A0A087Y7J0_POEFO Loading...

Protein O-mannosyl-transferase 2

AlphaFold DB , UniProt , Accession A0A087Y7J0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 758 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34	Very low	30.4	Very low	240 Å²	240	170.4 Å²	170.4	100%	1.182	83%	0.828	S	S	*	*				0	114.1	0	-52.9	175.3	-156.5	0	0	104.6
2	E	33.5	Very low	30.1	Very low	179 Å²	179	171.7 Å²	171.7	84%	0.836	83%	0.826	S	S	*	*			cis	-127.1	141.1	-1.8	-77.6	153.2	133.7	0	0	107.1
3	K	33.7	Very low	30	Very low	199 Å²	199	168.4 Å²	168.4	87%	0.865	82%	0.824	S	S	*	*				48.8	135.3	89.3	-75.1	-168.6	173.3	-170.5	0	113.2
4	E	30.8	Very low	29.8	Very low	187 Å²	187	171.1 Å²	171.1	87%	0.874	82%	0.82	S	S	*	*			cis	-127.4	154.4	30	-62.2	178.5	118.4	0	0	115.8
5	E	37.7	Very low	29.8	Very low	169 Å²	169	167.1 Å²	167.1	79%	0.79	81%	0.805	S	S	*	*			trans	-99.5	159.9	153.1	-64.4	174.7	107.4	0	0	108.5
6	C	24.2	Very low	29.7	Very low	128 Å²	128	162.9 Å²	162.9	87%	0.865	80%	0.799	S	S	*	*			trans	-140.6	133.7	156.5	-166.3	0	0	0	0	111.2
7	I	31.3	Very low	29.7	Very low	128 Å²	128	159.5 Å²	159.5	66%	0.656	80%	0.795	S	S	*	*			trans	-134.8	125.1	-173.8	-61	171.3	0	0	0	109.4
8	S	28.6	Very low	29.8	Very low	104 Å²	104	157.9 Å²	157.9	73%	0.727	80%	0.795	S	S	*	*			trans	-160.8	114.8	150.3	42.2	0	0	0	0	108.1
9	Q	28	Very low	29.8	Very low	168 Å²	168	155.9 Å²	155.9	79%	0.785	79%	0.792	S	S	*	*				64.2	130.1	76.4	-71.8	-168.9	1.1	0	0	114.5
10	W	25.1	Very low	29.8	Very low	233 Å²	233	159.1 Å²	159.1	88%	0.883	79%	0.794	S	S	*	*				-162.2	140.1	125.3	-111.9	38.5	0	0	0	112.8
11	H	27.2	Very low	29.9	Very low	139 Å²	139	158.7 Å²	158.7	64%	0.644	79%	0.794	S	S	*	*			trans	8.7	129.4	161.3	-61.6	-90.2	0	0	0	120.7
12	K	27.6	Very low	29.8	Very low	186 Å²	186	158.4 Å²	158.4	81%	0.809	78%	0.78	S	S	*	*				53.9	123.4	75.6	-78.5	-174.9	175.2	178.5	0	113
13	T	28.5	Very low	29.4	Very low	129 Å²	129	159.3 Å²	159.3	79%	0.791	78%	0.781	S	S	*	*			cis	-143	-141.7	10.9	-22.9	0	0	0	0	110.2
14	R	27.4	Very low	29.2	Very low	206 Å²	206	156 Å²	156	78%	0.777	78%	0.777	S	S	*	*			cis	-159.5	167.9	8.8	-147.7	-166.8	147.2	127.8	6.8	111.2
15	D	29.4	Very low	29.3	Very low	111 Å²	111	156.2 Å²	156.2	59%	0.594	78%	0.776	S	S	*	*			trans	5.4	146.9	150.6	-61.6	7.8	0	0	0	120.8
16	S	28.6	Very low	29.2	Very low	101 Å²	101	154 Å²	154	71%	0.706	78%	0.776	S	S	*	*			cis	-167.8	164.3	-1.4	50.7	0	0	0	0	113.6
17	S	29.1	Very low	29.4	Very low	105 Å²	105	153.1 Å²	153.1	73%	0.734	77%	0.771	S	S	*	*			trans	68.8	164.3	164	75.2	0	0	0	0	119.7
18	T	31.4	Very low	30.1	Very low	130 Å²	130	153 Å²	153	80%	0.798	78%	0.779	S	S	*	*				175.2	147.4	-74	42	0	0	0	0	110.5
19	V	30.5	Very low	29.9	Very low	120 Å²	120	152.9 Å²	152.9	73%	0.727	78%	0.784	S	S	*	*			trans	96.5	108.6	149.1	161.3	0	0	0	0	123.1
20	R	29.7	Very low	29.7	Very low	219 Å²	219	153.6 Å²	153.6	83%	0.826	79%	0.788	S	S	*	*			trans	67.9	109.1	136.4	-66.3	179.3	-177.9	160.3	-1.9	126
21	N	31.3	Very low	29.7	Very low	151 Å²	151	147.5 Å²	147.5	81%	0.807	78%	0.776	S	S	*	*				49.2	116.1	107.9	-66.9	-3	0	0	0	125.2
22	R	32	Very low	29.6	Very low	234 Å²	234	148.4 Å²	148.4	88%	0.883	78%	0.78	S	S	*	*				70.2	118.6	115.3	-157.9	-174.5	-160.7	-166.6	7.5	122.7
23	K	25.9	Very low	29.5	Very low	198 Å²	198	147.9 Å²	147.9	86%	0.861	78%	0.781	S	S	*	*			trans	-162.2	157.4	149.8	-96.5	160.5	-179.2	178	0	108
24	V	28.2	Very low	29.2	Very low	129 Å²	129	146.9 Å²	146.9	78%	0.782	78%	0.779	S	S	*	*			cis	111	134.4	7.3	176.3	0	0	0	0	115.1
25	F	32.8	Very low	29.7	Very low	192 Å²	192	142.1 Å²	142.1	84%	0.842	78%	0.775	S	S	*	*			trans	-81.1	166.9	-171.8	-76.1	-90.7	0	0	0	115.6
26	P	37.4	Very low	29.5	Very low	124 Å²	124	143.5 Å²	143.5	81%	0.805	78%	0.78	S	S	*	*				-148.7	176.6	100.5	40.8	-24.5	0	0	0	117.1
27	S	27.1	Very low	29.3	Very low	109 Å²	109	144.4 Å²	144.4	76%	0.762	78%	0.782	S	S	*	*			trans	-102.6	-163.8	168.2	-43.9	0	0	0	0	110.2
28	P	45.5	Very low	29.7	Very low	126 Å²	126	144.2 Å²	144.2	82%	0.818	78%	0.778	S	S	*	*			cis	-139.2	-178.2	-4.3	44.5	-26.9	0	0	0	116.4
29	A	25.1	Very low	29.3	Very low	101 Å²	101	147 Å²	147	84%	0.835	78%	0.782	S	S	*	*			trans	-167.9	167.3	155.6	0	0	0	0	0	113.7
30	Q	24.8	Very low	29	Very low	183 Å²	183	146.4 Å²	146.4	86%	0.855	78%	0.783	S	S	*	*			trans	-104.6	-178.3	172.5	-63	169.2	-28.2	0	0	109.6
31	T	24.1	Very low	28.9	Very low	105 Å²	105	145.4 Å²	145.4	64%	0.644	79%	0.785	S	S	*	*			cis	-166.8	167.8	24.6	-28.4	0	0	0	0	111.9
32	H	26	Very low	28.7	Very low	158 Å²	158	146.4 Å²	146.4	73%	0.731	79%	0.789	S	S	*	*			trans	81.2	130.4	151.1	-77	-59.2	0	0	0	124.8
33	Q	25.1	Very low	28.4	Very low	175 Å²	175	144.3 Å²	144.3	82%	0.818	79%	0.786	S	S	*	*			trans	77.5	115.3	136.9	-73.7	172.3	-12.9	0	0	123.2
34	S	22.5	Very low	28.4	Very low	107 Å²	107	146.3 Å²	146.3	75%	0.748	79%	0.788	S	S	*	*			trans	-73.9	174.5	150.7	56.5	0	0	0	0	110.6
35	P	36.3	Very low	28.2	Very low	106 Å²	106	147 Å²	147	69%	0.688	79%	0.787	S	S	*	*			cis	-159.2	-179.8	35.8	45.8	-22.6	0	0	0	121.5
36	I	25.4	Very low	27.9	Very low	140 Å²	140	146 Å²	146	72%	0.718	79%	0.79	S	S	*	*			trans	74.2	105.3	137.3	-80.6	163.2	0	0	0	122.3
37	T	25.3	Very low	27.3	Very low	121 Å²	121	146.4 Å²	146.4	74%	0.742	79%	0.791	S	S	*	*			trans	70	175.1	136.1	69.4	0	0	0	0	120.7
38	P	36.7	Very low	27.7	Very low	100 Å²	100	146.7 Å²	146.7	65%	0.649	79%	0.791	S	S	*	*				-138.6	-177	-62.4	42.7	-27.1	0	0	0	114.6
39	E	24.3	Very low	26.6	Very low	190 Å²	190	145.9 Å²	145.9	89%	0.888	79%	0.787	S	S	*	*			trans	63.2	171.6	165.1	-54	-162.2	131.8	0	0	115.3
40	S	24.6	Very low	26.7	Very low	107 Å²	107	145.8 Å²	145.8	75%	0.748	78%	0.78	S	S	*	*			cis	-140.5	176.7	3.3	69.9	0	0	0	0	112.6
41	K	26.6	Very low	26.7	Very low	198 Å²	198	145.2 Å²	145.2	86%	0.861	78%	0.782	S	S	*	*			trans	-72.5	151.9	179.8	-56	156.7	-176.8	162.1	0	111.6
42	I	27.7	Very low	26.7	Very low	172 Å²	172	143.5 Å²	143.5	88%	0.882	79%	0.786	S	S	*	*			trans	-159.2	144.1	133.8	-104.1	148.4	0	0	0	110
43	K	25.8	Very low	26.7	Very low	190 Å²	190	141.5 Å²	141.5	83%	0.826	79%	0.79	S	S	*	*			trans	-98.8	145.7	166.5	-73.6	-175.2	172.7	-169.3	0	109.2
44	R	24.5	Very low	26.8	Very low	240 Å²	240	139.4 Å²	139.4	91%	0.906	80%	0.795	S	S	*	*				-161.2	148.6	127.9	-111.2	165.8	-171.2	172.4	2.5	111
45	D	25.2	Very low	26.9	Very low	143 Å²	143	137.4 Å²	137.4	77%	0.765	79%	0.791	S	S	*	*			trans	-77.6	144.1	174.5	-46.8	-91.9	0	0	0	109.9
46	D	25.3	Very low	26.4	Very low	170 Å²	170	140.3 Å²	140.3	91%	0.909	80%	0.801	S	S	*	*			trans	-157.3	128.1	151.2	-96.7	-39.6	0	0	0	109.3
47	T	25.7	Very low	26.3	Very low	133 Å²	133	143.2 Å²	143.2	82%	0.816	81%	0.808	S	S	*	*			trans	-119.3	145.3	170.3	25.2	0	0	0	0	107.1
48	P	35.7	Very low	26.4	Very low	116 Å²	116	142.3 Å²	142.3	75%	0.753	81%	0.807	S	S	*	*				-154.6	-164.3	65.4	40.1	-17.9	0	0	0	116.8
49	C	22.5	Very low	25.9	Very low	109 Å²	109	141.3 Å²	141.3	74%	0.736	81%	0.807	S	S	*	*			trans	80.7	78.2	157.9	-66.3	0	0	0	0	120.5
50	S	27.2	Very low	26.1	Very low	98 Å²	98	143.5 Å²	143.5	69%	0.685	81%	0.807	S	S	*	*				30.2	111.3	120.7	60.1	0	0	0	0	120.7
51	N	24.4	Very low	26.4	Very low	171 Å²	171	142.3 Å²	142.3	91%	0.914	80%	0.804	S	S	*	*				175	163.8	111.5	-90.7	-22.9	0	0	0	111.7
52	G	24.2	Very low	26.5	Very low	70 Å²	70	137.5 Å²	137.5	72%	0.722	80%	0.795	S	S	*	*			trans	106.6	68.7	159.7	0	0	0	0	0	117.5
53	S	25.7	Very low	27.1	Very low	115 Å²	115	135.3 Å²	135.3	80%	0.804	79%	0.79	S	S	*	*			trans	-9.4	118.5	154.5	53.8	0	0	0	0	119.2
54	S	27.9	Very low	28.1	Very low	132 Å²	132	131.6 Å²	131.6	92%	0.923	78%	0.779	S	S	*	*			trans	-177.3	105.6	131.5	-80.7	0	0	0	0	110.3
55	G	24	Very low	29.6	Very low	65 Å²	65	125.2 Å²	125.2	67%	0.67	77%	0.767	S	S	*	*			trans	-165.4	123.4	177.3	0	0	0	0	0	111.7	F57	G55-F57 PolarHBondContact O-N 3.17Å
56	D	26.6	Very low	31.4	Very low	167 Å²	167	120.1 Å²	120.1	89%	0.893	74%	0.742	S	S	*	*			trans	-61.5	115.3	-177.3	-73.5	-60.7	0	0	0	111.6	S58	D56-S58 PolarHBondContact O-N 2.83Å
57	F	23	Very low	34	Very low	200 Å²	200	115.5 Å²	115.5	88%	0.877	72%	0.717	S	S	*	*			trans	-78.4	59.9	-179.7	-120.9	-90.3	0	0	0	111.7	G55 A59	G55-F57 PolarHBondContact O-N 3.17Å; F57-A59 HydrophobicContact CD1-CB 4.25Å; F57-A59 PolarHBondContact O-N 2.81Å
58	S	26.4	Very low	36.8	Very low	103 Å²	103	116.1 Å²	116.1	72%	0.72	71%	0.71	S	S	*	*			trans	-72.3	64.7	167.2	-162.4	0	0	0	0	110.1	D56 R60	D56-S58 PolarHBondContact O-N 2.83Å; S58-R60 VanDerWaalsContact C-N 3.27Å; S58-R60 PolarHBondContact O-N 2.81Å
59	A	27.6	Very low	39.5	Very low	79 Å²	79	116.3 Å²	116.3	65%	0.653	70%	0.704	S	S	*	*			trans	-66.4	88.2	173.1	0	0	0	0	0	109	F57 A61	F57-A59 HydrophobicContact CD1-CB 4.25Å; F57-A59 PolarHBondContact O-N 2.81Å; A59-A61 VanDerWaalsContact C-N 3.28Å; A59-A61 PolarHBondContact O-N 3.04Å
60	R	28.8	Very low	42.7	Very low	235 Å²	235	113.3 Å²	113.3	89%	0.887	68%	0.681	S	S	*	*			trans	-61.3	91.8	167.7	-76	-178.6	172.3	176.9	-1.7	108.7	S58 S62	S58-R60 VanDerWaalsContact C-N 3.27Å; S58-R60 PolarHBondContact O-N 2.81Å; R60-S62 PolarHBondContact O-N 2.84Å
61	A	30.4	Very low	45.9	Very low	83 Å²	83	110.6 Å²	110.6	69%	0.686	66%	0.658	S	S	*	*			trans	-56	112.9	164.8	0	0	0	0	0	108.2	A59 V63	A59-A61 VanDerWaalsContact C-N 3.28Å; A59-A61 PolarHBondContact O-N 3.04Å; A61-V63 PolarHBondContact O-N 3.07Å
62	S	28.6	Very low	49.2	Very low	96 Å²	96	107.9 Å²	107.9	67%	0.671	64%	0.643	S	S	*	*			trans	-62.9	120.6	171.6	44.5	0	0	0	0	108.1	R60 D64	R60-S62 PolarHBondContact O-N 2.84Å; S62-D64 PolarHBondContact O-N 2.94Å
63	V	40.5	Very low	52.6	Low	126 Å²	126	107.9 Å²	107.9	76%	0.764	63%	0.629	S	S	*	*			trans	-73.7	99.2	169.2	178.9	0	0	0	0	106.2	A61 T65	A61-V63 PolarHBondContact O-N 3.07Å; V63-T65 PolarHBondContact O-N 2.57Å
64	D	46.6	Very low	56	Low	112 Å²	112	102.6 Å²	102.6	60%	0.599	59%	0.592	S	S	*	*			trans	-60.4	102.3	175.8	-74.6	-19.6	0	0	0	109.1	S62	S62-D64 PolarHBondContact O-N 2.94Å
65	T	56.3	Low	59.2	Low	106 Å²	106	98.6 Å²	98.6	65%	0.65	56%	0.562	S	S	*	*			trans	-55.6	141.9	179.1	28.1	0	0	0	0	110.3	V63 N67	V63-T65 PolarHBondContact O-N 2.57Å; T65-N67 PolarHBondContact O-N 3.29Å; T65-N67 VanDerWaalsContact O-N 3.17Å
66	P	62	Low	62.7	Low	37 Å²	37	97.5 Å²	97.5	24%	0.24	55%	0.55	C	S	.	*			trans	-45.5	126.2	171.8	-25.6	31.8	0	0	0	110.9	Q68 Q174	P66-Q68 VanDerWaalsContact C-N 3.34Å; P66-Q68 WeakPolarHBondContact O-CG 3.39Å; P66-Q68 PolarHBondContact O-N 3.2Å; P66-Q174 VanDerWaalsContact CA-NE2 3.34Å
67	N	80.4	Confident	66.1	Low	73 Å²	73	93.2 Å²	93.2	39%	0.39	53%	0.527	S	S	.	.			trans	-61.8	101.1	172.6	-180	-18.6	0	0	0	107.5	T65 L69 L70 L71	T65-N67 PolarHBondContact O-N 3.29Å; T65-N67 VanDerWaalsContact O-N 3.17Å; N67-L69 PolarHBondContact O-N 2.66Å; N67-L69 VanDerWaalsContact O-N 3.14Å; N67-L69 PolarHBondContact OD1-N 2.96Å; N67-L70 HydrophobicContact CB-CB 4.35Å; N67-L70 HydrophobicContact CB-CD1 4.09Å; N67-L70 HydrophobicContact CB-CG 4.2Å; N67-L70 PolarHBondContact O-N 3.33Å; N67-L71 PolarHBondContact O-N 3.13Å; N67-L71 VanDerWaalsContact O-N 3.13Å
68	Q	84.8	Confident	69.6	Low	145 Å²	145	83.7 Å²	83.7	68%	0.678	49%	0.485	S	S	*	.	H	α-helix	trans	-59.5	-33.8	-166.5	-63.3	-179.7	-6.4	0	0	111.4	P66 L71 I72	P66-Q68 VanDerWaalsContact C-N 3.34Å; P66-Q68 WeakPolarHBondContact O-CG 3.39Å; P66-Q68 PolarHBondContact O-N 3.2Å; Q68-L71 PolarHBondContact O-N 2.61Å; Q68-I72 WeakPolarHBondContact O-CB 3.27Å; Q68-I72 WeakPolarHBondContact O-CD1 3.36Å; Q68-I72 WeakPolarHBondContact O-CG1 3.36Å; Q68-I72 PolarHBondContact O-N 3.41Å
69	L	90.9	Very high	73	Confident	120 Å²	120	81.4 Å²	81.4	63%	0.628	46%	0.462	S	S	*	.	H	α-helix	trans	-62.4	-45	175.3	-177.5	62	0	0	0	112.2	N67 I72 V73	N67-L69 PolarHBondContact O-N 2.66Å; N67-L69 VanDerWaalsContact O-N 3.14Å; N67-L69 PolarHBondContact OD1-N 2.96Å; L69-I72 PolarHBondContact O-N 2.77Å; L69-V73 WeakPolarHBondContact O-CG2 3.33Å; L69-V73 PolarHBondContact O-N 3.07Å
70	L	91.6	Very high	76.3	Confident	47 Å²	47	80.6 Å²	80.6	25%	0.246	46%	0.456	C	S	.	.	H	α-helix	trans	-64.8	-41.2	176.9	-67.4	-179.3	0	0	0	111.5	N67 V73 V74 H180	N67-L70 HydrophobicContact CB-CB 4.35Å; N67-L70 HydrophobicContact CB-CD1 4.09Å; N67-L70 HydrophobicContact CB-CG 4.2Å; N67-L70 PolarHBondContact O-N 3.33Å; L70-V73 PolarHBondContact O-N 2.88Å; L70-V74 WeakPolarHBondContact O-CB 3.33Å; L70-V74 VanDerWaalsContact O-CG2 3.32Å; L70-V74 WeakPolarHBondContact O-CG2 3.49Å; L70-V74 PolarHBondContact O-N 3.48Å; L70-H180 HydrophobicContact CD1-CB 4.31Å
71	L	93.1	Very high	79.4	Confident	40 Å²	40	70 Å²	70	21%	0.209	42%	0.417	C	S	.	.	H	α-helix	trans	-65.6	-38	177.7	-176.5	61.2	0	0	0	112.1	N67 Q68 T75 I167 Y170 L171	N67-L71 PolarHBondContact O-N 3.13Å; N67-L71 VanDerWaalsContact O-N 3.13Å; Q68-L71 PolarHBondContact O-N 2.61Å; L71-T75 VanDerWaalsContact O-CB 3.3Å; L71-T75 WeakPolarHBondContact O-CB 3.29Å; L71-T75 PolarHBondContact O-N 3.21Å; L71-T75 PolarHBondContact O-OG1 2.95Å; L71-I167 HydrophobicContact CD1-CG2 4.14Å; L71-Y170 HydrophobicContact CD1-CD1 3.86Å; L71-Y170 HydrophobicContact CD1-CE1 4.18Å; L71-L171 HydrophobicContact CD1-CD2 4.21Å; L71-L171 HydrophobicContact CD1-CG 4.42Å; L71-L171 HydrophobicContact CD2-CD2 4.28Å
72	I	94.6	Very high	82.6	Confident	114 Å²	114	66.1 Å²	66.1	59%	0.585	39%	0.385	S	S	*	.	H	α-helix	trans	-64.5	-44.8	173.8	-71.3	163.3	0	0	0	110.8	Q68 L69 T75 G76	Q68-I72 WeakPolarHBondContact O-CB 3.27Å; Q68-I72 WeakPolarHBondContact O-CD1 3.36Å; Q68-I72 WeakPolarHBondContact O-CG1 3.36Å; Q68-I72 PolarHBondContact O-N 3.41Å; L69-I72 PolarHBondContact O-N 2.77Å; I72-T75 PolarHBondContact O-N 3.05Å; I72-G76 PolarHBondContact O-N 2.99Å
73	V	95.2	Very high	85.8	Confident	71 Å²	71	65.1 Å²	65.1	43%	0.43	37%	0.372	S	S	.	.	H	α-helix	trans	-64	-46.1	177.3	170.4	0	0	0	0	111.6	L69 L70 T75 G76 L77	L69-V73 WeakPolarHBondContact O-CG2 3.33Å; L69-V73 PolarHBondContact O-N 3.07Å; L70-V73 PolarHBondContact O-N 2.88Å; V73-T75 VanDerWaalsContact C-N 3.3Å; V73-T75 PolarHBondContact O-N 2.9Å; V73-G76 PolarHBondContact O-N 3.46Å; V73-L77 HydrophobicContact CG1-CD1 3.83Å; V73-L77 HydrophobicContact CG1-CG 4.39Å; V73-L77 WeakPolarHBondContact O-CB 3.33Å; V73-L77 WeakPolarHBondContact O-CG 3.35Å; V73-L77 PolarHBondContact O-N 2.89Å
74	V	96	Very high	88.4	Confident	4 Å²	4	64.9 Å²	64.9	2%	0.024	36%	0.358	C	S	.	.	H	α-helix	trans	-58.3	-42.5	174.4	163.2	0	0	0	0	111.2	L70 S78 I167 Y170 L184 A187 I191	L70-V74 WeakPolarHBondContact O-CB 3.33Å; L70-V74 VanDerWaalsContact O-CG2 3.32Å; L70-V74 WeakPolarHBondContact O-CG2 3.49Å; L70-V74 PolarHBondContact O-N 3.48Å; V74-S78 WeakPolarHBondContact O-CB 3.48Å; V74-S78 PolarHBondContact O-N 3.24Å; V74-I167 HydrophobicContact CG1-CG1 4.49Å; V74-Y170 HydrophobicContact CG1-CG 4.47Å; V74-Y170 HydrophobicContact CG2-CD2 4.02Å; V74-Y170 HydrophobicContact CG2-CE2 4.3Å; V74-L184 HydrophobicContact CG2-CD1 4.25Å; V74-A187 HydrophobicContact CG1-CB 3.87Å; V74-A187 HydrophobicContact CG2-CB 3.82Å; V74-I191 HydrophobicContact CG1-CD1 4.23Å
75	T	96.9	Very high	90.5	Very high	48 Å²	48	63 Å²	63	29%	0.294	34%	0.344	S	S	.	.	H	α-helix	trans	-63.9	-51.9	177.1	-60.6	0	0	0	0	111.1	L71 I72 V73 L77 S78 F79 I167	L71-T75 VanDerWaalsContact O-CB 3.3Å; L71-T75 WeakPolarHBondContact O-CB 3.29Å; L71-T75 PolarHBondContact O-N 3.21Å; L71-T75 PolarHBondContact O-OG1 2.95Å; I72-T75 PolarHBondContact O-N 3.05Å; V73-T75 VanDerWaalsContact C-N 3.3Å; V73-T75 PolarHBondContact O-N 2.9Å; T75-L77 PolarHBondContact O-N 3.24Å; T75-S78 PolarHBondContact O-N 2.91Å; T75-F79 HydrophobicContact CG2-CD2 4.09Å; T75-F79 HydrophobicContact CG2-CE2 4.23Å; T75-F79 WeakPolarHBondContact O-CD2 3.36Å; T75-F79 PolarHBondContact O-N 3.37Å; T75-F79 VanDerWaalsContact O-N 3.08Å; T75-I167 HydrophobicContact CG2-CD1 3.81Å
76	G	97.2	Very high	92.1	Very high	42 Å²	42	59.2 Å²	59.2	43%	0.433	32%	0.32	S	S	.	.	H	α-helix	trans	-57.8	-46.8	179.9	0	0	0	0	0	112.7	I72 V73 A80	I72-G76 PolarHBondContact O-N 2.99Å; V73-G76 PolarHBondContact O-N 3.46Å; G76-A80 WeakPolarHBondContact O-CB 3.29Å; G76-A80 PolarHBondContact O-N 3.04Å
77	L	96.8	Very high	93.5	Very high	77 Å²	77	61 Å²	61	40%	0.403	33%	0.33	S	S	.	.	H	α-helix	trans	-66.7	-38.7	177.8	-69.9	174.2	0	0	0	112.8	V73 T75 A80 T81 I191	V73-L77 HydrophobicContact CG1-CD1 3.83Å; V73-L77 HydrophobicContact CG1-CG 4.39Å; V73-L77 WeakPolarHBondContact O-CB 3.33Å; V73-L77 WeakPolarHBondContact O-CG 3.35Å; V73-L77 PolarHBondContact O-N 2.89Å; T75-L77 PolarHBondContact O-N 3.24Å; L77-A80 PolarHBondContact O-N 3.08Å; L77-T81 PolarHBondContact O-N 3.41Å; L77-T81 PolarHBondContact O-OG1 3.41Å; L77-T81 VanDerWaalsContact O-OG1 3.12Å; L77-I191 HydrophobicContact CB-CD1 4.1Å; L77-I191 HydrophobicContact CB-CG2 4.14Å
78	S	97.1	Very high	93.9	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-64.3	-43.5	179.1	-172.3	0	0	0	0	112.7	V74 T75 T81 R82 S163 P166	V74-S78 WeakPolarHBondContact O-CB 3.48Å; V74-S78 PolarHBondContact O-N 3.24Å; T75-S78 PolarHBondContact O-N 2.91Å; S78-T81 PolarHBondContact O-OG1 3.32Å; S78-R82 PolarHBondContact O-N 3.47Å; S78-S163 PolarHBondContact OG-O 3.4Å; S78-P166 VanDerWaalsContact OG-CD 3.31Å; S78-P166 WeakPolarHBondContact OG-CD 3.29Å; S78-P166 WeakPolarHBondContact OG-CG 3.22Å
79	F	97.3	Very high	94.1	Very high	54 Å²	54	53.8 Å²	53.8	24%	0.237	29%	0.294	C	S	.	.	H	α-helix	trans	-70.5	-41.9	173.9	-85.8	-98	0	0	0	111.9	T75 T81 R82 L83 M160 F164 I167	T75-F79 HydrophobicContact CG2-CD2 4.09Å; T75-F79 HydrophobicContact CG2-CE2 4.23Å; T75-F79 WeakPolarHBondContact O-CD2 3.36Å; T75-F79 PolarHBondContact O-N 3.37Å; T75-F79 VanDerWaalsContact O-N 3.08Å; F79-T81 PolarHBondContact O-N 2.95Å; F79-R82 PolarHBondContact O-N 2.71Å; F79-L83 HydrophobicContact CD1-CD1 3.95Å; F79-L83 WeakPolarHBondContact O-CB 3.2Å; F79-L83 WeakPolarHBondContact O-CG 3.43Å; F79-L83 PolarHBondContact O-N 3.36Å; F79-M160 HydrophobicContact CE1-CG 4.19Å; F79-F164 HydrophobicContact CZ-CE2 4Å; F79-F164 HydrophobicContact CZ-CZ 4.12Å; F79-I167 HydrophobicContact CD2-CD1 4.27Å; F79-I167 HydrophobicContact CE2-CD1 3.88Å
80	A	96.4	Very high	94	Very high	62 Å²	62	51.6 Å²	51.6	51%	0.512	29%	0.287	S	S	.	.	H	α-helix	trans	-61.9	-40.4	-179.5	0	0	0	0	0	112.9	G76 L77 Y84	G76-A80 WeakPolarHBondContact O-CB 3.29Å; G76-A80 PolarHBondContact O-N 3.04Å; L77-A80 PolarHBondContact O-N 3.08Å; A80-Y84 WeakPolarHBondContact O-CB 3.44Å; A80-Y84 PolarHBondContact O-N 3.01Å
81	T	95.8	Very high	93.9	Very high	14 Å²	14	50.5 Å²	50.5	9%	0.086	28%	0.281	C	S	.	.	H	α-helix	trans	-68.1	-48.2	176.2	50.5	0	0	0	0	111.9	L77 S78 F79 Y84 I191 Y733	L77-T81 PolarHBondContact O-N 3.41Å; L77-T81 PolarHBondContact O-OG1 3.41Å; L77-T81 VanDerWaalsContact O-OG1 3.12Å; S78-T81 PolarHBondContact O-OG1 3.32Å; F79-T81 PolarHBondContact O-N 2.95Å; T81-Y84 WeakPolarHBondContact O-CB 3.44Å; T81-Y84 PolarHBondContact O-N 3.17Å; T81-I191 HydrophobicContact CG2-CG2 4.09Å; T81-Y733 WeakPolarHBondContact CA-OH 3.39Å; T81-Y733 WeakPolarHBondContact CB-OH 3.36Å; T81-Y733 WeakPolarHBondContact O-CE1 3.46Å; T81-Y733 PolarHBondContact O-OH 2.91Å
82	R	95.9	Very high	93.8	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-76.5	-29.1	-172.5	-73.6	161.4	176.1	70.3	4.4	114.5	S78 F79 A159 G162 S163 L190 C196 I197 Q201	S78-R82 PolarHBondContact O-N 3.47Å; F79-R82 PolarHBondContact O-N 2.71Å; R82-A159 HydrophobicContact CB-CB 4.41Å; R82-G162 VanDerWaalsContact CD-C 3.47Å; R82-G162 WeakPolarHBondContact CD-O 3.28Å; R82-G162 PolarHBondContact NE-O 3.2Å; R82-G162 VanDerWaalsContact NE-O 3.14Å; R82-S163 WeakPolarHBondContact CB-OG 3.48Å; R82-L190 PolarHBondContact NH2-O 2.94Å; R82-C196 PolarHBondContact NH2-SG 3.32Å; R82-I197 HydrophobicContact CG-CG1 4.48Å; R82-I197 HydrophobicContact CG-CG2 4.33Å; R82-Q201 WeakPolarHBondContact O-CG 3.4Å; R82-Q201 PolarHBondContact O-NE2 2.8Å
83	L	95.8	Very high	93.5	Very high	75 Å²	75	43.2 Å²	43.2	39%	0.393	24%	0.243	S	C	.	.	H	α-helix	trans	-86.6	-8.4	175.6	-62.2	179.3	0	0	0	113.5	F79 K85 I86 A159	F79-L83 HydrophobicContact CD1-CD1 3.95Å; F79-L83 WeakPolarHBondContact O-CB 3.2Å; F79-L83 WeakPolarHBondContact O-CG 3.43Å; F79-L83 PolarHBondContact O-N 3.36Å; L83-K85 PolarHBondContact O-N 3.03Å; L83-I86 HydrophobicContact CD2-CD1 3.95Å; L83-A159 HydrophobicContact CD2-CB 3.84Å
84	Y	94.9	Very high	93.2	Very high	122 Å²	122	41.8 Å²	41.8	48%	0.478	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	132	175.7	-175	-110.4	0	0	0	111.5	A80 T81 I86 Q201 Y733	A80-Y84 WeakPolarHBondContact O-CB 3.44Å; A80-Y84 PolarHBondContact O-N 3.01Å; T81-Y84 WeakPolarHBondContact O-CB 3.44Å; T81-Y84 PolarHBondContact O-N 3.17Å; Y84-I86 PolarHBondContact O-N 3Å; Y84-I86 VanDerWaalsContact O-N 3.14Å; Y84-Q201 PolarHBondContact O-NE2 2.89Å; Y84-Y733 AromaticContact CD1-CD1 3.97Å; Y84-Y733 HydrophobicContact CD1-CD1 3.97Å; Y84-Y733 AromaticContact CD1-CD2 3.64Å; Y84-Y733 HydrophobicContact CD1-CD2 3.64Å; Y84-Y733 HydrophobicContact CD1-CE1 4.01Å; Y84-Y733 AromaticContact CD1-CE2 3.71Å; Y84-Y733 HydrophobicContact CD1-CE2 3.71Å; Y84-Y733 AromaticContact CD1-CG 3.81Å; Y84-Y733 HydrophobicContact CD1-CG 3.81Å; Y84-Y733 AromaticContact CD1-CZ 3.91Å; Y84-Y733 AromaticContact CE1-CD2 3.84Å; Y84-Y733 HydrophobicContact CE1-CD2 3.84Å; Y84-Y733 HydrophobicContact CE1-CE2 4.21Å; Y84-Y733 HydrophobicContact CE1-CG 4.15Å
85	K	91.1	Very high	92.7	Very high	72 Å²	72	42.5 Å²	42.5	31%	0.313	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.4	29.4	176.2	-78	-175	170	-104.6	0	116	L83 T87 E88	L83-K85 PolarHBondContact O-N 3.03Å; K85-T87 PolarHBondContact O-N 3.43Å; K85-E88 HydrophobicContact CB-CB 4.32Å; K85-E88 IonicContact NZ-OE1 2.72Å; K85-E88 PolarHBondContact NZ-OE1 3.49Å; K85-E88 IonicContact NZ-OE2 2.77Å; K85-E88 PolarHBondContact NZ-OE2 3.36Å; K85-E88 WeakPolarHBondContact O-CA 3.37Å; K85-E88 WeakPolarHBondContact O-CB 3.39Å; K85-E88 PolarHBondContact O-N 3.16Å; K85-E88 VanDerWaalsContact O-O 3.11Å
86	I	91.3	Very high	92.4	Very high	27 Å²	27	40.2 Å²	40.2	14%	0.138	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-20.8	-174.4	-158.5	154	0	0	0	116.1	L83 Y84 R155 A159	L83-I86 HydrophobicContact CD2-CD1 3.95Å; Y84-I86 PolarHBondContact O-N 3Å; Y84-I86 VanDerWaalsContact O-N 3.14Å; I86-R155 HydrophobicContact CD1-CB 4.22Å; I86-R155 HydrophobicContact CG1-CB 3.75Å; I86-R155 VanDerWaalsContact O-CD 3.3Å; I86-R155 WeakPolarHBondContact O-CD 3.45Å; I86-R155 PolarHBondContact O-NH1 2.74Å; I86-A159 HydrophobicContact CD1-CB 3.41Å; I86-A159 VanDerWaalsContact CD1-CB 3.41Å
87	T	89.9	Confident	92.1	Very high	75 Å²	75	38.8 Å²	38.8	46%	0.46	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.7	4.3	173.1	51.7	0	0	0	0	113.8	K85 Y151 W152	K85-T87 PolarHBondContact O-N 3.43Å; T87-Y151 WeakPolarHBondContact CA-OH 3.21Å; T87-Y151 PolarHBondContact O-OH 3.25Å; T87-W152 HydrophobicContact CG2-CB 4.28Å
88	E	89	Confident	91.8	Very high	66 Å²	66	39.9 Å²	39.9	31%	0.308	21%	0.206	S	C	.	.			trans	-113.6	134.2	171.7	-58.6	179.8	-141.7	0	0	108.7	K85 Y596	K85-E88 HydrophobicContact CB-CB 4.32Å; K85-E88 IonicContact NZ-OE1 2.72Å; K85-E88 PolarHBondContact NZ-OE1 3.49Å; K85-E88 IonicContact NZ-OE2 2.77Å; K85-E88 PolarHBondContact NZ-OE2 3.36Å; K85-E88 WeakPolarHBondContact O-CA 3.37Å; K85-E88 WeakPolarHBondContact O-CB 3.39Å; K85-E88 PolarHBondContact O-N 3.16Å; K85-E88 VanDerWaalsContact O-O 3.11Å; E88-Y596 WeakPolarHBondContact CB-OH 3.48Å
89	P	89.1	Confident	91.7	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.207	C	C	.	.	S	Bend	cis	-72	150.9	-10.4	27.7	-27.3	0	0	0	112.4	H91 R155 Y596 V598	P89-H91 PolarHBondContact O-N 3.28Å; P89-R155 PolarHBondContact O-NH1 3.16Å; P89-R155 PolarHBondContact O-NH2 3.18Å; P89-Y596 HydrophobicContact CB-CD1 3.58Å; P89-Y596 HydrophobicContact CB-CE1 3.64Å; P89-Y596 HydrophobicContact CB-CG 4.42Å; P89-Y596 HydrophobicContact CG-CD1 4.04Å; P89-Y596 HydrophobicContact CG-CE1 3.85Å; P89-V598 HydrophobicContact CG-CG2 4.15Å
90	P	89.8	Confident	91.5	Very high	74 Å²	74	37.7 Å²	37.7	48%	0.481	20%	0.196	S	C	.	.	S	Bend	trans	-78.7	35.3	174.3	35.3	-37.7	0	0	0	113.1	Y146	P90-Y146 PolarHBondContact O-N 2.67Å; P90-Y146 VanDerWaalsContact O-N 3.16Å
91	H	89.4	Confident	91.3	Very high	23 Å²	23	37.7 Å²	37.7	11%	0.106	18%	0.184	C	C	.	.	B	Isolated β-bridge	trans	-140.3	160.9	177.9	61.7	-126.8	0	0	0	111.1	P89 D144 K145 Y146 R155 S589 Y596	P89-H91 PolarHBondContact O-N 3.28Å; H91-D144 CarbonylContact C-O 3.6Å; H91-D144 WeakPolarHBondContact CA-O 3.47Å; H91-D144 VanDerWaalsContact CB-O 3.27Å; H91-D144 WeakPolarHBondContact CB-O 3.38Å; H91-K145 HydrophobicContact CB-CG 4.29Å; H91-Y146 VanDerWaalsContact C-CE2 3.4Å; H91-Y146 WeakPolarHBondContact O-CE2 3.48Å; H91-R155 PolarHBondContact O-NH2 3.36Å; H91-S589 PolarHBondContact CD2-OG 3.48Å; H91-Y596 PolarHBondContact NE2-O 3.46Å
92	V	90.1	Very high	91.2	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.185	C	C	.	.			trans	-66.5	126	-178.3	-178.5	0	0	0	0	110.9	E96 T97 F137 F139 P142 G143 D144 Y146	V92-E96 HydrophobicContact CG1-CB 3.92Å; V92-T97 HydrophobicContact CG1-CG2 3.52Å; V92-F137 HydrophobicContact CG2-CE1 3.49Å; V92-F137 VanDerWaalsContact CG2-CE1 3.49Å; V92-F137 HydrophobicContact CG2-CZ 3.75Å; V92-F139 HydrophobicContact CG1-CD1 4.15Å; V92-F139 HydrophobicContact CG2-CD1 4.03Å; V92-F139 HydrophobicContact CG2-CE1 4.34Å; V92-P142 CarbonylContact O-C 3.6Å; V92-P142 WeakPolarHBondContact O-CA 3.38Å; V92-G143 PolarHBondContact O-N 2.85Å; V92-D144 HydrophobicContact CB-CB 4.44Å; V92-D144 HydrophobicContact CG2-CB 4.03Å; V92-D144 WeakPolarHBondContact CG2-O 3.42Å; V92-D144 PolarHBondContact N-O 3.26Å; V92-Y146 HydrophobicContact CG2-CD1 4.41Å; V92-Y146 HydrophobicContact CG2-CE1 3.78Å; V92-Y146 HydrophobicContact CG2-CE2 4.26Å
93	C	89.5	Confident	91.1	Very high	1 Å²	1	37.9 Å²	37.9	1%	0.007	19%	0.185	C	C	.	.			trans	-94.9	153.7	171.7	-58.9	0	0	0	0	111.7	D95 E96 Y202 F588	C93-D95 PolarHBondContact O-N 2.92Å; C93-E96 HydrophobicContact CB-CG 4.17Å; C93-E96 PolarHBondContact N-OE2 2.62Å; C93-E96 WeakPolarHBondContact O-CA 3.32Å; C93-E96 WeakPolarHBondContact O-CB 3.34Å; C93-E96 WeakPolarHBondContact O-CG 3.36Å; C93-E96 PolarHBondContact O-N 2.89Å; C93-Y202 HydrophobicContact CB-CD1 4.03Å; C93-Y202 HydrophobicContact CB-CE1 4.39Å; C93-Y202 HydrophobicContact CB-CG 4.32Å; C93-Y202 VanDerWaalsContact SG-CE1 3.54Å; C93-F588 CarbonylContact C-O 3.55Å; C93-F588 WeakPolarHBondContact CA-O 3.36Å
94	W	87.3	Confident	91.1	Very high	42 Å²	42	34.5 Å²	34.5	16%	0.159	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	2.8	-97	174.6	-174.6	59.3	0	0	0	116.6	E96 T97 L586 F588 Y671 H673	W94-E96 VanDerWaalsContact C-N 3.34Å; W94-E96 PolarHBondContact O-N 3.11Å; W94-T97 WeakPolarHBondContact O-CG2 3.24Å; W94-T97 PolarHBondContact O-OG1 3.17Å; W94-L586 HydrophobicContact CD2-CD2 3.99Å; W94-L586 HydrophobicContact CE3-CD2 3.94Å; W94-L586 HydrophobicContact CH2-CD2 3.98Å; W94-L586 HydrophobicContact CZ2-CD2 3.93Å; W94-L586 HydrophobicContact CZ3-CD2 3.94Å; W94-F588 HydrophobicContact CB-CD2 4.23Å; W94-F588 HydrophobicContact CB-CG 4.45Å; W94-F588 HydrophobicContact CD2-CE2 4.24Å; W94-F588 HydrophobicContact CE3-CD2 4.35Å; W94-F588 AromaticContact CE3-CE2 3.58Å; W94-F588 HydrophobicContact CE3-CE2 3.58Å; W94-F588 AromaticContact CE3-CZ 3.9Å; W94-F588 HydrophobicContact CE3-CZ 3.9Å; W94-F588 HydrophobicContact CZ3-CE2 4.33Å; W94-F588 PolarHBondContact N-O 2.87Å; W94-Y671 HydrophobicContact CH2-CD2 4.24Å; W94-Y671 HydrophobicContact CH2-CG 4.46Å; W94-Y671 HydrophobicContact CZ2-CD2 4.01Å; W94-Y671 HydrophobicContact CZ2-CE2 4.24Å; W94-Y671 HydrophobicContact CZ2-CG 4.22Å; W94-H673 AromaticContact CH2-CE1 3.6Å; W94-H673 AromaticContact CH2-ND1 3.28Å; W94-H673 VanDerWaalsContact CH2-ND1 3.28Å; W94-H673 WeakPolarHBondContact CH2-ND1 3.02Å; W94-H673 AromaticContact CZ3-ND1 3.58Å
95	D	86.4	Confident	91	Very high	19 Å²	19	31.1 Å²	31.1	10%	0.102	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-4.5	-176.6	-103.2	14.1	0	0	0	114.5	C93 T97 H98 F99 L204	C93-D95 PolarHBondContact O-N 2.92Å; D95-T97 PolarHBondContact O-N 3.45Å; D95-H98 PolarHBondContact O-N 3.38Å; D95-H98 IonicContact OD1-CD2 2.8Å; D95-F99 HydrophobicContact CB-CD2 4.11Å; D95-F99 HydrophobicContact CB-CE2 3.85Å; D95-F99 WeakPolarHBondContact O-CD2 3.36Å; D95-F99 PolarHBondContact O-N 2.83Å; D95-F99 VanDerWaalsContact O-N 3.08Å; D95-F99 WeakPolarHBondContact OD2-CE2 3.38Å; D95-L204 HydrophobicContact CB-CD2 3.34Å
96	E	91.6	Very high	91.2	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-60.9	-30.5	170.4	-55.2	-166.2	132.7	0	0	110.5	V92 C93 W94 H98 G100 F139 Y146 R155 Y202 I203	V92-E96 HydrophobicContact CG1-CB 3.92Å; C93-E96 HydrophobicContact CB-CG 4.17Å; C93-E96 PolarHBondContact N-OE2 2.62Å; C93-E96 WeakPolarHBondContact O-CA 3.32Å; C93-E96 WeakPolarHBondContact O-CB 3.34Å; C93-E96 WeakPolarHBondContact O-CG 3.36Å; C93-E96 PolarHBondContact O-N 2.89Å; W94-E96 VanDerWaalsContact C-N 3.34Å; W94-E96 PolarHBondContact O-N 3.11Å; E96-H98 PolarHBondContact O-N 2.89Å; E96-G100 WeakPolarHBondContact O-CA 3.41Å; E96-G100 PolarHBondContact O-N 3.17Å; E96-F139 VanDerWaalsContact O-CD1 3.32Å; E96-F139 WeakPolarHBondContact O-CD1 3.39Å; E96-Y146 PolarHBondContact OE2-OH 3.25Å; E96-R155 IonicContact OE1-CZ 2.57Å; E96-R155 IonicContact OE1-NE 2.79Å; E96-R155 PolarHBondContact OE1-NE 3.36Å; E96-R155 IonicContact OE1-NH2 3.83Å; E96-R155 PolarHBondContact OE1-NH2 2.72Å; E96-R155 IonicContact OE2-CZ 2.71Å; E96-R155 IonicContact OE2-NE 3.62Å; E96-R155 IonicContact OE2-NH2 3.12Å; E96-R155 PolarHBondContact OE2-NH2 3.46Å; E96-Y202 WeakPolarHBondContact OE1-CA 3.41Å; E96-Y202 WeakPolarHBondContact OE1-CB 3.39Å; E96-Y202 WeakPolarHBondContact OE1-CD1 3.25Å; E96-I203 HydrophobicContact CB-CB 4.15Å; E96-I203 HydrophobicContact CG-CB 3.89Å; E96-I203 HydrophobicContact CG-CG1 4.38Å; E96-I203 WeakPolarHBondContact OE1-CG1 3.43Å; E96-I203 PolarHBondContact OE1-N 3.49Å
97	T	89.9	Confident	91.3	Very high	12 Å²	12	28.8 Å²	28.8	7%	0.074	14%	0.144	C	C	.	.	H	α-helix	trans	-52.6	-33.4	170.8	57.1	0	0	0	0	113.4	V92 W94 D95 K101 P142	V92-T97 HydrophobicContact CG1-CG2 3.52Å; W94-T97 WeakPolarHBondContact O-CG2 3.24Å; W94-T97 PolarHBondContact O-OG1 3.17Å; D95-T97 PolarHBondContact O-N 3.45Å; T97-K101 VanDerWaalsContact O-CB 3.31Å; T97-K101 WeakPolarHBondContact O-CB 3.48Å; T97-P142 HydrophobicContact CG2-CG 3.96Å
98	H	91	Very high	91.4	Very high	100 Å²	100	28.7 Å²	28.7	46%	0.463	14%	0.14	S	C	.	.	H	α-helix	trans	-91.9	-53.1	-179.7	-67.8	-53	0	0	0	111.1	D95 E96 M102	D95-H98 PolarHBondContact O-N 3.38Å; D95-H98 IonicContact OD1-CD2 2.8Å; E96-H98 PolarHBondContact O-N 2.89Å; H98-M102 HydrophobicContact CB-CE 4.45Å; H98-M102 WeakPolarHBondContact O-CG 3.17Å; H98-M102 PolarHBondContact O-N 2.92Å; H98-M102 VanDerWaalsContact O-N 3.1Å
99	F	93.6	Very high	91.6	Very high	8 Å²	8	29.1 Å²	29.1	4%	0.035	14%	0.139	C	C	.	.	H	α-helix	trans	-81	-30.7	-171	-54.7	-51.8	0	0	0	114	D95 M102 G103 I124 L204 L205	D95-F99 HydrophobicContact CB-CD2 4.11Å; D95-F99 HydrophobicContact CB-CE2 3.85Å; D95-F99 WeakPolarHBondContact O-CD2 3.36Å; D95-F99 PolarHBondContact O-N 2.83Å; D95-F99 VanDerWaalsContact O-N 3.08Å; D95-F99 WeakPolarHBondContact OD2-CE2 3.38Å; F99-M102 HydrophobicContact CD1-SD 4.03Å; F99-M102 HydrophobicContact CE1-SD 4.47Å; F99-M102 PolarHBondContact O-N 3.37Å; F99-G103 PolarHBondContact O-N 3.14Å; F99-I124 HydrophobicContact CB-CD1 4.24Å; F99-L204 HydrophobicContact CD2-CD2 4.18Å; F99-L204 HydrophobicContact CE2-CD2 4.44Å; F99-L205 HydrophobicContact CD1-CD1 3.75Å; F99-L205 HydrophobicContact CD1-CD2 4.41Å; F99-L205 HydrophobicContact CD1-CG 3.7Å; F99-L205 HydrophobicContact CD2-CG 4.19Å; F99-L205 HydrophobicContact CE1-CD1 3.4Å; F99-L205 VanDerWaalsContact CE1-CD1 3.4Å; F99-L205 HydrophobicContact CE1-CG 3.76Å; F99-L205 HydrophobicContact CE2-CG 4.2Å; F99-L205 HydrophobicContact CG-CD1 4.47Å; F99-L205 HydrophobicContact CG-CG 3.94Å; F99-L205 HydrophobicContact CZ-CD1 3.83Å; F99-L205 HydrophobicContact CZ-CG 4Å
100	G	93.1	Very high	91.6	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-62.8	-46.7	169.9	0	0	0	0	0	111.5	E96 M102 G103 S104 F139	E96-G100 WeakPolarHBondContact O-CA 3.41Å; E96-G100 PolarHBondContact O-N 3.17Å; G100-M102 PolarHBondContact O-N 2.96Å; G100-G103 CarbonylContact O-C 3.54Å; G100-G103 VanDerWaalsContact O-CA 3.24Å; G100-G103 WeakPolarHBondContact O-CA 3.49Å; G100-G103 PolarHBondContact O-N 3.13Å; G100-S104 PolarHBondContact O-N 2.89Å; G100-S104 PolarHBondContact O-OG 3.32Å; G100-F139 VanDerWaalsContact C-CD2 3.44Å; G100-F139 VanDerWaalsContact CA-CZ 3.49Å
101	K	93.4	Very high	91.7	Very high	61 Å²	61	26.9 Å²	26.9	27%	0.265	12%	0.124	S	C	.	.	H	α-helix	trans	-58.3	-43.4	175.8	-159	176.6	-157.8	136	0	113.2	T97 G103 S104 Y105 P138 F139	T97-K101 VanDerWaalsContact O-CB 3.31Å; T97-K101 WeakPolarHBondContact O-CB 3.48Å; K101-G103 VanDerWaalsContact C-N 3.26Å; K101-G103 PolarHBondContact O-N 2.88Å; K101-S104 WeakPolarHBondContact O-CB 3.42Å; K101-S104 PolarHBondContact O-N 3.49Å; K101-Y105 HydrophobicContact CD-CE2 4.43Å; K101-Y105 WeakPolarHBondContact CE-OH 3.28Å; K101-Y105 HydrophobicContact CG-CE2 4Å; K101-Y105 WeakPolarHBondContact O-CD2 3.43Å; K101-Y105 PolarHBondContact O-N 3.25Å; K101-P138 VanDerWaalsContact CE-O 3.23Å; K101-P138 WeakPolarHBondContact CE-O 3.32Å; K101-P138 PolarHBondContact NZ-O 3.32Å; K101-P138 VanDerWaalsContact NZ-O 3.13Å; K101-F139 HydrophobicContact CB-CB 3.75Å; K101-F139 HydrophobicContact CB-CD2 4.31Å; K101-F139 HydrophobicContact CB-CG 4.29Å; K101-F139 HydrophobicContact CD-CB 4.49Å; K101-F139 HydrophobicContact CG-CB 4.18Å; K101-F139 VanDerWaalsContact N-CD2 3.32Å; K101-F139 PolarHBondContact NZ-O 2.94Å
102	M	94.1	Very high	91.7	Very high	19 Å²	19	26.1 Å²	26.1	9%	0.094	12%	0.121	C	C	.	.	H	α-helix	trans	-65.1	-32.6	173.6	-68	170.6	-168.7	0	0	111.6	H98 F99 G100 Y105 Y106 F112 D114 K121	H98-M102 HydrophobicContact CB-CE 4.45Å; H98-M102 WeakPolarHBondContact O-CG 3.17Å; H98-M102 PolarHBondContact O-N 2.92Å; H98-M102 VanDerWaalsContact O-N 3.1Å; F99-M102 HydrophobicContact CD1-SD 4.03Å; F99-M102 HydrophobicContact CE1-SD 4.47Å; F99-M102 PolarHBondContact O-N 3.37Å; G100-M102 PolarHBondContact O-N 2.96Å; M102-Y105 PolarHBondContact O-N 3.38Å; M102-Y106 WeakPolarHBondContact O-CD2 3.49Å; M102-Y106 PolarHBondContact O-N 3.1Å; M102-F112 HydrophobicContact CB-CE1 4.44Å; M102-F112 HydrophobicContact CB-CE2 3.9Å; M102-F112 HydrophobicContact CB-CZ 3.75Å; M102-F112 HydrophobicContact CG-CD2 4.01Å; M102-F112 HydrophobicContact CG-CE2 3.5Å; M102-F112 VanDerWaalsContact CG-CE2 3.5Å; M102-F112 HydrophobicContact CG-CZ 3.9Å; M102-F112 HydrophobicContact SD-CE2 3.92Å; M102-D114 HydrophobicContact CE-CB 3.92Å; M102-D114 WeakPolarHBondContact CE-OD1 3.28Å; M102-D114 HydrophobicContact SD-CB 4.15Å; M102-K121 HydrophobicContact CB-CD 4.34Å; M102-K121 HydrophobicContact SD-CD 3.84Å; M102-K121 PolarHBondContact SD-NZ 3.21Å
103	G	93.9	Very high	91.7	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-59.7	-50.4	168.6	0	0	0	0	0	112.4	F99 G100 K101 Y105 Y106 I107	F99-G103 PolarHBondContact O-N 3.14Å; G100-G103 CarbonylContact O-C 3.54Å; G100-G103 VanDerWaalsContact O-CA 3.24Å; G100-G103 WeakPolarHBondContact O-CA 3.49Å; G100-G103 PolarHBondContact O-N 3.13Å; K101-G103 VanDerWaalsContact C-N 3.26Å; K101-G103 PolarHBondContact O-N 2.88Å; G103-Y105 VanDerWaalsContact C-N 3.27Å; G103-Y105 PolarHBondContact O-N 3.21Å; G103-Y106 PolarHBondContact O-N 3.27Å; G103-Y106 VanDerWaalsContact O-N 3.14Å; G103-I107 PolarHBondContact O-N 2.94Å
104	S	93.9	Very high	91.7	Very high	4 Å²	4	29 Å²	29	3%	0.028	13%	0.134	C	C	.	.	H	α-helix	trans	-54.5	-41.8	173.4	-43.3	0	0	0	0	111.9	G100 K101 Y106 I107 N108 Y133	G100-S104 PolarHBondContact O-N 2.89Å; G100-S104 PolarHBondContact O-OG 3.32Å; K101-S104 WeakPolarHBondContact O-CB 3.42Å; K101-S104 PolarHBondContact O-N 3.49Å; S104-Y106 PolarHBondContact O-N 3.36Å; S104-I107 PolarHBondContact O-N 3.11Å; S104-N108 WeakPolarHBondContact O-CB 3.4Å; S104-N108 PolarHBondContact O-N 3.36Å; S104-N108 PolarHBondContact O-ND2 3.36Å; S104-Y133 PolarHBondContact OG-OH 3.39Å
105	Y	93.8	Very high	91.8	Very high	50 Å²	50	27.8 Å²	27.8	20%	0.196	13%	0.132	C	C	.	.	H	α-helix	trans	-64.9	-31.7	178.9	-65.5	-31.8	0	0	0	114.2	K101 M102 G103 R109 T110 F112 P321	K101-Y105 HydrophobicContact CD-CE2 4.43Å; K101-Y105 WeakPolarHBondContact CE-OH 3.28Å; K101-Y105 HydrophobicContact CG-CE2 4Å; K101-Y105 WeakPolarHBondContact O-CD2 3.43Å; K101-Y105 PolarHBondContact O-N 3.25Å; M102-Y105 PolarHBondContact O-N 3.38Å; G103-Y105 VanDerWaalsContact C-N 3.27Å; G103-Y105 PolarHBondContact O-N 3.21Å; Y105-R109 WeakPolarHBondContact O-CA 3.23Å; Y105-R109 PolarHBondContact O-N 3.1Å; Y105-T110 VanDerWaalsContact CA-OG1 3.25Å; Y105-T110 WeakPolarHBondContact CA-OG1 3.36Å; Y105-T110 WeakPolarHBondContact CB-OG1 3.34Å; Y105-T110 WeakPolarHBondContact CD1-OG1 3.29Å; Y105-T110 PolarHBondContact O-N 3.45Å; Y105-T110 PolarHBondContact O-OG1 3.43Å; Y105-F112 VanDerWaalsContact CB-CD1 3.47Å; Y105-F112 HydrophobicContact CD2-CB 3.73Å; Y105-F112 AromaticContact CD2-CD1 3.72Å; Y105-F112 HydrophobicContact CD2-CD1 3.72Å; Y105-F112 HydrophobicContact CD2-CD2 4.34Å; Y105-F112 HydrophobicContact CD2-CE1 4.4Å; Y105-F112 AromaticContact CD2-CG 3.67Å; Y105-F112 HydrophobicContact CD2-CG 3.67Å; Y105-F112 HydrophobicContact CE2-CB 4.17Å; Y105-F112 HydrophobicContact CE2-CG 4.46Å; Y105-F112 HydrophobicContact CG-CB 4.44Å; Y105-F112 HydrophobicContact CG-CD1 4.01Å; Y105-F112 HydrophobicContact CG-CG 4.38Å; Y105-P321 HydrophobicContact CE1-CG 4.48Å; Y105-P321 HydrophobicContact CE2-CG 4Å; Y105-P321 WeakPolarHBondContact OH-CG 3.39Å
106	Y	95.1	Very high	92.1	Very high	12 Å²	12	28.3 Å²	28.3	5%	0.047	13%	0.134	C	C	.	.	H	α-helix	trans	-69.9	-40.1	171.7	-77.6	-71.6	0	0	0	112.9	M102 G103 S104 R109 F112 P118 K121 M122 A125 H311 L314 L315	M102-Y106 WeakPolarHBondContact O-CD2 3.49Å; M102-Y106 PolarHBondContact O-N 3.1Å; G103-Y106 PolarHBondContact O-N 3.27Å; G103-Y106 VanDerWaalsContact O-N 3.14Å; S104-Y106 PolarHBondContact O-N 3.36Å; Y106-R109 VanDerWaalsContact O-CG 3.32Å; Y106-R109 WeakPolarHBondContact O-CG 3.27Å; Y106-R109 PolarHBondContact O-N 2.92Å; Y106-F112 HydrophobicContact CD2-CE1 4.15Å; Y106-F112 HydrophobicContact CD2-CZ 4.37Å; Y106-F112 AromaticContact CE2-CE1 3.71Å; Y106-F112 HydrophobicContact CE2-CE1 3.71Å; Y106-F112 AromaticContact CE2-CZ 3.6Å; Y106-F112 HydrophobicContact CE2-CZ 3.6Å; Y106-F112 AromaticContact CZ-CE1 3.92Å; Y106-F112 AromaticContact CZ-CZ 3.9Å; Y106-P118 WeakPolarHBondContact OH-CB 3.49Å; Y106-K121 HydrophobicContact CD2-CB 4.34Å; Y106-K121 HydrophobicContact CE2-CB 3.57Å; Y106-M122 HydrophobicContact CD1-CG 3.83Å; Y106-M122 HydrophobicContact CD2-CG 4.29Å; Y106-M122 HydrophobicContact CE1-CG 3.37Å; Y106-M122 HydrophobicContact CE1-SD 3.93Å; Y106-M122 HydrophobicContact CE2-CG 3.89Å; Y106-M122 HydrophobicContact CG-CG 4.28Å; Y106-M122 VanDerWaalsContact CZ-CG 3.41Å; Y106-A125 HydrophobicContact CD2-CB 4.1Å; Y106-A125 HydrophobicContact CG-CB 4.13Å; Y106-H311 AromaticContact CE1-ND1 3.62Å; Y106-H311 AromaticContact CZ-ND1 3.64Å; Y106-H311 PolarHBondContact OH-ND1 3.42Å; Y106-L314 HydrophobicContact CD1-CB 4.44Å; Y106-L314 HydrophobicContact CD1-CD1 4.25Å; Y106-L315 HydrophobicContact CD1-CD1 4.31Å; Y106-L315 HydrophobicContact CD1-CD2 3.48Å; Y106-L315 VanDerWaalsContact CD1-CD2 3.48Å; Y106-L315 HydrophobicContact CD1-CG 3.9Å; Y106-L315 HydrophobicContact CE1-CD1 3.82Å; Y106-L315 HydrophobicContact CE1-CD2 3.86Å; Y106-L315 HydrophobicContact CE1-CG 3.75Å; Y106-L315 HydrophobicContact CG-CD2 4.14Å
107	I	93.5	Very high	92.3	Very high	38 Å²	38	28.3 Å²	28.3	20%	0.195	13%	0.134	C	C	.	.	H	α-helix	trans	-66.9	-46.2	179.6	-63.6	167	0	0	0	109.9	G103 S104 R109 A125 Y133 D134	G103-I107 PolarHBondContact O-N 2.94Å; S104-I107 PolarHBondContact O-N 3.11Å; I107-R109 PolarHBondContact O-N 3.41Å; I107-A125 HydrophobicContact CG1-CB 4.44Å; I107-Y133 HydrophobicContact CD1-CD1 3.49Å; I107-Y133 VanDerWaalsContact CD1-CD1 3.49Å; I107-Y133 HydrophobicContact CD1-CE1 4.02Å; I107-D134 VanDerWaalsContact CG2-O 3.29Å; I107-D134 WeakPolarHBondContact CG2-O 3.31Å
108	N	92.5	Very high	92.6	Very high	73 Å²	73	27.8 Å²	27.8	39%	0.39	13%	0.13	S	C	.	.	H	α-helix	trans	-72.6	-12.4	174.8	-64.8	-27	0	0	0	113.5	S104 T110 G135	S104-N108 WeakPolarHBondContact O-CB 3.4Å; S104-N108 PolarHBondContact O-N 3.36Å; S104-N108 PolarHBondContact O-ND2 3.36Å; N108-T110 HydrophobicContact CB-CG2 4.08Å; N108-T110 PolarHBondContact O-N 2.83Å; N108-G135 PolarHBondContact ND2-O 2.89Å
109	R	92.6	Very high	92.9	Very high	75 Å²	75	24.4 Å²	24.4	28%	0.283	12%	0.116	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.5	26.2	-178.1	-62.3	-179.9	64.6	156.1	4.8	114.6	Y105 Y106 I107 A313 L314 N316 K317	Y105-R109 WeakPolarHBondContact O-CA 3.23Å; Y105-R109 PolarHBondContact O-N 3.1Å; Y106-R109 VanDerWaalsContact O-CG 3.32Å; Y106-R109 WeakPolarHBondContact O-CG 3.27Å; Y106-R109 PolarHBondContact O-N 2.92Å; I107-R109 PolarHBondContact O-N 3.41Å; R109-A313 PolarHBondContact NH2-O 3.39Å; R109-L314 WeakPolarHBondContact CB-O 3.49Å; R109-L314 WeakPolarHBondContact CG-O 3.33Å; R109-L314 PolarHBondContact NE-O 2.89Å; R109-L314 PolarHBondContact NH2-O 2.96Å; R109-N316 PolarHBondContact NE-OD1 3.24Å; R109-N316 PolarHBondContact NH2-OD1 2.75Å; R109-N316 PolarHBondContact O-N 3.36Å; R109-K317 HydrophobicContact CB-CB 3.86Å; R109-K317 HydrophobicContact CB-CD 4.06Å; R109-K317 HydrophobicContact CB-CG 3.9Å; R109-K317 PolarHBondContact O-N 2.89Å; R109-K317 VanDerWaalsContact O-N 3.15Å
110	T	90.2	Very high	93	Very high	26 Å²	26	24 Å²	24	16%	0.16	11%	0.114	C	C	.	.	B	Isolated β-bridge	trans	-78.3	128.1	172.9	49.4	0	0	0	0	110.3	Y105 N108 S318	Y105-T110 VanDerWaalsContact CA-OG1 3.25Å; Y105-T110 WeakPolarHBondContact CA-OG1 3.36Å; Y105-T110 WeakPolarHBondContact CB-OG1 3.34Å; Y105-T110 WeakPolarHBondContact CD1-OG1 3.29Å; Y105-T110 PolarHBondContact O-N 3.45Å; Y105-T110 PolarHBondContact O-OG1 3.43Å; N108-T110 HydrophobicContact CB-CG2 4.08Å; N108-T110 PolarHBondContact O-N 2.83Å; T110-S318 VanDerWaalsContact CA-OG 3.32Å; T110-S318 WeakPolarHBondContact CA-OG 3.26Å; T110-S318 WeakPolarHBondContact CG2-OG 3.46Å
111	F	90.7	Very high	93.1	Very high	1 Å²	1	24.1 Å²	24.1	0%	0.004	11%	0.114	C	C	.	.			trans	-67.3	142.9	175.6	-174.4	-98.4	0	0	0	112.2	F312 L315 S318 G320 D323 F326 F330 L334	F111-F312 HydrophobicContact CE2-CD1 4.33Å; F111-F312 HydrophobicContact CE2-CE1 4.15Å; F111-L315 HydrophobicContact CB-CB 4.5Å; F111-L315 HydrophobicContact CD2-CB 3.98Å; F111-L315 HydrophobicContact CD2-CD1 4.23Å; F111-S318 PolarHBondContact N-O 2.85Å; F111-G320 CarbonylContact O-C 3.52Å; F111-G320 WeakPolarHBondContact O-CA 3.45Å; F111-G320 PolarHBondContact O-N 3.27Å; F111-D323 HydrophobicContact CD1-CB 4.12Å; F111-F326 AromaticContact CE1-CD2 3.86Å; F111-F326 HydrophobicContact CE1-CD2 3.86Å; F111-F326 AromaticContact CE1-CE2 3.77Å; F111-F326 HydrophobicContact CE1-CE2 3.77Å; F111-F326 HydrophobicContact CE1-CZ 4.44Å; F111-F326 HydrophobicContact CZ-CD2 4.05Å; F111-F326 HydrophobicContact CZ-CE1 4.44Å; F111-F326 AromaticContact CZ-CE2 3.6Å; F111-F326 HydrophobicContact CZ-CE2 3.6Å; F111-F326 AromaticContact CZ-CZ 3.82Å; F111-F326 HydrophobicContact CZ-CZ 3.82Å; F111-F330 HydrophobicContact CD1-CE1 4.08Å; F111-F330 HydrophobicContact CD2-CE1 4.23Å; F111-F330 AromaticContact CD2-CZ 3.99Å; F111-F330 HydrophobicContact CD2-CZ 3.99Å; F111-F330 AromaticContact CE1-CE1 3.66Å; F111-F330 HydrophobicContact CE1-CE1 3.66Å; F111-F330 HydrophobicContact CE1-CZ 4.2Å; F111-F330 AromaticContact CE2-CE1 3.85Å; F111-F330 HydrophobicContact CE2-CE1 3.85Å; F111-F330 AromaticContact CE2-CZ 3.51Å; F111-F330 HydrophobicContact CE2-CZ 3.51Å; F111-F330 HydrophobicContact CG-CE1 4.35Å; F111-F330 AromaticContact CZ-CE1 3.54Å; F111-F330 HydrophobicContact CZ-CE1 3.54Å; F111-F330 AromaticContact CZ-CZ 3.61Å; F111-F330 HydrophobicContact CZ-CZ 3.61Å; F111-L334 HydrophobicContact CB-CD1 3.77Å; F111-L334 HydrophobicContact CB-CD2 3.76Å; F111-L334 HydrophobicContact CB-CG 4.41Å; F111-L334 HydrophobicContact CD1-CD1 3.89Å; F111-L334 HydrophobicContact CD2-CD2 4.21Å; F111-L334 HydrophobicContact CG-CD1 3.88Å; F111-L334 HydrophobicContact CG-CD2 3.96Å
112	F	90.6	Very high	93.3	Very high	8 Å²	8	22.3 Å²	22.3	4%	0.035	11%	0.107	C	C	.	.			trans	-147.6	157.5	174.8	70.9	-86.8	0	0	0	110.7	M102 Y105 Y106 D114 K121 L315 P321	M102-F112 HydrophobicContact CB-CE1 4.44Å; M102-F112 HydrophobicContact CB-CE2 3.9Å; M102-F112 HydrophobicContact CB-CZ 3.75Å; M102-F112 HydrophobicContact CG-CD2 4.01Å; M102-F112 HydrophobicContact CG-CE2 3.5Å; M102-F112 VanDerWaalsContact CG-CE2 3.5Å; M102-F112 HydrophobicContact CG-CZ 3.9Å; M102-F112 HydrophobicContact SD-CE2 3.92Å; Y105-F112 VanDerWaalsContact CB-CD1 3.47Å; Y105-F112 HydrophobicContact CD2-CB 3.73Å; Y105-F112 AromaticContact CD2-CD1 3.72Å; Y105-F112 HydrophobicContact CD2-CD1 3.72Å; Y105-F112 HydrophobicContact CD2-CD2 4.34Å; Y105-F112 HydrophobicContact CD2-CE1 4.4Å; Y105-F112 AromaticContact CD2-CG 3.67Å; Y105-F112 HydrophobicContact CD2-CG 3.67Å; Y105-F112 HydrophobicContact CE2-CB 4.17Å; Y105-F112 HydrophobicContact CE2-CG 4.46Å; Y105-F112 HydrophobicContact CG-CB 4.44Å; Y105-F112 HydrophobicContact CG-CD1 4.01Å; Y105-F112 HydrophobicContact CG-CG 4.38Å; Y106-F112 HydrophobicContact CD2-CE1 4.15Å; Y106-F112 HydrophobicContact CD2-CZ 4.37Å; Y106-F112 AromaticContact CE2-CE1 3.71Å; Y106-F112 HydrophobicContact CE2-CE1 3.71Å; Y106-F112 AromaticContact CE2-CZ 3.6Å; Y106-F112 HydrophobicContact CE2-CZ 3.6Å; Y106-F112 AromaticContact CZ-CE1 3.92Å; Y106-F112 AromaticContact CZ-CZ 3.9Å; F112-D114 HydrophobicContact CD2-CB 4.39Å; F112-D114 HydrophobicContact CE2-CB 4.07Å; F112-K121 HydrophobicContact CE2-CD 4.24Å; F112-K121 HydrophobicContact CZ-CD 4.15Å; F112-L315 HydrophobicContact CD1-CD1 3.69Å; F112-L315 HydrophobicContact CE1-CD1 3.61Å; F112-P321 WeakPolarHBondContact CA-O 3.28Å
113	F	88.5	Confident	93.4	Very high	34 Å²	34	23.1 Å²	23.1	15%	0.149	11%	0.112	C	C	.	.			trans	-99.6	142.6	170.6	174.1	-112.9	0	0	0	111.6	V115 P321 F325 F326 V557 M558	F113-V115 HydrophobicContact CE1-CG1 4.28Å; F113-V115 HydrophobicContact CZ-CG1 4.15Å; F113-P321 PolarHBondContact N-O 3.39Å; F113-F325 HydrophobicContact CB-CD2 3.84Å; F113-F325 HydrophobicContact CB-CE2 4.45Å; F113-F325 AromaticContact CD1-CD2 3.54Å; F113-F325 HydrophobicContact CD1-CD2 3.54Å; F113-F325 AromaticContact CD1-CE2 3.79Å; F113-F325 HydrophobicContact CD1-CE2 3.79Å; F113-F325 HydrophobicContact CD1-CG 4.19Å; F113-F325 HydrophobicContact CE1-CD2 4.43Å; F113-F325 AromaticContact CG-CD2 3.88Å; F113-F325 HydrophobicContact CG-CD2 3.88Å; F113-F325 HydrophobicContact CG-CE2 4.49Å; F113-F326 HydrophobicContact CB-CE2 4.2Å; F113-F326 AromaticContact CD2-CE2 3.84Å; F113-F326 HydrophobicContact CD2-CE2 3.84Å; F113-F326 HydrophobicContact CD2-CZ 4.24Å; F113-F326 HydrophobicContact CG-CE2 4.35Å; F113-V557 HydrophobicContact CD2-CG1 3.91Å; F113-V557 HydrophobicContact CE1-CG1 4.33Å; F113-V557 HydrophobicContact CE2-CB 4.17Å; F113-V557 HydrophobicContact CE2-CG1 3.5Å; F113-V557 VanDerWaalsContact CE2-CG1 3.5Å; F113-V557 HydrophobicContact CG-CG1 4.5Å; F113-V557 HydrophobicContact CZ-CG1 3.74Å; F113-M558 HydrophobicContact CE2-CG 4.06Å
