%	0.583	S	S	*	*	H	α-helix	trans	-63.2	-45.5	175	-74.9	170	0	0	0	111.9	T359 K360 I365 S366 D367	T359-L363 WeakPolarHBondContact O-CB 3.39Å; T359-L363 WeakPolarHBondContact O-CG 3.45Å; T359-L363 PolarHBondContact O-N 2.95Å; K360-L363 PolarHBondContact O-N 2.99Å; L363-I365 PolarHBondContact O-N 3.1Å; L363-S366 PolarHBondContact O-N 3.42Å; L363-D367 PolarHBondContact O-N 3.33Å
364	N	38.1	Very low	39	Very low	111 Å²	111	107.8 Å²	107.8	59%	0.594	56%	0.561	S	S	*	*	H	α-helix	trans	-66.2	-35.3	179.5	-167	32.4	0	0	0	112.7	K360 T361 Q368	K360-N364 WeakPolarHBondContact O-CB 3.31Å; K360-N364 PolarHBondContact O-N 3.24Å; T361-N364 PolarHBondContact O-N 3.39Å; N364-Q368 WeakPolarHBondContact O-CB 3.47Å; N364-Q368 PolarHBondContact O-N 3.3Å
365	I	39.6	Very low	38.7	Very low	99 Å²	99	111.1 Å²	111.1	51%	0.508	57%	0.567	S	S	.	*	H	α-helix	trans	-67.5	-44.3	172.1	-67.9	166.5	0	0	0	110.4	T361 V362 L363 D367 Q368 Y369	T361-I365 HydrophobicContact CG2-CD1 4.04Å; T361-I365 VanDerWaalsContact O-CG1 3.31Å; T361-I365 WeakPolarHBondContact O-CG1 3.35Å; T361-I365 PolarHBondContact O-N 2.88Å; V362-I365 PolarHBondContact O-N 3.12Å; L363-I365 PolarHBondContact O-N 3.1Å; I365-D367 PolarHBondContact O-N 3.27Å; I365-Q368 PolarHBondContact O-N 3.37Å; I365-Y369 WeakPolarHBondContact O-CB 3.38Å; I365-Y369 PolarHBondContact O-N 3Å
366	S	36.1	Very low	38.2	Very low	67 Å²	67	111.4 Å²	111.4	47%	0.469	56%	0.562	S	S	.	*	H	α-helix	trans	-60.6	-43.7	177	-171.9	0	0	0	0	111.8	V362 L363 Y369 K370	V362-S366 WeakPolarHBondContact O-CB 3.27Å; V362-S366 PolarHBondContact O-N 2.74Å; L363-S366 PolarHBondContact O-N 3.42Å; S366-Y369 PolarHBondContact O-N 2.97Å; S366-K370 VanDerWaalsContact O-CB 3.27Å; S366-K370 WeakPolarHBondContact O-CB 3.41Å; S366-K370 PolarHBondContact O-N 3.07Å
367	D	40.9	Very low	37.5	Very low	97 Å²	97	110.6 Å²	110.6	52%	0.519	56%	0.561	S	S	.	*	H	α-helix	trans	-68.3	-37.8	175.7	-80.4	-26.6	0	0	0	112.3	L363 I365 K370 K371	L363-D367 PolarHBondContact O-N 3.33Å; I365-D367 PolarHBondContact O-N 3.27Å; D367-K370 PolarHBondContact O-N 2.92Å; D367-K371 WeakPolarHBondContact O-CB 3.31Å; D367-K371 PolarHBondContact O-N 2.89Å
368	Q	39	Very low	37	Very low	136 Å²	136	111.7 Å²	111.7	64%	0.636	57%	0.566	S	S	*	*	H	α-helix	trans	-61.3	-43.9	170.4	-104.2	-157.1	7	0	0	111.9	N364 I365 K371 T372	N364-Q368 WeakPolarHBondContact O-CB 3.47Å; N364-Q368 PolarHBondContact O-N 3.3Å; I365-Q368 PolarHBondContact O-N 3.37Å; Q368-K371 PolarHBondContact O-N 2.7Å; Q368-T372 VanDerWaalsContact O-CB 3.31Å; Q368-T372 WeakPolarHBondContact O-CB 3.45Å; Q368-T372 PolarHBondContact O-N 2.7Å; Q368-T372 PolarHBondContact O-OG1 2.7Å
369	Y	34.7	Very low	36.3	Very low	161 Å²	161	112.6 Å²	112.6	63%	0.631	56%	0.564	S	S	*	*	H	α-helix	trans	-64	-47.8	178.4	-128.5	-91.7	0	0	0	110.5	I365 S366 K371 T372 V373	I365-Y369 WeakPolarHBondContact O-CB 3.38Å; I365-Y369 PolarHBondContact O-N 3Å; S366-Y369 PolarHBondContact O-N 2.97Å; Y369-K371 VanDerWaalsContact C-N 3.32Å; Y369-K371 PolarHBondContact O-N 3.4Å; Y369-T372 PolarHBondContact O-N 3.23Å; Y369-T372 VanDerWaalsContact O-N 3.13Å; Y369-V373 HydrophobicContact CD1-CG2 4.06Å; Y369-V373 WeakPolarHBondContact O-CB 3.39Å; Y369-V373 VanDerWaalsContact O-CG2 3.31Å; Y369-V373 WeakPolarHBondContact O-CG2 3.21Å; Y369-V373 PolarHBondContact O-N 3.21Å
370	K	43.4	Very low	35.8	Very low	132 Å²	132	113.7 Å²	113.7	57%	0.574	57%	0.574	S	S	*	*	H	α-helix	trans	-62.5	-37.5	178.1	-163.7	174.3	-173.3	179	0	112.3	S366 D367 N374	S366-K370 VanDerWaalsContact O-CB 3.27Å; S366-K370 WeakPolarHBondContact O-CB 3.41Å; S366-K370 PolarHBondContact O-N 3.07Å; D367-K370 PolarHBondContact O-N 2.92Å; K370-N374 WeakPolarHBondContact O-CB 3.31Å; K370-N374 PolarHBondContact O-N 3.01Å; K370-N374 PolarHBondContact O-OD1 2.91Å
371	K	44.5	Very low	35	Very low	166 Å²	166	113.8 Å²	113.8	72%	0.722	58%	0.579	S	S	*	*	H	α-helix	trans	-73.8	-28.4	175.7	-159.1	170.7	-166.2	172.4	0	112.7	D367 Q368 Y369 K375	D367-K371 WeakPolarHBondContact O-CB 3.31Å; D367-K371 PolarHBondContact O-N 2.89Å; Q368-K371 PolarHBondContact O-N 2.7Å; Y369-K371 VanDerWaalsContact C-N 3.32Å; Y369-K371 PolarHBondContact O-N 3.4Å; K371-K375 VanDerWaalsContact O-CB 3.25Å; K371-K375 WeakPolarHBondContact O-CB 3.41Å; K371-K375 PolarHBondContact O-N 3.11Å; K371-K375 VanDerWaalsContact O-N 3.12Å
372	T	36.3	Very low	34.6	Very low	69 Å²	69	113.9 Å²	113.9	42%	0.423	58%	0.581	S	S	.	*	H	α-helix	trans	-77.1	-48.4	173.8	-56.9	0	0	0	0	110.9	Q368 Y369 N374 K375 F376	Q368-T372 VanDerWaalsContact O-CB 3.31Å; Q368-T372 WeakPolarHBondContact O-CB 3.45Å; Q368-T372 PolarHBondContact O-N 2.7Å; Q368-T372 PolarHBondContact O-OG1 2.7Å; Y369-T372 PolarHBondContact O-N 3.23Å; Y369-T372 VanDerWaalsContact O-N 3.13Å; T372-N374 PolarHBondContact O-N 3.16Å; T372-K375 CarbonylContact O-C 3.54Å; T372-K375 WeakPolarHBondContact O-CA 3.28Å; T372-K375 WeakPolarHBondContact O-CB 3.4Å; T372-K375 PolarHBondContact O-N 3.48Å; T372-K375 VanDerWaalsContact O-N 3.07Å; T372-F376 HydrophobicContact CG2-CD2 3.96Å; T372-F376 HydrophobicContact CG2-CE2 4Å; T372-F376 WeakPolarHBondContact O-CD2 3.25Å; T372-F376 PolarHBondContact O-N 3.3Å
373	V	34.4	Very low	34.7	Very low	69 Å²	69	114.9 Å²	114.9	42%	0.418	59%	0.587	S	S	.	*	H	α-helix	trans	-58.4	-47.3	173.7	171.9	0	0	0	0	110.3	Y369 K375 F376 V377	Y369-V373 HydrophobicContact CD1-CG2 4.06Å; Y369-V373 WeakPolarHBondContact O-CB 3.39Å; Y369-V373 VanDerWaalsContact O-CG2 3.31Å; Y369-V373 WeakPolarHBondContact O-CG2 3.21Å; Y369-V373 PolarHBondContact O-N 3.21Å; V373-K375 VanDerWaalsContact C-N 3.3Å; V373-K375 PolarHBondContact O-N 3.36Å; V373-F376 CarbonylContact O-C 3.55Å; V373-F376 PolarHBondContact O-N 3.47Å; V373-F376 VanDerWaalsContact O-N 3.07Å; V373-V377 HydrophobicContact CG1-CG2 4.12Å; V373-V377 WeakPolarHBondContact O-CB 3.31Å; V373-V377 VanDerWaalsContact O-CG2 3.28Å; V373-V377 WeakPolarHBondContact O-CG2 3.3Å; V373-V377 PolarHBondContact O-N 3.24Å
374	N	34.1	Very low	34.5	Very low	76 Å²	76	117.4 Å²	117.4	41%	0.406	59%	0.591	S	S	.	*	H	α-helix	trans	-61.5	-37.1	174.4	-73.4	8	0	0	0	112.1	K370 T372 F376 V377 E378	K370-N374 WeakPolarHBondContact O-CB 3.31Å; K370-N374 PolarHBondContact O-N 3.01Å; K370-N374 PolarHBondContact O-OD1 2.91Å; T372-N374 PolarHBondContact O-N 3.16Å; N374-F376 VanDerWaalsContact C-N 3.3Å; N374-F376 PolarHBondContact O-N 2.85Å; N374-V377 PolarHBondContact O-N 3Å; N374-E378 VanDerWaalsContact O-CB 3.27Å; N374-E378 WeakPolarHBondContact O-CB 3.15Å; N374-E378 WeakPolarHBondContact O-CG 3.42Å; N374-E378 PolarHBondContact O-N 3.34Å
375	K	31.7	Very low	34.7	Very low	142 Å²	142	114.6 Å²	114.6	62%	0.617	58%	0.575	S	S	*	*	H	α-helix	trans	-67.6	-27.2	174.7	-171.6	178.3	179.6	-172.4	0	113.4	K371 T372 V373 Q379	K371-K375 VanDerWaalsContact O-CB 3.25Å; K371-K375 WeakPolarHBondContact O-CB 3.41Å; K371-K375 PolarHBondContact O-N 3.11Å; K371-K375 VanDerWaalsContact O-N 3.12Å; T372-K375 CarbonylContact O-C 3.54Å; T372-K375 WeakPolarHBondContact O-CA 3.28Å; T372-K375 WeakPolarHBondContact O-CB 3.4Å; T372-K375 PolarHBondContact O-N 3.48Å; T372-K375 VanDerWaalsContact O-N 3.07Å; V373-K375 VanDerWaalsContact C-N 3.3Å; V373-K375 PolarHBondContact O-N 3.36Å; K375-Q379 VanDerWaalsContact O-CG 3.31Å; K375-Q379 WeakPolarHBondContact O-CG 3.04Å
376	F	27.8	Very low	34.9	Very low	150 Å²	150	117.1 Å²	117.1	66%	0.658	59%	0.59	S	S	*	*	H	α-helix	trans	-82.7	-29	171.7	-88.5	-80.7	0	0	0	113	T372 V373 N374	T372-F376 HydrophobicContact CG2-CD2 3.96Å; T372-F376 HydrophobicContact CG2-CE2 4Å; T372-F376 WeakPolarHBondContact O-CD2 3.25Å; T372-F376 PolarHBondContact O-N 3.3Å; V373-F376 CarbonylContact O-C 3.55Å; V373-F376 PolarHBondContact O-N 3.47Å; V373-F376 VanDerWaalsContact O-N 3.07Å; N374-F376 VanDerWaalsContact C-N 3.3Å; N374-F376 PolarHBondContact O-N 2.85Å
377	V	32.2	Very low	35.4	Very low	110 Å²	110	123.9 Å²	123.9	67%	0.667	61%	0.605	S	S	*	*	H	α-helix	trans	-84.8	-30.5	179.3	171.6	0	0	0	0	112.3	V373 N374 Q379	V373-V377 HydrophobicContact CG1-CG2 4.12Å; V373-V377 WeakPolarHBondContact O-CB 3.31Å; V373-V377 VanDerWaalsContact O-CG2 3.28Å; V373-V377 WeakPolarHBondContact O-CG2 3.3Å; V373-V377 PolarHBondContact O-N 3.24Å; N374-V377 PolarHBondContact O-N 3Å; V377-Q379 VanDerWaalsContact C-N 3.31Å
378	E	30.5	Very low	35.4	Very low	159 Å²	159	120.6 Å²	120.6	74%	0.743	59%	0.589	S	S	*	*	S	Bend	trans	-81.6	-9.2	172	-68.8	178.1	156.4	0	0	112.7	N374 S380	N374-E378 VanDerWaalsContact O-CB 3.27Å; N374-E378 WeakPolarHBondContact O-CB 3.15Å; N374-E378 WeakPolarHBondContact O-CG 3.42Å; N374-E378 PolarHBondContact O-N 3.34Å; E378-S380 VanDerWaalsContact C-N 3.28Å; E378-S380 PolarHBondContact O-N 3.32Å; E378-S380 VanDerWaalsContact O-N 3.08Å
379	Q	26.9	Very low	35.6	Very low	118 Å²	118	116.6 Å²	116.6	55%	0.551	58%	0.576	S	S	*	*	S	Bend	trans	-81	79.2	164.2	-80.1	-177	-13.9	0	0	109.8	K375 V377 M381	K375-Q379 VanDerWaalsContact O-CG 3.31Å; K375-Q379 WeakPolarHBondContact O-CG 3.04Å; V377-Q379 VanDerWaalsContact C-N 3.31Å; Q379-M381 PolarHBondContact O-N 3.02Å; Q379-M381 VanDerWaalsContact O-N 3.07Å
380	S	27.1	Very low	36	Very low	99 Å²	99	114 Å²	114	69%	0.692	58%	0.579	S	S	*	*			trans	-40.5	113.2	168.1	55	0	0	0	0	111.2	E378 P382	E378-S380 VanDerWaalsContact C-N 3.28Å; E378-S380 PolarHBondContact O-N 3.32Å; E378-S380 VanDerWaalsContact O-N 3.08Å; S380-P382 WeakPolarHBondContact O-CD 3.32Å; S380-P382 VanDerWaalsContact O-N 3.09Å
381	M	25.6	Very low	35.9	Very low	154 Å²	154	111 Å²	111	76%	0.759	58%	0.579	S	S	*	*			trans	-55.3	109.7	-177.5	-93	-72.1	174	0	0	111.5	Q379 Y384	Q379-M381 PolarHBondContact O-N 3.02Å; Q379-M381 VanDerWaalsContact O-N 3.07Å; M381-Y384 HydrophobicContact CE-CD2 4.31Å; M381-Y384 HydrophobicContact CE-CE2 4.35Å; M381-Y384 HydrophobicContact SD-CD2 3.78Å; M381-Y384 HydrophobicContact SD-CE2 4.34Å
382	P	31.5	Very low	35.8	Very low	75 Å²	75	108 Å²	108	49%	0.487	57%	0.568	S	S	.	*			trans	-95.2	113	173.8	17.5	1.9	0	0	0	108.8	S380 Y384	S380-P382 WeakPolarHBondContact O-CD 3.32Å; S380-P382 VanDerWaalsContact O-N 3.09Å; P382-Y384 PolarHBondContact O-N 3.04Å
383	T	36.2	Very low	36	Very low	112 Å²	112	105.9 Å²	105.9	69%	0.687	55%	0.554	S	S	*	*			trans	28.9	68.8	158	31.6	0	0	0	0	115.2	L385 D386	T383-L385 PolarHBondContact O-N 3.33Å; T383-L385 VanDerWaalsContact O-N 3.14Å; T383-D386 PolarHBondContact O-N 3.25Å
384	Y	34.6	Very low	36.2	Very low	164 Å²	164	106.4 Å²	106.4	64%	0.643	56%	0.557	S	S	*	*	G	3₁₀ helix	trans	-66.1	-21.5	-167.3	-148.3	-89.5	0	0	0	114.3	M381 P382 D386	M381-Y384 HydrophobicContact CE-CD2 4.31Å; M381-Y384 HydrophobicContact CE-CE2 4.35Å; M381-Y384 HydrophobicContact SD-CD2 3.78Å; M381-Y384 HydrophobicContact SD-CE2 4.34Å; P382-Y384 PolarHBondContact O-N 3.04Å; Y384-D386 VanDerWaalsContact C-N 3.27Å; Y384-D386 PolarHBondContact O-N 3.24Å
385	L	41.2	Very low	36.5	Very low	52 Å²	52	105.6 Å²	105.6	27%	0.272	56%	0.561	S	S	.	*	G	3₁₀ helix	trans	-63.7	-31.2	177.7	-65.9	176.3	0	0	0	112.8	T383 R387 C388 P402	T383-L385 PolarHBondContact O-N 3.33Å; T383-L385 VanDerWaalsContact O-N 3.14Å; L385-R387 PolarHBondContact O-N 3.24Å; L385-R387 VanDerWaalsContact O-N 3.07Å; L385-C388 PolarHBondContact O-N 3.42Å; L385-P402 HydrophobicContact CD1-CB 4.28Å
386	D	45	Very low	36.7	Very low	151 Å²	151	101.6 Å²	101.6	81%	0.807	55%	0.548	S	S	*	.	G	3₁₀ helix	trans	-74	-0.7	-172.5	-139.8	30.2	0	0	0	113.6	T383 Y384	T383-D386 PolarHBondContact O-N 3.25Å; Y384-D386 VanDerWaalsContact C-N 3.27Å; Y384-D386 PolarHBondContact O-N 3.24Å
387	R	45.7	Very low	37.3	Very low	210 Å²	210	94.5 Å²	94.5	79%	0.792	52%	0.517	S	S	*	.	G	3₁₀ helix	trans	-126.2	0.8	179	-63.4	-175.2	-177.9	167.3	3.4	114	L385	L385-R387 PolarHBondContact O-N 3.24Å; L385-R387 VanDerWaalsContact O-N 3.07Å
388	C	40.2	Very low	37.6	Very low	27 Å²	27	90 Å²	90	18%	0.182	49%	0.492	C	S	.	.	S	Bend	trans	-86.6	140.5	177.7	-77.8	0	0	0	0	110.9	L385 Q392 I393	L385-C388 PolarHBondContact O-N 3.42Å; C388-Q392 HydrophobicContact CB-CB 3.86Å; C388-I393 HydrophobicContact CB-CD1 4.36Å; C388-I393 HydrophobicContact CB-CG1 3.56Å
389	S	43.8	Very low	38.1	Very low	52 Å²	52	84.3 Å²	84.3	36%	0.364	48%	0.477	S	S	.	.			trans	-65.6	157.2	168	81	0	0	0	0	110.2	A391 Q392 I393	S389-A391 PolarHBondContact O-N 3.39Å; S389-A391 VanDerWaalsContact O-N 3.1Å; S389-Q392 CarbonylContact O-C 3.57Å; S389-Q392 WeakPolarHBondContact O-CA 3.3Å; S389-Q392 WeakPolarHBondContact O-CB 3.33Å; S389-Q392 PolarHBondContact O-N 2.97Å; S389-Q392 PolarHBondContact OG-N 3.46Å; S389-I393 PolarHBondContact O-N 3.21Å
390	P	44.1	Very low	39	Very low	106 Å²	106	78.9 Å²	78.9	69%	0.688	45%	0.452	S	S	*	.	H	α-helix	trans	-53.6	-35.3	178.4	-29.1	36.3	0	0	0	113.7	I393 V394	P390-I393 PolarHBondContact O-N 3.14Å; P390-V394 VanDerWaalsContact O-CG2 3.31Å; P390-V394 WeakPolarHBondContact O-CG2 3.17Å; P390-V394 PolarHBondContact O-N 3.03Å
391	A	41	Very low	39.7	Very low	71 Å²	71	79 Å²	79	59%	0.587	45%	0.445	S	S	*	.	H	α-helix	trans	-69.9	-35.5	174.6	0	0	0	0	0	113.1	S389 A395	S389-A391 PolarHBondContact O-N 3.39Å; S389-A391 VanDerWaalsContact O-N 3.1Å; A391-A395 VanDerWaalsContact O-CB 3.24Å; A391-A395 WeakPolarHBondContact O-CB 3.17Å; A391-A395 PolarHBondContact O-N 3.12Å
392	Q	41.9	Very low	40.4	Very low	101 Å²	101	73.4 Å²	73.4	47%	0.472	42%	0.42	S	S	.	.	H	α-helix	trans	-69.6	-38.3	172.5	-70.8	171.6	-13.5	0	0	111.5	C388 S389 V396	C388-Q392 HydrophobicContact CB-CB 3.86Å; S389-Q392 CarbonylContact O-C 3.57Å; S389-Q392 WeakPolarHBondContact O-CA 3.3Å; S389-Q392 WeakPolarHBondContact O-CB 3.33Å; S389-Q392 PolarHBondContact O-N 2.97Å; S389-Q392 PolarHBondContact OG-N 3.46Å; Q392-V396 VanDerWaalsContact O-CB 3.22Å; Q392-V396 WeakPolarHBondContact O-CB 3.5Å; Q392-V396 WeakPolarHBondContact O-CG2 3.45Å; Q392-V396 PolarHBondContact O-N 3.05Å
393	I	40.1	Very low	40.8	Very low	26 Å²	26	73.1 Å²	73.1	13%	0.133	41%	0.414	C	S	.	.	H	α-helix	trans	-59.3	-58.1	172.4	-64.6	175.8	0	0	0	108.5	C388 S389 P390 A395 V396 T397 P402	C388-I393 HydrophobicContact CB-CD1 4.36Å; C388-I393 HydrophobicContact CB-CG1 3.56Å; S389-I393 PolarHBondContact O-N 3.21Å; P390-I393 PolarHBondContact O-N 3.14Å; I393-A395 VanDerWaalsContact C-N 3.3Å; I393-A395 PolarHBondContact O-N 3.21Å; I393-V396 CarbonylContact O-C 3.59Å; I393-V396 WeakPolarHBondContact O-CA 3.17Å; I393-V396 PolarHBondContact O-N 3.27Å; I393-T397 HydrophobicContact CG2-CG2 3.86Å; I393-T397 WeakPolarHBondContact O-CB 3.38Å; I393-T397 VanDerWaalsContact O-CG2 3.29Å; I393-T397 WeakPolarHBondContact O-CG2 3.5Å; I393-T397 PolarHBondContact O-N 3.43Å; I393-T397 PolarHBondContact O-OG1 2.84Å; I393-T397 VanDerWaalsContact O-OG1 3.04Å; I393-P402 HydrophobicContact CD1-CG 4.49Å; I393-P402 HydrophobicContact CG2-CB 3.78Å; I393-P402 HydrophobicContact CG2-CG 3.82Å
394	V	39.7	Very low	41	Very low	80 Å²	80	69.5 Å²	69.5	49%	0.485	39%	0.39	S	S	.	.	H	α-helix	trans	-54	-43.4	179.2	169.7	0	0	0	0	112.6	P390 V396 T397 G398 G399	P390-V394 VanDerWaalsContact O-CG2 3.31Å; P390-V394 WeakPolarHBondContact O-CG2 3.17Å; P390-V394 PolarHBondContact O-N 3.03Å; V394-V396 VanDerWaalsContact C-N 3.33Å; V394-V396 PolarHBondContact O-N 3.2Å; V394-T397 PolarHBondContact O-N 3.18Å; V394-G398 PolarHBondContact O-N 3.01Å; V394-G399 PolarHBondContact O-N 3.18Å
395	A	39.9	Very low	41.4	Very low	59 Å²	59	63.3 Å²	63.3	49%	0.488	37%	0.368	S	S	.	.	H	α-helix	trans	-67.1	-30.7	177.2	0	0	0	0	0	113.7	A391 I393	A391-A395 VanDerWaalsContact O-CB 3.24Å; A391-A395 WeakPolarHBondContact O-CB 3.17Å; A391-A395 PolarHBondContact O-N 3.12Å; I393-A395 VanDerWaalsContact C-N 3.3Å; I393-A395 PolarHBondContact O-N 3.21Å
396	V	34.6	Very low	41.3	Very low	57 Å²	57	65.5 Å²	65.5	35%	0.345	37%	0.373	S	S	.	.	H	α-helix	trans	-86.9	-25.7	178	170.5	0	0	0	0	112	Q392 I393 V394 R596	Q392-V396 VanDerWaalsContact O-CB 3.22Å; Q392-V396 WeakPolarHBondContact O-CB 3.5Å; Q392-V396 WeakPolarHBondContact O-CG2 3.45Å; Q392-V396 PolarHBondContact O-N 3.05Å; I393-V396 CarbonylContact O-C 3.59Å; I393-V396 WeakPolarHBondContact O-CA 3.17Å; I393-V396 PolarHBondContact O-N 3.27Å; V394-V396 VanDerWaalsContact C-N 3.33Å; V394-V396 PolarHBondContact O-N 3.2Å; V396-R596 PolarHBondContact O-NH1 3.48Å; V396-R596 PolarHBondContact O-NH2 3.48Å; V396-R596 VanDerWaalsContact O-NH2 3.12Å
397	T	40.6	Very low	41	Very low	1 Å²	1	60.7 Å²	60.7	1%	0.006	35%	0.347	C	S	.	.	H	α-helix	trans	-103.5	-3.7	-176.9	68.4	0	0	0	0	114.4	I393 V394 G399 A400 I405 N593	I393-T397 HydrophobicContact CG2-CG2 3.86Å; I393-T397 WeakPolarHBondContact O-CB 3.38Å; I393-T397 VanDerWaalsContact O-CG2 3.29Å; I393-T397 WeakPolarHBondContact O-CG2 3.5Å; I393-T397 PolarHBondContact O-N 3.43Å; I393-T397 PolarHBondContact O-OG1 2.84Å; I393-T397 VanDerWaalsContact O-OG1 3.04Å; V394-T397 PolarHBondContact O-N 3.18Å; T397-G399 PolarHBondContact O-N 3.35Å; T397-A400 WeakPolarHBondContact CB-O 3.18Å; T397-A400 WeakPolarHBondContact O-CB 3.36Å; T397-A400 PolarHBondContact O-N 2.7Å; T397-A400 VanDerWaalsContact O-N 3.09Å; T397-A400 PolarHBondContact OG1-O 3.33Å; T397-I405 HydrophobicContact CG2-CD1 3.52Å; T397-I405 HydrophobicContact CG2-CG1 4.38Å; T397-N593 PolarHBondContact O-OD1 2.96Å
398	G	40.3	Very low	40.9	Very low	15 Å²	15	51.7 Å²	51.7	16%	0.155	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	62.8	27.9	-178.6	0	0	0	0	0	113.1	Y184 V394	Y184-G398 PolarHBondContact OH-O 2.93Å; V394-G398 PolarHBondContact O-N 3.01Å
399	G	41	Very low	40.9	Very low	41 Å²	41	55.3 Å²	55.3	42%	0.423	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.9	-16.9	-173.6	0	0	0	0	0	115.2	V394 T397 L401	V394-G399 PolarHBondContact O-N 3.18Å; T397-G399 PolarHBondContact O-N 3.35Å; G399-L401 PolarHBondContact O-N 3.41Å
400	A	44.2	Very low	40.8	Very low	3 Å²	3	57.5 Å²	57.5	3%	0.025	33%	0.333	C	S	.	.			trans	-60.7	132.9	174.5	0	0	0	0	0	110.2	T397	T397-A400 WeakPolarHBondContact CB-O 3.18Å; T397-A400 WeakPolarHBondContact O-CB 3.36Å; T397-A400 PolarHBondContact O-N 2.7Å; T397-A400 VanDerWaalsContact O-N 3.09Å; T397-A400 PolarHBondContact OG1-O 3.33Å
401	L	43.2	Very low	40.6	Very low	103 Å²	103	56.5 Å²	56.5	54%	0.539	32%	0.322	S	S	.	.			trans	-58	138.1	179.9	-159.9	70	0	0	0	109.2	G399 D403 I404 I405	G399-L401 PolarHBondContact O-N 3.41Å; L401-D403 HydrophobicContact CD2-CB 4.31Å; L401-D403 PolarHBondContact O-N 2.93Å; L401-D403 VanDerWaalsContact O-N 3.1Å; L401-I404 HydrophobicContact CB-CD1 3.99Å; L401-I404 HydrophobicContact CB-CG1 4.12Å; L401-I404 WeakPolarHBondContact O-CA 3.49Å; L401-I404 WeakPolarHBondContact O-CB 3.43Å; L401-I404 PolarHBondContact O-N 3.35Å; L401-I405 PolarHBondContact O-N 3.13Å
402	P	39.4	Very low	40.7	Very low	36 Å²	36	54.5 Å²	54.5	23%	0.234	30%	0.301	C	S	.	.	H	α-helix	trans	-56.1	-30.6	-179.7	20	-32.9	0	0	0	112.7	L385 I393 I404 I405 R406	L385-P402 HydrophobicContact CD1-CB 4.28Å; I393-P402 HydrophobicContact CD1-CG 4.49Å; I393-P402 HydrophobicContact CG2-CB 3.78Å; I393-P402 HydrophobicContact CG2-CG 3.82Å; P402-I404 VanDerWaalsContact C-N 3.32Å; P402-I404 PolarHBondContact O-N 3.04Å; P402-I405 PolarHBondContact O-N 3.06Å; P402-R406 VanDerWaalsContact O-CB 3.25Å; P402-R406 WeakPolarHBondContact O-CB 3.26Å; P402-R406 PolarHBondContact O-N 3.01Å
403	D	39.6	Very low	40.6	Very low	68 Å²	68	52.3 Å²	52.3	36%	0.364	29%	0.293	S	S	.	.	H	α-helix	trans	-63.7	-30.9	171.7	-65.8	-58.4	0	0	0	113.5	L401 R406 N407	L401-D403 HydrophobicContact CD2-CB 4.31Å; L401-D403 PolarHBondContact O-N 2.93Å; L401-D403 VanDerWaalsContact O-N 3.1Å; D403-R406 IonicContact OD1-CZ 3.8Å; D403-R406 IonicContact OD1-NE 3.77Å; D403-R406 IonicContact OD1-NH2 2.73Å; D403-R406 PolarHBondContact OD1-NH2 3.14Å; D403-N407 WeakPolarHBondContact O-CB 3.31Å; D403-N407 PolarHBondContact O-N 3.47Å; D403-N407 PolarHBondContact O-ND2 3.12Å; D403-N407 PolarHBondContact O-OD1 3Å; D403-N407 VanDerWaalsContact O-OD1 3.08Å
404	I	41.2	Very low	40.5	Very low	36 Å²	36	58.6 Å²	58.6	19%	0.185	32%	0.321	C	S	.	.	H	α-helix	trans	-67.2	-44.8	175	-66.6	169.5	0	0	0	110	L401 P402 I408 L580	L401-I404 HydrophobicContact CB-CD1 3.99Å; L401-I404 HydrophobicContact CB-CG1 4.12Å; L401-I404 WeakPolarHBondContact O-CA 3.49Å; L401-I404 WeakPolarHBondContact O-CB 3.43Å; L401-I404 PolarHBondContact O-N 3.35Å; P402-I404 VanDerWaalsContact C-N 3.32Å; P402-I404 PolarHBondContact O-N 3.04Å; I404-I408 HydrophobicContact CG2-CD1 3.76Å; I404-I408 HydrophobicContact CG2-CG1 4.49Å; I404-I408 VanDerWaalsContact O-CB 3.29Å; I404-I408 WeakPolarHBondContact O-CB 3.4Å; I404-I408 WeakPolarHBondContact O-CD1 3.48Å; I404-I408 WeakPolarHBondContact O-CG1 3.47Å; I404-I408 PolarHBondContact O-N 2.95Å; I404-L580 HydrophobicContact CG2-CB 4.32Å; I404-L580 WeakPolarHBondContact CG2-O 3.14Å
405	I	42.3	Very low	40.3	Very low	35 Å²	35	60 Å²	60	18%	0.179	33%	0.33	C	S	.	.	H	α-helix	trans	-68.7	-40.2	177.2	-60.3	-166.5	0	0	0	110.9	T397 L401 P402 I408 E409	T397-I405 HydrophobicContact CG2-CD1 3.52Å; T397-I405 HydrophobicContact CG2-CG1 4.38Å; L401-I405 PolarHBondContact O-N 3.13Å; P402-I405 PolarHBondContact O-N 3.06Å; I405-I408 CarbonylContact O-C 3.48Å; I405-I408 PolarHBondContact O-N 3.11Å; I405-E409 PolarHBondContact O-N 3.14Å
406	R	39.4	Very low	39.9	Very low	98 Å²	98	62.4 Å²	62.4	37%	0.37	33%	0.334	S	S	.	.	H	α-helix	trans	-65	-41.8	177.1	-169.8	171.8	66.6	77.1	10.1	111.7	P402 D403 E409 E410	P402-R406 VanDerWaalsContact O-CB 3.25Å; P402-R406 WeakPolarHBondContact O-CB 3.26Å; P402-R406 PolarHBondContact O-N 3.01Å; D403-R406 IonicContact OD1-CZ 3.8Å; D403-R406 IonicContact OD1-NE 3.77Å; D403-R406 IonicContact OD1-NH2 2.73Å; D403-R406 PolarHBondContact OD1-NH2 3.14Å; R406-E409 CarbonylContact O-C 3.56Å; R406-E409 PolarHBondContact O-N 2.69Å; R406-E410 VanDerWaalsContact CD-OE1 3.27Å; R406-E410 WeakPolarHBondContact CD-OE1 2.94Å; R406-E410 HydrophobicContact CG-CG 4.15Å; R406-E410 WeakPolarHBondContact CG-OE1 3.42Å; R406-E410 IonicContact CZ-OE1 3.32Å; R406-E410 IonicContact CZ-OE2 3.54Å; R406-E410 IonicContact NE-OE1 3.24Å; R406-E410 IonicContact NH1-OE1 2.66Å; R406-E410 PolarHBondContact NH1-OE1 3.36Å; R406-E410 IonicContact NH1-OE2 2.8Å; R406-E410 PolarHBondContact NH1-OE2 2.93Å; R406-E410 WeakPolarHBondContact O-CB 3.38Å; R406-E410 WeakPolarHBondContact O-CG 3.28Å; R406-E410 PolarHBondContact O-N 3.08Å
407	N	38.8	Very low	39.8	Very low	49 Å²	49	65.6 Å²	65.6	26%	0.262	35%	0.349	S	S	.	.	H	α-helix	trans	-69.3	-35.7	173.3	-64.4	2.2	0	0	0	111.7	D403 E409 D411	D403-N407 WeakPolarHBondContact O-CB 3.31Å; D403-N407 PolarHBondContact O-N 3.47Å; D403-N407 PolarHBondContact O-ND2 3.12Å; D403-N407 PolarHBondContact O-OD1 3Å; D403-N407 VanDerWaalsContact O-OD1 3.08Å; N407-E409 PolarHBondContact O-N 2.96Å; N407-D411 WeakPolarHBondContact O-CA 3.13Å; N407-D411 WeakPolarHBondContact O-CB 3.42Å; N407-D411 PolarHBondContact O-N 2.93Å
408	I	42.5	Very low	39.4	Very low	21 Å²	21	72.5 Å²	72.5	11%	0.108	39%	0.386	C	S	.	.	H	α-helix	trans	-63.2	-15.9	169.7	-73.1	167.6	0	0	0	112.1	I404 I405 L412 L580 V597	I404-I408 HydrophobicContact CG2-CD1 3.76Å; I404-I408 HydrophobicContact CG2-CG1 4.49Å; I404-I408 VanDerWaalsContact O-CB 3.29Å; I404-I408 WeakPolarHBondContact O-CB 3.4Å; I404-I408 WeakPolarHBondContact O-CD1 3.48Å; I404-I408 WeakPolarHBondContact O-CG1 3.47Å; I404-I408 PolarHBondContact O-N 2.95Å; I405-I408 CarbonylContact O-C 3.48Å; I405-I408 PolarHBondContact O-N 3.11Å; I408-L412 WeakPolarHBondContact O-CD1 3.35Å; I408-L412 WeakPolarHBondContact O-CG 3.42Å; I408-L580 HydrophobicContact CD1-CB 4.24Å; I408-L580 HydrophobicContact CG1-CB 4.13Å; I408-L580 HydrophobicContact CG1-CD1 3.57Å; I408-V597 HydrophobicContact CG2-CG2 4.49Å
409	E	42	Very low	38.9	Very low	103 Å²	103	77.7 Å²	77.7	48%	0.481	41%	0.411	S	S	.	.	H	α-helix	trans	-104.9	-36.4	175.5	-164.2	149.6	-135.4	0	0	113.1	I405 R406 N407 R601	I405-E409 PolarHBondContact O-N 3.14Å; R406-E409 CarbonylContact O-C 3.56Å; R406-E409 PolarHBondContact O-N 2.69Å; N407-E409 PolarHBondContact O-N 2.96Å; E409-R601 IonicContact OE1-NH2 3.33Å
410	E	41.1	Very low	38.4	Very low	98 Å²	98	81.3 Å²	81.3	46%	0.458	42%	0.424	S	S	.	.	H	α-helix	trans	-82	-43.3	179	-69.9	177.2	-167	0	0	113.2	R406 L412 D413	R406-E410 VanDerWaalsContact CD-OE1 3.27Å; R406-E410 WeakPolarHBondContact CD-OE1 2.94Å; R406-E410 HydrophobicContact CG-CG 4.15Å; R406-E410 WeakPolarHBondContact CG-OE1 3.42Å; R406-E410 IonicContact CZ-OE1 3.32Å; R406-E410 IonicContact CZ-OE2 3.54Å; R406-E410 IonicContact NE-OE1 3.24Å; R406-E410 IonicContact NH1-OE1 2.66Å; R406-E410 PolarHBondContact NH1-OE1 3.36Å; R406-E410 IonicContact NH1-OE2 2.8Å; R406-E410 PolarHBondContact NH1-OE2 2.93Å; R406-E410 WeakPolarHBondContact O-CB 3.38Å; R406-E410 WeakPolarHBondContact O-CG 3.28Å; R406-E410 PolarHBondContact O-N 3.08Å; E410-L412 PolarHBondContact O-N 3.14Å; E410-D413 PolarHBondContact O-N 2.92Å; E410-D413 VanDerWaalsContact O-N 3.15Å
411	D	39.8	Very low	37.7	Very low	85 Å²	85	87.6 Å²	87.6	46%	0.455	46%	0.456	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	0.9	178.5	-63.1	-25.3	0	0	0	112.8	N407	N407-D411 WeakPolarHBondContact O-CA 3.13Å; N407-D411 WeakPolarHBondContact O-CB 3.42Å; N407-D411 PolarHBondContact O-N 2.93Å
412	L	43	Very low	37	Very low	29 Å²	29	90.1 Å²	90.1	15%	0.152	47%	0.465	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-13.8	171.7	-69.2	-179	0	0	0	113.8	I408 E410 R573	I408-L412 WeakPolarHBondContact O-CD1 3.35Å; I408-L412 WeakPolarHBondContact O-CG 3.42Å; E410-L412 PolarHBondContact O-N 3.14Å; L412-R573 HydrophobicContact CD2-CG 4.06Å; L412-R573 VanDerWaalsContact CD2-NE 3.33Å
413	D	39.1	Very low	36.6	Very low	56 Å²	56	94.1 Å²	94.1	30%	0.299	49%	0.489	S	S	.	.			trans	-93.6	-9.6	-172.5	-80.8	-19.2	0	0	0	114.1	E410 V415	E410-D413 PolarHBondContact O-N 2.92Å; E410-D413 VanDerWaalsContact O-N 3.15Å; D413-V415 PolarHBondContact O-N 3.38Å
414	E	39.3	Very low	36.1	Very low	158 Å²	158	98.2 Å²	98.2	74%	0.738	51%	0.51	S	S	*	.			trans	-78.1	84.3	171.9	-74.1	-149.7	148.6	0	0	112.6	N416	E414-N416 VanDerWaalsContact C-N 3.26Å; E414-N416 PolarHBondContact O-N 3.29Å; E414-N416 VanDerWaalsContact O-N 3.12Å
415	V	33.8	Very low	35.4	Very low	110 Å²	110	102.8 Å²	102.8	67%	0.667	53%	0.534	S	S	*	.			trans	-78.9	76.7	160.3	-174.5	0	0	0	0	109.1	D413	D413-V415 PolarHBondContact O-N 3.38Å
416	N	32.5	Very low	34.7	Very low	108 Å²	108	106.2 Å²	106.2	58%	0.578	56%	0.557	S	S	*	*			trans	-132	81.2	167.3	-107.7	-12.7	0	0	0	109.3	E414 D418	E414-N416 VanDerWaalsContact C-N 3.26Å; E414-N416 PolarHBondContact O-N 3.29Å; E414-N416 VanDerWaalsContact O-N 3.12Å; N416-D418 PolarHBondContact O-N 3.15Å
417	D	32.5	Very low	34.1	Very low	124 Å²	124	109.9 Å²	109.9	66%	0.663	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.4	-4.3	-177.6	-75.4	-42.9	0	0	0	114.1
418	D	32.7	Very low	33.7	Very low	146 Å²	146	111.8 Å²	111.8	78%	0.781	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.7	-11.7	-169.2	-64.5	-28.8	0	0	0	115.1	N416	N416-D418 PolarHBondContact O-N 3.15Å
419	N	29.2	Very low	33.2	Very low	125 Å²	125	119.5 Å²	119.5	67%	0.668	64%	0.643	S	S	*	*	S	Bend	trans	-111.6	-3.8	-171.7	-100.9	13.4	0	0	0	116.4
420	V	30.8	Very low	33	Very low	117 Å²	117	121.6 Å²	121.6	71%	0.709	65%	0.652	S	S	*	*	S	Bend	trans	-93.4	-6	-171.3	-176.2	0	0	0	0	113.6
421	I	29.3	Very low	32.5	Very low	135 Å²	135	121.2 Å²	121.2	69%	0.692	65%	0.65	S	S	*	*	S	Bend	trans	-89	-14.6	179.4	-68.2	-176.8	0	0	0	113.3	N425	I421-N425 PolarHBondContact O-ND2 3.04Å; I421-N425 VanDerWaalsContact O-ND2 3.08Å
422	E	28.7	Very low	32.4	Very low	155 Å²	155	122.6 Å²	122.6	72%	0.724	66%	0.662	S	S	*	*	S	Bend	trans	-91.5	-13.1	-174	-149.1	170.2	-156.8	0	0	114.7
423	V	30.6	Very low	32.2	Very low	120 Å²	120	128.4 Å²	128.4	73%	0.727	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.9	-1.6	-175.3	-173	0	0	0	0	113.7
424	L	28.8	Very low	32.2	Very low	155 Å²	155	128.1 Å²	128.1	81%	0.812	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.2	14.7	179.4	-67.7	176	0	0	0	114.1
425	N	28.2	Very low	32.1	Very low	131 Å²	131	126 Å²	126	70%	0.701	70%	0.697	S	S	*	*	S	Bend	trans	-121.1	18.3	-178.7	-77	-53.9	0	0	0	113.9	I421	I421-N425 PolarHBondContact O-ND2 3.04Å; I421-N425 VanDerWaalsContact O-ND2 3.08Å
426	T	27.3	Very low	32.4	Very low	108 Å²	108	125 Å²	125	66%	0.663	70%	0.7	S	S	*	*			trans	-132.4	64.6	-179.8	60.5	0	0	0	0	112.6
427	D	26.8	Very low	32.6	Very low	174 Å²	174	124.7 Å²	124.7	93%	0.93	71%	0.706	S	S	*	*			trans	-141.3	63.1	162.3	-93.1	-40.9	0	0	0	109.7
428	A	30.3	Very low	32.8	Very low	90 Å²	90	123.7 Å²	123.7	74%	0.744	71%	0.71	S	S	*	*			trans	-145.8	123.9	167	0	0	0	0	0	110.3
429	E	32.2	Very low	32.8	Very low	183 Å²	183	122 Å²	122	86%	0.855	71%	0.709	S	S	*	*			trans	80.1	105	162.1	-52.8	-165.3	174	0	0	121.1
430	H	36.6	Very low	33.1	Very low	147 Å²	147	125.1 Å²	125.1	68%	0.681	72%	0.722	S	S	*	*			trans	93.4	141.2	131	-102.2	-66.3	0	0	0	123.5	N239	N239-H430 PolarHBondContact OD1-CE1 2.74Å
431	E	31.4	Very low	33.3	Very low	89 Å²	89	127 Å²	127	42%	0.416	73%	0.728	S	S	.	*			trans	-85.2	173.9	-164.8	-54.1	-178.8	124.7	0	0	116.4	S237 N239	S237-E431 VanDerWaalsContact CB-OE1 3.25Å; S237-E431 WeakPolarHBondContact CB-OE1 3.03Å; S237-E431 PolarHBondContact OG-OE1 2.83Å; N239-E431 PolarHBondContact ND2-OE2 2.8Å
432	T	37.2	Very low	33.8	Very low	114 Å²	114	125.8 Å²	125.8	70%	0.699	73%	0.729	S	S	*	*			trans	103.3	74.9	150.6	64.6	0	0	0	0	121.4
433	N	39.3	Very low	33.9	Very low	151 Å²	151	123.5 Å²	123.5	81%	0.807	73%	0.73	S	S	*	*				54.8	156.9	115.8	-84.4	-20.7	0	0	0	123.9
434	P	39.5	Very low	34	Very low	51 Å²	51	125.1 Å²	125.1	33%	0.331	74%	0.735	S	S	.	*			trans	-137	-173.4	-140.6	42	-23.1	0	0	0	116	F51	F51-P434 HydrophobicContact CB-CG 3.96Å; F51-P434 HydrophobicContact CD1-CB 3.73Å; F51-P434 HydrophobicContact CD1-CG 3.1Å; F51-P434 HydrophobicContact CD2-CG 3.92Å; F51-P434 HydrophobicContact CE1-CB 3.88Å; F51-P434 HydrophobicContact CE1-CG 3.45Å; F51-P434 VanDerWaalsContact CE1-CG 3.45Å; F51-P434 HydrophobicContact CE2-CG 4.21Å; F51-P434 HydrophobicContact CG-CB 4.45Å; F51-P434 HydrophobicContact CG-CG 3.37Å; F51-P434 HydrophobicContact CZ-CG 4Å
435	S	36.8	Very low	34.1	Very low	113 Å²	113	124.8 Å²	124.8	79%	0.79	73%	0.732	S	S	*	*			trans	-165.5	128.9	163.4	-81.6	0	0	0	0	115.7
436	A	40.9	Very low	34.1	Very low	89 Å²	89	125 Å²	125	74%	0.736	74%	0.738	S	S	*	*			trans	47.4	146.7	140.3	0	0	0	0	0	122.4
437	S	36.3	Very low	34.3	Very low	101 Å²	101	130.4 Å²	130.4	71%	0.706	75%	0.746	S	S	*	*			cis	-166.7	161.3	0.5	47.9	0	0	0	0	113.5
438	S	35.6	Very low	34.4	Very low	104 Å²	104	131.3 Å²	131.3	73%	0.727	75%	0.745	S	S	*	*			trans	56.8	116.3	155.4	55.9	0	0	0	0	119.4
439	S	32.8	Very low	34.3	Very low	110 Å²	110	139.2 Å²	139.2	77%	0.769	76%	0.755	S	S	*	*			cis	78.7	105.7	44.8	-169.6	0	0	0	0	115.9
440	M	35.6	Very low	34.1	Very low	191 Å²	191	133.6 Å²	133.6	94%	0.941	75%	0.746	S	S	*	*			trans	-145.2	138.3	138.2	-74.4	-163.3	75.3	0	0	108.5
441	N	35.8	Very low	33.7	Very low	155 Å²	155	135.5 Å²	135.5	83%	0.829	76%	0.755	S	S	*	*			trans	-112.9	177.8	-168.8	-122	-1	0	0	0	111.4
442	P	39.5	Very low	33.5	Very low	110 Å²	110	138.7 Å²	138.7	71%	0.714	78%	0.775	S	S	*	*			trans	-117.6	170.5	-136.7	40.5	-27.9	0	0	0	115.6
443	S	31	Very low	33	Very low	107 Å²	107	139 Å²	139	75%	0.748	78%	0.782	S	S	*	*			trans	-159.7	144.8	155.8	-23.3	0	0	0	0	112.7
444	N	31.5	Very low	32.6	Very low	155 Å²	155	140.7 Å²	140.7	83%	0.829	79%	0.785	S	S	*	*			trans	58.9	91.3	152.1	-55.7	-20.7	0	0	0	120.1
445	I	31.5	Very low	32.1	Very low	148 Å²	148	143.2 Å²	143.2	76%	0.759	80%	0.804	S	S	*	*			trans	-133.8	109.7	140	-62.3	-174.7	0	0	0	110.1	R447	I445-R447 HydrophobicContact CG2-CG 4.02Å
446	V	27.3	Very low	31.8	Very low	135 Å²	135	146.3 Å²	146.3	82%	0.818	81%	0.811	S	S	*	*			trans	-76.2	130.4	161.7	171.6	0	0	0	0	108.7
447	R	32.9	Very low	31.2	Very low	222 Å²	222	150.8 Å²	150.8	84%	0.838	81%	0.814	S	S	*	*			trans	-139.2	110.4	160.1	-80.6	-171.9	-178.2	174	2.5	111.1	I445	I445-R447 HydrophobicContact CG2-CG 4.02Å
448	Q	27.6	Very low	30.9	Very low	193 Å²	193	151.6 Å²	151.6	90%	0.902	82%	0.819	S	S	*	*			trans	-74	129	158.6	-73.3	178.7	-37.4	0	0	109.8
449	R	29.2	Very low	30.5	Very low	255 Å²	255	153 Å²	153	96%	0.962	82%	0.815	S	S	*	*			trans	-165.6	128.8	158.2	-144.9	174.7	-168.7	170.2	2.9	104
450	G	28.5	Very low	30.5	Very low	65 Å²	65	156.4 Å²	156.4	67%	0.67	82%	0.815	S	S	*	*			cis	149.7	137.7	16.1	0	0	0	0	0	104.4
451	H	26.6	Very low	30.4	Very low	188 Å²	188	149.7 Å²	149.7	87%	0.87	79%	0.786	S	S	*	*			trans	-45.6	137.3	-167.3	-58.4	-92.9	0	0	0	115
452	N	27.6	Very low	30.4	Very low	155 Å²	155	144.8 Å²	144.8	83%	0.829	76%	0.762	S	S	*	*				-151.2	130.1	129	-94.5	-15.3	0	0	0	108.5	E454	N452-E454 PolarHBondContact O-N 3.22Å
453	S	26.2	Very low	30.4	Very low	122 Å²	122	142.3 Å²	142.3	85%	0.853	75%	0.745	S	S	*	*			trans	-89.4	92.8	177.7	52.9	0	0	0	0	109.4
454	E	31.6	Very low	31.1	Very low	186 Å²	186	138.3 Å²	138.3	87%	0.869	72%	0.715	S	S	*	*			trans	-85.1	127.3	170.2	-73.7	-173.2	143.8	0	0	110.5	N452 L456	N452-E454 PolarHBondContact O-N 3.22Å; E454-L456 PolarHBondContact O-N 3.11Å
455	S	28.5	Very low	31.7	Very low	104 Å²	104	133.6 Å²	133.6	73%	0.727	69%	0.689	S	S	*	*			trans	-55	127.2	-176.4	175.8	0	0	0	0	112	K457	S455-K457 PolarHBondContact O-N 3.05Å
456	L	30.6	Very low	32.4	Very low	178 Å²	178	126.9 Å²	126.9	93%	0.932	66%	0.655	S	S	*	*			trans	-61.2	84	160.4	-81.6	152.5	0	0	0	109.1	E454 S458	E454-L456 PolarHBondContact O-N 3.11Å; L456-S458 PolarHBondContact O-N 3.46Å
457	K	29.8	Very low	33.2	Very low	182 Å²	182	123 Å²	123	79%	0.791	63%	0.629	S	S	*	*			trans	-63	117.2	164.2	-92.7	-175.8	172.9	-179.5	0	107.5	S455 Q459	S455-K457 PolarHBondContact O-N 3.05Å; K457-Q459 PolarHBondContact O-N 3.28Å
458	S	28.5	Very low	33.9	Very low	118 Å²	118	112.7 Å²	112.7	83%	0.825	59%	0.591	S	S	*	*			trans	-56.2	107.3	168.2	174.1	0	0	0	0	109	L456	L456-S458 PolarHBondContact O-N 3.46Å
459	Q	28.8	Very low	34.7	Very low	135 Å²	135	111.4 Å²	111.4	63%	0.631	58%	0.578	S	S	*	*	P	Polyproline II helix	trans	-76	123.9	176.8	-139	151.2	-34.9	0	0	107.7	K457	K457-Q459 PolarHBondContact O-N 3.28Å
460	K	32.9	Very low	35.7	Very low	181 Å²	181	100 Å²	100	79%	0.787	54%	0.537	S	S	*	.	P	Polyproline II helix	trans	-92.7	117.3	-170.5	-175.1	176.4	-178.4	178.5	0	108.9	V462	K460-V462 PolarHBondContact O-N 2.88Å
461	P	32	Very low	36.4	Very low	50 Å²	50	101.1 Å²	101.1	33%	0.325	53%	0.53	S	S	.	.	P	Polyproline II helix	trans	-71.6	133.5	-163.5	29.8	-38.1	0	0	0	112.1	T463 R601	P461-T463 PolarHBondContact O-N 3.4Å; P461-R601 VanDerWaalsContact CB-NH2 3.31Å; P461-R601 VanDerWaalsContact CG-NH2 3.33Å
462	V	37.3	Very low	37.5	Very low	52 Å²	52	93.2 Å²	93.2	32%	0.315	50%	0.496	S	S	.	.			trans	-64.1	113.8	-161.1	-170.3	0	0	0	0	113.4	K460 R573	K460-V462 PolarHBondContact O-N 2.88Å; V462-R573 VanDerWaalsContact O-CZ 3.29Å; V462-R573 PolarHBondContact O-NH1 3.43Å; V462-R573 PolarHBondContact O-NH2 3.45Å
463	T	39.1	Very low	38.5	Very low	58 Å²	58	96.4 Å²	96.4	36%	0.356	50%	0.503	S	S	.	.			trans	-79.3	131.9	177	-50.9	0	0	0	0	112.5	P461 N465	P461-T463 PolarHBondContact O-N 3.4Å; T463-N465 VanDerWaalsContact C-N 3.34Å; T463-N465 HydrophobicContact CG2-CB 3.94Å; T463-N465 PolarHBondContact O-N 3.5Å; T463-N465 VanDerWaalsContact O-N 3.11Å
464	I	46	Very low	40.1	Very low	23 Å²	23	92.9 Å²	92.9	12%	0.118	47%	0.474	C	S	.	.			trans	-76.2	90.7	160.1	-59.2	178	0	0	0	106.7	I466 Y570 L574 L598 T611	I464-I466 HydrophobicContact CG2-CD1 3.88Å; I464-I466 HydrophobicContact CG2-CG1 4.15Å; I464-I466 PolarHBondContact O-N 3.26Å; I464-Y570 HydrophobicContact CG1-CD1 4.38Å; I464-Y570 HydrophobicContact CG2-CD1 4.14Å; I464-Y570 HydrophobicContact CG2-CD2 4.29Å; I464-Y570 HydrophobicContact CG2-CE1 4.06Å; I464-Y570 HydrophobicContact CG2-CE2 4.21Å; I464-Y570 HydrophobicContact CG2-CG 4.25Å; I464-L574 HydrophobicContact CD1-CD2 4.18Å; I464-L598 HydrophobicContact CD1-CD2 4.22Å; I464-T611 HydrophobicContact CD1-CG2 4.04Å; I464-T611 HydrophobicContact CG2-CG2 4.4Å
465	N	43.5	Very low	41.6	Very low	56 Å²	56	88.9 Å²	88.9	30%	0.299	46%	0.463	S	S	.	.			trans	-98.5	91.5	-169.6	-154.8	8	0	0	0	111.3	D125 T463	D125-N465 PolarHBondContact O-ND2 2.86Å; D125-N465 VanDerWaalsContact O-ND2 3.12Å; T463-N465 VanDerWaalsContact C-N 3.34Å; T463-N465 HydrophobicContact CG2-CB 3.94Å; T463-N465 PolarHBondContact O-N 3.5Å; T463-N465 VanDerWaalsContact O-N 3.11Å
466	I	46.3	Very low	43.2	Very low	7 Å²	7	89.3 Å²	89.3	4%	0.036	46%	0.463	C	S	.	.			trans	-117.6	75.9	178	-53.6	168.4	0	0	0	107.9	I464 L468 I566 Y570 N605 G607	I464-I466 HydrophobicContact CG2-CD1 3.88Å; I464-I466 HydrophobicContact CG2-CG1 4.15Å; I464-I466 PolarHBondContact O-N 3.26Å; I466-L468 VanDerWaalsContact C-N 3.26Å; I466-L468 HydrophobicContact CG2-CD1 3.91Å; I466-L468 HydrophobicContact CG2-CG 4.38Å; I466-L468 PolarHBondContact O-N 3.15Å; I466-I566 HydrophobicContact CD1-CD1 4.18Å; I466-I566 HydrophobicContact CD1-CG1 4.11Å; I466-Y570 HydrophobicContact CD1-CD2 4.1Å; I466-Y570 HydrophobicContact CD1-CE2 3.66Å; I466-Y570 HydrophobicContact CG1-CE2 3.79Å; I466-N605 PolarHBondContact O-OD1 3.03Å; I466-G607 WeakPolarHBondContact O-CA 3.3Å; I466-G607 PolarHBondContact O-N 2.73Å
467	D	43	Very low	45.6	Very low	53 Å²	53	81.4 Å²	81.4	28%	0.283	42%	0.422	S	S	.	.			trans	-76.3	75.4	179.8	-168.3	14	0	0	0	112	I122 R469	I122-D467 WeakPolarHBondContact CG2-O 3.46Å; D467-R469 PolarHBondContact O-N 2.74Å; D467-R469 VanDerWaalsContact OD1-CG 3.3Å; D467-R469 WeakPolarHBondContact OD1-CG 3.27Å; D467-R469 IonicContact OD1-NE 3.53Å; D467-R469 IonicContact OD1-NH2 3.9Å; D467-R469 IonicContact OD2-CZ 3.9Å; D467-R469 IonicContact OD2-NE 2.74Å; D467-R469 PolarHBondContact OD2-NE 3.33Å; D467-R469 IonicContact OD2-NH2 3Å; D467-R469 PolarHBondContact OD2-NH2 2.85Å
468	L	47.9	Very low	48.5	Very low	5 Å²	5	75.6 Å²	75.6	3%	0.026	40%	0.402	C	S	.	.			trans	-72	84.4	173	-104.8	152.9	0	0	0	110.6	L92 I122 I466 V470 W606 I610 L664	L92-L468 HydrophobicContact CB-CD2 4.42Å; L92-L468 HydrophobicContact CD1-CD1 3.68Å; L92-L468 HydrophobicContact CD1-CD2 3.63Å; L92-L468 HydrophobicContact CD1-CG 3.8Å; I122-L468 HydrophobicContact CD1-CB 4.37Å; I122-L468 HydrophobicContact CD1-CD2 3.51Å; I122-L468 HydrophobicContact CD1-CG 3.88Å; I466-L468 VanDerWaalsContact C-N 3.26Å; I466-L468 HydrophobicContact CG2-CD1 3.91Å; I466-L468 HydrophobicContact CG2-CG 4.38Å; I466-L468 PolarHBondContact O-N 3.15Å; L468-V470 HydrophobicContact CD2-CG2 4.5Å; L468-W606 HydrophobicContact CB-CB 3.31Å; L468-W606 HydrophobicContact CB-CG 4.27Å; L468-W606 HydrophobicContact CD1-CB 4.01Å; L468-W606 HydrophobicContact CG-CB 4.19Å; L468-I610 HydrophobicContact CD1-CD1 3.62Å; L468-L664 HydrophobicContact CD2-CD1 3.55Å
469	R	45.8	Very low	51.6	Low	166 Å²	166	72.1 Å²	72.1	63%	0.626	38%	0.377	S	S	*	.			trans	-89.2	102.6	171.6	-64.7	-170.7	-173.6	-105.4	-13.6	111.7	I120 D467 V471	I120-R469 WeakPolarHBondContact CG2-O 3.27Å; D467-R469 PolarHBondContact O-N 2.74Å; D467-R469 VanDerWaalsContact OD1-CG 3.3Å; D467-R469 WeakPolarHBondContact OD1-CG 3.27Å; D467-R469 IonicContact OD1-NE 3.53Å; D467-R469 IonicContact OD1-NH2 3.9Å; D467-R469 IonicContact OD2-CZ 3.9Å; D467-R469 IonicContact OD2-NE 2.74Å; D467-R469 PolarHBondContact OD2-NE 3.33Å; D467-R469 IonicContact OD2-NH2 3Å; D467-R469 PolarHBondContact OD2-NH2 2.85Å; R469-V471 HydrophobicContact CB-CG2 4.44Å
470	V	49.8	Very low	54.6	Low	17 Å²	17	71.8 Å²	71.8	10%	0.103	38%	0.375	C	S	.	.			trans	-92.8	113.1	170.4	-165	0	0	0	0	110	Y94 I120 L468 S472 I660 L664	Y94-V470 HydrophobicContact CD2-CG1 3.56Å; Y94-V470 HydrophobicContact CE2-CG1 3.85Å; Y94-V470 HydrophobicContact CG-CG1 4.28Å; I120-V470 HydrophobicContact CD1-CG1 4.1Å; L468-V470 HydrophobicContact CD2-CG2 4.5Å; V470-S472 VanDerWaalsContact C-N 3.32Å; V470-S472 PolarHBondContact O-N 3.01Å; V470-I660 HydrophobicContact CB-CD1 3.53Å; V470-I660 HydrophobicContact CB-CG1 3.81Å; V470-I660 HydrophobicContact CG1-CD1 3.53Å; V470-I660 HydrophobicContact CG1-CG1 3.47Å; V470-I660 VanDerWaalsContact CG1-CG1 3.47Å; V470-I660 HydrophobicContact CG2-CD1 4.25Å; V470-I660 HydrophobicContact CG2-CG1 4.14Å; V470-L664 HydrophobicContact CG2-CD1 4.22Å; V470-L664 HydrophobicContact CG2-CD2 4.05Å
471	V	43.3	Very low	57.4	Low	87 Å²	87	67.6 Å²	67.6	53%	0.527	36%	0.358	S	S	.	.			trans	-99.9	41.9	-169	-161	0	0	0	0	111.6	K118 I120 R469	K118-V471 PolarHBondContact NZ-O 3.22Å; I120-V471 HydrophobicContact CD1-CB 4.31Å; I120-V471 HydrophobicContact CD1-CG2 4.29Å; I120-V471 VanDerWaalsContact CD1-N 3.32Å; R469-V471 HydrophobicContact CB-CG2 4.44Å
472	S	49	Very low	60.4	Low	23 Å²	23	65.2 Å²	65.2	16%	0.161	34%	0.343	C	S	.	.			trans	-111.8	116.3	-171.8	-60.3	0	0	0	0	109.7	Y94 V470 L474	Y94-S472 WeakPolarHBondContact CE1-OG 3.42Å; Y94-S472 WeakPolarHBondContact CE2-OG 3.22Å; Y94-S472 PolarHBondContact OH-OG 2.8Å; V470-S472 VanDerWaalsContact C-N 3.32Å; V470-S472 PolarHBondContact O-N 3.01Å; S472-L474 PolarHBondContact O-N 3.15Å
473	K	49.7	Very low	63.1	Low	222 Å²	222	64.8 Å²	64.8	97%	0.965	34%	0.339	S	S	*	.			trans	-75.7	78.3	170.9	-73.3	-171.3	174.9	-172.1	0	109.1
474	L	58.6	Low	65.7	Low	47 Å²	47	66.2 Å²	66.2	25%	0.246	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-73.9	161	167	-72.9	145.5	0	0	0	109.2	S472 I660 F663	S472-L474 PolarHBondContact O-N 3.15Å; L474-I660 HydrophobicContact CD1-CB 3.89Å; L474-I660 HydrophobicContact CD1-CD1 3.81Å; L474-I660 HydrophobicContact CD1-CG1 3.65Å; L474-F663 HydrophobicContact CD2-CE2 3.76Å
475	T	63.6	Low	68	Low	103 Å²	103	65.8 Å²	65.8	63%	0.632	36%	0.356	S	S	*	.	P	Polyproline II helix	trans	-56.7	125.2	168.7	46.5	0	0	0	0	108.6	S477	T475-S477 PolarHBondContact O-N 2.83Å
476	P	62.4	Low	70.4	Confident	113 Å²	113	63.1 Å²	63.1	73%	0.734	34%	0.341	S	S	*	.	P	Polyproline II helix	trans	-61.8	129	180	26.2	-33.6	0	0	0	109.3
477	S	81.5	Confident	72.7	Confident	12 Å²	12	66.5 Å²	66.5	8%	0.084	36%	0.357	C	S	.	.	P	Polyproline II helix	trans	-79.1	155.2	165.1	-90.8	0	0	0	0	109.7	T475 E481 R659	T475-S477 PolarHBondContact O-N 2.83Å; S477-E481 VanDerWaalsContact CB-OE2 3.31Å; S477-E481 WeakPolarHBondContact CB-OE2 3.32Å; S477-E481 PolarHBondContact OG-OE2 3.38Å; S477-R659 PolarHBondContact OG-NH2 3.28Å
478	T	90.7	Very high	75.2	Confident	60 Å²	60	66 Å²	66	37%	0.368	35%	0.354	S	S	.	.	P	Polyproline II helix	trans	-80.4	155	169.1	87.4	0	0	0	0	110.2	E480 E481 V482	T478-E480 WeakPolarHBondContact CB-OE2 3.07Å; T478-E480 PolarHBondContact O-N 2.83Å; T478-E480 PolarHBondContact OG1-N 3.16Å; T478-E480 PolarHBondContact OG1-OE2 3.3Å; T478-E481 PolarHBondContact O-N 3.49Å; T478-E481 PolarHBondContact OG1-N 3.42Å; T478-E481 VanDerWaalsContact OG1-N 3.14Å; T478-V482 PolarHBondContact O-N 3.19Å
479	P	91.8	Very high	77.4	Confident	44 Å²	44	65.8 Å²	65.8	29%	0.286	35%	0.353	S	S	.	.	H	α-helix	trans	-55.8	-32.9	172	-26.1	36.4	0	0	0	113.1	V482 D483 V650 A653	P479-V482 PolarHBondContact O-N 3.29Å; P479-D483 WeakPolarHBondContact O-CB 3.23Å; P479-D483 PolarHBondContact O-N 3.23Å; P479-V650 HydrophobicContact CB-CG2 4.13Å; P479-V650 HydrophobicContact CG-CG1 4.43Å; P479-V650 HydrophobicContact CG-CG2 4.36Å; P479-A653 HydrophobicContact CB-CB 4.42Å; P479-A653 HydrophobicContact CG-CB 4.1Å
480	E	92.6	Very high	79.7	Confident	128 Å²	128	58 Å²	58	60%	0.598	32%	0.323	S	S	*	.	H	α-helix	trans	-71	-40.2	179.4	-54.6	72.2	-156.9	0	0	112.1	T478 V482 D483 A484	T478-E480 WeakPolarHBondContact CB-OE2 3.07Å; T478-E480 PolarHBondContact O-N 2.83Å; T478-E480 PolarHBondContact OG1-N 3.16Å; T478-E480 PolarHBondContact OG1-OE2 3.3Å; E480-V482 VanDerWaalsContact C-N 3.31Å; E480-V482 PolarHBondContact O-N 3.07Å; E480-D483 PolarHBondContact O-N 3.42Å; E480-A484 VanDerWaalsContact O-CB 3.3Å; E480-A484 WeakPolarHBondContact O-CB 3.5Å; E480-A484 PolarHBondContact O-N 3.13Å
481	E	92.2	Very high	81.8	Confident	93 Å²	93	57.1 Å²	57.1	44%	0.435	32%	0.319	S	S	.	.	H	α-helix	trans	-58.6	-44.7	170.1	-75.2	-174	-179.9	0	0	111.1	S477 T478 S485 R659	S477-E481 VanDerWaalsContact CB-OE2 3.31Å; S477-E481 WeakPolarHBondContact CB-OE2 3.32Å; S477-E481 PolarHBondContact OG-OE2 3.38Å; T478-E481 PolarHBondContact O-N 3.49Å; T478-E481 PolarHBondContact OG1-N 3.42Å; T478-E481 VanDerWaalsContact OG1-N 3.14Å; E481-S485 WeakPolarHBondContact O-CB 3.49Å; E481-S485 PolarHBondContact O-N 2.96Å; E481-S485 VanDerWaalsContact O-N 3.16Å; E481-R659 IonicContact OE2-NH2 2.7Å; E481-R659 PolarHBondContact OE2-NH2 3.4Å
482	V	93.9	Very high	84.3	Confident	1 Å²	1	53.2 Å²	53.2	1%	0.006	30%	0.295	C	S	.	.	H	α-helix	trans	-66.7	-45.7	-179.3	172.8	0	0	0	0	110.7	T478 P479 E480 S485 S486 F649 I652 A653 W658	T478-V482 PolarHBondContact O-N 3.19Å; P479-V482 PolarHBondContact O-N 3.29Å; E480-V482 VanDerWaalsContact C-N 3.31Å; E480-V482 PolarHBondContact O-N 3.07Å; V482-S485 PolarHBondContact O-N 3.23Å; V482-S486 WeakPolarHBondContact O-CB 3.4Å; V482-S486 PolarHBondContact O-N 2.81Å; V482-S486 PolarHBondContact O-OG 3.45Å; V482-F649 HydrophobicContact CG1-CB 3.89Å; V482-F649 HydrophobicContact CG1-CD1 4.24Å; V482-F649 HydrophobicContact CG1-CG 4.36Å; V482-I652 HydrophobicContact CG1-CB 3.91Å; V482-I652 HydrophobicContact CG1-CG2 3.6Å; V482-I652 HydrophobicContact CG2-CG2 4.12Å; V482-A653 HydrophobicContact CB-CB 4.49Å; V482-A653 HydrophobicContact CG2-CB 3.84Å; V482-W658 PolarHBondContact O-NE1 3Å
483	D	94.4	Very high	86.4	Confident	43 Å²	43	52.2 Å²	52.2	23%	0.23	29%	0.287	C	S	.	.	H	α-helix	trans	-60.6	-51.9	179.1	-167.8	0.8	0	0	0	111.1	P479 E480 S485 S486 R644 F649	P479-D483 WeakPolarHBondContact O-CB 3.23Å; P479-D483 PolarHBondContact O-N 3.23Å; E480-D483 PolarHBondContact O-N 3.42Å; D483-S485 PolarHBondContact O-N 3.37Å; D483-S486 WeakPolarHBondContact O-CB 3.44Å; D483-S486 PolarHBondContact O-N 3Å; D483-R644 IonicContact OD1-CZ 2.81Å; D483-R644 IonicContact OD1-NE 3.91Å; D483-R644 PolarHBondContact OD1-NE 2.76Å; D483-R644 IonicContact OD1-NH2 3.89Å; D483-R644 PolarHBondContact OD1-NH2 3.39Å; D483-R644 IonicContact OD2-CZ 2.97Å; D483-R644 IonicContact OD2-NE 2.79Å; D483-R644 PolarHBondContact OD2-NE 3.33Å; D483-R644 IonicContact OD2-NH2 3.01Å; D483-F649 HydrophobicContact CB-CD2 3.84Å; D483-F649 HydrophobicContact CB-CE2 4.4Å; D483-F649 HydrophobicContact CB-CG 4.44Å; D483-F649 WeakPolarHBondContact OD1-CD2 3.44Å; D483-F649 WeakPolarHBondContact OD1-CE2 3.29Å
484	A	93.4	Very high	88.4	Confident	87 Å²	87	41.7 Å²	41.7	72%	0.719	24%	0.242	S	C	*	.	H	α-helix	trans	-59.1	-31.4	178.9	0	0	0	0	0	113.7	E480	E480-A484 VanDerWaalsContact O-CB 3.3Å; E480-A484 WeakPolarHBondContact O-CB 3.5Å; E480-A484 PolarHBondContact O-N 3.13Å
485	S	93.8	Very high	90	Very high	15 Å²	15	39.5 Å²	39.5	11%	0.105	23%	0.23	C	C	.	.	H	α-helix	trans	-85	-23.6	177.9	-177.1	0	0	0	0	112.8	E481 V482 D483 E487 L488 V489 E552	E481-S485 WeakPolarHBondContact O-CB 3.49Å; E481-S485 PolarHBondContact O-N 2.96Å; E481-S485 VanDerWaalsContact O-N 3.16Å; V482-S485 PolarHBondContact O-N 3.23Å; D483-S485 PolarHBondContact O-N 3.37Å; S485-E487 PolarHBondContact O-N 2.88Å; S485-L488 WeakPolarHBondContact O-CB 3.41Å; S485-L488 PolarHBondContact O-N 3.43Å; S485-V489 WeakPolarHBondContact O-CG2 3.07Å; S485-V489 PolarHBondContact O-N 3.05Å; S485-E552 WeakPolarHBondContact OG-CG 3.19Å; S485-E552 PolarHBondContact OG-OE1 3.38Å
486	S	94.8	Very high	91.3	Very high	0 Å²	0	36 Å²	36	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-66	-41.6	-168.4	-70.3	0	0	0	0	114.5	V482 D483 L488 V489 F490 F649 W658	V482-S486 WeakPolarHBondContact O-CB 3.4Å; V482-S486 PolarHBondContact O-N 2.81Å; V482-S486 PolarHBondContact O-OG 3.45Å; D483-S486 WeakPolarHBondContact O-CB 3.44Å; D483-S486 PolarHBondContact O-N 3Å; S486-L488 PolarHBondContact O-N 2.9Å; S486-V489 PolarHBondContact O-N 2.9Å; S486-F490 WeakPolarHBondContact O-CB 3.34Å; S486-F490 VanDerWaalsContact O-CD1 3.31Å; S486-F490 WeakPolarHBondContact O-CD1 3.42Å; S486-F490 WeakPolarHBondContact O-CG 3.42Å; S486-F490 PolarHBondContact O-N 2.84Å; S486-F649 VanDerWaalsContact CB-CE1 3.43Å; S486-F649 WeakPolarHBondContact OG-CD1 3.18Å; S486-F649 WeakPolarHBondContact OG-CE1 3.41Å; S486-W658 WeakPolarHBondContact OG-CZ2 3.48Å; S486-W658 PolarHBondContact OG-NE1 2.8Å; S486-W658 VanDerWaalsContact OG-NE1 3.1Å
487	E	94.5	Very high	92.6	Very high	77 Å²	77	30.9 Å²	30.9	36%	0.36	17%	0.174	S	C	.	.	H	α-helix	trans	-60.3	-39.9	177.3	-175.4	171.6	-165.3	0	0	111.2	S485 F490 S491 P544 V640	S485-E487 PolarHBondContact O-N 2.88Å; E487-F490 PolarHBondContact O-N 2.91Å; E487-S491 WeakPolarHBondContact O-CB 3.43Å; E487-S491 PolarHBondContact O-N 2.91Å; E487-S491 PolarHBondContact O-OG 3.17Å; E487-P544 HydrophobicContact CG-CG 4.05Å; E487-V640 HydrophobicContact CB-CG2 3.9Å; E487-V640 HydrophobicContact CG-CG2 4.19Å
488	L	94.7	Very high	93.1	Very high	44 Å²	44	31.9 Å²	31.9	23%	0.23	18%	0.176	C	C	.	.	H	α-helix	trans	-70	-39.5	178.7	-163.7	66	0	0	0	112.1	S485 S486 S491 N492 P544 A546 E552	S485-L488 WeakPolarHBondContact O-CB 3.41Å; S485-L488 PolarHBondContact O-N 3.43Å; S486-L488 PolarHBondContact O-N 2.9Å; L488-S491 PolarHBondContact O-OG 3.29Å; L488-S491 VanDerWaalsContact O-OG 3.06Å; L488-N492 WeakPolarHBondContact O-CB 3.23Å; L488-N492 PolarHBondContact O-N 3.21Å; L488-N492 PolarHBondContact O-ND2 2.97Å; L488-P544 HydrophobicContact CD1-CB 4.04Å; L488-A546 HydrophobicContact CD1-CB 4.23Å; L488-A546 HydrophobicContact CD2-CB 4.05Å; L488-A546 HydrophobicContact CG-CB 3.93Å; L488-E552 HydrophobicContact CB-CB 4.47Å; L488-E552 HydrophobicContact CB-CG 4.3Å; L488-E552 HydrophobicContact CD2-CB 4.04Å; L488-E552 HydrophobicContact CD2-CG 3.94Å; L488-E552 HydrophobicContact CG-CB 4.15Å; L488-E552 HydrophobicContact CG-CG 4.32Å