114	D	89.6	Confident	93.6	Very high	27 Å²	27	23.1 Å²	23.1	14%	0.144	11%	0.112	C	C	.	.			trans	-147.5	159.1	164.3	-178.3	55.3	0	0	0	111.7	M102 F112 H116 K121 M558	M102-D114 HydrophobicContact CE-CB 3.92Å; M102-D114 WeakPolarHBondContact CE-OD1 3.28Å; M102-D114 HydrophobicContact SD-CB 4.15Å; F112-D114 HydrophobicContact CD2-CB 4.39Å; F112-D114 HydrophobicContact CE2-CB 4.07Å; D114-H116 WeakPolarHBondContact OD2-CA 3.5Å; D114-H116 VanDerWaalsContact OD2-CB 3.28Å; D114-H116 WeakPolarHBondContact OD2-CB 3.2Å; D114-H116 IonicContact OD2-CD2 3.62Å; D114-H116 IonicContact OD2-CG 3.55Å; D114-H116 PolarHBondContact OD2-N 3.41Å; D114-K121 VanDerWaalsContact CG-NZ 3.33Å; D114-K121 WeakPolarHBondContact OD2-CE 3.17Å; D114-K121 IonicContact OD2-NZ 2.74Å; D114-K121 PolarHBondContact OD2-NZ 3.13Å; D114-M558 WeakPolarHBondContact O-CG 3.26Å
115	V	89.1	Confident	93.7	Very high	17 Å²	17	23.2 Å²	23.2	10%	0.103	11%	0.113	C	C	.	.	S	Bend	trans	-79.8	-9.7	179	-63.2	0	0	0	0	114.7	F113 F254 N562 L565	F113-V115 HydrophobicContact CE1-CG1 4.28Å; F113-V115 HydrophobicContact CZ-CG1 4.15Å; V115-F254 WeakPolarHBondContact O-CE2 3.36Å; V115-N562 HydrophobicContact CB-CB 4.27Å; V115-N562 HydrophobicContact CG1-CB 4.41Å; V115-L565 HydrophobicContact CG1-CD1 4.22Å; V115-L565 HydrophobicContact CG2-CD1 4.11Å
116	H	92.5	Very high	93.8	Very high	30 Å²	30	25 Å²	25	14%	0.139	13%	0.125	C	C	.	.	S	Bend	trans	-106.4	141.3	177.4	-60.1	-34.7	0	0	0	112.2	D114 K121 L205 K253	D114-H116 WeakPolarHBondContact OD2-CA 3.5Å; D114-H116 VanDerWaalsContact OD2-CB 3.28Å; D114-H116 WeakPolarHBondContact OD2-CB 3.2Å; D114-H116 IonicContact OD2-CD2 3.62Å; D114-H116 IonicContact OD2-CG 3.55Å; D114-H116 PolarHBondContact OD2-N 3.41Å; H116-K121 WeakPolarHBondContact O-CE 3.46Å; H116-L205 HydrophobicContact CB-CD1 4.2Å; H116-K253 HydrophobicContact CB-CG 4.47Å
117	P	95.9	Very high	93.8	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.127	C	C	.	.			trans	-53.4	155.2	171	-31.9	41.1	0	0	0	114	L119 V250 G251 F254 Y304 F308	P117-L119 PolarHBondContact O-N 2.91Å; P117-V250 WeakPolarHBondContact CB-O 3.38Å; P117-V250 WeakPolarHBondContact CG-O 3.33Å; P117-G251 CarbonylContact C-O 3.56Å; P117-G251 VanDerWaalsContact CB-O 3.31Å; P117-G251 WeakPolarHBondContact CB-O 3.19Å; P117-F254 HydrophobicContact CG-CD1 3.98Å; P117-F254 HydrophobicContact CG-CD2 4.28Å; P117-F254 HydrophobicContact CG-CE1 3.55Å; P117-F254 HydrophobicContact CG-CE2 3.89Å; P117-F254 HydrophobicContact CG-CG 4.33Å; P117-F254 HydrophobicContact CG-CZ 3.5Å; P117-Y304 HydrophobicContact CB-CE2 4.2Å; P117-Y304 HydrophobicContact CG-CE2 4.36Å; P117-F308 HydrophobicContact CB-CE2 4.13Å; P117-F308 HydrophobicContact CB-CZ 4.18Å
118	P	96.6	Very high	93.9	Very high	1 Å²	1	23.2 Å²	23.2	1%	0.006	12%	0.118	C	C	.	.	S	Bend	trans	-85.5	-13.5	-155.8	30.5	-35.4	0	0	0	116.1	Y106 G120 K121 M122 V307 F308 H311	Y106-P118 WeakPolarHBondContact OH-CB 3.49Å; P118-G120 PolarHBondContact O-N 3.34Å; P118-K121 PolarHBondContact O-N 2.92Å; P118-M122 HydrophobicContact CB-CE 4.16Å; P118-M122 HydrophobicContact CG-CE 4.2Å; P118-M122 WeakPolarHBondContact O-CG 3.28Å; P118-M122 PolarHBondContact O-N 3.23Å; P118-V307 HydrophobicContact CG-CG1 3.78Å; P118-F308 HydrophobicContact CG-CD2 4.35Å; P118-F308 HydrophobicContact CG-CE1 4.47Å; P118-F308 HydrophobicContact CG-CE2 4.29Å; P118-F308 HydrophobicContact CG-CG 4.47Å; P118-F308 HydrophobicContact CG-CZ 4.37Å; P118-H311 HydrophobicContact CB-CB 3.91Å; P118-H311 HydrophobicContact CG-CB 3.76Å
119	L	97.4	Very high	94	Very high	29 Å²	29	27.4 Å²	27.4	15%	0.152	13%	0.13	C	C	.	.	H	α-helix	trans	-58.3	-52.2	-165.5	180	59.7	0	0	0	112.9	P117 K121 M122 L123 F212 G251 V252 V307	P117-L119 PolarHBondContact O-N 2.91Å; L119-K121 PolarHBondContact O-N 2.67Å; L119-M122 PolarHBondContact O-N 2.9Å; L119-M122 VanDerWaalsContact O-N 3.14Å; L119-L123 HydrophobicContact CD1-CD1 4.05Å; L119-L123 HydrophobicContact CD1-CG 4.09Å; L119-L123 HydrophobicContact CG-CD1 3.91Å; L119-L123 HydrophobicContact CG-CG 4.37Å; L119-L123 WeakPolarHBondContact O-CG 3.3Å; L119-L123 PolarHBondContact O-N 2.89Å; L119-F212 HydrophobicContact CD2-CE2 3.9Å; L119-F212 HydrophobicContact CD2-CZ 4.16Å; L119-G251 WeakPolarHBondContact CB-O 3.42Å; L119-G251 PolarHBondContact N-O 3.42Å; L119-V252 HydrophobicContact CB-CG2 4.27Å; L119-V252 HydrophobicContact CD2-CG2 4.37Å; L119-V252 HydrophobicContact CG-CG2 4.41Å; L119-V307 HydrophobicContact CB-CG1 4Å; L119-V307 HydrophobicContact CD1-CG2 3.99Å
120	G	96.1	Very high	94.2	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-63.1	-33.7	-176.3	0	0	0	0	0	112.5	P118 L123 I124 L205 I208	P118-G120 PolarHBondContact O-N 3.34Å; G120-L123 PolarHBondContact O-N 3.02Å; G120-I124 VanDerWaalsContact O-CG1 3.32Å; G120-I124 WeakPolarHBondContact O-CG1 3.28Å; G120-I124 PolarHBondContact O-N 3.3Å; G120-L205 VanDerWaalsContact C-CD2 3.49Å; G120-I208 WeakPolarHBondContact O-CD1 3.24Å
121	K	95.8	Very high	94.3	Very high	2 Å²	2	31.3 Å²	31.3	1%	0.009	15%	0.154	C	C	.	.	H	α-helix	trans	-69.8	-40.2	176.2	-49.2	170.5	-167.9	-68.6	0	111.4	M102 Y106 F112 D114 H116 P118 L119 L123 I124 A125 L205	M102-K121 HydrophobicContact CB-CD 4.34Å; M102-K121 HydrophobicContact SD-CD 3.84Å; M102-K121 PolarHBondContact SD-NZ 3.21Å; Y106-K121 HydrophobicContact CD2-CB 4.34Å; Y106-K121 HydrophobicContact CE2-CB 3.57Å; F112-K121 HydrophobicContact CE2-CD 4.24Å; F112-K121 HydrophobicContact CZ-CD 4.15Å; D114-K121 VanDerWaalsContact CG-NZ 3.33Å; D114-K121 WeakPolarHBondContact OD2-CE 3.17Å; D114-K121 IonicContact OD2-NZ 2.74Å; D114-K121 PolarHBondContact OD2-NZ 3.13Å; H116-K121 WeakPolarHBondContact O-CE 3.46Å; P118-K121 PolarHBondContact O-N 2.92Å; L119-K121 PolarHBondContact O-N 2.67Å; K121-L123 VanDerWaalsContact C-N 3.35Å; K121-I124 PolarHBondContact O-N 3.32Å; K121-A125 WeakPolarHBondContact O-CB 3.48Å; K121-A125 PolarHBondContact O-N 2.9Å; K121-L205 HydrophobicContact CG-CD1 4.36Å; K121-L205 HydrophobicContact CG-CD2 3.87Å
122	M	96.7	Very high	94.3	Very high	22 Å²	22	34 Å²	34	11%	0.108	18%	0.182	C	C	.	.	H	α-helix	trans	-66.6	-35.2	173.7	-69.2	-170.8	-60	0	0	112.2	Y106 P118 L119 A125 L126 V307 V310 H311 L314	Y106-M122 HydrophobicContact CD1-CG 3.83Å; Y106-M122 HydrophobicContact CD2-CG 4.29Å; Y106-M122 HydrophobicContact CE1-CG 3.37Å; Y106-M122 HydrophobicContact CE1-SD 3.93Å; Y106-M122 HydrophobicContact CE2-CG 3.89Å; Y106-M122 HydrophobicContact CG-CG 4.28Å; Y106-M122 VanDerWaalsContact CZ-CG 3.41Å; P118-M122 HydrophobicContact CB-CE 4.16Å; P118-M122 HydrophobicContact CG-CE 4.2Å; P118-M122 WeakPolarHBondContact O-CG 3.28Å; P118-M122 PolarHBondContact O-N 3.23Å; L119-M122 PolarHBondContact O-N 2.9Å; L119-M122 VanDerWaalsContact O-N 3.14Å; M122-A125 PolarHBondContact O-N 2.76Å; M122-L126 WeakPolarHBondContact O-CB 3.46Å; M122-L126 PolarHBondContact O-N 3.12Å; M122-V307 HydrophobicContact CE-CG1 3.89Å; M122-V310 HydrophobicContact SD-CG1 4.03Å; M122-H311 HydrophobicContact CE-CB 4.43Å; M122-H311 HydrophobicContact SD-CB 3.98Å; M122-L314 HydrophobicContact SD-CD1 4.04Å
123	L	97.3	Very high	94.5	Very high	37 Å²	37	34 Å²	34	19%	0.194	18%	0.182	C	C	.	.	H	α-helix	trans	-69.3	-40.7	175	-69.9	172.2	0	0	0	112.1	L119 G120 K121 L126 A127 F157 I208 F212	L119-L123 HydrophobicContact CD1-CD1 4.05Å; L119-L123 HydrophobicContact CD1-CG 4.09Å; L119-L123 HydrophobicContact CG-CD1 3.91Å; L119-L123 HydrophobicContact CG-CG 4.37Å; L119-L123 WeakPolarHBondContact O-CG 3.3Å; L119-L123 PolarHBondContact O-N 2.89Å; G120-L123 PolarHBondContact O-N 3.02Å; K121-L123 VanDerWaalsContact C-N 3.35Å; L123-L126 PolarHBondContact O-N 3.45Å; L123-A127 WeakPolarHBondContact O-CB 3.44Å; L123-A127 PolarHBondContact O-N 3.2Å; L123-F157 HydrophobicContact CB-CE1 3.68Å; L123-F157 HydrophobicContact CB-CZ 3.83Å; L123-F157 HydrophobicContact CD1-CZ 4.33Å; L123-F157 HydrophobicContact CD2-CZ 4.25Å; L123-F157 HydrophobicContact CG-CZ 4.36Å; L123-I208 HydrophobicContact CD1-CG2 3.92Å; L123-F212 HydrophobicContact CD1-CE2 4.26Å; L123-F212 HydrophobicContact CD1-CZ 4.45Å
124	I	96.7	Very high	94.6	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-59.9	-46.4	170.7	-72.2	165	0	0	0	110.6	F99 G120 K121 L126 A127 G128 M154 I203 L205 I208	F99-I124 HydrophobicContact CB-CD1 4.24Å; G120-I124 VanDerWaalsContact O-CG1 3.32Å; G120-I124 WeakPolarHBondContact O-CG1 3.28Å; G120-I124 PolarHBondContact O-N 3.3Å; K121-I124 PolarHBondContact O-N 3.32Å; I124-L126 PolarHBondContact O-N 3.32Å; I124-A127 PolarHBondContact O-N 3.02Å; I124-G128 PolarHBondContact O-N 3.32Å; I124-M154 HydrophobicContact CG2-CB 4.31Å; I124-M154 HydrophobicContact CG2-CE 4.26Å; I124-M154 HydrophobicContact CG2-CG 4.03Å; I124-M154 HydrophobicContact CG2-SD 3.66Å; I124-I203 HydrophobicContact CD1-CG2 4.16Å; I124-I203 HydrophobicContact CG1-CG2 4.45Å; I124-I203 HydrophobicContact CG2-CG2 3.59Å; I124-L205 HydrophobicContact CD1-CD2 4.07Å; I124-I208 HydrophobicContact CD1-CD1 4.02Å; I124-I208 HydrophobicContact CG1-CD1 3.87Å
125	A	96.2	Very high	94.7	Very high	6 Å²	6	35.5 Å²	35.5	5%	0.05	19%	0.192	C	C	.	.	H	α-helix	trans	-60.7	-42.6	176.5	0	0	0	0	0	112.6	Y106 I107 K121 M122 G128 Y129	Y106-A125 HydrophobicContact CD2-CB 4.1Å; Y106-A125 HydrophobicContact CG-CB 4.13Å; I107-A125 HydrophobicContact CG1-CB 4.44Å; K121-A125 WeakPolarHBondContact O-CB 3.48Å; K121-A125 PolarHBondContact O-N 2.9Å; M122-A125 PolarHBondContact O-N 2.76Å; A125-G128 PolarHBondContact O-N 3.16Å; A125-Y129 WeakPolarHBondContact O-CB 3.35Å; A125-Y129 PolarHBondContact O-N 3.44Å
126	L	95.9	Very high	94.9	Very high	88 Å²	88	37.8 Å²	37.8	46%	0.461	21%	0.209	S	C	.	.	H	α-helix	trans	-62.3	-45	176.6	178	62.8	0	0	0	111.5	M122 L123 I124 Y129 M130	M122-L126 WeakPolarHBondContact O-CB 3.46Å; M122-L126 PolarHBondContact O-N 3.12Å; L123-L126 PolarHBondContact O-N 3.45Å; I124-L126 PolarHBondContact O-N 3.32Å; L126-Y129 PolarHBondContact O-N 3.46Å; L126-M130 HydrophobicContact CD1-CG 4.03Å; L126-M130 HydrophobicContact CD1-SD 3.89Å; L126-M130 HydrophobicContact CG-CG 4.45Å; L126-M130 HydrophobicContact CG-SD 3.94Å; L126-M130 WeakPolarHBondContact O-CB 3.35Å; L126-M130 VanDerWaalsContact O-CG 3.29Å; L126-M130 WeakPolarHBondContact O-CG 3.45Å; L126-M130 PolarHBondContact O-N 3.05Å
127	A	96.3	Very high	94.9	Very high	10 Å²	10	36.9 Å²	36.9	8%	0.083	20%	0.204	C	C	.	.	H	α-helix	trans	-64.2	-39.8	177	0	0	0	0	0	112.9	L123 I124 T131 F157	L123-A127 WeakPolarHBondContact O-CB 3.44Å; L123-A127 PolarHBondContact O-N 3.2Å; I124-A127 PolarHBondContact O-N 3.02Å; A127-T131 WeakPolarHBondContact O-CG2 3.44Å; A127-T131 PolarHBondContact O-N 2.89Å; A127-T131 PolarHBondContact O-OG1 3.33Å; A127-F157 HydrophobicContact CB-CB 3.49Å; A127-F157 VanDerWaalsContact CB-CB 3.49Å; A127-F157 HydrophobicContact CB-CD1 4.36Å; A127-F157 HydrophobicContact CB-CD2 4.1Å; A127-F157 HydrophobicContact CB-CG 3.74Å
128	G	94.9	Very high	94.4	Very high	1 Å²	1	40.3 Å²	40.3	1%	0.01	23%	0.227	C	C	.	.	H	α-helix	trans	-59.7	-55.1	170.3	0	0	0	0	0	111.8	I124 A125 M130 T131 G132 Y133	I124-G128 PolarHBondContact O-N 3.32Å; A125-G128 PolarHBondContact O-N 3.16Å; G128-M130 PolarHBondContact O-N 3.45Å; G128-T131 CarbonylContact O-C 3.58Å; G128-T131 PolarHBondContact O-N 3.37Å; G128-T131 PolarHBondContact O-OG1 2.85Å; G128-T131 VanDerWaalsContact O-OG1 3.06Å; G128-G132 PolarHBondContact O-N 2.91Å; G128-Y133 WeakPolarHBondContact O-CB 3.42Å; G128-Y133 PolarHBondContact O-N 2.89Å
129	Y	94.9	Very high	94.1	Very high	162 Å²	162	40.4 Å²	40.4	64%	0.635	23%	0.227	S	C	*	.	H	α-helix	trans	-58.3	-44.4	-178.7	-177.7	-106.4	0	0	0	112.7	A125 L126 T131 G132	A125-Y129 WeakPolarHBondContact O-CB 3.35Å; A125-Y129 PolarHBondContact O-N 3.44Å; L126-Y129 PolarHBondContact O-N 3.46Å; Y129-T131 PolarHBondContact O-N 2.9Å; Y129-G132 PolarHBondContact O-N 2.84Å; Y129-G132 VanDerWaalsContact O-N 3.14Å
130	M	95.6	Very high	93.7	Very high	144 Å²	144	43.8 Å²	43.8	71%	0.709	25%	0.249	S	C	*	.	H	α-helix	trans	-65.4	-16.7	177	-74.1	-179.2	65.9	0	0	114.3	L126 G128	L126-M130 HydrophobicContact CD1-CG 4.03Å; L126-M130 HydrophobicContact CD1-SD 3.89Å; L126-M130 HydrophobicContact CG-CG 4.45Å; L126-M130 HydrophobicContact CG-SD 3.94Å; L126-M130 WeakPolarHBondContact O-CB 3.35Å; L126-M130 VanDerWaalsContact O-CG 3.29Å; L126-M130 WeakPolarHBondContact O-CG 3.45Å; L126-M130 PolarHBondContact O-N 3.05Å; G128-M130 PolarHBondContact O-N 3.45Å
131	T	93.1	Very high	93.2	Very high	38 Å²	38	49.8 Å²	49.8	23%	0.233	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.3	7	176.5	56.4	0	0	0	0	113.1	A127 G128 Y129 N150 W152 G153	A127-T131 WeakPolarHBondContact O-CG2 3.44Å; A127-T131 PolarHBondContact O-N 2.89Å; A127-T131 PolarHBondContact O-OG1 3.33Å; G128-T131 CarbonylContact O-C 3.58Å; G128-T131 PolarHBondContact O-N 3.37Å; G128-T131 PolarHBondContact O-OG1 2.85Å; G128-T131 VanDerWaalsContact O-OG1 3.06Å; Y129-T131 PolarHBondContact O-N 2.9Å; T131-N150 PolarHBondContact O-ND2 3.44Å; T131-W152 HydrophobicContact CG2-CH2 3.57Å; T131-W152 HydrophobicContact CG2-CZ2 3.56Å; T131-W152 HydrophobicContact CG2-CZ3 4.14Å; T131-G153 WeakPolarHBondContact OG1-CA 3.46Å
132	G	91.8	Very high	92.7	Very high	59 Å²	59	52.8 Å²	52.8	61%	0.608	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.1	20.9	176.7	0	0	0	0	0	115	G128 Y129	G128-G132 PolarHBondContact O-N 2.91Å; Y129-G132 PolarHBondContact O-N 2.84Å; Y129-G132 VanDerWaalsContact O-N 3.14Å
133	Y	94.1	Very high	92.1	Very high	7 Å²	7	53.4 Å²	53.4	3%	0.027	31%	0.307	C	S	.	.			trans	-71.5	131.8	163.2	-176.8	-117.6	0	0	0	110.2	S104 I107 G128 G135 F137 H149 N150 M154	S104-Y133 PolarHBondContact OG-OH 3.39Å; I107-Y133 HydrophobicContact CD1-CD1 3.49Å; I107-Y133 VanDerWaalsContact CD1-CD1 3.49Å; I107-Y133 HydrophobicContact CD1-CE1 4.02Å; G128-Y133 WeakPolarHBondContact O-CB 3.42Å; G128-Y133 PolarHBondContact O-N 2.89Å; Y133-G135 VanDerWaalsContact CE1-CA 3.48Å; Y133-F137 HydrophobicContact CE2-CB 3.95Å; Y133-F137 WeakPolarHBondContact OH-CB 3.3Å; Y133-F137 PolarHBondContact OH-N 3.43Å; Y133-F137 PolarHBondContact OH-O 3.47Å; Y133-H149 HydrophobicContact CE2-CB 4.38Å; Y133-N150 WeakPolarHBondContact CB-O 3.35Å; Y133-N150 VanDerWaalsContact CD2-O 3.3Å; Y133-N150 WeakPolarHBondContact CD2-O 3.25Å; Y133-M154 HydrophobicContact CD1-CE 3.3Å; Y133-M154 HydrophobicContact CE1-CE 3.65Å; Y133-M154 HydrophobicContact CG-CE 4.13Å
134	D	90.9	Very high	91.6	Very high	90 Å²	90	53.2 Å²	53.2	48%	0.481	31%	0.306	S	S	.	.			trans	-95.2	-17.3	-170.7	67.1	-21.7	0	0	0	114.1	I107 S136	I107-D134 VanDerWaalsContact CG2-O 3.29Å; I107-D134 WeakPolarHBondContact CG2-O 3.31Å; D134-S136 PolarHBondContact OD1-N 2.98Å; D134-S136 PolarHBondContact OD1-OG 3.36Å; D134-S136 WeakPolarHBondContact OD2-CB 3.46Å; D134-S136 PolarHBondContact OD2-OG 3.5Å
135	G	91	Very high	91.3	Very high	3 Å²	3	60.1 Å²	60.1	3%	0.031	34%	0.336	C	S	.	.	S	Bend	trans	89.2	9.1	-175.1	0	0	0	0	0	115.3	N108 Y133	N108-G135 PolarHBondContact ND2-O 2.89Å; Y133-G135 VanDerWaalsContact CE1-CA 3.48Å
136	S	92.4	Very high	90.9	Very high	64 Å²	64	60 Å²	60	45%	0.448	33%	0.334	S	S	.	.			trans	-83.3	-32.2	-176.4	61.1	0	0	0	0	114.4	D134 H149	D134-S136 PolarHBondContact OD1-N 2.98Å; D134-S136 PolarHBondContact OD1-OG 3.36Å; D134-S136 WeakPolarHBondContact OD2-CB 3.46Å; D134-S136 PolarHBondContact OD2-OG 3.5Å; S136-H149 PolarHBondContact OG-CD2 2.86Å; S136-H149 VanDerWaalsContact OG-CD2 3.25Å; S136-H149 PolarHBondContact OG-NE2 3.13Å
137	F	92.7	Very high	90.6	Very high	11 Å²	11	63.3 Å²	63.3	5%	0.048	35%	0.347	C	S	.	.			trans	-61.4	128.6	-177.5	-174	-102.8	0	0	0	112.4	V92 Y133 F139 D144 K145 Y146 H149	V92-F137 HydrophobicContact CG2-CE1 3.49Å; V92-F137 VanDerWaalsContact CG2-CE1 3.49Å; V92-F137 HydrophobicContact CG2-CZ 3.75Å; Y133-F137 HydrophobicContact CE2-CB 3.95Å; Y133-F137 WeakPolarHBondContact OH-CB 3.3Å; Y133-F137 PolarHBondContact OH-N 3.43Å; Y133-F137 PolarHBondContact OH-O 3.47Å; F137-F139 AromaticContact CD1-CD1 3.97Å; F137-F139 HydrophobicContact CD1-CD1 3.97Å; F137-F139 AromaticContact CD1-CD2 3.62Å; F137-F139 HydrophobicContact CD1-CD2 3.62Å; F137-F139 HydrophobicContact CD1-CE1 4.03Å; F137-F139 AromaticContact CD1-CE2 3.69Å; F137-F139 HydrophobicContact CD1-CE2 3.69Å; F137-F139 AromaticContact CD1-CG 3.76Å; F137-F139 HydrophobicContact CD1-CG 3.76Å; F137-F139 AromaticContact CD1-CZ 3.89Å; F137-F139 HydrophobicContact CD1-CZ 3.89Å; F137-F139 AromaticContact CE1-CD1 3.82Å; F137-F139 HydrophobicContact CE1-CD1 3.82Å; F137-F139 HydrophobicContact CE1-CD2 4.26Å; F137-F139 HydrophobicContact CE1-CE1 4.07Å; F137-F139 HydrophobicContact CE1-CE2 4.49Å; F137-F139 AromaticContact CE1-CG 3.91Å; F137-F139 HydrophobicContact CE1-CG 3.91Å; F137-F139 HydrophobicContact CE1-CZ 4.39Å; F137-F139 WeakPolarHBondContact O-CD2 3.34Å; F137-D144 HydrophobicContact CZ-CB 4.13Å; F137-K145 VanDerWaalsContact CE2-O 3.25Å; F137-K145 WeakPolarHBondContact CE2-O 3.48Å; F137-Y146 AromaticContact CD1-CD1 3.97Å; F137-Y146 HydrophobicContact CD1-CD1 3.97Å; F137-Y146 HydrophobicContact CD1-CE1 4.03Å; F137-Y146 AromaticContact CE1-CD1 3.72Å; F137-Y146 HydrophobicContact CE1-CD1 3.72Å; F137-Y146 AromaticContact CE1-CE1 3.72Å; F137-Y146 HydrophobicContact CE1-CE1 3.72Å; F137-Y146 HydrophobicContact CE2-CD1 4.43Å; F137-Y146 HydrophobicContact CG-CD1 4.43Å; F137-Y146 AromaticContact CZ-CD1 3.97Å; F137-Y146 HydrophobicContact CZ-CD1 3.97Å; F137-Y146 HydrophobicContact CZ-CE1 4.34Å; F137-H149 HydrophobicContact CB-CB 4.12Å; F137-H149 AromaticContact CD2-CE1 3.83Å; F137-H149 AromaticContact CD2-CG 3.97Å; F137-H149 AromaticContact CD2-ND1 3.53Å
138	P	86.5	Confident	90.2	Very high	73 Å²	73	71.7 Å²	71.7	47%	0.474	38%	0.384	S	S	.	.			trans	-85.8	-14	-162.4	32.1	-37.8	0	0	0	116.1	K101 V140	K101-P138 VanDerWaalsContact CE-O 3.23Å; K101-P138 WeakPolarHBondContact CE-O 3.32Å; K101-P138 PolarHBondContact NZ-O 3.32Å; K101-P138 VanDerWaalsContact NZ-O 3.13Å; P138-V140 HydrophobicContact CB-CG2 3.97Å; P138-V140 HydrophobicContact CG-CG2 4.04Å
139	F	90.9	Very high	90	Very high	3 Å²	3	74 Å²	74	1%	0.013	40%	0.395	C	S	.	.			trans	45	73.9	-178.3	-70.8	-84.4	0	0	0	112.4	V92 E96 G100 K101 F137 Y146 I203	V92-F139 HydrophobicContact CG1-CD1 4.15Å; V92-F139 HydrophobicContact CG2-CD1 4.03Å; V92-F139 HydrophobicContact CG2-CE1 4.34Å; E96-F139 VanDerWaalsContact O-CD1 3.32Å; E96-F139 WeakPolarHBondContact O-CD1 3.39Å; G100-F139 VanDerWaalsContact C-CD2 3.44Å; G100-F139 VanDerWaalsContact CA-CZ 3.49Å; K101-F139 HydrophobicContact CB-CB 3.75Å; K101-F139 HydrophobicContact CB-CD2 4.31Å; K101-F139 HydrophobicContact CB-CG 4.29Å; K101-F139 HydrophobicContact CD-CB 4.49Å; K101-F139 HydrophobicContact CG-CB 4.18Å; K101-F139 VanDerWaalsContact N-CD2 3.32Å; K101-F139 PolarHBondContact NZ-O 2.94Å; F137-F139 AromaticContact CD1-CD1 3.97Å; F137-F139 HydrophobicContact CD1-CD1 3.97Å; F137-F139 AromaticContact CD1-CD2 3.62Å; F137-F139 HydrophobicContact CD1-CD2 3.62Å; F137-F139 HydrophobicContact CD1-CE1 4.03Å; F137-F139 AromaticContact CD1-CE2 3.69Å; F137-F139 HydrophobicContact CD1-CE2 3.69Å; F137-F139 AromaticContact CD1-CG 3.76Å; F137-F139 HydrophobicContact CD1-CG 3.76Å; F137-F139 AromaticContact CD1-CZ 3.89Å; F137-F139 HydrophobicContact CD1-CZ 3.89Å; F137-F139 AromaticContact CE1-CD1 3.82Å; F137-F139 HydrophobicContact CE1-CD1 3.82Å; F137-F139 HydrophobicContact CE1-CD2 4.26Å; F137-F139 HydrophobicContact CE1-CE1 4.07Å; F137-F139 HydrophobicContact CE1-CE2 4.49Å; F137-F139 AromaticContact CE1-CG 3.91Å; F137-F139 HydrophobicContact CE1-CG 3.91Å; F137-F139 HydrophobicContact CE1-CZ 4.39Å; F137-F139 WeakPolarHBondContact O-CD2 3.34Å; F139-Y146 HydrophobicContact CD1-CE1 4.48Å; F139-Y146 AromaticContact CE1-CE1 3.62Å; F139-Y146 HydrophobicContact CE1-CE1 3.62Å; F139-Y146 AromaticContact CZ-CE1 3.93Å; F139-Y146 HydrophobicContact CZ-CE1 3.93Å; F139-I203 HydrophobicContact CE1-CD1 4.42Å; F139-I203 HydrophobicContact CZ-CD1 4.41Å
140	V	87.2	Confident	89.8	Confident	100 Å²	100	68.4 Å²	68.4	61%	0.606	38%	0.376	S	S	*	.			trans	-93.8	-49.3	-172.7	-175.4	0	0	0	0	111.9	P138 D144	P138-V140 HydrophobicContact CB-CG2 3.97Å; P138-V140 HydrophobicContact CG-CG2 4.04Å; V140-D144 WeakPolarHBondContact CB-OD2 3.39Å; V140-D144 PolarHBondContact N-OD2 3.12Å
141	K	86.4	Confident	89.5	Confident	126 Å²	126	62.8 Å²	62.8	55%	0.548	35%	0.347	S	S	.	.	S	Bend	trans	-147.3	161.1	-177.1	57.6	171.9	-178	174.3	0	111.8	D144	K141-D144 WeakPolarHBondContact CE-OD1 3.46Å; K141-D144 VanDerWaalsContact CG-CG 3.47Å; K141-D144 WeakPolarHBondContact CG-OD1 3.31Å; K141-D144 WeakPolarHBondContact CG-OD2 3.33Å; K141-D144 PolarHBondContact N-OD2 3.48Å; K141-D144 PolarHBondContact O-N 2.61Å
142	P	85.2	Confident	89.4	Confident	65 Å²	65	67.5 Å²	67.5	42%	0.422	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	146.1	169.2	-19	33.9	0	0	0	110.3	V92 T97 D144	V92-P142 CarbonylContact O-C 3.6Å; V92-P142 WeakPolarHBondContact O-CA 3.38Å; T97-P142 HydrophobicContact CG2-CG 3.96Å; P142-D144 VanDerWaalsContact C-N 3.34Å
143	G	84.5	Confident	89.5	Confident	35 Å²	35	64.9 Å²	64.9	36%	0.361	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.2	-8.3	-175.5	0	0	0	0	0	115.5	V92 K145	V92-G143 PolarHBondContact O-N 2.85Å; G143-K145 PolarHBondContact O-N 2.91Å
144	D	87	Confident	89.6	Confident	33 Å²	33	64.6 Å²	64.6	18%	0.176	33%	0.332	C	S	.	.			trans	-59.5	128.7	169.1	-73.3	-23.2	0	0	0	109.8	H91 V92 F137 V140 K141 P142	H91-D144 CarbonylContact C-O 3.6Å; H91-D144 WeakPolarHBondContact CA-O 3.47Å; H91-D144 VanDerWaalsContact CB-O 3.27Å; H91-D144 WeakPolarHBondContact CB-O 3.38Å; V92-D144 HydrophobicContact CB-CB 4.44Å; V92-D144 HydrophobicContact CG2-CB 4.03Å; V92-D144 WeakPolarHBondContact CG2-O 3.42Å; V92-D144 PolarHBondContact N-O 3.26Å; F137-D144 HydrophobicContact CZ-CB 4.13Å; V140-D144 WeakPolarHBondContact CB-OD2 3.39Å; V140-D144 PolarHBondContact N-OD2 3.12Å; K141-D144 WeakPolarHBondContact CE-OD1 3.46Å; K141-D144 VanDerWaalsContact CG-CG 3.47Å; K141-D144 WeakPolarHBondContact CG-OD1 3.31Å; K141-D144 WeakPolarHBondContact CG-OD2 3.33Å; K141-D144 PolarHBondContact N-OD2 3.48Å; K141-D144 PolarHBondContact O-N 2.61Å; P142-D144 VanDerWaalsContact C-N 3.34Å
145	K	89.6	Confident	89.8	Confident	145 Å²	145	60.3 Å²	60.3	63%	0.63	31%	0.31	S	S	*	.	B	Isolated β-bridge	trans	-79.7	142.9	179.7	-66.3	179.6	-178.2	177.2	0	110.3	H91 F137 G143 E147	H91-K145 HydrophobicContact CB-CG 4.29Å; F137-K145 VanDerWaalsContact CE2-O 3.25Å; F137-K145 WeakPolarHBondContact CE2-O 3.48Å; G143-K145 PolarHBondContact O-N 2.91Å; K145-E147 VanDerWaalsContact C-N 3.28Å; K145-E147 PolarHBondContact O-N 3.19Å
146	Y	88.2	Confident	90	Very high	3 Å²	3	60.9 Å²	60.9	1%	0.012	32%	0.315	C	S	.	.			trans	-74.8	-15.2	-179.8	-73	-70.2	0	0	0	114.1	P90 H91 V92 E96 F137 F139 H148 H149 Y151	P90-Y146 PolarHBondContact O-N 2.67Å; P90-Y146 VanDerWaalsContact O-N 3.16Å; H91-Y146 VanDerWaalsContact C-CE2 3.4Å; H91-Y146 WeakPolarHBondContact O-CE2 3.48Å; V92-Y146 HydrophobicContact CG2-CD1 4.41Å; V92-Y146 HydrophobicContact CG2-CE1 3.78Å; V92-Y146 HydrophobicContact CG2-CE2 4.26Å; E96-Y146 PolarHBondContact OE2-OH 3.25Å; F137-Y146 AromaticContact CD1-CD1 3.97Å; F137-Y146 HydrophobicContact CD1-CD1 3.97Å; F137-Y146 HydrophobicContact CD1-CE1 4.03Å; F137-Y146 AromaticContact CE1-CD1 3.72Å; F137-Y146 HydrophobicContact CE1-CD1 3.72Å; F137-Y146 AromaticContact CE1-CE1 3.72Å; F137-Y146 HydrophobicContact CE1-CE1 3.72Å; F137-Y146 HydrophobicContact CE2-CD1 4.43Å; F137-Y146 HydrophobicContact CG-CD1 4.43Å; F137-Y146 AromaticContact CZ-CD1 3.97Å; F137-Y146 HydrophobicContact CZ-CD1 3.97Å; F137-Y146 HydrophobicContact CZ-CE1 4.34Å; F139-Y146 HydrophobicContact CD1-CE1 4.48Å; F139-Y146 AromaticContact CE1-CE1 3.62Å; F139-Y146 HydrophobicContact CE1-CE1 3.62Å; F139-Y146 AromaticContact CZ-CE1 3.93Å; F139-Y146 HydrophobicContact CZ-CE1 3.93Å; Y146-H148 PolarHBondContact O-N 2.79Å; Y146-H148 VanDerWaalsContact O-N 3.15Å; Y146-H149 WeakPolarHBondContact O-CB 3.28Å; Y146-H149 PolarHBondContact O-N 3.36Å; Y146-H149 PolarHBondContact O-ND1 3.47Å; Y146-Y151 VanDerWaalsContact CB-CD1 3.45Å; Y146-Y151 AromaticContact CD1-CD1 3.9Å; Y146-Y151 HydrophobicContact CD1-CD1 3.9Å; Y146-Y151 AromaticContact CD1-CG 3.99Å; Y146-Y151 HydrophobicContact CD1-CG 3.99Å; Y146-Y151 AromaticContact CD2-CD1 3.45Å; Y146-Y151 HydrophobicContact CD2-CD1 3.45Å; Y146-Y151 VanDerWaalsContact CD2-CD1 3.45Å; Y146-Y151 AromaticContact CD2-CD2 3.96Å; Y146-Y151 HydrophobicContact CD2-CD2 3.96Å; Y146-Y151 AromaticContact CD2-CE1 3.6Å; Y146-Y151 HydrophobicContact CD2-CE1 3.6Å; Y146-Y151 HydrophobicContact CD2-CE2 4.09Å; Y146-Y151 AromaticContact CD2-CG 3.66Å; Y146-Y151 HydrophobicContact CD2-CG 3.66Å; Y146-Y151 AromaticContact CD2-CZ 3.92Å; Y146-Y151 HydrophobicContact CE1-CD1 4.5Å; Y146-Y151 HydrophobicContact CE1-CG 4.14Å; Y146-Y151 HydrophobicContact CE2-CD1 4.13Å; Y146-Y151 AromaticContact CE2-CD2 3.84Å; Y146-Y151 HydrophobicContact CE2-CD2 3.84Å; Y146-Y151 HydrophobicContact CE2-CE1 4.44Å; Y146-Y151 HydrophobicContact CE2-CE2 4.17Å; Y146-Y151 AromaticContact CE2-CG 3.83Å; Y146-Y151 HydrophobicContact CE2-CG 3.83Å; Y146-Y151 AromaticContact CG-CD1 3.32Å; Y146-Y151 HydrophobicContact CG-CD1 3.32Å; Y146-Y151 AromaticContact CG-CE1 3.79Å; Y146-Y151 HydrophobicContact CG-CE1 3.79Å; Y146-Y151 AromaticContact CG-CG 3.75Å; Y146-Y151 HydrophobicContact CG-CG 3.75Å
147	E	89.4	Confident	90.2	Very high	158 Å²	158	59.8 Å²	59.8	74%	0.738	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.4	-113.3	178.8	-59.9	179.7	165.2	0	0	112.5	K145	K145-E147 VanDerWaalsContact C-N 3.28Å; K145-E147 PolarHBondContact O-N 3.19Å
148	H	87	Confident	90.4	Very high	186 Å²	186	59.2 Å²	59.2	86%	0.861	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.8	-3.1	-179.4	-58	-59.1	0	0	0	113.9	Y146	Y146-H148 PolarHBondContact O-N 2.79Å; Y146-H148 VanDerWaalsContact O-N 3.15Å
149	H	90.9	Very high	90.9	Very high	50 Å²	50	55.8 Å²	55.8	23%	0.231	28%	0.277	C	S	.	.			trans	-80.3	132.1	-173.2	-52.7	86.7	0	0	0	111.1	Y133 S136 F137 Y146 Y151	Y133-H149 HydrophobicContact CE2-CB 4.38Å; S136-H149 PolarHBondContact OG-CD2 2.86Å; S136-H149 VanDerWaalsContact OG-CD2 3.25Å; S136-H149 PolarHBondContact OG-NE2 3.13Å; F137-H149 HydrophobicContact CB-CB 4.12Å; F137-H149 AromaticContact CD2-CE1 3.83Å; F137-H149 AromaticContact CD2-CG 3.97Å; F137-H149 AromaticContact CD2-ND1 3.53Å; Y146-H149 WeakPolarHBondContact O-CB 3.28Å; Y146-H149 PolarHBondContact O-N 3.36Å; Y146-H149 PolarHBondContact O-ND1 3.47Å; H149-Y151 PolarHBondContact O-N 3.36Å
150	N	90.7	Very high	91.2	Very high	43 Å²	43	59.2 Å²	59.2	23%	0.23	29%	0.294	C	S	.	.			trans	-77.5	110	177.6	-172.9	7.8	0	0	0	111.8	T131 Y133 W152	T131-N150 PolarHBondContact O-ND2 3.44Å; Y133-N150 WeakPolarHBondContact CB-O 3.35Å; Y133-N150 VanDerWaalsContact CD2-O 3.3Å; Y133-N150 WeakPolarHBondContact CD2-O 3.25Å; N150-W152 PolarHBondContact ND2-NE1 2.92Å; N150-W152 PolarHBondContact OD1-N 2.91Å
151	Y	90.1	Very high	91.7	Very high	26 Å²	26	55.1 Å²	55.1	10%	0.102	27%	0.269	C	S	.	.			trans	-108.2	-6.5	173.3	66.8	-83.2	0	0	0	113.5	T87 Y146 H149 G153 M154 R155	T87-Y151 WeakPolarHBondContact CA-OH 3.21Å; T87-Y151 PolarHBondContact O-OH 3.25Å; Y146-Y151 VanDerWaalsContact CB-CD1 3.45Å; Y146-Y151 AromaticContact CD1-CD1 3.9Å; Y146-Y151 HydrophobicContact CD1-CD1 3.9Å; Y146-Y151 AromaticContact CD1-CG 3.99Å; Y146-Y151 HydrophobicContact CD1-CG 3.99Å; Y146-Y151 AromaticContact CD2-CD1 3.45Å; Y146-Y151 HydrophobicContact CD2-CD1 3.45Å; Y146-Y151 VanDerWaalsContact CD2-CD1 3.45Å; Y146-Y151 AromaticContact CD2-CD2 3.96Å; Y146-Y151 HydrophobicContact CD2-CD2 3.96Å; Y146-Y151 AromaticContact CD2-CE1 3.6Å; Y146-Y151 HydrophobicContact CD2-CE1 3.6Å; Y146-Y151 HydrophobicContact CD2-CE2 4.09Å; Y146-Y151 AromaticContact CD2-CG 3.66Å; Y146-Y151 HydrophobicContact CD2-CG 3.66Å; Y146-Y151 AromaticContact CD2-CZ 3.92Å; Y146-Y151 HydrophobicContact CE1-CD1 4.5Å; Y146-Y151 HydrophobicContact CE1-CG 4.14Å; Y146-Y151 HydrophobicContact CE2-CD1 4.13Å; Y146-Y151 AromaticContact CE2-CD2 3.84Å; Y146-Y151 HydrophobicContact CE2-CD2 3.84Å; Y146-Y151 HydrophobicContact CE2-CE1 4.44Å; Y146-Y151 HydrophobicContact CE2-CE2 4.17Å; Y146-Y151 AromaticContact CE2-CG 3.83Å; Y146-Y151 HydrophobicContact CE2-CG 3.83Å; Y146-Y151 AromaticContact CG-CD1 3.32Å; Y146-Y151 HydrophobicContact CG-CD1 3.32Å; Y146-Y151 AromaticContact CG-CE1 3.79Å; Y146-Y151 HydrophobicContact CG-CE1 3.79Å; Y146-Y151 AromaticContact CG-CG 3.75Å; Y146-Y151 HydrophobicContact CG-CG 3.75Å; H149-Y151 PolarHBondContact O-N 3.36Å; Y151-G153 VanDerWaalsContact C-N 3.29Å; Y151-G153 PolarHBondContact O-N 3.16Å; Y151-M154 PolarHBondContact O-N 2.61Å; Y151-R155 HydrophobicContact CD2-CG 4.35Å; Y151-R155 PolarHBondContact O-N 3.14Å
152	W	92	Very high	92.2	Very high	138 Å²	138	49.1 Å²	49.1	52%	0.523	24%	0.243	S	C	.	.	H	α-helix	trans	-62.7	-36.1	-168.4	80.8	-112.2	0	0	0	112.1	T87 T131 N150 M154 R155 G156	T87-W152 HydrophobicContact CG2-CB 4.28Å; T131-W152 HydrophobicContact CG2-CH2 3.57Å; T131-W152 HydrophobicContact CG2-CZ2 3.56Å; T131-W152 HydrophobicContact CG2-CZ3 4.14Å; N150-W152 PolarHBondContact ND2-NE1 2.92Å; N150-W152 PolarHBondContact OD1-N 2.91Å; W152-M154 VanDerWaalsContact C-N 3.34Å; W152-M154 PolarHBondContact O-N 2.54Å; W152-R155 PolarHBondContact O-N 3.33Å; W152-G156 PolarHBondContact O-N 2.85Å
153	G	93.7	Very high	92.8	Very high	4 Å²	4	46 Å²	46	4%	0.041	22%	0.223	C	C	.	.	H	α-helix	trans	-64.5	-35.5	-179.8	0	0	0	0	0	113.7	T131 Y151 F157	T131-G153 WeakPolarHBondContact OG1-CA 3.46Å; Y151-G153 VanDerWaalsContact C-N 3.29Å; Y151-G153 PolarHBondContact O-N 3.16Å; G153-F157 WeakPolarHBondContact O-CB 3.39Å; G153-F157 PolarHBondContact O-N 3.21Å
154	M	95.1	Very high	93.5	Very high	1 Å²	1	47.5 Å²	47.5	1%	0.005	22%	0.22	C	C	.	.	H	α-helix	trans	-68.1	-48.1	178.1	-65.1	-169.6	175.6	0	0	111.3	I124 Y133 Y151 W152 F157 C158 I203	I124-M154 HydrophobicContact CG2-CB 4.31Å; I124-M154 HydrophobicContact CG2-CE 4.26Å; I124-M154 HydrophobicContact CG2-CG 4.03Å; I124-M154 HydrophobicContact CG2-SD 3.66Å; Y133-M154 HydrophobicContact CD1-CE 3.3Å; Y133-M154 HydrophobicContact CE1-CE 3.65Å; Y133-M154 HydrophobicContact CG-CE 4.13Å; Y151-M154 PolarHBondContact O-N 2.61Å; W152-M154 VanDerWaalsContact C-N 3.34Å; W152-M154 PolarHBondContact O-N 2.54Å; M154-F157 PolarHBondContact O-N 2.89Å; M154-C158 PolarHBondContact O-N 3Å; M154-C158 PolarHBondContact O-SG 3.37Å; M154-C158 VanDerWaalsContact O-SG 3.41Å; M154-I203 HydrophobicContact CB-CD1 3.72Å; M154-I203 HydrophobicContact CB-CG1 3.67Å; M154-I203 HydrophobicContact CB-CG2 4.14Å; M154-I203 HydrophobicContact CG-CD1 4.45Å; M154-I203 HydrophobicContact SD-CD1 3.97Å; M154-I203 HydrophobicContact SD-CG2 4.17Å
155	R	95.9	Very high	94	Very high	0 Å²	0	46 Å²	46	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-62.8	-46.3	173.7	-73.2	-166.4	179.6	166.8	1.5	111.6	I86 P89 H91 E96 Y151 W152 F157 C158 A159 Q201 I203	I86-R155 HydrophobicContact CD1-CB 4.22Å; I86-R155 HydrophobicContact CG1-CB 3.75Å; I86-R155 VanDerWaalsContact O-CD 3.3Å; I86-R155 WeakPolarHBondContact O-CD 3.45Å; I86-R155 PolarHBondContact O-NH1 2.74Å; P89-R155 PolarHBondContact O-NH1 3.16Å; P89-R155 PolarHBondContact O-NH2 3.18Å; H91-R155 PolarHBondContact O-NH2 3.36Å; E96-R155 IonicContact OE1-CZ 2.57Å; E96-R155 IonicContact OE1-NE 2.79Å; E96-R155 PolarHBondContact OE1-NE 3.36Å; E96-R155 IonicContact OE1-NH2 3.83Å; E96-R155 PolarHBondContact OE1-NH2 2.72Å; E96-R155 IonicContact OE2-CZ 2.71Å; E96-R155 IonicContact OE2-NE 3.62Å; E96-R155 IonicContact OE2-NH2 3.12Å; E96-R155 PolarHBondContact OE2-NH2 3.46Å; Y151-R155 HydrophobicContact CD2-CG 4.35Å; Y151-R155 PolarHBondContact O-N 3.14Å; W152-R155 PolarHBondContact O-N 3.33Å; R155-F157 VanDerWaalsContact C-N 3.3Å; R155-F157 PolarHBondContact O-N 3.33Å; R155-C158 WeakPolarHBondContact O-CB 3.29Å; R155-C158 PolarHBondContact O-N 2.91Å; R155-C158 VanDerWaalsContact O-N 3.13Å; R155-A159 WeakPolarHBondContact O-CB 3.28Å; R155-A159 PolarHBondContact O-N 2.72Å; R155-Q201 VanDerWaalsContact CB-O 3.27Å; R155-Q201 WeakPolarHBondContact CB-O 3.39Å; R155-Q201 WeakPolarHBondContact CG-O 3.17Å; R155-I203 HydrophobicContact CG-CD1 4.39Å; R155-I203 HydrophobicContact CG-CG1 3.73Å
156	G	95.8	Very high	94.4	Very high	14 Å²	14	39 Å²	39	14%	0.144	18%	0.181	C	C	.	.	H	α-helix	trans	-55.3	-41.7	177.9	0	0	0	0	0	113.3	W152 M160	W152-G156 PolarHBondContact O-N 2.85Å; G156-M160 WeakPolarHBondContact O-CB 3.4Å; G156-M160 PolarHBondContact O-N 3.35Å
157	F	96.7	Very high	94.8	Very high	41 Å²	41	39.5 Å²	39.5	18%	0.18	18%	0.184	C	C	.	.	H	α-helix	trans	-66.4	-44.8	175.4	-178.4	-95.1	0	0	0	112.7	L123 A127 G153 M154 R155 M160 L161 I208	L123-F157 HydrophobicContact CB-CE1 3.68Å; L123-F157 HydrophobicContact CB-CZ 3.83Å; L123-F157 HydrophobicContact CD1-CZ 4.33Å; L123-F157 HydrophobicContact CD2-CZ 4.25Å; L123-F157 HydrophobicContact CG-CZ 4.36Å; A127-F157 HydrophobicContact CB-CB 3.49Å; A127-F157 VanDerWaalsContact CB-CB 3.49Å; A127-F157 HydrophobicContact CB-CD1 4.36Å; A127-F157 HydrophobicContact CB-CD2 4.1Å; A127-F157 HydrophobicContact CB-CG 3.74Å; G153-F157 WeakPolarHBondContact O-CB 3.39Å; G153-F157 PolarHBondContact O-N 3.21Å; M154-F157 PolarHBondContact O-N 2.89Å; R155-F157 VanDerWaalsContact C-N 3.3Å; R155-F157 PolarHBondContact O-N 3.33Å; F157-M160 HydrophobicContact CD2-CE 3.73Å; F157-M160 HydrophobicContact CE2-CE 3.99Å; F157-M160 PolarHBondContact O-N 3.15Å; F157-L161 HydrophobicContact CD1-CD1 4.2Å; F157-L161 HydrophobicContact CE1-CD1 3.46Å; F157-L161 VanDerWaalsContact CE1-CD1 3.46Å; F157-L161 HydrophobicContact CE1-CG 4.27Å; F157-L161 HydrophobicContact CE2-CD1 4.4Å; F157-L161 HydrophobicContact CZ-CD1 3.58Å; F157-L161 HydrophobicContact CZ-CG 4.24Å; F157-L161 PolarHBondContact O-N 2.92Å; F157-I208 HydrophobicContact CE1-CD1 4.14Å; F157-I208 HydrophobicContact CE1-CG1 4.49Å
158	C	96.9	Very high	95.2	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-60	-46.9	174.7	-68.2	0	0	0	0	111.9	M154 R155 L161 G162 S200 Y202 P207	M154-C158 PolarHBondContact O-N 3Å; M154-C158 PolarHBondContact O-SG 3.37Å; M154-C158 VanDerWaalsContact O-SG 3.41Å; R155-C158 WeakPolarHBondContact O-CB 3.29Å; R155-C158 PolarHBondContact O-N 2.91Å; R155-C158 VanDerWaalsContact O-N 3.13Å; C158-L161 PolarHBondContact O-N 3.33Å; C158-G162 PolarHBondContact O-N 2.88Å; C158-S200 CarbonylContact C-O 3.41Å; C158-S200 WeakPolarHBondContact CB-O 3.32Å; C158-Y202 VanDerWaalsContact CB-O 3.29Å; C158-Y202 WeakPolarHBondContact CB-O 3.43Å; C158-Y202 PolarHBondContact SG-O 3.17Å; C158-Y202 VanDerWaalsContact SG-O 3.38Å; C158-P207 HydrophobicContact CB-CB 4.4Å; C158-P207 HydrophobicContact CB-CG 4.32Å
159	A	97	Very high	95.7	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-67.4	-37.2	-179.9	0	0	0	0	0	112.4	R82 L83 I86 R155 G162 S163 S200	R82-A159 HydrophobicContact CB-CB 4.41Å; L83-A159 HydrophobicContact CD2-CB 3.84Å; I86-A159 HydrophobicContact CD1-CB 3.41Å; I86-A159 VanDerWaalsContact CD1-CB 3.41Å; R155-A159 WeakPolarHBondContact O-CB 3.28Å; R155-A159 PolarHBondContact O-N 2.72Å; A159-G162 PolarHBondContact O-N 3.45Å; A159-S163 WeakPolarHBondContact O-CB 3.31Å; A159-S163 PolarHBondContact O-N 3Å; A159-S163 PolarHBondContact O-OG 2.88Å; A159-S200 VanDerWaalsContact CA-O 3.26Å; A159-S200 WeakPolarHBondContact CA-O 3.35Å; A159-S200 PolarHBondContact N-O 2.95Å
160	M	96.8	Very high	96	Very high	75 Å²	75	22.1 Å²	22.1	37%	0.369	10%	0.102	S	C	.	.	H	α-helix	trans	-60.2	-48.8	172.8	178.3	-175	70.3	0	0	111.2	F79 G156 F157 S163 F164	F79-M160 HydrophobicContact CE1-CG 4.19Å; G156-M160 WeakPolarHBondContact O-CB 3.4Å; G156-M160 PolarHBondContact O-N 3.35Å; F157-M160 HydrophobicContact CD2-CE 3.73Å; F157-M160 HydrophobicContact CE2-CE 3.99Å; F157-M160 PolarHBondContact O-N 3.15Å; M160-S163 WeakPolarHBondContact O-CB 3.25Å; M160-S163 PolarHBondContact O-N 3.38Å; M160-S163 VanDerWaalsContact O-N 3.17Å; M160-F164 HydrophobicContact CG-CE2 4.41Å; M160-F164 VanDerWaalsContact O-CD2 3.27Å; M160-F164 WeakPolarHBondContact O-CD2 3.4Å
161	L	97.6	Very high	96.3	Very high	14 Å²	14	21.5 Å²	21.5	7%	0.073	10%	0.099	C	C	.	.	H	α-helix	trans	-66.3	-39.3	176.7	-67.4	-174.2	0	0	0	112.1	F157 C158 S163 F164 I208 F211	F157-L161 HydrophobicContact CD1-CD1 4.2Å; F157-L161 HydrophobicContact CE1-CD1 3.46Å; F157-L161 VanDerWaalsContact CE1-CD1 3.46Å; F157-L161 HydrophobicContact CE1-CG 4.27Å; F157-L161 HydrophobicContact CE2-CD1 4.4Å; F157-L161 HydrophobicContact CZ-CD1 3.58Å; F157-L161 HydrophobicContact CZ-CG 4.24Å; F157-L161 PolarHBondContact O-N 2.92Å; C158-L161 PolarHBondContact O-N 3.33Å; L161-S163 PolarHBondContact O-N 2.98Å; L161-F164 PolarHBondContact O-N 2.87Å; L161-I208 HydrophobicContact CD1-CB 4.28Å; L161-I208 HydrophobicContact CD1-CG1 4.11Å; L161-I208 HydrophobicContact CD1-CG2 3.93Å; L161-F211 HydrophobicContact CB-CB 4.1Å; L161-F211 HydrophobicContact CB-CD2 4.2Å; L161-F211 HydrophobicContact CB-CG 4.17Å; L161-F211 HydrophobicContact CD2-CD1 4.1Å; L161-F211 HydrophobicContact CD2-CD2 3.84Å; L161-F211 HydrophobicContact CD2-CE1 4.12Å; L161-F211 HydrophobicContact CD2-CE2 3.86Å; L161-F211 HydrophobicContact CD2-CG 3.97Å; L161-F211 HydrophobicContact CD2-CZ 4.01Å; L161-F211 HydrophobicContact CG-CG 4.46Å
162	G	96.9	Very high	96.7	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-59.3	-30.8	171.4	0	0	0	0	0	113.5	R82 C158 A159 F164 L165	R82-G162 VanDerWaalsContact CD-C 3.47Å; R82-G162 WeakPolarHBondContact CD-O 3.28Å; R82-G162 PolarHBondContact NE-O 3.2Å; R82-G162 VanDerWaalsContact NE-O 3.14Å; C158-G162 PolarHBondContact O-N 2.88Å; A159-G162 PolarHBondContact O-N 3.45Å; G162-F164 VanDerWaalsContact C-N 3.25Å; G162-F164 PolarHBondContact O-N 2.91Å; G162-L165 WeakPolarHBondContact O-CB 3.39Å; G162-L165 VanDerWaalsContact O-CG 3.3Å; G162-L165 WeakPolarHBondContact O-CG 3.34Å; G162-L165 PolarHBondContact O-N 2.93Å; G162-L165 VanDerWaalsContact O-N 3.11Å
163	S	97.8	Very high	96.9	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-70.8	-18.2	179.4	-58.5	0	0	0	0	113.4	S78 R82 A159 M160 L161 I167	S78-S163 PolarHBondContact OG-O 3.4Å; R82-S163 WeakPolarHBondContact CB-OG 3.48Å; A159-S163 WeakPolarHBondContact O-CB 3.31Å; A159-S163 PolarHBondContact O-N 3Å; A159-S163 PolarHBondContact O-OG 2.88Å; M160-S163 WeakPolarHBondContact O-CB 3.25Å; M160-S163 PolarHBondContact O-N 3.38Å; M160-S163 VanDerWaalsContact O-N 3.17Å; L161-S163 PolarHBondContact O-N 2.98Å; S163-I167 VanDerWaalsContact O-CD1 3.31Å; S163-I167 WeakPolarHBondContact O-CD1 3.39Å; S163-I167 WeakPolarHBondContact O-CG1 3.25Å
164	F	97.9	Very high	97	Very high	67 Å²	67	13.8 Å²	13.8	29%	0.294	7%	0.069	S	C	.	.	H	α-helix	trans	-80.3	-14.6	170.6	-71.5	-82.5	0	0	0	113.5	F79 M160 L161 G162 I167 F168 F211	F79-F164 HydrophobicContact CZ-CE2 4Å; F79-F164 HydrophobicContact CZ-CZ 4.12Å; M160-F164 HydrophobicContact CG-CE2 4.41Å; M160-F164 VanDerWaalsContact O-CD2 3.27Å; M160-F164 WeakPolarHBondContact O-CD2 3.4Å; L161-F164 PolarHBondContact O-N 2.87Å; G162-F164 VanDerWaalsContact C-N 3.25Å; G162-F164 PolarHBondContact O-N 2.91Å; F164-I167 HydrophobicContact CD1-CD1 4.34Å; F164-I167 PolarHBondContact O-N 3.39Å; F164-F168 HydrophobicContact CB-CD1 4.5Å; F164-F168 HydrophobicContact CB-CD2 4.16Å; F164-F168 HydrophobicContact CB-CE1 4.19Å; F164-F168 HydrophobicContact CB-CE2 3.83Å; F164-F168 HydrophobicContact CB-CG 4.5Å; F164-F168 HydrophobicContact CB-CZ 3.85Å; F164-F168 AromaticContact CD1-CE1 3.92Å; F164-F168 HydrophobicContact CD1-CE1 3.92Å; F164-F168 HydrophobicContact CD1-CZ 4Å; F164-F168 HydrophobicContact CG-CE1 4.42Å; F164-F168 HydrophobicContact CG-CZ 4.14Å; F164-F168 WeakPolarHBondContact O-CB 3.32Å; F164-F168 WeakPolarHBondContact O-CG 3.5Å; F164-F168 PolarHBondContact O-N 3.4Å; F164-F211 HydrophobicContact CB-CD2 3.85Å; F164-F211 HydrophobicContact CB-CE2 3.85Å; F164-F211 HydrophobicContact CD2-CD2 4.25Å; F164-F211 AromaticContact CD2-CE2 3.81Å; F164-F211 HydrophobicContact CD2-CE2 3.81Å; F164-F211 HydrophobicContact CG-CD2 4.3Å; F164-F211 AromaticContact CG-CE2 3.87Å; F164-F211 HydrophobicContact CG-CE2 3.87Å
165	L	97.9	Very high	96.9	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-62.1	-48	-175.9	-54.5	176	0	0	0	113	G162 I167 A169 M210 M214 L680	G162-L165 WeakPolarHBondContact O-CB 3.39Å; G162-L165 VanDerWaalsContact O-CG 3.3Å; G162-L165 WeakPolarHBondContact O-CG 3.34Å; G162-L165 PolarHBondContact O-N 2.93Å; G162-L165 VanDerWaalsContact O-N 3.11Å; L165-I167 VanDerWaalsContact C-N 3.32Å; L165-I167 PolarHBondContact O-N 3.07Å; L165-A169 WeakPolarHBondContact O-CB 3.43Å; L165-A169 PolarHBondContact O-N 2.85Å; L165-M210 HydrophobicContact CD1-CB 3.89Å; L165-M210 HydrophobicContact CD1-CE 3.9Å; L165-M210 HydrophobicContact CD1-SD 4.19Å; L165-M210 VanDerWaalsContact CD2-C 3.43Å; L165-M210 HydrophobicContact CD2-CB 3.68Å; L165-M210 HydrophobicContact CG-CB 4.47Å; L165-M214 HydrophobicContact CD2-CB 4.32Å; L165-M214 HydrophobicContact CD2-CG 3.96Å; L165-L680 HydrophobicContact CB-CD2 4.48Å; L165-L680 HydrophobicContact CD2-CD1 4.42Å
166	P	97.6	Very high	96.8	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-70.2	-29	175.7	-17.8	33.8	0	0	0	112.9	S78 A169 Y170 L190 I191	S78-P166 VanDerWaalsContact OG-CD 3.31Å; S78-P166 WeakPolarHBondContact OG-CD 3.29Å; S78-P166 WeakPolarHBondContact OG-CG 3.22Å; P166-A169 PolarHBondContact O-N 3.33Å; P166-Y170 WeakPolarHBondContact O-CB 3.31Å; P166-Y170 PolarHBondContact O-N 3.49Å; P166-L190 HydrophobicContact CB-CB 4.02Å; P166-L190 HydrophobicContact CG-CB 4.01Å; P166-I191 HydrophobicContact CB-CD1 4.38Å; P166-I191 HydrophobicContact CB-CG1 3.72Å; P166-I191 HydrophobicContact CG-CG1 3.96Å
167	I	97.6	Very high	96.6	Very high	13 Å²	13	16.1 Å²	16.1	7%	0.067	8%	0.077	C	C	.	.	H	α-helix	trans	-69.7	-46.6	178.6	-55.4	173.5	0	0	0	110.1	L71 V74 T75 F79 S163 F164 L165 Y170 L171	L71-I167 HydrophobicContact CD1-CG2 4.14Å; V74-I167 HydrophobicContact CG1-CG1 4.49Å; T75-I167 HydrophobicContact CG2-CD1 3.81Å; F79-I167 HydrophobicContact CD2-CD1 4.27Å; F79-I167 HydrophobicContact CE2-CD1 3.88Å; S163-I167 VanDerWaalsContact O-CD1 3.31Å; S163-I167 WeakPolarHBondContact O-CD1 3.39Å; S163-I167 WeakPolarHBondContact O-CG1 3.25Å; F164-I167 HydrophobicContact CD1-CD1 4.34Å; F164-I167 PolarHBondContact O-N 3.39Å; L165-I167 VanDerWaalsContact C-N 3.32Å; L165-I167 PolarHBondContact O-N 3.07Å; I167-Y170 PolarHBondContact O-N 3.37Å; I167-L171 HydrophobicContact CG2-CD1 4.37Å; I167-L171 WeakPolarHBondContact O-CG 3.31Å; I167-L171 PolarHBondContact O-N 3.45Å
168	F	98.1	Very high	96.3	Very high	28 Å²	28	24.1 Å²	24.1	12%	0.123	11%	0.107	C	C	.	.	H	α-helix	trans	-65.8	-38.9	174.3	-65.5	-15.7	0	0	0	111.2	F164 L171 I172 F211 M214 A215 L218	F164-F168 HydrophobicContact CB-CD1 4.5Å; F164-F168 HydrophobicContact CB-CD2 4.16Å; F164-F168 HydrophobicContact CB-CE1 4.19Å; F164-F168 HydrophobicContact CB-CE2 3.83Å; F164-F168 HydrophobicContact CB-CG 4.5Å; F164-F168 HydrophobicContact CB-CZ 3.85Å; F164-F168 AromaticContact CD1-CE1 3.92Å; F164-F168 HydrophobicContact CD1-CE1 3.92Å; F164-F168 HydrophobicContact CD1-CZ 4Å; F164-F168 HydrophobicContact CG-CE1 4.42Å; F164-F168 HydrophobicContact CG-CZ 4.14Å; F164-F168 WeakPolarHBondContact O-CB 3.32Å; F164-F168 WeakPolarHBondContact O-CG 3.5Å; F164-F168 PolarHBondContact O-N 3.4Å; F168-L171 PolarHBondContact O-N 2.92Å; F168-I172 WeakPolarHBondContact O-CB 3.45Å; F168-I172 WeakPolarHBondContact O-CD1 3.18Å; F168-I172 WeakPolarHBondContact O-CG1 3.35Å; F168-I172 PolarHBondContact O-N 3.41Å; F168-F211 AromaticContact CE2-CD2 3.74Å; F168-F211 HydrophobicContact CE2-CD2 3.74Å; F168-F211 AromaticContact CE2-CE2 3.53Å; F168-F211 HydrophobicContact CE2-CE2 3.53Å; F168-F211 HydrophobicContact CE2-CZ 4.2Å; F168-F211 HydrophobicContact CZ-CD2 4.34Å; F168-F211 AromaticContact CZ-CE2 3.68Å; F168-F211 HydrophobicContact CZ-CE2 3.68Å; F168-F211 HydrophobicContact CZ-CZ 4.22Å; F168-M214 HydrophobicContact CB-CB 4.02Å; F168-M214 HydrophobicContact CB-CE 4.32Å; F168-M214 HydrophobicContact CD2-CB 3.79Å; F168-M214 HydrophobicContact CG-CB 4.42Å; F168-A215 HydrophobicContact CD2-CB 4.44Å; F168-A215 HydrophobicContact CE2-CB 3.88Å; F168-A215 HydrophobicContact CZ-CB 4.48Å; F168-L218 HydrophobicContact CB-CD2 4.28Å; F168-L218 HydrophobicContact CD1-CD2 3.49Å; F168-L218 VanDerWaalsContact CD1-CD2 3.49Å; F168-L218 HydrophobicContact CE1-CD2 4.02Å; F168-L218 HydrophobicContact CG-CD2 4Å
169	A	97.8	Very high	96	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-63.1	-42.6	174.7	0	0	0	0	0	112.8	L165 P166 I172 V173 T186 L190 M214 M684	L165-A169 WeakPolarHBondContact O-CB 3.43Å; L165-A169 PolarHBondContact O-N 2.85Å; P166-A169 PolarHBondContact O-N 3.33Å; A169-I172 PolarHBondContact O-N 2.96Å; A169-V173 WeakPolarHBondContact O-CB 3.33Å; A169-V173 WeakPolarHBondContact O-CG2 3.23Å; A169-V173 PolarHBondContact O-N 3.36Å; A169-T186 HydrophobicContact CB-CG2 3.71Å; A169-L190 HydrophobicContact CB-CD1 3.45Å; A169-L190 VanDerWaalsContact CB-CD1 3.45Å; A169-M214 HydrophobicContact CB-CE 3.63Å; A169-M684 HydrophobicContact CB-CG 3.97Å; A169-M684 HydrophobicContact CB-SD 4.12Å
170	Y	97.3	Very high	95.7	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-55.6	-51.3	172.4	-180	-85.7	0	0	0	110.8	L71 V74 P166 I167 V173 Q174 A183 A187	L71-Y170 HydrophobicContact CD1-CD1 3.86Å; L71-Y170 HydrophobicContact CD1-CE1 4.18Å; V74-Y170 HydrophobicContact CG1-CG 4.47Å; V74-Y170 HydrophobicContact CG2-CD2 4.02Å; V74-Y170 HydrophobicContact CG2-CE2 4.3Å; P166-Y170 WeakPolarHBondContact O-CB 3.31Å; P166-Y170 PolarHBondContact O-N 3.49Å; I167-Y170 PolarHBondContact O-N 3.37Å; Y170-V173 PolarHBondContact O-N 2.99Å; Y170-Q174 WeakPolarHBondContact O-CB 3.38Å; Y170-Q174 PolarHBondContact O-N 3.22Å; Y170-A183 HydrophobicContact CD1-CB 4.39Å; Y170-A183 VanDerWaalsContact CD2-C 3.48Å; Y170-A183 HydrophobicContact CD2-CB 3.59Å; Y170-A183 WeakPolarHBondContact CD2-O 3.38Å; Y170-A183 HydrophobicContact CE1-CB 4.39Å; Y170-A183 HydrophobicContact CE2-CB 3.59Å; Y170-A183 HydrophobicContact CG-CB 4Å; Y170-A183 WeakPolarHBondContact O-CB 3.22Å; Y170-A187 HydrophobicContact CD2-CB 4Å