489	V	94.7	Very high	92.9	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-61.5	-45.1	172.2	173	0	0	0	0	110.7	S485 S486 F493 E552 V555 L559 W658	S485-V489 WeakPolarHBondContact O-CG2 3.07Å; S485-V489 PolarHBondContact O-N 3.05Å; S486-V489 PolarHBondContact O-N 2.9Å; V489-F493 WeakPolarHBondContact O-CB 3.46Å; V489-F493 PolarHBondContact O-N 2.94Å; V489-E552 HydrophobicContact CG2-CB 3.9Å; V489-E552 HydrophobicContact CG2-CG 3.8Å; V489-V555 HydrophobicContact CG1-CG1 3.89Å; V489-V555 HydrophobicContact CG2-CG1 4.4Å; V489-L559 HydrophobicContact CG1-CD1 3.86Å; V489-W658 HydrophobicContact CG1-CD2 4.32Å; V489-W658 HydrophobicContact CG1-CE3 4.19Å; V489-W658 HydrophobicContact CG1-CH2 4.49Å; V489-W658 HydrophobicContact CG1-CZ3 4.28Å; V489-W658 HydrophobicContact CG2-CD2 4.08Å; V489-W658 HydrophobicContact CG2-CG 4Å
490	F	94.5	Very high	92.6	Very high	1 Å²	1	35.7 Å²	35.7	0%	0.004	18%	0.182	C	C	.	.	H	α-helix	trans	-71.6	-43	-175.1	-61.9	-8.3	0	0	0	112.3	S486 E487 F493 M494 F613 L639 V640 F649 W658	S486-F490 WeakPolarHBondContact O-CB 3.34Å; S486-F490 VanDerWaalsContact O-CD1 3.31Å; S486-F490 WeakPolarHBondContact O-CD1 3.42Å; S486-F490 WeakPolarHBondContact O-CG 3.42Å; S486-F490 PolarHBondContact O-N 2.84Å; E487-F490 PolarHBondContact O-N 2.91Å; F490-F493 PolarHBondContact O-N 3.24Å; F490-M494 WeakPolarHBondContact O-CG 3.47Å; F490-M494 PolarHBondContact O-N 2.98Å; F490-F613 HydrophobicContact CD1-CD2 4.36Å; F490-F613 HydrophobicContact CD1-CE2 4.13Å; F490-F613 HydrophobicContact CD1-CZ 4.23Å; F490-F613 HydrophobicContact CE1-CD1 4.28Å; F490-F613 HydrophobicContact CE1-CD2 4.05Å; F490-F613 AromaticContact CE1-CE1 3.69Å; F490-F613 HydrophobicContact CE1-CE1 3.69Å; F490-F613 AromaticContact CE1-CE2 3.41Å; F490-F613 HydrophobicContact CE1-CE2 3.41Å; F490-F613 VanDerWaalsContact CE1-CE2 3.41Å; F490-F613 HydrophobicContact CE1-CG 4.47Å; F490-F613 AromaticContact CE1-CZ 3.22Å; F490-F613 HydrophobicContact CE1-CZ 3.22Å; F490-F613 HydrophobicContact CE2-CE1 4.29Å; F490-F613 HydrophobicContact CE2-CZ 4.5Å; F490-F613 HydrophobicContact CZ-CD1 4.36Å; F490-F613 AromaticContact CZ-CE1 3.54Å; F490-F613 HydrophobicContact CZ-CE1 3.54Å; F490-F613 HydrophobicContact CZ-CE2 4.08Å; F490-F613 AromaticContact CZ-CZ 3.39Å; F490-F613 HydrophobicContact CZ-CZ 3.39Å; F490-L639 HydrophobicContact CD2-CB 4.48Å; F490-L639 HydrophobicContact CD2-CD2 3.81Å; F490-L639 HydrophobicContact CD2-CG 3.85Å; F490-L639 HydrophobicContact CE2-CD2 4.19Å; F490-L639 HydrophobicContact CE2-CG 3.91Å; F490-L639 HydrophobicContact CG-CD2 4.13Å; F490-V640 HydrophobicContact CD2-CG2 3.6Å; F490-V640 HydrophobicContact CE2-CG2 4.04Å; F490-F649 HydrophobicContact CE2-CE1 4.08Å; F490-F649 HydrophobicContact CE2-CZ 4.26Å; F490-F649 AromaticContact CZ-CE1 3.88Å; F490-F649 HydrophobicContact CZ-CE1 3.88Å; F490-W658 AromaticContact CE1-CH2 3.55Å; F490-W658 HydrophobicContact CE1-CH2 3.55Å; F490-W658 AromaticContact CE1-CZ2 3.62Å; F490-W658 HydrophobicContact CE1-CZ2 3.62Å; F490-W658 HydrophobicContact CZ-CH2 4.13Å; F490-W658 AromaticContact CZ-CZ2 3.99Å; F490-W658 HydrophobicContact CZ-CZ2 3.99Å
491	S	94.7	Very high	92.3	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-60.9	-48.2	177.7	65.2	0	0	0	0	111.5	E487 L488 M494 I495 P544	E487-S491 WeakPolarHBondContact O-CB 3.43Å; E487-S491 PolarHBondContact O-N 2.91Å; E487-S491 PolarHBondContact O-OG 3.17Å; L488-S491 PolarHBondContact O-OG 3.29Å; L488-S491 VanDerWaalsContact O-OG 3.06Å; S491-M494 PolarHBondContact O-N 3.2Å; S491-I495 WeakPolarHBondContact O-CD1 3.37Å; S491-I495 VanDerWaalsContact O-CG1 3.23Å; S491-I495 WeakPolarHBondContact O-CG1 3.43Å; S491-I495 PolarHBondContact O-N 3.03Å; S491-P544 WeakPolarHBondContact CB-O 3.44Å; S491-P544 PolarHBondContact OG-O 2.77Å
492	N	94.9	Very high	91.9	Very high	5 Å²	5	30 Å²	30	3%	0.027	16%	0.159	C	C	.	.	H	α-helix	trans	-70.6	-34.3	-179	-70.3	-93	0	0	0	111.2	L488 I495 D496 P544 A546 A556	L488-N492 WeakPolarHBondContact O-CB 3.23Å; L488-N492 PolarHBondContact O-N 3.21Å; L488-N492 PolarHBondContact O-ND2 2.97Å; N492-I495 PolarHBondContact O-N 2.79Å; N492-D496 WeakPolarHBondContact O-CB 3.44Å; N492-D496 PolarHBondContact O-N 3.2Å; N492-P544 PolarHBondContact ND2-O 3.3Å; N492-A546 PolarHBondContact ND2-N 3.33Å; N492-A546 VanDerWaalsContact ND2-N 3.1Å; N492-A546 PolarHBondContact OD1-N 3.41Å; N492-A556 HydrophobicContact CB-CB 3.71Å
493	F	93.7	Very high	91.5	Very high	2 Å²	2	32.8 Å²	32.8	1%	0.009	18%	0.179	C	C	.	.	H	α-helix	trans	-59.6	-48.3	171.1	162.5	-102.1	0	0	0	111.4	V489 F490 I495 R497 A556 L559 A560 F613 Y614	V489-F493 WeakPolarHBondContact O-CB 3.46Å; V489-F493 PolarHBondContact O-N 2.94Å; F490-F493 PolarHBondContact O-N 3.24Å; F493-I495 PolarHBondContact O-N 3.17Å; F493-R497 WeakPolarHBondContact O-CB 3.46Å; F493-R497 PolarHBondContact O-N 3.37Å; F493-A556 HydrophobicContact CB-CB 4.26Å; F493-L559 HydrophobicContact CD2-CB 3.62Å; F493-L559 HydrophobicContact CE2-CB 4.11Å; F493-L559 HydrophobicContact CG-CB 4.46Å; F493-A560 HydrophobicContact CD2-CB 4.23Å; F493-A560 HydrophobicContact CE2-CB 4.46Å; F493-F613 HydrophobicContact CD1-CB 4.39Å; F493-F613 HydrophobicContact CE1-CB 3.91Å; F493-F613 WeakPolarHBondContact CE1-O 3.31Å; F493-F613 HydrophobicContact CZ-CB 4.36Å; F493-Y614 HydrophobicContact CZ-CD2 4.39Å
494	M	92.2	Very high	90.9	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-64.1	-39.6	178.6	-68.1	-177.3	-164.3	0	0	112.1	F490 S491 Y498 V620 F632 V635 C636 L639	F490-M494 WeakPolarHBondContact O-CG 3.47Å; F490-M494 PolarHBondContact O-N 2.98Å; S491-M494 PolarHBondContact O-N 3.2Å; M494-Y498 VanDerWaalsContact O-CB 3.3Å; M494-Y498 WeakPolarHBondContact O-CB 3.31Å; M494-Y498 PolarHBondContact O-N 3.45Å; M494-V620 HydrophobicContact SD-CG2 3.92Å; M494-F632 HydrophobicContact CB-CD1 4.02Å; M494-F632 HydrophobicContact CB-CE1 4Å; M494-V635 HydrophobicContact CE-CG1 4.37Å; M494-C636 HydrophobicContact CE-CB 4.21Å; M494-C636 HydrophobicContact SD-CB 4.21Å; M494-L639 HydrophobicContact CE-CD2 3.93Å
495	I	91.5	Very high	90.4	Very high	1 Å²	1	32.4 Å²	32.4	1%	0.005	18%	0.178	C	C	.	.	H	α-helix	trans	-64.1	-52.5	177.1	-69.3	162	0	0	0	111.2	S491 N492 F493 Y498 R499 L540 L543	S491-I495 WeakPolarHBondContact O-CD1 3.37Å; S491-I495 VanDerWaalsContact O-CG1 3.23Å; S491-I495 WeakPolarHBondContact O-CG1 3.43Å; S491-I495 PolarHBondContact O-N 3.03Å; N492-I495 PolarHBondContact O-N 2.79Å; F493-I495 PolarHBondContact O-N 3.17Å; I495-Y498 PolarHBondContact O-N 3.17Å; I495-R499 VanDerWaalsContact O-CG 3.29Å; I495-R499 WeakPolarHBondContact O-CG 3.5Å; I495-R499 PolarHBondContact O-N 2.77Å; I495-L540 HydrophobicContact CG1-CD2 4.08Å; I495-L543 HydrophobicContact CD1-CB 3.99Å; I495-L543 HydrophobicContact CD1-CD1 4.05Å; I495-L543 HydrophobicContact CG1-CD1 3.88Å
496	D	91.1	Very high	89.8	Confident	29 Å²	29	34.6 Å²	34.6	16%	0.155	20%	0.197	C	C	.	.	H	α-helix	trans	-67.9	-38.1	-177.2	-78.9	-1.9	0	0	0	110.8	N492 R499 L500 A560	N492-D496 WeakPolarHBondContact O-CB 3.44Å; N492-D496 PolarHBondContact O-N 3.2Å; D496-R499 PolarHBondContact O-N 2.65Å; D496-L500 WeakPolarHBondContact O-CG 3.48Å; D496-L500 PolarHBondContact O-N 2.93Å; D496-A560 HydrophobicContact CB-CB 4.46Å
497	R	89.9	Confident	89.1	Confident	7 Å²	7	40.7 Å²	40.7	3%	0.026	23%	0.226	C	C	.	.	H	α-helix	trans	-64.2	-42.5	174.6	-179.1	63.4	-160.4	134.6	-16.1	112.6	F493 L500 E501 A560 D564 Y614 Y617	F493-R497 WeakPolarHBondContact O-CB 3.46Å; F493-R497 PolarHBondContact O-N 3.37Å; R497-L500 PolarHBondContact O-N 3.46Å; R497-E501 PolarHBondContact O-N 3.24Å; R497-A560 HydrophobicContact CB-CB 4.23Å; R497-D564 IonicContact CZ-OD1 2.78Å; R497-D564 IonicContact NH1-OD1 3.32Å; R497-D564 PolarHBondContact NH1-OD1 3.39Å; R497-D564 IonicContact NH1-OD2 3.79Å; R497-D564 IonicContact NH2-OD1 3.98Å; R497-D564 PolarHBondContact NH2-OD1 2.9Å; R497-D564 VanDerWaalsContact NH2-OD1 3.07Å; R497-Y614 PolarHBondContact NE-OH 3.49Å; R497-Y614 PolarHBondContact NH2-OH 2.93Å; R497-Y617 HydrophobicContact CB-CD2 3.97Å; R497-Y617 HydrophobicContact CB-CE2 3.97Å; R497-Y617 HydrophobicContact CB-CG 4.31Å; R497-Y617 HydrophobicContact CG-CD1 3.5Å; R497-Y617 VanDerWaalsContact CG-CD1 3.5Å; R497-Y617 HydrophobicContact CG-CD2 3.67Å; R497-Y617 HydrophobicContact CG-CE1 3.44Å; R497-Y617 VanDerWaalsContact CG-CE1 3.44Å; R497-Y617 HydrophobicContact CG-CE2 3.61Å; R497-Y617 HydrophobicContact CG-CG 3.62Å
498	Y	90.3	Very high	88.2	Confident	32 Å²	32	40 Å²	40	13%	0.125	23%	0.232	C	C	.	.	H	α-helix	trans	-60.9	-46	174.2	-179.5	-102.4	0	0	0	111.5	M494 I495 L500 E501 V502 D534 V536 L540 F632	M494-Y498 VanDerWaalsContact O-CB 3.3Å; M494-Y498 WeakPolarHBondContact O-CB 3.31Å; M494-Y498 PolarHBondContact O-N 3.45Å; I495-Y498 PolarHBondContact O-N 3.17Å; Y498-L500 VanDerWaalsContact C-N 3.31Å; Y498-L500 PolarHBondContact O-N 3.28Å; Y498-E501 PolarHBondContact O-N 2.86Å; Y498-V502 HydrophobicContact CD1-CG2 4.1Å; Y498-V502 HydrophobicContact CD2-CG2 4.35Å; Y498-V502 HydrophobicContact CE1-CG2 3.63Å; Y498-V502 HydrophobicContact CE2-CG2 3.9Å; Y498-V502 HydrophobicContact CG-CG2 4.44Å; Y498-V502 WeakPolarHBondContact O-CG2 3.18Å; Y498-V502 PolarHBondContact O-N 2.91Å; Y498-D534 PolarHBondContact OH-OD2 3.44Å; Y498-V536 HydrophobicContact CE1-CB 4.15Å; Y498-V536 HydrophobicContact CE1-CG1 3.86Å; Y498-V536 HydrophobicContact CE2-CG1 4.07Å; Y498-V536 WeakPolarHBondContact OH-CB 3.35Å; Y498-V536 VanDerWaalsContact OH-CG2 3.27Å; Y498-V536 WeakPolarHBondContact OH-CG2 3.48Å; Y498-L540 HydrophobicContact CD1-CD1 3.72Å; Y498-L540 HydrophobicContact CD1-CD2 4.12Å; Y498-L540 HydrophobicContact CD1-CG 4.45Å; Y498-L540 HydrophobicContact CE1-CD1 3.9Å; Y498-L540 HydrophobicContact CG-CD2 4.47Å; Y498-F632 HydrophobicContact CD1-CZ 4.5Å; Y498-F632 AromaticContact CD2-CZ 3.89Å; Y498-F632 HydrophobicContact CD2-CZ 3.89Å; Y498-F632 AromaticContact CG-CZ 3.84Å; Y498-F632 HydrophobicContact CG-CZ 3.84Å
499	R	88.5	Confident	87.4	Confident	117 Å²	117	41.7 Å²	41.7	44%	0.442	25%	0.248	S	C	.	.	H	α-helix	trans	-60.4	-38.6	177.7	-73.7	168.6	170.3	-167.2	-7.1	112.6	I495 D496 S503	I495-R499 VanDerWaalsContact O-CG 3.29Å; I495-R499 WeakPolarHBondContact O-CG 3.5Å; I495-R499 PolarHBondContact O-N 2.77Å; D496-R499 PolarHBondContact O-N 2.65Å; R499-S503 WeakPolarHBondContact O-CB 3.35Å; R499-S503 PolarHBondContact O-N 3.46Å; R499-S503 PolarHBondContact O-OG 3.18Å
500	L	85.5	Confident	86.4	Confident	68 Å²	68	44.7 Å²	44.7	36%	0.356	27%	0.269	S	S	.	.	H	α-helix	trans	-64.6	-46.5	173.3	-73.2	169.6	0	0	0	111.9	D496 R497 Y498 S503 A504 A560	D496-L500 WeakPolarHBondContact O-CG 3.48Å; D496-L500 PolarHBondContact O-N 2.93Å; R497-L500 PolarHBondContact O-N 3.46Å; Y498-L500 VanDerWaalsContact C-N 3.31Å; Y498-L500 PolarHBondContact O-N 3.28Å; L500-S503 PolarHBondContact O-N 3.22Å; L500-A504 WeakPolarHBondContact O-CB 3.07Å; L500-A504 PolarHBondContact O-N 3.28Å; L500-A560 HydrophobicContact CD1-CB 3.98Å
501	E	84.6	Confident	84.8	Confident	42 Å²	42	48.1 Å²	48.1	20%	0.196	29%	0.293	C	S	.	.	H	α-helix	trans	-65	-40	179.4	-169.9	166.7	167.9	0	0	112.1	R497 Y498 S505 Y617 R618	R497-E501 PolarHBondContact O-N 3.24Å; Y498-E501 PolarHBondContact O-N 2.86Å; E501-S505 WeakPolarHBondContact O-CB 3.15Å; E501-S505 PolarHBondContact O-N 3.27Å; E501-S505 PolarHBondContact O-OG 3.32Å; E501-Y617 WeakPolarHBondContact CB-OH 3.46Å; E501-Y617 WeakPolarHBondContact OE2-CE1 3.32Å; E501-Y617 VanDerWaalsContact OE2-CZ 3.31Å; E501-Y617 PolarHBondContact OE2-OH 2.92Å; E501-R618 VanDerWaalsContact CD-NH1 3.28Å; E501-R618 IonicContact OE1-CZ 2.83Å; E501-R618 IonicContact OE1-NH1 3.37Å; E501-R618 PolarHBondContact OE1-NH1 3.36Å; E501-R618 IonicContact OE2-NH1 3.46Å; E501-R618 PolarHBondContact OE2-NH1 3.46Å
502	V	85	Confident	83	Confident	58 Å²	58	55.7 Å²	55.7	35%	0.352	33%	0.329	S	S	.	.	H	α-helix	trans	-66	-44.7	174.1	172.9	0	0	0	0	111.5	Y498 A504 S505 A506	Y498-V502 HydrophobicContact CD1-CG2 4.1Å; Y498-V502 HydrophobicContact CD2-CG2 4.35Å; Y498-V502 HydrophobicContact CE1-CG2 3.63Å; Y498-V502 HydrophobicContact CE2-CG2 3.9Å; Y498-V502 HydrophobicContact CG-CG2 4.44Å; Y498-V502 WeakPolarHBondContact O-CG2 3.18Å; Y498-V502 PolarHBondContact O-N 2.91Å; V502-A504 PolarHBondContact O-N 3.36Å; V502-S505 PolarHBondContact O-N 2.71Å; V502-A506 PolarHBondContact O-N 3.08Å
503	S	85.1	Confident	81.2	Confident	61 Å²	61	58.7 Å²	58.7	43%	0.427	35%	0.35	S	S	.	.	H	α-helix	trans	-64.5	-41.5	180	-65.3	0	0	0	0	112.2	R499 L500 A506 Q507	R499-S503 WeakPolarHBondContact O-CB 3.35Å; R499-S503 PolarHBondContact O-N 3.46Å; R499-S503 PolarHBondContact O-OG 3.18Å; L500-S503 PolarHBondContact O-N 3.22Å; S503-A506 PolarHBondContact O-N 3.18Å; S503-Q507 WeakPolarHBondContact O-CG 3.14Å; S503-Q507 PolarHBondContact O-N 3.07Å; S503-Q507 VanDerWaalsContact O-N 3.09Å
504	A	82.6	Confident	79.3	Confident	56 Å²	56	63.5 Å²	63.5	46%	0.463	38%	0.38	S	S	.	.	H	α-helix	trans	-63.4	-40.4	173.8	0	0	0	0	0	112.1	L500 V502 Q507 A508	L500-A504 WeakPolarHBondContact O-CB 3.07Å; L500-A504 PolarHBondContact O-N 3.28Å; V502-A504 PolarHBondContact O-N 3.36Å; A504-Q507 PolarHBondContact O-N 3.07Å; A504-A508 PolarHBondContact O-N 2.86Å
505	S	81.5	Confident	77.4	Confident	66 Å²	66	67.5 Å²	67.5	46%	0.462	41%	0.413	S	S	.	.	H	α-helix	trans	-64.6	-39.4	177.6	-58	0	0	0	0	112.4	E501 V502 S509	E501-S505 WeakPolarHBondContact O-CB 3.15Å; E501-S505 PolarHBondContact O-N 3.27Å; E501-S505 PolarHBondContact O-OG 3.32Å; V502-S505 PolarHBondContact O-N 2.71Å; S505-S509 PolarHBondContact O-N 3.33Å; S505-S509 PolarHBondContact O-OG 3.14Å
506	A	82.3	Confident	75.4	Confident	60 Å²	60	72.7 Å²	72.7	50%	0.496	45%	0.449	S	S	.	.	H	α-helix	trans	-65.1	-43.6	174.6	0	0	0	0	0	112.1	V502 S503 S509 S510	V502-A506 PolarHBondContact O-N 3.08Å; S503-A506 PolarHBondContact O-N 3.18Å; A506-S509 WeakPolarHBondContact O-CB 3.29Å; A506-S509 PolarHBondContact O-N 3.03Å; A506-S510 PolarHBondContact O-N 3.35Å; A506-S510 PolarHBondContact O-OG 3.12Å
507	Q	79.9	Confident	73.1	Confident	129 Å²	129	75 Å²	75	60%	0.603	47%	0.468	S	S	*	.	H	α-helix	trans	-65.6	-37	177.9	-71.9	175.4	6.1	0	0	113.1	S503 A504 S509 S510 S511	S503-Q507 WeakPolarHBondContact O-CG 3.14Å; S503-Q507 PolarHBondContact O-N 3.07Å; S503-Q507 VanDerWaalsContact O-N 3.09Å; A504-Q507 PolarHBondContact O-N 3.07Å; Q507-S509 VanDerWaalsContact C-N 3.34Å; Q507-S510 WeakPolarHBondContact CA-OG 3.46Å; Q507-S510 PolarHBondContact O-OG 3.29Å; Q507-S511 WeakPolarHBondContact O-CB 3.3Å; Q507-S511 PolarHBondContact O-N 2.84Å; Q507-S511 PolarHBondContact O-OG 3.1Å
508	A	75.9	Confident	70.7	Confident	61 Å²	61	80.8 Å²	80.8	50%	0.504	51%	0.509	S	S	.	.	H	α-helix	trans	-61.4	-44.9	173.1	0	0	0	0	0	111.1	A504 S510 S511 Q512	A504-A508 PolarHBondContact O-N 2.86Å; A508-S510 PolarHBondContact O-N 2.78Å; A508-S511 PolarHBondContact O-N 3.45Å; A508-Q512 PolarHBondContact O-N 3.37Å
509	S	77.3	Confident	68.6	Low	80 Å²	80	82.9 Å²	82.9	56%	0.559	53%	0.533	S	S	*	.	H	α-helix	trans	-64	-39.3	179.9	-54.1	0	0	0	0	112.9	S505 A506 Q507 S513	S505-S509 PolarHBondContact O-N 3.33Å; S505-S509 PolarHBondContact O-OG 3.14Å; A506-S509 WeakPolarHBondContact O-CB 3.29Å; A506-S509 PolarHBondContact O-N 3.03Å; Q507-S509 VanDerWaalsContact C-N 3.34Å; S509-S513 PolarHBondContact O-OG 3.35Å; S509-S513 VanDerWaalsContact O-OG 3.05Å
510	S	72.7	Confident	66.2	Low	63 Å²	63	83.4 Å²	83.4	44%	0.441	56%	0.555	S	S	.	*	H	α-helix	trans	-73.3	-32.2	176	59.2	0	0	0	0	113.5	A506 Q507 A508 Q512 S513 T514	A506-S510 PolarHBondContact O-N 3.35Å; A506-S510 PolarHBondContact O-OG 3.12Å; Q507-S510 WeakPolarHBondContact CA-OG 3.46Å; Q507-S510 PolarHBondContact O-OG 3.29Å; A508-S510 PolarHBondContact O-N 2.78Å; S510-Q512 VanDerWaalsContact C-N 3.34Å; S510-S513 WeakPolarHBondContact CA-OG 3.09Å; S510-S513 PolarHBondContact O-N 3.19Å; S510-S513 PolarHBondContact O-OG 2.93Å; S510-T514 PolarHBondContact O-N 2.87Å
511	S	62.4	Low	64.2	Low	73 Å²	73	86.9 Å²	86.9	51%	0.51	57%	0.572	S	S	.	*	H	α-helix	trans	-71.4	-31	-179.7	-57.1	0	0	0	0	112.2	Q507 A508 S513 T514	Q507-S511 WeakPolarHBondContact O-CB 3.3Å; Q507-S511 PolarHBondContact O-N 2.84Å; Q507-S511 PolarHBondContact O-OG 3.1Å; A508-S511 PolarHBondContact O-N 3.45Å; S511-S513 VanDerWaalsContact C-N 3.31Å; S511-S513 PolarHBondContact O-N 2.92Å; S511-T514 PolarHBondContact O-OG1 3.47Å; S511-T514 VanDerWaalsContact O-OG1 3.13Å
512	Q	56.3	Low	62	Low	159 Å²	159	92.5 Å²	92.5	74%	0.743	60%	0.598	S	S	*	*	H	α-helix	trans	-72.8	-24	176.8	-156.6	169	17.8	0	0	112.8	A508 S510	A508-Q512 PolarHBondContact O-N 3.37Å; S510-Q512 VanDerWaalsContact C-N 3.34Å
513	S	56.9	Low	60.1	Low	69 Å²	69	96 Å²	96	48%	0.483	62%	0.619	S	S	.	*	H	α-helix	trans	-86.7	-23	178.7	31.1	0	0	0	0	113.8	S509 S510 S511 S517	S509-S513 PolarHBondContact O-OG 3.35Å; S509-S513 VanDerWaalsContact O-OG 3.05Å; S510-S513 WeakPolarHBondContact CA-OG 3.09Å; S510-S513 PolarHBondContact O-N 3.19Å; S510-S513 PolarHBondContact O-OG 2.93Å; S511-S513 VanDerWaalsContact C-N 3.31Å; S511-S513 PolarHBondContact O-N 2.92Å; S513-S517 WeakPolarHBondContact O-CB 3.31Å; S513-S517 PolarHBondContact O-OG 3.46Å
514	T	53.4	Low	57.9	Low	103 Å²	103	97.8 Å²	97.8	63%	0.632	63%	0.628	S	S	*	*	H	α-helix	trans	-80	-32.4	174	54.6	0	0	0	0	113.2	S510 S511 S516 S517	S510-T514 PolarHBondContact O-N 2.87Å; S511-T514 PolarHBondContact O-OG1 3.47Å; S511-T514 VanDerWaalsContact O-OG1 3.13Å; T514-S516 VanDerWaalsContact C-N 3.28Å; T514-S516 PolarHBondContact O-N 3.1Å; T514-S517 PolarHBondContact O-N 3.34Å
515	A	52.1	Low	55.7	Low	83 Å²	83	99.8 Å²	99.8	69%	0.686	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.2	-28.9	179.3	0	0	0	0	0	114.2
516	S	49.3	Very low	53.6	Low	110 Å²	110	104.9 Å²	104.9	77%	0.769	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.9	2	179.7	-62	0	0	0	0	114.4	T514	T514-S516 VanDerWaalsContact C-N 3.28Å; T514-S516 PolarHBondContact O-N 3.1Å
517	S	42.9	Very low	51.3	Low	78 Å²	78	105.5 Å²	105.5	55%	0.545	68%	0.677	S	S	.	*			trans	-117.6	49.9	-166.9	-59.2	0	0	0	0	113.7	S513 T514 A519	S513-S517 WeakPolarHBondContact O-CB 3.31Å; S513-S517 PolarHBondContact O-OG 3.46Å; T514-S517 PolarHBondContact O-N 3.34Å; S517-A519 PolarHBondContact O-N 2.79Å
518	S	41.4	Very low	49	Very low	129 Å²	129	108.6 Å²	108.6	90%	0.902	69%	0.691	S	S	*	*			trans	-76.7	42.2	167	-68.6	0	0	0	0	112.8
519	A	44.9	Very low	46.8	Very low	75 Å²	75	115.1 Å²	115.1	62%	0.62	71%	0.711	S	S	*	*	S	Bend	trans	-133.3	107	176.9	0	0	0	0	0	109.3	S517 I521	S517-A519 PolarHBondContact O-N 2.79Å; A519-I521 PolarHBondContact O-N 3.03Å; A519-I521 VanDerWaalsContact O-N 3.12Å
520	S	37.8	Very low	44.6	Very low	129 Å²	129	115.8 Å²	115.8	90%	0.902	72%	0.722	S	S	*	*			trans	-63.2	109.4	178.1	179.2	0	0	0	0	111.1
521	I	44.9	Very low	42.7	Very low	141 Å²	141	121.8 Å²	121.8	72%	0.723	74%	0.743	S	S	*	*			trans	-131.3	114.5	162.1	-59.3	-175.7	0	0	0	109.1	A519 V523	A519-I521 PolarHBondContact O-N 3.03Å; A519-I521 VanDerWaalsContact O-N 3.12Å; I521-V523 HydrophobicContact CG2-CG2 4.23Å; I521-V523 PolarHBondContact O-N 3.25Å
522	H	37.8	Very low	41.5	Very low	160 Å²	160	123.6 Å²	123.6	74%	0.741	76%	0.756	S	S	*	*			trans	-69.1	109.9	174.7	169.5	-76	0	0	0	110.6	T524	H522-T524 PolarHBondContact CE1-OG1 3.38Å
523	V	44.5	Very low	41.1	Very low	131 Å²	131	122 Å²	122	79%	0.794	75%	0.748	S	S	*	*			trans	-115.9	107.7	170.9	-177.5	0	0	0	0	109.8	I521	I521-V523 HydrophobicContact CG2-CG2 4.23Å; I521-V523 PolarHBondContact O-N 3.25Å
524	T	39.5	Very low	41.4	Very low	99 Å²	99	121.4 Å²	121.4	61%	0.607	74%	0.74	S	S	*	*			trans	-67.7	146.2	174.7	-49.8	0	0	0	0	111.1	H522 I526	H522-T524 PolarHBondContact CE1-OG1 3.38Å; T524-I526 PolarHBondContact O-N 3.04Å
525	A	35.2	Very low	42	Very low	97 Å²	97	121.5 Å²	121.5	80%	0.802	74%	0.742	S	S	*	*			trans	-59.6	120	-179.6	0	0	0	0	0	113.9
526	I	37.4	Very low	43.4	Very low	173 Å²	173	117.9 Å²	117.9	89%	0.887	71%	0.711	S	S	*	*			trans	-143.7	118.6	157.5	-57.3	-179.2	0	0	0	106	T524	T524-I526 PolarHBondContact O-N 3.04Å
527	G	34.9	Very low	44.8	Very low	74 Å²	74	114.6 Å²	114.6	76%	0.763	69%	0.688	S	S	*	*			trans	172.8	27.9	-174.2	0	0	0	0	0	118.2	Q529	G527-Q529 PolarHBondContact O-N 3.23Å
528	Q	32.6	Very low	46.7	Very low	194 Å²	194	117 Å²	117	91%	0.907	69%	0.691	S	S	*	*			trans	-76.5	96.9	162	-76.3	172.1	-50.1	0	0	108.7
529	Q	29.7	Very low	48.8	Very low	197 Å²	197	111.9 Å²	111.9	92%	0.921	65%	0.652	S	S	*	*			trans	168.1	107.6	151.1	-98.6	170.8	-50.9	0	0	111.3	G527	G527-Q529 PolarHBondContact O-N 3.23Å
530	A	31	Very low	50.8	Low	95 Å²	95	109.4 Å²	109.4	79%	0.785	63%	0.629	S	S	*	*			trans	153.2	88.2	146.3	0	0	0	0	0	109.8	S532	A530-S532 VanDerWaalsContact C-N 3.31Å; A530-S532 PolarHBondContact O-N 2.95Å
531	E	31.2	Very low	52.9	Low	188 Å²	188	107.9 Å²	107.9	88%	0.879	62%	0.618	S	S	*	*			trans	-69.7	93.8	160.3	-74.6	171.6	136.9	0	0	107.9	E533	E531-E533 VanDerWaalsContact C-N 3.34Å; E531-E533 PolarHBondContact O-N 2.75Å; E531-E533 VanDerWaalsContact O-N 3.13Å
532	S	38.6	Very low	54.7	Low	111 Å²	111	103.7 Å²	103.7	78%	0.776	60%	0.601	S	S	*	*			trans	-75.2	92.5	163.4	58.8	0	0	0	0	108	A530 D534	A530-S532 VanDerWaalsContact C-N 3.31Å; A530-S532 PolarHBondContact O-N 2.95Å; S532-D534 PolarHBondContact O-N 3.12Å
533	E	46.9	Very low	57.2	Low	127 Å²	127	96.6 Å²	96.6	59%	0.593	57%	0.569	S	S	*	*			trans	-47.3	111.7	170.5	-73.9	-74.8	179.3	0	0	109.9	E531	E531-E533 VanDerWaalsContact C-N 3.34Å; E531-E533 PolarHBondContact O-N 2.75Å; E531-E533 VanDerWaalsContact O-N 3.13Å
534	D	62.8	Low	59.4	Low	56 Å²	56	92.7 Å²	92.7	30%	0.299	55%	0.546	S	S	.	.			trans	-60.1	123.4	175	171	-3.6	0	0	0	107.9	Y498 S532 V536 S537	Y498-D534 PolarHBondContact OH-OD2 3.44Å; S532-D534 PolarHBondContact O-N 3.12Å; D534-V536 PolarHBondContact O-N 3.29Å; D534-V536 WeakPolarHBondContact OD1-CB 3.45Å; D534-V536 WeakPolarHBondContact OD1-CG2 3.22Å; D534-V536 PolarHBondContact OD1-N 3.27Å; D534-S537 WeakPolarHBondContact O-CB 3.25Å; D534-S537 PolarHBondContact O-N 3.44Å
535	P	67.5	Low	61.9	Low	105 Å²	105	94.4 Å²	94.4	68%	0.682	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-13	-178.5	24.3	-35.8	0	0	0	114
536	V	81	Confident	64.6	Low	7 Å²	7	90 Å²	90	4%	0.042	51%	0.506	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.4	-21.2	177.7	-166.8	0	0	0	0	112.8	Y498 D534 H538 Q539 L540 V624 F632	Y498-V536 HydrophobicContact CE1-CB 4.15Å; Y498-V536 HydrophobicContact CE1-CG1 3.86Å; Y498-V536 HydrophobicContact CE2-CG1 4.07Å; Y498-V536 WeakPolarHBondContact OH-CB 3.35Å; Y498-V536 VanDerWaalsContact OH-CG2 3.27Å; Y498-V536 WeakPolarHBondContact OH-CG2 3.48Å; D534-V536 PolarHBondContact O-N 3.29Å; D534-V536 WeakPolarHBondContact OD1-CB 3.45Å; D534-V536 WeakPolarHBondContact OD1-CG2 3.22Å; D534-V536 PolarHBondContact OD1-N 3.27Å; V536-H538 VanDerWaalsContact C-N 3.34Å; V536-H538 PolarHBondContact O-N 2.85Å; V536-Q539 WeakPolarHBondContact O-CA 3.29Å; V536-Q539 WeakPolarHBondContact O-CB 3.46Å; V536-Q539 PolarHBondContact O-N 3.48Å; V536-L540 HydrophobicContact CG1-CD1 4.47Å; V536-L540 HydrophobicContact CG1-CG 4.17Å; V536-L540 WeakPolarHBondContact O-CG 3.16Å; V536-L540 PolarHBondContact O-N 3.47Å; V536-V624 HydrophobicContact CG1-CG1 4.43Å; V536-V624 HydrophobicContact CG2-CG1 3.47Å; V536-V624 VanDerWaalsContact CG2-CG1 3.47Å; V536-F632 HydrophobicContact CG1-CD2 4.18Å; V536-F632 HydrophobicContact CG1-CE2 3.45Å; V536-F632 VanDerWaalsContact CG1-CE2 3.45Å; V536-F632 HydrophobicContact CG1-CZ 4.24Å
537	S	79.3	Confident	67.2	Low	41 Å²	41	88.7 Å²	88.7	29%	0.287	50%	0.496	S	S	.	.	H	α-helix	trans	-56.4	-42	-178.6	-73.7	0	0	0	0	113.7	D534 Q539 L540 S541	D534-S537 WeakPolarHBondContact O-CB 3.25Å; D534-S537 PolarHBondContact O-N 3.44Å; S537-Q539 VanDerWaalsContact C-N 3.32Å; S537-Q539 PolarHBondContact O-N 3.26Å; S537-L540 PolarHBondContact O-N 3.04Å; S537-S541 WeakPolarHBondContact O-CB 3.37Å; S537-S541 PolarHBondContact O-N 2.89Å; S537-S541 PolarHBondContact O-OG 3.35Å
538	H	81.9	Confident	69.5	Low	128 Å²	128	89.5 Å²	89.5	59%	0.593	49%	0.487	S	S	*	.	H	α-helix	trans	-64	-36.1	174.5	-63.8	-66.3	0	0	0	112.3	V536 S541 S542	V536-H538 VanDerWaalsContact C-N 3.34Å; V536-H538 PolarHBondContact O-N 2.85Å; H538-S541 PolarHBondContact O-N 3.42Å; H538-S542 PolarHBondContact O-N 2.94Å
539	Q	85.2	Confident	72	Confident	21 Å²	21	88.2 Å²	88.2	10%	0.098	48%	0.481	C	S	.	.	H	α-helix	trans	-70.9	-41	177.9	-54.8	-164.3	40.7	0	0	111.7	V536 S537 S541 S542 V628 N630 F632	V536-Q539 WeakPolarHBondContact O-CA 3.29Å; V536-Q539 WeakPolarHBondContact O-CB 3.46Å; V536-Q539 PolarHBondContact O-N 3.48Å; S537-Q539 VanDerWaalsContact C-N 3.32Å; S537-Q539 PolarHBondContact O-N 3.26Å; Q539-S541 PolarHBondContact O-N 3.1Å; Q539-S542 PolarHBondContact O-N 2.87Å; Q539-S542 PolarHBondContact O-OG 3.45Å; Q539-V628 PolarHBondContact NE2-O 2.85Å; Q539-N630 VanDerWaalsContact OE1-N 3.16Å; Q539-F632 HydrophobicContact CB-CD2 4.06Å
540	L	86.5	Confident	74.9	Confident	23 Å²	23	80 Å²	80	12%	0.12	45%	0.445	C	S	.	.	H	α-helix	trans	-62.7	-33.4	174.3	-62.7	172.1	0	0	0	112.1	I495 Y498 V536 S537 S542 L543 F632	I495-L540 HydrophobicContact CG1-CD2 4.08Å; Y498-L540 HydrophobicContact CD1-CD1 3.72Å; Y498-L540 HydrophobicContact CD1-CD2 4.12Å; Y498-L540 HydrophobicContact CD1-CG 4.45Å; Y498-L540 HydrophobicContact CE1-CD1 3.9Å; Y498-L540 HydrophobicContact CG-CD2 4.47Å; V536-L540 HydrophobicContact CG1-CD1 4.47Å; V536-L540 HydrophobicContact CG1-CG 4.17Å; V536-L540 WeakPolarHBondContact O-CG 3.16Å; V536-L540 PolarHBondContact O-N 3.47Å; S537-L540 PolarHBondContact O-N 3.04Å; L540-S542 VanDerWaalsContact C-N 3.27Å; L540-S542 PolarHBondContact O-N 3.31Å; L540-L543 PolarHBondContact O-N 3.07Å; L540-F632 HydrophobicContact CD2-CD1 3.89Å; L540-F632 HydrophobicContact CD2-CD2 4.21Å; L540-F632 HydrophobicContact CD2-CE1 3.49Å; L540-F632 VanDerWaalsContact CD2-CE1 3.49Å; L540-F632 HydrophobicContact CD2-CE2 3.85Å; L540-F632 HydrophobicContact CD2-CG 4.23Å; L540-F632 HydrophobicContact CD2-CZ 3.48Å; L540-F632 VanDerWaalsContact CD2-CZ 3.48Å
541	S	82.9	Confident	77.7	Confident	98 Å²	98	77.4 Å²	77.4	69%	0.685	42%	0.419	S	S	*	.	H	α-helix	trans	-73	-16.8	178.7	-57.2	0	0	0	0	113.6	S537 H538 Q539 L543	S537-S541 WeakPolarHBondContact O-CB 3.37Å; S537-S541 PolarHBondContact O-N 2.89Å; S537-S541 PolarHBondContact O-OG 3.35Å; H538-S541 PolarHBondContact O-N 3.42Å; Q539-S541 PolarHBondContact O-N 3.1Å; S541-L543 VanDerWaalsContact C-N 3.31Å
542	S	83.2	Confident	80.7	Confident	52 Å²	52	70.4 Å²	70.4	36%	0.364	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-10.3	176.2	74.4	0	0	0	0	114.2	H538 Q539 L540	H538-S542 PolarHBondContact O-N 2.94Å; Q539-S542 PolarHBondContact O-N 2.87Å; Q539-S542 PolarHBondContact O-OG 3.45Å; L540-S542 VanDerWaalsContact C-N 3.27Å; L540-S542 PolarHBondContact O-N 3.31Å
543	L	88.9	Confident	83.2	Confident	12 Å²	12	65.6 Å²	65.6	6%	0.063	35%	0.354	C	S	.	.	S	Bend	trans	-91.4	145.6	-177.3	-81.5	-179.8	0	0	0	112.1	I495 L540 S541 R545 F632 C636	I495-L543 HydrophobicContact CD1-CB 3.99Å; I495-L543 HydrophobicContact CD1-CD1 4.05Å; I495-L543 HydrophobicContact CG1-CD1 3.88Å; L540-L543 PolarHBondContact O-N 3.07Å; S541-L543 VanDerWaalsContact C-N 3.31Å; L543-R545 PolarHBondContact O-N 2.66Å; L543-F632 HydrophobicContact CD1-CB 3.81Å; L543-F632 HydrophobicContact CD1-CD1 3.77Å; L543-F632 HydrophobicContact CD1-CG 4.18Å; L543-F632 HydrophobicContact CG-CB 4.14Å; L543-C636 HydrophobicContact CD2-CB 3.9Å
544	P	91.9	Very high	85.3	Confident	49 Å²	49	62.6 Å²	62.6	32%	0.318	34%	0.341	S	S	.	.			trans	-65	133.5	174.9	26.3	-32.1	0	0	0	110.7	E487 L488 S491 N492	E487-P544 HydrophobicContact CG-CG 4.05Å; L488-P544 HydrophobicContact CD1-CB 4.04Å; S491-P544 WeakPolarHBondContact CB-O 3.44Å; S491-P544 PolarHBondContact OG-O 2.77Å; N492-P544 PolarHBondContact ND2-O 3.3Å
545	R	92.4	Very high	86.6	Confident	134 Å²	134	59.9 Å²	59.9	51%	0.506	33%	0.327	S	S	.	.			trans	-106.8	134.5	-176	-167.3	174.2	-164	79.2	26.4	111.2	L543	L543-R545 PolarHBondContact O-N 2.66Å
546	A	91.9	Very high	87.8	Confident	6 Å²	6	54.9 Å²	54.9	5%	0.05	29%	0.294	C	S	.	.	P	Polyproline II helix	trans	-77.8	148.5	175.3	0	0	0	0	0	110.8	L488 N492 E552 A553	L488-A546 HydrophobicContact CD1-CB 4.23Å; L488-A546 HydrophobicContact CD2-CB 4.05Å; L488-A546 HydrophobicContact CG-CB 3.93Å; N492-A546 PolarHBondContact ND2-N 3.33Å; N492-A546 VanDerWaalsContact ND2-N 3.1Å; N492-A546 PolarHBondContact OD1-N 3.41Å; A546-E552 HydrophobicContact CB-CB 4.25Å; A546-A553 HydrophobicContact CB-CB 3.87Å
547	E	91.9	Very high	88.2	Confident	145 Å²	145	60.7 Å²	60.7	68%	0.678	32%	0.315	S	S	*	.	P	Polyproline II helix	trans	-61.3	137.1	169.5	-75.3	-57.4	142.9	0	0	110.2	H549 S550 A553	E547-H549 PolarHBondContact O-N 3.03Å; E547-S550 WeakPolarHBondContact O-CB 3.4Å; E547-S550 PolarHBondContact O-N 3.5Å; E547-A553 WeakPolarHBondContact O-CB 3.24Å
548	P	81.8	Confident	88.6	Confident	90 Å²	90	59.5 Å²	59.5	58%	0.584	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.3	130.1	170.9	-23.1	33.9	0	0	0	109.8	S550	P548-S550 VanDerWaalsContact C-N 3.35Å
549	H	84.9	Confident	88.9	Confident	167 Å²	167	53.5 Å²	53.5	77%	0.773	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.1	7.2	-175.2	-39.2	-77.7	0	0	0	116.6	E547	E547-H549 PolarHBondContact O-N 3.03Å
550	S	91.9	Very high	89	Confident	25 Å²	25	52.5 Å²	52.5	18%	0.175	27%	0.274	C	S	.	.			trans	-65.1	159.3	164.6	102.9	0	0	0	0	111.2	E547 P548 E552 A553 I554	E547-S550 WeakPolarHBondContact O-CB 3.4Å; E547-S550 PolarHBondContact O-N 3.5Å; P548-S550 VanDerWaalsContact C-N 3.35Å; S550-E552 WeakPolarHBondContact CB-OE2 3.42Å; S550-E552 PolarHBondContact O-N 3.15Å; S550-E552 PolarHBondContact OG-N 2.95Å; S550-E552 VanDerWaalsContact OG-N 3.17Å; S550-E552 PolarHBondContact OG-OE2 3.31Å; S550-A553 PolarHBondContact O-N 2.81Å; S550-A553 PolarHBondContact OG-N 3.42Å; S550-I554 WeakPolarHBondContact O-CG1 3.34Å; S550-I554 PolarHBondContact O-N 2.98Å; S550-I554 VanDerWaalsContact O-N 3.1Å
551	V	89.1	Confident	88.8	Confident	40 Å²	40	55.6 Å²	55.6	24%	0.242	29%	0.287	C	S	.	.	H	α-helix	trans	-56.4	-43.3	174.4	170.8	0	0	0	0	110.2	A553 I554 V555 R659	V551-A553 PolarHBondContact O-N 3.42Å; V551-I554 PolarHBondContact O-N 3.33Å; V551-V555 HydrophobicContact CG1-CG2 4.06Å; V551-V555 VanDerWaalsContact O-CB 3.31Å; V551-V555 WeakPolarHBondContact O-CB 3.42Å; V551-V555 WeakPolarHBondContact O-CG2 3.37Å; V551-V555 PolarHBondContact O-N 3.36Å; V551-R659 HydrophobicContact CG1-CB 4.49Å; V551-R659 HydrophobicContact CG1-CG 3.56Å; V551-R659 HydrophobicContact CG2-CG 4.22Å
552	E	93.4	Very high	88.5	Confident	42 Å²	42	51 Å²	51	20%	0.196	26%	0.255	C	S	.	.	H	α-helix	trans	-62.2	-43.3	179.9	-60.8	77.1	-165.1	0	0	111.9	S485 L488 V489 A546 S550 V555 A556	S485-E552 WeakPolarHBondContact OG-CG 3.19Å; S485-E552 PolarHBondContact OG-OE1 3.38Å; L488-E552 HydrophobicContact CB-CB 4.47Å; L488-E552 HydrophobicContact CB-CG 4.3Å; L488-E552 HydrophobicContact CD2-CB 4.04Å; L488-E552 HydrophobicContact CD2-CG 3.94Å; L488-E552 HydrophobicContact CG-CB 4.15Å; L488-E552 HydrophobicContact CG-CG 4.32Å; V489-E552 HydrophobicContact CG2-CB 3.9Å; V489-E552 HydrophobicContact CG2-CG 3.8Å; A546-E552 HydrophobicContact CB-CB 4.25Å; S550-E552 WeakPolarHBondContact CB-OE2 3.42Å; S550-E552 PolarHBondContact O-N 3.15Å; S550-E552 PolarHBondContact OG-N 2.95Å; S550-E552 VanDerWaalsContact OG-N 3.17Å; S550-E552 PolarHBondContact OG-OE2 3.31Å; E552-V555 PolarHBondContact O-N 2.83Å; E552-A556 WeakPolarHBondContact O-CB 3.44Å; E552-A556 PolarHBondContact O-N 3.17Å
553	A	92.1	Very high	88	Confident	10 Å²	10	48.5 Å²	48.5	8%	0.083	24%	0.238	C	C	.	.	H	α-helix	trans	-63.5	-40.9	176.6	0	0	0	0	0	112.3	A546 E547 S550 V551 R557	A546-A553 HydrophobicContact CB-CB 3.87Å; E547-A553 WeakPolarHBondContact O-CB 3.24Å; S550-A553 PolarHBondContact O-N 2.81Å; S550-A553 PolarHBondContact OG-N 3.42Å; V551-A553 PolarHBondContact O-N 3.42Å; A553-R557 WeakPolarHBondContact O-CB 3.39Å; A553-R557 PolarHBondContact O-N 3.11Å; A553-R557 VanDerWaalsContact O-N 3.16Å
554	I	90	Very high	87.4	Confident	63 Å²	63	50.6 Å²	50.6	32%	0.323	25%	0.249	S	C	.	.	H	α-helix	trans	-69.5	-45.5	178.2	-63.7	165.8	0	0	0	110.4	S550 V551 R557 N558 Q662	S550-I554 WeakPolarHBondContact O-CG1 3.34Å; S550-I554 PolarHBondContact O-N 2.98Å; S550-I554 VanDerWaalsContact O-N 3.1Å; V551-I554 PolarHBondContact O-N 3.33Å; I554-R557 PolarHBondContact O-N 3.02Å; I554-N558 PolarHBondContact O-N 3.42Å; I554-N558 PolarHBondContact O-OD1 2.83Å; I554-Q662 HydrophobicContact CG2-CB 3.96Å
555	V	91.5	Very high	86.3	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-63.1	-44.3	178	167.1	0	0	0	0	111.4	V489 V551 E552 R557 N558 L559 W658 L661 Q662	V489-V555 HydrophobicContact CG1-CG1 3.89Å; V489-V555 HydrophobicContact CG2-CG1 4.4Å; V551-V555 HydrophobicContact CG1-CG2 4.06Å; V551-V555 VanDerWaalsContact O-CB 3.31Å; V551-V555 WeakPolarHBondContact O-CB 3.42Å; V551-V555 WeakPolarHBondContact O-CG2 3.37Å; V551-V555 PolarHBondContact O-N 3.36Å; E552-V555 PolarHBondContact O-N 2.83Å; V555-R557 PolarHBondContact O-N 2.74Å; V555-N558 PolarHBondContact O-N 2.88Å; V555-L559 HydrophobicContact CG1-CD1 3.95Å; V555-L559 HydrophobicContact CG1-CG 4.46Å; V555-L559 VanDerWaalsContact O-CB 3.32Å; V555-L559 WeakPolarHBondContact O-CB 3.26Å; V555-L559 WeakPolarHBondContact O-CG 3.16Å; V555-L559 PolarHBondContact O-N 2.84Å; V555-W658 HydrophobicContact CG1-CB 4.39Å; V555-W658 HydrophobicContact CG1-CE3 4.04Å; V555-W658 HydrophobicContact CG2-CB 4.4Å; V555-W658 VanDerWaalsContact CG2-O 3.23Å; V555-W658 WeakPolarHBondContact CG2-O 3.42Å; V555-L661 HydrophobicContact CG1-CB 3.92Å; V555-L661 HydrophobicContact CG1-CD1 3.89Å; V555-L661 HydrophobicContact CG1-CG 4.45Å; V555-L661 HydrophobicContact CG2-CB 4.25Å; V555-Q662 HydrophobicContact CG2-CB 4.08Å
556	A	92.6	Very high	85.1	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-58.7	-44.2	176	0	0	0	0	0	112.4	N492 F493 E552 L559 A560	N492-A556 HydrophobicContact CB-CB 3.71Å; F493-A556 HydrophobicContact CB-CB 4.26Å; E552-A556 WeakPolarHBondContact O-CB 3.44Å; E552-A556 PolarHBondContact O-N 3.17Å; A556-L559 WeakPolarHBondContact O-CB 3.45Å; A556-L559 PolarHBondContact O-N 3.47Å; A556-A560 PolarHBondContact O-N 3.5Å
557	R	89.6	Confident	84.1	Confident	129 Å²	129	44.7 Å²	44.7	49%	0.487	22%	0.223	S	C	.	.	H	α-helix	trans	-64.7	-49.6	176.7	-173.2	-179.2	-56.6	165.2	6.8	112.1	A553 I554 V555 L559 A560 E561	A553-R557 WeakPolarHBondContact O-CB 3.39Å; A553-R557 PolarHBondContact O-N 3.11Å; A553-R557 VanDerWaalsContact O-N 3.16Å; I554-R557 PolarHBondContact O-N 3.02Å; V555-R557 PolarHBondContact O-N 2.74Å; R557-L559 VanDerWaalsContact C-N 3.26Å; R557-L559 PolarHBondContact O-N 3.4Å; R557-A560 WeakPolarHBondContact O-CB 3.37Å; R557-A560 PolarHBondContact O-N 2.97Å; R557-E561 PolarHBondContact O-N 3.39Å
558	N	87	Confident	83.1	Confident	16 Å²	16	45.9 Å²	45.9	9%	0.086	22%	0.221	C	C	.	.	H	α-helix	trans	-59.8	-38.8	177.2	-69.2	7.3	0	0	0	111.2	I554 V555 E561 I562 L661 Q662 L664	I554-N558 PolarHBondContact O-N 3.42Å; I554-N558 PolarHBondContact O-OD1 2.83Å; V555-N558 PolarHBondContact O-N 2.88Å; N558-E561 PolarHBondContact O-N 2.98Å; N558-I562 WeakPolarHBondContact O-CB 3.35Å; N558-I562 WeakPolarHBondContact O-CD1 3.34Å; N558-I562 WeakPolarHBondContact O-CG1 3.43Å; N558-I562 PolarHBondContact O-N 2.9Å; N558-L661 PolarHBondContact ND2-O 3.02Å; N558-Q662 VanDerWaalsContact ND2-C 3.34Å; N558-Q662 WeakPolarHBondContact ND2-CA 3.42Å; N558-Q662 PolarHBondContact ND2-O 3.37Å; N558-L664 PolarHBondContact ND2-O 3.07Å
559	L	88	Confident	82.1	Confident	1 Å²	1	43.6 Å²	43.6	1%	0.005	20%	0.203	C	C	.	.	H	α-helix	trans	-62.6	-39	172.9	-82.6	171.5	0	0	0	112.6	V489 F493 V555 A556 R557 G563 I610 F613 L661	V489-L559 HydrophobicContact CG1-CD1 3.86Å; F493-L559 HydrophobicContact CD2-CB 3.62Å; F493-L559 HydrophobicContact CE2-CB 4.11Å; F493-L559 HydrophobicContact CG-CB 4.46Å; V555-L559 HydrophobicContact CG1-CD1 3.95Å; V555-L559 HydrophobicContact CG1-CG 4.46Å; V555-L559 VanDerWaalsContact O-CB 3.32Å; V555-L559 WeakPolarHBondContact O-CB 3.26Å; V555-L559 WeakPolarHBondContact O-CG 3.16Å; V555-L559 PolarHBondContact O-N 2.84Å; A556-L559 WeakPolarHBondContact O-CB 3.45Å; A556-L559 PolarHBondContact O-N 3.47Å; R557-L559 VanDerWaalsContact C-N 3.26Å; R557-L559 PolarHBondContact O-N 3.4Å; L559-G563 WeakPolarHBondContact O-CA 3.49Å; L559-G563 PolarHBondContact O-N 2.89Å; L559-I610 HydrophobicContact CD2-CB 4.45Å; L559-I610 HydrophobicContact CD2-CD1 3.9Å; L559-I610 HydrophobicContact CD2-CG1 3.64Å; L559-I610 HydrophobicContact CD2-CG2 4.08Å; L559-F613 HydrophobicContact CD1-CD2 4.4Å; L559-L661 HydrophobicContact CD1-CD1 3.9Å; L559-L661 HydrophobicContact CD2-CD1 3.73Å; L559-L661 HydrophobicContact CG-CD1 3.81Å
560	A	87.5	Confident	81.2	Confident	1 Å²	1	37 Å²	37	1%	0.008	17%	0.172	C	C	.	.	H	α-helix	trans	-67.1	-42.3	176.3	0	0	0	0	0	111.8	F493 D496 R497 L500 A556 R557 G563 D564	F493-A560 HydrophobicContact CD2-CB 4.23Å; F493-A560 HydrophobicContact CE2-CB 4.46Å; D496-A560 HydrophobicContact CB-CB 4.46Å; R497-A560 HydrophobicContact CB-CB 4.23Å; L500-A560 HydrophobicContact CD1-CB 3.98Å; A556-A560 PolarHBondContact O-N 3.5Å; R557-A560 WeakPolarHBondContact O-CB 3.37Å; R557-A560 PolarHBondContact O-N 2.97Å; A560-G563 CarbonylContact O-C 3.55Å; A560-G563 WeakPolarHBondContact O-CA 3.26Å; A560-G563 PolarHBondContact O-N 3.44Å; A560-G563 VanDerWaalsContact O-N 3.15Å; A560-D564 PolarHBondContact O-N 2.95Å
561	E	81.6	Confident	80.1	Confident	88 Å²	88	35.9 Å²	35.9	41%	0.411	16%	0.164	S	C	.	.	H	α-helix	trans	-65.8	-42.1	175.8	-69	176.4	-164.4	0	0	112.9	R557 N558 G563 D564	R557-E561 PolarHBondContact O-N 3.39Å; N558-E561 PolarHBondContact O-N 2.98Å; E561-G563 VanDerWaalsContact C-N 3.25Å; E561-G563 PolarHBondContact O-N 3.5Å; E561-D564 PolarHBondContact O-N 3.29Å
562	I	76.8	Confident	79.2	Confident	1 Å²	1	37.9 Å²	37.9	1%	0.005	18%	0.178	C	C	.	.	H	α-helix	trans	-65.1	-35.9	171	-66.4	165.1	0	0	0	109.9	L92 N558 D564 E565 I566 I610 L664	L92-I562 HydrophobicContact CD1-CD1 4.34Å; L92-I562 HydrophobicContact CD1-CG1 4.43Å; L92-I562 HydrophobicContact CD1-CG2 3.93Å; L92-I562 HydrophobicContact CD2-CD1 4.49Å; L92-I562 HydrophobicContact CD2-CG1 3.95Å; L92-I562 HydrophobicContact CD2-CG2 4.34Å; N558-I562 WeakPolarHBondContact O-CB 3.35Å; N558-I562 WeakPolarHBondContact O-CD1 3.34Å; N558-I562 WeakPolarHBondContact O-CG1 3.43Å; N558-I562 PolarHBondContact O-N 2.9Å; I562-D564 VanDerWaalsContact C-N 3.33Å; I562-D564 PolarHBondContact O-N 3.26Å; I562-E565 PolarHBondContact O-N 3.15Å; I562-I566 HydrophobicContact CG2-CD1 3.97Å; I562-I566 HydrophobicContact CG2-CG1 4.48Å; I562-I566 PolarHBondContact O-N 3.1Å; I562-I610 HydrophobicContact CG2-CD1 4.23Å; I562-L664 HydrophobicContact CD1-CB 4.05Å
563	G	73.3	Confident	77.8	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-60.6	-34.7	176.3	0	0	0	0	0	113.7	L559 A560 E561 E565 I566 N567 Y614	L559-G563 WeakPolarHBondContact O-CA 3.49Å; L559-G563 PolarHBondContact O-N 2.89Å; A560-G563 CarbonylContact O-C 3.55Å; A560-G563 WeakPolarHBondContact O-CA 3.26Å; A560-G563 PolarHBondContact O-N 3.44Å; A560-G563 VanDerWaalsContact O-N 3.15Å; E561-G563 VanDerWaalsContact C-N 3.25Å; E561-G563 PolarHBondContact O-N 3.5Å; G563-E565 VanDerWaalsContact C-N 3.35Å; G563-I566 PolarHBondContact O-N 3.28Å; G563-N567 VanDerWaalsContact O-CB 3.26Å; G563-N567 WeakPolarHBondContact O-CB 3.2Å; G563-N567 PolarHBondContact O-N 2.81Å; G563-Y614 WeakPolarHBondContact O-CE2 3.47Å
564	D	75.9	Confident	76.6	Confident	55 Å²	55	36.8 Å²	36.8	29%	0.294	17%	0.17	S	C	.	.	H	α-helix	trans	-64.2	-38.3	173.5	-86	-34.9	0	0	0	112.4	R497 A560 E561 I562 N567 R568	R497-D564 IonicContact CZ-OD1 2.78Å; R497-D564 IonicContact NH1-OD1 3.32Å; R497-D564 PolarHBondContact NH1-OD1 3.39Å; R497-D564 IonicContact NH1-OD2 3.79Å; R497-D564 IonicContact NH2-OD1 3.98Å; R497-D564 PolarHBondContact NH2-OD1 2.9Å; R497-D564 VanDerWaalsContact NH2-OD1 3.07Å; A560-D564 PolarHBondContact O-N 2.95Å; E561-D564 PolarHBondContact O-N 3.29Å; I562-D564 VanDerWaalsContact C-N 3.33Å; I562-D564 PolarHBondContact O-N 3.26Å; D564-N567 WeakPolarHBondContact O-CB 3.32Å; D564-N567 PolarHBondContact O-N 3.49Å; D564-R568 WeakPolarHBondContact O-CB 3.31Å; D564-R568 PolarHBondContact O-N 3.32Å
565	E	68.5	Low	75.7	Confident	21 Å²	21	35.8 Å²	35.8	10%	0.098	17%	0.165	C	C	.	.	H	α-helix	trans	-75.1	-35.5	178.3	-177.3	53.1	-154.8	0	0	111.7	I90 I562 G563 N567 R568 M569	I90-E565 HydrophobicContact CB-CG 4.34Å; I90-E565 HydrophobicContact CD1-CG 4.07Å; I90-E565 HydrophobicContact CG1-CG 3.93Å; I90-E565 HydrophobicContact CG2-CG 3.67Å; I562-E565 PolarHBondContact O-N 3.15Å; G563-E565 VanDerWaalsContact C-N 3.35Å; E565-N567 VanDerWaalsContact C-N 3.33Å; E565-R568 PolarHBondContact O-N 3.31Å; E565-R568 IonicContact OE1-CZ 2.7Å; E565-R568 IonicContact OE1-NE 2.84Å; E565-R568 PolarHBondContact OE1-NE 3.39Å; E565-R568 IonicContact OE1-NH2 2.7Å; E565-R568 PolarHBondContact OE1-NH2 3.2Å; E565-R568 IonicContact OE2-CZ 3.85Å; E565-R568 IonicContact OE2-NE 3.35Å; E565-R568 PolarHBondContact OE2-NE 3.23Å; E565-R568 IonicContact OE2-NH2 3.4Å; E565-R568 PolarHBondContact OE2-NH2 2.99Å; E565-M569 PolarHBondContact O-N 3.39Å; E565-M569 VanDerWaalsContact O-N 3.13Å
566	I	68.4	Low	74.6	Confident	1 Å²	1	41.4 Å²	41.4	1%	0.005	19%	0.186	C	C	.	.	H	α-helix	trans	-63.2	-39.8	167.4	-69.7	172	0	0	0	110.8	I90 I466 I562 G563 M569 Y570 I610	I90-I566 HydrophobicContact CD1-CB 4.46Å; I90-I566 HydrophobicContact CD1-CG1 3.59Å; I466-I566 HydrophobicContact CD1-CD1 4.18Å; I466-I566 HydrophobicContact CD1-CG1 4.11Å; I562-I566 HydrophobicContact CG2-CD1 3.97Å; I562-I566 HydrophobicContact CG2-CG1 4.48Å; I562-I566 PolarHBondContact O-N 3.1Å; G563-I566 PolarHBondContact O-N 3.28Å; I566-M569 PolarHBondContact O-N 2.58Å; I566-Y570 HydrophobicContact CG2-CD2 4.21Å; I566-Y570 WeakPolarHBondContact O-CA 3.41Å; I566-Y570 WeakPolarHBondContact O-CB 3.2Å; I566-Y570 PolarHBondContact O-N 3.35Å; I566-I610 HydrophobicContact CD1-CB 4.03Å; I566-I610 HydrophobicContact CD1-CG2 3.36Å
567	N	70.6	Confident	73.2	Confident	43 Å²	43	41.7 Å²	41.7	23%	0.23	19%	0.188	C	C	.	.	H	α-helix	trans	-65.1	-40.9	176.1	-170.6	61.5	0	0	0	111.9	G563 D564 E565 M569 G571 Y614	G563-N567 VanDerWaalsContact O-CB 3.26Å; G563-N567 WeakPolarHBondContact O-CB 3.2Å; G563-N567 PolarHBondContact O-N 2.81Å; D564-N567 WeakPolarHBondContact O-CB 3.32Å; D564-N567 PolarHBondContact O-N 3.49Å; E565-N567 VanDerWaalsContact C-N 3.33Å; N567-M569 VanDerWaalsContact C-N 3.27Å; N567-M569 PolarHBondContact O-N 2.92Å; N567-G571 WeakPolarHBondContact O-CA 3.45Å; N567-G571 PolarHBondContact O-N 2.84Å; N567-Y614 HydrophobicContact CB-CE1 4.1Å; N567-Y614 HydrophobicContact CB-CE2 4.12Å; N567-Y614 VanDerWaalsContact CB-OH 3.26Å; N567-Y614 WeakPolarHBondContact CB-OH 3.4Å; N567-Y614 WeakPolarHBondContact OD1-CE1 3.35Å; N567-Y614 PolarHBondContact OD1-OH 3.23Å
568	R	70.7	Confident	72.3	Confident	170 Å²	170	35.9 Å²	35.9	64%	0.642	17%	0.166	S	C	*	.	H	α-helix	trans	-60.6	-38	175.8	-168.3	178.1	74.1	103.9	0.7	112	D564 E565	D564-R568 WeakPolarHBondContact O-CB 3.31Å; D564-R568 PolarHBondContact O-N 3.32Å; E565-R568 PolarHBondContact O-N 3.31Å; E565-R568 IonicContact OE1-CZ 2.7Å; E565-R568 IonicContact OE1-NE 2.84Å; E565-R568 PolarHBondContact OE1-NE 3.39Å; E565-R568 IonicContact OE1-NH2 2.7Å; E565-R568 PolarHBondContact OE1-NH2 3.2Å; E565-R568 IonicContact OE2-CZ 3.85Å; E565-R568 IonicContact OE2-NE 3.35Å; E565-R568 PolarHBondContact OE2-NE 3.23Å; E565-R568 IonicContact OE2-NH2 3.4Å; E565-R568 PolarHBondContact OE2-NH2 2.99Å
569	M	61.9	Low	71.5	Confident	42 Å²	42	42.9 Å²	42.9	21%	0.207	20%	0.196	C	C	.	.	H	α-helix	trans	-91.6	-33.6	-175	-166.6	168.3	-58.7	0	0	114.4	T88 I90 E565 I566 N567	T88-M569 HydrophobicContact CG2-CE 3.96Å; I90-M569 HydrophobicContact CD1-CE 4.46Å; I90-M569 HydrophobicContact CD1-SD 4.41Å; I90-M569 HydrophobicContact CG1-CE 3.54Å; I90-M569 HydrophobicContact CG1-SD 3.85Å; E565-M569 PolarHBondContact O-N 3.39Å; E565-M569 VanDerWaalsContact O-N 3.13Å; I566-M569 PolarHBondContact O-N 2.58Å; N567-M569 VanDerWaalsContact C-N 3.27Å; N567-M569 PolarHBondContact O-N 2.92Å
570	Y	64.8	Low	70.5	Confident	29 Å²	29	45.4 Å²	45.4	11%	0.114	21%	0.21	C	C	.	.	H	α-helix	trans	-130.9	-7	-170.4	-55.1	-71.5	0	0	0	114.1	I90 I464 I466 I566 R573 L574	I90-Y570 HydrophobicContact CD1-CE2 4.34Å; I464-Y570 HydrophobicContact CG1-CD1 4.38Å; I464-Y570 HydrophobicContact CG2-CD1 4.14Å; I464-Y570 HydrophobicContact CG2-CD2 4.29Å; I464-Y570 HydrophobicContact CG2-CE1 4.06Å; I464-Y570 HydrophobicContact CG2-CE2 4.21Å; I464-Y570 HydrophobicContact CG2-CG 4.25Å; I466-Y570 HydrophobicContact CD1-CD2 4.1Å; I466-Y570 HydrophobicContact CD1-CE2 3.66Å; I466-Y570 HydrophobicContact CG1-CE2 3.79Å; I566-Y570 HydrophobicContact CG2-CD2 4.21Å; I566-Y570 WeakPolarHBondContact O-CA 3.41Å; I566-Y570 WeakPolarHBondContact O-CB 3.2Å; I566-Y570 PolarHBondContact O-N 3.35Å; Y570-R573 WeakPolarHBondContact O-CA 3.42Å; Y570-R573 WeakPolarHBondContact O-CB 3.37Å; Y570-R573 PolarHBondContact O-N 2.99Å; Y570-L574 PolarHBondContact O-N 3.47Å
571	G	68.8	Low	69.5	Low	1 Å²	1	45.7 Å²	45.7	1%	0.01	21%	0.211	C	C	.	.	H	α-helix	trans	-50.6	-50.7	179.9	0	0	0	0	0	113.6	N567 R573 L574 D575	N567-G571 WeakPolarHBondContact O-CA 3.45Å; N567-G571 PolarHBondContact O-N 2.84Å; G571-R573 PolarHBondContact O-N 3.48Å; G571-R573 VanDerWaalsContact O-N 3.11Å; G571-L574 PolarHBondContact O-N 3.37Å; G571-D575 WeakPolarHBondContact O-CB 3.23Å; G571-D575 PolarHBondContact O-N 3.16Å
572	P	69.6	Low	68.8	Low	82 Å²	82	44 Å²	44	53%	0.532	21%	0.207	S	C	.	.	H	α-helix	trans	-61.2	-20.3	175.9	-25.3	35.2	0	0	0	114.9	R576	P572-R576 WeakPolarHBondContact O-CG 3.14Å; P572-R576 PolarHBondContact O-NE 3.46Å
573	R	64	Low	68.3	Low	29 Å²	29	44.4 Å²	44.4	11%	0.109	21%	0.21	C	C	.	.	H	α-helix	trans	-86.2	-44.3	174.6	-175.6	179.2	176.3	-176.5	-0.9	111.3	L412 V462 Y570 G571 D575 R576 M577	L412-R573 HydrophobicContact CD2-CG 4.06Å; L412-R573 VanDerWaalsContact CD2-NE 3.33Å; V462-R573 VanDerWaalsContact O-CZ 3.29Å; V462-R573 PolarHBondContact O-NH1 3.43Å; V462-R573 PolarHBondContact O-NH2 3.45Å; Y570-R573 WeakPolarHBondContact O-CA 3.42Å; Y570-R573 WeakPolarHBondContact O-CB 3.37Å; Y570-R573 PolarHBondContact O-N 2.99Å; G571-R573 PolarHBondContact O-N 3.48Å; G571-R573 VanDerWaalsContact O-N 3.11Å; R573-D575 VanDerWaalsContact C-N 3.34Å; R573-R576 WeakPolarHBondContact O-CB 3.4Å; R573-R576 PolarHBondContact O-N 3.44Å; R573-M577 WeakPolarHBondContact O-CG 3.41Å; R573-M577 PolarHBondContact O-N 3.09Å
574	L	67.2	Low	68	Low	0 Å²	0	53.2 Å²	53.2	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-63.2	-41.1	175.6	-64.1	174.4	0	0	0	111.1	I464 Y570 G571 R576 M577 I578 T611 Y614	I464-L574 HydrophobicContact CD1-CD2 4.18Å; Y570-L574 PolarHBondContact O-N 3.47Å; G571-L574 PolarHBondContact O-N 3.37Å; L574-R576 VanDerWaalsContact C-N 3.3Å; L574-R576 PolarHBondContact O-N 3.26Å; L574-M577 HydrophobicContact CD2-SD 4.22Å; L574-M577 PolarHBondContact O-N 3.46Å; L574-I578 WeakPolarHBondContact O-CB 3.48Å; L574-I578 WeakPolarHBondContact O-CD1 3.31Å; L574-I578 VanDerWaalsContact O-CG1 3.23Å; L574-I578 WeakPolarHBondContact O-CG1 3.5Å; L574-I578 PolarHBondContact O-N 2.96Å; L574-T611 HydrophobicContact CD1-CG2 4.44Å; L574-T611 HydrophobicContact CD2-CG2 3.91Å; L574-Y614 HydrophobicContact CD1-CD1 3.62Å; L574-Y614 HydrophobicContact CD1-CE1 4.37Å; L574-Y614 HydrophobicContact CD1-CG 4.45Å
575	D	71.2	Confident	67.7	Low	43 Å²	43	52.3 Å²	52.3	23%	0.23	25%	0.245	C	C	.	.	H	α-helix	trans	-63.7	-33.2	174.5	-75	-8.6	0	0	0	112.6	G571 R573 K579 R618	G571-D575 WeakPolarHBondContact O-CB 3.23Å; G571-D575 PolarHBondContact O-N 3.16Å; R573-D575 VanDerWaalsContact C-N 3.34Å; D575-K579 WeakPolarHBondContact O-CB 3.37Å; D575-K579 WeakPolarHBondContact O-CG 3.46Å; D575-K579 PolarHBondContact O-N 3.14Å; D575-R618 VanDerWaalsContact CG-NH2 3.26Å; D575-R618 IonicContact OD1-CZ 3.94Å; D575-R618 VanDerWaalsContact OD1-CZ 3.32Å; D575-R618 IonicContact OD1-NE 2.76Å; D575-R618 PolarHBondContact OD1-NE 3.22Å; D575-R618 IonicContact OD1-NH2 3.45Å; D575-R618 PolarHBondContact OD1-NH2 2.87Å; D575-R618 IonicContact OD2-CZ 2.8Å; D575-R618 IonicContact OD2-NH2 2.68Å; D575-R618 PolarHBondContact OD2-NH2 3.45Å
576	R	68	Low	68.3	Low	117 Å²	117	52.4 Å²	52.4	44%	0.442	25%	0.248	S	C	.	.	H	α-helix	trans	-67	-48.7	172	-84.4	-178.1	-81.4	-176.8	-5.9	111.4	P572 R573 L574 I578 K579 L580	P572-R576 WeakPolarHBondContact O-CG 3.14Å; P572-R576 PolarHBondContact O-NE 3.46Å; R573-R576 WeakPolarHBondContact O-CB 3.4Å; R573-R576 PolarHBondContact O-N 3.44Å; L574-R576 VanDerWaalsContact C-N 3.3Å; L574-R576 PolarHBondContact O-N 3.26Å; R576-I578 VanDerWaalsContact C-N 3.27Å; R576-I578 PolarHBondContact O-N 3.09Å; R576-K579 PolarHBondContact O-N 3.08Å; R576-L580 WeakPolarHBondContact O-CG 3.46Å; R576-L580 PolarHBondContact O-N 3.3Å