171	L	96.9	Very high	95.5	Very high	30 Å²	30	24.9 Å²	24.9	16%	0.157	11%	0.112	C	C	.	.	H	α-helix	trans	-65.5	-45.3	-178.7	-67.5	170.7	0	0	0	111.9	L71 I167 F168 V173 Q174 E175 L218	L71-L171 HydrophobicContact CD1-CD2 4.21Å; L71-L171 HydrophobicContact CD1-CG 4.42Å; L71-L171 HydrophobicContact CD2-CD2 4.28Å; I167-L171 HydrophobicContact CG2-CD1 4.37Å; I167-L171 WeakPolarHBondContact O-CG 3.31Å; I167-L171 PolarHBondContact O-N 3.45Å; F168-L171 PolarHBondContact O-N 2.92Å; L171-V173 PolarHBondContact O-N 2.88Å; L171-Q174 PolarHBondContact O-N 3.47Å; L171-E175 WeakPolarHBondContact O-CB 3.39Å; L171-E175 VanDerWaalsContact O-CG 3.28Å; L171-E175 WeakPolarHBondContact O-CG 3.47Å; L171-E175 PolarHBondContact O-N 3.1Å; L171-L218 HydrophobicContact CB-CD1 3.72Å; L171-L218 HydrophobicContact CB-CD2 4.42Å; L171-L218 HydrophobicContact CD1-CD2 4.1Å
172	I	97.3	Very high	95.4	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-57.2	-50	176.1	-70.9	159.5	0	0	0	110.5	F168 A169 E175 L176 M214 V217 L218 L652 M684	F168-I172 WeakPolarHBondContact O-CB 3.45Å; F168-I172 WeakPolarHBondContact O-CD1 3.18Å; F168-I172 WeakPolarHBondContact O-CG1 3.35Å; F168-I172 PolarHBondContact O-N 3.41Å; A169-I172 PolarHBondContact O-N 2.96Å; I172-E175 PolarHBondContact O-N 2.84Å; I172-L176 HydrophobicContact CG2-CD1 3.75Å; I172-L176 HydrophobicContact CG2-CG 4.39Å; I172-L176 WeakPolarHBondContact O-CB 3.44Å; I172-L176 VanDerWaalsContact O-CG 3.32Å; I172-L176 WeakPolarHBondContact O-CG 3.48Å; I172-L176 PolarHBondContact O-N 2.64Å; I172-M214 HydrophobicContact CD1-CE 3.82Å; I172-M214 HydrophobicContact CD1-SD 4.34Å; I172-V217 HydrophobicContact CD1-CB 4.02Å; I172-V217 HydrophobicContact CD1-CG1 3.71Å; I172-V217 HydrophobicContact CG1-CG1 4.18Å; I172-V217 HydrophobicContact CG2-CG1 4.23Å; I172-L218 HydrophobicContact CD1-CB 4.11Å; I172-L218 HydrophobicContact CG1-CB 3.86Å; I172-L218 HydrophobicContact CG1-CD1 4.07Å; I172-L652 HydrophobicContact CG2-CD2 4.4Å; I172-M684 HydrophobicContact CB-SD 3.86Å; I172-M684 HydrophobicContact CD1-CE 4.46Å; I172-M684 HydrophobicContact CD1-SD 3.95Å; I172-M684 HydrophobicContact CG2-SD 3.57Å; I172-M684 VanDerWaalsContact CG2-SD 3.57Å
173	V	96.8	Very high	95.3	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-69.5	-36.9	-178.4	171.5	0	0	0	0	111.7	A169 Y170 L171 E175 L176 S177 A182 A183 T186 M684 V688	A169-V173 WeakPolarHBondContact O-CB 3.33Å; A169-V173 WeakPolarHBondContact O-CG2 3.23Å; A169-V173 PolarHBondContact O-N 3.36Å; Y170-V173 PolarHBondContact O-N 2.99Å; L171-V173 PolarHBondContact O-N 2.88Å; V173-E175 PolarHBondContact O-N 3.48Å; V173-L176 PolarHBondContact O-N 3.31Å; V173-S177 WeakPolarHBondContact O-CB 3.27Å; V173-S177 PolarHBondContact O-N 3.42Å; V173-S177 PolarHBondContact O-OG 2.99Å; V173-A182 HydrophobicContact CG1-CB 3.73Å; V173-A183 HydrophobicContact CG1-CB 4.41Å; V173-T186 HydrophobicContact CG2-CG2 3.92Å; V173-M684 HydrophobicContact CG2-CB 3.57Å; V173-M684 HydrophobicContact CG2-CG 3.69Å; V173-M684 HydrophobicContact CG2-SD 4.28Å; V173-V688 HydrophobicContact CG1-CG2 3.86Å; V173-V688 HydrophobicContact CG2-CG2 4.43Å
174	Q	95.4	Very high	95.2	Very high	6 Å²	6	26.7 Å²	26.7	3%	0.028	12%	0.121	C	C	.	.	H	α-helix	trans	-58.9	-47.7	172.3	-173.2	-170.6	-32.1	0	0	110.7	P66 Y170 L171 L176 R178 H180 A183	P66-Q174 VanDerWaalsContact CA-NE2 3.34Å; Y170-Q174 WeakPolarHBondContact O-CB 3.38Å; Y170-Q174 PolarHBondContact O-N 3.22Å; L171-Q174 PolarHBondContact O-N 3.47Å; Q174-L176 PolarHBondContact O-N 2.85Å; Q174-R178 WeakPolarHBondContact O-CA 3.26Å; Q174-R178 PolarHBondContact O-N 2.9Å; Q174-H180 PolarHBondContact NE2-CE1 2.99Å; Q174-A183 HydrophobicContact CB-CB 3.99Å
175	E	93.6	Very high	95.1	Very high	25 Å²	25	23.7 Å²	23.7	12%	0.117	11%	0.108	C	C	.	.	H	α-helix	trans	-69.7	-30	-177.9	-65.9	-28.5	148.1	0	0	114.1	L171 I172 V173 V221 K222 Q225	L171-E175 WeakPolarHBondContact O-CB 3.39Å; L171-E175 VanDerWaalsContact O-CG 3.28Å; L171-E175 WeakPolarHBondContact O-CG 3.47Å; L171-E175 PolarHBondContact O-N 3.1Å; I172-E175 PolarHBondContact O-N 2.84Å; V173-E175 PolarHBondContact O-N 3.48Å; E175-V221 HydrophobicContact CB-CG1 3.57Å; E175-V221 HydrophobicContact CG-CG1 4.41Å; E175-K222 HydrophobicContact CG-CD 4.28Å; E175-K222 WeakPolarHBondContact OE1-CE 3.19Å; E175-K222 IonicContact OE1-NZ 3.58Å; E175-K222 PolarHBondContact OE1-NZ 2.83Å; E175-K222 IonicContact OE2-NZ 2.81Å; E175-Q225 PolarHBondContact OE2-NE2 3.43Å; E175-Q225 PolarHBondContact OE2-OE1 3.03Å
176	L	93.5	Very high	95	Very high	31 Å²	31	23.7 Å²	23.7	16%	0.162	11%	0.108	C	C	.	.	H	α-helix	trans	-82.8	-36	177.9	-69.6	177.7	0	0	0	113.6	I172 V173 Q174 V221 L651 L652	I172-L176 HydrophobicContact CG2-CD1 3.75Å; I172-L176 HydrophobicContact CG2-CG 4.39Å; I172-L176 WeakPolarHBondContact O-CB 3.44Å; I172-L176 VanDerWaalsContact O-CG 3.32Å; I172-L176 WeakPolarHBondContact O-CG 3.48Å; I172-L176 PolarHBondContact O-N 2.64Å; V173-L176 PolarHBondContact O-N 3.31Å; Q174-L176 PolarHBondContact O-N 2.85Å; L176-V221 HydrophobicContact CD1-CG2 4.44Å; L176-V221 HydrophobicContact CD2-CG1 3.94Å; L176-V221 HydrophobicContact CD2-CG2 3.97Å; L176-V221 HydrophobicContact CG-CG1 4.13Å; L176-V221 HydrophobicContact CG-CG2 4.26Å; L176-L651 HydrophobicContact CD1-CD2 4.49Å; L176-L651 HydrophobicContact CD2-CD2 4.11Å; L176-L652 HydrophobicContact CD1-CD1 4.07Å; L176-L652 HydrophobicContact CD1-CD2 4.06Å; L176-L652 HydrophobicContact CD1-CG 3.94Å
177	S	91.9	Very high	95	Very high	8 Å²	8	23.7 Å²	23.7	6%	0.056	11%	0.108	C	C	.	.	H	α-helix	trans	-104.5	-11.3	-174.6	68.5	0	0	0	0	114.8	V173 S179 I644	V173-S177 WeakPolarHBondContact O-CB 3.27Å; V173-S177 PolarHBondContact O-N 3.42Å; V173-S177 PolarHBondContact O-OG 2.99Å; S177-S179 PolarHBondContact O-N 3.47Å; S177-S179 VanDerWaalsContact O-N 3.12Å; S177-S179 WeakPolarHBondContact OG-CB 3.43Å; S177-S179 PolarHBondContact OG-N 2.86Å; S177-I644 WeakPolarHBondContact O-CD1 3.38Å
178	R	90	Very high	95	Very high	210 Å²	210	23.5 Å²	23.5	79%	0.792	11%	0.109	S	C	*	.			trans	52.9	26.8	-169.9	-55.3	-179.5	-174.7	165.1	3.5	113	Q174	Q174-R178 WeakPolarHBondContact O-CA 3.26Å; Q174-R178 PolarHBondContact O-N 2.9Å
179	S	90.7	Very high	95	Very high	3 Å²	3	22.2 Å²	22.2	2%	0.021	10%	0.103	C	C	.	.			trans	-125.8	115	-173.3	176.1	0	0	0	0	112.1	S177 T181 A182 A183 D691 R695	S177-S179 PolarHBondContact O-N 3.47Å; S177-S179 VanDerWaalsContact O-N 3.12Å; S177-S179 WeakPolarHBondContact OG-CB 3.43Å; S177-S179 PolarHBondContact OG-N 2.86Å; S179-T181 PolarHBondContact O-N 2.77Å; S179-T181 PolarHBondContact OG-N 3.39Å; S179-T181 PolarHBondContact OG-OG1 2.92Å; S179-A182 PolarHBondContact OG-N 2.69Å; S179-A182 VanDerWaalsContact OG-N 3.14Å; S179-A183 WeakPolarHBondContact O-CB 3.32Å; S179-A183 PolarHBondContact O-N 2.82Å; S179-A183 VanDerWaalsContact O-N 3.13Å; S179-D691 WeakPolarHBondContact CB-OD2 3.33Å; S179-D691 PolarHBondContact OG-OD2 3.24Å; S179-R695 PolarHBondContact OG-NH2 2.41Å
180	H	90.9	Very high	95	Very high	52 Å²	52	22.2 Å²	22.2	24%	0.241	10%	0.103	C	C	.	.	H	α-helix	trans	-64.5	-26.2	171.1	-56.3	-54.3	0	0	0	112.6	L70 Q174 L184	L70-H180 HydrophobicContact CD1-CB 4.31Å; Q174-H180 PolarHBondContact NE2-CE1 2.99Å; H180-L184 VanDerWaalsContact O-CB 3.25Å; H180-L184 WeakPolarHBondContact O-CB 3.43Å; H180-L184 PolarHBondContact O-N 3.45Å
181	T	92.4	Very high	95	Very high	36 Å²	36	22.4 Å²	22.4	22%	0.221	10%	0.104	C	C	.	.	H	α-helix	trans	-76.3	-42	179.1	45.3	0	0	0	0	111.6	S179 A183 L184 I185 D691 R695	S179-T181 PolarHBondContact O-N 2.77Å; S179-T181 PolarHBondContact OG-N 3.39Å; S179-T181 PolarHBondContact OG-OG1 2.92Å; T181-A183 VanDerWaalsContact C-N 3.32Å; T181-A183 PolarHBondContact O-N 3.23Å; T181-L184 PolarHBondContact O-N 3.45Å; T181-I185 VanDerWaalsContact O-CG1 3.29Å; T181-I185 WeakPolarHBondContact O-CG1 3.29Å; T181-I185 PolarHBondContact O-N 3.25Å; T181-D691 VanDerWaalsContact CB-OD1 3.26Å; T181-D691 WeakPolarHBondContact CB-OD1 3.41Å; T181-D691 PolarHBondContact OG1-OD1 3.07Å; T181-D691 PolarHBondContact OG1-OD2 2.97Å; T181-R695 PolarHBondContact OG1-NH2 3.27Å
182	A	94.2	Very high	95	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-59.8	-43.2	170.5	0	0	0	0	0	111.8	V173 S179 I185 T186 G687 D691	V173-A182 HydrophobicContact CG1-CB 3.73Å; S179-A182 PolarHBondContact OG-N 2.69Å; S179-A182 VanDerWaalsContact OG-N 3.14Å; A182-I185 PolarHBondContact O-N 2.97Å; A182-T186 WeakPolarHBondContact O-CB 3.36Å; A182-T186 PolarHBondContact O-N 3.06Å; A182-T186 PolarHBondContact O-OG1 2.77Å; A182-G687 WeakPolarHBondContact CB-O 3.15Å; A182-D691 HydrophobicContact CB-CB 3.7Å
183	A	95.6	Very high	95	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-64.3	-42	177.2	0	0	0	0	0	112.3	Y170 V173 Q174 S179 T181 T186 A187	Y170-A183 HydrophobicContact CD1-CB 4.39Å; Y170-A183 VanDerWaalsContact CD2-C 3.48Å; Y170-A183 HydrophobicContact CD2-CB 3.59Å; Y170-A183 WeakPolarHBondContact CD2-O 3.38Å; Y170-A183 HydrophobicContact CE1-CB 4.39Å; Y170-A183 HydrophobicContact CE2-CB 3.59Å; Y170-A183 HydrophobicContact CG-CB 4Å; Y170-A183 WeakPolarHBondContact O-CB 3.22Å; V173-A183 HydrophobicContact CG1-CB 4.41Å; Q174-A183 HydrophobicContact CB-CB 3.99Å; S179-A183 WeakPolarHBondContact O-CB 3.32Å; S179-A183 PolarHBondContact O-N 2.82Å; S179-A183 VanDerWaalsContact O-N 3.13Å; T181-A183 VanDerWaalsContact C-N 3.32Å; T181-A183 PolarHBondContact O-N 3.23Å; A183-T186 WeakPolarHBondContact O-CB 3.28Å; A183-T186 PolarHBondContact O-N 3.13Å; A183-A187 WeakPolarHBondContact O-CB 3.45Å; A183-A187 PolarHBondContact O-N 2.89Å
184	L	95.3	Very high	94.9	Very high	51 Å²	51	22.4 Å²	22.4	27%	0.267	10%	0.103	S	C	.	.	H	α-helix	trans	-66.4	-41.5	177	-177.3	63.1	0	0	0	112.4	V74 H180 T181 A187 A188 L718	V74-L184 HydrophobicContact CG2-CD1 4.25Å; H180-L184 VanDerWaalsContact O-CB 3.25Å; H180-L184 WeakPolarHBondContact O-CB 3.43Å; H180-L184 PolarHBondContact O-N 3.45Å; T181-L184 PolarHBondContact O-N 3.45Å; L184-A187 PolarHBondContact O-N 3.43Å; L184-A188 WeakPolarHBondContact O-CB 3.4Å; L184-A188 PolarHBondContact O-N 3.32Å; L184-L718 HydrophobicContact CD2-CD1 4.29Å
185	I	96.1	Very high	94.9	Very high	5 Å²	5	22.1 Å²	22.1	3%	0.026	10%	0.102	C	C	.	.	H	α-helix	trans	-59.4	-49.8	174.1	-68.3	164.1	0	0	0	109.8	T181 A182 A187 A188 L189 D691 Q714 L717	T181-I185 VanDerWaalsContact O-CG1 3.29Å; T181-I185 WeakPolarHBondContact O-CG1 3.29Å; T181-I185 PolarHBondContact O-N 3.25Å; A182-I185 PolarHBondContact O-N 2.97Å; I185-A187 VanDerWaalsContact C-N 3.34Å; I185-A187 PolarHBondContact O-N 3.46Å; I185-A188 PolarHBondContact O-N 2.9Å; I185-L189 HydrophobicContact CG2-CD1 3.92Å; I185-L189 HydrophobicContact CG2-CG 4.42Å; I185-L189 VanDerWaalsContact O-CG 3.28Å; I185-L189 WeakPolarHBondContact O-CG 3.36Å; I185-L189 PolarHBondContact O-N 2.88Å; I185-D691 HydrophobicContact CD1-CB 4.36Å; I185-Q714 HydrophobicContact CD1-CG 4.47Å; I185-L717 HydrophobicContact CD1-CD2 4.15Å; I185-L717 HydrophobicContact CG1-CD2 4.14Å; I185-L717 HydrophobicContact CG2-CD2 3.78Å
186	T	96.9	Very high	95	Very high	0 Å²	0	21 Å²	21	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-56.1	-46.9	176.6	-60.5	0	0	0	0	112.1	A169 V173 A182 A183 L189 L190 M684	A169-T186 HydrophobicContact CB-CG2 3.71Å; V173-T186 HydrophobicContact CG2-CG2 3.92Å; A182-T186 WeakPolarHBondContact O-CB 3.36Å; A182-T186 PolarHBondContact O-N 3.06Å; A182-T186 PolarHBondContact O-OG1 2.77Å; A183-T186 WeakPolarHBondContact O-CB 3.28Å; A183-T186 PolarHBondContact O-N 3.13Å; T186-L189 PolarHBondContact O-N 3.28Å; T186-L190 HydrophobicContact CG2-CD1 4.36Å; T186-L190 PolarHBondContact O-N 3.5Å; T186-M684 HydrophobicContact CG2-CB 4.34Å; T186-M684 HydrophobicContact CG2-CG 3.76Å
187	A	97	Very high	95.1	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-63.6	-44.4	179.2	0	0	0	0	0	111.7	V74 Y170 A183 L184 I185 L190 I191	V74-A187 HydrophobicContact CG1-CB 3.87Å; V74-A187 HydrophobicContact CG2-CB 3.82Å; Y170-A187 HydrophobicContact CD2-CB 4Å; A183-A187 WeakPolarHBondContact O-CB 3.45Å; A183-A187 PolarHBondContact O-N 2.89Å; L184-A187 PolarHBondContact O-N 3.43Å; I185-A187 VanDerWaalsContact C-N 3.34Å; I185-A187 PolarHBondContact O-N 3.46Å; A187-L190 PolarHBondContact O-N 2.72Å; A187-I191 HydrophobicContact CB-CD1 4.41Å; A187-I191 WeakPolarHBondContact O-CB 3.49Å; A187-I191 WeakPolarHBondContact O-CG1 3.5Å; A187-I191 PolarHBondContact O-N 3.45Å
188	A	97	Very high	95.3	Very high	9 Å²	9	19.1 Å²	19.1	7%	0.074	9%	0.086	C	C	.	.	H	α-helix	trans	-61	-47.3	177.3	0	0	0	0	0	111.9	L184 I185 L190 I191 F192 L718	L184-A188 WeakPolarHBondContact O-CB 3.4Å; L184-A188 PolarHBondContact O-N 3.32Å; I185-A188 PolarHBondContact O-N 2.9Å; A188-L190 PolarHBondContact O-N 3.44Å; A188-I191 PolarHBondContact O-N 2.9Å; A188-F192 HydrophobicContact CB-CD2 4.26Å; A188-F192 HydrophobicContact CB-CE2 4.5Å; A188-F192 WeakPolarHBondContact O-CB 3.34Å; A188-F192 VanDerWaalsContact O-CD2 3.24Å; A188-F192 WeakPolarHBondContact O-CD2 3.31Å; A188-F192 PolarHBondContact O-N 2.88Å; A188-L718 HydrophobicContact CB-CD2 3.4Å
189	L	97.6	Very high	95.5	Very high	1 Å²	1	9.1 Å²	9.1	1%	0.005	5%	0.048	C	C	.	.	H	α-helix	trans	-55.6	-38.5	176.9	-67.5	167.5	0	0	0	112.1	I185 T186 D193 V606 T686 V721	I185-L189 HydrophobicContact CG2-CD1 3.92Å; I185-L189 HydrophobicContact CG2-CG 4.42Å; I185-L189 VanDerWaalsContact O-CG 3.28Å; I185-L189 WeakPolarHBondContact O-CG 3.36Å; I185-L189 PolarHBondContact O-N 2.88Å; T186-L189 PolarHBondContact O-N 3.28Å; L189-D193 VanDerWaalsContact O-CB 3.31Å; L189-D193 WeakPolarHBondContact O-CB 3.48Å; L189-D193 PolarHBondContact O-N 2.68Å; L189-D193 VanDerWaalsContact O-N 3.14Å; L189-V606 HydrophobicContact CB-CG1 4.19Å; L189-V606 HydrophobicContact CD2-CB 4.43Å; L189-V606 HydrophobicContact CD2-CG1 4.02Å; L189-V606 HydrophobicContact CD2-CG2 4.08Å; L189-T686 HydrophobicContact CD1-CG2 3.53Å; L189-V721 HydrophobicContact CD2-CG2 3.73Å
190	L	97.6	Very high	95.7	Very high	0 Å²	0	9 Å²	9	0%	0	5%	0.047	C	C	.	.	H	α-helix	trans	-89.9	-21.2	-178.9	-66.5	177.1	0	0	0	114.8	R82 P166 A169 T186 A187 A188 M679 L680	R82-L190 PolarHBondContact NH2-O 2.94Å; P166-L190 HydrophobicContact CB-CB 4.02Å; P166-L190 HydrophobicContact CG-CB 4.01Å; A169-L190 HydrophobicContact CB-CD1 3.45Å; A169-L190 VanDerWaalsContact CB-CD1 3.45Å; T186-L190 HydrophobicContact CG2-CD1 4.36Å; T186-L190 PolarHBondContact O-N 3.5Å; A187-L190 PolarHBondContact O-N 2.72Å; A188-L190 PolarHBondContact O-N 3.44Å; L190-M679 HydrophobicContact CD2-CE 4.35Å; L190-M679 HydrophobicContact CD2-SD 3.95Å; L190-L680 HydrophobicContact CD1-CD2 3.95Å; L190-L680 HydrophobicContact CD2-CD2 3.72Å; L190-L680 HydrophobicContact CG-CD2 4.47Å
191	I	97.6	Very high	95.9	Very high	3 Å²	3	6.7 Å²	6.7	2%	0.015	4%	0.037	C	C	.	.	H	α-helix	trans	-74.4	-35.3	170.9	-73.5	167	0	0	0	110.4	V74 L77 T81 P166 A187 A188	V74-I191 HydrophobicContact CG1-CD1 4.23Å; L77-I191 HydrophobicContact CB-CD1 4.1Å; L77-I191 HydrophobicContact CB-CG2 4.14Å; T81-I191 HydrophobicContact CG2-CG2 4.09Å; P166-I191 HydrophobicContact CB-CD1 4.38Å; P166-I191 HydrophobicContact CB-CG1 3.72Å; P166-I191 HydrophobicContact CG-CG1 3.96Å; A187-I191 HydrophobicContact CB-CD1 4.41Å; A187-I191 WeakPolarHBondContact O-CB 3.49Å; A187-I191 WeakPolarHBondContact O-CG1 3.5Å; A187-I191 PolarHBondContact O-N 3.45Å; A188-I191 PolarHBondContact O-N 2.9Å
192	F	97.5	Very high	96	Very high	31 Å²	31	5.1 Å²	5.1	14%	0.136	3%	0.027	C	C	.	.	S	Bend	trans	-108.3	9.3	-172.6	-62	-54.9	0	0	0	114.1	A188 N603 V721 L722 F725	A188-F192 HydrophobicContact CB-CD2 4.26Å; A188-F192 HydrophobicContact CB-CE2 4.5Å; A188-F192 WeakPolarHBondContact O-CB 3.34Å; A188-F192 VanDerWaalsContact O-CD2 3.24Å; A188-F192 WeakPolarHBondContact O-CD2 3.31Å; A188-F192 PolarHBondContact O-N 2.88Å; F192-N603 PolarHBondContact O-ND2 2.86Å; F192-V721 HydrophobicContact CB-CG1 3.69Å; F192-V721 HydrophobicContact CD2-CG1 4.04Å; F192-V721 HydrophobicContact CG-CG1 4.3Å; F192-L722 HydrophobicContact CD1-CD1 4.28Å; F192-L722 HydrophobicContact CE1-CD1 3.74Å; F192-L722 HydrophobicContact CE2-CD1 4.35Å; F192-L722 HydrophobicContact CZ-CD1 3.79Å; F192-F725 HydrophobicContact CB-CB 3.8Å; F192-F725 HydrophobicContact CB-CD2 4.4Å; F192-F725 HydrophobicContact CB-CG 4.05Å; F192-F725 HydrophobicContact CD1-CB 4.17Å; F192-F725 AromaticContact CD1-CD1 3.58Å; F192-F725 HydrophobicContact CD1-CD1 3.58Å; F192-F725 HydrophobicContact CD1-CD2 4.43Å; F192-F725 HydrophobicContact CD1-CE1 4.07Å; F192-F725 AromaticContact CD1-CG 3.78Å; F192-F725 HydrophobicContact CD1-CG 3.78Å; F192-F725 HydrophobicContact CE1-CD1 4.19Å; F192-F725 HydrophobicContact CE1-CE1 4.46Å; F192-F725 HydrophobicContact CG-CB 4.31Å; F192-F725 HydrophobicContact CG-CG 4.35Å; F192-F725 WeakPolarHBondContact O-CD2 3.27Å
193	D	97.2	Very high	96	Very high	0 Å²	0	5.1 Å²	5.1	0%	0	3%	0.027	C	C	.	.			trans	-79	116.4	165.4	179.2	53.8	0	0	0	110.8	L189 G195 C196 I197 G602 N603 V606 W607 M679	L189-D193 VanDerWaalsContact O-CB 3.31Å; L189-D193 WeakPolarHBondContact O-CB 3.48Å; L189-D193 PolarHBondContact O-N 2.68Å; L189-D193 VanDerWaalsContact O-N 3.14Å; D193-G195 PolarHBondContact O-N 3.43Å; D193-C196 HydrophobicContact CB-CB 3.95Å; D193-C196 PolarHBondContact O-N 3.28Å; D193-C196 VanDerWaalsContact OD2-CB 3.22Å; D193-C196 WeakPolarHBondContact OD2-CB 3.41Å; D193-C196 PolarHBondContact OD2-N 3.38Å; D193-I197 WeakPolarHBondContact O-CG1 3.21Å; D193-I197 PolarHBondContact O-N 3.07Å; D193-G602 WeakPolarHBondContact OD1-CA 3.3Å; D193-N603 PolarHBondContact OD1-N 3.01Å; D193-V606 HydrophobicContact CB-CG1 4.38Å; D193-W607 PolarHBondContact OD1-NE1 3.09Å; D193-M679 WeakPolarHBondContact OD2-CE 3.44Å
194	T	95.4	Very high	96	Very high	0 Å²	0	5.2 Å²	5.2	0%	0	3%	0.027	C	C	.	.	H	α-helix	trans	-60	-44.5	-179.7	47.9	0	0	0	0	111.7	C196 I197 T198 L601 N603 F725 F728	T194-C196 VanDerWaalsContact C-N 3.33Å; T194-C196 PolarHBondContact O-N 3.36Å; T194-I197 PolarHBondContact O-N 3.41Å; T194-I197 VanDerWaalsContact O-N 3.11Å; T194-T198 PolarHBondContact O-N 2.99Å; T194-T198 PolarHBondContact O-OG1 2.9Å; T194-L601 PolarHBondContact OG1-O 3.4Å; T194-N603 PolarHBondContact OG1-N 2.82Å; T194-N603 VanDerWaalsContact OG1-N 3.1Å; T194-F725 HydrophobicContact CG2-CD2 4.06Å; T194-F725 HydrophobicContact CG2-CE2 4.4Å; T194-F728 HydrophobicContact CG2-CB 3.86Å; T194-F728 WeakPolarHBondContact CG2-O 3.32Å
195	G	94.9	Very high	96	Very high	0 Å²	0	2.8 Å²	2.8	0%	0	1%	0.014	C	C	.	.	H	α-helix	trans	-60.9	-40.8	179.9	0	0	0	0	0	112.8	D193 I197 T198 I199 L600 L601	D193-G195 PolarHBondContact O-N 3.43Å; G195-I197 VanDerWaalsContact C-N 3.29Å; G195-I197 PolarHBondContact O-N 2.87Å; G195-T198 PolarHBondContact O-N 3.37Å; G195-I199 WeakPolarHBondContact O-CB 3.23Å; G195-I199 VanDerWaalsContact O-CG2 3.3Å; G195-I199 WeakPolarHBondContact O-CG2 3.3Å; G195-I199 PolarHBondContact O-N 3Å; G195-L600 WeakPolarHBondContact O-CD1 3.46Å; G195-L601 PolarHBondContact N-O 2.98Å
196	C	95.1	Very high	96	Very high	0 Å²	0	2.8 Å²	2.8	0%	0	1%	0.014	C	C	.	.	H	α-helix	trans	-67.5	-29.2	177.7	-166.1	0	0	0	0	112.2	R82 D193 T194 S200 M679	R82-C196 PolarHBondContact NH2-SG 3.32Å; D193-C196 HydrophobicContact CB-CB 3.95Å; D193-C196 PolarHBondContact O-N 3.28Å; D193-C196 VanDerWaalsContact OD2-CB 3.22Å; D193-C196 WeakPolarHBondContact OD2-CB 3.41Å; D193-C196 PolarHBondContact OD2-N 3.38Å; T194-C196 VanDerWaalsContact C-N 3.33Å; T194-C196 PolarHBondContact O-N 3.36Å; C196-S200 WeakPolarHBondContact O-CB 3.4Å; C196-S200 PolarHBondContact O-OG 3.48Å; C196-M679 HydrophobicContact CB-CE 4.15Å
197	I	96.3	Very high	96	Very high	0 Å²	0	2.8 Å²	2.8	0%	0	1%	0.014	C	C	.	.	H	α-helix	trans	-73.9	-56.1	169.9	-58	161.1	0	0	0	109.2	R82 D193 T194 G195 I199 S200 Q201 F725 S732 Y733	R82-I197 HydrophobicContact CG-CG1 4.48Å; R82-I197 HydrophobicContact CG-CG2 4.33Å; D193-I197 WeakPolarHBondContact O-CG1 3.21Å; D193-I197 PolarHBondContact O-N 3.07Å; T194-I197 PolarHBondContact O-N 3.41Å; T194-I197 VanDerWaalsContact O-N 3.11Å; G195-I197 VanDerWaalsContact C-N 3.29Å; G195-I197 PolarHBondContact O-N 2.87Å; I197-I199 VanDerWaalsContact C-N 3.33Å; I197-I199 PolarHBondContact O-N 2.83Å; I197-S200 WeakPolarHBondContact O-CA 3.32Å; I197-S200 VanDerWaalsContact O-CB 3.32Å; I197-S200 WeakPolarHBondContact O-CB 3.38Å; I197-S200 PolarHBondContact O-N 3.33Å; I197-Q201 HydrophobicContact CG2-CG 4.03Å; I197-Q201 WeakPolarHBondContact O-CG 3.32Å; I197-Q201 PolarHBondContact O-N 3.06Å; I197-Q201 VanDerWaalsContact O-N 3.14Å; I197-F725 HydrophobicContact CD1-CD2 4.32Å; I197-F725 HydrophobicContact CD1-CE2 3.48Å; I197-F725 VanDerWaalsContact CD1-CE2 3.48Å; I197-F725 HydrophobicContact CD1-CZ 4.12Å; I197-S732 VanDerWaalsContact CG2-OG 3.28Å; I197-S732 WeakPolarHBondContact CG2-OG 3.43Å; I197-Y733 HydrophobicContact CG2-CE1 3.73Å
198	T	95	Very high	96	Very high	0 Å²	0	2.8 Å²	2.8	0%	0	1%	0.014	C	C	.	.	H	α-helix	trans	-50.1	-51.1	-179	-48.1	0	0	0	0	111.4	T194 G195 S200 Q201 Y202 F588 V598 L600 S732	T194-T198 PolarHBondContact O-N 2.99Å; T194-T198 PolarHBondContact O-OG1 2.9Å; G195-T198 PolarHBondContact O-N 3.37Å; T198-S200 PolarHBondContact O-N 3.45Å; T198-Q201 PolarHBondContact O-N 3.46Å; T198-Y202 HydrophobicContact CG2-CD2 4.42Å; T198-Y202 HydrophobicContact CG2-CE2 3.99Å; T198-Y202 WeakPolarHBondContact O-CD2 3.36Å; T198-F588 HydrophobicContact CG2-CD1 3.79Å; T198-F588 HydrophobicContact CG2-CE1 4.03Å; T198-F588 HydrophobicContact CG2-CG 4.35Å; T198-V598 HydrophobicContact CG2-CG1 3.92Å; T198-L600 HydrophobicContact CG2-CB 4.2Å; T198-L600 HydrophobicContact CG2-CD1 3.98Å; T198-S732 WeakPolarHBondContact CA-OG 3.13Å; T198-S732 PolarHBondContact N-OG 2.96Å; T198-S732 VanDerWaalsContact N-OG 3.16Å; T198-S732 WeakPolarHBondContact OG1-CA 3.21Å; T198-S732 WeakPolarHBondContact OG1-CB 3.25Å; T198-S732 PolarHBondContact OG1-OG 2.93Å
199	I	94.9	Very high	96.1	Very high	0 Å²	0	2.4 Å²	2.4	0%	0	1%	0.011	C	C	.	.	H	α-helix	trans	-64.7	-25.8	-179.6	-159.7	72.1	0	0	0	112.6	G195 I197 L204 D206 P207 M210 F588 L600 H673 F676	G195-I199 WeakPolarHBondContact O-CB 3.23Å; G195-I199 VanDerWaalsContact O-CG2 3.3Å; G195-I199 WeakPolarHBondContact O-CG2 3.3Å; G195-I199 PolarHBondContact O-N 3Å; I197-I199 VanDerWaalsContact C-N 3.33Å; I197-I199 PolarHBondContact O-N 2.83Å; I199-L204 HydrophobicContact CD1-CD1 3.69Å; I199-L204 HydrophobicContact CG1-CD1 4.33Å; I199-D206 HydrophobicContact CD1-CB 4.43Å; I199-D206 HydrophobicContact CG1-CB 4.05Å; I199-P207 WeakPolarHBondContact O-CG 3.48Å; I199-M210 HydrophobicContact CG1-CE 4.46Å; I199-M210 HydrophobicContact CG2-CE 3.74Å; I199-F588 HydrophobicContact CD1-CZ 4.06Å; I199-L600 HydrophobicContact CB-CD1 4.2Å; I199-L600 HydrophobicContact CD1-CD2 4.05Å; I199-H673 HydrophobicContact CD1-CB 3.85Å; I199-F676 HydrophobicContact CG2-CD1 4.04Å; I199-F676 HydrophobicContact CG2-CE1 4.26Å
200	S	95.2	Very high	96.1	Very high	0 Å²	0	2.4 Å²	2.4	0%	0	1%	0.011	C	C	.	.	H	α-helix	trans	-78.8	-30.4	179.1	-63.9	0	0	0	0	114.1	C158 A159 C196 I197 T198	C158-S200 CarbonylContact C-O 3.41Å; C158-S200 WeakPolarHBondContact CB-O 3.32Å; A159-S200 VanDerWaalsContact CA-O 3.26Å; A159-S200 WeakPolarHBondContact CA-O 3.35Å; A159-S200 PolarHBondContact N-O 2.95Å; C196-S200 WeakPolarHBondContact O-CB 3.4Å; C196-S200 PolarHBondContact O-OG 3.48Å; I197-S200 WeakPolarHBondContact O-CA 3.32Å; I197-S200 VanDerWaalsContact O-CB 3.32Å; I197-S200 WeakPolarHBondContact O-CB 3.38Å; I197-S200 PolarHBondContact O-N 3.33Å; T198-S200 PolarHBondContact O-N 3.45Å
201	Q	94.2	Very high	96.1	Very high	5 Å²	5	4.1 Å²	4.1	2%	0.023	2%	0.019	C	C	.	.	H	α-helix	trans	-81.1	-22.3	-167.6	-67.6	-169.6	-66.1	0	0	114.8	R82 Y84 R155 I197 T198 S732	R82-Q201 WeakPolarHBondContact O-CG 3.4Å; R82-Q201 PolarHBondContact O-NE2 2.8Å; Y84-Q201 PolarHBondContact O-NE2 2.89Å; R155-Q201 VanDerWaalsContact CB-O 3.27Å; R155-Q201 WeakPolarHBondContact CB-O 3.39Å; R155-Q201 WeakPolarHBondContact CG-O 3.17Å; I197-Q201 HydrophobicContact CG2-CG 4.03Å; I197-Q201 WeakPolarHBondContact O-CG 3.32Å; I197-Q201 PolarHBondContact O-N 3.06Å; I197-Q201 VanDerWaalsContact O-N 3.14Å; T198-Q201 PolarHBondContact O-N 3.46Å; Q201-S732 PolarHBondContact OE1-OG 3.04Å
202	Y	94.4	Very high	96.2	Very high	3 Å²	3	5.7 Å²	5.7	1%	0.012	3%	0.025	C	C	.	.	S	Bend	trans	-99.6	165.7	-171.6	-61.8	-66.4	0	0	0	113.3	C93 E96 C158 T198 L204 F588 V598	C93-Y202 HydrophobicContact CB-CD1 4.03Å; C93-Y202 HydrophobicContact CB-CE1 4.39Å; C93-Y202 HydrophobicContact CB-CG 4.32Å; C93-Y202 VanDerWaalsContact SG-CE1 3.54Å; E96-Y202 WeakPolarHBondContact OE1-CA 3.41Å; E96-Y202 WeakPolarHBondContact OE1-CB 3.39Å; E96-Y202 WeakPolarHBondContact OE1-CD1 3.25Å; C158-Y202 VanDerWaalsContact CB-O 3.29Å; C158-Y202 WeakPolarHBondContact CB-O 3.43Å; C158-Y202 PolarHBondContact SG-O 3.17Å; C158-Y202 VanDerWaalsContact SG-O 3.38Å; T198-Y202 HydrophobicContact CG2-CD2 4.42Å; T198-Y202 HydrophobicContact CG2-CE2 3.99Å; T198-Y202 WeakPolarHBondContact O-CD2 3.36Å; Y202-L204 PolarHBondContact O-N 3.24Å; Y202-F588 AromaticContact CD2-CD1 3.68Å; Y202-F588 HydrophobicContact CD2-CD1 3.68Å; Y202-F588 AromaticContact CD2-CE1 3.78Å; Y202-F588 HydrophobicContact CD2-CE1 3.78Å; Y202-F588 HydrophobicContact CE2-CD1 4.03Å; Y202-F588 HydrophobicContact CE2-CE1 4.49Å; Y202-F588 HydrophobicContact CG-CD1 4.46Å; Y202-V598 HydrophobicContact CE2-CG1 4.03Å
203	I	95.5	Very high	96.2	Very high	0 Å²	0	4.2 Å²	4.2	0%	0	2%	0.019	C	C	.	.	S	Bend	trans	-71.3	75.5	179	-51.7	170.9	0	0	0	110	E96 I124 F139 M154 R155	E96-I203 HydrophobicContact CB-CB 4.15Å; E96-I203 HydrophobicContact CG-CB 3.89Å; E96-I203 HydrophobicContact CG-CG1 4.38Å; E96-I203 WeakPolarHBondContact OE1-CG1 3.43Å; E96-I203 PolarHBondContact OE1-N 3.49Å; I124-I203 HydrophobicContact CD1-CG2 4.16Å; I124-I203 HydrophobicContact CG1-CG2 4.45Å; I124-I203 HydrophobicContact CG2-CG2 3.59Å; F139-I203 HydrophobicContact CE1-CD1 4.42Å; F139-I203 HydrophobicContact CZ-CD1 4.41Å; M154-I203 HydrophobicContact CB-CD1 3.72Å; M154-I203 HydrophobicContact CB-CG1 3.67Å; M154-I203 HydrophobicContact CB-CG2 4.14Å; M154-I203 HydrophobicContact CG-CD1 4.45Å; M154-I203 HydrophobicContact SD-CD1 3.97Å; M154-I203 HydrophobicContact SD-CG2 4.17Å; R155-I203 HydrophobicContact CG-CD1 4.39Å; R155-I203 HydrophobicContact CG-CG1 3.73Å
204	L	95.3	Very high	96.3	Very high	1 Å²	1	4.2 Å²	4.2	1%	0.005	2%	0.019	C	C	.	.			trans	-126.2	155.5	-173.9	-60.7	-179.8	0	0	0	111.8	D95 F99 I199 Y202 F588	D95-L204 HydrophobicContact CB-CD2 3.34Å; F99-L204 HydrophobicContact CD2-CD2 4.18Å; F99-L204 HydrophobicContact CE2-CD2 4.44Å; I199-L204 HydrophobicContact CD1-CD1 3.69Å; I199-L204 HydrophobicContact CG1-CD1 4.33Å; Y202-L204 PolarHBondContact O-N 3.24Å; L204-F588 HydrophobicContact CD1-CE1 3.88Å; L204-F588 HydrophobicContact CD1-CZ 3.94Å
205	L	95.8	Very high	96.4	Very high	0 Å²	0	4.9 Å²	4.9	0%	0	2%	0.024	C	C	.	.	S	Bend	trans	-79.1	-23.6	174.1	-68.4	-177.4	0	0	0	113.4	F99 H116 G120 K121 I124 I208 L209 V252 K253	F99-L205 HydrophobicContact CD1-CD1 3.75Å; F99-L205 HydrophobicContact CD1-CD2 4.41Å; F99-L205 HydrophobicContact CD1-CG 3.7Å; F99-L205 HydrophobicContact CD2-CG 4.19Å; F99-L205 HydrophobicContact CE1-CD1 3.4Å; F99-L205 VanDerWaalsContact CE1-CD1 3.4Å; F99-L205 HydrophobicContact CE1-CG 3.76Å; F99-L205 HydrophobicContact CE2-CG 4.2Å; F99-L205 HydrophobicContact CG-CD1 4.47Å; F99-L205 HydrophobicContact CG-CG 3.94Å; F99-L205 HydrophobicContact CZ-CD1 3.83Å; F99-L205 HydrophobicContact CZ-CG 4Å; H116-L205 HydrophobicContact CB-CD1 4.2Å; G120-L205 VanDerWaalsContact C-CD2 3.49Å; K121-L205 HydrophobicContact CG-CD1 4.36Å; K121-L205 HydrophobicContact CG-CD2 3.87Å; I124-L205 HydrophobicContact CD1-CD2 4.07Å; L205-I208 PolarHBondContact O-N 3.42Å; L205-L209 PolarHBondContact O-N 2.86Å; L205-V252 HydrophobicContact CB-CG1 4.01Å; L205-V252 HydrophobicContact CD2-CG1 4.36Å; L205-V252 WeakPolarHBondContact O-CG1 3.48Å; L205-K253 HydrophobicContact CB-CG 4.48Å; L205-K253 HydrophobicContact CD1-CG 4.31Å
206	D	96.1	Very high	96.6	Very high	6 Å²	6	4.9 Å²	4.9	3%	0.032	2%	0.024	C	C	.	.	H	α-helix	trans	-66.4	-35.9	-171.1	-62.1	-83	0	0	0	114.8	I199 I208 L209 M210 K253 H673	I199-D206 HydrophobicContact CD1-CB 4.43Å; I199-D206 HydrophobicContact CG1-CB 4.05Å; D206-I208 VanDerWaalsContact C-N 3.31Å; D206-I208 PolarHBondContact O-N 3.48Å; D206-L209 PolarHBondContact O-N 3.49Å; D206-M210 HydrophobicContact CB-CE 4.48Å; D206-M210 WeakPolarHBondContact O-CB 3.38Å; D206-M210 WeakPolarHBondContact O-CE 3.31Å; D206-M210 VanDerWaalsContact O-CG 3.28Å; D206-M210 WeakPolarHBondContact O-CG 3.49Å; D206-M210 PolarHBondContact O-N 3.35Å; D206-K253 IonicContact OD1-NZ 3.53Å; D206-K253 PolarHBondContact OD1-NZ 3.08Å; D206-K253 IonicContact OD2-NZ 3.47Å; D206-K253 PolarHBondContact OD2-NZ 2.95Å; D206-H673 IonicContact OD1-CD2 2.62Å; D206-H673 PolarHBondContact OD1-CD2 2.82Å; D206-H673 IonicContact OD2-CD2 2.7Å
207	P	96.6	Very high	96.7	Very high	0 Å²	0	5 Å²	5	0%	0	3%	0.025	C	C	.	.	H	α-helix	trans	-61.8	-39.8	171.9	-26.4	39	0	0	0	112.3	C158 I199 F211	C158-P207 HydrophobicContact CB-CB 4.4Å; C158-P207 HydrophobicContact CB-CG 4.32Å; I199-P207 WeakPolarHBondContact O-CG 3.48Å; P207-F211 VanDerWaalsContact O-CB 3.23Å; P207-F211 WeakPolarHBondContact O-CB 3.46Å; P207-F211 PolarHBondContact O-N 2.9Å
208	I	97.9	Very high	96.8	Very high	0 Å²	0	5.5 Å²	5.5	0%	0	3%	0.028	C	C	.	.	H	α-helix	trans	-69.5	-42.2	179.2	-42	-179	0	0	0	110.2	G120 L123 I124 F157 L161 L205 D206 F211 F212 V252	G120-I208 WeakPolarHBondContact O-CD1 3.24Å; L123-I208 HydrophobicContact CD1-CG2 3.92Å; I124-I208 HydrophobicContact CD1-CD1 4.02Å; I124-I208 HydrophobicContact CG1-CD1 3.87Å; F157-I208 HydrophobicContact CE1-CD1 4.14Å; F157-I208 HydrophobicContact CE1-CG1 4.49Å; L161-I208 HydrophobicContact CD1-CB 4.28Å; L161-I208 HydrophobicContact CD1-CG1 4.11Å; L161-I208 HydrophobicContact CD1-CG2 3.93Å; L205-I208 PolarHBondContact O-N 3.42Å; D206-I208 VanDerWaalsContact C-N 3.31Å; D206-I208 PolarHBondContact O-N 3.48Å; I208-F211 PolarHBondContact O-N 3.23Å; I208-F212 HydrophobicContact CG2-CD2 4.11Å; I208-F212 HydrophobicContact CG2-CE2 3.79Å; I208-F212 WeakPolarHBondContact O-CD2 3.38Å; I208-F212 PolarHBondContact O-N 3.33Å; I208-V252 HydrophobicContact CB-CG1 4.3Å; I208-V252 HydrophobicContact CB-CG2 4.33Å; I208-V252 HydrophobicContact CG2-CG2 3.78Å
209	L	97.8	Very high	96.9	Very high	1 Å²	1	5.9 Å²	5.9	1%	0.005	3%	0.031	C	C	.	.	H	α-helix	trans	-61.3	-51.8	174.4	175.9	66.5	0	0	0	111.3	L205 D206 F211 F212 I213 A249 V252 K253 V255	L205-L209 PolarHBondContact O-N 2.86Å; D206-L209 PolarHBondContact O-N 3.49Å; L209-F211 VanDerWaalsContact C-N 3.31Å; L209-F211 PolarHBondContact O-N 2.99Å; L209-F212 PolarHBondContact O-N 2.9Å; L209-I213 HydrophobicContact CD1-CD1 3.97Å; L209-I213 HydrophobicContact CD1-CG1 4.36Å; L209-I213 HydrophobicContact CD2-CD1 4.44Å; L209-I213 HydrophobicContact CG-CD1 3.81Å; L209-I213 WeakPolarHBondContact O-CG1 3.14Å; L209-I213 PolarHBondContact O-N 2.98Å; L209-A249 WeakPolarHBondContact CD1-O 3.3Å; L209-V252 HydrophobicContact CB-CB 4.46Å; L209-V252 HydrophobicContact CB-CG1 3.88Å; L209-K253 HydrophobicContact CD1-CB 4.29Å; L209-K253 HydrophobicContact CD2-CB 4.11Å; L209-K253 HydrophobicContact CD2-CD 4.14Å; L209-K253 HydrophobicContact CD2-CG 4.34Å; L209-V255 HydrophobicContact CD2-CB 4.16Å; L209-V255 HydrophobicContact CD2-CG1 4.32Å
210	M	97.8	Very high	97.1	Very high	1 Å²	1	6 Å²	6	1%	0.005	3%	0.031	C	C	.	.	H	α-helix	trans	-63	-37.8	-180	-73	-172.7	-68.9	0	0	111.8	L165 I199 D206 F212 I213 M214 F676 P677 L680	L165-M210 HydrophobicContact CD1-CB 3.89Å; L165-M210 HydrophobicContact CD1-CE 3.9Å; L165-M210 HydrophobicContact CD1-SD 4.19Å; L165-M210 VanDerWaalsContact CD2-C 3.43Å; L165-M210 HydrophobicContact CD2-CB 3.68Å; L165-M210 HydrophobicContact CG-CB 4.47Å; I199-M210 HydrophobicContact CG1-CE 4.46Å; I199-M210 HydrophobicContact CG2-CE 3.74Å; D206-M210 HydrophobicContact CB-CE 4.48Å; D206-M210 WeakPolarHBondContact O-CB 3.38Å; D206-M210 WeakPolarHBondContact O-CE 3.31Å; D206-M210 VanDerWaalsContact O-CG 3.28Å; D206-M210 WeakPolarHBondContact O-CG 3.49Å; D206-M210 PolarHBondContact O-N 3.35Å; M210-F212 PolarHBondContact O-N 3.43Å; M210-I213 PolarHBondContact O-N 3.48Å; M210-M214 WeakPolarHBondContact O-CB 3.48Å; M210-M214 VanDerWaalsContact O-CG 3.28Å; M210-M214 WeakPolarHBondContact O-CG 3.39Å; M210-M214 PolarHBondContact O-N 3.46Å; M210-F676 HydrophobicContact CE-CB 4.43Å; M210-F676 HydrophobicContact SD-CB 3.67Å; M210-P677 HydrophobicContact CG-CG 4.13Å; M210-L680 HydrophobicContact CB-CD1 3.99Å; M210-L680 HydrophobicContact CG-CD1 4Å; M210-L680 HydrophobicContact SD-CD1 3.82Å; M210-L680 HydrophobicContact SD-CG 4.43Å
211	F	98.4	Very high	97.1	Very high	36 Å²	36	6.2 Å²	6.2	16%	0.158	3%	0.032	C	C	.	.	H	α-helix	trans	-57	-50.1	174.3	172	-93.4	0	0	0	111	L161 F164 F168 P207 I208 L209 M214 A215	L161-F211 HydrophobicContact CB-CB 4.1Å; L161-F211 HydrophobicContact CB-CD2 4.2Å; L161-F211 HydrophobicContact CB-CG 4.17Å; L161-F211 HydrophobicContact CD2-CD1 4.1Å; L161-F211 HydrophobicContact CD2-CD2 3.84Å; L161-F211 HydrophobicContact CD2-CE1 4.12Å; L161-F211 HydrophobicContact CD2-CE2 3.86Å; L161-F211 HydrophobicContact CD2-CG 3.97Å; L161-F211 HydrophobicContact CD2-CZ 4.01Å; L161-F211 HydrophobicContact CG-CG 4.46Å; F164-F211 HydrophobicContact CB-CD2 3.85Å; F164-F211 HydrophobicContact CB-CE2 3.85Å; F164-F211 HydrophobicContact CD2-CD2 4.25Å; F164-F211 AromaticContact CD2-CE2 3.81Å; F164-F211 HydrophobicContact CD2-CE2 3.81Å; F164-F211 HydrophobicContact CG-CD2 4.3Å; F164-F211 AromaticContact CG-CE2 3.87Å; F164-F211 HydrophobicContact CG-CE2 3.87Å; F168-F211 AromaticContact CE2-CD2 3.74Å; F168-F211 HydrophobicContact CE2-CD2 3.74Å; F168-F211 AromaticContact CE2-CE2 3.53Å; F168-F211 HydrophobicContact CE2-CE2 3.53Å; F168-F211 HydrophobicContact CE2-CZ 4.2Å; F168-F211 HydrophobicContact CZ-CD2 4.34Å; F168-F211 AromaticContact CZ-CE2 3.68Å; F168-F211 HydrophobicContact CZ-CE2 3.68Å; F168-F211 HydrophobicContact CZ-CZ 4.22Å; P207-F211 VanDerWaalsContact O-CB 3.23Å; P207-F211 WeakPolarHBondContact O-CB 3.46Å; P207-F211 PolarHBondContact O-N 2.9Å; I208-F211 PolarHBondContact O-N 3.23Å; L209-F211 VanDerWaalsContact C-N 3.31Å; L209-F211 PolarHBondContact O-N 2.99Å; F211-M214 PolarHBondContact O-N 2.82Å; F211-A215 WeakPolarHBondContact O-CB 3.37Å; F211-A215 PolarHBondContact O-N 2.83Å
212	F	98.5	Very high	97.2	Very high	35 Å²	35	7.8 Å²	7.8	15%	0.154	4%	0.039	C	C	.	.	H	α-helix	trans	-69.5	-35.8	179	-74.3	-56.9	0	0	0	113.4	L119 L123 I208 L209 M210 A216 G248 A249 V252	L119-F212 HydrophobicContact CD2-CE2 3.9Å; L119-F212 HydrophobicContact CD2-CZ 4.16Å; L123-F212 HydrophobicContact CD1-CE2 4.26Å; L123-F212 HydrophobicContact CD1-CZ 4.45Å; I208-F212 HydrophobicContact CG2-CD2 4.11Å; I208-F212 HydrophobicContact CG2-CE2 3.79Å; I208-F212 WeakPolarHBondContact O-CD2 3.38Å; I208-F212 PolarHBondContact O-N 3.33Å; L209-F212 PolarHBondContact O-N 2.9Å; M210-F212 PolarHBondContact O-N 3.43Å; F212-A216 VanDerWaalsContact O-CB 3.32Å; F212-A216 WeakPolarHBondContact O-CB 3.48Å; F212-A216 PolarHBondContact O-N 2.99Å; F212-G248 VanDerWaalsContact CD2-C 3.49Å; F212-A249 HydrophobicContact CB-CB 3.93Å; F212-V252 HydrophobicContact CD2-CG2 3.94Å; F212-V252 HydrophobicContact CE2-CG2 4.07Å
213	I	98.4	Very high	97.2	Very high	0 Å²	0	8 Å²	8	0%	0	4%	0.04	C	C	.	.	H	α-helix	trans	-59.9	-51.1	172.3	-70.5	170.9	0	0	0	110.2	L209 M210 A216 V217 A249 V259 P677 F681	L209-I213 HydrophobicContact CD1-CD1 3.97Å; L209-I213 HydrophobicContact CD1-CG1 4.36Å; L209-I213 HydrophobicContact CD2-CD1 4.44Å; L209-I213 HydrophobicContact CG-CD1 3.81Å; L209-I213 WeakPolarHBondContact O-CG1 3.14Å; L209-I213 PolarHBondContact O-N 2.98Å; M210-I213 PolarHBondContact O-N 3.48Å; I213-A216 PolarHBondContact O-N 3.02Å; I213-V217 WeakPolarHBondContact O-CG2 3.42Å; I213-V217 PolarHBondContact O-N 3.41Å; I213-A249 HydrophobicContact CG1-CB 4.16Å; I213-V259 HydrophobicContact CG1-CB 4.24Å; I213-V259 HydrophobicContact CG1-CG1 3.86Å; I213-V259 HydrophobicContact CG2-CB 4.22Å; I213-V259 HydrophobicContact CG2-CG2 4.24Å; I213-P677 HydrophobicContact CD1-CB 4.01Å; I213-P677 HydrophobicContact CD1-CG 4.27Å; I213-F681 HydrophobicContact CG2-CE2 4.25Å; I213-F681 HydrophobicContact CG2-CZ 4.27Å
214	M	98.2	Very high	97.1	Very high	0 Å²	0	9.7 Å²	9.7	0%	0	5%	0.049	C	C	.	.	H	α-helix	trans	-68.1	-36.8	-178.7	-68.6	-65.6	-75.5	0	0	112.3	L165 F168 A169 I172 M210 F211 V217 L218 L680 M684	L165-M214 HydrophobicContact CD2-CB 4.32Å; L165-M214 HydrophobicContact CD2-CG 3.96Å; F168-M214 HydrophobicContact CB-CB 4.02Å; F168-M214 HydrophobicContact CB-CE 4.32Å; F168-M214 HydrophobicContact CD2-CB 3.79Å; F168-M214 HydrophobicContact CG-CB 4.42Å; A169-M214 HydrophobicContact CB-CE 3.63Å; I172-M214 HydrophobicContact CD1-CE 3.82Å; I172-M214 HydrophobicContact CD1-SD 4.34Å; M210-M214 WeakPolarHBondContact O-CB 3.48Å; M210-M214 VanDerWaalsContact O-CG 3.28Å; M210-M214 WeakPolarHBondContact O-CG 3.39Å; M210-M214 PolarHBondContact O-N 3.46Å; F211-M214 PolarHBondContact O-N 2.82Å; M214-V217 PolarHBondContact O-N 3.31Å; M214-L218 VanDerWaalsContact O-CB 3.31Å; M214-L218 WeakPolarHBondContact O-CB 3.25Å; M214-L218 PolarHBondContact O-N 2.99Å; M214-L680 HydrophobicContact CG-CD1 3.74Å; M214-L680 HydrophobicContact SD-CB 4.06Å; M214-L680 HydrophobicContact SD-CD1 3.95Å; M214-M684 HydrophobicContact CE-CE 3.83Å; M214-M684 HydrophobicContact CE-SD 3.88Å; M214-M684 HydrophobicContact SD-CE 3.8Å
215	A	98.4	Very high	96.8	Very high	14 Å²	14	12.9 Å²	12.9	12%	0.116	6%	0.064	C	C	.	.	H	α-helix	trans	-64.4	-38.1	173	0	0	0	0	0	112.3	F168 F211 S219 A245	F168-A215 HydrophobicContact CD2-CB 4.44Å; F168-A215 HydrophobicContact CE2-CB 3.88Å; F168-A215 HydrophobicContact CZ-CB 4.48Å; F211-A215 WeakPolarHBondContact O-CB 3.37Å; F211-A215 PolarHBondContact O-N 2.83Å; A215-S219 VanDerWaalsContact O-CB 3.25Å; A215-S219 WeakPolarHBondContact O-CB 3.48Å; A215-S219 PolarHBondContact O-N 3.45Å; A215-S219 PolarHBondContact O-OG 3.25Å; A215-A245 HydrophobicContact CB-CB 3.96Å
216	A	98.3	Very high	96.5	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-67.3	-43.2	175.7	0	0	0	0	0	111.6	F212 I213 S219 M220 C242 A245 L246 V259	F212-A216 VanDerWaalsContact O-CB 3.32Å; F212-A216 WeakPolarHBondContact O-CB 3.48Å; F212-A216 PolarHBondContact O-N 2.99Å; I213-A216 PolarHBondContact O-N 3.02Å; A216-S219 PolarHBondContact O-N 2.85Å; A216-M220 VanDerWaalsContact O-CB 3.31Å; A216-M220 WeakPolarHBondContact O-CB 3.32Å; A216-M220 PolarHBondContact O-N 3.43Å; A216-C242 PolarHBondContact O-SG 3.33Å; A216-A245 HydrophobicContact CB-CB 3.75Å; A216-L246 HydrophobicContact CB-CD2 3.8Å; A216-L246 HydrophobicContact CB-CG 4.25Å; A216-V259 HydrophobicContact CB-CG2 3.96Å
217	V	98.3	Very high	95.8	Very high	2 Å²	2	18.2 Å²	18.2	1%	0.012	10%	0.097	C	C	.	.	H	α-helix	trans	-65.3	-46	176.1	176.4	0	0	0	0	111.4	I172 I213 M214 S219 M220 V221 V259 L262 F681	I172-V217 HydrophobicContact CD1-CB 4.02Å; I172-V217 HydrophobicContact CD1-CG1 3.71Å; I172-V217 HydrophobicContact CG1-CG1 4.18Å; I172-V217 HydrophobicContact CG2-CG1 4.23Å; I213-V217 WeakPolarHBondContact O-CG2 3.42Å; I213-V217 PolarHBondContact O-N 3.41Å; M214-V217 PolarHBondContact O-N 3.31Å; V217-S219 VanDerWaalsContact C-N 3.34Å; V217-S219 PolarHBondContact O-N 3.08Å; V217-M220 HydrophobicContact CG1-CE 4.19Å; V217-M220 PolarHBondContact O-N 2.95Å; V217-V221 HydrophobicContact CG1-CG2 4.48Å; V217-V221 WeakPolarHBondContact O-CG2 3.31Å; V217-V221 PolarHBondContact O-N 2.95Å; V217-V259 HydrophobicContact CG2-CG2 4.04Å; V217-L262 HydrophobicContact CG2-CD2 4.08Å; V217-F681 HydrophobicContact CG1-CE1 4.37Å; V217-F681 HydrophobicContact CG2-CE1 3.86Å; V217-F681 HydrophobicContact CG2-CZ 3.77Å
218	L	98.1	Very high	95.1	Very high	12 Å²	12	22.9 Å²	22.9	6%	0.063	13%	0.13	C	C	.	.	H	α-helix	trans	-59.5	-45.2	175.5	176.3	58.7	0	0	0	111.3	F168 L171 I172 M214 M220 V221 K222	F168-L218 HydrophobicContact CB-CD2 4.28Å; F168-L218 HydrophobicContact CD1-CD2 3.49Å; F168-L218 VanDerWaalsContact CD1-CD2 3.49Å; F168-L218 HydrophobicContact CE1-CD2 4.02Å; F168-L218 HydrophobicContact CG-CD2 4Å; L171-L218 HydrophobicContact CB-CD1 3.72Å; L171-L218 HydrophobicContact CB-CD2 4.42Å; L171-L218 HydrophobicContact CD1-CD2 4.1Å; I172-L218 HydrophobicContact CD1-CB 4.11Å; I172-L218 HydrophobicContact CG1-CB 3.86Å; I172-L218 HydrophobicContact CG1-CD1 4.07Å; M214-L218 VanDerWaalsContact O-CB 3.31Å; M214-L218 WeakPolarHBondContact O-CB 3.25Å; M214-L218 PolarHBondContact O-N 2.99Å; L218-M220 PolarHBondContact O-N 3.25Å; L218-V221 PolarHBondContact O-N 3.03Å; L218-K222 HydrophobicContact CD1-CG 4.01Å; L218-K222 HydrophobicContact CG-CG 4.5Å; L218-K222 WeakPolarHBondContact O-CB 3.46Å; L218-K222 VanDerWaalsContact O-CG 3.29Å; L218-K222 WeakPolarHBondContact O-CG 3.41Å; L218-K222 PolarHBondContact O-N 2.97Å
219	S	97.9	Very high	94.7	Very high	8 Å²	8	30.8 Å²	30.8	6%	0.056	16%	0.159	C	C	.	.	H	α-helix	trans	-65.4	-38.4	178.2	-57.6	0	0	0	0	112.2	A215 A216 V217 F223	A215-S219 VanDerWaalsContact O-CB 3.25Å; A215-S219 WeakPolarHBondContact O-CB 3.48Å; A215-S219 PolarHBondContact O-N 3.45Å; A215-S219 PolarHBondContact O-OG 3.25Å; A216-S219 PolarHBondContact O-N 2.85Å; V217-S219 VanDerWaalsContact C-N 3.34Å; V217-S219 PolarHBondContact O-N 3.08Å; S219-F223 WeakPolarHBondContact O-CB 3.28Å; S219-F223 PolarHBondContact O-N 3.37Å
220	M	97.2	Very high	94.4	Very high	3 Å²	3	33.2 Å²	33.2	2%	0.015	18%	0.175	C	C	.	.	H	α-helix	trans	-63	-46.9	173.4	176.2	-167.8	62.9	0	0	111.8	A216 V217 L218 F223 N224 V263 N266 L651	A216-M220 VanDerWaalsContact O-CB 3.31Å; A216-M220 WeakPolarHBondContact O-CB 3.32Å; A216-M220 PolarHBondContact O-N 3.43Å; V217-M220 HydrophobicContact CG1-CE 4.19Å; V217-M220 PolarHBondContact O-N 2.95Å; L218-M220 PolarHBondContact O-N 3.25Å; M220-F223 WeakPolarHBondContact O-CB 3.36Å; M220-F223 PolarHBondContact O-N 2.89Å; M220-N224 VanDerWaalsContact O-CG 3.29Å; M220-N224 PolarHBondContact O-N 3.35Å; M220-N224 PolarHBondContact O-OD1 3.02Å; M220-V263 HydrophobicContact CB-CG2 4.23Å; M220-V263 HydrophobicContact CG-CG1 4.48Å; M220-V263 HydrophobicContact CG-CG2 4.36Å; M220-V263 HydrophobicContact SD-CB 4.19Å; M220-V263 HydrophobicContact SD-CG1 4.41Å; M220-V263 HydrophobicContact SD-CG2 3.75Å; M220-N266 HydrophobicContact CG-CB 4.42Å; M220-N266 WeakPolarHBondContact CG-ND2 3.42Å; M220-N266 HydrophobicContact SD-CB 3.51Å; M220-N266 VanDerWaalsContact SD-CB 3.51Å; M220-N266 VanDerWaalsContact SD-CG 3.57Å; M220-L651 HydrophobicContact CE-CD1 4.1Å; M220-L651 HydrophobicContact CE-CD2 3.92Å; M220-L651 HydrophobicContact CE-CG 4.36Å
221	V	96.3	Very high	94.2	Very high	3 Å²	3	36.4 Å²	36.4	2%	0.018	19%	0.189	C	C	.	.	H	α-helix	trans	-65.2	-43.2	178.8	172.7	0	0	0	0	110.7	E175 L176 V217 L218 F223 N224 Q225 L651	E175-V221 HydrophobicContact CB-CG1 3.57Å; E175-V221 HydrophobicContact CG-CG1 4.41Å; L176-V221 HydrophobicContact CD1-CG2 4.44Å; L176-V221 HydrophobicContact CD2-CG1 3.94Å; L176-V221 HydrophobicContact CD2-CG2 3.97Å; L176-V221 HydrophobicContact CG-CG1 4.13Å; L176-V221 HydrophobicContact CG-CG2 4.26Å; V217-V221 HydrophobicContact CG1-CG2 4.48Å; V217-V221 WeakPolarHBondContact O-CG2 3.31Å; V217-V221 PolarHBondContact O-N 2.95Å; L218-V221 PolarHBondContact O-N 3.03Å; V221-F223 VanDerWaalsContact C-N 3.34Å; V221-F223 PolarHBondContact O-N 3.46Å; V221-N224 PolarHBondContact O-N 3.48Å; V221-Q225 WeakPolarHBondContact O-CG 3.37Å; V221-Q225 PolarHBondContact O-N 3.3Å; V221-Q225 VanDerWaalsContact O-N 3.16Å; V221-L651 HydrophobicContact CG2-CD2 4.26Å
222	K	95.4	Very high	94.1	Very high	38 Å²	38	37.2 Å²	37.2	17%	0.165	20%	0.197	C	C	.	.	H	α-helix	trans	-64.1	-36	174.5	-73.2	-74.6	174.3	-169.5	0	113	E175 L218 Q225 Q226 W238	E175-K222 HydrophobicContact CG-CD 4.28Å; E175-K222 WeakPolarHBondContact OE1-CE 3.19Å; E175-K222 IonicContact OE1-NZ 3.58Å; E175-K222 PolarHBondContact OE1-NZ 2.83Å; E175-K222 IonicContact OE2-NZ 2.81Å; L218-K222 HydrophobicContact CD1-CG 4.01Å; L218-K222 HydrophobicContact CG-CG 4.5Å; L218-K222 WeakPolarHBondContact O-CB 3.46Å; L218-K222 VanDerWaalsContact O-CG 3.29Å; L218-K222 WeakPolarHBondContact O-CG 3.41Å; L218-K222 PolarHBondContact O-N 2.97Å; K222-Q225 PolarHBondContact O-N 2.85Å; K222-Q226 PolarHBondContact O-N 3.33Å; K222-W238 HydrophobicContact CB-CB 4.46Å; K222-W238 HydrophobicContact CB-CD2 3.42Å; K222-W238 VanDerWaalsContact CB-CD2 3.42Å; K222-W238 HydrophobicContact CB-CE3 3.74Å; K222-W238 HydrophobicContact CB-CG 3.74Å; K222-W238 HydrophobicContact CB-CH2 4.34Å; K222-W238 HydrophobicContact CB-CZ2 4.07Å; K222-W238 HydrophobicContact CB-CZ3 4.18Å; K222-W238 HydrophobicContact CD-CH2 4.42Å; K222-W238 HydrophobicContact CD-CZ2 4.01Å; K222-W238 HydrophobicContact CG-CD2 4.16Å; K222-W238 HydrophobicContact CG-CE3 4.2Å; K222-W238 HydrophobicContact CG-CH2 4Å; K222-W238 HydrophobicContact CG-CZ2 3.95Å; K222-W238 HydrophobicContact CG-CZ3 4.13Å
223	F	95.6	Very high	93.9	Very high	8 Å²	8	39.4 Å²	39.4	4%	0.035	22%	0.222	C	C	.	.	H	α-helix	trans	-64.6	-47.9	172.6	173.2	-96	0	0	0	111.8	S219 M220 V221 Q225 Q226 W235 W238 L239 R292	S219-F223 WeakPolarHBondContact O-CB 3.28Å; S219-F223 PolarHBondContact O-N 3.37Å; M220-F223 WeakPolarHBondContact O-CB 3.36Å; M220-F223 PolarHBondContact O-N 2.89Å; V221-F223 VanDerWaalsContact C-N 3.34Å; V221-F223 PolarHBondContact O-N 3.46Å; F223-Q225 PolarHBondContact O-N 2.87Å; F223-Q226 PolarHBondContact O-N 3.21Å; F223-W235 AromaticContact CE2-CD2 3.75Å; F223-W235 HydrophobicContact CE2-CD2 3.75Å; F223-W235 AromaticContact CE2-CE2 3.31Å; F223-W235 HydrophobicContact CE2-CE3 4.31Å; F223-W235 HydrophobicContact CE2-CG 4.22Å; F223-W235 HydrophobicContact CE2-CH2 4.08Å; F223-W235 AromaticContact CE2-CZ2 3.5Å; F223-W235 HydrophobicContact CE2-CZ2 3.5Å; F223-W235 HydrophobicContact CE2-CZ3 4.45Å; F223-W235 AromaticContact CE2-NE1 3.51Å; F223-W235 AromaticContact CZ-CE2 3.65Å; F223-W235 HydrophobicContact CZ-CH2 4.23Å; F223-W235 AromaticContact CZ-CZ2 3.48Å; F223-W235 HydrophobicContact CZ-CZ2 3.48Å; F223-W235 VanDerWaalsContact CZ-CZ2 3.48Å; F223-W235 AromaticContact CZ-NE1 3.78Å; F223-W238 HydrophobicContact CB-CB 3.93Å; F223-L239 HydrophobicContact CD2-CB 3.82Å; F223-L239 HydrophobicContact CD2-CD1 4.27Å; F223-L239 HydrophobicContact CE2-CB 3.76Å; F223-L239 HydrophobicContact CE2-CD1 3.81Å; F223-L239 HydrophobicContact CE2-CD2 4.12Å; F223-L239 HydrophobicContact CE2-CG 4.11Å; F223-L239 HydrophobicContact CZ-CD1 4.08Å; F223-R292 HydrophobicContact CZ-CG 4.48Å