577	M	64.1	Low	68.9	Low	7 Å²	7	52.5 Å²	52.5	3%	0.034	25%	0.249	C	C	.	.	H	α-helix	trans	-55.8	-43.3	175	-66.2	170.1	64.1	0	0	111.5	R573 L574 L580 L581 V594	R573-M577 WeakPolarHBondContact O-CG 3.41Å; R573-M577 PolarHBondContact O-N 3.09Å; L574-M577 HydrophobicContact CD2-SD 4.22Å; L574-M577 PolarHBondContact O-N 3.46Å; M577-L580 PolarHBondContact O-N 2.89Å; M577-L581 WeakPolarHBondContact O-CG 3.19Å; M577-L581 PolarHBondContact O-N 3.08Å; M577-V594 HydrophobicContact CE-CB 4.5Å; M577-V594 HydrophobicContact CE-CG1 3.91Å; M577-V594 HydrophobicContact CE-CG2 4.04Å
578	I	70	Confident	69.6	Low	6 Å²	6	51 Å²	51	3%	0.031	24%	0.241	C	C	.	.	H	α-helix	trans	-70.7	-32.4	-179.3	-71.8	167.1	0	0	0	112.8	L574 R576 L580 L581 F615 R618 Q622	L574-I578 WeakPolarHBondContact O-CB 3.48Å; L574-I578 WeakPolarHBondContact O-CD1 3.31Å; L574-I578 VanDerWaalsContact O-CG1 3.23Å; L574-I578 WeakPolarHBondContact O-CG1 3.5Å; L574-I578 PolarHBondContact O-N 2.96Å; R576-I578 VanDerWaalsContact C-N 3.27Å; R576-I578 PolarHBondContact O-N 3.09Å; I578-L580 VanDerWaalsContact C-N 3.3Å; I578-L581 PolarHBondContact O-N 3.48Å; I578-F615 HydrophobicContact CD1-CD2 3.72Å; I578-F615 HydrophobicContact CD1-CE2 4.04Å; I578-F615 HydrophobicContact CG1-CD2 3.55Å; I578-F615 HydrophobicContact CG1-CE2 3.39Å; I578-R618 HydrophobicContact CD1-CB 3.22Å; I578-R618 HydrophobicContact CD1-CG 4.24Å; I578-Q622 HydrophobicContact CG2-CB 4.17Å; I578-Q622 HydrophobicContact CG2-CG 4.21Å; I578-Q622 VanDerWaalsContact CG2-OE1 3.28Å; I578-Q622 PolarHBondContact O-NE2 3.06Å
579	K	70.9	Confident	70.1	Confident	163 Å²	163	45.8 Å²	45.8	71%	0.709	22%	0.223	S	C	*	.	H	α-helix	trans	-67.7	-29.3	173.2	-78.7	169.3	-178.5	-177.6	0	113.1	D575 R576	D575-K579 WeakPolarHBondContact O-CB 3.37Å; D575-K579 WeakPolarHBondContact O-CG 3.46Å; D575-K579 PolarHBondContact O-N 3.14Å; R576-K579 PolarHBondContact O-N 3.08Å
580	L	66	Low	71	Confident	55 Å²	55	43.8 Å²	43.8	29%	0.288	21%	0.214	S	C	.	.	H	α-helix	trans	-81.9	-17.4	179.7	-67.2	173.1	0	0	0	113.1	I404 I408 R576 M577 I578	I404-L580 HydrophobicContact CG2-CB 4.32Å; I404-L580 WeakPolarHBondContact CG2-O 3.14Å; I408-L580 HydrophobicContact CD1-CB 4.24Å; I408-L580 HydrophobicContact CG1-CB 4.13Å; I408-L580 HydrophobicContact CG1-CD1 3.57Å; R576-L580 WeakPolarHBondContact O-CG 3.46Å; R576-L580 PolarHBondContact O-N 3.3Å; M577-L580 PolarHBondContact O-N 2.89Å; I578-L580 VanDerWaalsContact C-N 3.3Å
581	L	67.4	Low	71.8	Confident	6 Å²	6	42.4 Å²	42.4	3%	0.031	21%	0.208	C	C	.	.	S	Bend	trans	-81.9	130.2	174.6	-65.6	170.9	0	0	0	110.8	M577 I578 V583 M590 N593 V594 F615	M577-L581 WeakPolarHBondContact O-CG 3.19Å; M577-L581 PolarHBondContact O-N 3.08Å; I578-L581 PolarHBondContact O-N 3.48Å; L581-V583 PolarHBondContact O-N 3.38Å; L581-V583 VanDerWaalsContact O-N 3.1Å; L581-M590 HydrophobicContact CB-CG 4.17Å; L581-M590 HydrophobicContact CB-SD 3.86Å; L581-M590 HydrophobicContact CD1-CB 4.12Å; L581-M590 HydrophobicContact CD1-CG 4.02Å; L581-M590 HydrophobicContact CD1-SD 4.19Å; L581-M590 HydrophobicContact CD2-CG 4.39Å; L581-M590 HydrophobicContact CG-CG 4.42Å; L581-N593 HydrophobicContact CD2-CB 4.5Å; L581-V594 HydrophobicContact CD1-CG2 4Å; L581-F615 HydrophobicContact CD1-CE2 3.69Å; L581-F615 HydrophobicContact CD1-CZ 3.59Å
582	P	67.1	Low	72.4	Confident	52 Å²	52	42.9 Å²	42.9	34%	0.338	21%	0.209	S	C	.	.			trans	-71.2	109.8	176.1	30.2	-33.5	0	0	0	109.2	E584 E585	P582-E584 PolarHBondContact O-N 2.8Å; P582-E585 HydrophobicContact CG-CG 3.77Å; P582-E585 WeakPolarHBondContact CG-OE1 3.49Å; P582-E585 WeakPolarHBondContact O-CB 3.5Å; P582-E585 PolarHBondContact O-N 2.86Å
583	V	65.9	Low	72.8	Confident	10 Å²	10	39.8 Å²	39.8	6%	0.061	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-15.4	-171.4	-164.6	0	0	0	0	114.1	L581 Q622 R623 K626	L581-V583 PolarHBondContact O-N 3.38Å; L581-V583 VanDerWaalsContact O-N 3.1Å; V583-Q622 HydrophobicContact CG1-CG 4.27Å; V583-Q622 HydrophobicContact CG2-CG 4.02Å; V583-Q622 VanDerWaalsContact CG2-NE2 3.31Å; V583-R623 HydrophobicContact CG1-CG 3.85Å; V583-R623 PolarHBondContact O-NH2 3.45Å; V583-K626 HydrophobicContact CB-CD 3.93Å; V583-K626 HydrophobicContact CG1-CD 3.92Å; V583-K626 HydrophobicContact CG2-CD 4.13Å; V583-K626 VanDerWaalsContact CG2-NZ 3.33Å
584	E	66.6	Low	73.4	Confident	185 Å²	185	38.6 Å²	38.6	86%	0.864	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-19.3	177	-68.4	167.4	-149.5	0	0	113.8	P582	P582-E584 PolarHBondContact O-N 2.8Å
585	E	70.4	Confident	73.7	Confident	37 Å²	37	38.7 Å²	38.7	17%	0.173	19%	0.185	C	C	.	.	S	Bend	trans	-59.7	165	173.3	-85.1	174.2	-169.5	0	0	112.4	P582 M590 R623	P582-E585 HydrophobicContact CG-CG 3.77Å; P582-E585 WeakPolarHBondContact CG-OE1 3.49Å; P582-E585 WeakPolarHBondContact O-CB 3.5Å; P582-E585 PolarHBondContact O-N 2.86Å; E585-M590 HydrophobicContact CB-CE 4.13Å; E585-M590 HydrophobicContact CB-CG 4.33Å; E585-M590 WeakPolarHBondContact O-CE 3.32Å; E585-R623 PolarHBondContact O-NH2 3.24Å
586	C	80	Confident	73.7	Confident	22 Å²	22	40.5 Å²	40.5	15%	0.149	19%	0.189	C	C	.	.			trans	-66.4	137.6	172	-174.9	0	0	0	0	110	L588 E589 M590	C586-L588 PolarHBondContact O-N 3.24Å; C586-E589 HydrophobicContact CB-CB 4.46Å; C586-E589 HydrophobicContact CB-CG 4.02Å; C586-E589 WeakPolarHBondContact CB-OE2 3.15Å; C586-E589 PolarHBondContact N-OE2 3.36Å; C586-E589 PolarHBondContact O-N 2.8Å; C586-M590 PolarHBondContact O-N 3.16Å
587	P	82.1	Confident	73.9	Confident	4 Å²	4	36.8 Å²	36.8	3%	0.026	18%	0.179	C	C	.	.	H	α-helix	trans	-53.5	-31.4	174.5	-23.8	31.2	0	0	0	113.3	M590 F591 L619 V635 C638	P587-M590 PolarHBondContact O-N 2.66Å; P587-F591 HydrophobicContact CB-CE2 4.43Å; P587-F591 WeakPolarHBondContact O-CD2 3.49Å; P587-F591 PolarHBondContact O-N 2.96Å; P587-L619 HydrophobicContact CB-CD2 4.03Å; P587-V635 HydrophobicContact CB-CG2 4.12Å; P587-V635 HydrophobicContact CG-CG2 4.15Å; P587-C638 HydrophobicContact CB-CB 3.85Å
588	L	84.4	Confident	74.3	Confident	12 Å²	12	37.1 Å²	37.1	6%	0.063	18%	0.181	C	C	.	.	H	α-helix	trans	-64.1	-45.8	177.6	-171.9	51.8	0	0	0	112	L183 C586 M590 F591 Y592 C638 F642	L183-L588 HydrophobicContact CD1-CD2 4.16Å; L183-L588 HydrophobicContact CD1-CG 4.49Å; L183-L588 HydrophobicContact CD2-CD2 3.49Å; L183-L588 VanDerWaalsContact CD2-CD2 3.49Å; L183-L588 HydrophobicContact CG-CD2 4.5Å; C586-L588 PolarHBondContact O-N 3.24Å; L588-M590 VanDerWaalsContact C-N 3.33Å; L588-M590 PolarHBondContact O-N 2.95Å; L588-F591 WeakPolarHBondContact O-CB 3.37Å; L588-F591 PolarHBondContact O-N 2.94Å; L588-F591 VanDerWaalsContact O-N 3.14Å; L588-Y592 HydrophobicContact CD1-CD2 4.11Å; L588-Y592 HydrophobicContact CD1-CE2 3.83Å; L588-Y592 HydrophobicContact CG-CD2 4.15Å; L588-Y592 HydrophobicContact CG-CE2 3.99Å; L588-Y592 VanDerWaalsContact O-CD2 3.29Å; L588-Y592 WeakPolarHBondContact O-CD2 3.43Å; L588-Y592 PolarHBondContact O-N 3.09Å; L588-C638 HydrophobicContact CB-CB 4.21Å; L588-F642 HydrophobicContact CD1-CB 3.71Å; L588-F642 HydrophobicContact CD1-CD2 4.11Å; L588-F642 HydrophobicContact CD1-CG 4.37Å
589	E	80.9	Confident	74.6	Confident	60 Å²	60	38.6 Å²	38.6	28%	0.28	19%	0.188	S	C	.	.	H	α-helix	trans	-61.1	-42.7	176.6	-65.5	166.9	143.3	0	0	111.1	C586 F591 Y592 N593	C586-E589 HydrophobicContact CB-CB 4.46Å; C586-E589 HydrophobicContact CB-CG 4.02Å; C586-E589 WeakPolarHBondContact CB-OE2 3.15Å; C586-E589 PolarHBondContact N-OE2 3.36Å; C586-E589 PolarHBondContact O-N 2.8Å; E589-F591 PolarHBondContact O-N 2.98Å; E589-Y592 WeakPolarHBondContact O-CB 3.3Å; E589-Y592 PolarHBondContact O-N 3.3Å; E589-N593 PolarHBondContact O-N 3.34Å
590	M	81.2	Confident	74.5	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-61.2	-40	173.6	-75.7	-171.8	-97.8	0	0	112.9	L581 E585 C586 P587 L588 N593 V594 F615 L619 R623	L581-M590 HydrophobicContact CB-CG 4.17Å; L581-M590 HydrophobicContact CB-SD 3.86Å; L581-M590 HydrophobicContact CD1-CB 4.12Å; L581-M590 HydrophobicContact CD1-CG 4.02Å; L581-M590 HydrophobicContact CD1-SD 4.19Å; L581-M590 HydrophobicContact CD2-CG 4.39Å; L581-M590 HydrophobicContact CG-CG 4.42Å; E585-M590 HydrophobicContact CB-CE 4.13Å; E585-M590 HydrophobicContact CB-CG 4.33Å; E585-M590 WeakPolarHBondContact O-CE 3.32Å; C586-M590 PolarHBondContact O-N 3.16Å; P587-M590 PolarHBondContact O-N 2.66Å; L588-M590 VanDerWaalsContact C-N 3.33Å; L588-M590 PolarHBondContact O-N 2.95Å; M590-N593 PolarHBondContact O-N 3.21Å; M590-V594 PolarHBondContact O-N 3.42Å; M590-V594 VanDerWaalsContact O-N 3.09Å; M590-F615 HydrophobicContact CB-CZ 4.28Å; M590-L619 HydrophobicContact CB-CD2 4.34Å; M590-L619 HydrophobicContact CE-CD1 3.89Å; M590-L619 HydrophobicContact CE-CD2 4.38Å; M590-L619 HydrophobicContact SD-CD1 3.61Å; M590-L619 HydrophobicContact SD-CD2 4.27Å; M590-R623 VanDerWaalsContact CE-NH2 3.31Å
591	F	83	Confident	74.3	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-63.5	-43.9	172.6	-76.3	-59.3	0	0	0	112.2	P587 L588 E589 N593 V594 A595 L612 F615 V635 C638 L639 F642	P587-F591 HydrophobicContact CB-CE2 4.43Å; P587-F591 WeakPolarHBondContact O-CD2 3.49Å; P587-F591 PolarHBondContact O-N 2.96Å; L588-F591 WeakPolarHBondContact O-CB 3.37Å; L588-F591 PolarHBondContact O-N 2.94Å; L588-F591 VanDerWaalsContact O-N 3.14Å; E589-F591 PolarHBondContact O-N 2.98Å; F591-N593 PolarHBondContact O-N 2.66Å; F591-V594 PolarHBondContact O-N 2.93Å; F591-A595 WeakPolarHBondContact O-CB 3.4Å; F591-A595 PolarHBondContact O-N 3.08Å; F591-L612 HydrophobicContact CD1-CD1 3.86Å; F591-L612 HydrophobicContact CE1-CD1 4.48Å; F591-F615 AromaticContact CD1-CD1 3.67Å; F591-F615 HydrophobicContact CD1-CD1 3.67Å; F591-F615 AromaticContact CD1-CE1 3.64Å; F591-F615 HydrophobicContact CD1-CE1 3.64Å; F591-F615 AromaticContact CE1-CD1 3.65Å; F591-F615 HydrophobicContact CE1-CD1 3.65Å; F591-F615 AromaticContact CE1-CE1 3.87Å; F591-F615 HydrophobicContact CE1-CE1 3.87Å; F591-F615 HydrophobicContact CG-CE1 4.39Å; F591-V635 HydrophobicContact CE2-CG1 3.86Å; F591-V635 HydrophobicContact CZ-CG1 3.6Å; F591-C638 HydrophobicContact CD2-CB 4.11Å; F591-C638 HydrophobicContact CE2-CB 4.02Å; F591-L639 HydrophobicContact CD1-CD1 4.17Å; F591-L639 HydrophobicContact CE1-CB 4.37Å; F591-L639 HydrophobicContact CE1-CD1 3.77Å; F591-L639 HydrophobicContact CE2-CB 3.82Å; F591-L639 HydrophobicContact CZ-CB 3.7Å; F591-L639 HydrophobicContact CZ-CD1 4Å; F591-L639 HydrophobicContact CZ-CG 4.27Å; F591-F642 HydrophobicContact CB-CB 4.35Å; F591-F642 HydrophobicContact CB-CD1 4.16Å; F591-F642 HydrophobicContact CB-CD2 4.14Å; F591-F642 HydrophobicContact CB-CG 3.91Å
592	Y	81.6	Confident	74.3	Confident	10 Å²	10	37.3 Å²	37.3	4%	0.039	20%	0.2	C	C	.	.	H	α-helix	trans	-57.2	-47.1	174.7	-90.1	-83.1	0	0	0	111.9	L176 S179 L183 L588 E589 A595 R596 F642 Q645	L176-Y592 HydrophobicContact CD2-CD1 3.72Å; L176-Y592 HydrophobicContact CD2-CE1 3.74Å; S179-Y592 WeakPolarHBondContact CB-OH 3.47Å; L183-Y592 HydrophobicContact CD1-CD2 4.32Å; L183-Y592 HydrophobicContact CD1-CE2 3.37Å; L183-Y592 WeakPolarHBondContact CD1-OH 3.23Å; L588-Y592 HydrophobicContact CD1-CD2 4.11Å; L588-Y592 HydrophobicContact CD1-CE2 3.83Å; L588-Y592 HydrophobicContact CG-CD2 4.15Å; L588-Y592 HydrophobicContact CG-CE2 3.99Å; L588-Y592 VanDerWaalsContact O-CD2 3.29Å; L588-Y592 WeakPolarHBondContact O-CD2 3.43Å; L588-Y592 PolarHBondContact O-N 3.09Å; E589-Y592 WeakPolarHBondContact O-CB 3.3Å; E589-Y592 PolarHBondContact O-N 3.3Å; Y592-A595 PolarHBondContact O-N 3.28Å; Y592-R596 WeakPolarHBondContact O-CG 3.34Å; Y592-R596 PolarHBondContact O-N 2.91Å; Y592-R596 VanDerWaalsContact O-N 3.12Å; Y592-F642 HydrophobicContact CD1-CD2 4.44Å; Y592-F642 AromaticContact CD1-CE2 3.76Å; Y592-F642 HydrophobicContact CD1-CE2 3.76Å; Y592-F642 AromaticContact CD2-CD2 3.79Å; Y592-F642 HydrophobicContact CD2-CD2 3.79Å; Y592-F642 AromaticContact CD2-CE2 3.9Å; Y592-F642 HydrophobicContact CD2-CE2 3.9Å; Y592-F642 HydrophobicContact CE1-CD2 4.39Å; Y592-F642 AromaticContact CE1-CE2 3.89Å; Y592-F642 HydrophobicContact CE1-CE2 3.89Å; Y592-F642 AromaticContact CE2-CD2 3.7Å; Y592-F642 HydrophobicContact CE2-CD2 3.7Å; Y592-F642 AromaticContact CE2-CE2 3.99Å; Y592-F642 HydrophobicContact CE2-CE2 3.99Å; Y592-F642 HydrophobicContact CG-CD2 4.14Å; Y592-F642 AromaticContact CG-CE2 3.76Å; Y592-F642 HydrophobicContact CG-CE2 3.76Å; Y592-F642 AromaticContact CZ-CE2 3.99Å; Y592-Q645 PolarHBondContact OH-OE1 3.01Å
593	N	77.1	Confident	74.6	Confident	18 Å²	18	39.5 Å²	39.5	10%	0.096	21%	0.214	C	C	.	.	H	α-helix	trans	-62.2	-44.8	-179.4	-78.2	-27	0	0	0	112.6	T397 L581 E589 M590 F591	T397-N593 PolarHBondContact O-OD1 2.96Å; L581-N593 HydrophobicContact CD2-CB 4.5Å; E589-N593 PolarHBondContact O-N 3.34Å; M590-N593 PolarHBondContact O-N 3.21Å; F591-N593 PolarHBondContact O-N 2.66Å
594	V	76.3	Confident	75.2	Confident	4 Å²	4	40.5 Å²	40.5	2%	0.024	22%	0.22	C	C	.	.	H	α-helix	trans	-73.5	-38.1	177.8	169.8	0	0	0	0	112.7	M577 L581 M590 F591 R596 V597 L598 F615	M577-V594 HydrophobicContact CE-CB 4.5Å; M577-V594 HydrophobicContact CE-CG1 3.91Å; M577-V594 HydrophobicContact CE-CG2 4.04Å; L581-V594 HydrophobicContact CD1-CG2 4Å; M590-V594 PolarHBondContact O-N 3.42Å; M590-V594 VanDerWaalsContact O-N 3.09Å; F591-V594 PolarHBondContact O-N 2.93Å; V594-R596 VanDerWaalsContact C-N 3.29Å; V594-R596 PolarHBondContact O-N 2.95Å; V594-V597 PolarHBondContact O-N 3.37Å; V594-L598 HydrophobicContact CG1-CD1 3.81Å; V594-L598 HydrophobicContact CG1-CG 4.07Å; V594-L598 WeakPolarHBondContact O-CG 3.36Å; V594-L598 PolarHBondContact O-N 2.95Å; V594-F615 HydrophobicContact CB-CD1 4.31Å; V594-F615 HydrophobicContact CB-CD2 4.46Å; V594-F615 HydrophobicContact CB-CE1 4.12Å; V594-F615 HydrophobicContact CB-CE2 4.27Å; V594-F615 HydrophobicContact CB-CG 4.49Å; V594-F615 HydrophobicContact CB-CZ 4.11Å; V594-F615 HydrophobicContact CG1-CD1 4.18Å; V594-F615 HydrophobicContact CG1-CD2 4.13Å; V594-F615 HydrophobicContact CG1-CE1 4.48Å; V594-F615 HydrophobicContact CG1-CE2 4.43Å; V594-F615 HydrophobicContact CG1-CG 4.01Å; V594-F615 HydrophobicContact CG2-CD2 3.99Å; V594-F615 HydrophobicContact CG2-CE1 4.07Å; V594-F615 HydrophobicContact CG2-CE2 3.48Å; V594-F615 VanDerWaalsContact CG2-CE2 3.48Å; V594-F615 HydrophobicContact CG2-CG 4.49Å; V594-F615 HydrophobicContact CG2-CZ 3.53Å
595	A	74.3	Confident	75.6	Confident	2 Å²	2	33.1 Å²	33.1	2%	0.017	19%	0.187	C	C	.	.	H	α-helix	trans	-61.7	-36.5	178.3	0	0	0	0	0	112.5	F591 Y592 V597 L598 F599 F642	F591-A595 WeakPolarHBondContact O-CB 3.4Å; F591-A595 PolarHBondContact O-N 3.08Å; Y592-A595 PolarHBondContact O-N 3.28Å; A595-V597 VanDerWaalsContact C-N 3.26Å; A595-V597 PolarHBondContact O-N 3.08Å; A595-L598 PolarHBondContact O-N 3.04Å; A595-F599 HydrophobicContact CB-CD2 3.87Å; A595-F599 HydrophobicContact CB-CE2 4.07Å; A595-F599 VanDerWaalsContact O-CD2 3.3Å; A595-F599 WeakPolarHBondContact O-CD2 3.2Å; A595-F599 PolarHBondContact O-N 3.35Å; A595-F642 HydrophobicContact CB-CE1 3.57Å; A595-F642 HydrophobicContact CB-CE2 4.18Å; A595-F642 HydrophobicContact CB-CZ 3.18Å
596	R	71.6	Confident	75.9	Confident	80 Å²	80	31.5 Å²	31.5	30%	0.302	18%	0.179	S	C	.	.	H	α-helix	trans	-57.3	-38.7	172.3	-73.3	173.5	66	-131.9	2.2	112.2	V396 Y592 V594 A600	V396-R596 PolarHBondContact O-NH1 3.48Å; V396-R596 PolarHBondContact O-NH2 3.48Å; V396-R596 VanDerWaalsContact O-NH2 3.12Å; Y592-R596 WeakPolarHBondContact O-CG 3.34Å; Y592-R596 PolarHBondContact O-N 2.91Å; Y592-R596 VanDerWaalsContact O-N 3.12Å; V594-R596 VanDerWaalsContact C-N 3.29Å; V594-R596 PolarHBondContact O-N 2.95Å; R596-A600 WeakPolarHBondContact O-CB 3.44Å; R596-A600 PolarHBondContact O-N 3.25Å
597	V	71.1	Confident	75.7	Confident	40 Å²	40	30.5 Å²	30.5	24%	0.242	17%	0.172	C	C	.	.	H	α-helix	trans	-73.8	-38.4	177.2	-177.2	0	0	0	0	112.1	I408 V594 A595 R601	I408-V597 HydrophobicContact CG2-CG2 4.49Å; V594-V597 PolarHBondContact O-N 3.37Å; A595-V597 VanDerWaalsContact C-N 3.26Å; A595-V597 PolarHBondContact O-N 3.08Å; V597-R601 PolarHBondContact O-NH1 3.16Å; V597-R601 VanDerWaalsContact O-NH1 3.15Å
598	L	72.4	Confident	75.5	Confident	14 Å²	14	30.9 Å²	30.9	7%	0.073	17%	0.174	C	C	.	.	H	α-helix	trans	-72.5	-48.3	-178.4	-67.7	178.3	0	0	0	112.9	I464 V594 A595 Q608 T611 L612	I464-L598 HydrophobicContact CD1-CD2 4.22Å; V594-L598 HydrophobicContact CG1-CD1 3.81Å; V594-L598 HydrophobicContact CG1-CG 4.07Å; V594-L598 WeakPolarHBondContact O-CG 3.36Å; V594-L598 PolarHBondContact O-N 2.95Å; A595-L598 PolarHBondContact O-N 3.04Å; L598-Q608 PolarHBondContact O-NE2 3.31Å; L598-T611 HydrophobicContact CD1-CG2 4.18Å; L598-T611 HydrophobicContact CD2-CG2 3.69Å; L598-L612 HydrophobicContact CD1-CB 4.13Å; L598-L612 HydrophobicContact CD1-CD1 4.37Å
599	F	76	Confident	75.5	Confident	37 Å²	37	30.3 Å²	30.3	16%	0.162	17%	0.171	C	C	.	.	H	α-helix	trans	-93.3	-12.5	-171	-61.5	-73.4	0	0	0	114.5	A595 R601 T604 Q608 L612 I646 I648	A595-F599 HydrophobicContact CB-CD2 3.87Å; A595-F599 HydrophobicContact CB-CE2 4.07Å; A595-F599 VanDerWaalsContact O-CD2 3.3Å; A595-F599 WeakPolarHBondContact O-CD2 3.2Å; A595-F599 PolarHBondContact O-N 3.35Å; F599-R601 PolarHBondContact O-N 3.47Å; F599-T604 HydrophobicContact CD1-CG2 4.49Å; F599-T604 HydrophobicContact CE1-CG2 4.06Å; F599-Q608 HydrophobicContact CD1-CB 3.9Å; F599-Q608 HydrophobicContact CD1-CG 4.29Å; F599-Q608 HydrophobicContact CE1-CB 3.41Å; F599-Q608 VanDerWaalsContact CE1-CB 3.41Å; F599-Q608 HydrophobicContact CE1-CG 4.29Å; F599-Q608 HydrophobicContact CZ-CB 4Å; F599-L612 HydrophobicContact CE2-CD2 4.22Å; F599-L612 HydrophobicContact CZ-CD2 4.35Å; F599-I646 HydrophobicContact CD2-CD1 4.35Å; F599-I646 HydrophobicContact CE2-CD1 4.11Å; F599-I648 HydrophobicContact CE1-CD1 3.92Å; F599-I648 HydrophobicContact CZ-CD1 3.85Å
600	A	69.5	Low	75.5	Confident	83 Å²	83	27.5 Å²	27.5	69%	0.686	16%	0.158	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-12.4	176.6	0	0	0	0	0	114.9	R596	R596-A600 WeakPolarHBondContact O-CB 3.44Å; R596-A600 PolarHBondContact O-N 3.25Å
601	R	62	Low	75.4	Confident	88 Å²	88	27.6 Å²	27.6	33%	0.332	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.3	2.6	-172.8	-73.2	-174.1	166.4	65.7	13.8	115.2	E409 P461 V597 F599	E409-R601 IonicContact OE1-NH2 3.33Å; P461-R601 VanDerWaalsContact CB-NH2 3.31Å; P461-R601 VanDerWaalsContact CG-NH2 3.33Å; V597-R601 PolarHBondContact O-NH1 3.16Å; V597-R601 VanDerWaalsContact O-NH1 3.15Å; F599-R601 PolarHBondContact O-N 3.47Å
602	G	66.9	Low	75.5	Confident	26 Å²	26	27.6 Å²	27.6	27%	0.268	16%	0.158	S	C	.	.	S	Bend	trans	145.2	-178.8	178.9	0	0	0	0	0	112.5
603	P	74.5	Confident	75.9	Confident	97 Å²	97	27.1 Å²	27.1	63%	0.63	16%	0.156	S	C	*	.	S	Bend	trans	-60.1	146	-172.6	25.1	-35.8	0	0	0	112.5	N605 Q608	P603-N605 PolarHBondContact O-N 3.29Å; P603-N605 PolarHBondContact O-ND2 3.25Å; P603-Q608 PolarHBondContact O-OE1 3.1Å
604	T	77.7	Confident	76.2	Confident	31 Å²	31	26.3 Å²	26.3	19%	0.19	15%	0.152	C	C	.	.			trans	-47.3	124.9	177.2	-54	0	0	0	0	111	F599 V609 I648 W651	F599-T604 HydrophobicContact CD1-CG2 4.49Å; F599-T604 HydrophobicContact CE1-CG2 4.06Å; T604-V609 HydrophobicContact CG2-CG2 4.2Å; T604-I648 HydrophobicContact CG2-CD1 3.79Å; T604-W651 HydrophobicContact CG2-CB 4.38Å; T604-W651 HydrophobicContact CG2-CD2 3.43Å; T604-W651 VanDerWaalsContact CG2-CD2 3.43Å; T604-W651 HydrophobicContact CG2-CE3 3.8Å; T604-W651 HydrophobicContact CG2-CG 3.66Å; T604-W651 HydrophobicContact CG2-CZ2 4.31Å; T604-W651 HydrophobicContact CG2-CZ3 4.4Å; T604-W651 WeakPolarHBondContact O-CZ2 3.48Å; T604-W651 PolarHBondContact O-NE1 3.04Å
605	N	74.9	Confident	76.6	Confident	31 Å²	31	26.1 Å²	26.1	17%	0.166	15%	0.151	C	C	.	.			trans	-134.1	159.9	174.1	62.9	74	0	0	0	110.8	I466 P603 G607 Q608 V609	I466-N605 PolarHBondContact O-OD1 3.03Å; P603-N605 PolarHBondContact O-N 3.29Å; P603-N605 PolarHBondContact O-ND2 3.25Å; N605-G607 PolarHBondContact O-N 2.97Å; N605-G607 VanDerWaalsContact O-N 3.14Å; N605-G607 WeakPolarHBondContact OD1-CA 3.29Å; N605-G607 PolarHBondContact OD1-N 3.01Å; N605-G607 VanDerWaalsContact OD1-N 3.08Å; N605-Q608 PolarHBondContact ND2-OE1 2.95Å; N605-Q608 PolarHBondContact O-N 2.59Å; N605-Q608 VanDerWaalsContact O-N 3.14Å; N605-Q608 PolarHBondContact OD1-N 2.9Å; N605-Q608 VanDerWaalsContact OD1-N 3.11Å; N605-V609 PolarHBondContact O-N 3.35Å
606	W	77.5	Confident	77.4	Confident	2 Å²	2	26 Å²	26	1%	0.008	15%	0.15	C	C	.	.	H	α-helix	trans	-56.9	-30.1	-179	-85.6	117.5	0	0	0	113	L468 V609 I610 W651 I652 Q655 W658 I660 L661	L468-W606 HydrophobicContact CB-CB 3.31Å; L468-W606 HydrophobicContact CB-CG 4.27Å; L468-W606 HydrophobicContact CD1-CB 4.01Å; L468-W606 HydrophobicContact CG-CB 4.19Å; W606-V609 HydrophobicContact CE3-CB 4.4Å; W606-V609 HydrophobicContact CE3-CG1 4.27Å; W606-V609 HydrophobicContact CZ3-CG1 4.25Å; W606-V609 PolarHBondContact O-N 3.24Å; W606-I610 VanDerWaalsContact O-CG1 3.28Å; W606-I610 WeakPolarHBondContact O-CG1 3.33Å; W606-I610 PolarHBondContact O-N 2.78Å; W606-W651 HydrophobicContact CB-CH2 4.27Å; W606-W651 AromaticContact CD1-CH2 3.7Å; W606-W651 AromaticContact CD2-CH2 3.89Å; W606-W651 HydrophobicContact CD2-CH2 3.89Å; W606-W651 AromaticContact CD2-CZ3 3.85Å; W606-W651 HydrophobicContact CD2-CZ3 3.85Å; W606-W651 AromaticContact CE2-CH2 3.94Å; W606-W651 AromaticContact CE2-CZ3 3.89Å; W606-W651 HydrophobicContact CE3-CZ3 4.18Å; W606-W651 AromaticContact CG-CH2 3.71Å; W606-W651 HydrophobicContact CG-CH2 3.71Å; W606-W651 HydrophobicContact CG-CZ3 4.17Å; W606-W651 HydrophobicContact CZ2-CZ3 4.24Å; W606-W651 VanDerWaalsContact N-CH2 3.33Å; W606-W651 AromaticContact NE1-CH2 3.82Å; W606-I652 HydrophobicContact CH2-CB 4.31Å; W606-I652 HydrophobicContact CH2-CD1 4.44Å; W606-I652 HydrophobicContact CH2-CG1 3.87Å; W606-I652 HydrophobicContact CH2-CG2 3.8Å; W606-I652 HydrophobicContact CZ2-CG2 4.35Å; W606-I652 HydrophobicContact CZ3-CD1 4.45Å; W606-I652 HydrophobicContact CZ3-CG1 4.18Å; W606-Q655 HydrophobicContact CZ2-CB 3.99Å; W606-Q655 HydrophobicContact CZ2-CG 4.35Å; W606-W658 HydrophobicContact CH2-CE3 4.39Å; W606-W658 HydrophobicContact CH2-CZ3 4.28Å; W606-W658 HydrophobicContact CZ3-CZ3 4.01Å; W606-I660 HydrophobicContact CH2-CG2 4Å; W606-I660 HydrophobicContact CZ2-CG2 3.37Å; W606-L661 HydrophobicContact CD2-CD2 4.15Å; W606-L661 HydrophobicContact CE3-CD1 4.35Å; W606-L661 HydrophobicContact CE3-CD2 3.9Å; W606-L661 HydrophobicContact CH2-CD1 4.19Å; W606-L661 HydrophobicContact CH2-CD2 4.24Å; W606-L661 HydrophobicContact CH2-CG 4.15Å; W606-L661 HydrophobicContact CZ2-CD2 4.5Å; W606-L661 HydrophobicContact CZ3-CD1 3.76Å; W606-L661 HydrophobicContact CZ3-CD2 3.95Å; W606-L661 HydrophobicContact CZ3-CG 4.07Å
607	G	74.1	Confident	78.2	Confident	1 Å²	1	22.2 Å²	22.2	1%	0.01	14%	0.136	C	C	.	.	H	α-helix	trans	-62	-47.7	175.3	0	0	0	0	0	114.2	I466 N605 V609 T611	I466-G607 WeakPolarHBondContact O-CA 3.3Å; I466-G607 PolarHBondContact O-N 2.73Å; N605-G607 PolarHBondContact O-N 2.97Å; N605-G607 VanDerWaalsContact O-N 3.14Å; N605-G607 WeakPolarHBondContact OD1-CA 3.29Å; N605-G607 PolarHBondContact OD1-N 3.01Å; N605-G607 VanDerWaalsContact OD1-N 3.08Å; G607-V609 VanDerWaalsContact C-N 3.32Å; G607-T611 VanDerWaalsContact O-CB 3.31Å; G607-T611 WeakPolarHBondContact O-CB 3.45Å; G607-T611 PolarHBondContact O-N 2.79Å; G607-T611 PolarHBondContact O-OG1 2.81Å
608	Q	78.1	Confident	78.9	Confident	13 Å²	13	21.7 Å²	21.7	6%	0.061	13%	0.129	C	C	.	.	H	α-helix	trans	-62.2	-42.1	174.7	-66	160	-39.8	0	0	110.9	L598 F599 P603 N605 T611 L612	L598-Q608 PolarHBondContact O-NE2 3.31Å; F599-Q608 HydrophobicContact CD1-CB 3.9Å; F599-Q608 HydrophobicContact CD1-CG 4.29Å; F599-Q608 HydrophobicContact CE1-CB 3.41Å; F599-Q608 VanDerWaalsContact CE1-CB 3.41Å; F599-Q608 HydrophobicContact CE1-CG 4.29Å; F599-Q608 HydrophobicContact CZ-CB 4Å; P603-Q608 PolarHBondContact O-OE1 3.1Å; N605-Q608 PolarHBondContact ND2-OE1 2.95Å; N605-Q608 PolarHBondContact O-N 2.59Å; N605-Q608 VanDerWaalsContact O-N 3.14Å; N605-Q608 PolarHBondContact OD1-N 2.9Å; N605-Q608 VanDerWaalsContact OD1-N 3.11Å; Q608-T611 PolarHBondContact O-N 3.38Å; Q608-L612 WeakPolarHBondContact O-CB 3.43Å; Q608-L612 PolarHBondContact O-N 2.66Å