224	N	92.4	Very high	93.7	Very high	36 Å²	36	42.3 Å²	42.3	19%	0.193	24%	0.241	C	C	.	.	H	α-helix	trans	-55.3	-36	176.1	-72.2	-1.5	0	0	0	111.8	M220 V221 Q226 S227 N266	M220-N224 VanDerWaalsContact O-CG 3.29Å; M220-N224 PolarHBondContact O-N 3.35Å; M220-N224 PolarHBondContact O-OD1 3.02Å; V221-N224 PolarHBondContact O-N 3.48Å; N224-Q226 VanDerWaalsContact C-N 3.33Å; N224-Q226 PolarHBondContact O-N 2.99Å; N224-S227 WeakPolarHBondContact O-CB 3.41Å; N224-S227 PolarHBondContact O-N 3.4Å; N224-S227 PolarHBondContact O-OG 3.48Å; N224-N266 PolarHBondContact ND2-ND2 3.31Å; N224-N266 PolarHBondContact ND2-OD1 3.06Å; N224-N266 PolarHBondContact OD1-ND2 3.34Å
225	Q	88.9	Confident	93.6	Very high	68 Å²	68	42.4 Å²	42.4	32%	0.318	24%	0.241	S	C	.	.	H	α-helix	trans	-67.9	-26.2	175.3	-70	-176.9	-32.8	0	0	114.1	E175 V221 K222 F223 S227	E175-Q225 PolarHBondContact OE2-NE2 3.43Å; E175-Q225 PolarHBondContact OE2-OE1 3.03Å; V221-Q225 WeakPolarHBondContact O-CG 3.37Å; V221-Q225 PolarHBondContact O-N 3.3Å; V221-Q225 VanDerWaalsContact O-N 3.16Å; K222-Q225 PolarHBondContact O-N 2.85Å; F223-Q225 PolarHBondContact O-N 2.87Å; Q225-S227 PolarHBondContact O-N 2.92Å
226	Q	89.3	Confident	93.5	Very high	41 Å²	41	46.2 Å²	46.2	19%	0.192	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-82.4	8.3	175.5	-56.5	-47	-66.9	0	0	113.2	K222 F223 N224 S228 R229 W235	K222-Q226 PolarHBondContact O-N 3.33Å; F223-Q226 PolarHBondContact O-N 3.21Å; N224-Q226 VanDerWaalsContact C-N 3.33Å; N224-Q226 PolarHBondContact O-N 2.99Å; Q226-S228 PolarHBondContact O-N 2.88Å; Q226-R229 CarbonylContact O-C 3.58Å; Q226-R229 VanDerWaalsContact O-C 3.27Å; Q226-R229 WeakPolarHBondContact O-CA 3.5Å; Q226-R229 PolarHBondContact O-N 2.93Å; Q226-W235 HydrophobicContact CB-CB 4.12Å; Q226-W235 HydrophobicContact CB-CG 4.34Å
227	S	82.3	Confident	93.4	Very high	76 Å²	76	50.7 Å²	50.7	53%	0.531	28%	0.276	S	S	.	.	G	3₁₀ helix	trans	-50.9	-37.1	174.6	45.1	0	0	0	0	113.5	N224 Q225 R229	N224-S227 WeakPolarHBondContact O-CB 3.41Å; N224-S227 PolarHBondContact O-N 3.4Å; N224-S227 PolarHBondContact O-OG 3.48Å; Q225-S227 PolarHBondContact O-N 2.92Å; S227-R229 PolarHBondContact O-N 3.34Å
228	S	81.9	Confident	93.3	Very high	98 Å²	98	53.7 Å²	53.7	69%	0.685	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	-72.7	-8	175.3	61	0	0	0	0	115.2	Q226	Q226-S228 PolarHBondContact O-N 2.88Å
229	R	89.5	Confident	93.3	Very high	166 Å²	166	53.1 Å²	53.1	63%	0.626	29%	0.285	S	S	*	.	S	Bend	trans	-138	59.1	-177	-65.2	-173.4	-179.9	-176.1	0.3	111.3	Q226 S227 T232	Q226-R229 CarbonylContact O-C 3.58Å; Q226-R229 VanDerWaalsContact O-C 3.27Å; Q226-R229 WeakPolarHBondContact O-CA 3.5Å; Q226-R229 PolarHBondContact O-N 2.93Å; S227-R229 PolarHBondContact O-N 3.34Å; R229-T232 HydrophobicContact CB-CG2 4.05Å; R229-T232 WeakPolarHBondContact O-CG2 3.23Å; R229-T232 PolarHBondContact O-OG1 3.34Å
230	P	91.4	Very high	93.3	Very high	53 Å²	53	55.9 Å²	55.9	34%	0.344	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	150.5	-173.4	29.7	-37.5	0	0	0	112.4	T232 H288	P230-T232 PolarHBondContact O-N 3.44Å; P230-H288 WeakPolarHBondContact CB-CE1 3.4Å
231	F	94	Very high	93.3	Very high	67 Å²	67	59.1 Å²	59.1	29%	0.294	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.6	5.8	178.4	-48.1	-74.8	0	0	0	116.7	W235 W236 K287 H288 A291	F231-W235 HydrophobicContact CD1-CE3 4.41Å; F231-W235 HydrophobicContact CD1-CH2 4.13Å; F231-W235 AromaticContact CD1-CZ3 3.9Å; F231-W235 HydrophobicContact CD1-CZ3 3.9Å; F231-W235 HydrophobicContact CE1-CH2 4.04Å; F231-W235 HydrophobicContact CE1-CZ3 4.26Å; F231-W236 HydrophobicContact CD1-CZ2 4.41Å; F231-W236 VanDerWaalsContact O-CD1 3.28Å; F231-W236 PolarHBondContact O-NE1 3.12Å; F231-K287 HydrophobicContact CE1-CB 3.94Å; F231-K287 HydrophobicContact CE2-CB 4.29Å; F231-K287 HydrophobicContact CZ-CB 3.49Å; F231-K287 VanDerWaalsContact CZ-CB 3.49Å; F231-H288 AromaticContact CE1-ND1 3.91Å; F231-H288 AromaticContact CE2-CE1 3.54Å; F231-H288 AromaticContact CE2-ND1 3.81Å; F231-H288 AromaticContact CE2-NE2 3.8Å; F231-H288 HydrophobicContact CZ-CB 4.38Å; F231-H288 AromaticContact CZ-CE1 3.54Å; F231-H288 AromaticContact CZ-CG 3.69Å; F231-H288 AromaticContact CZ-ND1 3.29Å; F231-H288 VanDerWaalsContact CZ-ND1 3.29Å; F231-H288 WeakPolarHBondContact CZ-ND1 3.3Å; F231-A291 HydrophobicContact CE1-CB 4.08Å
232	T	95.3	Very high	93.4	Very high	53 Å²	53	59.1 Å²	59.1	33%	0.325	32%	0.318	S	S	.	.	S	Bend	trans	-69.9	163.7	172.7	60.6	0	0	0	0	112.1	R229 P230 W235 W236	R229-T232 HydrophobicContact CB-CG2 4.05Å; R229-T232 WeakPolarHBondContact O-CG2 3.23Å; R229-T232 PolarHBondContact O-OG1 3.34Å; P230-T232 PolarHBondContact O-N 3.44Å; T232-W235 WeakPolarHBondContact O-CB 3.45Å; T232-W235 PolarHBondContact O-N 3.44Å; T232-W236 PolarHBondContact O-N 2.92Å
233	A	94.4	Very high	93.6	Very high	82 Å²	82	57.3 Å²	57.3	68%	0.678	31%	0.31	S	S	*	.	H	α-helix	trans	-57.6	-41	179	0	0	0	0	0	113.9	W235 W236 L237	A233-W235 PolarHBondContact O-N 3.26Å; A233-W236 PolarHBondContact O-N 2.95Å; A233-L237 WeakPolarHBondContact O-CB 3.41Å; A233-L237 PolarHBondContact O-N 3.44Å
234	P	94.6	Very high	93.7	Very high	61 Å²	61	58.8 Å²	58.8	40%	0.396	32%	0.323	S	S	.	.	H	α-helix	trans	-63.9	-36.1	171.9	-24	35.8	0	0	0	113.7	L237 W238	P234-L237 PolarHBondContact O-N 3.45Å; P234-W238 PolarHBondContact O-N 3.46Å; P234-W238 VanDerWaalsContact O-N 3.11Å
235	W	95.8	Very high	94	Very high	2 Å²	2	57.3 Å²	57.3	1%	0.008	32%	0.317	C	S	.	.	H	α-helix	trans	-62.6	-46.4	176.5	-173.9	94.8	0	0	0	111.2	F223 Q226 F231 T232 A233 L239 H288 A291	F223-W235 AromaticContact CE2-CD2 3.75Å; F223-W235 HydrophobicContact CE2-CD2 3.75Å; F223-W235 AromaticContact CE2-CE2 3.31Å; F223-W235 HydrophobicContact CE2-CE3 4.31Å; F223-W235 HydrophobicContact CE2-CG 4.22Å; F223-W235 HydrophobicContact CE2-CH2 4.08Å; F223-W235 AromaticContact CE2-CZ2 3.5Å; F223-W235 HydrophobicContact CE2-CZ2 3.5Å; F223-W235 HydrophobicContact CE2-CZ3 4.45Å; F223-W235 AromaticContact CE2-NE1 3.51Å; F223-W235 AromaticContact CZ-CE2 3.65Å; F223-W235 HydrophobicContact CZ-CH2 4.23Å; F223-W235 AromaticContact CZ-CZ2 3.48Å; F223-W235 HydrophobicContact CZ-CZ2 3.48Å; F223-W235 VanDerWaalsContact CZ-CZ2 3.48Å; F223-W235 AromaticContact CZ-NE1 3.78Å; Q226-W235 HydrophobicContact CB-CB 4.12Å; Q226-W235 HydrophobicContact CB-CG 4.34Å; F231-W235 HydrophobicContact CD1-CE3 4.41Å; F231-W235 HydrophobicContact CD1-CH2 4.13Å; F231-W235 AromaticContact CD1-CZ3 3.9Å; F231-W235 HydrophobicContact CD1-CZ3 3.9Å; F231-W235 HydrophobicContact CE1-CH2 4.04Å; F231-W235 HydrophobicContact CE1-CZ3 4.26Å; T232-W235 WeakPolarHBondContact O-CB 3.45Å; T232-W235 PolarHBondContact O-N 3.44Å; A233-W235 PolarHBondContact O-N 3.26Å; W235-L239 HydrophobicContact CE3-CD2 4.25Å; W235-L239 HydrophobicContact CH2-CD2 3.76Å; W235-L239 HydrophobicContact CZ3-CD2 3.55Å; W235-L239 WeakPolarHBondContact O-CB 3.32Å; W235-L239 PolarHBondContact O-N 3.18Å; W235-L239 VanDerWaalsContact O-N 3.16Å; W235-H288 AromaticContact CZ2-CE1 3.88Å; W235-H288 AromaticContact CZ2-ND1 3.65Å; W235-A291 HydrophobicContact CH2-CB 3.68Å; W235-A291 HydrophobicContact CZ3-CB 3.96Å
236	W	96.3	Very high	94.4	Very high	94 Å²	94	54.2 Å²	54.2	36%	0.356	30%	0.302	S	S	.	.	H	α-helix	trans	-66.6	-38.5	174.2	-81.7	108.9	0	0	0	113.2	F231 T232 A233 L239 V240 A291	F231-W236 HydrophobicContact CD1-CZ2 4.41Å; F231-W236 VanDerWaalsContact O-CD1 3.28Å; F231-W236 PolarHBondContact O-NE1 3.12Å; T232-W236 PolarHBondContact O-N 2.92Å; A233-W236 PolarHBondContact O-N 2.95Å; W236-L239 HydrophobicContact CE3-CD2 3.9Å; W236-L239 HydrophobicContact CZ3-CD2 3.85Å; W236-L239 PolarHBondContact O-N 3.46Å; W236-V240 WeakPolarHBondContact O-CB 3.31Å; W236-V240 VanDerWaalsContact O-CG2 3.31Å; W236-V240 WeakPolarHBondContact O-CG2 3.33Å; W236-V240 PolarHBondContact O-N 2.84Å; W236-A291 HydrophobicContact CH2-CB 3.56Å; W236-A291 HydrophobicContact CZ2-CB 3.94Å; W236-A291 HydrophobicContact CZ3-CB 4.31Å
237	L	96.6	Very high	94.8	Very high	94 Å²	94	52.6 Å²	52.6	49%	0.492	30%	0.296	S	S	.	.	H	α-helix	trans	-57.6	-52.6	177.1	177.4	63.2	0	0	0	111.3	A233 P234 L239 V240 L241	A233-L237 WeakPolarHBondContact O-CB 3.41Å; A233-L237 PolarHBondContact O-N 3.44Å; P234-L237 PolarHBondContact O-N 3.45Å; L237-L239 VanDerWaalsContact C-N 3.33Å; L237-L239 PolarHBondContact O-N 3.23Å; L237-V240 PolarHBondContact O-N 3.17Å; L237-L241 HydrophobicContact CD1-CD1 3.84Å; L237-L241 HydrophobicContact CD1-CG 4.11Å; L237-L241 HydrophobicContact CG-CD1 3.92Å; L237-L241 WeakPolarHBondContact O-CB 3.28Å; L237-L241 VanDerWaalsContact O-CG 3.27Å; L237-L241 WeakPolarHBondContact O-CG 3.27Å; L237-L241 PolarHBondContact O-N 2.89Å
238	W	96.9	Very high	95.6	Very high	64 Å²	64	49.1 Å²	49.1	24%	0.242	27%	0.271	C	S	.	.	H	α-helix	trans	-67.4	-32.8	179.8	-66.2	118.9	0	0	0	112.9	K222 F223 P234 L241 C242	K222-W238 HydrophobicContact CB-CB 4.46Å; K222-W238 HydrophobicContact CB-CD2 3.42Å; K222-W238 VanDerWaalsContact CB-CD2 3.42Å; K222-W238 HydrophobicContact CB-CE3 3.74Å; K222-W238 HydrophobicContact CB-CG 3.74Å; K222-W238 HydrophobicContact CB-CH2 4.34Å; K222-W238 HydrophobicContact CB-CZ2 4.07Å; K222-W238 HydrophobicContact CB-CZ3 4.18Å; K222-W238 HydrophobicContact CD-CH2 4.42Å; K222-W238 HydrophobicContact CD-CZ2 4.01Å; K222-W238 HydrophobicContact CG-CD2 4.16Å; K222-W238 HydrophobicContact CG-CE3 4.2Å; K222-W238 HydrophobicContact CG-CH2 4Å; K222-W238 HydrophobicContact CG-CZ2 3.95Å; K222-W238 HydrophobicContact CG-CZ3 4.13Å; F223-W238 HydrophobicContact CB-CB 3.93Å; P234-W238 PolarHBondContact O-N 3.46Å; P234-W238 VanDerWaalsContact O-N 3.11Å; W238-L241 HydrophobicContact CE3-CD1 3.99Å; W238-L241 HydrophobicContact CZ3-CD1 4.07Å; W238-C242 VanDerWaalsContact O-CB 3.23Å; W238-C242 WeakPolarHBondContact O-CB 3.37Å; W238-C242 PolarHBondContact O-N 2.92Å
239	L	97.4	Very high	96.3	Very high	1 Å²	1	44.4 Å²	44.4	1%	0.005	24%	0.239	C	C	.	.	H	α-helix	trans	-64.7	-46.4	174.2	-175.3	58.3	0	0	0	112.2	F223 W235 W236 L237 C242 G243 A291 L296	F223-L239 HydrophobicContact CD2-CB 3.82Å; F223-L239 HydrophobicContact CD2-CD1 4.27Å; F223-L239 HydrophobicContact CE2-CB 3.76Å; F223-L239 HydrophobicContact CE2-CD1 3.81Å; F223-L239 HydrophobicContact CE2-CD2 4.12Å; F223-L239 HydrophobicContact CE2-CG 4.11Å; F223-L239 HydrophobicContact CZ-CD1 4.08Å; W235-L239 HydrophobicContact CE3-CD2 4.25Å; W235-L239 HydrophobicContact CH2-CD2 3.76Å; W235-L239 HydrophobicContact CZ3-CD2 3.55Å; W235-L239 WeakPolarHBondContact O-CB 3.32Å; W235-L239 PolarHBondContact O-N 3.18Å; W235-L239 VanDerWaalsContact O-N 3.16Å; W236-L239 HydrophobicContact CE3-CD2 3.9Å; W236-L239 HydrophobicContact CZ3-CD2 3.85Å; W236-L239 PolarHBondContact O-N 3.46Å; L237-L239 VanDerWaalsContact C-N 3.33Å; L237-L239 PolarHBondContact O-N 3.23Å; L239-C242 PolarHBondContact O-N 3.01Å; L239-G243 PolarHBondContact O-N 3.49Å; L239-A291 HydrophobicContact CD2-CB 4.49Å; L239-L296 HydrophobicContact CD1-CD1 3.98Å; L239-L296 HydrophobicContact CD1-CD2 3.92Å; L239-L296 HydrophobicContact CD1-CG 3.69Å
240	V	97.9	Very high	96.7	Very high	65 Å²	65	37.2 Å²	37.2	39%	0.394	21%	0.213	S	C	.	.	H	α-helix	trans	-68.6	-41.2	178.5	168.8	0	0	0	0	111.4	W236 L237 G243 A244 L299	W236-V240 WeakPolarHBondContact O-CB 3.31Å; W236-V240 VanDerWaalsContact O-CG2 3.31Å; W236-V240 WeakPolarHBondContact O-CG2 3.33Å; W236-V240 PolarHBondContact O-N 2.84Å; L237-V240 PolarHBondContact O-N 3.17Å; V240-G243 PolarHBondContact O-N 3.03Å; V240-A244 WeakPolarHBondContact O-CB 3.47Å; V240-A244 PolarHBondContact O-N 3.39Å; V240-L299 HydrophobicContact CB-CD2 4.25Å; V240-L299 HydrophobicContact CG1-CD2 3.93Å; V240-L299 HydrophobicContact CG2-CD2 4.29Å
241	L	97.9	Very high	97	Very high	72 Å²	72	34.7 Å²	34.7	38%	0.377	20%	0.197	S	C	.	.	H	α-helix	trans	-64.8	-39.5	174.6	-72.3	174.9	0	0	0	112	L237 W238 A244 A245	L237-L241 HydrophobicContact CD1-CD1 3.84Å; L237-L241 HydrophobicContact CD1-CG 4.11Å; L237-L241 HydrophobicContact CG-CD1 3.92Å; L237-L241 WeakPolarHBondContact O-CB 3.28Å; L237-L241 VanDerWaalsContact O-CG 3.27Å; L237-L241 WeakPolarHBondContact O-CG 3.27Å; L237-L241 PolarHBondContact O-N 2.89Å; W238-L241 HydrophobicContact CE3-CD1 3.99Å; W238-L241 HydrophobicContact CZ3-CD1 4.07Å; L241-A244 PolarHBondContact O-N 2.92Å; L241-A245 VanDerWaalsContact O-CB 3.29Å; L241-A245 WeakPolarHBondContact O-CB 3.19Å; L241-A245 PolarHBondContact O-N 3.01Å
242	C	98.2	Very high	97.1	Very high	3 Å²	3	31.5 Å²	31.5	2%	0.02	18%	0.183	C	C	.	.	H	α-helix	trans	-60.9	-48.1	173.2	-167.7	0	0	0	0	110.6	A216 W238 L239 A244 A245 L246 L296	A216-C242 PolarHBondContact O-SG 3.33Å; W238-C242 VanDerWaalsContact O-CB 3.23Å; W238-C242 WeakPolarHBondContact O-CB 3.37Å; W238-C242 PolarHBondContact O-N 2.92Å; L239-C242 PolarHBondContact O-N 3.01Å; C242-A244 PolarHBondContact O-N 3.43Å; C242-A245 PolarHBondContact O-N 2.93Å; C242-L246 WeakPolarHBondContact O-CG 3.33Å; C242-L246 PolarHBondContact O-N 3.39Å; C242-L296 HydrophobicContact CB-CD2 4.03Å
243	G	98.1	Very high	97.1	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-58.8	-45.3	176	0	0	0	0	0	113.9	L239 V240 A245 L246 A247 G295 P300	L239-G243 PolarHBondContact O-N 3.49Å; V240-G243 PolarHBondContact O-N 3.03Å; G243-A245 PolarHBondContact O-N 3.02Å; G243-L246 PolarHBondContact O-N 3.46Å; G243-A247 PolarHBondContact O-N 3.42Å; G243-G295 VanDerWaalsContact CA-O 3.28Å; G243-G295 WeakPolarHBondContact CA-O 3.41Å; G243-P300 WeakPolarHBondContact O-CG 3.29Å
244	A	98.3	Very high	97.1	Very high	38 Å²	38	27.2 Å²	27.2	31%	0.314	15%	0.145	S	C	.	.	H	α-helix	trans	-63.9	-39.4	176.3	0	0	0	0	0	112.5	V240 L241 C242 A247 G248 L303	V240-A244 WeakPolarHBondContact O-CB 3.47Å; V240-A244 PolarHBondContact O-N 3.39Å; L241-A244 PolarHBondContact O-N 2.92Å; C242-A244 PolarHBondContact O-N 3.43Å; A244-A247 WeakPolarHBondContact O-CB 3.24Å; A244-A247 PolarHBondContact O-N 3.26Å; A244-G248 PolarHBondContact O-N 3.48Å; A244-L303 HydrophobicContact CB-CD1 4Å
245	A	98.3	Very high	97	Very high	6 Å²	6	25.1 Å²	25.1	5%	0.05	13%	0.131	C	C	.	.	H	α-helix	trans	-69.7	-37.3	176.4	0	0	0	0	0	112.6	A215 A216 L241 C242 G243 G248 A249	A215-A245 HydrophobicContact CB-CB 3.96Å; A216-A245 HydrophobicContact CB-CB 3.75Å; L241-A245 VanDerWaalsContact O-CB 3.29Å; L241-A245 WeakPolarHBondContact O-CB 3.19Å; L241-A245 PolarHBondContact O-N 3.01Å; C242-A245 PolarHBondContact O-N 2.93Å; G243-A245 PolarHBondContact O-N 3.02Å; A245-G248 PolarHBondContact O-N 3.23Å; A245-A249 PolarHBondContact O-N 3.42Å
246	L	98.2	Very high	96.9	Very high	3 Å²	3	25 Å²	25	2%	0.016	13%	0.13	C	C	.	.	H	α-helix	trans	-61.7	-43.5	171.7	-71.8	-177.4	0	0	0	111.8	A216 C242 G243 G248 A249 V250 V259 I260 V263 L296	A216-L246 HydrophobicContact CB-CD2 3.8Å; A216-L246 HydrophobicContact CB-CG 4.25Å; C242-L246 WeakPolarHBondContact O-CG 3.33Å; C242-L246 PolarHBondContact O-N 3.39Å; G243-L246 PolarHBondContact O-N 3.46Å; L246-G248 VanDerWaalsContact C-N 3.31Å; L246-G248 PolarHBondContact O-N 3.38Å; L246-A249 PolarHBondContact O-N 3.01Å; L246-V250 WeakPolarHBondContact O-CG1 3.29Å; L246-V250 PolarHBondContact O-N 2.88Å; L246-V259 HydrophobicContact CD2-CB 4.48Å; L246-V259 HydrophobicContact CD2-CG1 3.93Å; L246-V259 HydrophobicContact CD2-CG2 4.14Å; L246-I260 HydrophobicContact CB-CG1 4.09Å; L246-I260 HydrophobicContact CD1-CG1 4.39Å; L246-I260 HydrophobicContact CD2-CB 4.46Å; L246-I260 HydrophobicContact CD2-CG1 3.79Å; L246-I260 HydrophobicContact CG-CG1 4.3Å; L246-V263 HydrophobicContact CD1-CB 4.21Å; L246-V263 HydrophobicContact CD1-CG1 4.11Å; L246-V263 HydrophobicContact CD1-CG2 4.48Å; L246-V263 HydrophobicContact CD2-CB 4.4Å; L246-V263 HydrophobicContact CD2-CG2 3.99Å; L246-L296 HydrophobicContact CD1-CD2 4.26Å
247	A	98	Very high	96.9	Very high	7 Å²	7	24.9 Å²	24.9	6%	0.058	14%	0.136	C	C	.	.	H	α-helix	trans	-60.1	-41.9	173	0	0	0	0	0	112	G243 A244 G251 P300 L303	G243-A247 PolarHBondContact O-N 3.42Å; A244-A247 WeakPolarHBondContact O-CB 3.24Å; A244-A247 PolarHBondContact O-N 3.26Å; A247-G251 WeakPolarHBondContact O-CA 3.35Å; A247-G251 PolarHBondContact O-N 2.9Å; A247-P300 HydrophobicContact CB-CB 4.24Å; A247-L303 HydrophobicContact CB-CB 3.7Å; A247-L303 HydrophobicContact CB-CD1 4.15Å
248	G	97.8	Very high	96.9	Very high	2 Å²	2	21.9 Å²	21.9	2%	0.021	12%	0.119	C	C	.	.	H	α-helix	trans	-60	-48.7	175.3	0	0	0	0	0	112.5	F212 A244 A245 L246 G251 V252	F212-G248 VanDerWaalsContact CD2-C 3.49Å; A244-G248 PolarHBondContact O-N 3.48Å; A245-G248 PolarHBondContact O-N 3.23Å; L246-G248 VanDerWaalsContact C-N 3.31Å; L246-G248 PolarHBondContact O-N 3.38Å; G248-G251 PolarHBondContact O-N 2.9Å; G248-V252 VanDerWaalsContact O-CG2 3.3Å; G248-V252 WeakPolarHBondContact O-CG2 3.39Å; G248-V252 PolarHBondContact O-N 3.42Å; G248-V252 VanDerWaalsContact O-N 3.1Å
249	A	97.9	Very high	96.9	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-60.8	-52.5	-177.5	0	0	0	0	0	112	L209 F212 I213 A245 L246 G251 V252 K253 V259	L209-A249 WeakPolarHBondContact CD1-O 3.3Å; F212-A249 HydrophobicContact CB-CB 3.93Å; I213-A249 HydrophobicContact CG1-CB 4.16Å; A245-A249 PolarHBondContact O-N 3.42Å; L246-A249 PolarHBondContact O-N 3.01Å; A249-G251 VanDerWaalsContact C-N 3.3Å; A249-G251 PolarHBondContact O-N 3.2Å; A249-V252 PolarHBondContact O-N 3.25Å; A249-K253 PolarHBondContact O-N 2.93Å; A249-K253 VanDerWaalsContact O-O 3.1Å; A249-V259 HydrophobicContact CB-CG1 3.79Å
250	V	97.1	Very high	96.9	Very high	15 Å²	15	21.4 Å²	21.4	9%	0.091	12%	0.121	C	C	.	.	H	α-helix	trans	-69.5	-29.6	177.7	71.7	0	0	0	0	112.2	P117 L246 V252 F254 L257 I260 Y304	P117-V250 WeakPolarHBondContact CB-O 3.38Å; P117-V250 WeakPolarHBondContact CG-O 3.33Å; L246-V250 WeakPolarHBondContact O-CG1 3.29Å; L246-V250 PolarHBondContact O-N 2.88Å; V250-V252 PolarHBondContact O-N 2.7Å; V250-F254 HydrophobicContact CG2-CD1 4.39Å; V250-L257 HydrophobicContact CG2-CD2 3.9Å; V250-L257 HydrophobicContact CG2-CG 4.14Å; V250-I260 HydrophobicContact CB-CD1 3.89Å; V250-I260 HydrophobicContact CG1-CD1 3.99Å; V250-I260 HydrophobicContact CG2-CD1 4.41Å; V250-Y304 HydrophobicContact CG1-CD2 3.72Å; V250-Y304 HydrophobicContact CG1-CE2 4.02Å; V250-Y304 HydrophobicContact CG1-CG 4.48Å; V250-Y304 HydrophobicContact CG2-CE2 4.25Å
251	G	97	Very high	96.9	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-67.6	-16	173.7	0	0	0	0	0	115.1	P117 L119 A247 G248 A249	P117-G251 CarbonylContact C-O 3.56Å; P117-G251 VanDerWaalsContact CB-O 3.31Å; P117-G251 WeakPolarHBondContact CB-O 3.19Å; L119-G251 WeakPolarHBondContact CB-O 3.42Å; L119-G251 PolarHBondContact N-O 3.42Å; A247-G251 WeakPolarHBondContact O-CA 3.35Å; A247-G251 PolarHBondContact O-N 2.9Å; G248-G251 PolarHBondContact O-N 2.9Å; A249-G251 VanDerWaalsContact C-N 3.3Å; A249-G251 PolarHBondContact O-N 3.2Å
252	V	97	Very high	96.9	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-98.9	-50.6	177.3	175	0	0	0	0	112.5	L119 L205 I208 L209 F212 G248 A249 V250	L119-V252 HydrophobicContact CB-CG2 4.27Å; L119-V252 HydrophobicContact CD2-CG2 4.37Å; L119-V252 HydrophobicContact CG-CG2 4.41Å; L205-V252 HydrophobicContact CB-CG1 4.01Å; L205-V252 HydrophobicContact CD2-CG1 4.36Å; L205-V252 WeakPolarHBondContact O-CG1 3.48Å; I208-V252 HydrophobicContact CB-CG1 4.3Å; I208-V252 HydrophobicContact CB-CG2 4.33Å; I208-V252 HydrophobicContact CG2-CG2 3.78Å; L209-V252 HydrophobicContact CB-CB 4.46Å; L209-V252 HydrophobicContact CB-CG1 3.88Å; F212-V252 HydrophobicContact CD2-CG2 3.94Å; F212-V252 HydrophobicContact CE2-CG2 4.07Å; G248-V252 VanDerWaalsContact O-CG2 3.3Å; G248-V252 WeakPolarHBondContact O-CG2 3.39Å; G248-V252 PolarHBondContact O-N 3.42Å; G248-V252 VanDerWaalsContact O-N 3.1Å; A249-V252 PolarHBondContact O-N 3.25Å; V250-V252 PolarHBondContact O-N 2.7Å
253	K	95.2	Very high	96.9	Very high	5 Å²	5	20.5 Å²	20.5	2%	0.022	11%	0.108	C	C	.	.			trans	-147.5	147.3	171.3	-65	-167.7	-174.3	173.1	0	109.1	H116 L205 D206 L209 A249 V255 G256 H673	H116-K253 HydrophobicContact CB-CG 4.47Å; L205-K253 HydrophobicContact CB-CG 4.48Å; L205-K253 HydrophobicContact CD1-CG 4.31Å; D206-K253 IonicContact OD1-NZ 3.53Å; D206-K253 PolarHBondContact OD1-NZ 3.08Å; D206-K253 IonicContact OD2-NZ 3.47Å; D206-K253 PolarHBondContact OD2-NZ 2.95Å; L209-K253 HydrophobicContact CD1-CB 4.29Å; L209-K253 HydrophobicContact CD2-CB 4.11Å; L209-K253 HydrophobicContact CD2-CD 4.14Å; L209-K253 HydrophobicContact CD2-CG 4.34Å; A249-K253 PolarHBondContact O-N 2.93Å; A249-K253 VanDerWaalsContact O-O 3.1Å; K253-V255 PolarHBondContact O-N 3.23Å; K253-G256 PolarHBondContact O-N 2.89Å; K253-H673 PolarHBondContact NZ-NE2 2.95Å
254	F	93.9	Very high	96.8	Very high	40 Å²	40	22.2 Å²	22.2	18%	0.175	13%	0.126	C	C	.	.	G	3₁₀ helix	trans	-59.1	-12.8	175.6	-66.9	-61.5	0	0	0	115.1	V115 P117 V250 G256 L257 M558	V115-F254 WeakPolarHBondContact O-CE2 3.36Å; P117-F254 HydrophobicContact CG-CD1 3.98Å; P117-F254 HydrophobicContact CG-CD2 4.28Å; P117-F254 HydrophobicContact CG-CE1 3.55Å; P117-F254 HydrophobicContact CG-CE2 3.89Å; P117-F254 HydrophobicContact CG-CG 4.33Å; P117-F254 HydrophobicContact CG-CZ 3.5Å; V250-F254 HydrophobicContact CG2-CD1 4.39Å; F254-G256 PolarHBondContact O-N 2.93Å; F254-L257 HydrophobicContact CB-CD1 4.38Å; F254-L257 VanDerWaalsContact O-CB 3.3Å; F254-L257 WeakPolarHBondContact O-CB 3.48Å; F254-L257 WeakPolarHBondContact O-CD1 3.4Å; F254-L257 VanDerWaalsContact O-CG 3.24Å; F254-L257 WeakPolarHBondContact O-CG 3.36Å; F254-L257 PolarHBondContact O-N 2.84Å; F254-M558 HydrophobicContact CE2-CB 4.12Å; F254-M558 HydrophobicContact CE2-SD 4.25Å; F254-M558 HydrophobicContact CZ-CB 4.34Å; F254-M558 HydrophobicContact CZ-SD 4.01Å
255	V	92.7	Very high	96.8	Very high	17 Å²	17	23.8 Å²	23.8	10%	0.103	13%	0.129	C	C	.	.	G	3₁₀ helix	trans	-58	-26	168.2	177.9	0	0	0	0	111.6	L209 K253 L257 F258 F663	L209-V255 HydrophobicContact CD2-CB 4.16Å; L209-V255 HydrophobicContact CD2-CG1 4.32Å; K253-V255 PolarHBondContact O-N 3.23Å; V255-L257 PolarHBondContact O-N 3.43Å; V255-L257 VanDerWaalsContact O-N 3.07Å; V255-F258 HydrophobicContact CG1-CD2 3.79Å; V255-F258 HydrophobicContact CG1-CE2 3.96Å; V255-F258 WeakPolarHBondContact O-CB 3.44Å; V255-F258 WeakPolarHBondContact O-CD2 3.33Å; V255-F258 WeakPolarHBondContact O-CG 3.37Å; V255-F258 PolarHBondContact O-N 2.92Å; V255-F663 HydrophobicContact CG1-CZ 4.42Å; V255-F663 HydrophobicContact CG2-CZ 4.24Å
256	G	93.7	Very high	96.7	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	13%	0.131	C	C	.	.	G	3₁₀ helix	trans	-60.3	-12.8	171.8	0	0	0	0	0	115.2	K253 F254 F258 V259 I260	K253-G256 PolarHBondContact O-N 2.89Å; F254-G256 PolarHBondContact O-N 2.93Å; G256-F258 PolarHBondContact O-N 3.49Å; G256-V259 WeakPolarHBondContact O-CG1 3.47Å; G256-V259 PolarHBondContact O-N 3.26Å; G256-I260 PolarHBondContact O-N 3.22Å
257	L	95.9	Very high	96.6	Very high	90 Å²	90	24.9 Å²	24.9	47%	0.471	14%	0.135	S	C	.	.	H	α-helix	trans	-62	-26.6	169.2	-66.9	170.4	0	0	0	112.4	V250 F254 V255 I260 F261	V250-L257 HydrophobicContact CG2-CD2 3.9Å; V250-L257 HydrophobicContact CG2-CG 4.14Å; F254-L257 HydrophobicContact CB-CD1 4.38Å; F254-L257 VanDerWaalsContact O-CB 3.3Å; F254-L257 WeakPolarHBondContact O-CB 3.48Å; F254-L257 WeakPolarHBondContact O-CD1 3.4Å; F254-L257 VanDerWaalsContact O-CG 3.24Å; F254-L257 WeakPolarHBondContact O-CG 3.36Å; F254-L257 PolarHBondContact O-N 2.84Å; V255-L257 PolarHBondContact O-N 3.43Å; V255-L257 VanDerWaalsContact O-N 3.07Å; L257-I260 HydrophobicContact CD2-CD1 4.28Å; L257-I260 PolarHBondContact O-N 2.88Å; L257-F261 PolarHBondContact O-N 3.36Å
258	F	96.9	Very high	96.5	Very high	31 Å²	31	27.3 Å²	27.3	14%	0.136	15%	0.154	C	C	.	.	H	α-helix	trans	-71.4	-36.7	179.3	-55.6	-28	0	0	0	112.5	V255 G256 F261 L262 L658 P662 F663 M666	V255-F258 HydrophobicContact CG1-CD2 3.79Å; V255-F258 HydrophobicContact CG1-CE2 3.96Å; V255-F258 WeakPolarHBondContact O-CB 3.44Å; V255-F258 WeakPolarHBondContact O-CD2 3.33Å; V255-F258 WeakPolarHBondContact O-CG 3.37Å; V255-F258 PolarHBondContact O-N 2.92Å; G256-F258 PolarHBondContact O-N 3.49Å; F258-F261 PolarHBondContact O-N 3.11Å; F258-L262 PolarHBondContact O-N 3.48Å; F258-L658 WeakPolarHBondContact CD2-O 3.41Å; F258-L658 VanDerWaalsContact CG-O 3.29Å; F258-L658 WeakPolarHBondContact CG-O 3.29Å; F258-P662 HydrophobicContact CD1-CG 4.24Å; F258-P662 HydrophobicContact CE1-CB 3.8Å; F258-P662 HydrophobicContact CE1-CG 3.72Å; F258-P662 HydrophobicContact CE2-CB 4.3Å; F258-P662 HydrophobicContact CE2-CG 4.33Å; F258-P662 HydrophobicContact CZ-CB 3.52Å; F258-P662 HydrophobicContact CZ-CG 3.78Å; F258-F663 HydrophobicContact CE2-CE2 4.24Å; F258-F663 HydrophobicContact CE2-CZ 4.05Å; F258-M666 HydrophobicContact CZ-CE 3.79Å
259	V	97.7	Very high	96.4	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-73.2	-32.3	172.3	67.6	0	0	0	0	111.9	I213 A216 V217 L246 A249 G256 F261 L262 V263 H659	I213-V259 HydrophobicContact CG1-CB 4.24Å; I213-V259 HydrophobicContact CG1-CG1 3.86Å; I213-V259 HydrophobicContact CG2-CB 4.22Å; I213-V259 HydrophobicContact CG2-CG2 4.24Å; A216-V259 HydrophobicContact CB-CG2 3.96Å; V217-V259 HydrophobicContact CG2-CG2 4.04Å; L246-V259 HydrophobicContact CD2-CB 4.48Å; L246-V259 HydrophobicContact CD2-CG1 3.93Å; L246-V259 HydrophobicContact CD2-CG2 4.14Å; A249-V259 HydrophobicContact CB-CG1 3.79Å; G256-V259 WeakPolarHBondContact O-CG1 3.47Å; G256-V259 PolarHBondContact O-N 3.26Å; V259-F261 VanDerWaalsContact C-N 3.31Å; V259-F261 PolarHBondContact O-N 3.34Å; V259-L262 PolarHBondContact O-N 3.06Å; V259-V263 HydrophobicContact CG2-CG2 4.35Å; V259-V263 WeakPolarHBondContact O-CG2 3.26Å; V259-V263 PolarHBondContact O-N 3.4Å; V259-H659 PolarHBondContact N-NE2 3.17Å
260	I	97.8	Very high	96.2	Very high	56 Å²	56	29.1 Å²	29.1	29%	0.287	17%	0.171	S	C	.	.	H	α-helix	trans	-59.9	-43.3	169.7	-68.1	169.4	0	0	0	110.4	L246 V250 G256 L257 G264	L246-I260 HydrophobicContact CB-CG1 4.09Å; L246-I260 HydrophobicContact CD1-CG1 4.39Å; L246-I260 HydrophobicContact CD2-CB 4.46Å; L246-I260 HydrophobicContact CD2-CG1 3.79Å; L246-I260 HydrophobicContact CG-CG1 4.3Å; V250-I260 HydrophobicContact CB-CD1 3.89Å; V250-I260 HydrophobicContact CG1-CD1 3.99Å; V250-I260 HydrophobicContact CG2-CD1 4.41Å; G256-I260 PolarHBondContact O-N 3.22Å; L257-I260 HydrophobicContact CD2-CD1 4.28Å; L257-I260 PolarHBondContact O-N 2.88Å; I260-G264 PolarHBondContact O-N 3.27Å
261	F	97.3	Very high	96.1	Very high	116 Å²	116	30.1 Å²	30.1	51%	0.509	18%	0.175	S	C	.	.	H	α-helix	trans	-69.5	-38.6	177.3	-166.8	-111.9	0	0	0	112.8	L257 F258 V259 G264 L265 L658	L257-F261 PolarHBondContact O-N 3.36Å; F258-F261 PolarHBondContact O-N 3.11Å; V259-F261 VanDerWaalsContact C-N 3.31Å; V259-F261 PolarHBondContact O-N 3.34Å; F261-G264 PolarHBondContact O-N 2.94Å; F261-L265 HydrophobicContact CD1-CD1 3.98Å; F261-L265 HydrophobicContact CD1-CG 4.33Å; F261-L265 HydrophobicContact CE1-CD1 3.57Å; F261-L265 HydrophobicContact CE1-CD2 4.48Å; F261-L265 HydrophobicContact CE1-CG 4.06Å; F261-L265 HydrophobicContact CZ-CD1 4.07Å; F261-L265 HydrophobicContact CZ-CD2 4.15Å; F261-L265 HydrophobicContact CZ-CG 4.16Å; F261-L265 WeakPolarHBondContact O-CG 3.24Å; F261-L265 PolarHBondContact O-N 3.39Å; F261-L658 HydrophobicContact CD1-CD1 3.76Å; F261-L658 HydrophobicContact CD1-CD2 3.55Å; F261-L658 HydrophobicContact CD1-CG 4.28Å; F261-L658 HydrophobicContact CE1-CD1 4.49Å; F261-L658 HydrophobicContact CE1-CD2 3.81Å
262	L	97.9	Very high	96.1	Very high	1 Å²	1	39.5 Å²	39.5	1%	0.005	21%	0.211	C	C	.	.	H	α-helix	trans	-59.2	-50.7	173.1	179	65.1	0	0	0	111.9	V217 F258 V259 G264 L265 N266 L651 L654 L658 F681	V217-L262 HydrophobicContact CG2-CD2 4.08Å; F258-L262 PolarHBondContact O-N 3.48Å; V259-L262 PolarHBondContact O-N 3.06Å; L262-G264 VanDerWaalsContact C-N 3.31Å; L262-G264 PolarHBondContact O-N 2.85Å; L262-L265 PolarHBondContact O-N 3.2Å; L262-N266 PolarHBondContact O-N 2.98Å; L262-L651 HydrophobicContact CD1-CD1 4.06Å; L262-L654 HydrophobicContact CD1-CB 4.22Å; L262-L654 HydrophobicContact CD1-CD2 3.93Å; L262-L654 HydrophobicContact CD1-CG 3.8Å; L262-L658 HydrophobicContact CB-CD1 3.91Å; L262-L658 HydrophobicContact CD1-CD1 4.16Å; L262-F681 HydrophobicContact CD2-CE1 3.74Å; L262-F681 HydrophobicContact CD2-CZ 3.69Å
263	V	97.9	Very high	95.9	Very high	3 Å²	3	46.2 Å²	46.2	2%	0.018	24%	0.237	C	C	.	.	H	α-helix	trans	-64.4	-38.7	176.8	176.3	0	0	0	0	110.5	M220 L246 V259 N266 T267 L296	M220-V263 HydrophobicContact CB-CG2 4.23Å; M220-V263 HydrophobicContact CG-CG1 4.48Å; M220-V263 HydrophobicContact CG-CG2 4.36Å; M220-V263 HydrophobicContact SD-CB 4.19Å; M220-V263 HydrophobicContact SD-CG1 4.41Å; M220-V263 HydrophobicContact SD-CG2 3.75Å; L246-V263 HydrophobicContact CD1-CB 4.21Å; L246-V263 HydrophobicContact CD1-CG1 4.11Å; L246-V263 HydrophobicContact CD1-CG2 4.48Å; L246-V263 HydrophobicContact CD2-CB 4.4Å; L246-V263 HydrophobicContact CD2-CG2 3.99Å; V259-V263 HydrophobicContact CG2-CG2 4.35Å; V259-V263 WeakPolarHBondContact O-CG2 3.26Å; V259-V263 PolarHBondContact O-N 3.4Å; V263-N266 PolarHBondContact O-N 3.2Å; V263-T267 WeakPolarHBondContact O-CB 3.35Å; V263-T267 PolarHBondContact O-N 3.17Å; V263-T267 PolarHBondContact O-OG1 3.14Å; V263-L296 HydrophobicContact CG1-CD1 4.25Å; V263-L296 HydrophobicContact CG1-CD2 4.3Å
264	G	97.3	Very high	95.8	Very high	36 Å²	36	47 Å²	47	37%	0.371	24%	0.241	S	C	.	.	H	α-helix	trans	-58.6	-47.1	174.7	0	0	0	0	0	113.2	I260 F261 L262 T267 A268	I260-G264 PolarHBondContact O-N 3.27Å; F261-G264 PolarHBondContact O-N 2.94Å; L262-G264 VanDerWaalsContact C-N 3.31Å; L262-G264 PolarHBondContact O-N 2.85Å; G264-T267 PolarHBondContact O-N 3.35Å; G264-A268 WeakPolarHBondContact O-CB 3.45Å; G264-A268 PolarHBondContact O-N 3.28Å
265	L	97.1	Very high	95.8	Very high	71 Å²	71	49.9 Å²	49.9	37%	0.372	26%	0.257	S	S	.	.	H	α-helix	trans	-66.2	-43.5	176.7	-72	-179	0	0	0	112.5	F261 L262 T267 A268 G269 L654 L658	F261-L265 HydrophobicContact CD1-CD1 3.98Å; F261-L265 HydrophobicContact CD1-CG 4.33Å; F261-L265 HydrophobicContact CE1-CD1 3.57Å; F261-L265 HydrophobicContact CE1-CD2 4.48Å; F261-L265 HydrophobicContact CE1-CG 4.06Å; F261-L265 HydrophobicContact CZ-CD1 4.07Å; F261-L265 HydrophobicContact CZ-CD2 4.15Å; F261-L265 HydrophobicContact CZ-CG 4.16Å; F261-L265 WeakPolarHBondContact O-CG 3.24Å; F261-L265 PolarHBondContact O-N 3.39Å; L262-L265 PolarHBondContact O-N 3.2Å; L265-T267 VanDerWaalsContact C-N 3.29Å; L265-T267 PolarHBondContact O-N 2.66Å; L265-A268 PolarHBondContact O-N 2.8Å; L265-G269 PolarHBondContact O-N 3.5Å; L265-L654 HydrophobicContact CB-CD2 4.36Å; L265-L654 HydrophobicContact CD1-CD1 4.15Å; L265-L654 HydrophobicContact CD1-CD2 4.03Å; L265-L658 HydrophobicContact CD1-CD1 4.35Å
266	N	96	Very high	95.9	Very high	18 Å²	18	51.7 Å²	51.7	10%	0.096	28%	0.28	C	S	.	.	H	α-helix	trans	-56.8	-46.1	172.2	173	85.3	0	0	0	110.9	M220 N224 L262 V263 A268 G269 D270 L651	M220-N266 HydrophobicContact CG-CB 4.42Å; M220-N266 WeakPolarHBondContact CG-ND2 3.42Å; M220-N266 HydrophobicContact SD-CB 3.51Å; M220-N266 VanDerWaalsContact SD-CB 3.51Å; M220-N266 VanDerWaalsContact SD-CG 3.57Å; N224-N266 PolarHBondContact ND2-ND2 3.31Å; N224-N266 PolarHBondContact ND2-OD1 3.06Å; N224-N266 PolarHBondContact OD1-ND2 3.34Å; L262-N266 PolarHBondContact O-N 2.98Å; V263-N266 PolarHBondContact O-N 3.2Å; N266-A268 PolarHBondContact O-N 2.99Å; N266-G269 PolarHBondContact O-N 3.25Å; N266-D270 VanDerWaalsContact O-CB 3.25Å; N266-D270 WeakPolarHBondContact O-CB 3.22Å; N266-D270 PolarHBondContact O-N 2.93Å; N266-L651 HydrophobicContact CB-CD1 4.46Å
267	T	96.4	Very high	95.8	Very high	15 Å²	15	55.1 Å²	55.1	9%	0.092	30%	0.298	C	S	.	.	H	α-helix	trans	-66	-37.4	-178.9	-57.2	0	0	0	0	112.1	V263 G264 L265 D270 L271 R292 L296	V263-T267 WeakPolarHBondContact O-CB 3.35Å; V263-T267 PolarHBondContact O-N 3.17Å; V263-T267 PolarHBondContact O-OG1 3.14Å; G264-T267 PolarHBondContact O-N 3.35Å; L265-T267 VanDerWaalsContact C-N 3.29Å; L265-T267 PolarHBondContact O-N 2.66Å; T267-D270 PolarHBondContact O-N 2.86Å; T267-L271 HydrophobicContact CG2-CD1 4.29Å; T267-L271 WeakPolarHBondContact O-CB 3.45Å; T267-L271 WeakPolarHBondContact O-CG 3.46Å; T267-L271 PolarHBondContact O-N 3.49Å; T267-R292 HydrophobicContact CG2-CB 4.15Å; T267-R292 HydrophobicContact CG2-CG 4.04Å; T267-L296 HydrophobicContact CG2-CD1 3.91Å
268	A	96.6	Very high	95.7	Very high	57 Å²	57	59.1 Å²	59.1	47%	0.471	32%	0.319	S	S	.	.	H	α-helix	trans	-67.7	-45	174.7	0	0	0	0	0	111.8	G264 L265 N266 D270 L271 W272	G264-A268 WeakPolarHBondContact O-CB 3.45Å; G264-A268 PolarHBondContact O-N 3.28Å; L265-A268 PolarHBondContact O-N 2.8Å; N266-A268 PolarHBondContact O-N 2.99Å; A268-D270 VanDerWaalsContact C-N 3.27Å; A268-D270 PolarHBondContact O-N 2.99Å; A268-L271 PolarHBondContact O-N 3.02Å; A268-W272 WeakPolarHBondContact O-CB 3.42Å; A268-W272 PolarHBondContact O-N 3.1Å
269	G	95.1	Very high	95.5	Very high	31 Å²	31	62.3 Å²	62.3	32%	0.32	35%	0.345	S	S	.	.	H	α-helix	trans	-65.2	-29.8	174.4	0	0	0	0	0	113.4	L265 N266 R273	L265-G269 PolarHBondContact O-N 3.5Å; N266-G269 PolarHBondContact O-N 3.25Å; G269-R273 PolarHBondContact O-N 2.89Å; G269-R273 VanDerWaalsContact O-N 3.1Å; G269-R273 PolarHBondContact O-NE 3.44Å
270	D	94.1	Very high	95.2	Very high	10 Å²	10	65.5 Å²	65.5	5%	0.053	36%	0.362	C	S	.	.	H	α-helix	trans	-73.3	-44.6	174.8	-165.9	61.3	0	0	0	112.3	N266 T267 A268 W272 R273 I274 R292	N266-D270 VanDerWaalsContact O-CB 3.25Å; N266-D270 WeakPolarHBondContact O-CB 3.22Å; N266-D270 PolarHBondContact O-N 2.93Å; T267-D270 PolarHBondContact O-N 2.86Å; A268-D270 VanDerWaalsContact C-N 3.27Å; A268-D270 PolarHBondContact O-N 2.99Å; D270-W272 VanDerWaalsContact C-N 3.31Å; D270-W272 PolarHBondContact O-N 2.82Å; D270-R273 PolarHBondContact O-N 2.67Å; D270-R273 IonicContact OD1-CZ 2.62Å; D270-R273 IonicContact OD1-NH1 3.68Å; D270-R273 PolarHBondContact OD1-NH1 3.21Å; D270-R273 IonicContact OD1-NH2 3.67Å; D270-I274 WeakPolarHBondContact O-CG1 3.21Å; D270-I274 PolarHBondContact O-N 3.43Å; D270-R292 IonicContact OD2-CZ 2.75Å; D270-R292 IonicContact OD2-NE 2.67Å; D270-R292 IonicContact OD2-NH2 3.53Å; D270-R292 PolarHBondContact OD2-NH2 3.41Å
271	L	95.1	Very high	95	Very high	35 Å²	35	65.2 Å²	65.2	18%	0.183	37%	0.365	C	S	.	.	H	α-helix	trans	-62.9	-35.3	171.2	-77.1	168	0	0	0	112.5	T267 A268 I274 L275 F289	T267-L271 HydrophobicContact CG2-CD1 4.29Å; T267-L271 WeakPolarHBondContact O-CB 3.45Å; T267-L271 WeakPolarHBondContact O-CG 3.46Å; T267-L271 PolarHBondContact O-N 3.49Å; A268-L271 PolarHBondContact O-N 3.02Å; L271-I274 PolarHBondContact O-N 3.43Å; L271-L275 WeakPolarHBondContact O-CB 3.35Å; L271-L275 PolarHBondContact O-N 3.02Å; L271-F289 HydrophobicContact CD1-CD2 4.1Å; L271-F289 HydrophobicContact CD2-CB 4.4Å
272	W	95.9	Very high	94.8	Very high	197 Å²	197	66.5 Å²	66.5	75%	0.746	38%	0.376	S	S	*	.	H	α-helix	trans	-64.2	-43.5	173.6	-176.8	-96.1	0	0	0	112.1	A268 D270 L275 G276	A268-W272 WeakPolarHBondContact O-CB 3.42Å; A268-W272 PolarHBondContact O-N 3.1Å; D270-W272 VanDerWaalsContact C-N 3.31Å; D270-W272 PolarHBondContact O-N 2.82Å; W272-L275 PolarHBondContact O-N 3.42Å; W272-G276 PolarHBondContact O-N 3.45Å; W272-G276 VanDerWaalsContact O-N 3.1Å
273	R	93.1	Very high	94.7	Very high	142 Å²	142	70.9 Å²	70.9	54%	0.536	40%	0.403	S	S	.	.	H	α-helix	trans	-62.3	-42.5	173.4	-79	-177.8	-91	99.1	-0.7	112	G269 D270 L275 G276 D277	G269-R273 PolarHBondContact O-N 2.89Å; G269-R273 VanDerWaalsContact O-N 3.1Å; G269-R273 PolarHBondContact O-NE 3.44Å; D270-R273 PolarHBondContact O-N 2.67Å; D270-R273 IonicContact OD1-CZ 2.62Å; D270-R273 IonicContact OD1-NH1 3.68Å; D270-R273 PolarHBondContact OD1-NH1 3.21Å; D270-R273 IonicContact OD1-NH2 3.67Å; R273-L275 VanDerWaalsContact C-N 3.34Å; R273-L275 PolarHBondContact O-N 2.96Å; R273-G276 PolarHBondContact O-N 3.41Å; R273-D277 PolarHBondContact O-N 3.3Å
274	I	93.3	Very high	94.4	Very high	22 Å²	22	73.1 Å²	73.1	11%	0.113	42%	0.415	C	S	.	.	H	α-helix	trans	-65.1	-35	176.3	-71.9	165.9	0	0	0	112.2	D270 L271 G276 D277 L280 V285	D270-I274 WeakPolarHBondContact O-CG1 3.21Å; D270-I274 PolarHBondContact O-N 3.43Å; L271-I274 PolarHBondContact O-N 3.43Å; I274-G276 VanDerWaalsContact C-N 3.34Å; I274-D277 PolarHBondContact O-N 3.12Å; I274-L280 HydrophobicContact CG2-CD1 4Å; I274-V285 HydrophobicContact CG2-CG2 4.16Å
275	L	94	Very high	94.3	Very high	99 Å²	99	72.6 Å²	72.6	52%	0.518	40%	0.404	S	S	.	.	H	α-helix	trans	-71.5	-28.1	175.7	-176.5	63.8	0	0	0	112.8	L271 W272 R273 D277 V285	L271-L275 WeakPolarHBondContact O-CB 3.35Å; L271-L275 PolarHBondContact O-N 3.02Å; W272-L275 PolarHBondContact O-N 3.42Å; R273-L275 VanDerWaalsContact C-N 3.34Å; R273-L275 PolarHBondContact O-N 2.96Å; L275-D277 VanDerWaalsContact C-N 3.34Å; L275-V285 HydrophobicContact CD1-CG1 4.31Å
276	G	94.5	Very high	94.2	Very high	56 Å²	56	71.8 Å²	71.8	58%	0.577	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.6	-10.9	174.6	0	0	0	0	0	114.7	W272 R273 I274 L278	W272-G276 PolarHBondContact O-N 3.45Å; W272-G276 VanDerWaalsContact O-N 3.1Å; R273-G276 PolarHBondContact O-N 3.41Å; I274-G276 VanDerWaalsContact C-N 3.34Å; G276-L278 PolarHBondContact O-N 2.96Å
277	D	92.6	Very high	94.2	Very high	72 Å²	72	75.7 Å²	75.7	39%	0.385	42%	0.424	S	S	.	.			trans	-82.7	97.9	179.2	-171.3	-15.4	0	0	0	111.1	R273 I274 L275 S279 L280	R273-D277 PolarHBondContact O-N 3.3Å; I274-D277 PolarHBondContact O-N 3.12Å; L275-D277 VanDerWaalsContact C-N 3.34Å; D277-S279 VanDerWaalsContact CG-OG 3.3Å; D277-S279 PolarHBondContact O-N 2.98Å; D277-S279 VanDerWaalsContact O-N 3.07Å; D277-S279 VanDerWaalsContact OD1-CB 3.27Å; D277-S279 WeakPolarHBondContact OD1-CB 3.13Å; D277-S279 PolarHBondContact OD1-N 3.4Å; D277-S279 PolarHBondContact OD1-OG 2.95Å; D277-S279 PolarHBondContact OD2-OG 3.37Å; D277-L280 HydrophobicContact CB-CD1 4.04Å; D277-L280 HydrophobicContact CB-CG 4.17Å; D277-L280 PolarHBondContact O-N 3.26Å; D277-L280 VanDerWaalsContact O-N 3.13Å
278	L	93	Very high	94.1	Very high	173 Å²	173	75.6 Å²	75.6	91%	0.906	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-4.7	179.9	-57	-179.7	0	0	0	114.2	G276	G276-L278 PolarHBondContact O-N 2.96Å
279	S	92.6	Very high	94.1	Very high	98 Å²	98	78.6 Å²	78.6	69%	0.685	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-17.1	172.6	75.8	0	0	0	0	113.5	D277	D277-S279 VanDerWaalsContact CG-OG 3.3Å; D277-S279 PolarHBondContact O-N 2.98Å; D277-S279 VanDerWaalsContact O-N 3.07Å; D277-S279 VanDerWaalsContact OD1-CB 3.27Å; D277-S279 WeakPolarHBondContact OD1-CB 3.13Å; D277-S279 PolarHBondContact OD1-N 3.4Å; D277-S279 PolarHBondContact OD1-OG 2.95Å; D277-S279 PolarHBondContact OD2-OG 3.37Å
280	L	91.5	Very high	94.2	Very high	68 Å²	68	82.2 Å²	82.2	36%	0.356	44%	0.437	S	S	.	.	S	Bend	trans	-94.8	144.3	-175.7	-60.1	-180	0	0	0	112.2	I274 D277	I274-L280 HydrophobicContact CG2-CD1 4Å; D277-L280 HydrophobicContact CB-CD1 4.04Å; D277-L280 HydrophobicContact CB-CG 4.17Å; D277-L280 PolarHBondContact O-N 3.26Å; D277-L280 VanDerWaalsContact O-N 3.13Å
281	S	94.1	Very high	94.3	Very high	50 Å²	50	82 Å²	82	35%	0.35	44%	0.436	S	S	.	.			trans	-78.5	150.6	174.2	88.7	0	0	0	0	111.4	V283 D284 V285	S281-V283 PolarHBondContact O-N 2.96Å; S281-V283 VanDerWaalsContact O-N 3.08Å; S281-V283 PolarHBondContact OG-N 3.45Å; S281-D284 WeakPolarHBondContact CB-OD2 3.48Å; S281-D284 WeakPolarHBondContact O-CA 3.49Å; S281-D284 PolarHBondContact O-N 3.26Å; S281-D284 PolarHBondContact OG-N 3.39Å; S281-D284 PolarHBondContact OG-OD2 2.92Å; S281-V285 PolarHBondContact O-N 3.47Å
282	L	93.5	Very high	94.4	Very high	142 Å²	142	80.9 Å²	80.9	74%	0.743	43%	0.429	S	S	*	.	H	α-helix	trans	-56.4	-26.1	172.6	-65.8	176.7	0	0	0	112.8	A286	L282-A286 WeakPolarHBondContact O-CB 3.3Å; L282-A286 PolarHBondContact O-N 3.34Å
283	V	94.3	Very high	94.5	Very high	94 Å²	94	73.1 Å²	73.1	57%	0.57	40%	0.404	S	S	*	.	H	α-helix	trans	-70.6	-36	175	-174.6	0	0	0	0	110.8	S281 A286 K287	S281-V283 PolarHBondContact O-N 2.96Å; S281-V283 VanDerWaalsContact O-N 3.08Å; S281-V283 PolarHBondContact OG-N 3.45Å; V283-A286 PolarHBondContact O-N 3.39Å; V283-K287 WeakPolarHBondContact O-CG 3.39Å; V283-K287 PolarHBondContact O-N 3.5Å
284	D	92.4	Very high	94.7	Very high	49 Å²	49	69.4 Å²	69.4	26%	0.262	40%	0.397	S	S	.	.	H	α-helix	trans	-75	-36.9	176.8	-59.7	-58.6	0	0	0	112	S281 A286 K287 H288	S281-D284 WeakPolarHBondContact CB-OD2 3.48Å; S281-D284 WeakPolarHBondContact O-CA 3.49Å; S281-D284 PolarHBondContact O-N 3.26Å; S281-D284 PolarHBondContact OG-N 3.39Å; S281-D284 PolarHBondContact OG-OD2 2.92Å; D284-A286 VanDerWaalsContact C-N 3.31Å; D284-A286 PolarHBondContact O-N 3.3Å; D284-K287 PolarHBondContact O-N 3.23Å; D284-K287 IonicContact OD1-NZ 2.66Å; D284-K287 PolarHBondContact OD1-NZ 3.43Å; D284-H288 WeakPolarHBondContact O-CB 3.08Å; D284-H288 PolarHBondContact O-N 2.88Å
285	V	94.4	Very high	94.9	Very high	25 Å²	25	68.4 Å²	68.4	15%	0.152	39%	0.392	C	S	.	.	H	α-helix	trans	-57.9	-44.4	167	-177.1	0	0	0	0	110.4	I274 L275 S281 H288 F289	I274-V285 HydrophobicContact CG2-CG2 4.16Å; L275-V285 HydrophobicContact CD1-CG1 4.31Å; S281-V285 PolarHBondContact O-N 3.47Å; V285-H288 WeakPolarHBondContact O-CB 3.17Å; V285-H288 PolarHBondContact O-N 3.23Å; V285-F289 PolarHBondContact O-N 2.86Å
286	A	95.7	Very high	95.1	Very high	54 Å²	54	64.9 Å²	64.9	45%	0.446	37%	0.374	S	S	.	.	H	α-helix	trans	-65.5	-42.4	177.4	0	0	0	0	0	113.2	L282 V283 D284 H288 F289 L290	L282-A286 WeakPolarHBondContact O-CB 3.3Å; L282-A286 PolarHBondContact O-N 3.34Å; V283-A286 PolarHBondContact O-N 3.39Å; D284-A286 VanDerWaalsContact C-N 3.31Å; D284-A286 PolarHBondContact O-N 3.3Å; A286-H288 VanDerWaalsContact C-N 3.27Å; A286-H288 PolarHBondContact O-N 3.18Å; A286-F289 PolarHBondContact O-N 3.43Å; A286-L290 WeakPolarHBondContact O-CB 3.34Å; A286-L290 PolarHBondContact O-N 2.88Å
287	K	95.7	Very high	95.2	Very high	100 Å²	100	67 Å²	67	44%	0.435	37%	0.371	S	S	.	.	H	α-helix	trans	-56.9	-43.8	170.4	-69.5	168.3	-165.8	160.3	0	110.6	F231 V283 D284 L290 A291	F231-K287 HydrophobicContact CE1-CB 3.94Å; F231-K287 HydrophobicContact CE2-CB 4.29Å; F231-K287 HydrophobicContact CZ-CB 3.49Å; F231-K287 VanDerWaalsContact CZ-CB 3.49Å; V283-K287 WeakPolarHBondContact O-CG 3.39Å; V283-K287 PolarHBondContact O-N 3.5Å; D284-K287 PolarHBondContact O-N 3.23Å; D284-K287 IonicContact OD1-NZ 2.66Å; D284-K287 PolarHBondContact OD1-NZ 3.43Å; K287-L290 PolarHBondContact O-N 3.39Å; K287-A291 VanDerWaalsContact O-CB 3.29Å; K287-A291 WeakPolarHBondContact O-CB 3.44Å; K287-A291 PolarHBondContact O-N 2.83Å
288	H	95.6	Very high	95.5	Very high	14 Å²	14	68.2 Å²	68.2	7%	0.065	38%	0.377	C	S	.	.	H	α-helix	trans	-67	-37.5	-178.9	-94.8	-39.2	0	0	0	113.5	P230 F231 W235 D284 V285 A286 R292	P230-H288 WeakPolarHBondContact CB-CE1 3.4Å; F231-H288 AromaticContact CE1-ND1 3.91Å; F231-H288 AromaticContact CE2-CE1 3.54Å; F231-H288 AromaticContact CE2-ND1 3.81Å; F231-H288 AromaticContact CE2-NE2 3.8Å; F231-H288 HydrophobicContact CZ-CB 4.38Å; F231-H288 AromaticContact CZ-CE1 3.54Å; F231-H288 AromaticContact CZ-CG 3.69Å; F231-H288 AromaticContact CZ-ND1 3.29Å; F231-H288 VanDerWaalsContact CZ-ND1 3.29Å; F231-H288 WeakPolarHBondContact CZ-ND1 3.3Å; W235-H288 AromaticContact CZ2-CE1 3.88Å; W235-H288 AromaticContact CZ2-ND1 3.65Å; D284-H288 WeakPolarHBondContact O-CB 3.08Å; D284-H288 PolarHBondContact O-N 2.88Å; V285-H288 WeakPolarHBondContact O-CB 3.17Å; V285-H288 PolarHBondContact O-N 3.23Å; A286-H288 VanDerWaalsContact C-N 3.27Å; A286-H288 PolarHBondContact O-N 3.18Å; H288-R292 VanDerWaalsContact CG-NH1 3.29Å; H288-R292 PolarHBondContact ND1-NH1 3.25Å; H288-R292 WeakPolarHBondContact O-CD 3.44Å; H288-R292 WeakPolarHBondContact O-CG 3.49Å; H288-R292 PolarHBondContact O-N 3.22Å; H288-R292 PolarHBondContact O-NH1 2.91Å
289	F	96.6	Very high	95.7	Very high	120 Å²	120	62 Å²	62	53%	0.526	34%	0.344	S	S	.	.	H	α-helix	trans	-65.8	-54.1	171.4	177.6	-99.8	0	0	0	111.1	L271 V285 A286 A291 R292 V293	L271-F289 HydrophobicContact CD1-CD2 4.1Å; L271-F289 HydrophobicContact CD2-CB 4.4Å; V285-F289 PolarHBondContact O-N 2.86Å; A286-F289 PolarHBondContact O-N 3.43Å; F289-A291 PolarHBondContact O-N 3.5Å; F289-R292 PolarHBondContact O-N 3.21Å; F289-R292 VanDerWaalsContact O-N 3.11Å; F289-V293 HydrophobicContact CD1-CG2 4.19Å; F289-V293 HydrophobicContact CE1-CG2 3.8Å; F289-V293 HydrophobicContact CE2-CG2 4.23Å; F289-V293 HydrophobicContact CZ-CG2 3.81Å; F289-V293 WeakPolarHBondContact O-CG2 3.36Å; F289-V293 PolarHBondContact O-N 3.3Å
290	L	96.9	Very high	95.9	Very high	107 Å²	107	58 Å²	58	56%	0.56	32%	0.316	S	S	*	.	H	α-helix	trans	-60.5	-42.8	-176.4	-178.6	60.6	0	0	0	112.4	A286 K287 R292 V293 V294	A286-L290 WeakPolarHBondContact O-CB 3.34Å; A286-L290 PolarHBondContact O-N 2.88Å; K287-L290 PolarHBondContact O-N 3.39Å; L290-R292 VanDerWaalsContact C-N 3.33Å; L290-R292 PolarHBondContact O-N 2.92Å; L290-V293 PolarHBondContact O-N 3.2Å; L290-V294 HydrophobicContact CD1-CG2 4.47Å; L290-V294 WeakPolarHBondContact O-CG2 3.43Å; L290-V294 PolarHBondContact O-N 3.35Å
291	A	96.5	Very high	96.2	Very high	6 Å²	6	59.5 Å²	59.5	5%	0.05	32%	0.324	C	S	.	.	H	α-helix	trans	-61.4	-39.9	176.4	0	0	0	0	0	112.4	F231 W235 W236 L239 K287 F289 V294 G295	F231-A291 HydrophobicContact CE1-CB 4.08Å; W235-A291 HydrophobicContact CH2-CB 3.68Å; W235-A291 HydrophobicContact CZ3-CB 3.96Å; W236-A291 HydrophobicContact CH2-CB 3.56Å; W236-A291 HydrophobicContact CZ2-CB 3.94Å; W236-A291 HydrophobicContact CZ3-CB 4.31Å; L239-A291 HydrophobicContact CD2-CB 4.49Å; K287-A291 VanDerWaalsContact O-CB 3.29Å; K287-A291 WeakPolarHBondContact O-CB 3.44Å; K287-A291 PolarHBondContact O-N 2.83Å; F289-A291 PolarHBondContact O-N 3.5Å; A291-V294 PolarHBondContact O-N 3.47Å; A291-G295 PolarHBondContact O-N 2.81Å
292	R	96.8	Very high	96.3	Very high	10 Å²	10	63.3 Å²	63.3	4%	0.038	33%	0.334	C	S	.	.	H	α-helix	trans	-67.6	-38.6	174.7	-73.6	165.3	176.5	87.2	-6.4	111.8	F223 T267 D270 H288 F289 L290 G295 L296	F223-R292 HydrophobicContact CZ-CG 4.48Å; T267-R292 HydrophobicContact CG2-CB 4.15Å; T267-R292 HydrophobicContact CG2-CG 4.04Å; D270-R292 IonicContact OD2-CZ 2.75Å; D270-R292 IonicContact OD2-NE 2.67Å; D270-R292 IonicContact OD2-NH2 3.53Å; D270-R292 PolarHBondContact OD2-NH2 3.41Å; H288-R292 VanDerWaalsContact CG-NH1 3.29Å; H288-R292 PolarHBondContact ND1-NH1 3.25Å; H288-R292 WeakPolarHBondContact O-CD 3.44Å; H288-R292 WeakPolarHBondContact O-CG 3.49Å; H288-R292 PolarHBondContact O-N 3.22Å; H288-R292 PolarHBondContact O-NH1 2.91Å; F289-R292 PolarHBondContact O-N 3.21Å; F289-R292 VanDerWaalsContact O-N 3.11Å; L290-R292 VanDerWaalsContact C-N 3.33Å; L290-R292 PolarHBondContact O-N 2.92Å; R292-G295 PolarHBondContact O-N 3.49Å; R292-L296 HydrophobicContact CB-CD1 4.46Å; R292-L296 WeakPolarHBondContact O-CA 3.47Å; R292-L296 VanDerWaalsContact O-CB 3.28Å; R292-L296 WeakPolarHBondContact O-CB 3.48Å; R292-L296 PolarHBondContact O-N 3.28Å
293	V	97.6	Very high	96.6	Very high	35 Å²	35	58.9 Å²	58.9	21%	0.212	31%	0.311	C	S	.	.	H	α-helix	trans	-61.3	-44.8	172.7	172	0	0	0	0	111.4	F289 L290 I297 L298	F289-V293 HydrophobicContact CD1-CG2 4.19Å; F289-V293 HydrophobicContact CE1-CG2 3.8Å; F289-V293 HydrophobicContact CE2-CG2 4.23Å; F289-V293 HydrophobicContact CZ-CG2 3.81Å; F289-V293 WeakPolarHBondContact O-CG2 3.36Å; F289-V293 PolarHBondContact O-N 3.3Å; L290-V293 PolarHBondContact O-N 3.2Å; V293-I297 HydrophobicContact CG1-CD1 4.48Å; V293-I297 HydrophobicContact CG2-CD1 4.35Å; V293-I297 WeakPolarHBondContact O-CA 3.49Å; V293-I297 WeakPolarHBondContact O-CB 3.3Å; V293-I297 PolarHBondContact O-N 3.46Å; V293-I297 VanDerWaalsContact O-N 3.1Å; V293-L298 HydrophobicContact CG1-CD1 4.41Å; V293-L298 HydrophobicContact CG1-CG 4.32Å; V293-L298 PolarHBondContact O-N 2.99Å
294	V	97.6	Very high	96.7	Very high	63 Å²	63	55.6 Å²	55.6	38%	0.382	29%	0.289	S	S	.	.	I	π-helix	trans	-63.1	-51.6	176.6	172.6	0	0	0	0	111	L290 A291 L298 L299	L290-V294 HydrophobicContact CD1-CG2 4.47Å; L290-V294 WeakPolarHBondContact O-CG2 3.43Å; L290-V294 PolarHBondContact O-N 3.35Å; A291-V294 PolarHBondContact O-N 3.47Å; V294-L298 HydrophobicContact CG2-CD1 4.3Å; V294-L299 WeakPolarHBondContact O-CB 3.35Å; V294-L299 PolarHBondContact O-N 3.45Å
295	G	96.8	Very high	96.9	Very high	2 Å²	2	55.2 Å²	55.2	2%	0.021	29%	0.288	C	S	.	.	I	π-helix	trans	-75.2	-32.6	-173.7	0	0	0	0	0	115.7	G243 A291 R292 P300	G243-G295 VanDerWaalsContact CA-O 3.28Å; G243-G295 WeakPolarHBondContact CA-O 3.41Å; A291-G295 PolarHBondContact O-N 2.81Å; R292-G295 PolarHBondContact O-N 3.49Å; G295-P300 WeakPolarHBondContact O-CD 3.47Å
296	L	97.6	Very high	97	Very high	25 Å²	25	58 Å²	58	13%	0.131	30%	0.301	C	S	.	.	I	π-helix	trans	-114.8	-3.2	-171.3	-55.9	173.5	0	0	0	114.3	L239 C242 L246 V263 T267 R292	L239-L296 HydrophobicContact CD1-CD1 3.98Å; L239-L296 HydrophobicContact CD1-CD2 3.92Å; L239-L296 HydrophobicContact CD1-CG 3.69Å; C242-L296 HydrophobicContact CB-CD2 4.03Å; L246-L296 HydrophobicContact CD1-CD2 4.26Å; V263-L296 HydrophobicContact CG1-CD1 4.25Å; V263-L296 HydrophobicContact CG1-CD2 4.3Å; T267-L296 HydrophobicContact CG2-CD1 3.91Å; R292-L296 HydrophobicContact CB-CD1 4.46Å; R292-L296 WeakPolarHBondContact O-CA 3.47Å; R292-L296 VanDerWaalsContact O-CB 3.28Å; R292-L296 WeakPolarHBondContact O-CB 3.48Å; R292-L296 PolarHBondContact O-N 3.28Å
297	I	97.5	Very high	97	Very high	101 Å²	101	56.6 Å²	56.6	52%	0.518	29%	0.287	S	S	.	.	I	π-helix	trans	-126.4	-58	174.7	-50.2	179.4	0	0	0	111.1	V293 P300 L301	V293-I297 HydrophobicContact CG1-CD1 4.48Å; V293-I297 HydrophobicContact CG2-CD1 4.35Å; V293-I297 WeakPolarHBondContact O-CA 3.49Å; V293-I297 WeakPolarHBondContact O-CB 3.3Å; V293-I297 PolarHBondContact O-N 3.46Å; V293-I297 VanDerWaalsContact O-N 3.1Å; I297-P300 WeakPolarHBondContact O-CD 3.38Å; I297-L301 VanDerWaalsContact O-CB 3.24Å; I297-L301 WeakPolarHBondContact O-CB 3.45Å; I297-L301 PolarHBondContact O-N 3.49Å; I297-L301 VanDerWaalsContact O-N 3.12Å
298	L	98	Very high	97	Very high	97 Å²	97	51.8 Å²	51.8	51%	0.508	27%	0.266	S	S	.	.	I	π-helix	trans	-71.5	-46.6	-174.3	-59.8	-179.8	0	0	0	112.6	V293 V294 L301 F302	V293-L298 HydrophobicContact CG1-CD1 4.41Å; V293-L298 HydrophobicContact CG1-CG 4.32Å; V293-L298 PolarHBondContact O-N 2.99Å; V294-L298 HydrophobicContact CG2-CD1 4.3Å; L298-L301 PolarHBondContact O-N 2.93Å; L298-F302 WeakPolarHBondContact O-CB 3.28Å; L298-F302 PolarHBondContact O-N 2.92Å
299	L	97.7	Very high	97	Very high	43 Å²	43	52.9 Å²	52.9	23%	0.225	28%	0.278	C	S	.	.	H	α-helix	trans	-61	-48.3	176.3	170.1	68.5	0	0	0	112.2	V240 V294 L301 F302 L303	V240-L299 HydrophobicContact CB-CD2 4.25Å; V240-L299 HydrophobicContact CG1-CD2 3.93Å; V240-L299 HydrophobicContact CG2-CD2 4.29Å; V294-L299 WeakPolarHBondContact O-CB 3.35Å; V294-L299 PolarHBondContact O-N 3.45Å; L299-L301 PolarHBondContact O-N 3.05Å; L299-F302 PolarHBondContact O-N 3.14Å; L299-L303 HydrophobicContact CD1-CD1 3.79Å; L299-L303 HydrophobicContact CD1-CG 4Å; L299-L303 HydrophobicContact CG-CD1 4.08Å; L299-L303 WeakPolarHBondContact O-CG 3.35Å; L299-L303 PolarHBondContact O-N 3.43Å
300	P	97.5	Very high	97	Very high	13 Å²	13	50.1 Å²	50.1	8%	0.084	27%	0.27	C	S	.	.	H	α-helix	trans	-61.4	-41.7	176.7	-24.8	32.8	0	0	0	113.6	G243 A247 G295 I297 L303 Y304	G243-P300 WeakPolarHBondContact O-CG 3.29Å; A247-P300 HydrophobicContact CB-CB 4.24Å; G295-P300 WeakPolarHBondContact O-CD 3.47Å; I297-P300 WeakPolarHBondContact O-CD 3.38Å; P300-L303 PolarHBondContact O-N 3.05Å; P300-Y304 VanDerWaalsContact O-CB 3.25Å; P300-Y304 WeakPolarHBondContact O-CB 3.3Å; P300-Y304 PolarHBondContact O-N 3.26Å
301	L	97	Very high	96.9	Very high	99 Å²	99	45.4 Å²	45.4	52%	0.518	25%	0.246	S	C	.	.	H	α-helix	trans	-62.8	-44.7	177.4	180	61.3	0	0	0	111.4	I297 L298 L299 Y304 V305	I297-L301 VanDerWaalsContact O-CB 3.24Å; I297-L301 WeakPolarHBondContact O-CB 3.45Å; I297-L301 PolarHBondContact O-N 3.49Å; I297-L301 VanDerWaalsContact O-N 3.12Å; L298-L301 PolarHBondContact O-N 2.93Å; L299-L301 PolarHBondContact O-N 3.05Å; L301-Y304 PolarHBondContact O-N 3.26Å; L301-V305 HydrophobicContact CD1-CG2 4.25Å; L301-V305 WeakPolarHBondContact O-CB 3.33Å; L301-V305 VanDerWaalsContact O-CG2 3.26Å; L301-V305 WeakPolarHBondContact O-CG2 3.22Å; L301-V305 PolarHBondContact O-N 3.5Å
302	F	97.6	Very high	96.7	Very high	130 Å²	130	45.2 Å²	45.2	57%	0.57	24%	0.244	S	C	*	.	H	α-helix	trans	-59.7	-48.8	176.2	172.6	-100.8	0	0	0	112.1	L298 L299 Y304 V305 L306	L298-F302 WeakPolarHBondContact O-CB 3.28Å; L298-F302 PolarHBondContact O-N 2.92Å; L299-F302 PolarHBondContact O-N 3.14Å; F302-Y304 VanDerWaalsContact C-N 3.34Å; F302-Y304 PolarHBondContact O-N 3.34Å; F302-V305 PolarHBondContact O-N 3.07Å; F302-L306 HydrophobicContact CE1-CD2 4.4Å; F302-L306 WeakPolarHBondContact O-CB 3.48Å; F302-L306 PolarHBondContact O-N 2.89Å
303	L	97.9	Very high	96.4	Very high	49 Å²	49	47.2 Å²	47.2	26%	0.257	26%	0.262	S	S	.	.	H	α-helix	trans	-63.9	-38.6	178.9	-69.6	174.3	0	0	0	112.2	A244 A247 L299 P300 L306 V307	A244-L303 HydrophobicContact CB-CD1 4Å; A247-L303 HydrophobicContact CB-CB 3.7Å; A247-L303 HydrophobicContact CB-CD1 4.15Å; L299-L303 HydrophobicContact CD1-CD1 3.79Å; L299-L303 HydrophobicContact CD1-CG 4Å; L299-L303 HydrophobicContact CG-CD1 4.08Å; L299-L303 WeakPolarHBondContact O-CG 3.35Å; L299-L303 PolarHBondContact O-N 3.43Å; P300-L303 PolarHBondContact O-N 3.05Å; L303-L306 PolarHBondContact O-N 2.87Å; L303-V307 WeakPolarHBondContact O-CG2 3.43Å; L303-V307 PolarHBondContact O-N 3.1Å
304	Y	97.1	Very high	96.1	Very high	26 Å²	26	48.4 Å²	48.4	10%	0.102	27%	0.267	C	S	.	.	H	α-helix	trans	-65.6	-43.3	175.7	-177.8	-100.9	0	0	0	112.2	P117 V250 P300 L301 F302 V307 F308 H555	P117-Y304 HydrophobicContact CB-CE2 4.2Å; P117-Y304 HydrophobicContact CG-CE2 4.36Å; V250-Y304 HydrophobicContact CG1-CD2 3.72Å; V250-Y304 HydrophobicContact CG1-CE2 4.02Å; V250-Y304 HydrophobicContact CG1-CG 4.48Å; V250-Y304 HydrophobicContact CG2-CE2 4.25Å; P300-Y304 VanDerWaalsContact O-CB 3.25Å; P300-Y304 WeakPolarHBondContact O-CB 3.3Å; P300-Y304 PolarHBondContact O-N 3.26Å; L301-Y304 PolarHBondContact O-N 3.26Å; F302-Y304 VanDerWaalsContact C-N 3.34Å; F302-Y304 PolarHBondContact O-N 3.34Å; Y304-V307 WeakPolarHBondContact O-CB 3.32Å; Y304-V307 PolarHBondContact O-N 3.46Å; Y304-F308 HydrophobicContact CE1-CD2 4.16Å; Y304-F308 AromaticContact CE1-CE2 3.86Å; Y304-F308 HydrophobicContact CE1-CE2 3.86Å; Y304-F308 HydrophobicContact CE2-CD2 4.47Å; Y304-F308 AromaticContact CE2-CE2 3.82Å; Y304-F308 HydrophobicContact CE2-CE2 3.82Å; Y304-F308 AromaticContact CZ-CE2 3.45Å; Y304-F308 VanDerWaalsContact CZ-CE2 3.45Å; Y304-F308 PolarHBondContact O-N 3.29Å; Y304-F308 WeakPolarHBondContact OH-CE2 3.42Å; Y304-H555 AromaticContact CE1-CE1 3.88Å; Y304-H555 AromaticContact CE1-NE2 3.32Å; Y304-H555 VanDerWaalsContact CE1-NE2 3.32Å; Y304-H555 WeakPolarHBondContact CE1-NE2 3.48Å; Y304-H555 AromaticContact CZ-NE2 3.46Å; Y304-H555 PolarHBondContact OH-NE2 3.29Å
305	V	96.8	Very high	95.7	Very high	40 Å²	40	45.5 Å²	45.5	24%	0.242	25%	0.249	C	C	.	.	H	α-helix	trans	-64.2	-40	174.4	172.6	0	0	0	0	111.3	L301 F302 V307 F308 A309 F547 L551	L301-V305 HydrophobicContact CD1-CG2 4.25Å; L301-V305 WeakPolarHBondContact O-CB 3.33Å; L301-V305 VanDerWaalsContact O-CG2 3.26Å; L301-V305 WeakPolarHBondContact O-CG2 3.22Å; L301-V305 PolarHBondContact O-N 3.5Å; F302-V305 PolarHBondContact O-N 3.07Å; V305-V307 PolarHBondContact O-N 3.43Å; V305-F308 PolarHBondContact O-N 3.34Å; V305-A309 PolarHBondContact O-N 3.06Å; V305-F547 HydrophobicContact CG1-CE1 3.68Å; V305-F547 HydrophobicContact CG1-CZ 4.02Å; V305-L551 HydrophobicContact CG1-CD2 4.39Å; V305-L551 HydrophobicContact CG2-CD2 4.08Å
306	L	96.4	Very high	95	Very high	83 Å²	83	47.5 Å²	47.5	44%	0.435	26%	0.26	S	S	.	.	H	α-helix	trans	-61.9	-40.9	174.8	178.9	62.1	0	0	0	112	F302 L303 F308 A309 V310	F302-L306 HydrophobicContact CE1-CD2 4.4Å; F302-L306 WeakPolarHBondContact O-CB 3.48Å; F302-L306 PolarHBondContact O-N 2.89Å; L303-L306 PolarHBondContact O-N 2.87Å; L306-F308 VanDerWaalsContact C-N 3.33Å; L306-F308 PolarHBondContact O-N 3.3Å; L306-A309 WeakPolarHBondContact O-CB 3.33Å; L306-A309 PolarHBondContact O-N 3.45Å; L306-A309 VanDerWaalsContact O-N 3.14Å; L306-V310 WeakPolarHBondContact O-CG2 3.31Å; L306-V310 PolarHBondContact O-N 3.38Å
307	V	96.8	Very high	94	Very high	25 Å²	25	52.2 Å²	52.2	15%	0.152	28%	0.279	C	S	.	.	H	α-helix	trans	-58.2	-42.6	173.9	156.1	0	0	0	0	111.8	P118 L119 M122 L303 Y304 V305 H311	P118-V307 HydrophobicContact CG-CG1 3.78Å; L119-V307 HydrophobicContact CB-CG1 4Å; L119-V307 HydrophobicContact CD1-CG2 3.99Å; M122-V307 HydrophobicContact CE-CG1 3.89Å; L303-V307 WeakPolarHBondContact O-CG2 3.43Å; L303-V307 PolarHBondContact O-N 3.1Å; Y304-V307 WeakPolarHBondContact O-CB 3.32Å; Y304-V307 PolarHBondContact O-N 3.46Å; V305-V307 PolarHBondContact O-N 3.43Å; V307-H311 WeakPolarHBondContact O-CB 3.46Å; V307-H311 PolarHBondContact O-N 2.9Å
308	F	95.6	Very high	92.9	Very high	0 Å²	0	49 Å²	49	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-70.7	-35	173.6	-86	-96.4	0	0	0	113.1	P117 P118 Y304 V305 L306 V310 H311 F312 L551 H555 M558	P117-F308 HydrophobicContact CB-CE2 4.13Å; P117-F308 HydrophobicContact CB-CZ 4.18Å; P118-F308 HydrophobicContact CG-CD2 4.35Å; P118-F308 HydrophobicContact CG-CE1 4.47Å; P118-F308 HydrophobicContact CG-CE2 4.29Å; P118-F308 HydrophobicContact CG-CG 4.47Å; P118-F308 HydrophobicContact CG-CZ 4.37Å; Y304-F308 HydrophobicContact CE1-CD2 4.16Å; Y304-F308 AromaticContact CE1-CE2 3.86Å; Y304-F308 HydrophobicContact CE1-CE2 3.86Å; Y304-F308 HydrophobicContact CE2-CD2 4.47Å; Y304-F308 AromaticContact CE2-CE2 3.82Å; Y304-F308 HydrophobicContact CE2-CE2 3.82Å; Y304-F308 AromaticContact CZ-CE2 3.45Å; Y304-F308 VanDerWaalsContact CZ-CE2 3.45Å; Y304-F308 PolarHBondContact O-N 3.29Å; Y304-F308 WeakPolarHBondContact OH-CE2 3.42Å; V305-F308 PolarHBondContact O-N 3.34Å; L306-F308 VanDerWaalsContact C-N 3.33Å; L306-F308 PolarHBondContact O-N 3.3Å; F308-V310 PolarHBondContact O-N 2.91Å; F308-H311 PolarHBondContact O-N 2.99Å; F308-F312 HydrophobicContact CB-CE2 4.27Å; F308-F312 AromaticContact CD1-CE2 3.84Å; F308-F312 HydrophobicContact CD1-CE2 3.84Å; F308-F312 HydrophobicContact CD1-CZ 4.16Å; F308-F312 WeakPolarHBondContact O-CD2 3.4Å; F308-F312 PolarHBondContact O-N 2.66Å; F308-L551 HydrophobicContact CB-CD1 3.48Å; F308-L551 VanDerWaalsContact CB-CD1 3.48Å; F308-L551 HydrophobicContact CD1-CD1 3.82Å; F308-L551 HydrophobicContact CD2-CD1 4.22Å; F308-L551 HydrophobicContact CG-CD1 3.58Å; F308-H555 AromaticContact CE1-CE1 3.86Å; F308-H555 AromaticContact CE2-CE1 3.86Å; F308-H555 AromaticContact CZ-CE1 3.63Å; F308-H555 AromaticContact CZ-NE2 3.93Å; F308-M558 HydrophobicContact CE1-CE 3.8Å; F308-M558 HydrophobicContact CE1-SD 4.2Å; F308-M558 HydrophobicContact CZ-CE 3.89Å; F308-M558 HydrophobicContact CZ-SD 3.95Å
309	A	95.1	Very high	92	Very high	36 Å²	36	46 Å²	46	30%	0.298	25%	0.252	S	S	.	.	H	α-helix	trans	-61	-43.4	174.3	0	0	0	0	0	111.8	V305 L306 A313 F547	V305-A309 PolarHBondContact O-N 3.06Å; L306-A309 WeakPolarHBondContact O-CB 3.33Å; L306-A309 PolarHBondContact O-N 3.45Å; L306-A309 VanDerWaalsContact O-N 3.14Å; A309-A313 VanDerWaalsContact O-CB 3.3Å; A309-A313 WeakPolarHBondContact O-CB 3.34Å; A309-A313 PolarHBondContact O-N 2.69Å; A309-F547 HydrophobicContact CB-CE2 3.96Å; A309-F547 HydrophobicContact CB-CZ 3.81Å
310	V	95.6	Very high	91	Very high	62 Å²	62	44.6 Å²	44.6	38%	0.376	25%	0.249	S	C	.	.	H	α-helix	trans	-63.6	-46.8	174	173.6	0	0	0	0	111.1	M122 L306 F308 F312 A313 L314	M122-V310 HydrophobicContact SD-CG1 4.03Å; L306-V310 WeakPolarHBondContact O-CG2 3.31Å; L306-V310 PolarHBondContact O-N 3.38Å; F308-V310 PolarHBondContact O-N 2.91Å; V310-F312 PolarHBondContact O-N 2.95Å; V310-A313 PolarHBondContact O-N 3.08Å; V310-A313 VanDerWaalsContact O-N 3.08Å; V310-L314 HydrophobicContact CG1-CD1 3.84Å; V310-L314 HydrophobicContact CG1-CG 4.21Å; V310-L314 WeakPolarHBondContact O-CG 3.29Å; V310-L314 PolarHBondContact O-N 3.28Å
311	H	94.7	Very high	89.9	Confident	9 Å²	9	47.7 Å²	47.7	4%	0.042	27%	0.269	C	S	.	.	H	α-helix	trans	-52.6	-51.8	177.2	164.5	83.3	0	0	0	112.5	Y106 P118 M122 V307 F308 A313 L314 L315	Y106-H311 AromaticContact CE1-ND1 3.62Å; Y106-H311 AromaticContact CZ-ND1 3.64Å; Y106-H311 PolarHBondContact OH-ND1 3.42Å; P118-H311 HydrophobicContact CB-CB 3.91Å; P118-H311 HydrophobicContact CG-CB 3.76Å; M122-H311 HydrophobicContact CE-CB 4.43Å; M122-H311 HydrophobicContact SD-CB 3.98Å; V307-H311 WeakPolarHBondContact O-CB 3.46Å; V307-H311 PolarHBondContact O-N 2.9Å; F308-H311 PolarHBondContact O-N 2.99Å; H311-A313 VanDerWaalsContact C-N 3.32Å; H311-A313 PolarHBondContact O-N 3.39Å; H311-L314 PolarHBondContact O-N 3.14Å; H311-L315 VanDerWaalsContact CE1-CD1 3.44Å; H311-L315 WeakPolarHBondContact CE1-CD1 3.48Å; H311-L315 PolarHBondContact O-N 2.92Å
312	F	92.5	Very high	88.8	Confident	2 Å²	2	43.6 Å²	43.6	1%	0.009	25%	0.25	C	S	.	.	H	α-helix	trans	-74.4	-17.8	178.7	-61.5	-60.3	0	0	0	114.2	F111 F308 V310 F330 R333 F547 I550	F111-F312 HydrophobicContact CE2-CD1 4.33Å; F111-F312 HydrophobicContact CE2-CE1 4.15Å; F308-F312 HydrophobicContact CB-CE2 4.27Å; F308-F312 AromaticContact CD1-CE2 3.84Å; F308-F312 HydrophobicContact CD1-CE2 3.84Å; F308-F312 HydrophobicContact CD1-CZ 4.16Å; F308-F312 WeakPolarHBondContact O-CD2 3.4Å; F308-F312 PolarHBondContact O-N 2.66Å; V310-F312 PolarHBondContact O-N 2.95Å; F312-F330 AromaticContact CD1-CE2 3.96Å; F312-F330 HydrophobicContact CD1-CE2 3.96Å; F312-F330 HydrophobicContact CD1-CZ 4.1Å; F312-F330 AromaticContact CE1-CE2 3.94Å; F312-F330 HydrophobicContact CE1-CE2 3.94Å; F312-F330 HydrophobicContact CE1-CZ 4.06Å; F312-R333 VanDerWaalsContact C-NH2 3.34Å; F312-R333 PolarHBondContact O-NH2 3.4Å; F312-F547 HydrophobicContact CD2-CE2 4.13Å; F312-I550 HydrophobicContact CD1-CG2 4.13Å; F312-I550 HydrophobicContact CD2-CG2 3.91Å; F312-I550 HydrophobicContact CE1-CG2 3.92Å; F312-I550 HydrophobicContact CE2-CG2 3.68Å; F312-I550 HydrophobicContact CG-CG2 4.15Å; F312-I550 HydrophobicContact CZ-CG2 3.7Å
313	A	91.4	Very high	87.8	Confident	51 Å²	51	39 Å²	39	42%	0.421	23%	0.232	S	C	.	.	H	α-helix	trans	-78.8	-34.6	172.7	0	0	0	0	0	112	R109 A309 V310 H311	R109-A313 PolarHBondContact NH2-O 3.39Å; A309-A313 VanDerWaalsContact O-CB 3.3Å; A309-A313 WeakPolarHBondContact O-CB 3.34Å; A309-A313 PolarHBondContact O-N 2.69Å; V310-A313 PolarHBondContact O-N 3.08Å; V310-A313 VanDerWaalsContact O-N 3.08Å; H311-A313 VanDerWaalsContact C-N 3.32Å; H311-A313 PolarHBondContact O-N 3.39Å
314	L	91.4	Very high	86.6	Confident	61 Å²	61	38.2 Å²	38.2	32%	0.319	24%	0.235	S	C	.	.	H	α-helix	trans	-73.1	-54	174.4	-68.6	174.4	0	0	0	111.4	Y106 R109 M122 V310 H311 N316	Y106-L314 HydrophobicContact CD1-CB 4.44Å; Y106-L314 HydrophobicContact CD1-CD1 4.25Å; R109-L314 WeakPolarHBondContact CB-O 3.49Å; R109-L314 WeakPolarHBondContact CG-O 3.33Å; R109-L314 PolarHBondContact NE-O 2.89Å; R109-L314 PolarHBondContact NH2-O 2.96Å; M122-L314 HydrophobicContact SD-CD1 4.04Å; V310-L314 HydrophobicContact CG1-CD1 3.84Å; V310-L314 HydrophobicContact CG1-CG 4.21Å; V310-L314 WeakPolarHBondContact O-CG 3.29Å; V310-L314 PolarHBondContact O-N 3.28Å; H311-L314 PolarHBondContact O-N 3.14Å; L314-N316 VanDerWaalsContact C-N 3.32Å; L314-N316 PolarHBondContact O-N 3.5Å; L314-N316 PolarHBondContact O-OD1 3.43Å
315	L	88.9	Confident	85.5	Confident	1 Å²	1	40.9 Å²	40.9	1%	0.005	25%	0.247	C	C	.	.	S	Bend	trans	-82.4	70.7	-174.1	-58.4	-168.4	0	0	0	112.4	Y106 F111 F112 H311	Y106-L315 HydrophobicContact CD1-CD1 4.31Å; Y106-L315 HydrophobicContact CD1-CD2 3.48Å; Y106-L315 VanDerWaalsContact CD1-CD2 3.48Å; Y106-L315 HydrophobicContact CD1-CG 3.9Å; Y106-L315 HydrophobicContact CE1-CD1 3.82Å; Y106-L315 HydrophobicContact CE1-CD2 3.86Å; Y106-L315 HydrophobicContact CE1-CG 3.75Å; Y106-L315 HydrophobicContact CG-CD2 4.14Å; F111-L315 HydrophobicContact CB-CB 4.5Å; F111-L315 HydrophobicContact CD2-CB 3.98Å; F111-L315 HydrophobicContact CD2-CD1 4.23Å; F112-L315 HydrophobicContact CD1-CD1 3.69Å; F112-L315 HydrophobicContact CE1-CD1 3.61Å; H311-L315 VanDerWaalsContact CE1-CD1 3.44Å; H311-L315 WeakPolarHBondContact CE1-CD1 3.48Å; H311-L315 PolarHBondContact O-N 2.92Å
316	N	82.4	Confident	84.7	Confident	45 Å²	45	39.2 Å²	39.2	24%	0.241	24%	0.237	C	C	.	.			trans	-131.5	-6.9	-176.3	73.8	-27.6	0	0	0	115.6	R109 L314 I335	R109-N316 PolarHBondContact NE-OD1 3.24Å; R109-N316 PolarHBondContact NH2-OD1 2.75Å; R109-N316 PolarHBondContact O-N 3.36Å; L314-N316 VanDerWaalsContact C-N 3.32Å; L314-N316 PolarHBondContact O-N 3.5Å; L314-N316 PolarHBondContact O-OD1 3.43Å; N316-I335 WeakPolarHBondContact O-CB 3.34Å; N316-I335 VanDerWaalsContact O-CG1 3.3Å; N316-I335 WeakPolarHBondContact O-CG1 3.46Å; N316-I335 PolarHBondContact O-N 3.13Å; N316-I335 VanDerWaalsContact O-N 3.08Å
317	K	76.3	Confident	83.8	Confident	124 Å²	124	36.5 Å²	36.5	54%	0.539	23%	0.225	S	C	.	.	S	Bend	trans	-84.9	-26.7	-170.2	-81.3	-161.3	175.6	-175.9	0	114.9	R109 I335	R109-K317 HydrophobicContact CB-CB 3.86Å; R109-K317 HydrophobicContact CB-CD 4.06Å; R109-K317 HydrophobicContact CB-CG 3.9Å; R109-K317 PolarHBondContact O-N 2.89Å; R109-K317 VanDerWaalsContact O-N 3.15Å; K317-I335 CarbonylContact C-O 3.58Å; K317-I335 CarbonylContact O-C 3.55Å; K317-I335 WeakPolarHBondContact O-CB 3.43Å
318	S	75.1	Confident	82.9	Confident	33 Å²	33	35.5 Å²	35.5	23%	0.231	22%	0.219	C	C	.	.	B	Isolated β-bridge	trans	-153.3	139.3	-170.6	26.8	0	0	0	0	110.4	T110 F111 I335	T110-S318 VanDerWaalsContact CA-OG 3.32Å; T110-S318 WeakPolarHBondContact CA-OG 3.26Å; T110-S318 WeakPolarHBondContact CG2-OG 3.46Å; F111-S318 PolarHBondContact N-O 2.85Å; S318-I335 CarbonylContact C-O 3.5Å; S318-I335 WeakPolarHBondContact CA-O 3.24Å; S318-I335 PolarHBondContact N-O 2.95Å
319	S	77.5	Confident	82.1	Confident	33 Å²	33	37 Å²	37	23%	0.231	23%	0.228	C	C	.	.			trans	-61.2	147.1	160.3	-115.3	0	0	0	0	109.9	D323 I335 N337	S319-D323 WeakPolarHBondContact CB-OD2 3.39Å; S319-D323 PolarHBondContact OG-OD2 3.24Å; S319-I335 PolarHBondContact N-O 3.31Å; S319-N337 WeakPolarHBondContact OG-CB 3.47Å; S319-N337 PolarHBondContact OG-ND2 2.95Å
320	G	77.6	Confident	81.4	Confident	15 Å²	15	35.3 Å²	35.3	16%	0.155	21%	0.214	C	C	.	.			trans	-160.3	178.6	-178.7	0	0	0	0	0	111	F111 G322 D323	F111-G320 CarbonylContact O-C 3.52Å; F111-G320 WeakPolarHBondContact O-CA 3.45Å; F111-G320 PolarHBondContact O-N 3.27Å; G320-G322 PolarHBondContact O-N 3.41Å; G320-G322 VanDerWaalsContact O-N 3.09Å; G320-D323 PolarHBondContact O-N 2.82Å
321	P	73.4	Confident	80.7	Confident	77 Å²	77	32.6 Å²	32.6	50%	0.5	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	115	-163.5	23.5	-32.6	0	0	0	112.3	Y105 F112 F113	Y105-P321 HydrophobicContact CE1-CG 4.48Å; Y105-P321 HydrophobicContact CE2-CG 4Å; Y105-P321 WeakPolarHBondContact OH-CG 3.39Å; F112-P321 WeakPolarHBondContact CA-O 3.28Å; F113-P321 PolarHBondContact N-O 3.39Å
322	G	73.8	Confident	80	Confident	13 Å²	13	32.2 Å²	32.2	13%	0.134	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	111.9	-2.1	177.3	0	0	0	0	0	115.1	G320 G324 F325	G320-G322 PolarHBondContact O-N 3.41Å; G320-G322 VanDerWaalsContact O-N 3.09Å; G322-G324 PolarHBondContact O-N 3.45Å; G322-F325 WeakPolarHBondContact O-CD2 3.27Å; G322-F325 PolarHBondContact O-N 2.89Å; G322-F325 VanDerWaalsContact O-N 3.14Å
323	D	76.7	Confident	79.5	Confident	35 Å²	35	35.6 Å²	35.6	19%	0.187	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-50.8	-36.9	163.5	63.2	-12.1	0	0	0	112.6	F111 S319 G320 F325 F326 Q331 L334 N337	F111-D323 HydrophobicContact CD1-CB 4.12Å; S319-D323 WeakPolarHBondContact CB-OD2 3.39Å; S319-D323 PolarHBondContact OG-OD2 3.24Å; G320-D323 PolarHBondContact O-N 2.82Å; D323-F325 PolarHBondContact O-N 2.97Å; D323-F325 VanDerWaalsContact O-N 3.14Å; D323-F326 PolarHBondContact O-N 3.46Å; D323-Q331 VanDerWaalsContact C-NE2 3.3Å; D323-Q331 HydrophobicContact CB-CG 4.41Å; D323-Q331 PolarHBondContact O-NE2 3.39Å; D323-L334 HydrophobicContact CB-CD1 4.03Å; D323-N337 PolarHBondContact OD2-ND2 3.41Å
324	G	73.3	Confident	79.1	Confident	31 Å²	31	33.2 Å²	33.2	32%	0.32	19%	0.188	S	C	.	.	G	3₁₀ helix	trans	-53.9	-28.9	175.9	0	0	0	0	0	115.4	G322 F326 K357	G322-G324 PolarHBondContact O-N 3.45Å; G324-F326 VanDerWaalsContact C-N 3.27Å; G324-F326 PolarHBondContact O-N 2.96Å; G324-K357 PolarHBondContact O-NZ 2.8Å
325	F	73.7	Confident	78.6	Confident	82 Å²	82	33.6 Å²	33.6	36%	0.36	19%	0.19	S	C	.	.	G	3₁₀ helix	trans	-73	-17.4	177.5	-63	-69.2	0	0	0	113.7	F113 G322 D323 I361 A362 V557	F113-F325 HydrophobicContact CB-CD2 3.84Å; F113-F325 HydrophobicContact CB-CE2 4.45Å; F113-F325 AromaticContact CD1-CD2 3.54Å; F113-F325 HydrophobicContact CD1-CD2 3.54Å; F113-F325 AromaticContact CD1-CE2 3.79Å; F113-F325 HydrophobicContact CD1-CE2 3.79Å; F113-F325 HydrophobicContact CD1-CG 4.19Å; F113-F325 HydrophobicContact CE1-CD2 4.43Å; F113-F325 AromaticContact CG-CD2 3.88Å; F113-F325 HydrophobicContact CG-CD2 3.88Å; F113-F325 HydrophobicContact CG-CE2 4.49Å; G322-F325 WeakPolarHBondContact O-CD2 3.27Å; G322-F325 PolarHBondContact O-N 2.89Å; G322-F325 VanDerWaalsContact O-N 3.14Å; D323-F325 PolarHBondContact O-N 2.97Å; D323-F325 VanDerWaalsContact O-N 3.14Å; F325-I361 HydrophobicContact CD1-CG2 3.99Å; F325-A362 HydrophobicContact CD1-CB 4.36Å; F325-A362 HydrophobicContact CE1-CB 4.09Å; F325-V557 HydrophobicContact CB-CG1 3.86Å
326	F	79.9	Confident	77.9	Confident	6 Å²	6	36.4 Å²	36.4	3%	0.026	22%	0.22	C	C	.	.	S	Bend	trans	-96.8	164	179.8	-71.8	-103.1	0	0	0	112	F111 F113 D323 G324 F330 K357 E553	F111-F326 AromaticContact CE1-CD2 3.86Å; F111-F326 HydrophobicContact CE1-CD2 3.86Å; F111-F326 AromaticContact CE1-CE2 3.77Å; F111-F326 HydrophobicContact CE1-CE2 3.77Å; F111-F326 HydrophobicContact CE1-CZ 4.44Å; F111-F326 HydrophobicContact CZ-CD2 4.05Å; F111-F326 HydrophobicContact CZ-CE1 4.44Å; F111-F326 AromaticContact CZ-CE2 3.6Å; F111-F326 HydrophobicContact CZ-CE2 3.6Å; F111-F326 AromaticContact CZ-CZ 3.82Å; F111-F326 HydrophobicContact CZ-CZ 3.82Å; F113-F326 HydrophobicContact CB-CE2 4.2Å; F113-F326 AromaticContact CD2-CE2 3.84Å; F113-F326 HydrophobicContact CD2-CE2 3.84Å; F113-F326 HydrophobicContact CD2-CZ 4.24Å; F113-F326 HydrophobicContact CG-CE2 4.35Å; D323-F326 PolarHBondContact O-N 3.46Å; G324-F326 VanDerWaalsContact C-N 3.27Å; G324-F326 PolarHBondContact O-N 2.96Å; F326-F330 HydrophobicContact CB-CB 4.17Å; F326-F330 HydrophobicContact CB-CD1 3.56Å; F326-F330 HydrophobicContact CB-CE1 4.32Å; F326-F330 HydrophobicContact CB-CG 4.09Å; F326-F330 AromaticContact CD1-CD1 3.81Å; F326-F330 HydrophobicContact CD1-CD1 3.81Å; F326-F330 HydrophobicContact CD1-CD2 4.38Å; F326-F330 HydrophobicContact CD1-CE1 4.12Å; F326-F330 AromaticContact CD1-CG 3.96Å; F326-F330 HydrophobicContact CD1-CG 3.96Å; F326-F330 AromaticContact CG-CD1 3.74Å; F326-F330 HydrophobicContact CG-CD1 3.74Å; F326-F330 HydrophobicContact CG-CE1 4.09Å; F326-F330 HydrophobicContact CG-CG 4.29Å; F326-K357 PolarHBondContact O-NZ 3.24Å; F326-E553 HydrophobicContact CD1-CG 3.87Å; F326-E553 HydrophobicContact CE1-CG 4.36Å
327	S	78.5	Confident	77.7	Confident	26 Å²	26	35 Å²	35	18%	0.182	21%	0.212	C	C	.	.			trans	-57.8	145	171.9	67.3	0	0	0	0	112.3	T329 F330 Q331 E553	S327-T329 WeakPolarHBondContact CB-OG1 3.24Å; S327-T329 PolarHBondContact O-N 3.22Å; S327-T329 PolarHBondContact OG-OG1 2.78Å; S327-F330 WeakPolarHBondContact O-CA 3.3Å; S327-F330 WeakPolarHBondContact O-CB 3.43Å; S327-F330 PolarHBondContact O-N 3.14Å; S327-F330 WeakPolarHBondContact OG-CB 3.42Å; S327-F330 PolarHBondContact OG-N 2.93Å; S327-F330 VanDerWaalsContact OG-N 3.08Å; S327-Q331 PolarHBondContact O-N 3.04Å; S327-E553 WeakPolarHBondContact CA-OE1 3.43Å; S327-E553 WeakPolarHBondContact CB-OE1 3.45Å; S327-E553 WeakPolarHBondContact CB-OE2 3.49Å; S327-E553 PolarHBondContact N-OE1 3.29Å; S327-E553 PolarHBondContact OG-OE1 3.34Å; S327-E553 PolarHBondContact OG-OE2 3.44Å
328	S	77.9	Confident	77.5	Confident	4 Å²	4	34.5 Å²	34.5	3%	0.028	22%	0.216	C	C	.	.	H	α-helix	trans	-55.2	-33.8	171.6	-45.5	0	0	0	0	112.3	Q331 S332 E528	S328-Q331 PolarHBondContact O-N 3.45Å; S328-S332 PolarHBondContact O-N 2.87Å; S328-E528 WeakPolarHBondContact CB-OE1 3.48Å; S328-E528 PolarHBondContact OG-OE1 2.65Å
329	T	77.4	Confident	77.4	Confident	31 Å²	31	33 Å²	33	19%	0.19	21%	0.205	C	C	.	.	H	α-helix	trans	-60.9	-43.6	170.3	33.5	0	0	0	0	112.9	S327 S332 P545	S327-T329 WeakPolarHBondContact CB-OG1 3.24Å; S327-T329 PolarHBondContact O-N 3.22Å; S327-T329 PolarHBondContact OG-OG1 2.78Å; T329-S332 PolarHBondContact O-OG 3.37Å; T329-P545 WeakPolarHBondContact O-CD 3.25Å
330	F	82.1	Confident	77.2	Confident	1 Å²	1	35.5 Å²	35.5	0%	0.004	21%	0.21	C	C	.	.	H	α-helix	trans	-66	-44.7	171.7	173.7	-92.5	0	0	0	111.2	F111 F312 F326 S327 S332 R333 L334 I550	F111-F330 HydrophobicContact CD1-CE1 4.08Å; F111-F330 HydrophobicContact CD2-CE1 4.23Å; F111-F330 AromaticContact CD2-CZ 3.99Å; F111-F330 HydrophobicContact CD2-CZ 3.99Å; F111-F330 AromaticContact CE1-CE1 3.66Å; F111-F330 HydrophobicContact CE1-CE1 3.66Å; F111-F330 HydrophobicContact CE1-CZ 4.2Å; F111-F330 AromaticContact CE2-CE1 3.85Å; F111-F330 HydrophobicContact CE2-CE1 3.85Å; F111-F330 AromaticContact CE2-CZ 3.51Å; F111-F330 HydrophobicContact CE2-CZ 3.51Å; F111-F330 HydrophobicContact CG-CE1 4.35Å; F111-F330 AromaticContact CZ-CE1 3.54Å; F111-F330 HydrophobicContact CZ-CE1 3.54Å; F111-F330 AromaticContact CZ-CZ 3.61Å; F111-F330 HydrophobicContact CZ-CZ 3.61Å; F312-F330 AromaticContact CD1-CE2 3.96Å; F312-F330 HydrophobicContact CD1-CE2 3.96Å; F312-F330 HydrophobicContact CD1-CZ 4.1Å; F312-F330 AromaticContact CE1-CE2 3.94Å; F312-F330 HydrophobicContact CE1-CE2 3.94Å; F312-F330 HydrophobicContact CE1-CZ 4.06Å; F326-F330 HydrophobicContact CB-CB 4.17Å; F326-F330 HydrophobicContact CB-CD1 3.56Å; F326-F330 HydrophobicContact CB-CE1 4.32Å; F326-F330 HydrophobicContact CB-CG 4.09Å; F326-F330 AromaticContact CD1-CD1 3.81Å; F326-F330 HydrophobicContact CD1-CD1 3.81Å; F326-F330 HydrophobicContact CD1-CD2 4.38Å; F326-F330 HydrophobicContact CD1-CE1 4.12Å; F326-F330 AromaticContact CD1-CG 3.96Å; F326-F330 HydrophobicContact CD1-CG 3.96Å; F326-F330 AromaticContact CG-CD1 3.74Å; F326-F330 HydrophobicContact CG-CD1 3.74Å; F326-F330 HydrophobicContact CG-CE1 4.09Å; F326-F330 HydrophobicContact CG-CG 4.29Å; S327-F330 WeakPolarHBondContact O-CA 3.3Å; S327-F330 WeakPolarHBondContact O-CB 3.43Å; S327-F330 PolarHBondContact O-N 3.14Å; S327-F330 WeakPolarHBondContact OG-CB 3.42Å; S327-F330 PolarHBondContact OG-N 2.93Å; S327-F330 VanDerWaalsContact OG-N 3.08Å; F330-S332 PolarHBondContact O-N 3.24Å; F330-R333 VanDerWaalsContact O-CB 3.26Å; F330-R333 WeakPolarHBondContact O-CB 3.41Å; F330-R333 PolarHBondContact O-N 3.46Å; F330-L334 HydrophobicContact CE1-CD1 4.17Å; F330-L334 HydrophobicContact CE1-CD2 4.31Å; F330-L334 HydrophobicContact CE1-CG 4.37Å; F330-L334 HydrophobicContact CZ-CD2 4.37Å; F330-I550 HydrophobicContact CD2-CB 4.41Å; F330-I550 HydrophobicContact CD2-CD1 4.22Å; F330-I550 HydrophobicContact CD2-CG1 4.02Å; F330-I550 HydrophobicContact CD2-CG2 3.72Å; F330-I550 HydrophobicContact CE2-CG2 3.57Å
331	Q	81	Confident	76.8	Confident	5 Å²	5	40 Å²	40	2%	0.023	23%	0.23	C	C	.	.	H	α-helix	trans	-56.9	-36.1	179.3	-68.4	-170.5	20.3	0	0	113	D323 S327 S328 R333 L334 N337 L339	D323-Q331 VanDerWaalsContact C-NE2 3.3Å; D323-Q331 HydrophobicContact CB-CG 4.41Å; D323-Q331 PolarHBondContact O-NE2 3.39Å; S327-Q331 PolarHBondContact O-N 3.04Å; S328-Q331 PolarHBondContact O-N 3.45Å; Q331-R333 PolarHBondContact O-N 2.88Å; Q331-L334 WeakPolarHBondContact O-CB 3.29Å; Q331-L334 PolarHBondContact O-N 2.96Å; Q331-N337 PolarHBondContact OE1-ND2 2.9Å; Q331-L339 HydrophobicContact CB-CD1 4.2Å
332	S	79.1	Confident	76.7	Confident	1 Å²	1	38.5 Å²	38.5	1%	0.007	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-13.5	175.9	79.9	0	0	0	0	115.4	S328 T329 F330	S328-S332 PolarHBondContact O-N 2.87Å; T329-S332 PolarHBondContact O-OG 3.37Å; F330-S332 PolarHBondContact O-N 3.24Å
333	R	81	Confident	76.9	Confident	73 Å²	73	41 Å²	41	28%	0.275	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-29	173.2	177.6	-179.4	164	158.3	-1.2	112.7	F312 F330 Q331 I335 I550	F312-R333 VanDerWaalsContact C-NH2 3.34Å; F312-R333 PolarHBondContact O-NH2 3.4Å; F330-R333 VanDerWaalsContact O-CB 3.26Å; F330-R333 WeakPolarHBondContact O-CB 3.41Å; F330-R333 PolarHBondContact O-N 3.46Å; Q331-R333 PolarHBondContact O-N 2.88Å; R333-I335 PolarHBondContact O-N 3.48Å; R333-I550 VanDerWaalsContact NH1-CD1 3.33Å
334	L	83.6	Confident	77.2	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	23%	0.229	C	C	.	.	S	Bend	trans	-77	119.8	-172.6	-58.1	179.9	0	0	0	110.1	F111 D323 F330 Q331 G336 N337 Y340	F111-L334 HydrophobicContact CB-CD1 3.77Å; F111-L334 HydrophobicContact CB-CD2 3.76Å; F111-L334 HydrophobicContact CB-CG 4.41Å; F111-L334 HydrophobicContact CD1-CD1 3.89Å; F111-L334 HydrophobicContact CD2-CD2 4.21Å; F111-L334 HydrophobicContact CG-CD1 3.88Å; F111-L334 HydrophobicContact CG-CD2 3.96Å; D323-L334 HydrophobicContact CB-CD1 4.03Å; F330-L334 HydrophobicContact CE1-CD1 4.17Å; F330-L334 HydrophobicContact CE1-CD2 4.31Å; F330-L334 HydrophobicContact CE1-CG 4.37Å; F330-L334 HydrophobicContact CZ-CD2 4.37Å; Q331-L334 WeakPolarHBondContact O-CB 3.29Å; Q331-L334 PolarHBondContact O-N 2.96Å; L334-G336 PolarHBondContact O-N 3.33Å; L334-N337 HydrophobicContact CB-CB 4.1Å; L334-N337 WeakPolarHBondContact O-CB 3.44Å; L334-N337 PolarHBondContact O-N 3.23Å; L334-Y340 WeakPolarHBondContact O-CB 3.32Å; L334-Y340 VanDerWaalsContact O-CD2 3.23Å; L334-Y340 WeakPolarHBondContact O-CD2 3.42Å
335	I	81.4	Confident	77.8	Confident	69 Å²	69	38.5 Å²	38.5	35%	0.354	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	140.4	174.2	-59.7	168.4	0	0	0	108.2	N316 K317 S318 S319 R333 N337 Y340	N316-I335 WeakPolarHBondContact O-CB 3.34Å; N316-I335 VanDerWaalsContact O-CG1 3.3Å; N316-I335 WeakPolarHBondContact O-CG1 3.46Å; N316-I335 PolarHBondContact O-N 3.13Å; N316-I335 VanDerWaalsContact O-N 3.08Å; K317-I335 CarbonylContact C-O 3.58Å; K317-I335 CarbonylContact O-C 3.55Å; K317-I335 WeakPolarHBondContact O-CB 3.43Å; S318-I335 CarbonylContact C-O 3.5Å; S318-I335 WeakPolarHBondContact CA-O 3.24Å; S318-I335 PolarHBondContact N-O 2.95Å; S319-I335 PolarHBondContact N-O 3.31Å; R333-I335 PolarHBondContact O-N 3.48Å; I335-N337 VanDerWaalsContact C-N 3.25Å; I335-N337 PolarHBondContact O-N 3.07Å; I335-Y340 HydrophobicContact CB-CE2 4.4Å; I335-Y340 HydrophobicContact CG1-CD2 4.36Å; I335-Y340 HydrophobicContact CG1-CE1 4.35Å; I335-Y340 HydrophobicContact CG1-CE2 3.71Å
336	G	73.8	Confident	78.4	Confident	61 Å²	61	36.9 Å²	36.9	63%	0.629	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	74.3	3	-179.1	0	0	0	0	0	116	L334	L334-G336 PolarHBondContact O-N 3.33Å
337	N	77.9	Confident	78.9	Confident	14 Å²	14	39.8 Å²	39.8	8%	0.075	22%	0.219	C	C	.	.	S	Bend	trans	-76.1	147.8	163.1	-176.5	-79.2	0	0	0	110.1	S319 D323 Q331 L334 I335 L339 Y340	S319-N337 WeakPolarHBondContact OG-CB 3.47Å; S319-N337 PolarHBondContact OG-ND2 2.95Å; D323-N337 PolarHBondContact OD2-ND2 3.41Å; Q331-N337 PolarHBondContact OE1-ND2 2.9Å; L334-N337 HydrophobicContact CB-CB 4.1Å; L334-N337 WeakPolarHBondContact O-CB 3.44Å; L334-N337 PolarHBondContact O-N 3.23Å; I335-N337 VanDerWaalsContact C-N 3.25Å; I335-N337 PolarHBondContact O-N 3.07Å; N337-L339 PolarHBondContact O-N 2.87Å; N337-L339 WeakPolarHBondContact OD1-CB 3.43Å; N337-L339 PolarHBondContact OD1-N 2.91Å; N337-Y340 WeakPolarHBondContact O-CB 3.32Å; N337-Y340 PolarHBondContact O-N 3.18Å
338	N	71.9	Confident	79.5	Confident	115 Å²	115	38.7 Å²	38.7	62%	0.615	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-16.8	179.6	-68.5	9.1	0	0	0	114.4	V342	N338-V342 WeakPolarHBondContact O-CG2 3.4Å
339	L	73.6	Confident	80.1	Confident	1 Å²	1	38.5 Å²	38.5	1%	0.005	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.1	-3.4	174	-62.9	172.3	0	0	0	113.3	Q331 N337 N341 M344 E528 D529	Q331-L339 HydrophobicContact CB-CD1 4.2Å; N337-L339 PolarHBondContact O-N 2.87Å; N337-L339 WeakPolarHBondContact OD1-CB 3.43Å; N337-L339 PolarHBondContact OD1-N 2.91Å; L339-N341 PolarHBondContact O-N 2.82Å; L339-M344 HydrophobicContact CD2-CE 4.17Å; L339-E528 HydrophobicContact CD1-CG 4.11Å; L339-E528 HydrophobicContact CD2-CG 4.29Å; L339-D529 WeakPolarHBondContact CD2-OD1 3.39Å
340	Y	72.4	Confident	80.8	Confident	86 Å²	86	38.8 Å²	38.8	34%	0.337	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	119.6	-176	-174.5	-97	0	0	0	111.7	L334 I335 N337 V342	L334-Y340 WeakPolarHBondContact O-CB 3.32Å; L334-Y340 VanDerWaalsContact O-CD2 3.23Å; L334-Y340 WeakPolarHBondContact O-CD2 3.42Å; I335-Y340 HydrophobicContact CB-CE2 4.4Å; I335-Y340 HydrophobicContact CG1-CD2 4.36Å; I335-Y340 HydrophobicContact CG1-CE1 4.35Å; I335-Y340 HydrophobicContact CG1-CE2 3.71Å; N337-Y340 WeakPolarHBondContact O-CB 3.32Å; N337-Y340 PolarHBondContact O-N 3.18Å; Y340-V342 PolarHBondContact O-N 3.46Å; Y340-V342 VanDerWaalsContact O-N 3.11Å
341	N	70.1	Confident	81.1	Confident	108 Å²	108	41 Å²	41	58%	0.578	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.6	22.3	178.4	-158.6	58.2	0	0	0	114.9	L339	L339-N341 PolarHBondContact O-N 2.82Å
342	V	72	Confident	81.7	Confident	46 Å²	46	40.8 Å²	40.8	28%	0.279	23%	0.229	S	C	.	.			trans	-67.7	144.9	175.4	169.6	0	0	0	0	110.8	N338 Y340 M344 L540	N338-V342 WeakPolarHBondContact O-CG2 3.4Å; Y340-V342 PolarHBondContact O-N 3.46Å; Y340-V342 VanDerWaalsContact O-N 3.11Å; V342-M344 HydrophobicContact CG1-CB 4.31Å; V342-M344 HydrophobicContact CG1-CE 3.8Å; V342-L540 HydrophobicContact CB-CD1 3.82Å; V342-L540 HydrophobicContact CG1-CD1 4.18Å; V342-L540 WeakPolarHBondContact O-CB 3.47Å; V342-L540 PolarHBondContact O-N 3.13Å; V342-L540 VanDerWaalsContact O-N 3.09Å
343	S	77.1	Confident	82.4	Confident	65 Å²	65	41.7 Å²	41.7	46%	0.455	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	121.4	165.9	69.6	0	0	0	0	108.9	I538	S343-I538 WeakPolarHBondContact CA-O 3.13Å
344	M	83.6	Confident	83	Confident	13 Å²	13	38.3 Å²	38.3	6%	0.064	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	159.6	178.9	58	171.2	61.3	0	0	110.7	L339 V342 V478 L479 E528 N537 I538 L540	L339-M344 HydrophobicContact CD2-CE 4.17Å; V342-M344 HydrophobicContact CG1-CB 4.31Å; V342-M344 HydrophobicContact CG1-CE 3.8Å; M344-V478 HydrophobicContact SD-CG1 3.61Å; M344-L479 HydrophobicContact CE-CD1 4.4Å; M344-L479 HydrophobicContact SD-CD1 3.71Å; M344-E528 WeakPolarHBondContact CE-O 3.49Å; M344-N537 WeakPolarHBondContact CA-OD1 3.46Å; M344-I538 PolarHBondContact N-O 3.25Å; M344-I538 VanDerWaalsContact N-O 3.13Å; M344-I538 PolarHBondContact O-N 3.31Å; M344-L540 HydrophobicContact CE-CD1 3.76Å; M344-L540 HydrophobicContact CG-CD1 4.01Å; M344-L540 HydrophobicContact CG-CG 4.46Å; M344-L540 HydrophobicContact SD-CD1 3.95Å
345	P	86.1	Confident	83.5	Confident	2 Å²	2	38.7 Å²	38.7	1%	0.013	23%	0.225	C	C	.	.			trans	-75.2	134.4	-177.2	-8.2	23.5	0	0	0	111.7	Y347 V478 H530 L535 N537	P345-Y347 PolarHBondContact O-N 3.14Å; P345-V478 WeakPolarHBondContact O-CG2 3.42Å; P345-H530 WeakPolarHBondContact CD-O 3.38Å; P345-H530 PolarHBondContact O-ND1 2.92Å; P345-L535 HydrophobicContact CB-CB 3.59Å; P345-L535 HydrophobicContact CB-CD1 3.68Å; P345-L535 HydrophobicContact CB-CG 4.31Å; P345-L535 HydrophobicContact CG-CB 3.84Å; P345-L535 HydrophobicContact CG-CD1 4.18Å; P345-N537 WeakPolarHBondContact CD-OD1 3.38Å; P345-N537 WeakPolarHBondContact CG-OD1 3.27Å
346	E	85.4	Confident	84.1	Confident	48 Å²	48	35.4 Å²	35.4	22%	0.224	21%	0.208	C	C	.	.	S	Bend	trans	-64	-35.8	-174.6	-180	-179	-165	0	0	113.5	K477 V478 I538	E346-K477 HydrophobicContact CG-CG 4.36Å; E346-K477 CarbonylContact O-C 3.6Å; E346-K477 WeakPolarHBondContact O-CA 3.28Å; E346-K477 IonicContact OE1-NZ 2.64Å; E346-K477 PolarHBondContact OE1-NZ 3.04Å; E346-K477 IonicContact OE2-NZ 3.69Å; E346-V478 PolarHBondContact O-N 3.02Å; E346-I538 HydrophobicContact CB-CD1 3.96Å
347	Y	89.8	Confident	84.9	Confident	67 Å²	67	33.2 Å²	33.2	26%	0.263	18%	0.181	S	C	.	.	B	Isolated β-bridge	trans	-111.3	137.7	-172.3	-57.2	-79	0	0	0	111.6	P345 L414 L475 V476 K477 H530	P345-Y347 PolarHBondContact O-N 3.14Å; Y347-L414 HydrophobicContact CG-CD1 4.36Å; Y347-L475 HydrophobicContact CD1-CB 3.55Å; Y347-L475 HydrophobicContact CD1-CD1 3.85Å; Y347-L475 HydrophobicContact CD1-CG 4.28Å; Y347-L475 HydrophobicContact CE1-CB 3.89Å; Y347-L475 HydrophobicContact CE1-CD1 3.84Å; Y347-L475 HydrophobicContact CG-CD1 4.43Å; Y347-V476 WeakPolarHBondContact CA-O 3.42Å; Y347-K477 HydrophobicContact CD1-CG 3.92Å; Y347-K477 HydrophobicContact CE1-CD 4.33Å; Y347-K477 HydrophobicContact CE1-CG 3.63Å; Y347-K477 PolarHBondContact OH-NZ 3.02Å; Y347-H530 PolarHBondContact O-CE1 3.17Å
348	L	91.7	Very high	85.5	Confident	2 Å²	2	32.7 Å²	32.7	1%	0.01	18%	0.178	C	C	.	.			trans	-65.7	138.9	173.3	-173.5	65.9	0	0	0	110.9	I354 V400 L414 V415 V476 I527	L348-I354 HydrophobicContact CD1-CD1 4.32Å; L348-I354 HydrophobicContact CD1-CG2 3.53Å; L348-V400 HydrophobicContact CD1-CG2 4.18Å; L348-L414 CarbonylContact O-C 3.57Å; L348-L414 WeakPolarHBondContact O-CA 3.5Å; L348-V415 HydrophobicContact CB-CB 4.25Å; L348-V415 HydrophobicContact CB-CG2 4.46Å; L348-V415 HydrophobicContact CD2-CB 3.89Å; L348-V415 HydrophobicContact CD2-CG1 4.12Å; L348-V415 HydrophobicContact CD2-CG2 3.87Å; L348-V415 HydrophobicContact CG-CB 4.09Å; L348-V415 HydrophobicContact CG-CG2 3.87Å; L348-V415 PolarHBondContact O-N 2.97Å; L348-V476 HydrophobicContact CB-CB 3.99Å; L348-V476 HydrophobicContact CB-CG1 3.99Å; L348-V476 HydrophobicContact CD2-CG1 4.2Å; L348-V476 PolarHBondContact N-O 3.2Å; L348-I527 HydrophobicContact CB-CD1 4.39Å; L348-I527 HydrophobicContact CD1-CD1 4.17Å; L348-I527 HydrophobicContact CD2-CD1 3.7Å; L348-I527 HydrophobicContact CG-CD1 4.31Å
349	A	91.9	Very high	86.1	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.163	C	C	.	.	B	Isolated β-bridge	trans	-126.4	163.3	172.1	0	0	0	0	0	112	S352 P412 D413 L414 L535	A349-S352 PolarHBondContact N-OG 3.03Å; A349-S352 WeakPolarHBondContact O-CB 3.28Å; A349-S352 PolarHBondContact O-N 3.33Å; A349-S352 PolarHBondContact O-OG 3.38Å; A349-S352 VanDerWaalsContact O-OG 3.12Å; A349-P412 HydrophobicContact CB-CB 4.4Å; A349-D413 CarbonylContact C-O 3.06Å; A349-D413 WeakPolarHBondContact CA-O 3.43Å; A349-D413 VanDerWaalsContact CB-O 3.28Å; A349-D413 WeakPolarHBondContact CB-O 3.11Å; A349-L414 HydrophobicContact CB-CD2 3.98Å; A349-L535 HydrophobicContact CB-CD1 3.86Å
350	Y	90.9	Very high	86.5	Confident	38 Å²	38	32.8 Å²	32.8	15%	0.149	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	145.5	165.5	-66.6	-85.4	0	0	0	110.2	S352 V400 K402 D413 V415 I420 I421	Y350-S352 PolarHBondContact O-N 3.06Å; Y350-V400 HydrophobicContact CD1-CG1 4.23Å; Y350-K402 HydrophobicContact CD1-CB 3.71Å; Y350-K402 HydrophobicContact CD1-CG 4.12Å; Y350-K402 HydrophobicContact CE1-CB 3.91Å; Y350-K402 HydrophobicContact CE1-CG 3.93Å; Y350-K402 HydrophobicContact CG-CB 4.34Å; Y350-D413 HydrophobicContact CD2-CB 3.73Å; Y350-D413 HydrophobicContact CE2-CB 4.45Å; Y350-D413 PolarHBondContact N-O 3.4Å; Y350-V415 HydrophobicContact CD1-CG2 4.48Å; Y350-V415 HydrophobicContact CD2-CG2 3.9Å; Y350-V415 HydrophobicContact CE1-CG2 4.39Å; Y350-V415 HydrophobicContact CE2-CG2 3.79Å; Y350-V415 HydrophobicContact CG-CG2 4.27Å; Y350-I420 PolarHBondContact OH-O 3.18Å; Y350-I420 VanDerWaalsContact OH-O 3.12Å; Y350-I421 HydrophobicContact CE1-CG2 3.83Å
351	G	89.1	Confident	86.1	Confident	47 Å²	47	30.5 Å²	30.5	49%	0.485	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.8	0.7	-170.7	0	0	0	0	0	114.7	L399 V400	G351-L399 WeakPolarHBondContact O-CD1 3.31Å; G351-V400 PolarHBondContact N-O 2.85Å
352	S	92.3	Very high	85.8	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.151	C	C	.	.			trans	-75	138.1	173.8	-70.4	0	0	0	0	112.5	A349 Y350 L399 V400 H530 N532	A349-S352 PolarHBondContact N-OG 3.03Å; A349-S352 WeakPolarHBondContact O-CB 3.28Å; A349-S352 PolarHBondContact O-N 3.33Å; A349-S352 PolarHBondContact O-OG 3.38Å; A349-S352 VanDerWaalsContact O-OG 3.12Å; Y350-S352 PolarHBondContact O-N 3.06Å; S352-L399 WeakPolarHBondContact O-CD1 3.13Å; S352-V400 PolarHBondContact O-N 3.43Å; S352-H530 WeakPolarHBondContact CB-NE2 3.48Å; S352-H530 PolarHBondContact OG-NE2 3.42Å; S352-N532 WeakPolarHBondContact OG-CB 3.47Å; S352-N532 PolarHBondContact OG-ND2 2.89Å
353	T	94.1	Very high	86	Confident	20 Å²	20	24.8 Å²	24.8	12%	0.123	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	134.3	162.3	-55.3	0	0	0	0	109.3	M397 W398 K426 I531	T353-M397 HydrophobicContact CG2-CB 3.94Å; T353-M397 HydrophobicContact CG2-CE 4.12Å; T353-M397 HydrophobicContact CG2-CG 4.11Å; T353-M397 HydrophobicContact CG2-SD 3.95Å; T353-W398 CarbonylContact C-O 3.49Å; T353-W398 WeakPolarHBondContact CA-O 3.42Å; T353-K426 HydrophobicContact CG2-CD 4Å; T353-I531 PolarHBondContact N-O 2.78Å; T353-I531 PolarHBondContact O-N 2.94Å
354	I	94.3	Very high	86.4	Confident	3 Å²	3	21.7 Å²	21.7	2%	0.015	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	157.5	-179.5	56	173.8	0	0	0	113	L348 V356 W398 V400 L423 I527 D529 H530	L348-I354 HydrophobicContact CD1-CD1 4.32Å; L348-I354 HydrophobicContact CD1-CG2 3.53Å; I354-V356 HydrophobicContact CD1-CG2 3.61Å; I354-V356 HydrophobicContact CG1-CG2 4Å; I354-W398 HydrophobicContact CG1-CB 4.44Å; I354-W398 WeakPolarHBondContact CG1-O 3.34Å; I354-W398 PolarHBondContact N-O 3.49Å; I354-W398 PolarHBondContact O-N 2.86Å; I354-V400 HydrophobicContact CD1-CG2 3.57Å; I354-V400 HydrophobicContact CG1-CG2 3.94Å; I354-L423 HydrophobicContact CD1-CD2 4.27Å; I354-I527 HydrophobicContact CB-CG2 3.99Å; I354-I527 HydrophobicContact CD1-CD1 4.44Å; I354-I527 HydrophobicContact CG2-CG2 3.71Å; I354-D529 CarbonylContact C-O 3.49Å; I354-D529 VanDerWaalsContact CA-O 3.28Å; I354-D529 WeakPolarHBondContact CA-O 3.48Å; I354-H530 HydrophobicContact CG2-CB 4.4Å
355	T	93.5	Very high	86.8	Confident	7 Å²	7	21.6 Å²	21.6	4%	0.043	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	142.4	158	65.7	0	0	0	0	109.7	N396 M397 E528 D529	T355-N396 HydrophobicContact CG2-CB 4.36Å; T355-M397 HydrophobicContact CG2-CG 4.43Å; T355-E528 PolarHBondContact O-N 2.95Å; T355-D529 HydrophobicContact CG2-CB 4.07Å; T355-D529 PolarHBondContact N-O 2.64Å; T355-D529 VanDerWaalsContact OG1-CB 3.3Å; T355-D529 WeakPolarHBondContact OG1-CB 3.31Å; T355-D529 PolarHBondContact OG1-N 3.23Å; T355-D529 PolarHBondContact OG1-OD2 2.76Å
356	V	93.6	Very high	87.3	Confident	0 Å²	0	21.5 Å²	21.5	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	106.7	-170.6	-176.6	0	0	0	0	109.6	I354 Y365 L366 F485 W525 N526	I354-V356 HydrophobicContact CD1-CG2 3.61Å; I354-V356 HydrophobicContact CG1-CG2 4Å; V356-Y365 CarbonylContact O-C 3.11Å; V356-Y365 WeakPolarHBondContact O-CA 3.45Å; V356-L366 HydrophobicContact CB-CB 4.27Å; V356-L366 PolarHBondContact O-N 2.87Å; V356-F485 HydrophobicContact CG1-CE2 3.8Å; V356-F485 HydrophobicContact CG1-CZ 4.2Å; V356-W525 HydrophobicContact CG1-CB 3.84Å; V356-W525 HydrophobicContact CG1-CD2 4.24Å; V356-W525 HydrophobicContact CG1-CE3 3.88Å; V356-W525 HydrophobicContact CG1-CG 4.27Å; V356-N526 CarbonylContact C-O 3.59Å; V356-N526 WeakPolarHBondContact CA-O 3.41Å
357	K	90.6	Very high	87.8	Confident	16 Å²	16	19.4 Å²	19.4	7%	0.07	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	137	-177.2	-179.6	176.6	174.9	-173.7	0	111.6	G324 F326 Y365 W525 N526 E528	G324-K357 PolarHBondContact O-NZ 2.8Å; F326-K357 PolarHBondContact O-NZ 3.24Å; K357-Y365 HydrophobicContact CB-CD1 4.17Å; K357-Y365 HydrophobicContact CB-CE1 4.28Å; K357-Y365 HydrophobicContact CD-CE1 4.44Å; K357-W525 CarbonylContact O-C 3.59Å; K357-W525 WeakPolarHBondContact O-CA 3.42Å; K357-N526 PolarHBondContact N-O 2.87Å; K357-N526 PolarHBondContact O-N 3.44Å; K357-E528 WeakPolarHBondContact CB-OE2 3.32Å; K357-E528 WeakPolarHBondContact CD-OE2 3.48Å
358	N	91.4	Very high	88.1	Confident	3 Å²	3	16.2 Å²	16.2	2%	0.016	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	142.5	177.9	-164.9	-97.3	0	0	0	111.8	R360 G364 S496 P521 S522 Q524 W525	N358-R360 VanDerWaalsContact C-N 3.31Å; N358-R360 PolarHBondContact O-N 2.86Å; N358-R360 WeakPolarHBondContact OD1-CB 3.19Å; N358-R360 PolarHBondContact OD1-N 3.43Å; N358-R360 VanDerWaalsContact OD1-N 3.13Å; N358-G364 PolarHBondContact N-O 3.14Å; N358-S496 VanDerWaalsContact CG-CB 3.5Å; N358-S496 WeakPolarHBondContact ND2-CB 3.44Å; N358-P521 PolarHBondContact OD1-O 3.18Å; N358-S522 PolarHBondContact ND2-O 3.47Å; N358-Q524 PolarHBondContact ND2-O 3.05Å; N358-W525 HydrophobicContact CB-CD2 4.26Å; N358-W525 HydrophobicContact CB-CE3 3.69Å; N358-W525 HydrophobicContact CB-CH2 4.07Å; N358-W525 HydrophobicContact CB-CZ3 3.61Å; N358-W525 VanDerWaalsContact ND2-CZ2 3.26Å; N358-W525 WeakPolarHBondContact ND2-CZ2 3.47Å
359	L	84.2	Confident	88.2	Confident	56 Å²	56	17 Å²	17	29%	0.293	10%	0.098	S	C	.	.	S	Bend	trans	-85.3	2.8	-177.2	-78.3	156.5	0	0	0	114.4	K482 P521 Q524 N526	L359-K482 HydrophobicContact CD1-CB 3.93Å; L359-K482 HydrophobicContact CD1-CD 4.2Å; L359-K482 HydrophobicContact CD1-CG 3.71Å; L359-P521 CarbonylContact C-O 3.5Å; L359-Q524 HydrophobicContact CB-CB 4.14Å; L359-Q524 WeakPolarHBondContact CB-O 3.27Å; L359-Q524 HydrophobicContact CD1-CB 3.77Å; L359-Q524 PolarHBondContact N-O 3.26Å; L359-N526 HydrophobicContact CD1-CB 4.32Å; L359-N526 HydrophobicContact CD2-CB 4.39Å; L359-N526 HydrophobicContact CG-CB 4.29Å