609	V	84.2	Confident	79.7	Confident	0 Å²	0	21 Å²	21	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-61.3	-50.1	178.6	175.5	0	0	0	0	111.6	T604 N605 W606 G607 T611 L612 F613 I648 W651 I652	T604-V609 HydrophobicContact CG2-CG2 4.2Å; N605-V609 PolarHBondContact O-N 3.35Å; W606-V609 HydrophobicContact CE3-CB 4.4Å; W606-V609 HydrophobicContact CE3-CG1 4.27Å; W606-V609 HydrophobicContact CZ3-CG1 4.25Å; W606-V609 PolarHBondContact O-N 3.24Å; G607-V609 VanDerWaalsContact C-N 3.32Å; V609-T611 VanDerWaalsContact C-N 3.33Å; V609-T611 PolarHBondContact O-N 3.22Å; V609-L612 WeakPolarHBondContact O-CB 3.49Å; V609-L612 PolarHBondContact O-N 2.98Å; V609-F613 HydrophobicContact CG1-CE1 3.96Å; V609-F613 HydrophobicContact CG1-CE2 3.67Å; V609-F613 HydrophobicContact CG1-CZ 3.32Å; V609-F613 WeakPolarHBondContact O-CD1 3.25Å; V609-F613 WeakPolarHBondContact O-CG 3.19Å; V609-F613 PolarHBondContact O-N 3.47Å; V609-I648 HydrophobicContact CG1-CG2 4.49Å; V609-I648 HydrophobicContact CG2-CD1 4.45Å; V609-I648 HydrophobicContact CG2-CG2 4.23Å; V609-W651 HydrophobicContact CG2-CE3 4.18Å; V609-W651 HydrophobicContact CG2-CZ3 3.92Å; V609-I652 HydrophobicContact CG1-CD1 4.28Å
610	I	82.1	Confident	80.3	Confident	1 Å²	1	19.3 Å²	19.3	1%	0.005	12%	0.118	C	C	.	.	H	α-helix	trans	-67.7	-36.1	179	-57.9	173	0	0	0	110.9	L468 L559 I562 I566 W606 L612 F613 Y614	L468-I610 HydrophobicContact CD1-CD1 3.62Å; L559-I610 HydrophobicContact CD2-CB 4.45Å; L559-I610 HydrophobicContact CD2-CD1 3.9Å; L559-I610 HydrophobicContact CD2-CG1 3.64Å; L559-I610 HydrophobicContact CD2-CG2 4.08Å; I562-I610 HydrophobicContact CG2-CD1 4.23Å; I566-I610 HydrophobicContact CD1-CB 4.03Å; I566-I610 HydrophobicContact CD1-CG2 3.36Å; W606-I610 VanDerWaalsContact O-CG1 3.28Å; W606-I610 WeakPolarHBondContact O-CG1 3.33Å; W606-I610 PolarHBondContact O-N 2.78Å; I610-L612 VanDerWaalsContact C-N 3.33Å; I610-L612 PolarHBondContact O-N 3.41Å; I610-F613 PolarHBondContact O-N 2.96Å; I610-Y614 PolarHBondContact O-N 2.88Å
611	T	78.4	Confident	81.2	Confident	1 Å²	1	16 Å²	16	1%	0.006	9%	0.09	C	C	.	.	H	α-helix	trans	-61.8	-40.5	175	-56.9	0	0	0	0	111.7	I464 L574 L598 G607 Q608 V609 Y614 F615	I464-T611 HydrophobicContact CD1-CG2 4.04Å; I464-T611 HydrophobicContact CG2-CG2 4.4Å; L574-T611 HydrophobicContact CD1-CG2 4.44Å; L574-T611 HydrophobicContact CD2-CG2 3.91Å; L598-T611 HydrophobicContact CD1-CG2 4.18Å; L598-T611 HydrophobicContact CD2-CG2 3.69Å; G607-T611 VanDerWaalsContact O-CB 3.31Å; G607-T611 WeakPolarHBondContact O-CB 3.45Å; G607-T611 PolarHBondContact O-N 2.79Å; G607-T611 PolarHBondContact O-OG1 2.81Å; Q608-T611 PolarHBondContact O-N 3.38Å; V609-T611 VanDerWaalsContact C-N 3.33Å; V609-T611 PolarHBondContact O-N 3.22Å; T611-Y614 PolarHBondContact O-N 2.89Å; T611-F615 WeakPolarHBondContact O-CB 3.08Å; T611-F615 PolarHBondContact O-N 3.13Å
612	L	86.2	Confident	82.2	Confident	0 Å²	0	13.5 Å²	13.5	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-61.9	-41.2	175.2	-178.7	69.8	0	0	0	111.9	F591 L598 F599 Q608 V609 I610 F615 G616 L639 F642	F591-L612 HydrophobicContact CD1-CD1 3.86Å; F591-L612 HydrophobicContact CE1-CD1 4.48Å; L598-L612 HydrophobicContact CD1-CB 4.13Å; L598-L612 HydrophobicContact CD1-CD1 4.37Å; F599-L612 HydrophobicContact CE2-CD2 4.22Å; F599-L612 HydrophobicContact CZ-CD2 4.35Å; Q608-L612 WeakPolarHBondContact O-CB 3.43Å; Q608-L612 PolarHBondContact O-N 2.66Å; V609-L612 WeakPolarHBondContact O-CB 3.49Å; V609-L612 PolarHBondContact O-N 2.98Å; I610-L612 VanDerWaalsContact C-N 3.33Å; I610-L612 PolarHBondContact O-N 3.41Å; L612-F615 WeakPolarHBondContact O-CB 3.44Å; L612-F615 PolarHBondContact O-N 3.04Å; L612-G616 PolarHBondContact O-N 2.92Å; L612-L639 HydrophobicContact CD2-CD1 4.06Å; L612-L639 HydrophobicContact CG-CD1 4Å; L612-F642 HydrophobicContact CD1-CE1 4.32Å; L612-F642 HydrophobicContact CD2-CD1 4.05Å; L612-F642 HydrophobicContact CD2-CE1 3.96Å
613	F	88.5	Confident	83.2	Confident	1 Å²	1	12.9 Å²	12.9	0%	0.004	7%	0.071	C	C	.	.	H	α-helix	trans	-69.8	-40.5	178.4	-58.5	-9.8	0	0	0	111.4	F490 F493 L559 V609 I610 F615 G616 Y617 L639 W658	F490-F613 HydrophobicContact CD1-CD2 4.36Å; F490-F613 HydrophobicContact CD1-CE2 4.13Å; F490-F613 HydrophobicContact CD1-CZ 4.23Å; F490-F613 HydrophobicContact CE1-CD1 4.28Å; F490-F613 HydrophobicContact CE1-CD2 4.05Å; F490-F613 AromaticContact CE1-CE1 3.69Å; F490-F613 HydrophobicContact CE1-CE1 3.69Å; F490-F613 AromaticContact CE1-CE2 3.41Å; F490-F613 HydrophobicContact CE1-CE2 3.41Å; F490-F613 VanDerWaalsContact CE1-CE2 3.41Å; F490-F613 HydrophobicContact CE1-CG 4.47Å; F490-F613 AromaticContact CE1-CZ 3.22Å; F490-F613 HydrophobicContact CE1-CZ 3.22Å; F490-F613 HydrophobicContact CE2-CE1 4.29Å; F490-F613 HydrophobicContact CE2-CZ 4.5Å; F490-F613 HydrophobicContact CZ-CD1 4.36Å; F490-F613 AromaticContact CZ-CE1 3.54Å; F490-F613 HydrophobicContact CZ-CE1 3.54Å; F490-F613 HydrophobicContact CZ-CE2 4.08Å; F490-F613 AromaticContact CZ-CZ 3.39Å; F490-F613 HydrophobicContact CZ-CZ 3.39Å; F493-F613 HydrophobicContact CD1-CB 4.39Å; F493-F613 HydrophobicContact CE1-CB 3.91Å; F493-F613 WeakPolarHBondContact CE1-O 3.31Å; F493-F613 HydrophobicContact CZ-CB 4.36Å; L559-F613 HydrophobicContact CD1-CD2 4.4Å; V609-F613 HydrophobicContact CG1-CE1 3.96Å; V609-F613 HydrophobicContact CG1-CE2 3.67Å; V609-F613 HydrophobicContact CG1-CZ 3.32Å; V609-F613 WeakPolarHBondContact O-CD1 3.25Å; V609-F613 WeakPolarHBondContact O-CG 3.19Å; V609-F613 PolarHBondContact O-N 3.47Å; I610-F613 PolarHBondContact O-N 2.96Å; F613-F615 VanDerWaalsContact C-N 3.34Å; F613-F615 PolarHBondContact O-N 3.44Å; F613-G616 WeakPolarHBondContact O-CA 3.36Å; F613-G616 PolarHBondContact O-N 3.17Å; F613-G616 VanDerWaalsContact O-N 3.15Å; F613-Y617 PolarHBondContact O-N 3.3Å; F613-L639 HydrophobicContact CD1-CD1 4.1Å; F613-L639 HydrophobicContact CD1-CD2 3.86Å; F613-L639 HydrophobicContact CD1-CG 4.4Å; F613-L639 HydrophobicContact CE1-CD1 4.37Å; F613-L639 HydrophobicContact CE1-CD2 4.5Å; F613-L639 HydrophobicContact CG-CD2 4.49Å; F613-W658 AromaticContact CE2-CH2 3.57Å; F613-W658 HydrophobicContact CE2-CH2 3.57Å; F613-W658 AromaticContact CE2-CZ3 3.95Å; F613-W658 HydrophobicContact CE2-CZ3 3.95Å; F613-W658 AromaticContact CZ-CH2 3.69Å; F613-W658 HydrophobicContact CZ-CH2 3.69Å; F613-W658 HydrophobicContact CZ-CZ3 4.46Å
614	Y	84.1	Confident	83.8	Confident	0 Å²	0	9.6 Å²	9.6	0%	0	5%	0.049	C	C	.	.	H	α-helix	trans	-63.7	-40.3	175.3	-160.2	-88.9	0	0	0	111.9	F493 R497 G563 N567 L574 I610 T611 G616 Y617 R618	F493-Y614 HydrophobicContact CZ-CD2 4.39Å; R497-Y614 PolarHBondContact NE-OH 3.49Å; R497-Y614 PolarHBondContact NH2-OH 2.93Å; G563-Y614 WeakPolarHBondContact O-CE2 3.47Å; N567-Y614 HydrophobicContact CB-CE1 4.1Å; N567-Y614 HydrophobicContact CB-CE2 4.12Å; N567-Y614 VanDerWaalsContact CB-OH 3.26Å; N567-Y614 WeakPolarHBondContact CB-OH 3.4Å; N567-Y614 WeakPolarHBondContact OD1-CE1 3.35Å; N567-Y614 PolarHBondContact OD1-OH 3.23Å; L574-Y614 HydrophobicContact CD1-CD1 3.62Å; L574-Y614 HydrophobicContact CD1-CE1 4.37Å; L574-Y614 HydrophobicContact CD1-CG 4.45Å; I610-Y614 PolarHBondContact O-N 2.88Å; T611-Y614 PolarHBondContact O-N 2.89Å; Y614-G616 VanDerWaalsContact C-N 3.34Å; Y614-G616 PolarHBondContact O-N 3.41Å; Y614-Y617 HydrophobicContact CE2-CD1 4.3Å; Y614-Y617 PolarHBondContact O-N 2.95Å; Y614-R618 HydrophobicContact CD1-CG 3.76Å; Y614-R618 HydrophobicContact CE1-CG 3.38Å; Y614-R618 WeakPolarHBondContact O-CG 3.37Å; Y614-R618 PolarHBondContact O-N 3.33Å
615	F	84.6	Confident	84.2	Confident	0 Å²	0	15.6 Å²	15.6	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-56.9	-46.8	169.9	167.9	-97.5	0	0	0	111.5	I578 L581 M590 F591 V594 T611 L612 F613 Y617 R618 L619	I578-F615 HydrophobicContact CD1-CD2 3.72Å; I578-F615 HydrophobicContact CD1-CE2 4.04Å; I578-F615 HydrophobicContact CG1-CD2 3.55Å; I578-F615 HydrophobicContact CG1-CE2 3.39Å; L581-F615 HydrophobicContact CD1-CE2 3.69Å; L581-F615 HydrophobicContact CD1-CZ 3.59Å; M590-F615 HydrophobicContact CB-CZ 4.28Å; F591-F615 AromaticContact CD1-CD1 3.67Å; F591-F615 HydrophobicContact CD1-CD1 3.67Å; F591-F615 AromaticContact CD1-CE1 3.64Å; F591-F615 HydrophobicContact CD1-CE1 3.64Å; F591-F615 AromaticContact CE1-CD1 3.65Å; F591-F615 HydrophobicContact CE1-CD1 3.65Å; F591-F615 AromaticContact CE1-CE1 3.87Å; F591-F615 HydrophobicContact CE1-CE1 3.87Å; F591-F615 HydrophobicContact CG-CE1 4.39Å; V594-F615 HydrophobicContact CB-CD1 4.31Å; V594-F615 HydrophobicContact CB-CD2 4.46Å; V594-F615 HydrophobicContact CB-CE1 4.12Å; V594-F615 HydrophobicContact CB-CE2 4.27Å; V594-F615 HydrophobicContact CB-CG 4.49Å; V594-F615 HydrophobicContact CB-CZ 4.11Å; V594-F615 HydrophobicContact CG1-CD1 4.18Å; V594-F615 HydrophobicContact CG1-CD2 4.13Å; V594-F615 HydrophobicContact CG1-CE1 4.48Å; V594-F615 HydrophobicContact CG1-CE2 4.43Å; V594-F615 HydrophobicContact CG1-CG 4.01Å; V594-F615 HydrophobicContact CG2-CD2 3.99Å; V594-F615 HydrophobicContact CG2-CE1 4.07Å; V594-F615 HydrophobicContact CG2-CE2 3.48Å; V594-F615 VanDerWaalsContact CG2-CE2 3.48Å; V594-F615 HydrophobicContact CG2-CG 4.49Å; V594-F615 HydrophobicContact CG2-CZ 3.53Å; T611-F615 WeakPolarHBondContact O-CB 3.08Å; T611-F615 PolarHBondContact O-N 3.13Å; L612-F615 WeakPolarHBondContact O-CB 3.44Å; L612-F615 PolarHBondContact O-N 3.04Å; F613-F615 VanDerWaalsContact C-N 3.34Å; F613-F615 PolarHBondContact O-N 3.44Å; F615-Y617 PolarHBondContact O-N 3.38Å; F615-R618 PolarHBondContact O-N 2.99Å; F615-L619 HydrophobicContact CE1-CD2 4.49Å; F615-L619 WeakPolarHBondContact O-CB 3.08Å; F615-L619 PolarHBondContact O-N 3.48Å
616	G	89.9	Confident	84.7	Confident	0 Å²	0	20.2 Å²	20.2	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-57.6	-45.6	174.7	0	0	0	0	0	113.2	L612 F613 Y614 R618 L619 V620 V635	L612-G616 PolarHBondContact O-N 2.92Å; F613-G616 WeakPolarHBondContact O-CA 3.36Å; F613-G616 PolarHBondContact O-N 3.17Å; F613-G616 VanDerWaalsContact O-N 3.15Å; Y614-G616 VanDerWaalsContact C-N 3.34Å; Y614-G616 PolarHBondContact O-N 3.41Å; G616-R618 PolarHBondContact O-N 3.29Å; G616-L619 WeakPolarHBondContact O-CB 3.11Å; G616-L619 PolarHBondContact O-N 3.4Å; G616-V620 PolarHBondContact O-N 2.96Å; G616-V635 WeakPolarHBondContact O-CG1 3.13Å
617	Y	90.3	Very high	85	Confident	1 Å²	1	23.2 Å²	23.2	0%	0.004	12%	0.123	C	C	.	.	H	α-helix	trans	-59.6	-46.4	174.5	167.9	-100.9	0	0	0	112.5	R497 E501 F613 Y614 F615 L619 V620 V621	R497-Y617 HydrophobicContact CB-CD2 3.97Å; R497-Y617 HydrophobicContact CB-CE2 3.97Å; R497-Y617 HydrophobicContact CB-CG 4.31Å; R497-Y617 HydrophobicContact CG-CD1 3.5Å; R497-Y617 VanDerWaalsContact CG-CD1 3.5Å; R497-Y617 HydrophobicContact CG-CD2 3.67Å; R497-Y617 HydrophobicContact CG-CE1 3.44Å; R497-Y617 VanDerWaalsContact CG-CE1 3.44Å; R497-Y617 HydrophobicContact CG-CE2 3.61Å; R497-Y617 HydrophobicContact CG-CG 3.62Å; E501-Y617 WeakPolarHBondContact CB-OH 3.46Å; E501-Y617 WeakPolarHBondContact OE2-CE1 3.32Å; E501-Y617 VanDerWaalsContact OE2-CZ 3.31Å; E501-Y617 PolarHBondContact OE2-OH 2.92Å; F613-Y617 PolarHBondContact O-N 3.3Å; Y614-Y617 HydrophobicContact CE2-CD1 4.3Å; Y614-Y617 PolarHBondContact O-N 2.95Å; F615-Y617 PolarHBondContact O-N 3.38Å; Y617-L619 VanDerWaalsContact C-N 3.31Å; Y617-L619 PolarHBondContact O-N 2.87Å; Y617-V620 WeakPolarHBondContact O-CB 3.22Å; Y617-V620 PolarHBondContact O-N 2.93Å; Y617-V620 VanDerWaalsContact O-N 3.13Å; Y617-V621 HydrophobicContact CD1-CG2 4.48Å; Y617-V621 HydrophobicContact CE1-CG2 3.8Å; Y617-V621 HydrophobicContact CE2-CG2 3.83Å; Y617-V621 VanDerWaalsContact CZ-CG2 3.41Å; Y617-V621 PolarHBondContact O-N 3.15Å; Y617-V621 WeakPolarHBondContact OH-CG2 3.35Å
618	R	85.7	Confident	85.5	Confident	28 Å²	28	25 Å²	25	11%	0.106	13%	0.133	C	C	.	.	H	α-helix	trans	-66.9	-31.8	178.9	-65.1	-60.3	-75.7	177.1	-7.9	112.4	E501 D575 I578 Y614 F615 G616 V621 Q622	E501-R618 VanDerWaalsContact CD-NH1 3.28Å; E501-R618 IonicContact OE1-CZ 2.83Å; E501-R618 IonicContact OE1-NH1 3.37Å; E501-R618 PolarHBondContact OE1-NH1 3.36Å; E501-R618 IonicContact OE2-NH1 3.46Å; E501-R618 PolarHBondContact OE2-NH1 3.46Å; D575-R618 VanDerWaalsContact CG-NH2 3.26Å; D575-R618 IonicContact OD1-CZ 3.94Å; D575-R618 VanDerWaalsContact OD1-CZ 3.32Å; D575-R618 IonicContact OD1-NE 2.76Å; D575-R618 PolarHBondContact OD1-NE 3.22Å; D575-R618 IonicContact OD1-NH2 3.45Å; D575-R618 PolarHBondContact OD1-NH2 2.87Å; D575-R618 IonicContact OD2-CZ 2.8Å; D575-R618 IonicContact OD2-NH2 2.68Å; D575-R618 PolarHBondContact OD2-NH2 3.45Å; I578-R618 HydrophobicContact CD1-CB 3.22Å; I578-R618 HydrophobicContact CD1-CG 4.24Å; Y614-R618 HydrophobicContact CD1-CG 3.76Å; Y614-R618 HydrophobicContact CE1-CG 3.38Å; Y614-R618 WeakPolarHBondContact O-CG 3.37Å; Y614-R618 PolarHBondContact O-N 3.33Å; F615-R618 PolarHBondContact O-N 2.99Å; G616-R618 PolarHBondContact O-N 3.29Å; R618-V621 PolarHBondContact O-N 3.23Å; R618-Q622 PolarHBondContact O-N 3.06Å
619	L	87.9	Confident	85.9	Confident	1 Å²	1	27.5 Å²	27.5	1%	0.005	16%	0.156	C	C	.	.	H	α-helix	trans	-63.8	-39.7	170.4	179.5	60	0	0	0	111.9	P587 M590 F615 G616 Y617 Q622 R623 V635	P587-L619 HydrophobicContact CB-CD2 4.03Å; M590-L619 HydrophobicContact CB-CD2 4.34Å; M590-L619 HydrophobicContact CE-CD1 3.89Å; M590-L619 HydrophobicContact CE-CD2 4.38Å; M590-L619 HydrophobicContact SD-CD1 3.61Å; M590-L619 HydrophobicContact SD-CD2 4.27Å; F615-L619 HydrophobicContact CE1-CD2 4.49Å; F615-L619 WeakPolarHBondContact O-CB 3.08Å; F615-L619 PolarHBondContact O-N 3.48Å; G616-L619 WeakPolarHBondContact O-CB 3.11Å; G616-L619 PolarHBondContact O-N 3.4Å; Y617-L619 VanDerWaalsContact C-N 3.31Å; Y617-L619 PolarHBondContact O-N 2.87Å; L619-Q622 PolarHBondContact O-N 3.18Å; L619-R623 HydrophobicContact CD1-CG 4.42Å; L619-R623 WeakPolarHBondContact O-CB 3.48Å; L619-R623 WeakPolarHBondContact O-CG 3.35Å; L619-R623 PolarHBondContact O-N 3.46Å; L619-V635 HydrophobicContact CD2-CG1 4.28Å; L619-V635 HydrophobicContact CD2-CG2 4.26Å; L619-V635 HydrophobicContact CG-CG2 4.17Å
620	V	89.6	Confident	86.1	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-59.3	-51	170.8	175	0	0	0	0	110.7	M494 G616 Y617 Q622 R623 V624 A631 F632 V635	M494-V620 HydrophobicContact SD-CG2 3.92Å; G616-V620 PolarHBondContact O-N 2.96Å; Y617-V620 WeakPolarHBondContact O-CB 3.22Å; Y617-V620 PolarHBondContact O-N 2.93Å; Y617-V620 VanDerWaalsContact O-N 3.13Å; V620-Q622 VanDerWaalsContact C-N 3.27Å; V620-Q622 PolarHBondContact O-N 3.1Å; V620-R623 PolarHBondContact O-N 3.41Å; V620-R623 VanDerWaalsContact O-N 3.11Å; V620-V624 HydrophobicContact CG1-CG2 4.02Å; V620-V624 WeakPolarHBondContact O-CB 3.21Å; V620-V624 VanDerWaalsContact O-CG2 3.32Å; V620-V624 WeakPolarHBondContact O-CG2 3.45Å; V620-V624 PolarHBondContact O-N 3.2Å; V620-A631 HydrophobicContact CG1-CB 4.48Å; V620-F632 HydrophobicContact CG1-CB 4.39Å; V620-F632 HydrophobicContact CG1-CD1 3.73Å; V620-F632 HydrophobicContact CG1-CD2 3.41Å; V620-F632 VanDerWaalsContact CG1-CD2 3.41Å; V620-F632 HydrophobicContact CG1-CE1 3.72Å; V620-F632 HydrophobicContact CG1-CE2 3.38Å; V620-F632 HydrophobicContact CG1-CG 3.58Å; V620-F632 HydrophobicContact CG1-CZ 3.54Å; V620-V635 HydrophobicContact CG2-CB 3.52Å; V620-V635 HydrophobicContact CG2-CG1 3.78Å; V620-V635 HydrophobicContact CG2-CG2 3.78Å
621	V	87.2	Confident	86.5	Confident	14 Å²	14	31.4 Å²	31.4	9%	0.085	18%	0.177	C	C	.	.	H	α-helix	trans	-57	-41.2	179.4	174.3	0	0	0	0	111.5	Y617 R618 K625	Y617-V621 HydrophobicContact CD1-CG2 4.48Å; Y617-V621 HydrophobicContact CE1-CG2 3.8Å; Y617-V621 HydrophobicContact CE2-CG2 3.83Å; Y617-V621 VanDerWaalsContact CZ-CG2 3.41Å; Y617-V621 PolarHBondContact O-N 3.15Å; Y617-V621 WeakPolarHBondContact OH-CG2 3.35Å; R618-V621 PolarHBondContact O-N 3.23Å; V621-K625 HydrophobicContact CG1-CD 4.08Å; V621-K625 WeakPolarHBondContact O-CB 3.37Å; V621-K625 VanDerWaalsContact O-CG 3.26Å; V621-K625 WeakPolarHBondContact O-CG 3.37Å; V621-K625 PolarHBondContact O-N 3.04Å
622	Q	84.2	Confident	87.2	Confident	35 Å²	35	31.3 Å²	31.3	16%	0.164	18%	0.177	C	C	.	.	H	α-helix	trans	-65.4	-42.7	176.7	-168.7	-168.6	39.5	0	0	112.4	I578 V583 R618 L619 V620 K625 K626	I578-Q622 HydrophobicContact CG2-CB 4.17Å; I578-Q622 HydrophobicContact CG2-CG 4.21Å; I578-Q622 VanDerWaalsContact CG2-OE1 3.28Å; I578-Q622 PolarHBondContact O-NE2 3.06Å; V583-Q622 HydrophobicContact CG1-CG 4.27Å; V583-Q622 HydrophobicContact CG2-CG 4.02Å; V583-Q622 VanDerWaalsContact CG2-NE2 3.31Å; R618-Q622 PolarHBondContact O-N 3.06Å; L619-Q622 PolarHBondContact O-N 3.18Å; V620-Q622 VanDerWaalsContact C-N 3.27Å; V620-Q622 PolarHBondContact O-N 3.1Å; Q622-K625 PolarHBondContact O-N 3.05Å; Q622-K626 PolarHBondContact O-N 3.25Å
623	R	87.8	Confident	87.4	Confident	14 Å²	14	35.5 Å²	35.5	5%	0.053	19%	0.193	C	C	.	.	H	α-helix	trans	-66.5	-43.7	177.7	-79.8	-174	169.3	-119.5	-19.4	112.8	V583 E585 M590 L619 V620 K625 K626 G627 V628 A631	V583-R623 HydrophobicContact CG1-CG 3.85Å; V583-R623 PolarHBondContact O-NH2 3.45Å; E585-R623 PolarHBondContact O-NH2 3.24Å; M590-R623 VanDerWaalsContact CE-NH2 3.31Å; L619-R623 HydrophobicContact CD1-CG 4.42Å; L619-R623 WeakPolarHBondContact O-CB 3.48Å; L619-R623 WeakPolarHBondContact O-CG 3.35Å; L619-R623 PolarHBondContact O-N 3.46Å; V620-R623 PolarHBondContact O-N 3.41Å; V620-R623 VanDerWaalsContact O-N 3.11Å; R623-K625 VanDerWaalsContact C-N 3.34Å; R623-K625 PolarHBondContact O-N 3.4Å; R623-K626 CarbonylContact O-C 3.52Å; R623-K626 PolarHBondContact O-N 3.33Å; R623-K626 VanDerWaalsContact O-N 3.07Å; R623-G627 PolarHBondContact O-N 3.42Å; R623-V628 HydrophobicContact CB-CB 4.01Å; R623-V628 HydrophobicContact CB-CG1 4.49Å; R623-V628 HydrophobicContact CB-CG2 4.16Å; R623-V628 HydrophobicContact CG-CG2 4.35Å; R623-V628 WeakPolarHBondContact O-CB 3.47Å; R623-V628 WeakPolarHBondContact O-CG2 3.44Å; R623-V628 PolarHBondContact O-N 2.99Å; R623-A631 HydrophobicContact CB-CB 3.66Å
624	V	87.8	Confident	87.6	Confident	28 Å²	28	38.1 Å²	38.1	17%	0.17	21%	0.205	C	C	.	.	H	α-helix	trans	-59.1	-45	174	170.4	0	0	0	0	110.6	V536 V620 K626 G627 A631 F632	V536-V624 HydrophobicContact CG1-CG1 4.43Å; V536-V624 HydrophobicContact CG2-CG1 3.47Å; V536-V624 VanDerWaalsContact CG2-CG1 3.47Å; V620-V624 HydrophobicContact CG1-CG2 4.02Å; V620-V624 WeakPolarHBondContact O-CB 3.21Å; V620-V624 VanDerWaalsContact O-CG2 3.32Å; V620-V624 WeakPolarHBondContact O-CG2 3.45Å; V620-V624 PolarHBondContact O-N 3.2Å; V624-K626 PolarHBondContact O-N 3.02Å; V624-G627 PolarHBondContact O-N 2.91Å; V624-A631 HydrophobicContact CG2-CB 3.92Å; V624-F632 HydrophobicContact CG2-CD2 4.19Å; V624-F632 HydrophobicContact CG2-CE2 3.92Å
625	K	85.3	Confident	88	Confident	157 Å²	157	38.1 Å²	38.1	68%	0.683	21%	0.205	S	C	*	.	H	α-helix	trans	-62.2	-23.4	175.2	-75.7	173.2	-179.2	176.9	0	114	V621 Q622 R623	V621-K625 HydrophobicContact CG1-CD 4.08Å; V621-K625 WeakPolarHBondContact O-CB 3.37Å; V621-K625 VanDerWaalsContact O-CG 3.26Å; V621-K625 WeakPolarHBondContact O-CG 3.37Å; V621-K625 PolarHBondContact O-N 3.04Å; Q622-K625 PolarHBondContact O-N 3.05Å; R623-K625 VanDerWaalsContact C-N 3.34Å; R623-K625 PolarHBondContact O-N 3.4Å
626	K	85.1	Confident	88.4	Confident	127 Å²	127	38.1 Å²	38.1	55%	0.552	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.7	5.3	172.1	-70.8	-160.1	178.2	-171.5	0	114.1	V583 Q622 R623 V624 V628	V583-K626 HydrophobicContact CB-CD 3.93Å; V583-K626 HydrophobicContact CG1-CD 3.92Å; V583-K626 HydrophobicContact CG2-CD 4.13Å; V583-K626 VanDerWaalsContact CG2-NZ 3.33Å; Q622-K626 PolarHBondContact O-N 3.25Å; R623-K626 CarbonylContact O-C 3.52Å; R623-K626 PolarHBondContact O-N 3.33Å; R623-K626 VanDerWaalsContact O-N 3.07Å; V624-K626 PolarHBondContact O-N 3.02Å; K626-V628 VanDerWaalsContact C-N 3.34Å; K626-V628 HydrophobicContact CB-CG2 4.42Å
627	G	84.3	Confident	88.6	Confident	65 Å²	65	42.8 Å²	42.8	67%	0.67	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	75.1	17.4	179.8	0	0	0	0	0	114.8	R623 V624 A629	R623-G627 PolarHBondContact O-N 3.42Å; V624-G627 PolarHBondContact O-N 2.91Å; G627-A629 PolarHBondContact O-N 3.28Å
628	V	85.1	Confident	88.7	Confident	39 Å²	39	43.3 Å²	43.3	24%	0.236	23%	0.227	C	C	.	.			trans	-68.9	119.2	176.2	-179.7	0	0	0	0	109.5	Q539 R623 K626 A631	Q539-V628 PolarHBondContact NE2-O 2.85Å; R623-V628 HydrophobicContact CB-CB 4.01Å; R623-V628 HydrophobicContact CB-CG1 4.49Å; R623-V628 HydrophobicContact CB-CG2 4.16Å; R623-V628 HydrophobicContact CG-CG2 4.35Å; R623-V628 WeakPolarHBondContact O-CB 3.47Å; R623-V628 WeakPolarHBondContact O-CG2 3.44Å; R623-V628 PolarHBondContact O-N 2.99Å; K626-V628 VanDerWaalsContact C-N 3.34Å; K626-V628 HydrophobicContact CB-CG2 4.42Å; V628-A631 HydrophobicContact CB-CB 4.45Å; V628-A631 HydrophobicContact CG1-CB 4.38Å
629	A	86.5	Confident	89.1	Confident	65 Å²	65	42 Å²	42	54%	0.537	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.7	146.1	175.5	0	0	0	0	0	111.7	G627 A631 Q634	G627-A629 PolarHBondContact O-N 3.28Å; A629-A631 PolarHBondContact O-N 3.31Å; A629-A631 VanDerWaalsContact O-N 3.15Å; A629-Q634 PolarHBondContact O-NE2 3.15Å
630	N	87.6	Confident	89.3	Confident	83 Å²	83	42.3 Å²	42.3	44%	0.444	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.7	30.5	-179.9	-59.3	-17.3	0	0	0	114.4	Q539 F632 Y633 Q634	Q539-N630 VanDerWaalsContact OE1-N 3.16Å; N630-F632 VanDerWaalsContact C-N 3.29Å; N630-F632 PolarHBondContact O-N 3.38Å; N630-Y633 PolarHBondContact O-N 3.3Å; N630-Q634 WeakPolarHBondContact O-CG 3.48Å; N630-Q634 PolarHBondContact O-N 3.13Å
631	A	90.5	Very high	89.5	Confident	0 Å²	0	44 Å²	44	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-56.9	-41.3	-178.8	0	0	0	0	0	112.3	V620 R623 V624 V628 A629 V635	V620-A631 HydrophobicContact CG1-CB 4.48Å; R623-A631 HydrophobicContact CB-CB 3.66Å; V624-A631 HydrophobicContact CG2-CB 3.92Å; V628-A631 HydrophobicContact CB-CB 4.45Å; V628-A631 HydrophobicContact CG1-CB 4.38Å; A629-A631 PolarHBondContact O-N 3.31Å; A629-A631 VanDerWaalsContact O-N 3.15Å; A631-V635 WeakPolarHBondContact O-CB 3.39Å; A631-V635 VanDerWaalsContact O-CG2 3.26Å; A631-V635 WeakPolarHBondContact O-CG2 3.01Å; A631-V635 PolarHBondContact O-N 3.37Å
632	F	92.4	Very high	89.6	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-55.6	-53.4	174.2	-85	-89.4	0	0	0	112.2	M494 Y498 V536 Q539 L540 L543 V620 V624 N630 C636	M494-F632 HydrophobicContact CB-CD1 4.02Å; M494-F632 HydrophobicContact CB-CE1 4Å; Y498-F632 HydrophobicContact CD1-CZ 4.5Å; Y498-F632 AromaticContact CD2-CZ 3.89Å; Y498-F632 HydrophobicContact CD2-CZ 3.89Å; Y498-F632 AromaticContact CG-CZ 3.84Å; Y498-F632 HydrophobicContact CG-CZ 3.84Å; V536-F632 HydrophobicContact CG1-CD2 4.18Å; V536-F632 HydrophobicContact CG1-CE2 3.45Å; V536-F632 VanDerWaalsContact CG1-CE2 3.45Å; V536-F632 HydrophobicContact CG1-CZ 4.24Å; Q539-F632 HydrophobicContact CB-CD2 4.06Å; L540-F632 HydrophobicContact CD2-CD1 3.89Å; L540-F632 HydrophobicContact CD2-CD2 4.21Å; L540-F632 HydrophobicContact CD2-CE1 3.49Å; L540-F632 VanDerWaalsContact CD2-CE1 3.49Å; L540-F632 HydrophobicContact CD2-CE2 3.85Å; L540-F632 HydrophobicContact CD2-CG 4.23Å; L540-F632 HydrophobicContact CD2-CZ 3.48Å; L540-F632 VanDerWaalsContact CD2-CZ 3.48Å; L543-F632 HydrophobicContact CD1-CB 3.81Å; L543-F632 HydrophobicContact CD1-CD1 3.77Å; L543-F632 HydrophobicContact CD1-CG 4.18Å; L543-F632 HydrophobicContact CG-CB 4.14Å; V620-F632 HydrophobicContact CG1-CB 4.39Å; V620-F632 HydrophobicContact CG1-CD1 3.73Å; V620-F632 HydrophobicContact CG1-CD2 3.41Å; V620-F632 VanDerWaalsContact CG1-CD2 3.41Å; V620-F632 HydrophobicContact CG1-CE1 3.72Å; V620-F632 HydrophobicContact CG1-CE2 3.38Å; V620-F632 HydrophobicContact CG1-CG 3.58Å; V620-F632 HydrophobicContact CG1-CZ 3.54Å; V624-F632 HydrophobicContact CG2-CD2 4.19Å; V624-F632 HydrophobicContact CG2-CE2 3.92Å; N630-F632 VanDerWaalsContact C-N 3.29Å; N630-F632 PolarHBondContact O-N 3.38Å; F632-C636 WeakPolarHBondContact O-CB 3.47Å; F632-C636 PolarHBondContact O-N 3.05Å
633	Y	91.8	Very high	90	Very high	87 Å²	87	41.7 Å²	41.7	34%	0.341	22%	0.224	S	C	.	.	H	α-helix	trans	-62.6	-48	179.6	177.7	-95.9	0	0	0	112.1	N630 V635 C636 R637	N630-Y633 PolarHBondContact O-N 3.3Å; Y633-V635 PolarHBondContact O-N 3.22Å; Y633-C636 PolarHBondContact O-N 2.73Å; Y633-R637 WeakPolarHBondContact O-CB 3.34Å; Y633-R637 PolarHBondContact O-N 3.25Å
634	Q	91.2	Very high	90.2	Very high	56 Å²	56	46.5 Å²	46.5	26%	0.262	24%	0.242	S	C	.	.	H	α-helix	trans	-56.7	-50.8	179.5	-71	175.9	23.8	0	0	111.9	A629 N630 C638	A629-Q634 PolarHBondContact O-NE2 3.15Å; N630-Q634 WeakPolarHBondContact O-CG 3.48Å; N630-Q634 PolarHBondContact O-N 3.13Å; Q634-C638 WeakPolarHBondContact O-CB 3.34Å; Q634-C638 PolarHBondContact O-N 3.34Å; Q634-C638 PolarHBondContact O-SG 2.98Å
635	V	92.8	Very high	90.3	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-71.4	-38	-176.3	179.4	0	0	0	0	111.1	M494 P587 F591 G616 L619 V620 A631 Y633 C638 L639	M494-V635 HydrophobicContact CE-CG1 4.37Å; P587-V635 HydrophobicContact CB-CG2 4.12Å; P587-V635 HydrophobicContact CG-CG2 4.15Å; F591-V635 HydrophobicContact CE2-CG1 3.86Å; F591-V635 HydrophobicContact CZ-CG1 3.6Å; G616-V635 WeakPolarHBondContact O-CG1 3.13Å; L619-V635 HydrophobicContact CD2-CG1 4.28Å; L619-V635 HydrophobicContact CD2-CG2 4.26Å; L619-V635 HydrophobicContact CG-CG2 4.17Å; V620-V635 HydrophobicContact CG2-CB 3.52Å; V620-V635 HydrophobicContact CG2-CG1 3.78Å; V620-V635 HydrophobicContact CG2-CG2 3.78Å; A631-V635 WeakPolarHBondContact O-CB 3.39Å; A631-V635 VanDerWaalsContact O-CG2 3.26Å; A631-V635 WeakPolarHBondContact O-CG2 3.01Å; A631-V635 PolarHBondContact O-N 3.37Å; Y633-V635 PolarHBondContact O-N 3.22Å; V635-C638 PolarHBondContact O-N 3.49Å; V635-L639 WeakPolarHBondContact O-CB 3.13Å; V635-L639 PolarHBondContact O-N 3.3Å
636	C	94.2	Very high	90.3	Very high	0 Å²	0	41 Å²	41	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-60.5	-50.7	174.8	-170.6	0	0	0	0	111.4	M494 L543 F632 Y633 C638 L639 V640	M494-C636 HydrophobicContact CE-CB 4.21Å; M494-C636 HydrophobicContact SD-CB 4.21Å; L543-C636 HydrophobicContact CD2-CB 3.9Å; F632-C636 WeakPolarHBondContact O-CB 3.47Å; F632-C636 PolarHBondContact O-N 3.05Å; Y633-C636 PolarHBondContact O-N 2.73Å; C636-C638 VanDerWaalsContact C-N 3.35Å; C636-C638 PolarHBondContact O-N 3.25Å; C636-L639 PolarHBondContact O-N 3.18Å; C636-V640 WeakPolarHBondContact O-CG2 3.22Å; C636-V640 PolarHBondContact O-N 3.48Å
637	R	92.8	Very high	90.5	Very high	98 Å²	98	38.2 Å²	38.2	37%	0.37	21%	0.208	S	C	.	.	H	α-helix	trans	-60.1	-42	176.7	179.6	175.5	164.5	145.9	1.5	112.2	E190 Y633 S641	E190-R637 IonicContact OE1-CZ 3.69Å; E190-R637 IonicContact OE1-NH2 3.54Å; E190-R637 PolarHBondContact OE1-NH2 2.98Å; E190-R637 IonicContact OE2-CZ 2.93Å; E190-R637 IonicContact OE2-NH2 2.93Å; E190-R637 PolarHBondContact OE2-NH2 3.02Å; Y633-R637 WeakPolarHBondContact O-CB 3.34Å; Y633-R637 PolarHBondContact O-N 3.25Å; R637-S641 WeakPolarHBondContact O-CB 3.4Å; R637-S641 PolarHBondContact O-N 3.42Å
638	C	92.5	Very high	90.8	Very high	12 Å²	12	35.2 Å²	35.2	8%	0.081	18%	0.177	C	C	.	.	H	α-helix	trans	-64.4	-41.5	176	-68.4	0	0	0	0	112.1	P587 L588 F591 Q634 V635 C636 S641 F642	P587-C638 HydrophobicContact CB-CB 3.85Å; L588-C638 HydrophobicContact CB-CB 4.21Å; F591-C638 HydrophobicContact CD2-CB 4.11Å; F591-C638 HydrophobicContact CE2-CB 4.02Å; Q634-C638 WeakPolarHBondContact O-CB 3.34Å; Q634-C638 PolarHBondContact O-N 3.34Å; Q634-C638 PolarHBondContact O-SG 2.98Å; V635-C638 PolarHBondContact O-N 3.49Å; C636-C638 VanDerWaalsContact C-N 3.35Å; C636-C638 PolarHBondContact O-N 3.25Å; C638-S641 PolarHBondContact O-N 3.09Å; C638-F642 VanDerWaalsContact O-CB 3.23Å; C638-F642 WeakPolarHBondContact O-CB 3.48Å; C638-F642 PolarHBondContact O-N 2.82Å
639	L	93.6	Very high	91.3	Very high	1 Å²	1	33.7 Å²	33.7	1%	0.005	17%	0.167	C	C	.	.	H	α-helix	trans	-64.5	-44.5	177.5	179.5	58.9	0	0	0	112	F490 M494 F591 L612 F613 V635 C636 F642 C643	F490-L639 HydrophobicContact CD2-CB 4.48Å; F490-L639 HydrophobicContact CD2-CD2 3.81Å; F490-L639 HydrophobicContact CD2-CG 3.85Å; F490-L639 HydrophobicContact CE2-CD2 4.19Å; F490-L639 HydrophobicContact CE2-CG 3.91Å; F490-L639 HydrophobicContact CG-CD2 4.13Å; M494-L639 HydrophobicContact CE-CD2 3.93Å; F591-L639 HydrophobicContact CD1-CD1 4.17Å; F591-L639 HydrophobicContact CE1-CB 4.37Å; F591-L639 HydrophobicContact CE1-CD1 3.77Å; F591-L639 HydrophobicContact CE2-CB 3.82Å; F591-L639 HydrophobicContact CZ-CB 3.7Å; F591-L639 HydrophobicContact CZ-CD1 4Å; F591-L639 HydrophobicContact CZ-CG 4.27Å; L612-L639 HydrophobicContact CD2-CD1 4.06Å; L612-L639 HydrophobicContact CG-CD1 4Å; F613-L639 HydrophobicContact CD1-CD1 4.1Å; F613-L639 HydrophobicContact CD1-CD2 3.86Å; F613-L639 HydrophobicContact CD1-CG 4.4Å; F613-L639 HydrophobicContact CE1-CD1 4.37Å; F613-L639 HydrophobicContact CE1-CD2 4.5Å; F613-L639 HydrophobicContact CG-CD2 4.49Å; V635-L639 WeakPolarHBondContact O-CB 3.13Å; V635-L639 PolarHBondContact O-N 3.3Å; C636-L639 PolarHBondContact O-N 3.18Å; L639-F642 PolarHBondContact O-N 3.23Å; L639-C643 WeakPolarHBondContact O-CB 3.4Å; L639-C643 PolarHBondContact O-N 2.75Å; L639-C643 PolarHBondContact O-SG 2.72Å; L639-C643 VanDerWaalsContact O-SG 3.39Å
640	V	93.7	Very high	91.5	Very high	7 Å²	7	32.8 Å²	32.8	4%	0.042	16%	0.155	C	C	.	.	H	α-helix	trans	-60.8	-47.1	175.4	174	0	0	0	0	110.8	E487 F490 C636 F642 C643 R644 F649	E487-V640 HydrophobicContact CB-CG2 3.9Å; E487-V640 HydrophobicContact CG-CG2 4.19Å; F490-V640 HydrophobicContact CD2-CG2 3.6Å; F490-V640 HydrophobicContact CE2-CG2 4.04Å; C636-V640 WeakPolarHBondContact O-CG2 3.22Å; C636-V640 PolarHBondContact O-N 3.48Å; V640-F642 PolarHBondContact O-N 3.07Å; V640-C643 PolarHBondContact O-N 3.35Å; V640-R644 PolarHBondContact O-N 2.93Å; V640-R644 VanDerWaalsContact O-N 3.08Å; V640-F649 HydrophobicContact CG1-CE2 4.38Å; V640-F649 HydrophobicContact CG1-CZ 4.22Å
641	S	92.3	Very high	91.6	Very high	37 Å²	37	30.7 Å²	30.7	26%	0.259	14%	0.141	S	C	.	.	H	α-helix	trans	-58.9	-47.3	177.2	-167.4	0	0	0	0	111.6	R637 C638 R644 Q645	R637-S641 WeakPolarHBondContact O-CB 3.4Å; R637-S641 PolarHBondContact O-N 3.42Å; C638-S641 PolarHBondContact O-N 3.09Å; S641-R644 PolarHBondContact O-N 3.19Å; S641-Q645 VanDerWaalsContact O-CG 3.25Å; S641-Q645 WeakPolarHBondContact O-CG 3.5Å; S641-Q645 PolarHBondContact O-N 2.97Å; S641-Q645 PolarHBondContact OG-NE2 3.35Å
642	F	90.8	Very high	91.6	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-60.2	-51.1	177.8	-178.4	-102.1	0	0	0	112.5	L588 F591 Y592 A595 L612 C638 L639 V640 R644 Q645 I646	L588-F642 HydrophobicContact CD1-CB 3.71Å; L588-F642 HydrophobicContact CD1-CD2 4.11Å; L588-F642 HydrophobicContact CD1-CG 4.37Å; F591-F642 HydrophobicContact CB-CB 4.35Å; F591-F642 HydrophobicContact CB-CD1 4.16Å; F591-F642 HydrophobicContact CB-CD2 4.14Å; F591-F642 HydrophobicContact CB-CG 3.91Å; Y592-F642 HydrophobicContact CD1-CD2 4.44Å; Y592-F642 AromaticContact CD1-CE2 3.76Å; Y592-F642 HydrophobicContact CD1-CE2 3.76Å; Y592-F642 AromaticContact CD2-CD2 3.79Å; Y592-F642 HydrophobicContact CD2-CD2 3.79Å; Y592-F642 AromaticContact CD2-CE2 3.9Å; Y592-F642 HydrophobicContact CD2-CE2 3.9Å; Y592-F642 HydrophobicContact CE1-CD2 4.39Å; Y592-F642 AromaticContact CE1-CE2 3.89Å; Y592-F642 HydrophobicContact CE1-CE2 3.89Å; Y592-F642 AromaticContact CE2-CD2 3.7Å; Y592-F642 HydrophobicContact CE2-CD2 3.7Å; Y592-F642 AromaticContact CE2-CE2 3.99Å; Y592-F642 HydrophobicContact CE2-CE2 3.99Å; Y592-F642 HydrophobicContact CG-CD2 4.14Å; Y592-F642 AromaticContact CG-CE2 3.76Å; Y592-F642 HydrophobicContact CG-CE2 3.76Å; Y592-F642 AromaticContact CZ-CE2 3.99Å; A595-F642 HydrophobicContact CB-CE1 3.57Å; A595-F642 HydrophobicContact CB-CE2 4.18Å; A595-F642 HydrophobicContact CB-CZ 3.18Å; L612-F642 HydrophobicContact CD1-CE1 4.32Å; L612-F642 HydrophobicContact CD2-CD1 4.05Å; L612-F642 HydrophobicContact CD2-CE1 3.96Å; C638-F642 VanDerWaalsContact O-CB 3.23Å; C638-F642 WeakPolarHBondContact O-CB 3.48Å; C638-F642 PolarHBondContact O-N 2.82Å; L639-F642 PolarHBondContact O-N 3.23Å; V640-F642 PolarHBondContact O-N 3.07Å; F642-R644 PolarHBondContact O-N 3.38Å; F642-Q645 PolarHBondContact O-N 3.5Å; F642-Q645 VanDerWaalsContact O-N 3.08Å; F642-I646 HydrophobicContact CD1-CD1 4.31Å; F642-I646 HydrophobicContact CD1-CG1 4.29Å; F642-I646 HydrophobicContact CE1-CD1 3.4Å; F642-I646 VanDerWaalsContact CE1-CD1 3.4Å; F642-I646 HydrophobicContact CE1-CG1 3.76Å; F642-I646 HydrophobicContact CE2-CG1 4.42Å; F642-I646 HydrophobicContact CE2-CG2 4.16Å; F642-I646 HydrophobicContact CZ-CD1 3.55Å; F642-I646 HydrophobicContact CZ-CG1 3.8Å; F642-I646 HydrophobicContact CZ-CG2 4.09Å; F642-I646 VanDerWaalsContact O-CG1 3.31Å; F642-I646 WeakPolarHBondContact O-CG1 3.36Å; F642-I646 PolarHBondContact O-N 2.92Å; F642-I646 VanDerWaalsContact O-N 3.09Å
643	C	92.3	Very high	91.5	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-61	-31.8	179.2	-74.4	0	0	0	0	112.9	L639 V640 N647 I648 F649	L639-C643 WeakPolarHBondContact O-CB 3.4Å; L639-C643 PolarHBondContact O-N 2.75Å; L639-C643 PolarHBondContact O-SG 2.72Å; L639-C643 VanDerWaalsContact O-SG 3.39Å; V640-C643 PolarHBondContact O-N 3.35Å; C643-N647 PolarHBondContact O-N 2.95Å; C643-I648 HydrophobicContact CB-CB 4.08Å; C643-I648 HydrophobicContact CB-CG2 4.4Å; C643-I648 PolarHBondContact O-N 3.02Å; C643-F649 HydrophobicContact CB-CD1 4.11Å; C643-F649 HydrophobicContact CB-CE1 3.4Å; C643-F649 HydrophobicContact CB-CE2 4.26Å; C643-F649 HydrophobicContact CB-CZ 3.5Å; C643-F649 VanDerWaalsContact CB-CZ 3.5Å
644	R	92.4	Very high	91.2	Very high	114 Å²	114	33.3 Å²	33.3	43%	0.43	16%	0.157	S	C	.	.	H	α-helix	trans	-69.3	-45.3	171.9	-164.1	177.8	-65.2	110.7	-2.4	111.8	D483 V640 S641 F642 I646 N647 F649	D483-R644 IonicContact OD1-CZ 2.81Å; D483-R644 IonicContact OD1-NE 3.91Å; D483-R644 PolarHBondContact OD1-NE 2.76Å; D483-R644 IonicContact OD1-NH2 3.89Å; D483-R644 PolarHBondContact OD1-NH2 3.39Å; D483-R644 IonicContact OD2-CZ 2.97Å; D483-R644 IonicContact OD2-NE 2.79Å; D483-R644 PolarHBondContact OD2-NE 3.33Å; D483-R644 IonicContact OD2-NH2 3.01Å; V640-R644 PolarHBondContact O-N 2.93Å; V640-R644 VanDerWaalsContact O-N 3.08Å; S641-R644 PolarHBondContact O-N 3.19Å; F642-R644 PolarHBondContact O-N 3.38Å; R644-I646 VanDerWaalsContact C-N 3.33Å; R644-I646 PolarHBondContact O-N 3.38Å; R644-N647 PolarHBondContact O-N 2.97Å; R644-F649 HydrophobicContact CB-CD2 4.15Å; R644-F649 HydrophobicContact CB-CE2 3.85Å; R644-F649 HydrophobicContact CG-CD2 4.44Å; R644-F649 HydrophobicContact CG-CE2 4.48Å
645	Q	88.4	Confident	90.7	Very high	55 Å²	55	33.6 Å²	33.6	26%	0.257	16%	0.158	S	C	.	.	H	α-helix	trans	-61.8	-35.8	-178.9	-73.3	162.7	-9.9	0	0	113.4	Y592 S641 F642	Y592-Q645 PolarHBondContact OH-OE1 3.01Å; S641-Q645 VanDerWaalsContact O-CG 3.25Å; S641-Q645 WeakPolarHBondContact O-CG 3.5Å; S641-Q645 PolarHBondContact O-N 2.97Å; S641-Q645 PolarHBondContact OG-NE2 3.35Å; F642-Q645 PolarHBondContact O-N 3.5Å; F642-Q645 VanDerWaalsContact O-N 3.08Å
646	I	86.6	Confident	90.1	Very high	15 Å²	15	33.9 Å²	33.9	8%	0.077	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.8	23.2	177.5	61.1	145.6	0	0	0	114	L176 F599 F642 R644 I648	L176-I646 HydrophobicContact CD2-CG2 3.7Å; L176-I646 HydrophobicContact CG-CG2 4.17Å; F599-I646 HydrophobicContact CD2-CD1 4.35Å; F599-I646 HydrophobicContact CE2-CD1 4.11Å; F642-I646 HydrophobicContact CD1-CD1 4.31Å; F642-I646 HydrophobicContact CD1-CG1 4.29Å; F642-I646 HydrophobicContact CE1-CD1 3.4Å; F642-I646 VanDerWaalsContact CE1-CD1 3.4Å; F642-I646 HydrophobicContact CE1-CG1 3.76Å; F642-I646 HydrophobicContact CE2-CG1 4.42Å; F642-I646 HydrophobicContact CE2-CG2 4.16Å; F642-I646 HydrophobicContact CZ-CD1 3.55Å; F642-I646 HydrophobicContact CZ-CG1 3.8Å; F642-I646 HydrophobicContact CZ-CG2 4.09Å; F642-I646 VanDerWaalsContact O-CG1 3.31Å; F642-I646 WeakPolarHBondContact O-CG1 3.36Å; F642-I646 PolarHBondContact O-N 2.92Å; F642-I646 VanDerWaalsContact O-N 3.09Å; R644-I646 VanDerWaalsContact C-N 3.33Å; R644-I646 PolarHBondContact O-N 3.38Å; I646-I648 HydrophobicContact CD1-CD1 3.89Å; I646-I648 HydrophobicContact CD1-CG1 3.46Å; I646-I648 VanDerWaalsContact CD1-CG1 3.46Å; I646-I648 HydrophobicContact CG1-CG1 3.77Å; I646-I648 PolarHBondContact O-N 3.1Å; I646-I648 VanDerWaalsContact O-N 3.1Å
647	N	89.4	Confident	89.8	Confident	68 Å²	68	33.9 Å²	33.9	36%	0.364	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.1	24.9	171.9	-67.5	-64.4	0	0	0	116.2	Q175 C643 R644 F649 V650 W651	Q175-N647 PolarHBondContact OE1-ND2 2.98Å; C643-N647 PolarHBondContact O-N 2.95Å; R644-N647 PolarHBondContact O-N 2.97Å; N647-F649 VanDerWaalsContact C-N 3.29Å; N647-F649 PolarHBondContact O-N 3.29Å; N647-V650 HydrophobicContact CB-CB 4.41Å; N647-V650 HydrophobicContact CB-CG2 4.29Å; N647-V650 WeakPolarHBondContact O-CB 3.39Å; N647-V650 PolarHBondContact O-N 3.4Å; N647-W651 PolarHBondContact O-N 3.04Å; N647-W651 VanDerWaalsContact O-N 3.15Å
648	I	90.8	Very high	89.7	Confident	3 Å²	3	29.5 Å²	29.5	2%	0.015	15%	0.145	C	C	.	.	H	α-helix	trans	-63.4	-35.4	179.1	-68.2	-69.2	0	0	0	111.3	F599 T604 V609 C643 I646 V650 W651 I652	F599-I648 HydrophobicContact CE1-CD1 3.92Å; F599-I648 HydrophobicContact CZ-CD1 3.85Å; T604-I648 HydrophobicContact CG2-CD1 3.79Å; V609-I648 HydrophobicContact CG1-CG2 4.49Å; V609-I648 HydrophobicContact CG2-CD1 4.45Å; V609-I648 HydrophobicContact CG2-CG2 4.23Å; C643-I648 HydrophobicContact CB-CB 4.08Å; C643-I648 HydrophobicContact CB-CG2 4.4Å; C643-I648 PolarHBondContact O-N 3.02Å; I646-I648 HydrophobicContact CD1-CD1 3.89Å; I646-I648 HydrophobicContact CD1-CG1 3.46Å; I646-I648 VanDerWaalsContact CD1-CG1 3.46Å; I646-I648 HydrophobicContact CG1-CG1 3.77Å; I646-I648 PolarHBondContact O-N 3.1Å; I646-I648 VanDerWaalsContact O-N 3.1Å; I648-V650 VanDerWaalsContact C-N 3.34Å; I648-V650 PolarHBondContact O-N 3.21Å; I648-W651 PolarHBondContact O-N 2.76Å; I648-I652 HydrophobicContact CG2-CD1 3.71Å; I648-I652 HydrophobicContact CG2-CG1 4.25Å; I648-I652 WeakPolarHBondContact O-CG1 3.3Å; I648-I652 PolarHBondContact O-N 2.64Å
649	F	93.7	Very high	89.4	Confident	6 Å²	6	33 Å²	33	3%	0.026	16%	0.156	C	C	.	.	H	α-helix	trans	-65.1	-36.7	176.6	-56.1	-30.1	0	0	0	112.7	V482 D483 S486 F490 V640 C643 R644 N647 I652 A653	V482-F649 HydrophobicContact CG1-CB 3.89Å; V482-F649 HydrophobicContact CG1-CD1 4.24Å; V482-F649 HydrophobicContact CG1-CG 4.36Å; D483-F649 HydrophobicContact CB-CD2 3.84Å; D483-F649 HydrophobicContact CB-CE2 4.4Å; D483-F649 HydrophobicContact CB-CG 4.44Å; D483-F649 WeakPolarHBondContact OD1-CD2 3.44Å; D483-F649 WeakPolarHBondContact OD1-CE2 3.29Å; S486-F649 VanDerWaalsContact CB-CE1 3.43Å; S486-F649 WeakPolarHBondContact OG-CD1 3.18Å; S486-F649 WeakPolarHBondContact OG-CE1 3.41Å; F490-F649 HydrophobicContact CE2-CE1 4.08Å; F490-F649 HydrophobicContact CE2-CZ 4.26Å; F490-F649 AromaticContact CZ-CE1 3.88Å; F490-F649 HydrophobicContact CZ-CE1 3.88Å; V640-F649 HydrophobicContact CG1-CE2 4.38Å; V640-F649 HydrophobicContact CG1-CZ 4.22Å; C643-F649 HydrophobicContact CB-CD1 4.11Å; C643-F649 HydrophobicContact CB-CE1 3.4Å; C643-F649 HydrophobicContact CB-CE2 4.26Å; C643-F649 HydrophobicContact CB-CZ 3.5Å; C643-F649 VanDerWaalsContact CB-CZ 3.5Å; R644-F649 HydrophobicContact CB-CD2 4.15Å; R644-F649 HydrophobicContact CB-CE2 3.85Å; R644-F649 HydrophobicContact CG-CD2 4.44Å; R644-F649 HydrophobicContact CG-CE2 4.48Å; N647-F649 VanDerWaalsContact C-N 3.29Å; N647-F649 PolarHBondContact O-N 3.29Å; F649-I652 PolarHBondContact O-N 2.98Å; F649-A653 WeakPolarHBondContact O-CB 3.4Å; F649-A653 PolarHBondContact O-N 3.41Å
650	V	91.4	Very high	88.7	Confident	47 Å²	47	33 Å²	33	29%	0.285	16%	0.156	S	C	.	.	H	α-helix	trans	-63.3	-44.5	173	-177.3	0	0	0	0	110.2	P479 N647 I648 A653 Q654	P479-V650 HydrophobicContact CB-CG2 4.13Å; P479-V650 HydrophobicContact CG-CG1 4.43Å; P479-V650 HydrophobicContact CG-CG2 4.36Å; N647-V650 HydrophobicContact CB-CB 4.41Å; N647-V650 HydrophobicContact CB-CG2 4.29Å; N647-V650 WeakPolarHBondContact O-CB 3.39Å; N647-V650 PolarHBondContact O-N 3.4Å; I648-V650 VanDerWaalsContact C-N 3.34Å; I648-V650 PolarHBondContact O-N 3.21Å; V650-A653 PolarHBondContact O-N 2.99Å; V650-Q654 VanDerWaalsContact O-CG 3.3Å; V650-Q654 WeakPolarHBondContact O-CG 3.43Å; V650-Q654 PolarHBondContact O-N 3.44Å
651	W	90.1	Very high	88.1	Confident	38 Å²	38	32.7 Å²	32.7	14%	0.144	15%	0.154	C	C	.	.	H	α-helix	trans	-63.2	-43.2	176.7	-179.6	88.3	0	0	0	112.3	T604 W606 V609 N647 I648 A653 Q654 Q655	T604-W651 HydrophobicContact CG2-CB 4.38Å; T604-W651 HydrophobicContact CG2-CD2 3.43Å; T604-W651 VanDerWaalsContact CG2-CD2 3.43Å; T604-W651 HydrophobicContact CG2-CE3 3.8Å; T604-W651 HydrophobicContact CG2-CG 3.66Å; T604-W651 HydrophobicContact CG2-CZ2 4.31Å; T604-W651 HydrophobicContact CG2-CZ3 4.4Å; T604-W651 WeakPolarHBondContact O-CZ2 3.48Å; T604-W651 PolarHBondContact O-NE1 3.04Å; W606-W651 HydrophobicContact CB-CH2 4.27Å; W606-W651 AromaticContact CD1-CH2 3.7Å; W606-W651 AromaticContact CD2-CH2 3.89Å; W606-W651 HydrophobicContact CD2-CH2 3.89Å; W606-W651 AromaticContact CD2-CZ3 3.85Å; W606-W651 HydrophobicContact CD2-CZ3 3.85Å; W606-W651 AromaticContact CE2-CH2 3.94Å; W606-W651 AromaticContact CE2-CZ3 3.89Å; W606-W651 HydrophobicContact CE3-CZ3 4.18Å; W606-W651 AromaticContact CG-CH2 3.71Å; W606-W651 HydrophobicContact CG-CH2 3.71Å; W606-W651 HydrophobicContact CG-CZ3 4.17Å; W606-W651 HydrophobicContact CZ2-CZ3 4.24Å; W606-W651 VanDerWaalsContact N-CH2 3.33Å; W606-W651 AromaticContact NE1-CH2 3.82Å; V609-W651 HydrophobicContact CG2-CE3 4.18Å; V609-W651 HydrophobicContact CG2-CZ3 3.92Å; N647-W651 PolarHBondContact O-N 3.04Å; N647-W651 VanDerWaalsContact O-N 3.15Å; I648-W651 PolarHBondContact O-N 2.76Å; W651-A653 PolarHBondContact O-N 2.85Å; W651-Q654 WeakPolarHBondContact O-CB 3.42Å; W651-Q654 PolarHBondContact O-N 3.11Å; W651-Q655 HydrophobicContact CD2-CG 4.14Å; W651-Q655 HydrophobicContact CE3-CG 4.13Å; W651-Q655 HydrophobicContact CH2-CG 3.58Å; W651-Q655 HydrophobicContact CZ2-CG 3.61Å; W651-Q655 HydrophobicContact CZ3-CG 3.86Å; W651-Q655 WeakPolarHBondContact O-CG 3.23Å; W651-Q655 PolarHBondContact O-N 2.95Å; W651-Q655 VanDerWaalsContact O-N 3.11Å
652	I	89.7	Confident	87.7	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-62.7	-42.2	176.3	-70.2	168.2	0	0	0	111.1	V482 W606 V609 I648 F649 Q654 Q655 G656 G657 W658	V482-I652 HydrophobicContact CG1-CB 3.91Å; V482-I652 HydrophobicContact CG1-CG2 3.6Å; V482-I652 HydrophobicContact CG2-CG2 4.12Å; W606-I652 HydrophobicContact CH2-CB 4.31Å; W606-I652 HydrophobicContact CH2-CD1 4.44Å; W606-I652 HydrophobicContact CH2-CG1 3.87Å; W606-I652 HydrophobicContact CH2-CG2 3.8Å; W606-I652 HydrophobicContact CZ2-CG2 4.35Å; W606-I652 HydrophobicContact CZ3-CD1 4.45Å; W606-I652 HydrophobicContact CZ3-CG1 4.18Å; V609-I652 HydrophobicContact CG1-CD1 4.28Å; I648-I652 HydrophobicContact CG2-CD1 3.71Å; I648-I652 HydrophobicContact CG2-CG1 4.25Å; I648-I652 WeakPolarHBondContact O-CG1 3.3Å; I648-I652 PolarHBondContact O-N 2.64Å; F649-I652 PolarHBondContact O-N 2.98Å; I652-Q654 VanDerWaalsContact C-N 3.34Å; I652-Q654 PolarHBondContact O-N 3.02Å; I652-Q655 PolarHBondContact O-N 2.88Å; I652-G656 PolarHBondContact O-N 2.76Å; I652-G657 WeakPolarHBondContact O-CA 3.26Å; I652-G657 PolarHBondContact O-N 3.11Å; I652-W658 HydrophobicContact CD1-CH2 3.42Å; I652-W658 VanDerWaalsContact CD1-CH2 3.42Å; I652-W658 HydrophobicContact CD1-CZ2 3.65Å; I652-W658 HydrophobicContact CD1-CZ3 4.07Å; I652-W658 HydrophobicContact CG2-CD2 4.33Å
653	A	90.2	Very high	86.8	Confident	4 Å²	4	34.7 Å²	34.7	3%	0.033	16%	0.159	C	C	.	.	H	α-helix	trans	-59.2	-44	175.1	0	0	0	0	0	111.7	P479 V482 F649 V650 W651 Q655 G656	P479-A653 HydrophobicContact CB-CB 4.42Å; P479-A653 HydrophobicContact CG-CB 4.1Å; V482-A653 HydrophobicContact CB-CB 4.49Å; V482-A653 HydrophobicContact CG2-CB 3.84Å; F649-A653 WeakPolarHBondContact O-CB 3.4Å; F649-A653 PolarHBondContact O-N 3.41Å; V650-A653 PolarHBondContact O-N 2.99Å; W651-A653 PolarHBondContact O-N 2.85Å; A653-Q655 PolarHBondContact O-N 2.95Å; A653-G656 PolarHBondContact O-N 2.64Å
654	Q	86.4	Confident	85.6	Confident	139 Å²	139	34.8 Å²	34.8	65%	0.65	16%	0.16	S	C	*	.	H	α-helix	trans	-61.5	-27.1	173.5	-68.7	169.3	2.8	0	0	113.5	V650 W651 I652 G656	V650-Q654 VanDerWaalsContact O-CG 3.3Å; V650-Q654 WeakPolarHBondContact O-CG 3.43Å; V650-Q654 PolarHBondContact O-N 3.44Å; W651-Q654 WeakPolarHBondContact O-CB 3.42Å; W651-Q654 PolarHBondContact O-N 3.11Å; I652-Q654 VanDerWaalsContact C-N 3.34Å; I652-Q654 PolarHBondContact O-N 3.02Å; Q654-G656 VanDerWaalsContact C-N 3.29Å
655	Q	80.5	Confident	84.1	Confident	62 Å²	62	37 Å²	37	29%	0.29	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-3.9	172.4	-57	-41.4	-66.2	0	0	113.7	W606 W651 I652 A653 I660	W606-Q655 HydrophobicContact CZ2-CB 3.99Å; W606-Q655 HydrophobicContact CZ2-CG 4.35Å; W651-Q655 HydrophobicContact CD2-CG 4.14Å; W651-Q655 HydrophobicContact CE3-CG 4.13Å; W651-Q655 HydrophobicContact CH2-CG 3.58Å; W651-Q655 HydrophobicContact CZ2-CG 3.61Å; W651-Q655 HydrophobicContact CZ3-CG 3.86Å; W651-Q655 WeakPolarHBondContact O-CG 3.23Å; W651-Q655 PolarHBondContact O-N 2.95Å; W651-Q655 VanDerWaalsContact O-N 3.11Å; I652-Q655 PolarHBondContact O-N 2.88Å; A653-Q655 PolarHBondContact O-N 2.95Å; Q655-I660 WeakPolarHBondContact O-CD1 3.4Å
656	G	79.6	Confident	82.7	Confident	5 Å²	5	36.2 Å²	36.2	5%	0.052	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	101.1	14.5	-175.1	0	0	0	0	0	114.9	I652 A653 Q654	I652-G656 PolarHBondContact O-N 2.76Å; A653-G656 PolarHBondContact O-N 2.64Å; Q654-G656 VanDerWaalsContact C-N 3.29Å
657	G	88.5	Confident	81.1	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	19%	0.188	C	C	.	.			trans	75	-177.8	175.2	0	0	0	0	0	114.8	I652 R659 I660	I652-G657 WeakPolarHBondContact O-CA 3.26Å; I652-G657 PolarHBondContact O-N 3.11Å; G657-R659 PolarHBondContact O-N 2.68Å; G657-I660 VanDerWaalsContact O-CG2 3.26Å; G657-I660 WeakPolarHBondContact O-CG2 3.32Å; G657-I660 PolarHBondContact O-N 3.45Å
658	W	90.5	Very high	79	Confident	7 Å²	7	45.1 Å²	45.1	3%	0.027	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-33.9	-176.5	-71.6	123.1	0	0	0	114.7	V482 S486 V489 F490 V555 W606 F613 I652 I660 L661	V482-W658 PolarHBondContact O-NE1 3Å; S486-W658 WeakPolarHBondContact OG-CZ2 3.48Å; S486-W658 PolarHBondContact OG-NE1 2.8Å; S486-W658 VanDerWaalsContact OG-NE1 3.1Å; V489-W658 HydrophobicContact CG1-CD2 4.32Å; V489-W658 HydrophobicContact CG1-CE3 4.19Å; V489-W658 HydrophobicContact CG1-CH2 4.49Å; V489-W658 HydrophobicContact CG1-CZ3 4.28Å; V489-W658 HydrophobicContact CG2-CD2 4.08Å; V489-W658 HydrophobicContact CG2-CG 4Å; F490-W658 AromaticContact CE1-CH2 3.55Å; F490-W658 HydrophobicContact CE1-CH2 3.55Å; F490-W658 AromaticContact CE1-CZ2 3.62Å; F490-W658 HydrophobicContact CE1-CZ2 3.62Å; F490-W658 HydrophobicContact CZ-CH2 4.13Å; F490-W658 AromaticContact CZ-CZ2 3.99Å; F490-W658 HydrophobicContact CZ-CZ2 3.99Å; V555-W658 HydrophobicContact CG1-CB 4.39Å; V555-W658 HydrophobicContact CG1-CE3 4.04Å; V555-W658 HydrophobicContact CG2-CB 4.4Å; V555-W658 VanDerWaalsContact CG2-O 3.23Å; V555-W658 WeakPolarHBondContact CG2-O 3.42Å; W606-W658 HydrophobicContact CH2-CE3 4.39Å; W606-W658 HydrophobicContact CH2-CZ3 4.28Å; W606-W658 HydrophobicContact CZ3-CZ3 4.01Å; F613-W658 AromaticContact CE2-CH2 3.57Å; F613-W658 HydrophobicContact CE2-CH2 3.57Å; F613-W658 AromaticContact CE2-CZ3 3.95Å; F613-W658 HydrophobicContact CE2-CZ3 3.95Å; F613-W658 AromaticContact CZ-CH2 3.69Å; F613-W658 HydrophobicContact CZ-CH2 3.69Å; F613-W658 HydrophobicContact CZ-CZ3 4.46Å; I652-W658 HydrophobicContact CD1-CH2 3.42Å; I652-W658 VanDerWaalsContact CD1-CH2 3.42Å; I652-W658 HydrophobicContact CD1-CZ2 3.65Å; I652-W658 HydrophobicContact CD1-CZ3 4.07Å; I652-W658 HydrophobicContact CG2-CD2 4.33Å; W658-I660 PolarHBondContact O-N 2.96Å; W658-L661 HydrophobicContact CE3-CD1 3.84Å; W658-L661 HydrophobicContact CZ3-CD1 3.88Å; W658-L661 PolarHBondContact O-N 2.81Å
659	R	86.2	Confident	76.5	Confident	85 Å²	85	49.6 Å²	49.6	32%	0.321	23%	0.228	S	C	.	.	H	α-helix	trans	-50	-26	178.8	-74.9	178.9	-83.9	-101.1	6.3	113.6	S477 E481 V551 G657 L661 Q662 F663	S477-R659 PolarHBondContact OG-NH2 3.28Å; E481-R659 IonicContact OE2-NH2 2.7Å; E481-R659 PolarHBondContact OE2-NH2 3.4Å; V551-R659 HydrophobicContact CG1-CB 4.49Å; V551-R659 HydrophobicContact CG1-CG 3.56Å; V551-R659 HydrophobicContact CG2-CG 4.22Å; G657-R659 PolarHBondContact O-N 2.68Å; R659-L661 PolarHBondContact O-N 3.37Å; R659-Q662 WeakPolarHBondContact O-CB 3.44Å; R659-Q662 WeakPolarHBondContact O-CG 3.26Å; R659-Q662 PolarHBondContact O-N 3.05Å; R659-F663 WeakPolarHBondContact O-CD2 3.39Å