360	R	82.1	Confident	88.2	Confident	62 Å²	62	24.6 Å²	24.6	23%	0.234	13%	0.127	C	C	.	.	S	Bend	trans	-64.7	153.7	164.6	-166.3	-168.1	76.6	116.9	-4.1	110.5	N358 A362 G363 G498 P521 S522	N358-R360 VanDerWaalsContact C-N 3.31Å; N358-R360 PolarHBondContact O-N 2.86Å; N358-R360 WeakPolarHBondContact OD1-CB 3.19Å; N358-R360 PolarHBondContact OD1-N 3.43Å; N358-R360 VanDerWaalsContact OD1-N 3.13Å; R360-A362 PolarHBondContact NH2-O 2.97Å; R360-G363 VanDerWaalsContact O-CA 3.25Å; R360-G363 WeakPolarHBondContact O-CA 3.18Å; R360-G363 PolarHBondContact O-N 2.77Å; R360-G498 PolarHBondContact NH1-O 3.46Å; R360-P521 PolarHBondContact N-O 3.47Å; R360-S522 WeakPolarHBondContact CD-OG 3.45Å
361	I	63.4	Low	88.3	Confident	38 Å²	38	27 Å²	27	20%	0.195	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.5	138.5	166.5	-67.2	-174.7	0	0	0	109.3	F325 G363 V557 R560	F325-I361 HydrophobicContact CD1-CG2 3.99Å; I361-G363 PolarHBondContact O-N 3.23Å; I361-V557 HydrophobicContact CD1-CB 4.27Å; I361-V557 HydrophobicContact CD1-CG1 4.32Å; I361-V557 HydrophobicContact CD1-CG2 4Å; I361-R560 HydrophobicContact CD1-CB 3.67Å; I361-R560 HydrophobicContact CD1-CG 4.18Å
362	A	64.8	Low	88.5	Confident	28 Å²	28	27.5 Å²	27.5	23%	0.231	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.2	36.4	-159.8	0	0	0	0	0	111.6	F325 R360 G364 L390	F325-A362 HydrophobicContact CD1-CB 4.36Å; F325-A362 HydrophobicContact CE1-CB 4.09Å; R360-A362 PolarHBondContact NH2-O 2.97Å; A362-G364 PolarHBondContact O-N 2.78Å; A362-L390 HydrophobicContact CB-CD2 4.22Å; A362-L390 WeakPolarHBondContact O-CD2 3.45Å
363	G	75.9	Confident	88.5	Confident	5 Å²	5	27.9 Å²	27.9	5%	0.052	13%	0.132	C	C	.	.			trans	-70.8	113.8	168.8	0	0	0	0	0	109	R360 I361	R360-G363 VanDerWaalsContact O-CA 3.25Å; R360-G363 WeakPolarHBondContact O-CA 3.18Å; R360-G363 PolarHBondContact O-N 2.77Å; I361-G363 PolarHBondContact O-N 3.23Å
364	G	86.1	Confident	88.3	Confident	0 Å²	0	29 Å²	29	0%	0	14%	0.14	C	C	.	.	P	Polyproline II helix	trans	-75.6	168.3	173.7	0	0	0	0	0	112.5	N358 A362 Y389	N358-G364 PolarHBondContact N-O 3.14Å; A362-G364 PolarHBondContact O-N 2.78Å; G364-Y389 CarbonylContact C-O 3.57Å; G364-Y389 WeakPolarHBondContact CA-O 3.44Å
365	Y	91.6	Very high	87.7	Confident	11 Å²	11	36.8 Å²	36.8	4%	0.043	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	140.1	163.1	-56.3	-93.2	0	0	0	109.3	V356 K357 H367 A388 Y389 H391 K392 N396 E528	V356-Y365 CarbonylContact O-C 3.11Å; V356-Y365 WeakPolarHBondContact O-CA 3.45Å; K357-Y365 HydrophobicContact CB-CD1 4.17Å; K357-Y365 HydrophobicContact CB-CE1 4.28Å; K357-Y365 HydrophobicContact CD-CE1 4.44Å; Y365-H367 PolarHBondContact O-N 2.95Å; Y365-A388 CarbonylContact O-C 3.58Å; Y365-A388 VanDerWaalsContact O-CA 3.23Å; Y365-A388 WeakPolarHBondContact O-CA 3.3Å; Y365-Y389 WeakPolarHBondContact CD2-O 3.47Å; Y365-Y389 PolarHBondContact N-O 2.86Å; Y365-Y389 PolarHBondContact O-N 3.38Å; Y365-H391 VanDerWaalsContact CD2-O 3.31Å; Y365-H391 WeakPolarHBondContact CD2-O 3.15Å; Y365-K392 HydrophobicContact CE1-CD 4.46Å; Y365-K392 HydrophobicContact CE1-CG 3.94Å; Y365-K392 HydrophobicContact CE2-CG 3.91Å; Y365-K392 VanDerWaalsContact CZ-CG 3.46Å; Y365-K392 WeakPolarHBondContact OH-CE 3.32Å; Y365-K392 VanDerWaalsContact OH-CG 3.27Å; Y365-K392 WeakPolarHBondContact OH-CG 3.34Å; Y365-N396 VanDerWaalsContact CB-ND2 3.28Å; Y365-N396 WeakPolarHBondContact CB-ND2 3.42Å; Y365-N396 WeakPolarHBondContact CD2-ND2 3.44Å; Y365-N396 HydrophobicContact CG-CB 4.4Å; Y365-N396 VanDerWaalsContact CG-ND2 3.29Å; Y365-E528 WeakPolarHBondContact CE1-OE2 3.24Å; Y365-E528 PolarHBondContact OH-OE2 2.83Å
366	L	96.1	Very high	86.8	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.3	119.3	168.3	-174.6	68.4	0	0	0	108.6	V356 V386 W398 L432 L494 V511 W525	V356-L366 HydrophobicContact CB-CB 4.27Å; V356-L366 PolarHBondContact O-N 2.87Å; L366-V386 HydrophobicContact CD1-CG1 3.71Å; L366-W398 HydrophobicContact CD2-CD2 4.17Å; L366-W398 HydrophobicContact CD2-CZ2 3.99Å; L366-W398 HydrophobicContact CG-CZ2 3.77Å; L366-W398 PolarHBondContact O-NE1 2.93Å; L366-L432 HydrophobicContact CD1-CD1 4.42Å; L366-L432 HydrophobicContact CD2-CD1 4.3Å; L366-L432 HydrophobicContact CD2-CD2 4.11Å; L366-L494 HydrophobicContact CD1-CD2 4.41Å; L366-L494 HydrophobicContact CD2-CD2 4.3Å; L366-V511 HydrophobicContact CD1-CG1 4.1Å; L366-V511 HydrophobicContact CD1-CG2 4.37Å; L366-W525 HydrophobicContact CB-CZ3 4.06Å; L366-W525 HydrophobicContact CD1-CH2 4.22Å
367	H	95.9	Very high	86.1	Confident	4 Å²	4	41.9 Å²	41.9	2%	0.019	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	146.9	-166.1	176.2	95.6	0	0	0	110.4	Y365 H369 V386 T387 Y389 N395 N396 Q508	Y365-H367 PolarHBondContact O-N 2.95Å; H367-H369 AromaticContact CD2-CE1 2.61Å; H367-H369 PolarHBondContact CD2-CE1 3.02Å; H367-H369 AromaticContact CD2-ND1 3.45Å; H367-H369 PolarHBondContact CD2-ND1 3.31Å; H367-H369 AromaticContact CE1-CE1 3.37Å; H367-H369 PolarHBondContact CE1-CE1 3.31Å; H367-H369 AromaticContact CG-CE1 3.92Å; H367-H369 AromaticContact NE2-CE1 2.09Å; H367-H369 PolarHBondContact NE2-CE1 3.17Å; H367-H369 AromaticContact NE2-CG 3.95Å; H367-H369 AromaticContact NE2-ND1 3.09Å; H367-H369 PolarHBondContact NE2-ND1 3.43Å; H367-V386 WeakPolarHBondContact O-CA 3.38Å; H367-T387 PolarHBondContact CD2-OG1 3.4Å; H367-T387 PolarHBondContact N-O 2.97Å; H367-T387 PolarHBondContact O-N 3.17Å; H367-Y389 AromaticContact CE1-CD1 3.98Å; H367-Y389 AromaticContact ND1-CD1 3.88Å; H367-N395 WeakPolarHBondContact CA-O 3.5Å; H367-N395 PolarHBondContact ND1-O 2.92Å; H367-N396 PolarHBondContact ND1-OD1 2.94Å; H367-Q508 PolarHBondContact CD2-OE1 3.33Å; H367-Q508 PolarHBondContact NE2-NE2 3.03Å; H367-Q508 VanDerWaalsContact NE2-NE2 3.2Å
368	S	95.8	Very high	85.3	Confident	1 Å²	1	42.3 Å²	42.3	1%	0.007	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	146.8	171.4	-164.6	0	0	0	0	110.5	Q384 Q385 N395 H425	S368-Q384 VanDerWaalsContact OG-CD 3.29Å; S368-Q384 PolarHBondContact OG-NE2 3.07Å; S368-Q385 WeakPolarHBondContact CB-O 3.36Å; S368-Q385 PolarHBondContact OG-O 3.2Å; S368-N395 PolarHBondContact N-O 3.12Å; S368-N395 WeakPolarHBondContact O-CB 3.45Å; S368-N395 PolarHBondContact O-OD1 2.87Å; S368-H425 PolarHBondContact O-CE1 3.11Å; S368-H425 PolarHBondContact O-NE2 3.21Å
369	H	94.4	Very high	84.4	Confident	17 Å²	17	43 Å²	43	8%	0.079	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	164	-176.2	50.9	-122	0	0	0	110.1	H367 H371 Q384 W506 Q508	H367-H369 AromaticContact CD2-CE1 2.61Å; H367-H369 PolarHBondContact CD2-CE1 3.02Å; H367-H369 AromaticContact CD2-ND1 3.45Å; H367-H369 PolarHBondContact CD2-ND1 3.31Å; H367-H369 AromaticContact CE1-CE1 3.37Å; H367-H369 PolarHBondContact CE1-CE1 3.31Å; H367-H369 AromaticContact CG-CE1 3.92Å; H367-H369 AromaticContact NE2-CE1 2.09Å; H367-H369 PolarHBondContact NE2-CE1 3.17Å; H367-H369 AromaticContact NE2-CG 3.95Å; H367-H369 AromaticContact NE2-ND1 3.09Å; H367-H369 PolarHBondContact NE2-ND1 3.43Å; H369-H371 AromaticContact CD2-CG 3.85Å; H369-H371 AromaticContact CD2-ND1 3.31Å; H369-H371 PolarHBondContact CD2-ND1 2.84Å; H369-H371 VanDerWaalsContact CD2-ND1 3.31Å; H369-H371 AromaticContact CG-ND1 3.96Å; H369-H371 PolarHBondContact O-N 3.38Å; H369-Q384 WeakPolarHBondContact O-CG 3.02Å; H369-Q384 PolarHBondContact O-NE2 3.23Å; H369-W506 AromaticContact NE2-CD1 3.87Å; H369-Q508 PolarHBondContact CE1-NE2 2.83Å; H369-Q508 VanDerWaalsContact CE1-NE2 3.32Å; H369-Q508 PolarHBondContact CE1-OE1 2.84Å; H369-Q508 VanDerWaalsContact CE1-OE1 3.27Å; H369-Q508 PolarHBondContact NE2-OE1 2.99Å
370	W	92.1	Very high	83.4	Confident	160 Å²	160	50.3 Å²	50.3	61%	0.606	27%	0.268	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-58.8	-18.2	-169.2	-64.1	96.3	0	0	0	116.2	E427 T428	W370-E427 VanDerWaalsContact CZ2-O 3.26Å; W370-E427 WeakPolarHBondContact CZ2-O 3.38Å; W370-T428 HydrophobicContact CD2-CG2 3.58Å; W370-T428 HydrophobicContact CE3-CG2 3.9Å; W370-T428 HydrophobicContact CG-CG2 4.07Å; W370-T428 HydrophobicContact CH2-CG2 4.08Å; W370-T428 HydrophobicContact CZ2-CG2 3.78Å; W370-T428 HydrophobicContact CZ3-CG2 4.14Å
371	H	93.3	Very high	82.8	Confident	88 Å²	88	53.6 Å²	53.6	41%	0.407	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	145.8	175	-49.4	103.9	0	0	0	113	H369 Q385 W506	H369-H371 AromaticContact CD2-CG 3.85Å; H369-H371 AromaticContact CD2-ND1 3.31Å; H369-H371 PolarHBondContact CD2-ND1 2.84Å; H369-H371 VanDerWaalsContact CD2-ND1 3.31Å; H369-H371 AromaticContact CG-ND1 3.96Å; H369-H371 PolarHBondContact O-N 3.38Å; H371-Q385 PolarHBondContact O-N 2.91Å; H371-W506 AromaticContact CE1-CE2 3.54Å; H371-W506 AromaticContact CE1-CZ2 3.46Å; H371-W506 VanDerWaalsContact CE1-CZ2 3.46Å; H371-W506 WeakPolarHBondContact CE1-CZ2 3.43Å; H371-W506 AromaticContact CE1-NE1 3.25Å; H371-W506 PolarHBondContact CE1-NE1 3.49Å; H371-W506 AromaticContact CG-NE1 3.77Å; H371-W506 AromaticContact ND1-CD1 3.99Å; H371-W506 AromaticContact ND1-CE2 3.94Å; H371-W506 AromaticContact ND1-NE1 3.17Å; H371-W506 PolarHBondContact ND1-NE1 3.26Å; H371-W506 VanDerWaalsContact ND1-NE1 3.17Å; H371-W506 AromaticContact NE2-CZ2 3.66Å; H371-W506 AromaticContact NE2-NE1 3.85Å
372	L	93.4	Very high	83.6	Confident	58 Å²	58	56.2 Å²	56.2	30%	0.304	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	162.4	177.6	-48.6	178.3	0	0	0	110.8	Q382 Q383 Q384 Q385	L372-Q382 HydrophobicContact CB-CB 3.96Å; L372-Q382 HydrophobicContact CD1-CB 3.85Å; L372-Q383 CarbonylContact C-O 3.58Å; L372-Q383 WeakPolarHBondContact CA-O 3.32Å; L372-Q384 HydrophobicContact CD2-CB 4.27Å; L372-Q385 PolarHBondContact O-NE2 2.95Å
373	Y	91.3	Very high	84.8	Confident	8 Å²	8	55.6 Å²	55.6	3%	0.031	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-65.7	137	168	-76.6	-76.4	0	0	0	110.4	V377 Q383 Q385 V386 P440 V448 T449 W504	Y373-V377 HydrophobicContact CD1-CG1 4.39Å; Y373-Q383 PolarHBondContact N-O 3.05Å; Y373-Q385 HydrophobicContact CD1-CG 4.17Å; Y373-Q385 HydrophobicContact CD2-CG 4.22Å; Y373-Q385 HydrophobicContact CE1-CG 4.21Å; Y373-Q385 HydrophobicContact CE2-CB 4.3Å; Y373-Q385 HydrophobicContact CE2-CG 4.28Å; Y373-Q385 HydrophobicContact CG-CG 4.15Å; Y373-V386 PolarHBondContact OH-N 3.04Å; Y373-V386 PolarHBondContact OH-O 3.27Å; Y373-P440 HydrophobicContact CD1-CG 4.19Å; Y373-P440 HydrophobicContact CE1-CG 3.69Å; Y373-V448 PolarHBondContact OH-O 3.22Å; Y373-T449 HydrophobicContact CD2-CG2 3.97Å; Y373-T449 HydrophobicContact CE2-CG2 3.73Å; Y373-W504 AromaticContact CD1-CH2 3.9Å; Y373-W504 HydrophobicContact CD1-CH2 3.9Å; Y373-W504 AromaticContact CD1-CZ3 3.6Å; Y373-W504 HydrophobicContact CD1-CZ3 3.6Å; Y373-W504 AromaticContact CE1-CH2 3.87Å; Y373-W504 HydrophobicContact CE1-CH2 3.87Å; Y373-W504 AromaticContact CE1-CZ3 3.66Å; Y373-W504 HydrophobicContact CE1-CZ3 3.66Å
374	P	90	Very high	85.6	Confident	45 Å²	45	55.4 Å²	55.4	29%	0.292	29%	0.288	S	S	.	.	P	Polyproline II helix	trans	-71.1	160.3	-179.4	29.8	-35.1	0	0	0	112.2	V377 W504	P374-V377 HydrophobicContact CG-CB 4.09Å; P374-V377 HydrophobicContact CG-CG2 3.81Å; P374-V377 WeakPolarHBondContact O-CB 3.13Å; P374-V377 PolarHBondContact O-N 3.01Å; P374-V377 VanDerWaalsContact O-N 3.08Å; P374-W504 HydrophobicContact CG-CB 4.33Å; P374-W504 HydrophobicContact CG-CD2 3.82Å; P374-W504 HydrophobicContact CG-CE3 4.15Å; P374-W504 HydrophobicContact CG-CG 3.9Å
375	E	81.3	Confident	86	Confident	165 Å²	165	55.6 Å²	55.6	77%	0.771	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	140.6	-178.2	-57.7	-164.5	162.9	0	0	112.7	V377 Q382	E375-V377 PolarHBondContact O-N 2.9Å; E375-Q382 PolarHBondContact OE1-NE2 2.83Å; E375-Q382 VanDerWaalsContact OE1-NE2 3.14Å
376	G	75.1	Confident	86.2	Confident	83 Å²	83	55 Å²	55	86%	0.856	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.3	-8.7	-173.9	0	0	0	0	0	115.3	G378	G376-G378 PolarHBondContact O-N 3.39Å
377	V	79.5	Confident	86.2	Confident	32 Å²	32	55 Å²	55	19%	0.194	29%	0.286	C	S	.	.	S	Bend	trans	-98.6	78.8	-179	-173.6	0	0	0	0	111.8	Y373 P374 E375 P440 Q447 W504	Y373-V377 HydrophobicContact CD1-CG1 4.39Å; P374-V377 HydrophobicContact CG-CB 4.09Å; P374-V377 HydrophobicContact CG-CG2 3.81Å; P374-V377 WeakPolarHBondContact O-CB 3.13Å; P374-V377 PolarHBondContact O-N 3.01Å; P374-V377 VanDerWaalsContact O-N 3.08Å; E375-V377 PolarHBondContact O-N 2.9Å; V377-P440 HydrophobicContact CG1-CB 3.71Å; V377-P440 HydrophobicContact CG1-CG 3.97Å; V377-Q447 PolarHBondContact O-NE2 3.28Å; V377-W504 HydrophobicContact CG1-CH2 4.09Å; V377-W504 HydrophobicContact CG1-CZ2 3.93Å
378	G	74	Confident	86.1	Confident	25 Å²	25	54.9 Å²	54.9	26%	0.258	29%	0.286	S	S	.	.	S	Bend	trans	102.8	-116.2	171.7	0	0	0	0	0	112.9	G376	G376-G378 PolarHBondContact O-N 3.39Å
379	A	72	Confident	85.8	Confident	18 Å²	18	58 Å²	58	15%	0.149	30%	0.298	C	S	.	.	S	Bend	trans	-62.1	151.7	177	0	0	0	0	0	113.2	Q381 H437	A379-Q381 VanDerWaalsContact C-N 3.26Å; A379-Q381 PolarHBondContact O-N 2.77Å; A379-H437 VanDerWaalsContact CA-CD2 3.46Å; A379-H437 WeakPolarHBondContact CA-CD2 3.39Å
380	K	62.5	Low	85.3	Confident	209 Å²	209	61.3 Å²	61.3	91%	0.909	32%	0.315	S	S	*	.	S	Bend	trans	-70.2	-21.7	172.7	-71.7	-171.4	176.3	-175.1	0	113.4
381	Q	71.2	Confident	84.7	Confident	131 Å²	131	59.1 Å²	59.1	61%	0.612	31%	0.312	S	S	*	.	S	Bend	trans	-97	132.2	172.4	-68.1	179.6	-8.9	0	0	109	A379 Q383	A379-Q381 VanDerWaalsContact C-N 3.26Å; A379-Q381 PolarHBondContact O-N 2.77Å; Q381-Q383 PolarHBondContact O-N 3.34Å
382	Q	80.1	Confident	84	Confident	92 Å²	92	58 Å²	58	43%	0.43	31%	0.306	S	S	.	.			trans	-69.7	92.1	174.8	-64	-175.4	4.6	0	0	110.1	L372 E375	L372-Q382 HydrophobicContact CB-CB 3.96Å; L372-Q382 HydrophobicContact CD1-CB 3.85Å; E375-Q382 PolarHBondContact OE1-NE2 2.83Å; E375-Q382 VanDerWaalsContact OE1-NE2 3.14Å
383	Q	88.6	Confident	83.6	Confident	16 Å²	16	58.2 Å²	58.2	8%	0.075	31%	0.307	C	S	.	.	P	Polyproline II helix	trans	-88.3	163.6	173.1	-66.2	178	-22.4	0	0	111	L372 Y373 Q381 H435 T449 Y451	L372-Q383 CarbonylContact C-O 3.58Å; L372-Q383 WeakPolarHBondContact CA-O 3.32Å; Y373-Q383 PolarHBondContact N-O 3.05Å; Q381-Q383 PolarHBondContact O-N 3.34Å; Q383-H435 PolarHBondContact OE1-CE1 3.28Å; Q383-H435 PolarHBondContact OE1-ND1 3.22Å; Q383-T449 HydrophobicContact CB-CG2 3.96Å; Q383-T449 VanDerWaalsContact OE1-CB 3.3Å; Q383-T449 VanDerWaalsContact OE1-CG2 3.3Å; Q383-T449 PolarHBondContact OE1-OG1 2.93Å; Q383-Y451 HydrophobicContact CG-CD2 4.22Å; Q383-Y451 VanDerWaalsContact NE2-CD2 3.35Å
384	Q	93.1	Very high	83.4	Confident	1 Å²	1	66.6 Å²	66.6	1%	0.005	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	143.7	-176	-170.8	-177.9	-10.1	0	0	111.4	S368 H369 L372 T428 T449 G450	S368-Q384 VanDerWaalsContact OG-CD 3.29Å; S368-Q384 PolarHBondContact OG-NE2 3.07Å; H369-Q384 WeakPolarHBondContact O-CG 3.02Å; H369-Q384 PolarHBondContact O-NE2 3.23Å; L372-Q384 HydrophobicContact CD2-CB 4.27Å; Q384-T428 PolarHBondContact NE2-OG1 2.79Å; Q384-T428 PolarHBondContact OE1-OG1 3.31Å; Q384-T449 WeakPolarHBondContact O-CA 3.4Å; Q384-G450 WeakPolarHBondContact CB-O 3.46Å; Q384-G450 PolarHBondContact N-O 3.31Å; Q384-G450 VanDerWaalsContact N-O 3.17Å; Q384-G450 PolarHBondContact O-N 3.46Å
385	Q	94.7	Very high	83.6	Confident	3 Å²	3	66.1 Å²	66.1	1%	0.014	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	133.7	176.9	-62	-169.5	33.4	0	0	111.8	S368 H371 L372 Y373 W504	S368-Q385 WeakPolarHBondContact CB-O 3.36Å; S368-Q385 PolarHBondContact OG-O 3.2Å; H371-Q385 PolarHBondContact O-N 2.91Å; L372-Q385 PolarHBondContact O-NE2 2.95Å; Y373-Q385 HydrophobicContact CD1-CG 4.17Å; Y373-Q385 HydrophobicContact CD2-CG 4.22Å; Y373-Q385 HydrophobicContact CE1-CG 4.21Å; Y373-Q385 HydrophobicContact CE2-CB 4.3Å; Y373-Q385 HydrophobicContact CE2-CG 4.28Å; Y373-Q385 HydrophobicContact CG-CG 4.15Å; Q385-W504 PolarHBondContact NE2-O 3.05Å
386	V	96.3	Very high	84.2	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	126.9	167.7	173.7	0	0	0	0	108.7	L366 H367 Y373 W398 L432 V448 V511	L366-V386 HydrophobicContact CD1-CG1 3.71Å; H367-V386 WeakPolarHBondContact O-CA 3.38Å; Y373-V386 PolarHBondContact OH-N 3.04Å; Y373-V386 PolarHBondContact OH-O 3.27Å; V386-W398 HydrophobicContact CG2-CH2 4.25Å; V386-L432 HydrophobicContact CG1-CD1 3.84Å; V386-L432 HydrophobicContact CG2-CD1 4.33Å; V386-V448 HydrophobicContact CB-CG1 4.16Å; V386-V448 HydrophobicContact CG1-CG1 3.92Å; V386-V511 HydrophobicContact CG1-CG1 4.34Å
387	T	95.4	Very high	85.2	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	179.5	-170.3	69	0	0	0	0	110.2	H367 L501 Q508 V509 V511	H367-T387 PolarHBondContact CD2-OG1 3.4Å; H367-T387 PolarHBondContact N-O 2.97Å; H367-T387 PolarHBondContact O-N 3.17Å; T387-L501 HydrophobicContact CG2-CD1 3.8Å; T387-Q508 HydrophobicContact CG2-CB 4.21Å; T387-Q508 PolarHBondContact OG1-OE1 2.8Å; T387-V509 CarbonylContact C-O 3.51Å; T387-V511 WeakPolarHBondContact O-CG2 3.16Å
388	A	93.6	Very high	85.9	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	113.6	163.3	0	0	0	0	0	109.5	Y365 V509 V511	Y365-A388 CarbonylContact O-C 3.58Å; Y365-A388 VanDerWaalsContact O-CA 3.23Å; Y365-A388 WeakPolarHBondContact O-CA 3.3Å; A388-V509 HydrophobicContact CB-CB 4.03Å; A388-V509 HydrophobicContact CB-CG1 4.39Å; A388-V509 PolarHBondContact N-O 3.17Å; A388-V509 WeakPolarHBondContact O-CB 3.39Å; A388-V509 PolarHBondContact O-N 3.2Å; A388-V511 HydrophobicContact CB-CG2 3.72Å
389	Y	90.6	Very high	86.9	Confident	67 Å²	67	55.1 Å²	55.1	26%	0.263	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	141.5	-179.1	-174.1	-129.4	0	0	0	111	G364 Y365 H367 H391 D393 Q508	G364-Y389 CarbonylContact C-O 3.57Å; G364-Y389 WeakPolarHBondContact CA-O 3.44Å; Y365-Y389 WeakPolarHBondContact CD2-O 3.47Å; Y365-Y389 PolarHBondContact N-O 2.86Å; Y365-Y389 PolarHBondContact O-N 3.38Å; H367-Y389 AromaticContact CE1-CD1 3.98Å; H367-Y389 AromaticContact ND1-CD1 3.88Å; Y389-H391 HydrophobicContact CD1-CB 4.34Å; Y389-H391 WeakPolarHBondContact CD1-O 3.46Å; Y389-H391 HydrophobicContact CE1-CB 3.76Å; Y389-H391 AromaticContact CE2-CD2 3.98Å; Y389-H391 AromaticContact CZ-CD2 3.75Å; Y389-D393 HydrophobicContact CD1-CB 4.17Å; Y389-D393 HydrophobicContact CE1-CB 4.15Å; Y389-Q508 HydrophobicContact CD2-CG 4Å
390	L	82.6	Confident	87.9	Confident	86 Å²	86	54.2 Å²	54.2	45%	0.45	25%	0.247	S	C	.	.	S	Bend	trans	-84.1	-12	-169.1	-64.9	176.3	0	0	0	114.5	A362	A362-L390 HydrophobicContact CB-CD2 4.22Å; A362-L390 WeakPolarHBondContact O-CD2 3.45Å
391	H	80.3	Confident	89.2	Confident	115 Å²	115	47.5 Å²	47.5	53%	0.532	22%	0.218	S	C	.	.	S	Bend	trans	-116.2	159.4	-176.6	-53.3	-79	0	0	0	111.2	Y365 Y389 N396	Y365-H391 VanDerWaalsContact CD2-O 3.31Å; Y365-H391 WeakPolarHBondContact CD2-O 3.15Å; Y389-H391 HydrophobicContact CD1-CB 4.34Å; Y389-H391 WeakPolarHBondContact CD1-O 3.46Å; Y389-H391 HydrophobicContact CE1-CB 3.76Å; Y389-H391 AromaticContact CE2-CD2 3.98Å; Y389-H391 AromaticContact CZ-CD2 3.75Å; H391-N396 PolarHBondContact O-ND2 2.89Å
392	K	78.8	Confident	90	Very high	65 Å²	65	45.6 Å²	45.6	28%	0.283	21%	0.208	S	C	.	.			trans	-73.8	127.3	172.2	-71.6	-159.6	177.1	-157.5	0	109.8	Y365 D529	Y365-K392 HydrophobicContact CE1-CD 4.46Å; Y365-K392 HydrophobicContact CE1-CG 3.94Å; Y365-K392 HydrophobicContact CE2-CG 3.91Å; Y365-K392 VanDerWaalsContact CZ-CG 3.46Å; Y365-K392 WeakPolarHBondContact OH-CE 3.32Å; Y365-K392 VanDerWaalsContact OH-CG 3.27Å; Y365-K392 WeakPolarHBondContact OH-CG 3.34Å; K392-D529 IonicContact NZ-OD1 3.08Å; K392-D529 PolarHBondContact NZ-OD1 3.36Å; K392-D529 IonicContact NZ-OD2 3.02Å; K392-D529 PolarHBondContact NZ-OD2 2.8Å
393	D	84.7	Confident	90	Very high	61 Å²	61	43.1 Å²	43.1	33%	0.326	20%	0.2	S	C	.	.			trans	-142.1	157.3	-178.8	-163.7	-62.7	0	0	0	108.7	Y389 N395 N396	Y389-D393 HydrophobicContact CD1-CB 4.17Å; Y389-D393 HydrophobicContact CE1-CB 4.15Å; D393-N395 PolarHBondContact O-N 2.75Å; D393-N395 WeakPolarHBondContact OD1-CB 3.39Å; D393-N395 PolarHBondContact OD1-N 3.3Å; D393-N395 PolarHBondContact OD1-ND2 3.27Å; D393-N396 PolarHBondContact N-ND2 3.35Å; D393-N396 VanDerWaalsContact N-ND2 3.13Å; D393-N396 VanDerWaalsContact O-CB 3.31Å; D393-N396 WeakPolarHBondContact O-CB 3.29Å; D393-N396 PolarHBondContact O-N 2.9Å
394	Y	88.1	Confident	89.3	Confident	185 Å²	185	48 Å²	48	73%	0.725	23%	0.227	S	C	*	.	G	3₁₀ helix	trans	-65	-30.2	171.5	-65.4	-74.1	0	0	0	111.7	N396 M397	Y394-N396 PolarHBondContact O-N 3.5Å; Y394-M397 WeakPolarHBondContact O-CB 3.24Å; Y394-M397 WeakPolarHBondContact O-CG 3.37Å; Y394-M397 PolarHBondContact O-N 3.48Å; Y394-M397 VanDerWaalsContact O-N 3.08Å
395	N	93.8	Very high	87.7	Confident	34 Å²	34	56.4 Å²	56.4	18%	0.182	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-69.4	9.5	171.9	-66.1	-85.1	0	0	0	114.2	H367 S368 D393 H425	H367-N395 WeakPolarHBondContact CA-O 3.5Å; H367-N395 PolarHBondContact ND1-O 2.92Å; S368-N395 PolarHBondContact N-O 3.12Å; S368-N395 WeakPolarHBondContact O-CB 3.45Å; S368-N395 PolarHBondContact O-OD1 2.87Å; D393-N395 PolarHBondContact O-N 2.75Å; D393-N395 WeakPolarHBondContact OD1-CB 3.39Å; D393-N395 PolarHBondContact OD1-N 3.3Å; D393-N395 PolarHBondContact OD1-ND2 3.27Å; N395-H425 WeakPolarHBondContact CA-NE2 3.35Å; N395-H425 PolarHBondContact O-NE2 3.37Å; N395-H425 VanDerWaalsContact O-NE2 3.16Å
396	N	94.1	Very high	85.9	Confident	1 Å²	1	62.1 Å²	62.1	1%	0.005	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-102.6	1.5	169.9	-56.7	-7.7	0	0	0	112.2	T355 Y365 H367 H391 D393 Y394	T355-N396 HydrophobicContact CG2-CB 4.36Å; Y365-N396 VanDerWaalsContact CB-ND2 3.28Å; Y365-N396 WeakPolarHBondContact CB-ND2 3.42Å; Y365-N396 WeakPolarHBondContact CD2-ND2 3.44Å; Y365-N396 HydrophobicContact CG-CB 4.4Å; Y365-N396 VanDerWaalsContact CG-ND2 3.29Å; H367-N396 PolarHBondContact ND1-OD1 2.94Å; H391-N396 PolarHBondContact O-ND2 2.89Å; D393-N396 PolarHBondContact N-ND2 3.35Å; D393-N396 VanDerWaalsContact N-ND2 3.13Å; D393-N396 VanDerWaalsContact O-CB 3.31Å; D393-N396 WeakPolarHBondContact O-CB 3.29Å; D393-N396 PolarHBondContact O-N 2.9Å; Y394-N396 PolarHBondContact O-N 3.5Å
397	M	94.4	Very high	83.9	Confident	28 Å²	28	68 Å²	68	14%	0.138	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	126	-176.6	-72	-167.5	142.4	0	0	112.5	T353 T355 Y394 H425 K426 I531	T353-M397 HydrophobicContact CG2-CB 3.94Å; T353-M397 HydrophobicContact CG2-CE 4.12Å; T353-M397 HydrophobicContact CG2-CG 4.11Å; T353-M397 HydrophobicContact CG2-SD 3.95Å; T355-M397 HydrophobicContact CG2-CG 4.43Å; Y394-M397 WeakPolarHBondContact O-CB 3.24Å; Y394-M397 WeakPolarHBondContact O-CG 3.37Å; Y394-M397 PolarHBondContact O-N 3.48Å; Y394-M397 VanDerWaalsContact O-N 3.08Å; M397-H425 PolarHBondContact O-CD2 3.45Å; M397-K426 HydrophobicContact CB-CB 3.85Å; M397-K426 HydrophobicContact CB-CD 3.86Å; M397-K426 HydrophobicContact CG-CD 4.43Å; M397-K426 WeakPolarHBondContact O-CB 3.28Å; M397-K426 PolarHBondContact O-N 3.39Å; M397-K426 HydrophobicContact SD-CD 3.7Å; M397-K426 PolarHBondContact SD-NZ 2.9Å; M397-I531 HydrophobicContact CE-CD1 3.67Å
398	W	95.2	Very high	82	Confident	1 Å²	1	75.5 Å²	75.5	0%	0.004	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	141	176	-60.9	80.4	0	0	0	110.6	T353 I354 L366 V386 L423 E424 H425 L432	T353-W398 CarbonylContact C-O 3.49Å; T353-W398 WeakPolarHBondContact CA-O 3.42Å; I354-W398 HydrophobicContact CG1-CB 4.44Å; I354-W398 WeakPolarHBondContact CG1-O 3.34Å; I354-W398 PolarHBondContact N-O 3.49Å; I354-W398 PolarHBondContact O-N 2.86Å; L366-W398 HydrophobicContact CD2-CD2 4.17Å; L366-W398 HydrophobicContact CD2-CZ2 3.99Å; L366-W398 HydrophobicContact CG-CZ2 3.77Å; L366-W398 PolarHBondContact O-NE1 2.93Å; V386-W398 HydrophobicContact CG2-CH2 4.25Å; W398-L423 HydrophobicContact CB-CD2 4.31Å; W398-L423 HydrophobicContact CE3-CB 3.97Å; W398-E424 CarbonylContact C-O 3.43Å; W398-E424 WeakPolarHBondContact CA-O 3.44Å; W398-H425 HydrophobicContact CD2-CB 4.38Å; W398-H425 HydrophobicContact CE3-CB 3.9Å; W398-H425 HydrophobicContact CH2-CB 3.86Å; W398-H425 HydrophobicContact CZ2-CB 4.32Å; W398-H425 HydrophobicContact CZ3-CB 3.64Å; W398-L432 HydrophobicContact CE3-CB 4.44Å; W398-L432 HydrophobicContact CH2-CB 4.36Å; W398-L432 HydrophobicContact CH2-CD1 3.99Å; W398-L432 HydrophobicContact CZ3-CB 3.79Å; W398-L432 HydrophobicContact CZ3-CD1 4.27Å
399	L	94.1	Very high	80.3	Confident	44 Å²	44	78.3 Å²	78.3	23%	0.23	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	128.4	178.2	-174.6	56.4	0	0	0	109.5	G351 S352 H401 E424	G351-L399 WeakPolarHBondContact O-CD1 3.31Å; S352-L399 WeakPolarHBondContact O-CD1 3.13Å; L399-H401 WeakPolarHBondContact CD2-NE2 3.27Å; L399-H401 WeakPolarHBondContact CG-NE2 3.34Å; L399-H401 PolarHBondContact O-N 3Å; L399-E424 PolarHBondContact N-O 3.23Å; L399-E424 PolarHBondContact O-N 3Å
400	V	93.7	Very high	79	Confident	0 Å²	0	84.2 Å²	84.2	0%	0	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	104.9	-175.6	-176.7	0	0	0	0	110.7	L348 Y350 G351 S352 I354 V415 I421 L423	L348-V400 HydrophobicContact CD1-CG2 4.18Å; Y350-V400 HydrophobicContact CD1-CG1 4.23Å; G351-V400 PolarHBondContact N-O 2.85Å; S352-V400 PolarHBondContact O-N 3.43Å; I354-V400 HydrophobicContact CD1-CG2 3.57Å; I354-V400 HydrophobicContact CG1-CG2 3.94Å; V400-V415 HydrophobicContact CG1-CG2 4.29Å; V400-I421 HydrophobicContact CG1-CB 4.14Å; V400-I421 HydrophobicContact CG1-CD1 4.26Å; V400-I421 HydrophobicContact CG1-CG2 3.96Å; V400-L423 HydrophobicContact CG2-CD2 3.95Å
401	H	89.9	Confident	78.4	Confident	67 Å²	67	84.6 Å²	84.6	31%	0.31	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	148.9	177.3	-77.3	-88.6	0	0	0	112.7	L399 I421 R422	L399-H401 WeakPolarHBondContact CD2-NE2 3.27Å; L399-H401 WeakPolarHBondContact CG-NE2 3.34Å; L399-H401 PolarHBondContact O-N 3Å; H401-I421 WeakPolarHBondContact O-CA 3.33Å; H401-R422 HydrophobicContact CB-CB 4.12Å; H401-R422 PolarHBondContact N-O 3.41Å; H401-R422 PolarHBondContact O-N 3.22Å
402	K	87.7	Confident	78.3	Confident	92 Å²	92	81 Å²	81	40%	0.4	42%	0.416	S	S	.	.			trans	-79.2	144.1	169	-155.7	168.4	-176.9	177	0	108.3	Y350 D404 D413	Y350-K402 HydrophobicContact CD1-CB 3.71Å; Y350-K402 HydrophobicContact CD1-CG 4.12Å; Y350-K402 HydrophobicContact CE1-CB 3.91Å; Y350-K402 HydrophobicContact CE1-CG 3.93Å; Y350-K402 HydrophobicContact CG-CB 4.34Å; K402-D404 VanDerWaalsContact C-N 3.35Å; K402-D413 IonicContact NZ-OD2 2.69Å; K402-D413 PolarHBondContact NZ-OD2 3.18Å
403	P	79.9	Confident	78.7	Confident	40 Å²	40	81.1 Å²	81.1	26%	0.26	42%	0.42	S	S	.	.	S	Bend	trans	-64.3	-39.6	-179.5	-25	36.1	0	0	0	113.1	I420 L462	P403-I420 WeakPolarHBondContact CD-O 3.3Å; P403-I420 HydrophobicContact CG-CB 3.95Å; P403-I420 HydrophobicContact CG-CG2 3.73Å; P403-I420 WeakPolarHBondContact CG-O 3.46Å; P403-L462 HydrophobicContact CB-CD2 3.88Å; P403-L462 HydrophobicContact CG-CD2 4.18Å
404	D	73.4	Confident	79	Confident	119 Å²	119	80.5 Å²	80.5	64%	0.636	42%	0.416	S	S	*	.	S	Bend	trans	-89.1	134.1	179.7	-54.7	-63.4	0	0	0	110.5	K402 D406	K402-D404 VanDerWaalsContact C-N 3.35Å; D404-D406 PolarHBondContact O-N 3.47Å
405	N	60.8	Low	79.2	Confident	176 Å²	176	71.7 Å²	71.7	94%	0.941	38%	0.381	S	S	*	.			trans	-83.6	42.5	-169.2	-156	37	0	0	0	112.7
406	D	56.4	Low	79.2	Confident	123 Å²	123	76 Å²	76	66%	0.658	40%	0.395	S	S	*	.			trans	-85.7	161	-169.3	-149.7	-23.5	0	0	0	112.9	D404	D404-D406 PolarHBondContact O-N 3.47Å
407	T	55.2	Low	79.1	Confident	125 Å²	125	77.5 Å²	77.5	77%	0.767	40%	0.402	S	S	*	.			trans	-49.7	140.6	-173.9	48.5	0	0	0	0	114.2	S409	T407-S409 PolarHBondContact O-N 2.7Å
408	Q	55.4	Low	78.9	Confident	157 Å²	157	77.3 Å²	77.3	73%	0.734	41%	0.407	S	S	*	.			trans	-68.8	98.7	178	-66.4	-170.1	27.2	0	0	110.6
409	S	58.3	Low	78.8	Confident	59 Å²	59	79.6 Å²	79.6	41%	0.413	42%	0.42	S	S	.	.			trans	-56.9	142.8	169.7	-172.3	0	0	0	0	111.2	T407 T411 R534	T407-S409 PolarHBondContact O-N 2.7Å; S409-T411 PolarHBondContact O-N 3.12Å; S409-T411 PolarHBondContact OG-N 2.98Å; S409-T411 PolarHBondContact OG-OG1 2.88Å; S409-R534 PolarHBondContact O-NH1 2.87Å
410	E	61.6	Low	78.8	Confident	191 Å²	191	79.9 Å²	79.9	89%	0.893	42%	0.421	S	S	*	.	S	Bend	trans	-64.1	-33.2	175	-61.8	-171.5	145	0	0	111.3
411	T	70.4	Confident	78.8	Confident	93 Å²	93	79.9 Å²	79.9	57%	0.571	42%	0.421	S	S	*	.	S	Bend	trans	-86.6	131.4	174.3	58.4	0	0	0	0	110.9	S409 D413	S409-T411 PolarHBondContact O-N 3.12Å; S409-T411 PolarHBondContact OG-N 2.98Å; S409-T411 PolarHBondContact OG-OG1 2.88Å; T411-D413 PolarHBondContact O-N 2.96Å
412	P	78.9	Confident	79	Confident	40 Å²	40	78.6 Å²	78.6	26%	0.26	41%	0.413	S	S	.	.			trans	-69.7	111.5	177.4	27.3	-33.2	0	0	0	111.8	A349 L414 R534 L535	A349-P412 HydrophobicContact CB-CB 4.4Å; P412-L414 PolarHBondContact O-N 3.46Å; P412-R534 HydrophobicContact CB-CB 4.27Å; P412-R534 HydrophobicContact CG-CB 4.38Å; P412-L535 HydrophobicContact CB-CD2 3.96Å; P412-L535 HydrophobicContact CB-CG 4.43Å; P412-L535 HydrophobicContact CG-CD2 3.49Å; P412-L535 VanDerWaalsContact CG-CD2 3.49Å; P412-L535 HydrophobicContact CG-CG 4.3Å
413	D	87.5	Confident	79.3	Confident	67 Å²	67	74.2 Å²	74.2	36%	0.358	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-59.4	122.2	172.4	-89.9	-12.7	0	0	0	110.6	A349 Y350 K402 T411	A349-D413 CarbonylContact C-O 3.06Å; A349-D413 WeakPolarHBondContact CA-O 3.43Å; A349-D413 VanDerWaalsContact CB-O 3.28Å; A349-D413 WeakPolarHBondContact CB-O 3.11Å; Y350-D413 HydrophobicContact CD2-CB 3.73Å; Y350-D413 HydrophobicContact CE2-CB 4.45Å; Y350-D413 PolarHBondContact N-O 3.4Å; K402-D413 IonicContact NZ-OD2 2.69Å; K402-D413 PolarHBondContact NZ-OD2 3.18Å; T411-D413 PolarHBondContact O-N 2.96Å
414	L	90.9	Very high	79.9	Confident	48 Å²	48	73.1 Å²	73.1	25%	0.251	39%	0.386	S	S	.	.	B	Isolated β-bridge	trans	-88.8	138.8	176.7	-55.4	-175.7	0	0	0	111.8	Y347 L348 A349 P412 L475 L535	Y347-L414 HydrophobicContact CG-CD1 4.36Å; L348-L414 CarbonylContact O-C 3.57Å; L348-L414 WeakPolarHBondContact O-CA 3.5Å; A349-L414 HydrophobicContact CB-CD2 3.98Å; P412-L414 PolarHBondContact O-N 3.46Å; L414-L475 HydrophobicContact CB-CD2 3.61Å; L414-L475 HydrophobicContact CD1-CD1 4.23Å; L414-L475 HydrophobicContact CD1-CD2 3.87Å; L414-L475 HydrophobicContact CG-CD2 4.41Å; L414-L535 HydrophobicContact CD2-CD2 4.03Å
415	V	91.8	Very high	81	Confident	0 Å²	0	67.5 Å²	67.5	0%	0	36%	0.355	C	S	.	.	P	Polyproline II helix	trans	-80.9	134.4	179.9	-175.1	0	0	0	0	111	L348 Y350 V400 D419 I421 V465 V476	L348-V415 HydrophobicContact CB-CB 4.25Å; L348-V415 HydrophobicContact CB-CG2 4.46Å; L348-V415 HydrophobicContact CD2-CB 3.89Å; L348-V415 HydrophobicContact CD2-CG1 4.12Å; L348-V415 HydrophobicContact CD2-CG2 3.87Å; L348-V415 HydrophobicContact CG-CB 4.09Å; L348-V415 HydrophobicContact CG-CG2 3.87Å; L348-V415 PolarHBondContact O-N 2.97Å; Y350-V415 HydrophobicContact CD1-CG2 4.48Å; Y350-V415 HydrophobicContact CD2-CG2 3.9Å; Y350-V415 HydrophobicContact CE1-CG2 4.39Å; Y350-V415 HydrophobicContact CE2-CG2 3.79Å; Y350-V415 HydrophobicContact CG-CG2 4.27Å; V400-V415 HydrophobicContact CG1-CG2 4.29Å; V415-D419 HydrophobicContact CG1-CB 4.36Å; V415-I421 HydrophobicContact CG1-CG2 4.11Å; V415-V465 HydrophobicContact CG1-CG2 4.29Å; V415-V476 HydrophobicContact CG1-CG2 4.21Å; V415-V476 PolarHBondContact O-N 3.49Å; V415-V476 VanDerWaalsContact O-N 3.08Å
416	R	93.1	Very high	82.5	Confident	125 Å²	125	64.1 Å²	64.1	47%	0.472	33%	0.332	S	S	.	.	B	Isolated β-bridge	trans	-120.2	161.2	-175.6	-56.7	169.8	-169.4	-120.9	7.2	112.3	G418 D419 D474 L475	R416-G418 PolarHBondContact O-N 2.84Å; R416-D419 WeakPolarHBondContact CA-OD2 3.34Å; R416-D419 WeakPolarHBondContact CB-OD2 3.41Å; R416-D419 PolarHBondContact N-OD2 3.14Å; R416-D419 WeakPolarHBondContact O-CB 3.32Å; R416-D419 PolarHBondContact O-N 3.4Å; R416-D419 VanDerWaalsContact O-N 3.16Å; R416-D474 CarbonylContact C-O 3.54Å; R416-D474 VanDerWaalsContact CA-O 3.27Å; R416-D474 WeakPolarHBondContact CA-O 3Å; R416-L475 HydrophobicContact CG-CD2 3.96Å
417	H	92.6	Very high	84.2	Confident	33 Å²	33	63.1 Å²	63.1	15%	0.153	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	120.9	167.7	176.7	121.5	0	0	0	109.9	V467 G470 R471 G473 D474	H417-V467 HydrophobicContact CB-CB 4.16Å; H417-V467 HydrophobicContact CB-CG2 4Å; H417-V467 PolarHBondContact CE1-O 3.48Å; H417-V467 PolarHBondContact ND1-N 2.95Å; H417-V467 VanDerWaalsContact ND1-N 3.15Å; H417-V467 PolarHBondContact ND1-O 3.43Å; H417-G470 PolarHBondContact CE1-O 3.23Å; H417-R471 WeakPolarHBondContact CB-O 3.36Å; H417-G473 PolarHBondContact O-N 3.12Å; H417-D474 HydrophobicContact CB-CB 4.39Å; H417-D474 PolarHBondContact N-O 2.86Å
418	G	90.8	Very high	86	Confident	24 Å²	24	57.3 Å²	57.3	25%	0.247	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	103.6	-10.8	178.6	0	0	0	0	0	114.3	R416 Q464 V465	R416-G418 PolarHBondContact O-N 2.84Å; G418-Q464 PolarHBondContact O-NE2 3.48Å; G418-V465 PolarHBondContact N-O 3.23Å
419	D	93.3	Very high	87.7	Confident	48 Å²	48	52 Å²	52	26%	0.257	27%	0.267	S	S	.	.			trans	-72	156.8	-179.5	-66.2	-8.3	0	0	0	111.9	V415 R416 Q464 V465	V415-D419 HydrophobicContact CG1-CB 4.36Å; R416-D419 WeakPolarHBondContact CA-OD2 3.34Å; R416-D419 WeakPolarHBondContact CB-OD2 3.41Å; R416-D419 PolarHBondContact N-OD2 3.14Å; R416-D419 WeakPolarHBondContact O-CB 3.32Å; R416-D419 PolarHBondContact O-N 3.4Å; R416-D419 VanDerWaalsContact O-N 3.16Å; D419-Q464 CarbonylContact O-C 3.6Å; D419-Q464 WeakPolarHBondContact O-CA 3.46Å; D419-V465 PolarHBondContact O-N 3.27Å
420	I	93.4	Very high	89.3	Confident	51 Å²	51	51.6 Å²	51.6	26%	0.262	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	135.9	174.8	-53.7	175.7	0	0	0	108.4	Y350 P403 L462 W463 Q464 K488	Y350-I420 PolarHBondContact OH-O 3.18Å; Y350-I420 VanDerWaalsContact OH-O 3.12Å; P403-I420 WeakPolarHBondContact CD-O 3.3Å; P403-I420 HydrophobicContact CG-CB 3.95Å; P403-I420 HydrophobicContact CG-CG2 3.73Å; P403-I420 WeakPolarHBondContact CG-O 3.46Å; I420-L462 HydrophobicContact CG2-CB 4.06Å; I420-L462 HydrophobicContact CG2-CD2 4.35Å; I420-W463 WeakPolarHBondContact CA-O 3.27Å; I420-Q464 HydrophobicContact CG1-CB 4.42Å; I420-Q464 HydrophobicContact CG1-CG 4.36Å; I420-K488 HydrophobicContact CD1-CD 4.31Å; I420-K488 HydrophobicContact CD1-CG 4.42Å
421	I	93.6	Very high	90.9	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	162.5	176.4	69.9	170.7	0	0	0	110.4	Y350 V400 H401 V415 L423 W463 V465 F485	Y350-I421 HydrophobicContact CE1-CG2 3.83Å; V400-I421 HydrophobicContact CG1-CB 4.14Å; V400-I421 HydrophobicContact CG1-CD1 4.26Å; V400-I421 HydrophobicContact CG1-CG2 3.96Å; H401-I421 WeakPolarHBondContact O-CA 3.33Å; V415-I421 HydrophobicContact CG1-CG2 4.11Å; I421-L423 HydrophobicContact CD1-CD1 4.2Å; I421-L423 HydrophobicContact CD1-CD2 3.73Å; I421-L423 HydrophobicContact CD1-CG 3.74Å; I421-L423 HydrophobicContact CG1-CG 4.41Å; I421-W463 HydrophobicContact CG1-CB 4.4Å; I421-W463 PolarHBondContact N-O 2.95Å; I421-W463 PolarHBondContact O-N 2.79Å; I421-V465 HydrophobicContact CB-CG2 4.41Å; I421-V465 HydrophobicContact CD1-CG2 3.6Å; I421-V465 HydrophobicContact CG1-CG2 3.73Å; I421-V465 HydrophobicContact CG2-CG2 3.82Å; I421-F485 HydrophobicContact CD1-CD1 4.18Å; I421-F485 HydrophobicContact CD1-CE1 3.9Å
422	R	93.1	Very high	92.1	Very high	40 Å²	40	38.1 Å²	38.1	15%	0.151	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	138.4	158.7	177.4	-175.3	-72	176.5	-2.9	107.8	H401 N431 G455 D461	H401-R422 HydrophobicContact CB-CB 4.12Å; H401-R422 PolarHBondContact N-O 3.41Å; H401-R422 PolarHBondContact O-N 3.22Å; R422-N431 WeakPolarHBondContact CD-OD1 3.3Å; R422-N431 HydrophobicContact CG-CB 4.37Å; R422-G455 PolarHBondContact NH1-O 3.38Å; R422-D461 HydrophobicContact CG-CB 4.43Å
423	L	94.3	Very high	92.8	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	110.3	175.5	-71.9	171.7	0	0	0	108.5	I354 W398 V400 I421 N431 L432 F485	I354-L423 HydrophobicContact CD1-CD2 4.27Å; W398-L423 HydrophobicContact CB-CD2 4.31Å; W398-L423 HydrophobicContact CE3-CB 3.97Å; V400-L423 HydrophobicContact CG2-CD2 3.95Å; I421-L423 HydrophobicContact CD1-CD1 4.2Å; I421-L423 HydrophobicContact CD1-CD2 3.73Å; I421-L423 HydrophobicContact CD1-CG 3.74Å; I421-L423 HydrophobicContact CG1-CG 4.41Å; L423-N431 CarbonylContact O-C 3.42Å; L423-N431 WeakPolarHBondContact O-CA 3.5Å; L423-L432 HydrophobicContact CB-CB 4.02Å; L423-L432 HydrophobicContact CB-CD2 4.43Å; L423-L432 HydrophobicContact CD1-CD2 3.83Å; L423-L432 PolarHBondContact O-N 2.77Å; L423-F485 HydrophobicContact CD1-CD1 4.27Å; L423-F485 HydrophobicContact CD1-CE1 4.17Å
424	E	94.2	Very high	93.1	Very high	16 Å²	16	33.4 Å²	33.4	8%	0.075	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	129.7	175.7	-167.8	175.8	132.6	0	0	110	W398 L399 K426 T429 R430 G455	W398-E424 CarbonylContact C-O 3.43Å; W398-E424 WeakPolarHBondContact CA-O 3.44Å; L399-E424 PolarHBondContact N-O 3.23Å; L399-E424 PolarHBondContact O-N 3Å; E424-K426 PolarHBondContact O-N 2.84Å; E424-T429 WeakPolarHBondContact OE1-CA 3.48Å; E424-T429 VanDerWaalsContact OE1-CB 3.28Å; E424-T429 WeakPolarHBondContact OE1-CB 3.5Å; E424-R430 CarbonylContact C-O 3.55Å; E424-G455 PolarHBondContact OE2-N 2.91Å
425	H	95.1	Very high	93.2	Very high	1 Å²	1	32 Å²	32	1%	0.005	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	120.7	177.2	-179.1	-120.4	0	0	0	110.3	S368 N395 M397 W398 E427 T428 T429 R430	S368-H425 PolarHBondContact O-CE1 3.11Å; S368-H425 PolarHBondContact O-NE2 3.21Å; N395-H425 WeakPolarHBondContact CA-NE2 3.35Å; N395-H425 PolarHBondContact O-NE2 3.37Å; N395-H425 VanDerWaalsContact O-NE2 3.16Å; M397-H425 PolarHBondContact O-CD2 3.45Å; W398-H425 HydrophobicContact CD2-CB 4.38Å; W398-H425 HydrophobicContact CE3-CB 3.9Å; W398-H425 HydrophobicContact CH2-CB 3.86Å; W398-H425 HydrophobicContact CZ2-CB 4.32Å; W398-H425 HydrophobicContact CZ3-CB 3.64Å; H425-E427 PolarHBondContact O-N 3.23Å; H425-T428 PolarHBondContact ND1-OG1 3.44Å; H425-T428 PolarHBondContact O-N 3.39Å; H425-T429 WeakPolarHBondContact O-CA 3.4Å; H425-T429 PolarHBondContact O-N 3.23Å; H425-R430 PolarHBondContact N-O 2.84Å
426	K	92.8	Very high	93.2	Very high	105 Å²	105	38 Å²	38	46%	0.457	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-38	-166	-174.8	-178.9	174.6	-175.8	0	114.3	T353 M397 E424	T353-K426 HydrophobicContact CG2-CD 4Å; M397-K426 HydrophobicContact CB-CB 3.85Å; M397-K426 HydrophobicContact CB-CD 3.86Å; M397-K426 HydrophobicContact CG-CD 4.43Å; M397-K426 WeakPolarHBondContact O-CB 3.28Å; M397-K426 PolarHBondContact O-N 3.39Å; M397-K426 HydrophobicContact SD-CD 3.7Å; M397-K426 PolarHBondContact SD-NZ 2.9Å; E424-K426 PolarHBondContact O-N 2.84Å
427	E	92.7	Very high	93.1	Very high	102 Å²	102	36 Å²	36	48%	0.477	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-31.9	-175.3	-168.9	64.1	-164.6	0	0	112.5	W370 H425	W370-E427 VanDerWaalsContact CZ2-O 3.26Å; W370-E427 WeakPolarHBondContact CZ2-O 3.38Å; H425-E427 PolarHBondContact O-N 3.23Å
428	T	91.9	Very high	93.1	Very high	3 Å²	3	39.8 Å²	39.8	2%	0.018	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.2	-1.6	-174.2	66.7	0	0	0	0	114.4	W370 Q384 H425 R430	W370-T428 HydrophobicContact CD2-CG2 3.58Å; W370-T428 HydrophobicContact CE3-CG2 3.9Å; W370-T428 HydrophobicContact CG-CG2 4.07Å; W370-T428 HydrophobicContact CH2-CG2 4.08Å; W370-T428 HydrophobicContact CZ2-CG2 3.78Å; W370-T428 HydrophobicContact CZ3-CG2 4.14Å; Q384-T428 PolarHBondContact NE2-OG1 2.79Å; Q384-T428 PolarHBondContact OE1-OG1 3.31Å; H425-T428 PolarHBondContact ND1-OG1 3.44Å; H425-T428 PolarHBondContact O-N 3.39Å; T428-R430 WeakPolarHBondContact O-CG 3.45Å; T428-R430 PolarHBondContact O-N 2.99Å
429	T	92.4	Very high	93.2	Very high	47 Å²	47	38.7 Å²	38.7	29%	0.288	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.2	31.5	-179.3	65.4	0	0	0	0	114.1	E424 H425 I453 N454	E424-T429 WeakPolarHBondContact OE1-CA 3.48Å; E424-T429 VanDerWaalsContact OE1-CB 3.28Å; E424-T429 WeakPolarHBondContact OE1-CB 3.5Å; H425-T429 WeakPolarHBondContact O-CA 3.4Å; H425-T429 PolarHBondContact O-N 3.23Å; T429-I453 CarbonylContact O-C 3.59Å; T429-I453 VanDerWaalsContact O-CA 3.29Å; T429-I453 WeakPolarHBondContact O-CA 3.43Å; T429-N454 PolarHBondContact O-N 3.43Å; T429-N454 PolarHBondContact OG1-N 2.81Å
430	R	92.2	Very high	93	Very high	50 Å²	50	37 Å²	37	19%	0.189	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	141	-177.4	-61.2	-142.3	-169.1	175.7	2.2	112.1	E424 H425 T428 G450 Y451 G452	E424-R430 CarbonylContact C-O 3.55Å; H425-R430 PolarHBondContact N-O 2.84Å; T428-R430 WeakPolarHBondContact O-CG 3.45Å; T428-R430 PolarHBondContact O-N 2.99Å; R430-G450 WeakPolarHBondContact CD-O 3.47Å; R430-G450 PolarHBondContact NH1-O 3.05Å; R430-Y451 CarbonylContact C-O 3.48Å; R430-G452 WeakPolarHBondContact CD-O 3.26Å; R430-G452 WeakPolarHBondContact CG-O 3.29Å
431	N	93.7	Very high	92.9	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	144.1	177.4	-54.7	-29	0	0	0	111.2	R422 L423 H433 G450 Y451 T456 D461	R422-N431 WeakPolarHBondContact CD-OD1 3.3Å; R422-N431 HydrophobicContact CG-CB 4.37Å; L423-N431 CarbonylContact O-C 3.42Å; L423-N431 WeakPolarHBondContact O-CA 3.5Å; N431-H433 PolarHBondContact O-N 2.81Å; N431-G450 WeakPolarHBondContact O-CA 3.31Å; N431-Y451 PolarHBondContact N-O 2.98Å; N431-Y451 PolarHBondContact O-N 3.1Å; N431-T456 PolarHBondContact ND2-O 3.19Å; N431-D461 HydrophobicContact CB-CB 3.8Å; N431-D461 VanDerWaalsContact CB-CG 3.45Å; N431-D461 PolarHBondContact ND2-OD2 2.83Å
432	L	95.5	Very high	92.9	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	115.1	164.5	-175.1	70.4	0	0	0	109.2	L366 V386 W398 L423 V448 W463 L494	L366-L432 HydrophobicContact CD1-CD1 4.42Å; L366-L432 HydrophobicContact CD2-CD1 4.3Å; L366-L432 HydrophobicContact CD2-CD2 4.11Å; V386-L432 HydrophobicContact CG1-CD1 3.84Å; V386-L432 HydrophobicContact CG2-CD1 4.33Å; W398-L432 HydrophobicContact CE3-CB 4.44Å; W398-L432 HydrophobicContact CH2-CB 4.36Å; W398-L432 HydrophobicContact CH2-CD1 3.99Å; W398-L432 HydrophobicContact CZ3-CB 3.79Å; W398-L432 HydrophobicContact CZ3-CD1 4.27Å; L423-L432 HydrophobicContact CB-CB 4.02Å; L423-L432 HydrophobicContact CB-CD2 4.43Å; L423-L432 HydrophobicContact CD1-CD2 3.83Å; L423-L432 PolarHBondContact O-N 2.77Å; L432-V448 HydrophobicContact CD1-CG1 3.53Å; L432-V448 HydrophobicContact CG-CG1 4.33Å; L432-W463 HydrophobicContact CD2-CD2 4.23Å; L432-W463 HydrophobicContact CD2-CZ2 4.02Å; L432-W463 HydrophobicContact CG-CZ2 3.92Å; L432-W463 PolarHBondContact O-NE1 3.1Å; L432-L494 HydrophobicContact CD2-CD1 4.36Å; L432-L494 HydrophobicContact CD2-CD2 4.04Å
433	H	94.4	Very high	92.7	Very high	9 Å²	9	41.3 Å²	41.3	4%	0.042	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	150.8	-170.1	-173.7	88.5	0	0	0	111.3	N431 H435 V448 T449 Y451 D458 D461	N431-H433 PolarHBondContact O-N 2.81Å; H433-H435 AromaticContact CD2-ND1 3.38Å; H433-H435 PolarHBondContact CD2-ND1 3.37Å; H433-H435 AromaticContact NE2-ND1 3.72Å; H433-V448 VanDerWaalsContact O-CA 3.31Å; H433-V448 WeakPolarHBondContact O-CA 3.47Å; H433-T449 PolarHBondContact N-O 2.89Å; H433-T449 PolarHBondContact O-N 2.92Å; H433-Y451 AromaticContact CE1-CD1 3.65Å; H433-Y451 AromaticContact CE1-CG 3.97Å; H433-Y451 AromaticContact ND1-CD1 3.67Å; H433-Y451 AromaticContact ND1-CG 3.92Å; H433-D458 IonicContact CE1-OD1 3.5Å; H433-D458 IonicContact CE1-OD2 3.84Å; H433-D458 IonicContact ND1-OD1 3.67Å; H433-D461 WeakPolarHBondContact CB-OD1 3.23Å; H433-D461 IonicContact CE1-OD1 3.91Å; H433-D461 IonicContact CG-OD1 3.49Å; H433-D461 IonicContact ND1-OD1 2.77Å; H433-D461 PolarHBondContact ND1-OD1 2.8Å
434	S	94.3	Very high	92.7	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	139.2	170.2	-166.4	0	0	0	0	113.2	Q447 N460 H487 C513	S434-Q447 PolarHBondContact OG-O 3.46Å; S434-N460 PolarHBondContact N-O 2.81Å; S434-H487 PolarHBondContact O-CE1 3.11Å; S434-H487 PolarHBondContact O-NE2 3.41Å; S434-C513 VanDerWaalsContact OG-CB 3.23Å; S434-C513 WeakPolarHBondContact OG-CB 3.44Å
435	H	92	Very high	92.7	Very high	19 Å²	19	48.9 Å²	48.9	9%	0.088	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	164.2	-170.3	52.4	-100.5	0	0	0	111.4	Q383 H433 H437 Q447	Q383-H435 PolarHBondContact OE1-CE1 3.28Å; Q383-H435 PolarHBondContact OE1-ND1 3.22Å; H433-H435 AromaticContact CD2-ND1 3.38Å; H433-H435 PolarHBondContact CD2-ND1 3.37Å; H433-H435 AromaticContact NE2-ND1 3.72Å; H435-H437 AromaticContact CD2-CD2 3.39Å; H435-H437 PolarHBondContact CD2-CD2 2.91Å; H435-H437 AromaticContact CD2-CG 3.81Å; H435-H437 AromaticContact NE2-CD2 3.86Å; H435-H437 PolarHBondContact O-N 3.32Å; H435-Q447 PolarHBondContact NE2-OE1 3.32Å
436	L	91.1	Very high	92.7	Very high	124 Å²	124	51.1 Å²	51.1	65%	0.649	24%	0.241	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-70.2	16.1	-170.7	-64.2	174	0	0	0	116.3	F446 T490	L436-F446 HydrophobicContact CB-CE1 4.4Å; L436-F446 HydrophobicContact CD2-CD1 4.16Å; L436-F446 HydrophobicContact CD2-CE1 3.58Å; L436-F446 HydrophobicContact CD2-CE2 4.23Å; L436-F446 HydrophobicContact CD2-CZ 3.62Å; L436-T490 HydrophobicContact CD2-CG2 3.59Å; L436-T490 HydrophobicContact CG-CG2 3.99Å
437	H	91.8	Very high	92.8	Very high	84 Å²	84	46.2 Å²	46.2	39%	0.389	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	148.1	170.2	-64.2	-68.5	0	0	0	110.9	A379 H435 F446 Q447	A379-H437 VanDerWaalsContact CA-CD2 3.46Å; A379-H437 WeakPolarHBondContact CA-CD2 3.39Å; H435-H437 AromaticContact CD2-CD2 3.39Å; H435-H437 PolarHBondContact CD2-CD2 2.91Å; H435-H437 AromaticContact CD2-CG 3.81Å; H435-H437 AromaticContact NE2-CD2 3.86Å; H435-H437 PolarHBondContact O-N 3.32Å; H437-F446 CarbonylContact O-C 3.53Å; H437-F446 WeakPolarHBondContact O-CA 3.47Å; H437-Q447 PolarHBondContact O-N 2.88Å
438	Q	92.8	Very high	93	Very high	113 Å²	113	41.4 Å²	41.4	53%	0.528	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	142	-177.9	-63.5	178.1	4.2	0	0	112.2	K443	Q438-K443 HydrophobicContact CB-CD 4.1Å
439	A	92.6	Very high	93.1	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	20%	0.196	C	C	.	.	P	Polyproline II helix	trans	-61.6	159.2	176.9	0	0	0	0	0	113.5	L441 K443 H445 T512	A439-L441 PolarHBondContact O-N 3.46Å; A439-K443 WeakPolarHBondContact O-CD 3.26Å; A439-K443 WeakPolarHBondContact O-CE 3.34Å; A439-K443 PolarHBondContact O-NZ 3.33Å; A439-H445 HydrophobicContact CB-CB 4.44Å; A439-H445 PolarHBondContact N-O 3.27Å; A439-T512 HydrophobicContact CB-CG2 3.58Å
440	P	89.6	Confident	93.1	Very high	12 Å²	12	39.1 Å²	39.1	8%	0.078	18%	0.183	C	C	.	.	S	Bend	trans	-55.6	-46.4	-175.4	-28.7	36.5	0	0	0	115	Y373 V377 K443 L501 W504 E510	Y373-P440 HydrophobicContact CD1-CG 4.19Å; Y373-P440 HydrophobicContact CE1-CG 3.69Å; V377-P440 HydrophobicContact CG1-CB 3.71Å; V377-P440 HydrophobicContact CG1-CG 3.97Å; P440-K443 WeakPolarHBondContact O-CE 3.3Å; P440-K443 PolarHBondContact O-NZ 3.14Å; P440-L501 HydrophobicContact CB-CD2 4.28Å; P440-W504 HydrophobicContact CB-CH2 3.79Å; P440-W504 HydrophobicContact CB-CZ2 4.02Å; P440-W504 HydrophobicContact CG-CH2 4.01Å; P440-E510 WeakPolarHBondContact CD-OE1 3.44Å
441	L	91	Very high	93	Very high	60 Å²	60	40.8 Å²	40.8	31%	0.314	19%	0.19	S	C	.	.	S	Bend	trans	-118.3	-25.9	-177.1	-54.8	178.5	0	0	0	113	A439 K499 T500 L501 E510	A439-L441 PolarHBondContact O-N 3.46Å; L441-K499 HydrophobicContact CB-CD 3.72Å; L441-K499 HydrophobicContact CD1-CB 3.83Å; L441-K499 HydrophobicContact CD1-CD 4.24Å; L441-K499 PolarHBondContact O-NZ 3.46Å; L441-T500 WeakPolarHBondContact CD1-O 3.24Å; L441-L501 HydrophobicContact CD1-CD2 4.04Å; L441-L501 HydrophobicContact CG-CD2 4.25Å; L441-E510 WeakPolarHBondContact CA-OE1 3.43Å; L441-E510 PolarHBondContact N-OE1 2.92Å
442	T	92.9	Very high	92.6	Very high	19 Å²	19	41.4 Å²	41.4	12%	0.117	20%	0.196	C	C	.	.			trans	-105.9	72	-177.6	-56.6	0	0	0	0	110.9	K444 H445 S497 K499 E510	T442-K444 PolarHBondContact O-N 3.31Å; T442-H445 HydrophobicContact CG2-CB 4.21Å; T442-H445 PolarHBondContact O-N 3.16Å; T442-S497 PolarHBondContact OG1-OG 3.06Å; T442-K499 WeakPolarHBondContact OG1-CE 3.21Å; T442-K499 PolarHBondContact OG1-NZ 3.46Å; T442-E510 VanDerWaalsContact CB-OE2 3.32Å; T442-E510 WeakPolarHBondContact CB-OE2 3.39Å; T442-E510 PolarHBondContact N-OE1 2.89Å; T442-E510 PolarHBondContact N-OE2 3.38Å; T442-E510 PolarHBondContact OG1-OE2 2.81Å
443	K	90.4	Very high	91.8	Very high	103 Å²	103	46 Å²	46	45%	0.448	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-12.5	-172.5	-57.5	-66.1	166.3	-161.7	0	116.7	Q438 A439 P440	Q438-K443 HydrophobicContact CB-CD 4.1Å; A439-K443 WeakPolarHBondContact O-CD 3.26Å; A439-K443 WeakPolarHBondContact O-CE 3.34Å; A439-K443 PolarHBondContact O-NZ 3.33Å; P440-K443 WeakPolarHBondContact O-CE 3.3Å; P440-K443 PolarHBondContact O-NZ 3.14Å
444	K	92.6	Very high	90.6	Very high	158 Å²	158	51.5 Å²	51.5	69%	0.687	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.1	-6.6	172.2	-64.2	-170.8	177.1	-173.7	0	113.9	T442 Y516	T442-K444 PolarHBondContact O-N 3.31Å; K444-Y516 HydrophobicContact CB-CE2 4.42Å
445	H	94.8	Very high	89.1	Confident	17 Å²	17	53.3 Å²	53.3	8%	0.079	27%	0.268	C	S	.	.	S	Bend	trans	-112.9	160.7	176.9	-65.1	-174.4	0	0	0	110.2	A439 T442 Y495 T512 S514 Y516	A439-H445 HydrophobicContact CB-CB 4.44Å; A439-H445 PolarHBondContact N-O 3.27Å; T442-H445 HydrophobicContact CG2-CB 4.21Å; T442-H445 PolarHBondContact O-N 3.16Å; H445-Y495 AromaticContact CE1-CD1 3.59Å; H445-Y495 AromaticContact CE1-CE1 3.78Å; H445-Y495 AromaticContact ND1-CD1 3.97Å; H445-T512 HydrophobicContact CB-CG2 4.28Å; H445-T512 PolarHBondContact ND1-OG1 2.83Å; H445-S514 PolarHBondContact CD2-OG 2.79Å; H445-S514 VanDerWaalsContact CE1-CB 3.5Å; H445-S514 WeakPolarHBondContact CE1-CB 3.45Å; H445-S514 PolarHBondContact CE1-OG 2.93Å; H445-S514 VanDerWaalsContact CE1-OG 3.25Å; H445-S514 PolarHBondContact NE2-OG 3.45Å; H445-Y516 AromaticContact NE2-CD2 3.89Å
446	F	95.4	Very high	88.3	Confident	49 Å²	49	56.6 Å²	56.6	22%	0.215	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	151.7	173.5	-58.2	-59.8	0	0	0	111.7	L436 H437 C492 T512 C513 P515	L436-F446 HydrophobicContact CB-CE1 4.4Å; L436-F446 HydrophobicContact CD2-CD1 4.16Å; L436-F446 HydrophobicContact CD2-CE1 3.58Å; L436-F446 HydrophobicContact CD2-CE2 4.23Å; L436-F446 HydrophobicContact CD2-CZ 3.62Å; H437-F446 CarbonylContact O-C 3.53Å; H437-F446 WeakPolarHBondContact O-CA 3.47Å; F446-C492 HydrophobicContact CD2-CB 3.97Å; F446-C492 HydrophobicContact CE2-CB 4.4Å; F446-T512 WeakPolarHBondContact O-CA 3.46Å; F446-C513 HydrophobicContact CB-CB 4.28Å; F446-C513 PolarHBondContact N-O 3.02Å; F446-C513 PolarHBondContact O-N 3.05Å; F446-P515 HydrophobicContact CE2-CB 4.28Å
447	Q	94.8	Very high	87.5	Confident	2 Å²	2	52.5 Å²	52.5	1%	0.009	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	149.3	175	-169.3	178	18.9	0	0	110.7	V377 S434 H435 H437 T449	V377-Q447 PolarHBondContact O-NE2 3.28Å; S434-Q447 PolarHBondContact OG-O 3.46Å; H435-Q447 PolarHBondContact NE2-OE1 3.32Å; H437-Q447 PolarHBondContact O-N 2.88Å; Q447-T449 HydrophobicContact CG-CG2 3.79Å
448	V	95.9	Very high	87.3	Confident	1 Å²	1	51.3 Å²	51.3	1%	0.006	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	138.8	171.8	174.3	0	0	0	0	107.5	Y373 V386 L432 H433 W463 L494 V511 C513	Y373-V448 PolarHBondContact OH-O 3.22Å; V386-V448 HydrophobicContact CB-CG1 4.16Å; V386-V448 HydrophobicContact CG1-CG1 3.92Å; L432-V448 HydrophobicContact CD1-CG1 3.53Å; L432-V448 HydrophobicContact CG-CG1 4.33Å; H433-V448 VanDerWaalsContact O-CA 3.31Å; H433-V448 WeakPolarHBondContact O-CA 3.47Å; V448-W463 HydrophobicContact CG2-CH2 4.44Å; V448-L494 HydrophobicContact CG1-CD1 4.07Å; V448-L494 HydrophobicContact CG2-CD1 4.05Å; V448-V511 HydrophobicContact CB-CG1 4.27Å; V448-V511 HydrophobicContact CG1-CG1 4.19Å; V448-C513 HydrophobicContact CG2-CB 3.78Å
449	T	94.6	Very high	87.1	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	171.3	-169.5	61.5	0	0	0	0	111.7	Y373 Q383 Q384 H433 Q447	Y373-T449 HydrophobicContact CD2-CG2 3.97Å; Y373-T449 HydrophobicContact CE2-CG2 3.73Å; Q383-T449 HydrophobicContact CB-CG2 3.96Å; Q383-T449 VanDerWaalsContact OE1-CB 3.3Å; Q383-T449 VanDerWaalsContact OE1-CG2 3.3Å; Q383-T449 PolarHBondContact OE1-OG1 2.93Å; Q384-T449 WeakPolarHBondContact O-CA 3.4Å; H433-T449 PolarHBondContact N-O 2.89Å; H433-T449 PolarHBondContact O-N 2.92Å; Q447-T449 HydrophobicContact CG-CG2 3.79Å
450	G	93.1	Very high	87.1	Confident	1 Å²	1	50.8 Å²	50.8	1%	0.01	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	115.1	165	0	0	0	0	0	111.2	Q384 R430 N431	Q384-G450 WeakPolarHBondContact CB-O 3.46Å; Q384-G450 PolarHBondContact N-O 3.31Å; Q384-G450 VanDerWaalsContact N-O 3.17Å; Q384-G450 PolarHBondContact O-N 3.46Å; R430-G450 WeakPolarHBondContact CD-O 3.47Å; R430-G450 PolarHBondContact NH1-O 3.05Å; N431-G450 WeakPolarHBondContact O-CA 3.31Å
451	Y	90.2	Very high	87.2	Confident	86 Å²	86	50.2 Å²	50.2	34%	0.337	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	166	-179.8	-172.4	-110.2	0	0	0	111.8	Q383 R430 N431 H433	Q383-Y451 HydrophobicContact CG-CD2 4.22Å; Q383-Y451 VanDerWaalsContact NE2-CD2 3.35Å; R430-Y451 CarbonylContact C-O 3.48Å; N431-Y451 PolarHBondContact N-O 2.98Å; N431-Y451 PolarHBondContact O-N 3.1Å; H433-Y451 AromaticContact CE1-CD1 3.65Å; H433-Y451 AromaticContact CE1-CG 3.97Å; H433-Y451 AromaticContact ND1-CD1 3.67Å; H433-Y451 AromaticContact ND1-CG 3.92Å
452	G	85.9	Confident	87.4	Confident	12 Å²	12	49 Å²	49	12%	0.124	27%	0.273	C	S	.	.			trans	67.5	175.4	-172.5	0	0	0	0	0	113.5	R430 T456	R430-G452 WeakPolarHBondContact CD-O 3.26Å; R430-G452 WeakPolarHBondContact CG-O 3.29Å; G452-T456 WeakPolarHBondContact CA-O 3.28Å
453	I	78.3	Confident	87.5	Confident	96 Å²	96	48.1 Å²	48.1	49%	0.492	27%	0.268	S	S	.	.	S	Bend	trans	-147	133.4	170.7	-63.3	-175.9	0	0	0	108	T429 T456	T429-I453 CarbonylContact O-C 3.59Å; T429-I453 VanDerWaalsContact O-CA 3.29Å; T429-I453 WeakPolarHBondContact O-CA 3.43Å; I453-T456 PolarHBondContact N-OG1 3.4Å; I453-T456 WeakPolarHBondContact O-CB 3.47Å; I453-T456 PolarHBondContact O-N 2.97Å; I453-T456 VanDerWaalsContact O-N 3.16Å; I453-T456 PolarHBondContact O-OG1 2.78Å
454	N	69	Low	87.7	Confident	126 Å²	126	45.9 Å²	45.9	67%	0.674	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.5	64.1	170.3	-171.4	29.5	0	0	0	112.7	T429 T456	T429-N454 PolarHBondContact O-N 3.43Å; T429-N454 PolarHBondContact OG1-N 2.81Å; N454-T456 PolarHBondContact O-N 3.46Å
455	G	62.9	Low	87.8	Confident	37 Å²	37	38.5 Å²	38.5	38%	0.381	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.8	-12.9	-178.3	0	0	0	0	0	117.2	R422 E424	R422-G455 PolarHBondContact NH1-O 3.38Å; E424-G455 PolarHBondContact OE2-N 2.91Å
456	T	73.8	Confident	87.8	Confident	89 Å²	89	39.7 Å²	39.7	55%	0.546	23%	0.232	S	C	.	.			trans	-66.7	140.2	169.9	63.2	0	0	0	0	110.2	N431 G452 I453 N454	N431-T456 PolarHBondContact ND2-O 3.19Å; G452-T456 WeakPolarHBondContact CA-O 3.28Å; I453-T456 PolarHBondContact N-OG1 3.4Å; I453-T456 WeakPolarHBondContact O-CB 3.47Å; I453-T456 PolarHBondContact O-N 2.97Å; I453-T456 VanDerWaalsContact O-N 3.16Å; I453-T456 PolarHBondContact O-OG1 2.78Å; N454-T456 PolarHBondContact O-N 3.46Å
457	G	76.3	Confident	87.7	Confident	38 Å²	38	38 Å²	38	39%	0.392	23%	0.226	S	C	.	.			trans	176.9	176.1	-171.2	0	0	0	0	0	113.6	D461	G457-D461 WeakPolarHBondContact CA-OD2 3.41Å
458	D	86.6	Confident	87.4	Confident	59 Å²	59	39.1 Å²	39.1	32%	0.316	23%	0.234	S	C	.	.			trans	-128.3	-168.4	-178.2	80.9	-6.8	0	0	0	113.1	H433 N460 D461	H433-D458 IonicContact CE1-OD1 3.5Å; H433-D458 IonicContact CE1-OD2 3.84Å; H433-D458 IonicContact ND1-OD1 3.67Å; D458-N460 PolarHBondContact O-N 3.24Å; D458-N460 VanDerWaalsContact OD1-CA 3.32Å; D458-N460 WeakPolarHBondContact OD1-CA 3.49Å; D458-N460 VanDerWaalsContact OD1-CB 3.25Å; D458-N460 WeakPolarHBondContact OD1-CB 3.22Å; D458-N460 PolarHBondContact OD1-N 2.92Å; D458-N460 PolarHBondContact OD2-ND2 2.94Å; D458-D461 PolarHBondContact N-OD2 2.82Å; D458-D461 PolarHBondContact O-N 2.64Å; D458-D461 PolarHBondContact OD1-N 2.8Å
459	A	88.9	Confident	86.8	Confident	60 Å²	60	43.1 Å²	43.1	50%	0.496	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-72.3	-11.6	178.7	0	0	0	0	0	114.1	D461	A459-D461 VanDerWaalsContact C-N 3.34Å
460	N	91.5	Very high	86.3	Confident	41 Å²	41	44.1 Å²	44.1	22%	0.219	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-91.5	4.1	176.8	-53.2	-74.8	0	0	0	112.8	S434 D458 H487 A489	S434-N460 PolarHBondContact N-O 2.81Å; D458-N460 PolarHBondContact O-N 3.24Å; D458-N460 VanDerWaalsContact OD1-CA 3.32Å; D458-N460 WeakPolarHBondContact OD1-CA 3.49Å; D458-N460 VanDerWaalsContact OD1-CB 3.25Å; D458-N460 WeakPolarHBondContact OD1-CB 3.22Å; D458-N460 PolarHBondContact OD1-N 2.92Å; D458-N460 PolarHBondContact OD2-ND2 2.94Å; N460-H487 VanDerWaalsContact C-NE2 3.32Å; N460-H487 WeakPolarHBondContact CA-NE2 3.33Å; N460-H487 PolarHBondContact O-NE2 3.02Å; N460-A489 VanDerWaalsContact OD1-CB 3.24Å; N460-A489 WeakPolarHBondContact OD1-CB 3.34Å
461	D	92.6	Very high	85.9	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	32%	0.321	C	S	.	.	G	3₁₀ helix	trans	-95.8	4.2	170.9	-61.6	-27.6	0	0	0	112.4	R422 N431 H433 G457 D458 A459	R422-D461 HydrophobicContact CG-CB 4.43Å; N431-D461 HydrophobicContact CB-CB 3.8Å; N431-D461 VanDerWaalsContact CB-CG 3.45Å; N431-D461 PolarHBondContact ND2-OD2 2.83Å; H433-D461 WeakPolarHBondContact CB-OD1 3.23Å; H433-D461 IonicContact CE1-OD1 3.91Å; H433-D461 IonicContact CG-OD1 3.49Å; H433-D461 IonicContact ND1-OD1 2.77Å; H433-D461 PolarHBondContact ND1-OD1 2.8Å; G457-D461 WeakPolarHBondContact CA-OD2 3.41Å; D458-D461 PolarHBondContact N-OD2 2.82Å; D458-D461 PolarHBondContact O-N 2.64Å; D458-D461 PolarHBondContact OD1-N 2.8Å; A459-D461 VanDerWaalsContact C-N 3.34Å
462	L	94.3	Very high	85.5	Confident	36 Å²	36	60.8 Å²	60.8	19%	0.188	35%	0.347	C	S	.	.			trans	-100.3	122.6	-171.7	-61.8	-178.8	0	0	0	111.9	P403 I420 K488	P403-L462 HydrophobicContact CB-CD2 3.88Å; P403-L462 HydrophobicContact CG-CD2 4.18Å; I420-L462 HydrophobicContact CG2-CB 4.06Å; I420-L462 HydrophobicContact CG2-CD2 4.35Å; L462-K488 HydrophobicContact CB-CB 3.94Å; L462-K488 VanDerWaalsContact O-CB 3.32Å; L462-K488 WeakPolarHBondContact O-CB 3.39Å; L462-K488 PolarHBondContact O-N 2.68Å
463	W	95.8	Very high	85.2	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	125.5	-177.5	-62	83	0	0	0	110.8	I420 I421 L432 V448 F485 L486 H487 L494 C513	I420-W463 WeakPolarHBondContact CA-O 3.27Å; I421-W463 HydrophobicContact CG1-CB 4.4Å; I421-W463 PolarHBondContact N-O 2.95Å; I421-W463 PolarHBondContact O-N 2.79Å; L432-W463 HydrophobicContact CD2-CD2 4.23Å; L432-W463 HydrophobicContact CD2-CZ2 4.02Å; L432-W463 HydrophobicContact CG-CZ2 3.92Å; L432-W463 PolarHBondContact O-NE1 3.1Å; V448-W463 HydrophobicContact CG2-CH2 4.44Å; W463-F485 HydrophobicContact CB-CB 4.34Å; W463-F485 HydrophobicContact CD2-CB 4.4Å; W463-F485 HydrophobicContact CE3-CB 3.77Å; W463-L486 CarbonylContact C-O 3.53Å; W463-L486 WeakPolarHBondContact CA-O 3.3Å; W463-H487 HydrophobicContact CD2-CB 4.44Å; W463-H487 HydrophobicContact CE3-CB 3.88Å; W463-H487 HydrophobicContact CH2-CB 3.87Å; W463-H487 HydrophobicContact CZ2-CB 4.4Å; W463-H487 HydrophobicContact CZ3-CB 3.58Å; W463-L494 HydrophobicContact CE3-CB 4.36Å; W463-L494 HydrophobicContact CH2-CB 4.39Å; W463-L494 HydrophobicContact CH2-CD1 3.91Å; W463-L494 HydrophobicContact CZ3-CB 3.77Å; W463-L494 HydrophobicContact CZ3-CD1 4.15Å; W463-L494 HydrophobicContact CZ3-CG 4.49Å; W463-C513 HydrophobicContact CH2-CB 4.39Å
464	Q	95.1	Very high	85.7	Confident	56 Å²	56	60.4 Å²	60.4	26%	0.262	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	128.2	174.4	-168.5	166.6	4.6	0	0	110	G418 D419 I420 L486	G418-Q464 PolarHBondContact O-NE2 3.48Å; D419-Q464 CarbonylContact O-C 3.6Å; D419-Q464 WeakPolarHBondContact O-CA 3.46Å; I420-Q464 HydrophobicContact CG1-CB 4.42Å; I420-Q464 HydrophobicContact CG1-CG 4.36Å; Q464-L486 HydrophobicContact CB-CB 4.38Å; Q464-L486 PolarHBondContact N-O 2.96Å; Q464-L486 PolarHBondContact O-N 3.08Å
465	V	94.9	Very high	86.8	Confident	2 Å²	2	57.1 Å²	57.1	1%	0.012	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	121.1	-177.9	-174.7	0	0	0	0	110	V415 G418 D419 I421 V476 V483 F485	V415-V465 HydrophobicContact CG1-CG2 4.29Å; G418-V465 PolarHBondContact N-O 3.23Å; D419-V465 PolarHBondContact O-N 3.27Å; I421-V465 HydrophobicContact CB-CG2 4.41Å; I421-V465 HydrophobicContact CD1-CG2 3.6Å; I421-V465 HydrophobicContact CG1-CG2 3.73Å; I421-V465 HydrophobicContact CG2-CG2 3.82Å; V465-V476 HydrophobicContact CG1-CG2 3.96Å; V465-V483 HydrophobicContact CG1-CB 4.38Å; V465-V483 HydrophobicContact CG1-CG1 4.16Å; V465-F485 HydrophobicContact CG2-CD1 4.22Å; V465-F485 HydrophobicContact CG2-CE1 4.2Å
466	E	94.1	Very high	88.1	Confident	43 Å²	43	55.4 Å²	55.4	20%	0.201	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	116.9	178.8	-173.5	-164.4	-177.4	0	0	109.9	V483 R484 L486	E466-V483 CarbonylContact O-C 3.46Å; E466-V483 WeakPolarHBondContact O-CA 3.15Å; E466-R484 HydrophobicContact CB-CB 4.37Å; E466-R484 PolarHBondContact N-O 3.33Å; E466-R484 PolarHBondContact O-N 3.48Å; E466-R484 IonicContact OE1-CZ 2.61Å; E466-R484 IonicContact OE1-NE 3.38Å; E466-R484 IonicContact OE1-NH2 3.88Å; E466-R484 PolarHBondContact OE1-NH2 3.08Å; E466-R484 IonicContact OE2-CZ 3.92Å; E466-R484 IonicContact OE2-NE 3.52Å; E466-R484 PolarHBondContact OE2-NE 3.46Å; E466-R484 IonicContact OE2-NH2 2.68Å; E466-R484 PolarHBondContact OE2-NH2 3.23Å; E466-L486 HydrophobicContact CB-CD1 4.2Å; E466-L486 VanDerWaalsContact OE2-CD1 3.32Å; E466-L486 WeakPolarHBondContact OE2-CD1 3.11Å
467	V	92.9	Very high	88.8	Confident	12 Å²	12	54 Å²	54	7%	0.073	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	117	172	-178	0	0	0	0	108.8	H417 G469 G470 V476 V483	H417-V467 HydrophobicContact CB-CB 4.16Å; H417-V467 HydrophobicContact CB-CG2 4Å; H417-V467 PolarHBondContact CE1-O 3.48Å; H417-V467 PolarHBondContact ND1-N 2.95Å; H417-V467 VanDerWaalsContact ND1-N 3.15Å; H417-V467 PolarHBondContact ND1-O 3.43Å; V467-G469 PolarHBondContact O-N 3.16Å; V467-G470 PolarHBondContact O-N 3.36Å; V467-V476 HydrophobicContact CG2-CG2 3.84Å; V467-V483 HydrophobicContact CG2-CG1 4.2Å
468	C	87.9	Confident	89.3	Confident	26 Å²	26	52.5 Å²	52.5	18%	0.176	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	123.4	179.6	-66.5	0	0	0	0	111.3	G470 K482 R484 E519	C468-G470 PolarHBondContact O-N 3.06Å; C468-K482 HydrophobicContact CB-CB 4.22Å; C468-K482 PolarHBondContact N-O 3.15Å; C468-R484 VanDerWaalsContact SG-CG 3.58Å; C468-E519 PolarHBondContact SG-OE2 3.16Å
469	G	84.6	Confident	89	Confident	85 Å²	85	50.1 Å²	50.1	88%	0.876	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.7	0.9	-175.7	0	0	0	0	0	115.3	V467	V467-G469 PolarHBondContact O-N 3.16Å
470	G	83	Confident	88.6	Confident	21 Å²	21	54.1 Å²	54.1	22%	0.216	27%	0.273	C	S	.	.	P	Polyproline II helix	trans	-80	163.7	172.4	0	0	0	0	0	112.7	H417 V467 C468 D474	H417-G470 PolarHBondContact CE1-O 3.23Å; V467-G470 PolarHBondContact O-N 3.36Å; C468-G470 PolarHBondContact O-N 3.06Å; G470-D474 WeakPolarHBondContact CA-OD2 3.36Å
471	R	86.2	Confident	88.4	Confident	202 Å²	202	52.9 Å²	52.9	76%	0.762	27%	0.268	S	S	*	.	P	Polyproline II helix	trans	-102.2	158.6	174.2	-61.3	178.8	-179.2	-178.1	0.1	110.2	H417 G473 D474	H417-R471 WeakPolarHBondContact CB-O 3.36Å; R471-G473 PolarHBondContact O-N 2.86Å; R471-D474 PolarHBondContact N-OD2 2.91Å; R471-D474 VanDerWaalsContact O-CB 3.3Å; R471-D474 WeakPolarHBondContact O-CB 3.47Å; R471-D474 VanDerWaalsContact O-CG 3.31Å; R471-D474 PolarHBondContact O-N 3.3Å
472	R	80.7	Confident	88.3	Confident	236 Å²	236	58.2 Å²	58.2	89%	0.891	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	123.1	177.1	-174.3	179.3	-178.3	-174.1	-0.2	110.5
473	G	79.9	Confident	88.3	Confident	29 Å²	29	56.5 Å²	56.5	30%	0.299	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	95.9	-8.2	-176.9	0	0	0	0	0	115.6	H417 R471	H417-G473 PolarHBondContact O-N 3.12Å; R471-G473 PolarHBondContact O-N 2.86Å
474	D	89	Confident	88.3	Confident	71 Å²	71	57.4 Å²	57.4	38%	0.38	29%	0.286	S	S	.	.			trans	-61.7	135.5	172.3	-74.5	-3.1	0	0	0	110.6	R416 H417 G470 R471	R416-D474 CarbonylContact C-O 3.54Å; R416-D474 VanDerWaalsContact CA-O 3.27Å; R416-D474 WeakPolarHBondContact CA-O 3Å; H417-D474 HydrophobicContact CB-CB 4.39Å; H417-D474 PolarHBondContact N-O 2.86Å; G470-D474 WeakPolarHBondContact CA-OD2 3.36Å; R471-D474 PolarHBondContact N-OD2 2.91Å; R471-D474 VanDerWaalsContact O-CB 3.3Å; R471-D474 WeakPolarHBondContact O-CB 3.47Å; R471-D474 VanDerWaalsContact O-CG 3.31Å; R471-D474 PolarHBondContact O-N 3.3Å
475	L	91	Very high	88.4	Confident	57 Å²	57	54.9 Å²	54.9	30%	0.298	27%	0.274	S	S	.	.	B	Isolated β-bridge	trans	-75.3	140.8	-179.1	-66.2	165.2	0	0	0	112.1	Y347 L414 R416 K477	Y347-L475 HydrophobicContact CD1-CB 3.55Å; Y347-L475 HydrophobicContact CD1-CD1 3.85Å; Y347-L475 HydrophobicContact CD1-CG 4.28Å; Y347-L475 HydrophobicContact CE1-CB 3.89Å; Y347-L475 HydrophobicContact CE1-CD1 3.84Å; Y347-L475 HydrophobicContact CG-CD1 4.43Å; L414-L475 HydrophobicContact CB-CD2 3.61Å; L414-L475 HydrophobicContact CD1-CD1 4.23Å; L414-L475 HydrophobicContact CD1-CD2 3.87Å; L414-L475 HydrophobicContact CG-CD2 4.41Å; R416-L475 HydrophobicContact CG-CD2 3.96Å; L475-K477 PolarHBondContact O-N 3.37Å
476	V	90.2	Very high	88.4	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	28%	0.282	C	S	.	.			trans	-74.4	107.8	174.8	179.2	0	0	0	0	109.7	Y347 L348 V415 V465 V467 V483 I527	Y347-V476 WeakPolarHBondContact CA-O 3.42Å; L348-V476 HydrophobicContact CB-CB 3.99Å; L348-V476 HydrophobicContact CB-CG1 3.99Å; L348-V476 HydrophobicContact CD2-CG1 4.2Å; L348-V476 PolarHBondContact N-O 3.2Å; V415-V476 HydrophobicContact CG1-CG2 4.21Å; V415-V476 PolarHBondContact O-N 3.49Å; V415-V476 VanDerWaalsContact O-N 3.08Å; V465-V476 HydrophobicContact CG1-CG2 3.96Å; V467-V476 HydrophobicContact CG2-CG2 3.84Å; V476-V483 HydrophobicContact CG1-CG1 3.9Å; V476-I527 HydrophobicContact CG1-CD1 3.64Å
477	K	88.7	Confident	88.5	Confident	61 Å²	61	54.5 Å²	54.5	27%	0.265	27%	0.273	S	S	.	.	B	Isolated β-bridge	trans	-89.6	124.3	176.8	-70.3	173.9	179.2	-80.7	0	111	E346 Y347 L475 R480 S481	E346-K477 HydrophobicContact CG-CG 4.36Å; E346-K477 CarbonylContact O-C 3.6Å; E346-K477 WeakPolarHBondContact O-CA 3.28Å; E346-K477 IonicContact OE1-NZ 2.64Å; E346-K477 PolarHBondContact OE1-NZ 3.04Å; E346-K477 IonicContact OE2-NZ 3.69Å; Y347-K477 HydrophobicContact CD1-CG 3.92Å; Y347-K477 HydrophobicContact CE1-CD 4.33Å; Y347-K477 HydrophobicContact CE1-CG 3.63Å; Y347-K477 PolarHBondContact OH-NZ 3.02Å; L475-K477 PolarHBondContact O-N 3.37Å; K477-R480 HydrophobicContact CB-CB 4.27Å; K477-R480 PolarHBondContact O-N 3.13Å; K477-S481 PolarHBondContact N-OG 3.22Å; K477-S481 WeakPolarHBondContact O-CB 3.36Å; K477-S481 PolarHBondContact O-N 2.99Å; K477-S481 PolarHBondContact O-OG 2.92Å
478	V	86.8	Confident	88.6	Confident	6 Å²	6	58.8 Å²	58.8	4%	0.036	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	142.5	173.8	177.5	0	0	0	0	110.4	M344 P345 E346 R480 I527 H530	M344-V478 HydrophobicContact SD-CG1 3.61Å; P345-V478 WeakPolarHBondContact O-CG2 3.42Å; E346-V478 PolarHBondContact O-N 3.02Å; V478-R480 PolarHBondContact O-N 3.23Å; V478-I527 HydrophobicContact CG1-CG2 4.34Å; V478-I527 HydrophobicContact CG2-CG2 4.14Å; V478-H530 HydrophobicContact CG1-CB 4.01Å; V478-H530 HydrophobicContact CG2-CB 3.77Å
479	L	79.9	Confident	88.9	Confident	9 Å²	9	60.2 Å²	60.2	5%	0.047	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	60.1	-20.4	-178.3	-68.4	158.7	0	0	0	117.4	M344 N526 I527 E528 L540	M344-L479 HydrophobicContact CE-CD1 4.4Å; M344-L479 HydrophobicContact SD-CD1 3.71Å; L479-N526 VanDerWaalsContact C-OD1 3.28Å; L479-N526 VanDerWaalsContact CA-OD1 3.3Å; L479-N526 WeakPolarHBondContact CA-OD1 3.43Å; L479-N526 PolarHBondContact O-ND2 3.22Å; L479-N526 PolarHBondContact O-OD1 3.08Å; L479-I527 WeakPolarHBondContact CA-O 3.49Å; L479-I527 PolarHBondContact N-O 2.85Å; L479-E528 HydrophobicContact CD2-CB 4.37Å; L479-E528 HydrophobicContact CD2-CG 4.19Å; L479-L540 HydrophobicContact CD1-CD1 4.2Å; L479-L540 HydrophobicContact CD1-CD2 3.45Å; L479-L540 VanDerWaalsContact CD1-CD2 3.45Å; L479-L540 HydrophobicContact CD1-CG 4.36Å
480	R	80.7	Confident	89.2	Confident	143 Å²	143	58.1 Å²	58.1	54%	0.54	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.4	-39	-179.7	-80	-177.1	163.6	162.2	-0.4	114	K477 V478 K482	K477-R480 HydrophobicContact CB-CB 4.27Å; K477-R480 PolarHBondContact O-N 3.13Å; V478-R480 PolarHBondContact O-N 3.23Å; R480-K482 PolarHBondContact O-N 3.08Å
481	S	87.7	Confident	89.7	Confident	15 Å²	15	59 Å²	59	11%	0.105	28%	0.284	C	S	.	.			trans	-78.7	114.4	-177.8	-71.9	0	0	0	0	111.1	K477 V483	K477-S481 PolarHBondContact N-OG 3.22Å; K477-S481 WeakPolarHBondContact O-CB 3.36Å; K477-S481 PolarHBondContact O-N 2.99Å; K477-S481 PolarHBondContact O-OG 2.92Å; S481-V483 PolarHBondContact O-N 2.95Å
482	K	91.4	Very high	90.2	Very high	113 Å²	113	49.4 Å²	49.4	49%	0.491	25%	0.248	S	C	.	.			trans	-74.3	113.7	166.3	-55.7	-180	-176.5	170.6	0	107.6	L359 C468 R480	L359-K482 HydrophobicContact CD1-CB 3.93Å; L359-K482 HydrophobicContact CD1-CD 4.2Å; L359-K482 HydrophobicContact CD1-CG 3.71Å; C468-K482 HydrophobicContact CB-CB 4.22Å; C468-K482 PolarHBondContact N-O 3.15Å; R480-K482 PolarHBondContact O-N 3.08Å
483	V	94.3	Very high	90.9	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	148.2	-177.2	-66.6	0	0	0	0	111.6	V465 E466 V467 V476 S481 F485 W525 I527	V465-V483 HydrophobicContact CG1-CB 4.38Å; V465-V483 HydrophobicContact CG1-CG1 4.16Å; E466-V483 CarbonylContact O-C 3.46Å; E466-V483 WeakPolarHBondContact O-CA 3.15Å; V467-V483 HydrophobicContact CG2-CG1 4.2Å; V476-V483 HydrophobicContact CG1-CG1 3.9Å; S481-V483 PolarHBondContact O-N 2.95Å; V483-F485 HydrophobicContact CG2-CE2 3.92Å; V483-F485 HydrophobicContact CG2-CZ 3.78Å; V483-W525 HydrophobicContact CG2-CB 4.23Å; V483-W525 WeakPolarHBondContact CG2-O 3.21Å; V483-W525 PolarHBondContact N-O 3.37Å; V483-W525 PolarHBondContact O-N 3.22Å; V483-I527 HydrophobicContact CG2-CG1 4.46Å
484	R	95.3	Very high	91.7	Very high	18 Å²	18	36.8 Å²	36.8	7%	0.068	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	146.5	164.5	-50	-162.8	-68.5	-179.1	-12.3	108.6	E466 C468 L486 V493 L517 E519	E466-R484 HydrophobicContact CB-CB 4.37Å; E466-R484 PolarHBondContact N-O 3.33Å; E466-R484 PolarHBondContact O-N 3.48Å; E466-R484 IonicContact OE1-CZ 2.61Å; E466-R484 IonicContact OE1-NE 3.38Å; E466-R484 IonicContact OE1-NH2 3.88Å; E466-R484 PolarHBondContact OE1-NH2 3.08Å; E466-R484 IonicContact OE2-CZ 3.92Å; E466-R484 IonicContact OE2-NE 3.52Å; E466-R484 PolarHBondContact OE2-NE 3.46Å; E466-R484 IonicContact OE2-NH2 2.68Å; E466-R484 PolarHBondContact OE2-NH2 3.23Å; C468-R484 VanDerWaalsContact SG-CG 3.58Å; R484-L486 HydrophobicContact CB-CD1 3.69Å; R484-V493 HydrophobicContact CB-CG2 3.93Å; R484-L517 PolarHBondContact NH1-O 2.62Å; R484-E519 VanDerWaalsContact NH1-CG 3.33Å
485	F	96.4	Very high	92	Very high	3 Å²	3	35.7 Å²	35.7	1%	0.013	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	110.9	172.5	-57.1	-80.7	0	0	0	107.4	V356 I421 L423 W463 V465 V483 V493 L494 W525	V356-F485 HydrophobicContact CG1-CE2 3.8Å; V356-F485 HydrophobicContact CG1-CZ 4.2Å; I421-F485 HydrophobicContact CD1-CD1 4.18Å; I421-F485 HydrophobicContact CD1-CE1 3.9Å; L423-F485 HydrophobicContact CD1-CD1 4.27Å; L423-F485 HydrophobicContact CD1-CE1 4.17Å; W463-F485 HydrophobicContact CB-CB 4.34Å; W463-F485 HydrophobicContact CD2-CB 4.4Å; W463-F485 HydrophobicContact CE3-CB 3.77Å; V465-F485 HydrophobicContact CG2-CD1 4.22Å; V465-F485 HydrophobicContact CG2-CE1 4.2Å; V483-F485 HydrophobicContact CG2-CE2 3.92Å; V483-F485 HydrophobicContact CG2-CZ 3.78Å; F485-V493 WeakPolarHBondContact O-CA 3.33Å; F485-L494 HydrophobicContact CB-CB 3.95Å; F485-L494 HydrophobicContact CB-CD2 4.26Å; F485-L494 HydrophobicContact CD2-CD2 3.84Å; F485-L494 HydrophobicContact CG-CD2 4.35Å; F485-L494 PolarHBondContact O-N 3.48Å; F485-W525 HydrophobicContact CD2-CB 4.49Å; F485-W525 AromaticContact CD2-CD1 3.96Å; F485-W525 HydrophobicContact CD2-CG 4.21Å; F485-W525 HydrophobicContact CE2-CB 3.91Å; F485-W525 HydrophobicContact CE2-CG 4.05Å
486	L	96.1	Very high	92.1	Very high	36 Å²	36	33 Å²	33	19%	0.188	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	117.2	179.8	-83.7	65.7	0	0	0	108.9	W463 Q464 E466 R484 K488 C492 V493 L517	W463-L486 CarbonylContact C-O 3.53Å; W463-L486 WeakPolarHBondContact CA-O 3.3Å; Q464-L486 HydrophobicContact CB-CB 4.38Å; Q464-L486 PolarHBondContact N-O 2.96Å; Q464-L486 PolarHBondContact O-N 3.08Å; E466-L486 HydrophobicContact CB-CD1 4.2Å; E466-L486 VanDerWaalsContact OE2-CD1 3.32Å; E466-L486 WeakPolarHBondContact OE2-CD1 3.11Å; R484-L486 HydrophobicContact CB-CD1 3.69Å; L486-K488 PolarHBondContact O-N 2.85Å; L486-C492 CarbonylContact C-O 3.59Å; L486-C492 WeakPolarHBondContact CA-O 3.32Å; L486-V493 HydrophobicContact CD1-CB 4.41Å; L486-V493 HydrophobicContact CD1-CG2 4.02Å; L486-L517 HydrophobicContact CD2-CD2 4.43Å; L486-L517 HydrophobicContact CG-CD2 4.45Å
487	H	96.8	Very high	92	Very high	1 Å²	1	34.2 Å²	34.2	1%	0.005	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67	122.9	-179.3	-177.4	-123.9	0	0	0	110.8	S434 N460 W463 A489 T490 G491 C492	S434-H487 PolarHBondContact O-CE1 3.11Å; S434-H487 PolarHBondContact O-NE2 3.41Å; N460-H487 VanDerWaalsContact C-NE2 3.32Å; N460-H487 WeakPolarHBondContact CA-NE2 3.33Å; N460-H487 PolarHBondContact O-NE2 3.02Å; W463-H487 HydrophobicContact CD2-CB 4.44Å; W463-H487 HydrophobicContact CE3-CB 3.88Å; W463-H487 HydrophobicContact CH2-CB 3.87Å; W463-H487 HydrophobicContact CZ2-CB 4.4Å; W463-H487 HydrophobicContact CZ3-CB 3.58Å; H487-A489 PolarHBondContact O-N 2.61Å; H487-T490 PolarHBondContact ND1-OG1 2.62Å; H487-G491 WeakPolarHBondContact O-CA 3.32Å; H487-G491 PolarHBondContact O-N 2.9Å; H487-C492 PolarHBondContact N-O 3.28Å
488	K	94.3	Very high	91.8	Very high	102 Å²	102	32.2 Å²	32.2	44%	0.443	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-34.9	-164.3	-165.6	55.7	168.7	179.2	0	113.8	I420 L462 L486	I420-K488 HydrophobicContact CD1-CD 4.31Å; I420-K488 HydrophobicContact CD1-CG 4.42Å; L462-K488 HydrophobicContact CB-CB 3.94Å; L462-K488 VanDerWaalsContact O-CB 3.32Å; L462-K488 WeakPolarHBondContact O-CB 3.39Å; L462-K488 PolarHBondContact O-N 2.68Å; L486-K488 PolarHBondContact O-N 2.85Å
489	A	93.4	Very high	91.9	Very high	57 Å²	57	36.3 Å²	36.3	47%	0.471	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-30.9	-175.7	0	0	0	0	0	114.1	N460 H487	N460-A489 VanDerWaalsContact OD1-CB 3.24Å; N460-A489 WeakPolarHBondContact OD1-CB 3.34Å; H487-A489 PolarHBondContact O-N 2.61Å
490	T	92.1	Very high	92.3	Very high	40 Å²	40	40 Å²	40	25%	0.245	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114.9	-7.9	-177.6	66.2	0	0	0	0	114.6	L436 H487 C492	L436-T490 HydrophobicContact CD2-CG2 3.59Å; L436-T490 HydrophobicContact CG-CG2 3.99Å; H487-T490 PolarHBondContact ND1-OG1 2.62Å; T490-C492 PolarHBondContact O-N 3.38Å; T490-C492 PolarHBondContact OG1-SG 2.85Å
491	G	93.3	Very high	92.8	Very high	41 Å²	41	33.4 Å²	33.4	42%	0.423	19%	0.189	S	C	.	.			trans	70.5	11.3	178	0	0	0	0	0	115.3	H487 L517	H487-G491 WeakPolarHBondContact O-CA 3.32Å; H487-G491 PolarHBondContact O-N 2.9Å; G491-L517 WeakPolarHBondContact O-CD2 3.23Å
492	C	95.4	Very high	92.9	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	20%	0.202	C	C	.	.			trans	-82.7	163.1	175.5	62.6	0	0	0	0	112.1	F446 L486 H487 T490 C513 S514	F446-C492 HydrophobicContact CD2-CB 3.97Å; F446-C492 HydrophobicContact CE2-CB 4.4Å; L486-C492 CarbonylContact C-O 3.59Å; L486-C492 WeakPolarHBondContact CA-O 3.32Å; H487-C492 PolarHBondContact N-O 3.28Å; T490-C492 PolarHBondContact O-N 3.38Å; T490-C492 PolarHBondContact OG1-SG 2.85Å; C492-C513 HydrophobicContact CB-CB 4Å; C492-C513 WeakPolarHBondContact CB-SG 3.15Å; C492-C513 WeakPolarHBondContact SG-CB 3.38Å; C492-C513 CovalentContact SG-SG 2.03Å; C492-C513 PolarHBondContact SG-SG 3.23Å; C492-S514 CarbonylContact C-O 3.56Å; C492-S514 VanDerWaalsContact CA-O 3.3Å; C492-S514 WeakPolarHBondContact CA-O 3.46Å; C492-S514 VanDerWaalsContact CB-O 3.26Å; C492-S514 WeakPolarHBondContact CB-O 3.46Å
493	V	96.6	Very high	92.9	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	137.6	178	62.2	0	0	0	0	112.1	R484 F485 L486 Y495 C513 S514 L517	R484-V493 HydrophobicContact CB-CG2 3.93Å; F485-V493 WeakPolarHBondContact O-CA 3.33Å; L486-V493 HydrophobicContact CD1-CB 4.41Å; L486-V493 HydrophobicContact CD1-CG2 4.02Å; V493-Y495 PolarHBondContact O-N 3.36Å; V493-C513 CarbonylContact O-C 3.54Å; V493-C513 WeakPolarHBondContact O-CA 3.25Å; V493-S514 PolarHBondContact N-O 2.77Å; V493-S514 PolarHBondContact O-N 3.29Å; V493-L517 HydrophobicContact CB-CD2 4.09Å; V493-L517 HydrophobicContact CG1-CD2 4.26Å
494	L	96.7	Very high	92.7	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.6	121.7	176.2	-170.7	69.2	0	0	0	110.8	L366 L432 V448 W463 F485 V511 W525	L366-L494 HydrophobicContact CD1-CD2 4.41Å; L366-L494 HydrophobicContact CD2-CD2 4.3Å; L432-L494 HydrophobicContact CD2-CD1 4.36Å; L432-L494 HydrophobicContact CD2-CD2 4.04Å; V448-L494 HydrophobicContact CG1-CD1 4.07Å; V448-L494 HydrophobicContact CG2-CD1 4.05Å; W463-L494 HydrophobicContact CE3-CB 4.36Å; W463-L494 HydrophobicContact CH2-CB 4.39Å; W463-L494 HydrophobicContact CH2-CD1 3.91Å; W463-L494 HydrophobicContact CZ3-CB 3.77Å; W463-L494 HydrophobicContact CZ3-CD1 4.15Å; W463-L494 HydrophobicContact CZ3-CG 4.49Å; F485-L494 HydrophobicContact CB-CB 3.95Å; F485-L494 HydrophobicContact CB-CD2 4.26Å; F485-L494 HydrophobicContact CD2-CD2 3.84Å; F485-L494 HydrophobicContact CG-CD2 4.35Å; F485-L494 PolarHBondContact O-N 3.48Å; L494-V511 HydrophobicContact CD1-CG1 3.74Å; L494-V511 HydrophobicContact CG-CG1 4.47Å; L494-W525 HydrophobicContact CD2-CZ2 3.93Å; L494-W525 HydrophobicContact CG-CZ2 3.78Å; L494-W525 PolarHBondContact O-NE1 3.15Å
495	Y	94.9	Very high	92.4	Very high	48 Å²	48	40.9 Å²	40.9	19%	0.188	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	118.7	-162.3	-168.2	-77.7	0	0	0	111.6	H445 V493 S497 T512 T520 S522	H445-Y495 AromaticContact CE1-CD1 3.59Å; H445-Y495 AromaticContact CE1-CE1 3.78Å; H445-Y495 AromaticContact ND1-CD1 3.97Å; V493-Y495 PolarHBondContact O-N 3.36Å; Y495-S497 PolarHBondContact O-N 2.9Å; Y495-T512 PolarHBondContact N-O 3.02Å; Y495-T512 PolarHBondContact O-N 3.22Å; Y495-T512 VanDerWaalsContact O-O 3.11Å; Y495-T512 PolarHBondContact O-OG1 3.16Å; Y495-T520 WeakPolarHBondContact CE2-OG1 3.34Å; Y495-S522 WeakPolarHBondContact CA-O 3.42Å; Y495-S522 VanDerWaalsContact CE1-CB 3.5Å
496	S	93.4	Very high	92.1	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	109.6	168.1	-175.1	0	0	0	0	109.3	N358 G498 S522	N358-S496 VanDerWaalsContact CG-CB 3.5Å; N358-S496 WeakPolarHBondContact ND2-CB 3.44Å; S496-G498 PolarHBondContact O-N 2.94Å; S496-S522 PolarHBondContact N-O 2.76Å; S496-S522 WeakPolarHBondContact O-CB 3.5Å; S496-S522 PolarHBondContact O-OG 3.1Å
497	S	87.9	Confident	91.7	Very high	25 Å²	25	52.2 Å²	52.2	18%	0.175	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	-27.9	-177.1	97.2	0	0	0	0	111.8	T442 Y495 K499 E510	T442-S497 PolarHBondContact OG1-OG 3.06Å; Y495-S497 PolarHBondContact O-N 2.9Å; S497-K499 VanDerWaalsContact C-N 3.32Å; S497-K499 PolarHBondContact OG-N 3.22Å; S497-E510 WeakPolarHBondContact CB-OE2 3.2Å; S497-E510 PolarHBondContact N-O 3.26Å; S497-E510 WeakPolarHBondContact OG-CB 3.2Å; S497-E510 PolarHBondContact OG-OE2 3.44Å
498	G	85.2	Confident	91.5	Very high	20 Å²	20	53 Å²	53	21%	0.206	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	84.8	0.3	178.1	0	0	0	0	0	115.2	R360 S496	R360-G498 PolarHBondContact NH1-O 3.46Å; S496-G498 PolarHBondContact O-N 2.94Å
499	K	88.3	Confident	91.4	Very high	91 Å²	91	48.6 Å²	48.6	40%	0.396	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	141.5	171	-63.7	174.6	-178.4	159.9	0	110.7	L441 T442 S497 V509 E510	L441-K499 HydrophobicContact CB-CD 3.72Å; L441-K499 HydrophobicContact CD1-CB 3.83Å; L441-K499 HydrophobicContact CD1-CD 4.24Å; L441-K499 PolarHBondContact O-NZ 3.46Å; T442-K499 WeakPolarHBondContact OG1-CE 3.21Å; T442-K499 PolarHBondContact OG1-NZ 3.46Å; S497-K499 VanDerWaalsContact C-N 3.32Å; S497-K499 PolarHBondContact OG-N 3.22Å; K499-V509 WeakPolarHBondContact O-CA 3.43Å; K499-E510 PolarHBondContact O-N 3.24Å
500	T	88.8	Confident	91.4	Very high	87 Å²	87	45.9 Å²	45.9	53%	0.534	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	131.9	169.3	-47.8	0	0	0	0	110	L441 E507	L441-T500 WeakPolarHBondContact CD1-O 3.24Å; T500-E507 HydrophobicContact CG2-CB 3.98Å; T500-E507 VanDerWaalsContact CG2-O 3.28Å; T500-E507 WeakPolarHBondContact CG2-O 3.49Å
501	L	90.3	Very high	91.6	Very high	5 Å²	5	44 Å²	44	3%	0.026	22%	0.221	C	C	.	.	P	Polyproline II helix	trans	-71.5	154.2	172.4	-66.4	177.7	0	0	0	111	T387 P440 L441 W504 E507 Q508 E510	T387-L501 HydrophobicContact CG2-CD1 3.8Å; P440-L501 HydrophobicContact CB-CD2 4.28Å; L441-L501 HydrophobicContact CD1-CD2 4.04Å; L441-L501 HydrophobicContact CG-CD2 4.25Å; L501-W504 HydrophobicContact CD1-CH2 4.26Å; L501-W504 HydrophobicContact CD1-CZ3 4.16Å; L501-W504 HydrophobicContact CD2-CH2 3.82Å; L501-W504 HydrophobicContact CD2-CZ2 4.35Å; L501-W504 HydrophobicContact CG-CH2 4.46Å; L501-E507 WeakPolarHBondContact O-CA 3.15Å; L501-Q508 WeakPolarHBondContact CB-O 3.32Å; L501-Q508 PolarHBondContact N-O 3.01Å; L501-E510 HydrophobicContact CD2-CB 3.76Å; L501-E510 HydrophobicContact CD2-CG 4.06Å; L501-E510 HydrophobicContact CG-CB 4.26Å
502	P	91	Very high	91.7	Very high	57 Å²	57	42.1 Å²	42.1	37%	0.37	20%	0.201	S	C	.	.			trans	-63.7	174.7	169.7	-18.4	32.5	0	0	0	112	W504 G505	P502-W504 HydrophobicContact CG-CZ2 4.35Å; P502-W504 PolarHBondContact O-N 2.94Å; P502-G505 WeakPolarHBondContact O-CA 3.4Å; P502-G505 PolarHBondContact O-N 2.98Å
503	K	90.3	Very high	91.8	Very high	170 Å²	170	42.1 Å²	42.1	74%	0.739	20%	0.201	S	C	*	.	G	3₁₀ helix	trans	-51.5	-28.9	-175.9	-65.7	-171.1	175	-170.7	0	115.9	G505 W506 E507	K503-G505 PolarHBondContact O-N 3.37Å; K503-W506 PolarHBondContact O-N 3.4Å; K503-W506 VanDerWaalsContact O-N 3.14Å; K503-E507 WeakPolarHBondContact CG-OE1 3.35Å
504	W	90.6	Very high	91.8	Very high	75 Å²	75	42.1 Å²	42.1	28%	0.284	20%	0.201	S	C	.	.	G	3₁₀ helix	trans	-65.2	-21	174.9	60.3	-109.9	0	0	0	114	Y373 P374 V377 Q385 P440 L501 P502	Y373-W504 AromaticContact CD1-CH2 3.9Å; Y373-W504 HydrophobicContact CD1-CH2 3.9Å; Y373-W504 AromaticContact CD1-CZ3 3.6Å; Y373-W504 HydrophobicContact CD1-CZ3 3.6Å; Y373-W504 AromaticContact CE1-CH2 3.87Å; Y373-W504 HydrophobicContact CE1-CH2 3.87Å; Y373-W504 AromaticContact CE1-CZ3 3.66Å; Y373-W504 HydrophobicContact CE1-CZ3 3.66Å; P374-W504 HydrophobicContact CG-CB 4.33Å; P374-W504 HydrophobicContact CG-CD2 3.82Å; P374-W504 HydrophobicContact CG-CE3 4.15Å; P374-W504 HydrophobicContact CG-CG 3.9Å; V377-W504 HydrophobicContact CG1-CH2 4.09Å; V377-W504 HydrophobicContact CG1-CZ2 3.93Å; Q385-W504 PolarHBondContact NE2-O 3.05Å; P440-W504 HydrophobicContact CB-CH2 3.79Å; P440-W504 HydrophobicContact CB-CZ2 4.02Å; P440-W504 HydrophobicContact CG-CH2 4.01Å; L501-W504 HydrophobicContact CD1-CH2 4.26Å; L501-W504 HydrophobicContact CD1-CZ3 4.16Å; L501-W504 HydrophobicContact CD2-CH2 3.82Å; L501-W504 HydrophobicContact CD2-CZ2 4.35Å; L501-W504 HydrophobicContact CG-CH2 4.46Å; P502-W504 HydrophobicContact CG-CZ2 4.35Å; P502-W504 PolarHBondContact O-N 2.94Å
505	G	89	Confident	91.6	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-109.5	28.6	174.3	0	0	0	0	0	112.4	P502 K503 E507 Q508	P502-G505 WeakPolarHBondContact O-CA 3.4Å; P502-G505 PolarHBondContact O-N 2.98Å; K503-G505 PolarHBondContact O-N 3.37Å; G505-E507 PolarHBondContact O-N 3.1Å; G505-Q508 WeakPolarHBondContact O-CB 3.39Å; G505-Q508 PolarHBondContact O-N 3.08Å
506	W	89.6	Confident	91.4	Very high	159 Å²	159	49 Å²	49	60%	0.602	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.5	26.9	171.1	-62.7	88.6	0	0	0	115.3	H369 H371 K503 Q508	H369-W506 AromaticContact NE2-CD1 3.87Å; H371-W506 AromaticContact CE1-CE2 3.54Å; H371-W506 AromaticContact CE1-CZ2 3.46Å; H371-W506 VanDerWaalsContact CE1-CZ2 3.46Å; H371-W506 WeakPolarHBondContact CE1-CZ2 3.43Å; H371-W506 AromaticContact CE1-NE1 3.25Å; H371-W506 PolarHBondContact CE1-NE1 3.49Å; H371-W506 AromaticContact CG-NE1 3.77Å; H371-W506 AromaticContact ND1-CD1 3.99Å; H371-W506 AromaticContact ND1-CE2 3.94Å; H371-W506 AromaticContact ND1-NE1 3.17Å; H371-W506 PolarHBondContact ND1-NE1 3.26Å; H371-W506 VanDerWaalsContact ND1-NE1 3.17Å; H371-W506 AromaticContact NE2-CZ2 3.66Å; H371-W506 AromaticContact NE2-NE1 3.85Å; K503-W506 PolarHBondContact O-N 3.4Å; K503-W506 VanDerWaalsContact O-N 3.14Å; W506-Q508 HydrophobicContact CB-CG 4Å; W506-Q508 PolarHBondContact O-N 3.28Å; W506-Q508 VanDerWaalsContact O-N 3.12Å
507	E	88.6	Confident	91.2	Very high	119 Å²	119	53.1 Å²	53.1	56%	0.556	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.9	29	-175.4	-58.6	-179.1	-176.2	0	0	112.9	T500 L501 K503 G505	T500-E507 HydrophobicContact CG2-CB 3.98Å; T500-E507 VanDerWaalsContact CG2-O 3.28Å; T500-E507 WeakPolarHBondContact CG2-O 3.49Å; L501-E507 WeakPolarHBondContact O-CA 3.15Å; K503-E507 WeakPolarHBondContact CG-OE1 3.35Å; G505-E507 PolarHBondContact O-N 3.1Å
508	Q	91.6	Very high	91.2	Very high	17 Å²	17	59.7 Å²	59.7	8%	0.079	28%	0.282	C	S	.	.	P	Polyproline II helix	trans	-82.7	169.2	174	-57.6	-174.9	-22.4	0	0	111.4	H367 H369 T387 Y389 L501 G505 W506	H367-Q508 PolarHBondContact CD2-OE1 3.33Å; H367-Q508 PolarHBondContact NE2-NE2 3.03Å; H367-Q508 VanDerWaalsContact NE2-NE2 3.2Å; H369-Q508 PolarHBondContact CE1-NE2 2.83Å; H369-Q508 VanDerWaalsContact CE1-NE2 3.32Å; H369-Q508 PolarHBondContact CE1-OE1 2.84Å; H369-Q508 VanDerWaalsContact CE1-OE1 3.27Å; H369-Q508 PolarHBondContact NE2-OE1 2.99Å; T387-Q508 HydrophobicContact CG2-CB 4.21Å; T387-Q508 PolarHBondContact OG1-OE1 2.8Å; Y389-Q508 HydrophobicContact CD2-CG 4Å; L501-Q508 WeakPolarHBondContact CB-O 3.32Å; L501-Q508 PolarHBondContact N-O 3.01Å; G505-Q508 WeakPolarHBondContact O-CB 3.39Å; G505-Q508 PolarHBondContact O-N 3.08Å; W506-Q508 HydrophobicContact CB-CG 4Å; W506-Q508 PolarHBondContact O-N 3.28Å; W506-Q508 VanDerWaalsContact O-N 3.12Å
509	V	92.1	Very high	91.3	Very high	9 Å²	9	63 Å²	63	6%	0.055	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	136.5	-177	178.8	0	0	0	0	111.6	T387 A388 K499 V511	T387-V509 CarbonylContact C-O 3.51Å; A388-V509 HydrophobicContact CB-CB 4.03Å; A388-V509 HydrophobicContact CB-CG1 4.39Å; A388-V509 PolarHBondContact N-O 3.17Å; A388-V509 WeakPolarHBondContact O-CB 3.39Å; A388-V509 PolarHBondContact O-N 3.2Å; K499-V509 WeakPolarHBondContact O-CA 3.43Å; V509-V511 PolarHBondContact O-N 2.87Å
510	E	94.8	Very high	91.3	Very high	1 Å²	1	60.4 Å²	60.4	1%	0.005	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	122.9	177.6	-175.4	-165.4	-144.5	0	0	111.9	P440 L441 T442 S497 K499 L501 T512	P440-E510 WeakPolarHBondContact CD-OE1 3.44Å; L441-E510 WeakPolarHBondContact CA-OE1 3.43Å; L441-E510 PolarHBondContact N-OE1 2.92Å; T442-E510 VanDerWaalsContact CB-OE2 3.32Å; T442-E510 WeakPolarHBondContact CB-OE2 3.39Å; T442-E510 PolarHBondContact N-OE1 2.89Å; T442-E510 PolarHBondContact N-OE2 3.38Å; T442-E510 PolarHBondContact OG1-OE2 2.81Å; S497-E510 WeakPolarHBondContact CB-OE2 3.2Å; S497-E510 PolarHBondContact N-O 3.26Å; S497-E510 WeakPolarHBondContact OG-CB 3.2Å; S497-E510 PolarHBondContact OG-OE2 3.44Å; K499-E510 PolarHBondContact O-N 3.24Å; L501-E510 HydrophobicContact CD2-CB 3.76Å; L501-E510 HydrophobicContact CD2-CG 4.06Å; L501-E510 HydrophobicContact CG-CB 4.26Å; E510-T512 HydrophobicContact CG-CG2 3.66Å
511	V	96.3	Very high	91.1	Very high	1 Å²	1	58.9 Å²	58.9	1%	0.006	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	141.7	165.9	171.9	0	0	0	0	109.3	L366 V386 T387 A388 V448 L494 V509 W525	L366-V511 HydrophobicContact CD1-CG1 4.1Å; L366-V511 HydrophobicContact CD1-CG2 4.37Å; V386-V511 HydrophobicContact CG1-CG1 4.34Å; T387-V511 WeakPolarHBondContact O-CG2 3.16Å; A388-V511 HydrophobicContact CB-CG2 3.72Å; V448-V511 HydrophobicContact CB-CG1 4.27Å; V448-V511 HydrophobicContact CG1-CG1 4.19Å; L494-V511 HydrophobicContact CD1-CG1 3.74Å; L494-V511 HydrophobicContact CG-CG1 4.47Å; V509-V511 PolarHBondContact O-N 2.87Å; V511-W525 HydrophobicContact CG2-CH2 4.12Å
512	T	95.5	Very high	91.1	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	166.9	-172.1	62.6	0	0	0	0	110.1	A439 H445 F446 Y495 E510	A439-T512 HydrophobicContact CB-CG2 3.58Å; H445-T512 HydrophobicContact CB-CG2 4.28Å; H445-T512 PolarHBondContact ND1-OG1 2.83Å; F446-T512 WeakPolarHBondContact O-CA 3.46Å; Y495-T512 PolarHBondContact N-O 3.02Å; Y495-T512 PolarHBondContact O-N 3.22Å; Y495-T512 VanDerWaalsContact O-O 3.11Å; Y495-T512 PolarHBondContact O-OG1 3.16Å; E510-T512 HydrophobicContact CG-CG2 3.66Å
513	C	96.4	Very high	91.2	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	113.3	167	-163	0	0	0	0	109.2	S434 F446 V448 W463 C492 V493	S434-C513 VanDerWaalsContact OG-CB 3.23Å; S434-C513 WeakPolarHBondContact OG-CB 3.44Å; F446-C513 HydrophobicContact CB-CB 4.28Å; F446-C513 PolarHBondContact N-O 3.02Å; F446-C513 PolarHBondContact O-N 3.05Å; V448-C513 HydrophobicContact CG2-CB 3.78Å; W463-C513 HydrophobicContact CH2-CB 4.39Å; C492-C513 HydrophobicContact CB-CB 4Å; C492-C513 WeakPolarHBondContact CB-SG 3.15Å; C492-C513 WeakPolarHBondContact SG-CB 3.38Å; C492-C513 CovalentContact SG-SG 2.03Å; C492-C513 PolarHBondContact SG-SG 3.23Å; V493-C513 CarbonylContact O-C 3.54Å; V493-C513 WeakPolarHBondContact O-CA 3.25Å
514	S	95.9	Very high	91.3	Very high	1 Å²	1	49.8 Å²	49.8	1%	0.007	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	128.6	-172	-170.2	0	0	0	0	111.4	H445 C492 V493 Y516	H445-S514 PolarHBondContact CD2-OG 2.79Å; H445-S514 VanDerWaalsContact CE1-CB 3.5Å; H445-S514 WeakPolarHBondContact CE1-CB 3.45Å; H445-S514 PolarHBondContact CE1-OG 2.93Å; H445-S514 VanDerWaalsContact CE1-OG 3.25Å; H445-S514 PolarHBondContact NE2-OG 3.45Å; C492-S514 CarbonylContact C-O 3.56Å; C492-S514 VanDerWaalsContact CA-O 3.3Å; C492-S514 WeakPolarHBondContact CA-O 3.46Å; C492-S514 VanDerWaalsContact CB-O 3.26Å; C492-S514 WeakPolarHBondContact CB-O 3.46Å; V493-S514 PolarHBondContact N-O 2.77Å; V493-S514 PolarHBondContact O-N 3.29Å; S514-Y516 PolarHBondContact O-N 2.95Å; S514-Y516 PolarHBondContact OG-N 2.93Å
515	P	93.7	Very high	91.4	Very high	58 Å²	58	46.2 Å²	46.2	38%	0.377	22%	0.219	S	C	.	.	S	Bend	trans	-69.6	-9.5	170.7	30.5	-35.4	0	0	0	112.7	F446 L517	F446-P515 HydrophobicContact CE2-CB 4.28Å; P515-L517 PolarHBondContact O-N 2.89Å
516	Y	91.2	Very high	91.5	Very high	135 Å²	135	46.8 Å²	46.8	53%	0.529	22%	0.222	S	C	.	.			trans	-88	91	180	-57.4	-69.9	0	0	0	110.9	K444 H445 S514 K518	K444-Y516 HydrophobicContact CB-CE2 4.42Å; H445-Y516 AromaticContact NE2-CD2 3.89Å; S514-Y516 PolarHBondContact O-N 2.95Å; S514-Y516 PolarHBondContact OG-N 2.93Å; Y516-K518 PolarHBondContact O-N 3.4Å
517	L	88.9	Confident	91.6	Very high	85 Å²	85	39.3 Å²	39.3	45%	0.445	19%	0.194	S	C	.	.			trans	-65	10.9	-178.5	-66.9	178.8	0	0	0	116.3	R484 L486 G491 V493 P515 E519	R484-L517 PolarHBondContact NH1-O 2.62Å; L486-L517 HydrophobicContact CD2-CD2 4.43Å; L486-L517 HydrophobicContact CG-CD2 4.45Å; G491-L517 WeakPolarHBondContact O-CD2 3.23Å; V493-L517 HydrophobicContact CB-CD2 4.09Å; V493-L517 HydrophobicContact CG1-CD2 4.26Å; P515-L517 PolarHBondContact O-N 2.89Å; L517-E519 PolarHBondContact O-N 3.25Å
518	K	87.9	Confident	91.4	Very high	163 Å²	163	33.7 Å²	33.7	71%	0.709	17%	0.167	S	C	*	.			trans	-68.7	126.1	178.3	-178.5	174	180	174.1	0	110.4	Y516 T520	Y516-K518 PolarHBondContact O-N 3.4Å; K518-T520 HydrophobicContact CG-CG2 4.4Å; K518-T520 PolarHBondContact O-N 3.02Å; K518-T520 VanDerWaalsContact O-N 3.17Å
519	E	86.4	Confident	91.2	Very high	91 Å²	91	34.5 Å²	34.5	43%	0.425	17%	0.172	S	C	.	.			trans	-58.4	120.8	173.2	-76	-161.6	-146.5	0	0	111.7	C468 R484 L517 Q524	C468-E519 PolarHBondContact SG-OE2 3.16Å; R484-E519 VanDerWaalsContact NH1-CG 3.33Å; L517-E519 PolarHBondContact O-N 3.25Å; E519-Q524 PolarHBondContact OE2-NE2 2.83Å
520	T	87.8	Confident	91	Very high	35 Å²	35	34.4 Å²	34.4	22%	0.215	17%	0.171	C	C	.	.			trans	-146.7	154	178.6	55.9	0	0	0	0	109.5	Y495 K518 S522 S523 Q524	Y495-T520 WeakPolarHBondContact CE2-OG1 3.34Å; K518-T520 HydrophobicContact CG-CG2 4.4Å; K518-T520 PolarHBondContact O-N 3.02Å; K518-T520 VanDerWaalsContact O-N 3.17Å; T520-S522 PolarHBondContact O-N 3.15Å; T520-S522 VanDerWaalsContact O-N 3.12Å; T520-S523 PolarHBondContact N-OG 3.4Å; T520-S523 PolarHBondContact O-N 3.16Å; T520-S523 PolarHBondContact O-OG 2.96Å; T520-S523 PolarHBondContact OG1-N 2.75Å; T520-S523 PolarHBondContact OG1-OG 2.62Å; T520-Q524 WeakPolarHBondContact O-CG 3.16Å; T520-Q524 PolarHBondContact O-N 3.38Å
521	P	85.8	Confident	90.7	Very high	56 Å²	56	38.8 Å²	38.8	36%	0.364	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-28.9	177.2	-27.4	35.9	0	0	0	114.5	N358 L359 R360 Q524	N358-P521 PolarHBondContact OD1-O 3.18Å; L359-P521 CarbonylContact C-O 3.5Å; R360-P521 PolarHBondContact N-O 3.47Å; P521-Q524 PolarHBondContact O-N 3.21Å; P521-Q524 VanDerWaalsContact O-O 3.09Å