660	I	79.5	Confident	73.8	Confident	1 Å²	1	56.4 Å²	56.4	1%	0.005	25%	0.254	C	S	.	.	H	α-helix	trans	-61.7	-32.2	177.8	-159.1	154.6	0	0	0	113.5	V470 L474 W606 Q655 G657 W658	V470-I660 HydrophobicContact CB-CD1 3.53Å; V470-I660 HydrophobicContact CB-CG1 3.81Å; V470-I660 HydrophobicContact CG1-CD1 3.53Å; V470-I660 HydrophobicContact CG1-CG1 3.47Å; V470-I660 VanDerWaalsContact CG1-CG1 3.47Å; V470-I660 HydrophobicContact CG2-CD1 4.25Å; V470-I660 HydrophobicContact CG2-CG1 4.14Å; L474-I660 HydrophobicContact CD1-CB 3.89Å; L474-I660 HydrophobicContact CD1-CD1 3.81Å; L474-I660 HydrophobicContact CD1-CG1 3.65Å; W606-I660 HydrophobicContact CH2-CG2 4Å; W606-I660 HydrophobicContact CZ2-CG2 3.37Å; Q655-I660 WeakPolarHBondContact O-CD1 3.4Å; G657-I660 VanDerWaalsContact O-CG2 3.26Å; G657-I660 WeakPolarHBondContact O-CG2 3.32Å; G657-I660 PolarHBondContact O-N 3.45Å; W658-I660 PolarHBondContact O-N 2.96Å
661	L	81.8	Confident	71	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-78	-19.8	180	-57.3	-176.3	0	0	0	112.6	V555 N558 L559 W606 W658 R659 F663 L664	V555-L661 HydrophobicContact CG1-CB 3.92Å; V555-L661 HydrophobicContact CG1-CD1 3.89Å; V555-L661 HydrophobicContact CG1-CG 4.45Å; V555-L661 HydrophobicContact CG2-CB 4.25Å; N558-L661 PolarHBondContact ND2-O 3.02Å; L559-L661 HydrophobicContact CD1-CD1 3.9Å; L559-L661 HydrophobicContact CD2-CD1 3.73Å; L559-L661 HydrophobicContact CG-CD1 3.81Å; W606-L661 HydrophobicContact CD2-CD2 4.15Å; W606-L661 HydrophobicContact CE3-CD1 4.35Å; W606-L661 HydrophobicContact CE3-CD2 3.9Å; W606-L661 HydrophobicContact CH2-CD1 4.19Å; W606-L661 HydrophobicContact CH2-CD2 4.24Å; W606-L661 HydrophobicContact CH2-CG 4.15Å; W606-L661 HydrophobicContact CZ2-CD2 4.5Å; W606-L661 HydrophobicContact CZ3-CD1 3.76Å; W606-L661 HydrophobicContact CZ3-CD2 3.95Å; W606-L661 HydrophobicContact CZ3-CG 4.07Å; W658-L661 HydrophobicContact CE3-CD1 3.84Å; W658-L661 HydrophobicContact CZ3-CD1 3.88Å; W658-L661 PolarHBondContact O-N 2.81Å; R659-L661 PolarHBondContact O-N 3.37Å; L661-F663 PolarHBondContact O-N 3.05Å; L661-L664 HydrophobicContact CD2-CD1 3.56Å; L661-L664 PolarHBondContact O-N 3.41Å; L661-L664 VanDerWaalsContact O-N 3.14Å
662	Q	82	Confident	68.5	Low	49 Å²	49	63.6 Å²	63.6	23%	0.229	29%	0.294	C	S	.	.	H	α-helix	trans	-63.4	-24.3	176.2	93.6	-158.9	-7	0	0	112	I554 V555 N558 R659	I554-Q662 HydrophobicContact CG2-CB 3.96Å; V555-Q662 HydrophobicContact CG2-CB 4.08Å; N558-Q662 VanDerWaalsContact ND2-C 3.34Å; N558-Q662 WeakPolarHBondContact ND2-CA 3.42Å; N558-Q662 PolarHBondContact ND2-O 3.37Å; R659-Q662 WeakPolarHBondContact O-CB 3.44Å; R659-Q662 WeakPolarHBondContact O-CG 3.26Å; R659-Q662 PolarHBondContact O-N 3.05Å
663	F	72	Confident	65.8	Low	30 Å²	30	69.9 Å²	69.9	13%	0.132	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.2	-6	179.5	-57.8	-59.5	0	0	0	113.8	Y94 A95 P96 L474 R659 L661	Y94-F663 WeakPolarHBondContact CA-O 3.46Å; Y94-F663 HydrophobicContact CD2-CB 3.64Å; Y94-F663 HydrophobicContact CE2-CB 3.38Å; Y94-F663 AromaticContact CE2-CD2 3.69Å; Y94-F663 HydrophobicContact CE2-CD2 3.69Å; Y94-F663 AromaticContact CE2-CG 3.85Å; Y94-F663 HydrophobicContact CE2-CG 3.85Å; Y94-F663 HydrophobicContact CG-CB 4.43Å; Y94-F663 AromaticContact CZ-CD2 3.88Å; A95-F663 PolarHBondContact N-O 3.46Å; A95-F663 WeakPolarHBondContact O-CD1 3.21Å; P96-F663 HydrophobicContact CB-CD1 4.42Å; P96-F663 HydrophobicContact CB-CE1 4.39Å; L474-F663 HydrophobicContact CD2-CE2 3.76Å; R659-F663 WeakPolarHBondContact O-CD2 3.39Å; L661-F663 PolarHBondContact O-N 3.05Å
664	L	67.5	Low	63.3	Low	3 Å²	3	79.6 Å²	79.6	2%	0.016	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	128.1	175.8	-66.4	-176	0	0	0	110.1	Y94 L468 V470 N558 I562 L661	Y94-L664 HydrophobicContact CD2-CD2 4.26Å; L468-L664 HydrophobicContact CD2-CD1 3.55Å; V470-L664 HydrophobicContact CG2-CD1 4.22Å; V470-L664 HydrophobicContact CG2-CD2 4.05Å; N558-L664 PolarHBondContact ND2-O 3.07Å; I562-L664 HydrophobicContact CD1-CB 4.05Å; L661-L664 HydrophobicContact CD2-CD1 3.56Å; L661-L664 PolarHBondContact O-N 3.41Å; L661-L664 VanDerWaalsContact O-N 3.14Å
665	R	61.7	Low	60.7	Low	161 Å²	161	79.8 Å²	79.8	61%	0.608	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.5	143	170.7	-64.5	-174.6	-178.8	178.1	1.3	110.6	L92 V93 H667	L92-R665 WeakPolarHBondContact CA-O 3.2Å; V93-R665 PolarHBondContact N-O 3.22Å; V93-R665 PolarHBondContact O-N 3.19Å; R665-H667 PolarHBondContact O-N 3.42Å
666	S	57.7	Low	58.7	Low	37 Å²	37	82.3 Å²	82.3	26%	0.259	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	115.5	168.5	-171.4	0	0	0	0	109.2
667	H	53.3	Low	56.7	Low	108 Å²	108	89.7 Å²	89.7	50%	0.5	44%	0.435	S	S	.	.			trans	-96.3	99.7	177.4	-168.7	-66.2	0	0	0	109.6	T91 V93 R665 T669	T91-H667 PolarHBondContact O-N 3.47Å; V93-H667 HydrophobicContact CG2-CB 3.87Å; R665-H667 PolarHBondContact O-N 3.42Å; H667-T669 PolarHBondContact O-N 2.94Å
668	R	45.9	Very low	54.3	Low	162 Å²	162	99.2 Å²	99.2	61%	0.611	48%	0.477	S	S	*	.			trans	-64.9	104.7	166.1	-74.8	-172.7	-174.9	152.4	5.5	109	Y670	R668-Y670 HydrophobicContact CB-CD2 3.94Å; R668-Y670 HydrophobicContact CB-CE2 3.72Å; R668-Y670 HydrophobicContact CG-CE2 4.45Å; R668-Y670 PolarHBondContact NH1-OH 3.39Å; R668-Y670 PolarHBondContact O-N 3.21Å
669	T	37.6	Very low	51.7	Low	97 Å²	97	107.9 Å²	107.9	60%	0.595	52%	0.515	S	S	*	.			trans	-72.4	98.9	156.1	51.8	0	0	0	0	107.1	H667 D671	H667-T669 PolarHBondContact O-N 2.94Å; T669-D671 PolarHBondContact O-N 2.66Å
670	Y	37.2	Very low	49.2	Very low	150 Å²	150	111 Å²	111	59%	0.588	54%	0.538	S	S	*	.			trans	-68	107.4	164.3	-76.2	-90.7	0	0	0	107.3	R668 D672	R668-Y670 HydrophobicContact CB-CD2 3.94Å; R668-Y670 HydrophobicContact CB-CE2 3.72Å; R668-Y670 HydrophobicContact CG-CE2 4.45Å; R668-Y670 PolarHBondContact NH1-OH 3.39Å; R668-Y670 PolarHBondContact O-N 3.21Å; Y670-D672 VanDerWaalsContact CD1-OD2 3.23Å; Y670-D672 WeakPolarHBondContact CD1-OD2 3.45Å; Y670-D672 PolarHBondContact O-N 3.45Å
671	D	34.2	Very low	47	Very low	119 Å²	119	120.7 Å²	120.7	64%	0.636	58%	0.582	S	S	*	*			trans	-77	55	165.6	-94.4	-10.6	0	0	0	107.9	K86 T669	K86-D671 IonicContact NZ-OD1 3.07Å; K86-D671 PolarHBondContact NZ-OD1 3.44Å; K86-D671 IonicContact NZ-OD2 3.06Å; K86-D671 PolarHBondContact NZ-OD2 3.43Å; T669-D671 PolarHBondContact O-N 2.66Å
672	D	36.4	Very low	44.8	Very low	116 Å²	116	125.8 Å²	125.8	62%	0.62	62%	0.618	S	S	*	*			trans	-97.4	106.1	-178.9	-70.8	-8.7	0	0	0	110.3	Y670	Y670-D672 VanDerWaalsContact CD1-OD2 3.23Å; Y670-D672 WeakPolarHBondContact CD1-OD2 3.45Å; Y670-D672 PolarHBondContact O-N 3.45Å
673	D	32.8	Very low	42.5	Very low	132 Å²	132	129.7 Å²	129.7	71%	0.706	65%	0.646	S	S	*	*			trans	56.7	54.7	149.9	-62.4	-28.4	0	0	0	121.5	N675	D673-N675 PolarHBondContact O-N 3.03Å
674	E	38.5	Very low	40.6	Very low	208 Å²	208	137.4 Å²	137.4	97%	0.972	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.4	47.2	151.3	-93.1	-150.6	152.6	0	0	112.9
675	N	32.2	Very low	39.1	Very low	144 Å²	144	142.9 Å²	142.9	77%	0.77	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-157.5	32.8	168.3	-143.2	-9	0	0	0	117.8	D673	D673-N675 PolarHBondContact O-N 3.03Å
676	V	37	Very low	37.6	Very low	114 Å²	114	142 Å²	142	69%	0.691	73%	0.725	S	S	*	*	S	Bend	trans	-129	46.2	173.8	-160.3	0	0	0	0	112.8
677	D	37.8	Very low	36.7	Very low	160 Å²	160	147.1 Å²	147.1	86%	0.856	76%	0.755	S	S	*	*			trans	-149.6	41.6	173.4	-109.7	-29.6	0	0	0	115
678	K	39.6	Very low	35.6	Very low	200 Å²	200	147.8 Å²	147.8	87%	0.87	77%	0.766	S	S	*	*	S	Bend	trans	-135.1	46.4	173.5	-73	-175.6	-178.7	156.9	0	114.6
679	K	34.7	Very low	35.2	Very low	189 Å²	189	144.9 Å²	144.9	82%	0.822	77%	0.771	S	S	*	*	S	Bend	trans	-158.3	142.9	158.1	-123.5	168.1	-177.4	172.6	0	111.5
680	N	34.8	Very low	34.9	Very low	151 Å²	151	148 Å²	148	81%	0.807	78%	0.778	S	S	*	*			trans	91	45.6	169.8	-46.2	-22.8	0	0	0	118.6
681	H	32.1	Very low	34.9	Very low	204 Å²	204	145.1 Å²	145.1	94%	0.944	78%	0.777	S	S	*	*			trans	-98.6	94.5	151.5	-97.4	-31	0	0	0	111.6
682	S	35.9	Very low	34.9	Very low	107 Å²	107	146 Å²	146	75%	0.748	78%	0.781	S	S	*	*			trans	167.2	111.6	153.7	-177.4	0	0	0	0	107
683	T	34.8	Very low	35	Very low	132 Å²	132	148.7 Å²	148.7	81%	0.81	80%	0.795	S	S	*	*				-164.7	138.7	88.3	-66.5	0	0	0	0	109.7
684	K	30.6	Very low	35.1	Very low	191 Å²	191	150 Å²	150	83%	0.83	80%	0.797	S	S	*	*			trans	-81.3	144.3	175.2	-71.1	176.2	173.6	176.6	0	112.2
685	S	36.7	Very low	35.1	Very low	118 Å²	118	145.8 Å²	145.8	83%	0.825	79%	0.791	S	S	*	*			trans	-154.2	117.9	145.8	57.5	0	0	0	0	111.8
686	N	30.9	Very low	35	Very low	142 Å²	142	147.7 Å²	147.7	76%	0.759	79%	0.789	S	S	*	*			trans	-77.6	145.3	178	-57.5	-19.9	0	0	0	111.5
687	V	37.9	Very low	34.9	Very low	146 Å²	146	150.6 Å²	150.6	89%	0.885	80%	0.795	S	S	*	*			trans	-142	137.4	136.1	-176.5	0	0	0	0	108.2
688	T	31.1	Very low	34.6	Very low	121 Å²	121	149.9 Å²	149.9	74%	0.742	79%	0.787	S	S	*	*			trans	-133	166.8	-178.8	-55.7	0	0	0	0	109.1
689	S	36.5	Very low	34.3	Very low	101 Å²	101	147.1 Å²	147.1	71%	0.706	78%	0.781	S	S	*	*			trans	99.4	142.8	177	81.6	0	0	0	0	114.1
690	H	32.5	Very low	34.3	Very low	162 Å²	162	143.6 Å²	143.6	75%	0.75	78%	0.776	S	S	*	*			cis	-160.4	154.6	-3	-140.3	-108.2	0	0	0	109
691	T	36	Very low	34.1	Very low	91 Å²	91	141.3 Å²	141.3	56%	0.558	77%	0.771	S	S	*	*			trans	21.7	152.3	143.2	59.3	0	0	0	0	121.8
692	D	34.5	Very low	34.1	Very low	138 Å²	138	139.4 Å²	139.4	74%	0.738	77%	0.767	S	S	*	*			cis	-167.3	161.2	-6.4	-86.6	-27.9	0	0	0	105.5
693	D	39.1	Very low	33.8	Very low	171 Å²	171	139.5 Å²	139.5	91%	0.914	76%	0.76	S	S	*	*			trans	174.8	134.5	138.6	-94.2	-24.9	0	0	0	111.9
694	E	35.3	Very low	33.7	Very low	159 Å²	159	141.6 Å²	141.6	74%	0.743	76%	0.76	S	S	*	*			trans	-95.4	144.3	179.5	-61.6	-175.9	134.5	0	0	112.6	Y696	E694-Y696 HydrophobicContact CB-CE2 4.36Å
695	S	38	Very low	33.7	Very low	121 Å²	121	138.8 Å²	138.8	85%	0.846	75%	0.754	S	S	*	*			trans	-151	133	151.8	67.8	0	0	0	0	111.5
696	Y	30	Very low	33.6	Very low	183 Å²	183	138.9 Å²	138.9	72%	0.718	75%	0.751	S	S	*	*			trans	-95.6	171.1	-163.8	-77.7	-104.7	0	0	0	115.2	E694	E694-Y696 HydrophobicContact CB-CE2 4.36Å
697	Q	35.2	Very low	33.6	Very low	175 Å²	175	139.4 Å²	139.4	82%	0.818	75%	0.754	S	S	*	*			trans	85	147.5	156.2	-58	-169	-21.3	0	0	118.5
698	Q	31.6	Very low	33.1	Very low	146 Å²	146	137.7 Å²	137.7	68%	0.682	75%	0.748	S	S	*	*			cis	-168.9	160.8	-29.8	-165.5	151.4	-21.6	0	0	107.5
699	N	31.8	Very low	33.1	Very low	142 Å²	142	139.2 Å²	139.2	76%	0.759	75%	0.752	S	S	*	*			trans	123.3	84.8	167.4	-62.1	-13.9	0	0	0	112
700	T	34.7	Very low	32.7	Very low	115 Å²	115	141.1 Å²	141.1	71%	0.706	75%	0.754	S	S	*	*				61.3	129	82.6	65.2	0	0	0	0	114.6
701	S	30.2	Very low	32.6	Very low	102 Å²	102	139 Å²	139	71%	0.713	76%	0.756	S	S	*	*			cis	-173.8	169.7	-0.4	42.2	0	0	0	0	111.1
702	L	33.4	Very low	32.2	Very low	164 Å²	164	141.8 Å²	141.8	86%	0.859	77%	0.767	S	S	*	*			trans	80.2	87.5	-178.1	-52.1	171.1	0	0	0	113.1
703	N	29.2	Very low	32.1	Very low	110 Å²	110	141.8 Å²	141.8	59%	0.588	77%	0.767	S	S	*	*			cis	67.4	118	42	-139.7	26	0	0	0	111.4
704	H	32.8	Very low	31.7	Very low	175 Å²	175	141.7 Å²	141.7	81%	0.81	77%	0.767	S	S	*	*			cis	-135.6	153.5	49.2	-93.4	-96.7	0	0	0	117.1
705	N	30.8	Very low	31.6	Very low	132 Å²	132	138.9 Å²	138.9	71%	0.706	77%	0.765	S	S	*	*			trans	-79.5	160.9	179.9	-69.9	-32.7	0	0	0	114.8
706	P	34.5	Very low	31.3	Very low	120 Å²	120	142.8 Å²	142.8	78%	0.779	77%	0.77	S	S	*	*			trans	-73.6	152.9	161.6	33.7	-35.1	0	0	0	111.3
707	L	30.5	Very low	31.4	Very low	154 Å²	154	141.5 Å²	141.5	81%	0.806	78%	0.775	S	S	*	*			trans	-123.5	117.7	165.2	-125.5	87.8	0	0	0	110
708	S	27.1	Very low	31.1	Very low	109 Å²	109	142.6 Å²	142.6	76%	0.762	78%	0.777	S	S	*	*			trans	-69.2	138.2	154.2	51.5	0	0	0	0	109.2
709	D	31.7	Very low	31.4	Very low	154 Å²	154	141.8 Å²	141.8	82%	0.824	78%	0.781	S	S	*	*			trans	-136.6	132	157.8	-128.2	-21.6	0	0	0	110.3
710	N	28.5	Very low	31.7	Very low	141 Å²	141	139.6 Å²	139.6	75%	0.754	78%	0.775	S	S	*	*			trans	-72.7	142.2	-177.1	-86.6	-14.6	0	0	0	111
711	C	29.6	Very low	31.8	Very low	118 Å²	118	141.3 Å²	141.3	80%	0.797	78%	0.779	S	S	*	*			trans	-156.8	87	140.8	-101.3	0	0	0	0	110.3	N713	C711-N713 PolarHBondContact O-N 3.27Å
712	D	27.4	Very low	32.5	Very low	148 Å²	148	142 Å²	142	79%	0.791	78%	0.779	S	S	*	*			trans	-57.3	124.9	150.9	-68.9	-52.7	0	0	0	108.3
713	N	33.1	Very low	33.1	Very low	138 Å²	138	136.3 Å²	136.3	74%	0.738	75%	0.749	S	S	*	*			trans	-160.7	110.5	153.7	-93.9	-53.8	0	0	0	109.3	C711 S715	C711-N713 PolarHBondContact O-N 3.27Å; N713-S715 PolarHBondContact O-N 3.15Å
714	D	29.3	Very low	34.2	Very low	170 Å²	170	135.2 Å²	135.2	91%	0.909	75%	0.746	S	S	*	*			trans	-51.1	122.8	162.9	-78.7	-57.5	0	0	0	110
715	S	34.2	Very low	35	Very low	99 Å²	99	131.6 Å²	131.6	69%	0.692	74%	0.741	S	S	*	*			trans	-147.7	99.3	168.3	-81	0	0	0	0	109.7	N713 L717	N713-S715 PolarHBondContact O-N 3.15Å; S715-L717 PolarHBondContact O-N 2.97Å
716	Q	31	Very low	36.4	Very low	203 Å²	203	129.9 Å²	129.9	95%	0.949	74%	0.736	S	S	*	*			trans	-56.1	99.2	169.3	-62.2	177.2	4.7	0	0	109.2
717	L	32.3	Very low	37.7	Very low	157 Å²	157	125.2 Å²	125.2	82%	0.822	71%	0.709	S	S	*	*			trans	-100.5	111	176.4	-151.1	78.9	0	0	0	110.2	S715 V719	S715-L717 PolarHBondContact O-N 2.97Å; L717-V719 PolarHBondContact O-N 3.17Å; L717-V719 VanDerWaalsContact O-N 3.12Å
718	F	29.3	Very low	39.4	Very low	197 Å²	197	124 Å²	124	86%	0.864	70%	0.697	S	S	*	*			trans	-44.5	114.8	170.9	-103.1	-115.6	0	0	0	111.1	P720	F718-P720 WeakPolarHBondContact O-CD 3.37Å
719	V	37.3	Very low	41.5	Very low	129 Å²	129	123.2 Å²	123.2	78%	0.782	69%	0.688	S	S	*	*			trans	-77.1	111.6	161.1	179.4	0	0	0	0	106.7	L717 L721	L717-V719 PolarHBondContact O-N 3.17Å; L717-V719 VanDerWaalsContact O-N 3.12Å; V719-L721 PolarHBondContact O-N 3.35Å
720	P	39.2	Very low	43.5	Very low	97 Å²	97	120.7 Å²	120.7	63%	0.63	68%	0.678	S	S	*	*			trans	-62.6	126	170.8	27.1	-32.6	0	0	0	108	F718 V722	F718-P720 WeakPolarHBondContact O-CD 3.37Å; P720-V722 HydrophobicContact CB-CG2 4.27Å; P720-V722 HydrophobicContact CG-CG2 4.34Å; P720-V722 PolarHBondContact O-N 3.31Å
721	L	36.1	Very low	45.8	Very low	150 Å²	150	118.1 Å²	118.1	79%	0.785	66%	0.663	S	S	*	*			trans	-71.1	70.1	179.9	-166.5	82.8	0	0	0	110	V719 L723	V719-L721 PolarHBondContact O-N 3.35Å; L721-L723 HydrophobicContact CD2-CD1 3.5Å; L721-L723 HydrophobicContact CG-CD1 3.66Å; L721-L723 PolarHBondContact O-N 2.75Å
722	V	45	Very low	48	Very low	118 Å²	118	115 Å²	115	72%	0.715	65%	0.646	S	S	*	*			trans	-75.9	81.6	174.7	-175.5	0	0	0	0	107.5	P720 T724	P720-V722 HydrophobicContact CB-CG2 4.27Å; P720-V722 HydrophobicContact CG-CG2 4.34Å; P720-V722 PolarHBondContact O-N 3.31Å; V722-T724 PolarHBondContact O-N 2.89Å
723	L	45.9	Very low	50.3	Low	44 Å²	44	114.4 Å²	114.4	23%	0.23	64%	0.636	C	S	.	*			trans	-57.4	112.7	167.4	-79.4	90.6	0	0	0	107.8	L721 F728 I731	L721-L723 HydrophobicContact CD2-CD1 3.5Å; L721-L723 HydrophobicContact CG-CD1 3.66Å; L721-L723 PolarHBondContact O-N 2.75Å; L723-F728 HydrophobicContact CB-CD2 3.31Å; L723-F728 HydrophobicContact CB-CE2 3.54Å; L723-F728 HydrophobicContact CB-CG 4.09Å; L723-F728 HydrophobicContact CB-CZ 4.46Å; L723-F728 HydrophobicContact CD1-CE2 4.17Å; L723-F728 HydrophobicContact CD1-CZ 4.4Å; L723-F728 HydrophobicContact CD2-CB 4.28Å; L723-F728 HydrophobicContact CD2-CD1 3.91Å; L723-F728 HydrophobicContact CD2-CD2 3.73Å; L723-F728 HydrophobicContact CD2-CE1 4.11Å; L723-F728 HydrophobicContact CD2-CE2 3.93Å; L723-F728 HydrophobicContact CD2-CG 3.7Å; L723-F728 HydrophobicContact CD2-CZ 4.11Å; L723-F728 HydrophobicContact CG-CD2 4.07Å; L723-F728 HydrophobicContact CG-CE2 4.11Å; L723-I731 HydrophobicContact CD2-CD1 3.63Å; L723-I731 HydrophobicContact CG-CD1 4.49Å
724	T	53.2	Low	52.5	Low	86 Å²	86	110.6 Å²	110.6	53%	0.528	62%	0.624	S	S	.	*			trans	-55.3	149.7	161.4	55.9	0	0	0	0	108.7	V722 T726 G727 F728	V722-T724 PolarHBondContact O-N 2.89Å; T724-T726 PolarHBondContact O-N 3.47Å; T724-T726 VanDerWaalsContact O-N 3.08Å; T724-T726 PolarHBondContact OG1-OG1 3.48Å; T724-G727 WeakPolarHBondContact O-CA 3.45Å; T724-G727 PolarHBondContact O-N 3.12Å; T724-G727 PolarHBondContact OG1-N 3.44Å; T724-F728 PolarHBondContact O-N 2.91Å
725	S	49.9	Very low	54.8	Low	99 Å²	99	107.2 Å²	107.2	69%	0.692	61%	0.606	S	S	*	*	H	α-helix	trans	-59.3	-28.3	-175.6	60.8	0	0	0	0	112.7	F728 V729	S725-F728 PolarHBondContact O-N 3.29Å; S725-V729 WeakPolarHBondContact O-CG2 3.49Å; S725-V729 PolarHBondContact O-N 3.46Å
726	T	58.9	Low	57.2	Low	97 Å²	97	108.4 Å²	108.4	60%	0.595	60%	0.595	S	S	*	*	H	α-helix	trans	-69.5	-37.9	170.5	46.9	0	0	0	0	113.4	T724 F728 V729 V730	T724-T726 PolarHBondContact O-N 3.47Å; T724-T726 VanDerWaalsContact O-N 3.08Å; T724-T726 PolarHBondContact OG1-OG1 3.48Å; T726-F728 VanDerWaalsContact C-N 3.34Å; T726-V729 PolarHBondContact O-N 3.43Å; T726-V730 WeakPolarHBondContact O-CG2 3.27Å; T726-V730 PolarHBondContact O-N 3.05Å
727	G	62.9	Low	59.5	Low	21 Å²	21	104.3 Å²	104.3	22%	0.216	57%	0.572	C	S	.	*	H	α-helix	trans	-62.7	-39.8	171.8	0	0	0	0	0	112.4	T724 V730 I731	T724-G727 WeakPolarHBondContact O-CA 3.45Å; T724-G727 PolarHBondContact O-N 3.12Å; T724-G727 PolarHBondContact OG1-N 3.44Å; G727-V730 PolarHBondContact O-N 2.89Å; G727-I731 WeakPolarHBondContact O-CB 3.4Å; G727-I731 WeakPolarHBondContact O-CG1 3.41Å; G727-I731 PolarHBondContact O-N 2.88Å
728	F	64.9	Low	61.8	Low	129 Å²	129	106 Å²	106	57%	0.566	57%	0.568	S	S	*	*	H	α-helix	trans	-61.7	-41.7	171.6	-107.6	-65.4	0	0	0	112.1	L723 T724 S725 T726 A732	L723-F728 HydrophobicContact CB-CD2 3.31Å; L723-F728 HydrophobicContact CB-CE2 3.54Å; L723-F728 HydrophobicContact CB-CG 4.09Å; L723-F728 HydrophobicContact CB-CZ 4.46Å; L723-F728 HydrophobicContact CD1-CE2 4.17Å; L723-F728 HydrophobicContact CD1-CZ 4.4Å; L723-F728 HydrophobicContact CD2-CB 4.28Å; L723-F728 HydrophobicContact CD2-CD1 3.91Å; L723-F728 HydrophobicContact CD2-CD2 3.73Å; L723-F728 HydrophobicContact CD2-CE1 4.11Å; L723-F728 HydrophobicContact CD2-CE2 3.93Å; L723-F728 HydrophobicContact CD2-CG 3.7Å; L723-F728 HydrophobicContact CD2-CZ 4.11Å; L723-F728 HydrophobicContact CG-CD2 4.07Å; L723-F728 HydrophobicContact CG-CE2 4.11Å; T724-F728 PolarHBondContact O-N 2.91Å; S725-F728 PolarHBondContact O-N 3.29Å; T726-F728 VanDerWaalsContact C-N 3.34Å; F728-A732 WeakPolarHBondContact O-CB 3.38Å; F728-A732 PolarHBondContact O-N 2.93Å
729	V	72	Confident	64.1	Low	93 Å²	93	103.3 Å²	103.3	56%	0.564	56%	0.562	S	S	*	*	H	α-helix	trans	-64.5	-44.8	176.1	171.8	0	0	0	0	111.5	S725 T726 A732 F733	S725-V729 WeakPolarHBondContact O-CG2 3.49Å; S725-V729 PolarHBondContact O-N 3.46Å; T726-V729 PolarHBondContact O-N 3.43Å; V729-A732 PolarHBondContact O-N 2.96Å; V729-F733 WeakPolarHBondContact O-CB 3.48Å; V729-F733 PolarHBondContact O-N 3.43Å
730	V	74.1	Confident	66.2	Low	101 Å²	101	106.2 Å²	106.2	61%	0.612	56%	0.559	S	S	*	*	H	α-helix	trans	-65.2	-43.8	179.1	174.6	0	0	0	0	111.4	T726 G727 F733 A734	T726-V730 WeakPolarHBondContact O-CG2 3.27Å; T726-V730 PolarHBondContact O-N 3.05Å; G727-V730 PolarHBondContact O-N 2.89Å; V730-F733 PolarHBondContact O-N 2.78Å; V730-A734 VanDerWaalsContact O-CB 3.32Å; V730-A734 WeakPolarHBondContact O-CB 3.4Å; V730-A734 PolarHBondContact O-N 3.39Å
731	I	76.3	Confident	67.7	Low	86 Å²	86	110.2 Å²	110.2	44%	0.441	56%	0.562	S	S	.	*	H	α-helix	trans	-67.2	-38.8	176.6	-72.1	164.7	0	0	0	110.9	L723 G727 A734 L735	L723-I731 HydrophobicContact CD2-CD1 3.63Å; L723-I731 HydrophobicContact CG-CD1 4.49Å; G727-I731 WeakPolarHBondContact O-CB 3.4Å; G727-I731 WeakPolarHBondContact O-CG1 3.41Å; G727-I731 PolarHBondContact O-N 2.88Å; I731-A734 PolarHBondContact O-N 3.28Å; I731-L735 HydrophobicContact CG2-CD1 3.83Å; I731-L735 HydrophobicContact CG2-CG 4.36Å; I731-L735 VanDerWaalsContact O-CB 3.27Å; I731-L735 WeakPolarHBondContact O-CB 3.41Å; I731-L735 VanDerWaalsContact O-CG 3.23Å; I731-L735 WeakPolarHBondContact O-CG 3.22Å; I731-L735 PolarHBondContact O-N 3.37Å
732	A	75.9	Confident	69.3	Low	53 Å²	53	108.3 Å²	108.3	44%	0.438	55%	0.551	S	S	.	*	H	α-helix	trans	-66.4	-36.4	173.8	0	0	0	0	0	112.6	F728 V729 W736	F728-A732 WeakPolarHBondContact O-CB 3.38Å; F728-A732 PolarHBondContact O-N 2.93Å; V729-A732 PolarHBondContact O-N 2.96Å; A732-W736 WeakPolarHBondContact O-CB 3.49Å; A732-W736 PolarHBondContact O-N 3.14Å
733	F	76.6	Confident	70.5	Confident	135 Å²	135	107.7 Å²	107.7	59%	0.592	54%	0.542	S	S	*	.	H	α-helix	trans	-72.8	-37.9	176.8	-140.4	-86.4	0	0	0	111.6	V729 V730 W736 Y737	V729-F733 WeakPolarHBondContact O-CB 3.48Å; V729-F733 PolarHBondContact O-N 3.43Å; V730-F733 PolarHBondContact O-N 2.78Å; F733-W736 HydrophobicContact CD1-CE3 4.47Å; F733-W736 HydrophobicContact CE1-CE3 4.25Å; F733-W736 HydrophobicContact CE1-CZ3 4.16Å; F733-W736 HydrophobicContact CZ-CE3 4.49Å; F733-W736 HydrophobicContact CZ-CZ3 4.26Å; F733-W736 PolarHBondContact O-N 3.34Å; F733-Y737 VanDerWaalsContact O-CB 3.25Å; F733-Y737 WeakPolarHBondContact O-CB 3.46Å; F733-Y737 PolarHBondContact O-N 3.37Å
734	A	77.7	Confident	71.9	Confident	58 Å²	58	111.3 Å²	111.3	48%	0.479	56%	0.559	S	S	.	*	H	α-helix	trans	-65.4	-46.3	172.7	0	0	0	0	0	111.4	V730 I731 Y737 Y738	V730-A734 VanDerWaalsContact O-CB 3.32Å; V730-A734 WeakPolarHBondContact O-CB 3.4Å; V730-A734 PolarHBondContact O-N 3.39Å; I731-A734 PolarHBondContact O-N 3.28Å; A734-Y737 PolarHBondContact O-N 3.04Å; A734-Y738 VanDerWaalsContact O-CB 3.27Å; A734-Y738 WeakPolarHBondContact O-CB 3.45Å; A734-Y738 PolarHBondContact O-N 3.05Å
735	L	79.3	Confident	73	Confident	100 Å²	100	112.8 Å²	112.8	52%	0.524	56%	0.561	S	S	.	*	H	α-helix	trans	-62.2	-42.6	173.3	-75.2	169.2	0	0	0	111.5	I731 Y738 L739	I731-L735 HydrophobicContact CG2-CD1 3.83Å; I731-L735 HydrophobicContact CG2-CG 4.36Å; I731-L735 VanDerWaalsContact O-CB 3.27Å; I731-L735 WeakPolarHBondContact O-CB 3.41Å; I731-L735 VanDerWaalsContact O-CG 3.23Å; I731-L735 WeakPolarHBondContact O-CG 3.22Å; I731-L735 PolarHBondContact O-N 3.37Å; L735-Y738 CarbonylContact O-C 3.55Å; L735-Y738 PolarHBondContact O-N 3.13Å; L735-L739 WeakPolarHBondContact O-CB 3.36Å; L735-L739 WeakPolarHBondContact O-CD1 3.45Å; L735-L739 WeakPolarHBondContact O-CG 3.46Å; L735-L739 PolarHBondContact O-N 3.3Å
736	W	83.4	Confident	74.5	Confident	124 Å²	124	113.6 Å²	113.6	47%	0.47	55%	0.553	S	S	.	*	H	α-helix	trans	-64.2	-41.5	176.5	178.9	83.9	0	0	0	112.1	A732 F733 L739 R740	A732-W736 WeakPolarHBondContact O-CB 3.49Å; A732-W736 PolarHBondContact O-N 3.14Å; F733-W736 HydrophobicContact CD1-CE3 4.47Å; F733-W736 HydrophobicContact CE1-CE3 4.25Å; F733-W736 HydrophobicContact CE1-CZ3 4.16Å; F733-W736 HydrophobicContact CZ-CE3 4.49Å; F733-W736 HydrophobicContact CZ-CZ3 4.26Å; F733-W736 PolarHBondContact O-N 3.34Å; W736-L739 PolarHBondContact O-N 3.21Å; W736-R740 VanDerWaalsContact CH2-NH1 3.32Å; W736-R740 WeakPolarHBondContact O-CB 3.41Å; W736-R740 PolarHBondContact O-N 3.01Å
737	Y	80.2	Confident	75.5	Confident	117 Å²	117	114.7 Å²	114.7	46%	0.459	55%	0.55	S	S	.	*	H	α-helix	trans	-64.7	-41.1	174.6	-174.1	-95.7	0	0	0	111.5	F733 A734 R740 R741	F733-Y737 VanDerWaalsContact O-CB 3.25Å; F733-Y737 WeakPolarHBondContact O-CB 3.46Å; F733-Y737 PolarHBondContact O-N 3.37Å; A734-Y737 PolarHBondContact O-N 3.04Å; Y737-R740 PolarHBondContact O-N 3.39Å; Y737-R741 WeakPolarHBondContact O-CB 3.25Å; Y737-R741 PolarHBondContact O-N 2.58Å
738	Y	79	Confident	76.4	Confident	191 Å²	191	121.4 Å²	121.4	75%	0.749	57%	0.574	S	S	*	*	H	α-helix	trans	-73.4	-24.9	177.8	-158.7	-85.7	0	0	0	113.6	A734 L735	A734-Y738 VanDerWaalsContact O-CB 3.27Å; A734-Y738 WeakPolarHBondContact O-CB 3.45Å; A734-Y738 PolarHBondContact O-N 3.05Å; L735-Y738 CarbonylContact O-C 3.55Å; L735-Y738 PolarHBondContact O-N 3.13Å
739	L	79.2	Confident	77.3	Confident	142 Å²	142	120.8 Å²	120.8	74%	0.743	58%	0.575	S	S	*	*	H	α-helix	trans	-89.2	-18.7	174.4	-75.6	164.3	0	0	0	113.4	L735 W736	L735-L739 WeakPolarHBondContact O-CB 3.36Å; L735-L739 WeakPolarHBondContact O-CD1 3.45Å; L735-L739 WeakPolarHBondContact O-CG 3.46Å; L735-L739 PolarHBondContact O-N 3.3Å; W736-L739 PolarHBondContact O-N 3.21Å
740	R	80.7	Confident	77.7	Confident	190 Å²	190	123.2 Å²	123.2	72%	0.717	58%	0.576	S	S	*	*	H	α-helix	trans	-89	-17.7	175.6	-177.7	167.9	-176.5	155	5.9	112.4	W736 Y737	W736-R740 VanDerWaalsContact CH2-NH1 3.32Å; W736-R740 WeakPolarHBondContact O-CB 3.41Å; W736-R740 PolarHBondContact O-N 3.01Å; Y737-R740 PolarHBondContact O-N 3.39Å
741	R	70.6	Confident	78.1	Confident	181 Å²	181	125.2 Å²	125.2	68%	0.683	57%	0.572	S	S	*	*			trans	-92.1	0	173.5	-169.3	173.9	-173.1	-161.5	1.3	111	Y132 Y737	Y132-R741 VanDerWaalsContact CE1-NH1 3.27Å; Y132-R741 VanDerWaalsContact CZ-CZ 3.48Å; Y132-R741 PolarHBondContact OH-NH1 2.86Å; Y132-R741 VanDerWaalsContact OH-NH1 3.16Å; Y737-R741 WeakPolarHBondContact O-CB 3.25Å; Y737-R741 PolarHBondContact O-N 2.58Å

Retrieved 741 of 741 residues in 390.7 ms (Link to these results)

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