522	S	89.4	Confident	90.3	Very high	13 Å²	13	39.1 Å²	39.1	9%	0.091	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69	-29.5	173.6	-85	0	0	0	0	114.4	N358 R360 Y495 S496 T520	N358-S522 PolarHBondContact ND2-O 3.47Å; R360-S522 WeakPolarHBondContact CD-OG 3.45Å; Y495-S522 WeakPolarHBondContact CA-O 3.42Å; Y495-S522 VanDerWaalsContact CE1-CB 3.5Å; S496-S522 PolarHBondContact N-O 2.76Å; S496-S522 WeakPolarHBondContact O-CB 3.5Å; S496-S522 PolarHBondContact O-OG 3.1Å; T520-S522 PolarHBondContact O-N 3.15Å; T520-S522 VanDerWaalsContact O-N 3.12Å
523	S	93	Very high	89.8	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87	-11.5	175.3	66.6	0	0	0	0	113.8	T520	T520-S523 PolarHBondContact N-OG 3.4Å; T520-S523 PolarHBondContact O-N 3.16Å; T520-S523 PolarHBondContact O-OG 2.96Å; T520-S523 PolarHBondContact OG1-N 2.75Å; T520-S523 PolarHBondContact OG1-OG 2.62Å
524	Q	92.8	Very high	89.3	Confident	27 Å²	27	51.6 Å²	51.6	13%	0.126	26%	0.259	C	S	.	.			trans	-100.4	136.6	-177.5	-70.2	178.2	-10.9	0	0	109.9	N358 L359 E519 T520 P521	N358-Q524 PolarHBondContact ND2-O 3.05Å; L359-Q524 HydrophobicContact CB-CB 4.14Å; L359-Q524 WeakPolarHBondContact CB-O 3.27Å; L359-Q524 HydrophobicContact CD1-CB 3.77Å; L359-Q524 PolarHBondContact N-O 3.26Å; E519-Q524 PolarHBondContact OE2-NE2 2.83Å; T520-Q524 WeakPolarHBondContact O-CG 3.16Å; T520-Q524 PolarHBondContact O-N 3.38Å; P521-Q524 PolarHBondContact O-N 3.21Å; P521-Q524 VanDerWaalsContact O-O 3.09Å
525	W	92.9	Very high	88.7	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	157.3	179.9	-57.6	81.3	0	0	0	109.6	V356 K357 N358 L366 V483 F485 L494 V511	V356-W525 HydrophobicContact CG1-CB 3.84Å; V356-W525 HydrophobicContact CG1-CD2 4.24Å; V356-W525 HydrophobicContact CG1-CE3 3.88Å; V356-W525 HydrophobicContact CG1-CG 4.27Å; K357-W525 CarbonylContact O-C 3.59Å; K357-W525 WeakPolarHBondContact O-CA 3.42Å; N358-W525 HydrophobicContact CB-CD2 4.26Å; N358-W525 HydrophobicContact CB-CE3 3.69Å; N358-W525 HydrophobicContact CB-CH2 4.07Å; N358-W525 HydrophobicContact CB-CZ3 3.61Å; N358-W525 VanDerWaalsContact ND2-CZ2 3.26Å; N358-W525 WeakPolarHBondContact ND2-CZ2 3.47Å; L366-W525 HydrophobicContact CB-CZ3 4.06Å; L366-W525 HydrophobicContact CD1-CH2 4.22Å; V483-W525 HydrophobicContact CG2-CB 4.23Å; V483-W525 WeakPolarHBondContact CG2-O 3.21Å; V483-W525 PolarHBondContact N-O 3.37Å; V483-W525 PolarHBondContact O-N 3.22Å; F485-W525 HydrophobicContact CD2-CB 4.49Å; F485-W525 AromaticContact CD2-CD1 3.96Å; F485-W525 HydrophobicContact CD2-CG 4.21Å; F485-W525 HydrophobicContact CE2-CB 3.91Å; F485-W525 HydrophobicContact CE2-CG 4.05Å; L494-W525 HydrophobicContact CD2-CZ2 3.93Å; L494-W525 HydrophobicContact CG-CZ2 3.78Å; L494-W525 PolarHBondContact O-NE1 3.15Å; V511-W525 HydrophobicContact CG2-CH2 4.12Å
526	N	91.1	Very high	88.3	Confident	13 Å²	13	55.1 Å²	55.1	7%	0.07	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	145.8	172.9	-162.5	12	0	0	0	109.1	V356 K357 L359 L479	V356-N526 CarbonylContact C-O 3.59Å; V356-N526 WeakPolarHBondContact CA-O 3.41Å; K357-N526 PolarHBondContact N-O 2.87Å; K357-N526 PolarHBondContact O-N 3.44Å; L359-N526 HydrophobicContact CD1-CB 4.32Å; L359-N526 HydrophobicContact CD2-CB 4.39Å; L359-N526 HydrophobicContact CG-CB 4.29Å; L479-N526 VanDerWaalsContact C-OD1 3.28Å; L479-N526 VanDerWaalsContact CA-OD1 3.3Å; L479-N526 WeakPolarHBondContact CA-OD1 3.43Å; L479-N526 PolarHBondContact O-ND2 3.22Å; L479-N526 PolarHBondContact O-OD1 3.08Å
527	I	91.2	Very high	87.9	Confident	2 Å²	2	53 Å²	53	1%	0.01	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	119.2	173.3	-58.7	177	0	0	0	106.4	L348 I354 V476 V478 L479 V483	L348-I527 HydrophobicContact CB-CD1 4.39Å; L348-I527 HydrophobicContact CD1-CD1 4.17Å; L348-I527 HydrophobicContact CD2-CD1 3.7Å; L348-I527 HydrophobicContact CG-CD1 4.31Å; I354-I527 HydrophobicContact CB-CG2 3.99Å; I354-I527 HydrophobicContact CD1-CD1 4.44Å; I354-I527 HydrophobicContact CG2-CG2 3.71Å; V476-I527 HydrophobicContact CG1-CD1 3.64Å; V478-I527 HydrophobicContact CG1-CG2 4.34Å; V478-I527 HydrophobicContact CG2-CG2 4.14Å; L479-I527 WeakPolarHBondContact CA-O 3.49Å; L479-I527 PolarHBondContact N-O 2.85Å; V483-I527 HydrophobicContact CG2-CG1 4.46Å
528	E	85.1	Confident	87.4	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	-60.3	-164.7	179	156.3	-148.4	0	0	112.9	S328 L339 M344 T355 K357 Y365 L479	S328-E528 WeakPolarHBondContact CB-OE1 3.48Å; S328-E528 PolarHBondContact OG-OE1 2.65Å; L339-E528 HydrophobicContact CD1-CG 4.11Å; L339-E528 HydrophobicContact CD2-CG 4.29Å; M344-E528 WeakPolarHBondContact CE-O 3.49Å; T355-E528 PolarHBondContact O-N 2.95Å; K357-E528 WeakPolarHBondContact CB-OE2 3.32Å; K357-E528 WeakPolarHBondContact CD-OE2 3.48Å; Y365-E528 WeakPolarHBondContact CE1-OE2 3.24Å; Y365-E528 PolarHBondContact OH-OE2 2.83Å; L479-E528 HydrophobicContact CD2-CB 4.37Å; L479-E528 HydrophobicContact CD2-CG 4.19Å
529	D	86.3	Confident	86.7	Confident	34 Å²	34	47.2 Å²	47.2	18%	0.182	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	138.4	167.3	-48.8	-71.6	0	0	0	109.1	L339 I354 T355 K392	L339-D529 WeakPolarHBondContact CD2-OD1 3.39Å; I354-D529 CarbonylContact C-O 3.49Å; I354-D529 VanDerWaalsContact CA-O 3.28Å; I354-D529 WeakPolarHBondContact CA-O 3.48Å; T355-D529 HydrophobicContact CG2-CB 4.07Å; T355-D529 PolarHBondContact N-O 2.64Å; T355-D529 VanDerWaalsContact OG1-CB 3.3Å; T355-D529 WeakPolarHBondContact OG1-CB 3.31Å; T355-D529 PolarHBondContact OG1-N 3.23Å; T355-D529 PolarHBondContact OG1-OD2 2.76Å; K392-D529 IonicContact NZ-OD1 3.08Å; K392-D529 PolarHBondContact NZ-OD1 3.36Å; K392-D529 IonicContact NZ-OD2 3.02Å; K392-D529 PolarHBondContact NZ-OD2 2.8Å
530	H	89.3	Confident	85.7	Confident	7 Å²	7	43 Å²	43	3%	0.032	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	124.2	179	177.6	-143.8	0	0	0	110.3	P345 Y347 S352 I354 V478	P345-H530 WeakPolarHBondContact CD-O 3.38Å; P345-H530 PolarHBondContact O-ND1 2.92Å; Y347-H530 PolarHBondContact O-CE1 3.17Å; S352-H530 WeakPolarHBondContact CB-NE2 3.48Å; S352-H530 PolarHBondContact OG-NE2 3.42Å; I354-H530 HydrophobicContact CG2-CB 4.4Å; V478-H530 HydrophobicContact CG1-CB 4.01Å; V478-H530 HydrophobicContact CG2-CB 3.77Å
531	I	88.8	Confident	84.5	Confident	93 Å²	93	44 Å²	44	48%	0.477	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	115.5	-177.7	-53.6	177.9	0	0	0	109.1	T353 M397	T353-I531 PolarHBondContact N-O 2.78Å; T353-I531 PolarHBondContact O-N 2.94Å; M397-I531 HydrophobicContact CE-CD1 3.67Å
532	N	88	Confident	83.4	Confident	9 Å²	9	47.4 Å²	47.4	5%	0.048	26%	0.262	C	S	.	.			trans	-150.4	117.8	169.2	-170.8	-32.4	0	0	0	109.5	S352 R534 L535	S352-N532 WeakPolarHBondContact OG-CB 3.47Å; S352-N532 PolarHBondContact OG-ND2 2.89Å; N532-R534 PolarHBondContact O-N 3.11Å; N532-R534 WeakPolarHBondContact OD1-CB 3.2Å; N532-R534 PolarHBondContact OD1-N 3.48Å; N532-L535 HydrophobicContact CB-CD1 4.18Å; N532-L535 HydrophobicContact CB-CG 4.48Å; N532-L535 PolarHBondContact O-N 3.16Å
533	P	84.7	Confident	82.2	Confident	131 Å²	131	48.4 Å²	48.4	85%	0.851	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-9	-177.8	30.8	-36.2	0	0	0	114
534	R	84.3	Confident	81.2	Confident	130 Å²	130	52.6 Å²	52.6	49%	0.491	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.2	-4.3	178.3	-55.9	-172.8	-175.4	-167.9	1.8	113.8	S409 P412 N532	S409-R534 PolarHBondContact O-NH1 2.87Å; P412-R534 HydrophobicContact CB-CB 4.27Å; P412-R534 HydrophobicContact CG-CB 4.38Å; N532-R534 PolarHBondContact O-N 3.11Å; N532-R534 WeakPolarHBondContact OD1-CB 3.2Å; N532-R534 PolarHBondContact OD1-N 3.48Å
535	L	84.8	Confident	80.5	Confident	28 Å²	28	52.6 Å²	52.6	15%	0.147	29%	0.287	C	S	.	.	S	Bend	trans	-115.7	147.4	-176.6	-67.3	173.5	0	0	0	112.2	P345 A349 P412 L414 N532	P345-L535 HydrophobicContact CB-CB 3.59Å; P345-L535 HydrophobicContact CB-CD1 3.68Å; P345-L535 HydrophobicContact CB-CG 4.31Å; P345-L535 HydrophobicContact CG-CB 3.84Å; P345-L535 HydrophobicContact CG-CD1 4.18Å; A349-L535 HydrophobicContact CB-CD1 3.86Å; P412-L535 HydrophobicContact CB-CD2 3.96Å; P412-L535 HydrophobicContact CB-CG 4.43Å; P412-L535 HydrophobicContact CG-CD2 3.49Å; P412-L535 VanDerWaalsContact CG-CD2 3.49Å; P412-L535 HydrophobicContact CG-CG 4.3Å; L414-L535 HydrophobicContact CD2-CD2 4.03Å; N532-L535 HydrophobicContact CB-CD1 4.18Å; N532-L535 HydrophobicContact CB-CG 4.48Å; N532-L535 PolarHBondContact O-N 3.16Å
536	P	84.4	Confident	80.2	Confident	105 Å²	105	57.5 Å²	57.5	68%	0.682	31%	0.313	S	S	*	.			trans	-69.8	130.6	171.5	29.6	-33.8	0	0	0	110.9
537	N	83.1	Confident	80.1	Confident	90 Å²	90	60.1 Å²	60.1	48%	0.481	32%	0.324	S	S	.	.			trans	-78.3	135.5	174.1	-71.6	-27.9	0	0	0	111.1	M344 P345	M344-N537 WeakPolarHBondContact CA-OD1 3.46Å; P345-N537 WeakPolarHBondContact CD-OD1 3.38Å; P345-N537 WeakPolarHBondContact CG-OD1 3.27Å
538	I	77.8	Confident	80	Confident	73 Å²	73	65.7 Å²	65.7	37%	0.374	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	142.8	173.5	-54.7	-168	0	0	0	109	S343 M344 E346 L542	S343-I538 WeakPolarHBondContact CA-O 3.13Å; M344-I538 PolarHBondContact N-O 3.25Å; M344-I538 VanDerWaalsContact N-O 3.13Å; M344-I538 PolarHBondContact O-N 3.31Å; E346-I538 HydrophobicContact CB-CD1 3.96Å; I538-L542 HydrophobicContact CG2-CD1 4.44Å
539	S	72.8	Confident	80.1	Confident	54 Å²	54	70.4 Å²	70.4	38%	0.378	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	130.3	179.5	72.5	0	0	0	0	112.3	S541	S539-S541 PolarHBondContact O-N 3.09Å; S539-S541 PolarHBondContact OG-OG 3.37Å
540	L	66.8	Low	80.2	Confident	4 Å²	4	68.9 Å²	68.9	2%	0.021	37%	0.367	C	S	.	.	G	3₁₀ helix	trans	-64.2	-7.5	179.5	-96	154.1	0	0	0	115.3	V342 M344 L479 L542 L543	V342-L540 HydrophobicContact CB-CD1 3.82Å; V342-L540 HydrophobicContact CG1-CD1 4.18Å; V342-L540 WeakPolarHBondContact O-CB 3.47Å; V342-L540 PolarHBondContact O-N 3.13Å; V342-L540 VanDerWaalsContact O-N 3.09Å; M344-L540 HydrophobicContact CE-CD1 3.76Å; M344-L540 HydrophobicContact CG-CD1 4.01Å; M344-L540 HydrophobicContact CG-CG 4.46Å; M344-L540 HydrophobicContact SD-CD1 3.95Å; L479-L540 HydrophobicContact CD1-CD1 4.2Å; L479-L540 HydrophobicContact CD1-CD2 3.45Å; L479-L540 VanDerWaalsContact CD1-CD2 3.45Å; L479-L540 HydrophobicContact CD1-CG 4.36Å; L540-L542 PolarHBondContact O-N 2.72Å; L540-L543 HydrophobicContact CD2-CB 4.06Å; L540-L543 HydrophobicContact CD2-CD1 3.63Å; L540-L543 HydrophobicContact CD2-CG 4.34Å; L540-L543 HydrophobicContact CG-CD1 4.38Å; L540-L543 PolarHBondContact O-N 3Å
541	S	62.2	Low	80.3	Confident	54 Å²	54	69.4 Å²	69.4	38%	0.378	37%	0.37	S	S	.	.	G	3₁₀ helix	trans	-55.7	-34.6	177.2	63.4	0	0	0	0	113.2	S539 L543	S539-S541 PolarHBondContact O-N 3.09Å; S539-S541 PolarHBondContact OG-OG 3.37Å; S541-L543 VanDerWaalsContact C-N 3.25Å; S541-L543 PolarHBondContact O-N 3.32Å
542	L	62.5	Low	80.4	Confident	128 Å²	128	70.4 Å²	70.4	67%	0.67	38%	0.376	S	S	*	.	G	3₁₀ helix	trans	-76.2	-5	179.5	-62.6	173.2	0	0	0	114.4	I538 L540	I538-L542 HydrophobicContact CG2-CD1 4.44Å; L540-L542 PolarHBondContact O-N 2.72Å
543	L	65.4	Low	80.3	Confident	34 Å²	34	72.2 Å²	72.2	18%	0.178	38%	0.384	C	S	.	.	G	3₁₀ helix	trans	-113.4	5.8	-173.6	-56.4	178.2	0	0	0	113	L540 S541	L540-L543 HydrophobicContact CD2-CB 4.06Å; L540-L543 HydrophobicContact CD2-CD1 3.63Å; L540-L543 HydrophobicContact CD2-CG 4.34Å; L540-L543 HydrophobicContact CG-CD1 4.38Å; L540-L543 PolarHBondContact O-N 3Å; S541-L543 VanDerWaalsContact C-N 3.25Å; S541-L543 PolarHBondContact O-N 3.32Å
544	K	71.9	Confident	80.6	Confident	89 Å²	89	66 Å²	66	39%	0.387	34%	0.344	S	S	.	.	P	Polyproline II helix	trans	-68.3	132.8	-179.6	-70.1	-179.6	175.1	179.8	0	111.3
545	P	77.6	Confident	81	Confident	26 Å²	26	61.5 Å²	61.5	17%	0.169	33%	0.328	C	S	.	.	P	Polyproline II helix	trans	-74.4	152.1	-176.5	28.3	-33.5	0	0	0	112.9	T329 E549 I550	T329-P545 WeakPolarHBondContact O-CD 3.25Å; P545-E549 VanDerWaalsContact CA-OE2 3.28Å; P545-E549 WeakPolarHBondContact CA-OE2 3.4Å; P545-E549 HydrophobicContact CB-CB 4.24Å; P545-E549 WeakPolarHBondContact CB-OE2 3.36Å; P545-I550 HydrophobicContact CB-CG1 4.15Å; P545-I550 HydrophobicContact CG-CD1 4.1Å; P545-I550 HydrophobicContact CG-CG1 3.82Å
546	N	86.8	Confident	81.1	Confident	103 Å²	103	63.9 Å²	63.9	55%	0.551	34%	0.34	S	S	*	.	P	Polyproline II helix	trans	-68.7	153.2	177.2	-68.6	-64.5	0	0	0	111.6	L548 E549 I550	N546-L548 PolarHBondContact O-N 3Å; N546-L548 VanDerWaalsContact O-N 3.17Å; N546-E549 HydrophobicContact CB-CG 4.17Å; N546-E549 PolarHBondContact N-OE2 3Å; N546-E549 PolarHBondContact ND2-OE1 3.29Å; N546-E549 WeakPolarHBondContact O-CA 3.39Å; N546-E549 WeakPolarHBondContact O-CB 3.38Å; N546-E549 PolarHBondContact O-N 3.25Å; N546-I550 WeakPolarHBondContact O-CG1 3.42Å; N546-I550 PolarHBondContact O-N 2.95Å
547	F	89	Confident	81.1	Confident	68 Å²	68	59.1 Å²	59.1	30%	0.298	31%	0.309	S	S	.	.	H	α-helix	trans	-56.1	-36.6	179.8	171.3	-105.9	0	0	0	113.6	V305 A309 F312 I550 L551	V305-F547 HydrophobicContact CG1-CE1 3.68Å; V305-F547 HydrophobicContact CG1-CZ 4.02Å; A309-F547 HydrophobicContact CB-CE2 3.96Å; A309-F547 HydrophobicContact CB-CZ 3.81Å; F312-F547 HydrophobicContact CD2-CE2 4.13Å; F547-I550 PolarHBondContact O-N 3.44Å; F547-L551 WeakPolarHBondContact O-CB 3.45Å; F547-L551 PolarHBondContact O-N 3.07Å
548	L	88.5	Confident	81.4	Confident	119 Å²	119	55.2 Å²	55.2	62%	0.623	29%	0.288	S	S	*	.	H	α-helix	trans	-68.7	-32.6	175.8	-64.9	178.6	0	0	0	113	N546 L552	N546-L548 PolarHBondContact O-N 3Å; N546-L548 VanDerWaalsContact O-N 3.17Å; L548-L552 WeakPolarHBondContact O-CD1 3.48Å; L548-L552 PolarHBondContact O-N 3.14Å
549	E	86.8	Confident	81.9	Confident	100 Å²	100	56.6 Å²	56.6	47%	0.467	30%	0.295	S	S	.	.	H	α-helix	trans	-69.2	-41.6	174.2	-66.1	156.4	-161.6	0	0	110.6	P545 N546 L552 E553	P545-E549 VanDerWaalsContact CA-OE2 3.28Å; P545-E549 WeakPolarHBondContact CA-OE2 3.4Å; P545-E549 HydrophobicContact CB-CB 4.24Å; P545-E549 WeakPolarHBondContact CB-OE2 3.36Å; N546-E549 HydrophobicContact CB-CG 4.17Å; N546-E549 PolarHBondContact N-OE2 3Å; N546-E549 PolarHBondContact ND2-OE1 3.29Å; N546-E549 WeakPolarHBondContact O-CA 3.39Å; N546-E549 WeakPolarHBondContact O-CB 3.38Å; N546-E549 PolarHBondContact O-N 3.25Å; E549-L552 WeakPolarHBondContact O-CA 3.36Å; E549-L552 PolarHBondContact O-N 2.98Å; E549-E553 WeakPolarHBondContact O-CB 3.46Å; E549-E553 PolarHBondContact O-N 2.86Å
550	I	88.7	Confident	82.1	Confident	2 Å²	2	60 Å²	60	1%	0.01	30%	0.3	C	S	.	.	H	α-helix	trans	-62.4	-45.4	175	-63.3	176.8	0	0	0	111	F312 F330 R333 P545 N546 F547 L552 E553 S554	F312-I550 HydrophobicContact CD1-CG2 4.13Å; F312-I550 HydrophobicContact CD2-CG2 3.91Å; F312-I550 HydrophobicContact CE1-CG2 3.92Å; F312-I550 HydrophobicContact CE2-CG2 3.68Å; F312-I550 HydrophobicContact CG-CG2 4.15Å; F312-I550 HydrophobicContact CZ-CG2 3.7Å; F330-I550 HydrophobicContact CD2-CB 4.41Å; F330-I550 HydrophobicContact CD2-CD1 4.22Å; F330-I550 HydrophobicContact CD2-CG1 4.02Å; F330-I550 HydrophobicContact CD2-CG2 3.72Å; F330-I550 HydrophobicContact CE2-CG2 3.57Å; R333-I550 VanDerWaalsContact NH1-CD1 3.33Å; P545-I550 HydrophobicContact CB-CG1 4.15Å; P545-I550 HydrophobicContact CG-CD1 4.1Å; P545-I550 HydrophobicContact CG-CG1 3.82Å; N546-I550 WeakPolarHBondContact O-CG1 3.42Å; N546-I550 PolarHBondContact O-N 2.95Å; F547-I550 PolarHBondContact O-N 3.44Å; I550-L552 VanDerWaalsContact C-N 3.35Å; I550-E553 PolarHBondContact O-N 2.92Å; I550-S554 VanDerWaalsContact O-CB 3.26Å; I550-S554 WeakPolarHBondContact O-CB 3.19Å; I550-S554 PolarHBondContact O-N 3.23Å
551	L	92.2	Very high	82.8	Confident	18 Å²	18	60.7 Å²	60.7	9%	0.094	31%	0.308	C	S	.	.	H	α-helix	trans	-62.8	-44.2	175.6	-171.6	71	0	0	0	110.9	V305 F308 F547 H555	V305-L551 HydrophobicContact CG1-CD2 4.39Å; V305-L551 HydrophobicContact CG2-CD2 4.08Å; F308-L551 HydrophobicContact CB-CD1 3.48Å; F308-L551 VanDerWaalsContact CB-CD1 3.48Å; F308-L551 HydrophobicContact CD1-CD1 3.82Å; F308-L551 HydrophobicContact CD2-CD1 4.22Å; F308-L551 HydrophobicContact CG-CD1 3.58Å; F547-L551 WeakPolarHBondContact O-CB 3.45Å; F547-L551 PolarHBondContact O-N 3.07Å; L551-H555 PolarHBondContact O-N 2.86Å; L551-H555 VanDerWaalsContact O-N 3.12Å; L551-H555 PolarHBondContact O-ND1 3.22Å
552	L	90.1	Very high	83.8	Confident	114 Å²	114	59.6 Å²	59.6	60%	0.597	30%	0.298	S	S	*	.	H	α-helix	trans	-45.8	-64.7	169.2	65.4	63.9	0	0	0	112.2	L548 E549 I550 S554 H555 I556	L548-L552 WeakPolarHBondContact O-CD1 3.48Å; L548-L552 PolarHBondContact O-N 3.14Å; E549-L552 WeakPolarHBondContact O-CA 3.36Å; E549-L552 PolarHBondContact O-N 2.98Å; I550-L552 VanDerWaalsContact C-N 3.35Å; L552-S554 PolarHBondContact O-N 3.38Å; L552-H555 PolarHBondContact O-N 2.88Å; L552-I556 VanDerWaalsContact O-CG1 3.31Å; L552-I556 WeakPolarHBondContact O-CG1 3.26Å; L552-I556 PolarHBondContact O-N 3.28Å; L552-I556 VanDerWaalsContact O-N 3.1Å
553	E	86.9	Confident	84.6	Confident	46 Å²	46	57.1 Å²	57.1	22%	0.215	29%	0.291	C	S	.	.	H	α-helix	trans	-58.1	-48.1	-178.7	177.2	161.8	-137.7	0	0	111.6	F326 S327 E549 I550 H555 I556 V557	F326-E553 HydrophobicContact CD1-CG 3.87Å; F326-E553 HydrophobicContact CE1-CG 4.36Å; S327-E553 WeakPolarHBondContact CA-OE1 3.43Å; S327-E553 WeakPolarHBondContact CB-OE1 3.45Å; S327-E553 WeakPolarHBondContact CB-OE2 3.49Å; S327-E553 PolarHBondContact N-OE1 3.29Å; S327-E553 PolarHBondContact OG-OE1 3.34Å; S327-E553 PolarHBondContact OG-OE2 3.44Å; E549-E553 WeakPolarHBondContact O-CB 3.46Å; E549-E553 PolarHBondContact O-N 2.86Å; I550-E553 PolarHBondContact O-N 2.92Å; E553-H555 VanDerWaalsContact C-N 3.31Å; E553-H555 PolarHBondContact O-N 2.91Å; E553-I556 WeakPolarHBondContact O-CB 3.23Å; E553-I556 PolarHBondContact O-N 3.32Å; E553-I556 VanDerWaalsContact O-N 3.08Å; E553-V557 HydrophobicContact CG-CG2 4.17Å; E553-V557 WeakPolarHBondContact O-CG2 3.19Å; E553-V557 PolarHBondContact O-N 3.11Å
554	S	89.9	Confident	84.9	Confident	2 Å²	2	58.1 Å²	58.1	1%	0.014	31%	0.31	C	S	.	.	H	α-helix	trans	-55.7	-44.1	179.4	-176.1	0	0	0	0	112.6	I550 L552 V557 M558	I550-S554 VanDerWaalsContact O-CB 3.26Å; I550-S554 WeakPolarHBondContact O-CB 3.19Å; I550-S554 PolarHBondContact O-N 3.23Å; L552-S554 PolarHBondContact O-N 3.38Å; S554-V557 PolarHBondContact O-N 2.9Å; S554-M558 WeakPolarHBondContact O-CB 3.45Å; S554-M558 VanDerWaalsContact O-CG 3.3Å; S554-M558 WeakPolarHBondContact O-CG 3.46Å; S554-M558 PolarHBondContact O-N 3.07Å
555	H	92.6	Very high	85.2	Confident	35 Å²	35	57.9 Å²	57.9	16%	0.162	31%	0.312	C	S	.	.	H	α-helix	trans	-67.6	-39.4	176.8	-76.5	74.1	0	0	0	112.4	Y304 F308 L551 L552 E553 V557 M558 I559	Y304-H555 AromaticContact CE1-CE1 3.88Å; Y304-H555 AromaticContact CE1-NE2 3.32Å; Y304-H555 VanDerWaalsContact CE1-NE2 3.32Å; Y304-H555 WeakPolarHBondContact CE1-NE2 3.48Å; Y304-H555 AromaticContact CZ-NE2 3.46Å; Y304-H555 PolarHBondContact OH-NE2 3.29Å; F308-H555 AromaticContact CE1-CE1 3.86Å; F308-H555 AromaticContact CE2-CE1 3.86Å; F308-H555 AromaticContact CZ-CE1 3.63Å; F308-H555 AromaticContact CZ-NE2 3.93Å; L551-H555 PolarHBondContact O-N 2.86Å; L551-H555 VanDerWaalsContact O-N 3.12Å; L551-H555 PolarHBondContact O-ND1 3.22Å; L552-H555 PolarHBondContact O-N 2.88Å; E553-H555 VanDerWaalsContact C-N 3.31Å; E553-H555 PolarHBondContact O-N 2.91Å; H555-V557 VanDerWaalsContact C-N 3.33Å; H555-V557 PolarHBondContact O-N 3.49Å; H555-M558 PolarHBondContact O-N 2.54Å; H555-I559 WeakPolarHBondContact O-CB 3.35Å; H555-I559 WeakPolarHBondContact O-CD1 3.45Å; H555-I559 VanDerWaalsContact O-CG1 3.24Å; H555-I559 WeakPolarHBondContact O-CG1 3.5Å; H555-I559 PolarHBondContact O-N 3.09Å
556	I	86.5	Confident	85.2	Confident	78 Å²	78	63.6 Å²	63.6	40%	0.4	33%	0.334	S	S	.	.	H	α-helix	trans	-62	-41.7	175.6	-68.1	166.8	0	0	0	110.8	L552 E553 R560	L552-I556 VanDerWaalsContact O-CG1 3.31Å; L552-I556 WeakPolarHBondContact O-CG1 3.26Å; L552-I556 PolarHBondContact O-N 3.28Å; L552-I556 VanDerWaalsContact O-N 3.1Å; E553-I556 WeakPolarHBondContact O-CB 3.23Å; E553-I556 PolarHBondContact O-N 3.32Å; E553-I556 VanDerWaalsContact O-N 3.08Å; I556-R560 VanDerWaalsContact CG2-CZ 3.47Å; I556-R560 VanDerWaalsContact O-CB 3.31Å; I556-R560 WeakPolarHBondContact O-CB 3.05Å; I556-R560 WeakPolarHBondContact O-CD 3.38Å; I556-R560 VanDerWaalsContact O-CG 3.24Å; I556-R560 WeakPolarHBondContact O-CG 3.41Å; I556-R560 PolarHBondContact O-N 3.2Å
557	V	85.2	Confident	84.3	Confident	4 Å²	4	61.9 Å²	61.9	2%	0.024	33%	0.329	C	S	.	.	H	α-helix	trans	-71.7	-42.6	178	-176.2	0	0	0	0	111.1	F113 F325 I361 E553 S554 H555 R560 G561	F113-V557 HydrophobicContact CD2-CG1 3.91Å; F113-V557 HydrophobicContact CE1-CG1 4.33Å; F113-V557 HydrophobicContact CE2-CB 4.17Å; F113-V557 HydrophobicContact CE2-CG1 3.5Å; F113-V557 VanDerWaalsContact CE2-CG1 3.5Å; F113-V557 HydrophobicContact CG-CG1 4.5Å; F113-V557 HydrophobicContact CZ-CG1 3.74Å; F325-V557 HydrophobicContact CB-CG1 3.86Å; I361-V557 HydrophobicContact CD1-CB 4.27Å; I361-V557 HydrophobicContact CD1-CG1 4.32Å; I361-V557 HydrophobicContact CD1-CG2 4Å; E553-V557 HydrophobicContact CG-CG2 4.17Å; E553-V557 WeakPolarHBondContact O-CG2 3.19Å; E553-V557 PolarHBondContact O-N 3.11Å; S554-V557 PolarHBondContact O-N 2.9Å; H555-V557 VanDerWaalsContact C-N 3.33Å; H555-V557 PolarHBondContact O-N 3.49Å; V557-R560 PolarHBondContact O-N 3.27Å; V557-G561 PolarHBondContact O-N 2.93Å
558	M	90.1	Very high	83.3	Confident	8 Å²	8	65.2 Å²	65.2	4%	0.039	34%	0.343	C	S	.	.	H	α-helix	trans	-58.4	-50.6	174.8	-77.8	-178.4	174.7	0	0	112.7	F113 D114 F254 F308 S554 H555 R560 G561 N562	F113-M558 HydrophobicContact CE2-CG 4.06Å; D114-M558 WeakPolarHBondContact O-CG 3.26Å; F254-M558 HydrophobicContact CE2-CB 4.12Å; F254-M558 HydrophobicContact CE2-SD 4.25Å; F254-M558 HydrophobicContact CZ-CB 4.34Å; F254-M558 HydrophobicContact CZ-SD 4.01Å; F308-M558 HydrophobicContact CE1-CE 3.8Å; F308-M558 HydrophobicContact CE1-SD 4.2Å; F308-M558 HydrophobicContact CZ-CE 3.89Å; F308-M558 HydrophobicContact CZ-SD 3.95Å; S554-M558 WeakPolarHBondContact O-CB 3.45Å; S554-M558 VanDerWaalsContact O-CG 3.3Å; S554-M558 WeakPolarHBondContact O-CG 3.46Å; S554-M558 PolarHBondContact O-N 3.07Å; H555-M558 PolarHBondContact O-N 2.54Å; M558-R560 PolarHBondContact O-N 3.26Å; M558-G561 PolarHBondContact O-N 3.06Å; M558-N562 VanDerWaalsContact O-CB 3.25Å; M558-N562 WeakPolarHBondContact O-CB 3.23Å; M558-N562 PolarHBondContact O-N 3.13Å
559	I	86.8	Confident	81.7	Confident	103 Å²	103	66.9 Å²	66.9	53%	0.528	35%	0.353	S	S	.	.	H	α-helix	trans	-63.6	-42.4	-178.3	-69	166.2	0	0	0	111.2	H555 S563	H555-I559 WeakPolarHBondContact O-CB 3.35Å; H555-I559 WeakPolarHBondContact O-CD1 3.45Å; H555-I559 VanDerWaalsContact O-CG1 3.24Å; H555-I559 WeakPolarHBondContact O-CG1 3.5Å; H555-I559 PolarHBondContact O-N 3.09Å; I559-S563 PolarHBondContact O-N 2.8Å; I559-S563 VanDerWaalsContact O-N 3.1Å; I559-S563 PolarHBondContact O-OG 3.37Å
560	R	78.6	Confident	80.2	Confident	126 Å²	126	70.3 Å²	70.3	48%	0.475	37%	0.374	S	S	.	.	H	α-helix	trans	-74.1	-35.2	179.1	-70.7	173.4	178.1	173.9	1.9	112.9	I361 I556 V557 M558 S563 G564	I361-R560 HydrophobicContact CD1-CB 3.67Å; I361-R560 HydrophobicContact CD1-CG 4.18Å; I556-R560 VanDerWaalsContact CG2-CZ 3.47Å; I556-R560 VanDerWaalsContact O-CB 3.31Å; I556-R560 WeakPolarHBondContact O-CB 3.05Å; I556-R560 WeakPolarHBondContact O-CD 3.38Å; I556-R560 VanDerWaalsContact O-CG 3.24Å; I556-R560 WeakPolarHBondContact O-CG 3.41Å; I556-R560 PolarHBondContact O-N 3.2Å; V557-R560 PolarHBondContact O-N 3.27Å; M558-R560 PolarHBondContact O-N 3.26Å; R560-S563 WeakPolarHBondContact CA-OG 3.39Å; R560-S563 PolarHBondContact O-OG 2.71Å; R560-G564 PolarHBondContact O-N 2.84Å
561	G	80.3	Confident	79	Confident	18 Å²	18	74 Å²	74	19%	0.186	39%	0.391	C	S	.	.	H	α-helix	trans	-62.4	-48.9	171.6	0	0	0	0	0	111.3	V557 M558 S563 G564 L565	V557-G561 PolarHBondContact O-N 2.93Å; M558-G561 PolarHBondContact O-N 3.06Å; G561-S563 VanDerWaalsContact C-N 3.33Å; G561-S563 PolarHBondContact O-N 2.87Å; G561-G564 WeakPolarHBondContact O-CA 3.31Å; G561-G564 PolarHBondContact O-N 3.15Å; G561-L565 PolarHBondContact O-N 2.97Å
562	N	84	Confident	77.5	Confident	30 Å²	30	79.6 Å²	79.6	16%	0.16	42%	0.419	C	S	.	.	H	α-helix	trans	-59	-40.4	177.4	-172.7	-0	0	0	0	112.5	V115 M558 G564 L565 R668	V115-N562 HydrophobicContact CB-CB 4.27Å; V115-N562 HydrophobicContact CG1-CB 4.41Å; M558-N562 VanDerWaalsContact O-CB 3.25Å; M558-N562 WeakPolarHBondContact O-CB 3.23Å; M558-N562 PolarHBondContact O-N 3.13Å; N562-G564 VanDerWaalsContact C-N 3.29Å; N562-G564 PolarHBondContact O-N 2.86Å; N562-L565 PolarHBondContact O-N 3.08Å; N562-R668 WeakPolarHBondContact OD1-CD 3.49Å; N562-R668 PolarHBondContact OD1-NH1 2.83Å
563	S	79	Confident	76.8	Confident	77 Å²	77	75.7 Å²	75.7	54%	0.538	40%	0.399	S	S	.	.	H	α-helix	trans	-79.6	-6.4	174.1	47.9	0	0	0	0	114.7	I559 R560 G561	I559-S563 PolarHBondContact O-N 2.8Å; I559-S563 VanDerWaalsContact O-N 3.1Å; I559-S563 PolarHBondContact O-OG 3.37Å; R560-S563 WeakPolarHBondContact CA-OG 3.39Å; R560-S563 PolarHBondContact O-OG 2.71Å; G561-S563 VanDerWaalsContact C-N 3.33Å; G561-S563 PolarHBondContact O-N 2.87Å
564	G	71.6	Confident	76.7	Confident	55 Å²	55	74.1 Å²	74.1	57%	0.567	39%	0.393	S	S	*	.	H	α-helix	trans	-84.6	-18.4	167.6	0	0	0	0	0	114	R560 G561 N562 K566	R560-G564 PolarHBondContact O-N 2.84Å; G561-G564 WeakPolarHBondContact O-CA 3.31Å; G561-G564 PolarHBondContact O-N 3.15Å; N562-G564 VanDerWaalsContact C-N 3.29Å; N562-G564 PolarHBondContact O-N 2.86Å; G564-K566 PolarHBondContact O-N 3.09Å
565	L	78.6	Confident	76.7	Confident	83 Å²	83	79.7 Å²	79.7	44%	0.435	42%	0.417	S	S	.	.			trans	-75.1	64.3	179	-64.5	176	0	0	0	112.2	V115 G561 N562 R668 V669	V115-L565 HydrophobicContact CG1-CD1 4.22Å; V115-L565 HydrophobicContact CG2-CD1 4.11Å; G561-L565 PolarHBondContact O-N 2.97Å; N562-L565 PolarHBondContact O-N 3.08Å; L565-R668 CarbonylContact O-C 3.21Å; L565-R668 VanDerWaalsContact O-CA 3.31Å; L565-R668 WeakPolarHBondContact O-CA 3.4Å; L565-R668 WeakPolarHBondContact O-CB 3.38Å; L565-V669 PolarHBondContact O-N 2.82Å
566	K	76.5	Confident	76.7	Confident	147 Å²	147	78.8 Å²	78.8	64%	0.639	41%	0.414	S	S	*	.	P	Polyproline II helix	trans	-81.3	144.3	172.4	-64.6	-170.2	175.7	-172	0	110.5	G564	G564-K566 PolarHBondContact O-N 3.09Å
567	P	69.5	Low	77	Confident	66 Å²	66	80.7 Å²	80.7	43%	0.429	42%	0.416	S	S	.	.	P	Polyproline II helix	trans	-61	139.5	173.2	27.7	-34.7	0	0	0	109.9	V669	P567-V669 HydrophobicContact CB-CG2 4.11Å
568	K	67.8	Low	77.4	Confident	139 Å²	139	81.1 Å²	81.1	60%	0.604	42%	0.418	S	S	*	.	P	Polyproline II helix	trans	-77.8	146.3	166	-52.4	-168.8	-160.9	89.3	0	109.2	N570 E571	K568-N570 PolarHBondContact O-N 2.85Å; K568-E571 HydrophobicContact CB-CG 4.07Å; K568-E571 WeakPolarHBondContact CB-OE2 3.43Å; K568-E571 WeakPolarHBondContact CG-OE2 3.36Å; K568-E571 PolarHBondContact N-OE2 3.43Å; K568-E571 IonicContact NZ-OE1 3.74Å; K568-E571 PolarHBondContact NZ-OE1 2.85Å; K568-E571 IonicContact NZ-OE2 3.75Å; K568-E571 PolarHBondContact O-N 3.08Å
569	D	53.4	Low	77.6	Confident	153 Å²	153	80.7 Å²	80.7	82%	0.818	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	133.1	165.6	-55.1	-59.5	0	0	0	108.7
570	N	55.7	Low	78	Confident	172 Å²	172	76.3 Å²	76.3	92%	0.92	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.1	1.5	-173.1	-46.2	-35.1	0	0	0	118.2	K568	K568-N570 PolarHBondContact O-N 2.85Å
571	E	63.5	Low	78.7	Confident	80 Å²	80	73.7 Å²	73.7	37%	0.374	39%	0.389	S	S	.	.			trans	-86.6	127	171.5	-75.2	175.4	165.4	0	0	112.4	K568 N573	K568-E571 HydrophobicContact CB-CG 4.07Å; K568-E571 WeakPolarHBondContact CB-OE2 3.43Å; K568-E571 WeakPolarHBondContact CG-OE2 3.36Å; K568-E571 PolarHBondContact N-OE2 3.43Å; K568-E571 IonicContact NZ-OE1 3.74Å; K568-E571 PolarHBondContact NZ-OE1 2.85Å; K568-E571 IonicContact NZ-OE2 3.75Å; K568-E571 PolarHBondContact O-N 3.08Å; E571-N573 VanDerWaalsContact CB-ND2 3.34Å; E571-N573 WeakPolarHBondContact CB-ND2 3.43Å; E571-N573 PolarHBondContact O-N 3.05Å; E571-N573 PolarHBondContact O-ND2 3.24Å
572	M	60.6	Low	79.3	Confident	136 Å²	136	72.9 Å²	72.9	67%	0.67	38%	0.38	S	S	*	.			trans	-70.6	86.2	178.9	-75.8	174	68.2	0	0	111.9
573	N	76.4	Confident	79.7	Confident	32 Å²	32	75.7 Å²	75.7	17%	0.171	39%	0.389	C	S	.	.	P	Polyproline II helix	trans	-103.1	137.2	179.9	-66.2	-67.9	0	0	0	111.7	E571 V669	E571-N573 VanDerWaalsContact CB-ND2 3.34Å; E571-N573 WeakPolarHBondContact CB-ND2 3.43Å; E571-N573 PolarHBondContact O-N 3.05Å; E571-N573 PolarHBondContact O-ND2 3.24Å; N573-V669 WeakPolarHBondContact OD1-CG1 3.28Å
574	S	84.7	Confident	80.2	Confident	13 Å²	13	73.7 Å²	73.7	9%	0.091	37%	0.371	C	S	.	.	P	Polyproline II helix	trans	-80.1	137.5	-178.2	72	0	0	0	0	111.8	W579 L670 Y671 Y672	S574-W579 PolarHBondContact OG-NE1 2.94Å; S574-L670 PolarHBondContact N-O 2.83Å; S574-L670 PolarHBondContact OG-O 3.36Å; S574-Y671 VanDerWaalsContact OG-C 3.22Å; S574-Y671 WeakPolarHBondContact OG-CA 3.36Å; S574-Y672 PolarHBondContact OG-N 3.02Å; S574-Y672 VanDerWaalsContact OG-N 3.07Å
575	K	90.1	Very high	81	Confident	119 Å²	119	71.6 Å²	71.6	52%	0.517	35%	0.349	S	S	.	.	P	Polyproline II helix	trans	-93.8	151.8	178.3	-54.9	171.2	-173.8	167.9	0	110.1	W577 H578 W579	K575-W577 VanDerWaalsContact C-N 3.27Å; K575-W577 PolarHBondContact O-N 2.62Å; K575-W577 VanDerWaalsContact O-N 3.11Å; K575-H578 VanDerWaalsContact O-CB 3.26Å; K575-H578 WeakPolarHBondContact O-CB 3.47Å; K575-H578 PolarHBondContact O-N 2.76Å; K575-W579 PolarHBondContact O-NE1 3.27Å
576	P	92.9	Very high	81.4	Confident	16 Å²	16	69 Å²	69	10%	0.104	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-49	-43.1	-177.4	-31.6	36.2	0	0	0	114.8	H578 W579 P580 Y660 F663 Y664 L670	P576-H578 VanDerWaalsContact C-N 3.25Å; P576-H578 PolarHBondContact O-N 3.36Å; P576-W579 HydrophobicContact CB-CE3 4.26Å; P576-W579 HydrophobicContact CB-CH2 4.12Å; P576-W579 HydrophobicContact CB-CZ3 3.97Å; P576-W579 HydrophobicContact CG-CH2 3.98Å; P576-W579 HydrophobicContact CG-CZ2 4.36Å; P576-W579 HydrophobicContact CG-CZ3 4.3Å; P576-W579 PolarHBondContact O-N 3.36Å; P576-W579 VanDerWaalsContact O-N 3.16Å; P576-P580 WeakPolarHBondContact O-CD 3.41Å; P576-Y660 HydrophobicContact CB-CE2 4.21Å; P576-Y660 PolarHBondContact O-OH 2.97Å; P576-Y660 VanDerWaalsContact O-OH 3.13Å; P576-F663 HydrophobicContact CG-CB 4.11Å; P576-Y664 HydrophobicContact CB-CD1 4.39Å; P576-Y664 HydrophobicContact CB-CD2 3.9Å; P576-Y664 HydrophobicContact CB-CE1 4.25Å; P576-Y664 HydrophobicContact CB-CE2 3.72Å; P576-Y664 HydrophobicContact CB-CG 4.25Å; P576-Y664 HydrophobicContact CG-CD2 4.47Å; P576-Y664 HydrophobicContact CG-CG 4.47Å; P576-L670 HydrophobicContact CG-CD1 4.09Å
577	W	92.8	Very high	81.9	Confident	117 Å²	117	67.4 Å²	67.4	44%	0.443	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	-67.9	-17.8	179.8	71.6	-98.2	0	0	0	114.6	K575 W579 Y583	K575-W577 VanDerWaalsContact C-N 3.27Å; K575-W577 PolarHBondContact O-N 2.62Å; K575-W577 VanDerWaalsContact O-N 3.11Å; W577-W579 PolarHBondContact O-N 3.27Å; W577-Y583 HydrophobicContact CH2-CD1 4.4Å; W577-Y583 HydrophobicContact CH2-CE1 4.41Å; W577-Y583 HydrophobicContact CZ3-CD1 4.45Å; W577-Y583 HydrophobicContact CZ3-CG 4.46Å
578	H	93.6	Very high	82.6	Confident	13 Å²	13	64.4 Å²	64.4	6%	0.06	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-63.9	-31.1	173.9	-65.2	-162.8	0	0	0	110.7	K575 P576 N582 Y583	K575-H578 VanDerWaalsContact O-CB 3.26Å; K575-H578 WeakPolarHBondContact O-CB 3.47Å; K575-H578 PolarHBondContact O-N 2.76Å; P576-H578 VanDerWaalsContact C-N 3.25Å; P576-H578 PolarHBondContact O-N 3.36Å; H578-N582 PolarHBondContact O-N 3.22Å; H578-Y583 HydrophobicContact CB-CD1 4.32Å; H578-Y583 AromaticContact CG-CD1 3.86Å; H578-Y583 AromaticContact ND1-CD1 3.87Å; H578-Y583 WeakPolarHBondContact O-CB 3.29Å; H578-Y583 PolarHBondContact O-N 2.96Å
579	W	94.4	Very high	83.3	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-53.9	-163.4	-44.1	-33.6	0	0	0	113.4	S574 K575 P576 W577 I581 N582 W607 Y660 F663 L670 Y672 H674 Y675	S574-W579 PolarHBondContact OG-NE1 2.94Å; K575-W579 PolarHBondContact O-NE1 3.27Å; P576-W579 HydrophobicContact CB-CE3 4.26Å; P576-W579 HydrophobicContact CB-CH2 4.12Å; P576-W579 HydrophobicContact CB-CZ3 3.97Å; P576-W579 HydrophobicContact CG-CH2 3.98Å; P576-W579 HydrophobicContact CG-CZ2 4.36Å; P576-W579 HydrophobicContact CG-CZ3 4.3Å; P576-W579 PolarHBondContact O-N 3.36Å; P576-W579 VanDerWaalsContact O-N 3.16Å; W577-W579 PolarHBondContact O-N 3.27Å; W579-I581 VanDerWaalsContact C-N 3.26Å; W579-I581 PolarHBondContact O-N 3.3Å; W579-N582 PolarHBondContact O-N 3.37Å; W579-W607 WeakPolarHBondContact O-CZ3 3.41Å; W579-Y660 HydrophobicContact CE3-CD2 4.08Å; W579-Y660 AromaticContact CE3-CE2 3.77Å; W579-Y660 HydrophobicContact CE3-CE2 3.77Å; W579-Y660 HydrophobicContact CZ3-CD2 4.28Å; W579-Y660 HydrophobicContact CZ3-CE2 4.24Å; W579-F663 HydrophobicContact CH2-CB 3.84Å; W579-F663 HydrophobicContact CH2-CD2 4.22Å; W579-F663 AromaticContact CH2-CG 3.96Å; W579-F663 HydrophobicContact CH2-CG 3.96Å; W579-F663 HydrophobicContact CZ3-CB 3.88Å; W579-F663 AromaticContact CZ3-CD2 3.81Å; W579-F663 HydrophobicContact CZ3-CD2 3.81Å; W579-F663 AromaticContact CZ3-CG 3.96Å; W579-F663 HydrophobicContact CZ3-CG 3.96Å; W579-L670 HydrophobicContact CH2-CB 4.37Å; W579-L670 HydrophobicContact CH2-CD1 4.28Å; W579-L670 HydrophobicContact CZ2-CB 4Å; W579-Y672 HydrophobicContact CB-CD2 4.44Å; W579-Y672 AromaticContact CD1-CD2 3.94Å; W579-Y672 HydrophobicContact CG-CD2 4.47Å; W579-H674 HydrophobicContact CH2-CB 3.99Å; W579-H674 HydrophobicContact CZ2-CB 4.4Å; W579-H674 HydrophobicContact CZ3-CB 4.33Å; W579-Y675 HydrophobicContact CB-CD1 4Å; W579-Y675 HydrophobicContact CB-CD2 4.14Å; W579-Y675 HydrophobicContact CB-CG 3.65Å; W579-Y675 AromaticContact CE3-CD2 3.99Å; W579-Y675 HydrophobicContact CE3-CD2 3.99Å; W579-Y675 HydrophobicContact CE3-CG 4.17Å; W579-Y675 HydrophobicContact CG-CG 4.43Å
580	P	94	Very high	84	Confident	10 Å²	10	51.5 Å²	51.5	7%	0.065	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-27.9	-174.6	-19.4	32.3	0	0	0	114	P576 N582 L611 Y660 Y675	P576-P580 WeakPolarHBondContact O-CD 3.41Å; P580-N582 VanDerWaalsContact C-N 3.27Å; P580-L611 HydrophobicContact CB-CD1 4.11Å; P580-Y660 WeakPolarHBondContact CD-OH 3.48Å; P580-Y660 HydrophobicContact CG-CE1 4.2Å; P580-Y660 HydrophobicContact CG-CE2 4.11Å; P580-Y660 VanDerWaalsContact CG-OH 3.29Å; P580-Y660 WeakPolarHBondContact CG-OH 3.26Å; P580-Y675 HydrophobicContact CG-CE1 4.49Å; P580-Y675 HydrophobicContact CG-CE2 3.92Å
581	I	94.1	Very high	84.2	Confident	72 Å²	72	48.7 Å²	48.7	37%	0.369	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-11.4	177.7	-61	169.2	0	0	0	111.1	W579 Y583 W608 L611	W579-I581 VanDerWaalsContact C-N 3.26Å; W579-I581 PolarHBondContact O-N 3.3Å; I581-Y583 VanDerWaalsContact C-N 3.29Å; I581-W608 PolarHBondContact O-NE1 3.45Å; I581-L611 HydrophobicContact CG1-CD2 3.91Å
582	N	93.1	Very high	84.2	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	63.9	30.4	-172.7	-149.8	24.3	0	0	0	113	H578 W579 P580 Q584 L601 G602 W607 Y672 M753 W756	H578-N582 PolarHBondContact O-N 3.22Å; W579-N582 PolarHBondContact O-N 3.37Å; P580-N582 VanDerWaalsContact C-N 3.27Å; N582-Q584 PolarHBondContact O-N 3.39Å; N582-L601 WeakPolarHBondContact OD1-CD1 3.27Å; N582-G602 PolarHBondContact ND2-O 2.94Å; N582-W607 HydrophobicContact CB-CB 4.49Å; N582-W607 HydrophobicContact CB-CE3 4.45Å; N582-Y672 PolarHBondContact OD1-OH 2.79Å; N582-M753 VanDerWaalsContact O-CE 3.23Å; N582-M753 WeakPolarHBondContact O-CE 3.2Å; N582-W756 PolarHBondContact O-NE1 3.43Å
583	Y	92.4	Very high	84.2	Confident	90 Å²	90	47.6 Å²	47.6	35%	0.353	23%	0.232	S	C	.	.			trans	-61.3	-37.7	-167.7	178.3	-109.4	0	0	0	113.9	W577 H578 I581 M753 S755	W577-Y583 HydrophobicContact CH2-CD1 4.4Å; W577-Y583 HydrophobicContact CH2-CE1 4.41Å; W577-Y583 HydrophobicContact CZ3-CD1 4.45Å; W577-Y583 HydrophobicContact CZ3-CG 4.46Å; H578-Y583 HydrophobicContact CB-CD1 4.32Å; H578-Y583 AromaticContact CG-CD1 3.86Å; H578-Y583 AromaticContact ND1-CD1 3.87Å; H578-Y583 WeakPolarHBondContact O-CB 3.29Å; H578-Y583 PolarHBondContact O-N 2.96Å; I581-Y583 VanDerWaalsContact C-N 3.29Å; Y583-M753 HydrophobicContact CD2-SD 4.32Å; Y583-S755 WeakPolarHBondContact CE2-OG 3.24Å; Y583-S755 WeakPolarHBondContact O-CB 3.36Å; Y583-S755 PolarHBondContact O-OG 2.79Å
584	Q	88.8	Confident	83.4	Confident	34 Å²	34	52.3 Å²	52.3	16%	0.159	26%	0.262	C	S	.	.			trans	-146.7	121.5	-179	-170.1	-178.5	25.3	0	0	109.2	N582 Y672	N582-Q584 PolarHBondContact O-N 3.39Å; Q584-Y672 WeakPolarHBondContact O-CD2 3.4Å
585	G	87.5	Confident	82.8	Confident	11 Å²	11	55.2 Å²	55.2	11%	0.113	27%	0.274	C	S	.	.			trans	-82.4	-167.2	172.8	0	0	0	0	0	112.4	Y599 L600	G585-Y599 WeakPolarHBondContact CA-OH 3.25Å; G585-Y599 PolarHBondContact N-OH 2.8Å; G585-L600 CarbonylContact C-O 3.19Å; G585-L600 VanDerWaalsContact CA-O 3.26Å; G585-L600 WeakPolarHBondContact CA-O 3.09Å
586	L	88.4	Confident	82.4	Confident	29 Å²	29	51.6 Å²	51.6	15%	0.152	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	120.3	-177.3	175.7	56.6	0	0	0	110.7	W94 F588 L600	W94-L586 HydrophobicContact CD2-CD2 3.99Å; W94-L586 HydrophobicContact CE3-CD2 3.94Å; W94-L586 HydrophobicContact CH2-CD2 3.98Å; W94-L586 HydrophobicContact CZ2-CD2 3.93Å; W94-L586 HydrophobicContact CZ3-CD2 3.94Å; L586-F588 HydrophobicContact CD2-CE2 4.02Å; L586-F588 HydrophobicContact CG-CD2 4.18Å; L586-F588 HydrophobicContact CG-CE2 4.15Å; L586-F588 PolarHBondContact O-N 2.81Å; L586-L600 HydrophobicContact CB-CB 4.29Å; L586-L600 HydrophobicContact CB-CD2 4.5Å; L586-L600 PolarHBondContact N-O 3.26Å; L586-L600 WeakPolarHBondContact O-CB 3.4Å; L586-L600 PolarHBondContact O-N 2.85Å
587	R	86.8	Confident	82.2	Confident	113 Å²	113	51.4 Å²	51.4	43%	0.426	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.6	122.8	172.9	-70	-175.7	173.7	109.5	-8	109.5	Y599 E757	R587-Y599 HydrophobicContact CB-CD2 4.4Å; R587-Y599 HydrophobicContact CG-CD2 3.84Å; R587-Y599 HydrophobicContact CG-CE2 3.85Å; R587-E757 IonicContact CZ-OE2 2.73Å; R587-E757 PolarHBondContact NE-O 2.95Å; R587-E757 IonicContact NH1-OE2 2.82Å; R587-E757 PolarHBondContact NH1-OE2 3.45Å; R587-E757 IonicContact NH2-OE2 2.79Å; R587-E757 PolarHBondContact NH2-OE2 3.38Å
588	F	83.8	Confident	82.1	Confident	4 Å²	4	45.9 Å²	45.9	2%	0.018	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	-36.9	-177.7	-106.3	-136.1	0	0	0	112.4	C93 W94 T198 I199 Y202 L204 L586 V598 L600	C93-F588 CarbonylContact C-O 3.55Å; C93-F588 WeakPolarHBondContact CA-O 3.36Å; W94-F588 HydrophobicContact CB-CD2 4.23Å; W94-F588 HydrophobicContact CB-CG 4.45Å; W94-F588 HydrophobicContact CD2-CE2 4.24Å; W94-F588 HydrophobicContact CE3-CD2 4.35Å; W94-F588 AromaticContact CE3-CE2 3.58Å; W94-F588 HydrophobicContact CE3-CE2 3.58Å; W94-F588 AromaticContact CE3-CZ 3.9Å; W94-F588 HydrophobicContact CE3-CZ 3.9Å; W94-F588 HydrophobicContact CZ3-CE2 4.33Å; W94-F588 PolarHBondContact N-O 2.87Å; T198-F588 HydrophobicContact CG2-CD1 3.79Å; T198-F588 HydrophobicContact CG2-CE1 4.03Å; T198-F588 HydrophobicContact CG2-CG 4.35Å; I199-F588 HydrophobicContact CD1-CZ 4.06Å; Y202-F588 AromaticContact CD2-CD1 3.68Å; Y202-F588 HydrophobicContact CD2-CD1 3.68Å; Y202-F588 AromaticContact CD2-CE1 3.78Å; Y202-F588 HydrophobicContact CD2-CE1 3.78Å; Y202-F588 HydrophobicContact CE2-CD1 4.03Å; Y202-F588 HydrophobicContact CE2-CE1 4.49Å; Y202-F588 HydrophobicContact CG-CD1 4.46Å; L204-F588 HydrophobicContact CD1-CE1 3.88Å; L204-F588 HydrophobicContact CD1-CZ 3.94Å; L586-F588 HydrophobicContact CD2-CE2 4.02Å; L586-F588 HydrophobicContact CG-CD2 4.18Å; L586-F588 HydrophobicContact CG-CE2 4.15Å; L586-F588 PolarHBondContact O-N 2.81Å; F588-V598 WeakPolarHBondContact CA-O 3.33Å; F588-V598 HydrophobicContact CB-CB 3.98Å; F588-V598 HydrophobicContact CB-CG1 3.83Å; F588-V598 WeakPolarHBondContact CB-O 3.3Å; F588-V598 PolarHBondContact N-O 3.48Å; F588-L600 HydrophobicContact CD2-CB 3.55Å; F588-L600 HydrophobicContact CD2-CD2 4.44Å; F588-L600 HydrophobicContact CE2-CB 3.51Å; F588-L600 HydrophobicContact CE2-CD2 3.54Å; F588-L600 HydrophobicContact CE2-CG 4.08Å; F588-L600 HydrophobicContact CG-CB 4.19Å; F588-L600 HydrophobicContact CZ-CB 4.08Å; F588-L600 HydrophobicContact CZ-CD2 3.79Å; F588-L600 HydrophobicContact CZ-CG 4.35Å
589	S	82.7	Confident	82	Confident	7 Å²	7	45.7 Å²	45.7	5%	0.049	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.4	161.1	169.6	-154.8	0	0	0	0	112.7	H91 R597 V598	H91-S589 PolarHBondContact CD2-OG 3.48Å; S589-R597 VanDerWaalsContact O-CA 3.29Å; S589-R597 WeakPolarHBondContact O-CA 3.42Å; S589-V598 PolarHBondContact N-O 3.36Å; S589-V598 VanDerWaalsContact N-O 3.15Å; S589-V598 PolarHBondContact O-N 3Å
590	G	67.4	Low	81.9	Confident	13 Å²	13	45.7 Å²	45.7	13%	0.134	23%	0.233	C	C	.	.			trans	75	139.1	-178.2	0	0	0	0	0	113.3
591	V	60.6	Low	81.9	Confident	113 Å²	113	45.2 Å²	45.2	69%	0.685	23%	0.23	S	C	*	.			trans	-122.3	-28.6	173.7	-176.2	0	0	0	0	111.2	E595	V591-E595 PolarHBondContact N-OE2 3.39Å; V591-E595 VanDerWaalsContact N-OE2 3.08Å
592	N	62.9	Low	81.9	Confident	85 Å²	85	41.8 Å²	41.8	46%	0.455	21%	0.212	S	C	.	.	S	Bend	trans	-90	155.8	-176.2	-58.2	-48.7	0	0	0	112.3	T594 E595	N592-T594 PolarHBondContact O-N 3.33Å; N592-E595 HydrophobicContact CB-CB 4.47Å; N592-E595 HydrophobicContact CB-CG 4.09Å; N592-E595 PolarHBondContact N-OE2 2.98Å; N592-E595 VanDerWaalsContact ND2-CD 3.31Å; N592-E595 PolarHBondContact ND2-OE1 2.86Å; N592-E595 PolarHBondContact O-N 2.93Å
593	E	60.1	Low	82.1	Confident	109 Å²	109	41.8 Å²	41.8	51%	0.509	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-31.4	176.1	-66.2	143.6	-138	0	0	112.9	G737	E593-G737 CarbonylContact O-C 3.58Å; E593-G737 WeakPolarHBondContact O-CA 3.33Å; E593-G737 PolarHBondContact O-N 3.03Å; E593-G737 VanDerWaalsContact O-O 3.11Å
594	T	60.8	Low	82.3	Confident	131 Å²	131	37.5 Å²	37.5	80%	0.804	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87	-6.5	-177.3	54	0	0	0	0	114.1	N592	N592-T594 PolarHBondContact O-N 3.33Å
595	E	71.9	Confident	82.6	Confident	73 Å²	73	37.2 Å²	37.2	34%	0.341	20%	0.196	S	C	.	.	S	Bend	trans	-93.2	149.4	179.7	-75.2	167.6	-174.8	0	0	111.6	V591 N592 R597	V591-E595 PolarHBondContact N-OE2 3.39Å; V591-E595 VanDerWaalsContact N-OE2 3.08Å; N592-E595 HydrophobicContact CB-CB 4.47Å; N592-E595 HydrophobicContact CB-CG 4.09Å; N592-E595 PolarHBondContact N-OE2 2.98Å; N592-E595 VanDerWaalsContact ND2-CD 3.31Å; N592-E595 PolarHBondContact ND2-OE1 2.86Å; N592-E595 PolarHBondContact O-N 2.93Å; E595-R597 PolarHBondContact O-N 2.85Å
596	Y	82.5	Confident	83.1	Confident	44 Å²	44	36.7 Å²	36.7	17%	0.173	19%	0.19	C	C	.	.			trans	-69.1	114.5	168.6	-178.9	-74.9	0	0	0	108.8	E88 P89 H91 V598 Y733 M735 T736	E88-Y596 WeakPolarHBondContact CB-OH 3.48Å; P89-Y596 HydrophobicContact CB-CD1 3.58Å; P89-Y596 HydrophobicContact CB-CE1 3.64Å; P89-Y596 HydrophobicContact CB-CG 4.42Å; P89-Y596 HydrophobicContact CG-CD1 4.04Å; P89-Y596 HydrophobicContact CG-CE1 3.85Å; H91-Y596 PolarHBondContact NE2-O 3.46Å; Y596-V598 HydrophobicContact CD1-CG2 4.22Å; Y596-V598 HydrophobicContact CE1-CG2 3.82Å; Y596-Y733 PolarHBondContact OH-O 2.77Å; Y596-M735 CarbonylContact C-O 3.55Å; Y596-M735 WeakPolarHBondContact CA-O 3.21Å; Y596-T736 HydrophobicContact CD2-CG2 4.08Å
597	R	87.4	Confident	83.5	Confident	12 Å²	12	35.5 Å²	35.5	5%	0.045	18%	0.184	C	C	.	.	B	Isolated β-bridge	trans	-101.4	149.4	-176.2	-59.4	-161.5	-63.2	-79.3	0.1	112.2	S589 E595 G734 M735 G737 P738 F758	S589-R597 VanDerWaalsContact O-CA 3.29Å; S589-R597 WeakPolarHBondContact O-CA 3.42Å; E595-R597 PolarHBondContact O-N 2.85Å; R597-G734 WeakPolarHBondContact O-CA 2.93Å; R597-M735 HydrophobicContact CB-CE 4.39Å; R597-M735 PolarHBondContact N-O 2.57Å; R597-M735 PolarHBondContact O-N 2.98Å; R597-G737 PolarHBondContact NH1-O 3.28Å; R597-G737 PolarHBondContact NH2-O 3.38Å; R597-P738 PolarHBondContact NH2-O 2.95Å; R597-F758 VanDerWaalsContact CZ-OXT 3.23Å; R597-F758 PolarHBondContact NE-OXT 3.08Å; R597-F758 PolarHBondContact NH2-OXT 3.14Å
598	V	90.6	Very high	83.9	Confident	1 Å²	1	34.9 Å²	34.9	1%	0.006	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	136.3	172.3	-177.3	0	0	0	0	108.6	P89 T198 Y202 F588 S589 Y596	P89-V598 HydrophobicContact CG-CG2 4.15Å; T198-V598 HydrophobicContact CG2-CG1 3.92Å; Y202-V598 HydrophobicContact CE2-CG1 4.03Å; F588-V598 WeakPolarHBondContact CA-O 3.33Å; F588-V598 HydrophobicContact CB-CB 3.98Å; F588-V598 HydrophobicContact CB-CG1 3.83Å; F588-V598 WeakPolarHBondContact CB-O 3.3Å; F588-V598 PolarHBondContact N-O 3.48Å; S589-V598 PolarHBondContact N-O 3.36Å; S589-V598 VanDerWaalsContact N-O 3.15Å; S589-V598 PolarHBondContact O-N 3Å; Y596-V598 HydrophobicContact CD1-CG2 4.22Å; Y596-V598 HydrophobicContact CE1-CG2 3.82Å
599	Y	91.4	Very high	84.5	Confident	8 Å²	8	36.5 Å²	36.5	3%	0.031	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	116.3	-175.5	-169.3	-98.9	0	0	0	111.2	G585 R587 L601 L731 E757 F758	G585-Y599 WeakPolarHBondContact CA-OH 3.25Å; G585-Y599 PolarHBondContact N-OH 2.8Å; R587-Y599 HydrophobicContact CB-CD2 4.4Å; R587-Y599 HydrophobicContact CG-CD2 3.84Å; R587-Y599 HydrophobicContact CG-CE2 3.85Å; Y599-L601 HydrophobicContact CD1-CB 3.69Å; Y599-L601 HydrophobicContact CE1-CB 3.78Å; Y599-L601 HydrophobicContact CE1-CD1 4.18Å; Y599-L601 HydrophobicContact CE1-CD2 4.38Å; Y599-L601 HydrophobicContact CE1-CG 4.34Å; Y599-L601 PolarHBondContact O-N 3.2Å; Y599-L731 HydrophobicContact CD1-CD2 4.41Å; Y599-L731 PolarHBondContact N-O 2.95Å; Y599-L731 VanDerWaalsContact N-O 3.16Å; Y599-L731 VanDerWaalsContact O-O 3.08Å; Y599-E757 WeakPolarHBondContact CE2-O 3.47Å; Y599-E757 PolarHBondContact OH-N 2.89Å; Y599-F758 HydrophobicContact CD1-CB 3.93Å; Y599-F758 AromaticContact CD1-CD1 3.72Å; Y599-F758 HydrophobicContact CD1-CD1 3.72Å; Y599-F758 HydrophobicContact CD1-CG 4.29Å; Y599-F758 HydrophobicContact CD2-CB 3.92Å; Y599-F758 HydrophobicContact CE1-CB 4.43Å; Y599-F758 AromaticContact CE1-CD1 3.75Å; Y599-F758 HydrophobicContact CE1-CD1 3.75Å; Y599-F758 HydrophobicContact CE2-CB 4.43Å; Y599-F758 HydrophobicContact CG-CB 3.65Å; Y599-F758 HydrophobicContact CG-CD1 4.34Å; Y599-F758 HydrophobicContact CG-CG 4.49Å
600	L	92.9	Very high	85.2	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	98.6	176.2	178.1	70	0	0	0	109.6	G195 T198 I199 G585 L586 F588 Y672 H673 F676	G195-L600 WeakPolarHBondContact O-CD1 3.46Å; T198-L600 HydrophobicContact CG2-CB 4.2Å; T198-L600 HydrophobicContact CG2-CD1 3.98Å; I199-L600 HydrophobicContact CB-CD1 4.2Å; I199-L600 HydrophobicContact CD1-CD2 4.05Å; G585-L600 CarbonylContact C-O 3.19Å; G585-L600 VanDerWaalsContact CA-O 3.26Å; G585-L600 WeakPolarHBondContact CA-O 3.09Å; L586-L600 HydrophobicContact CB-CB 4.29Å; L586-L600 HydrophobicContact CB-CD2 4.5Å; L586-L600 PolarHBondContact N-O 3.26Å; L586-L600 WeakPolarHBondContact O-CB 3.4Å; L586-L600 PolarHBondContact O-N 2.85Å; F588-L600 HydrophobicContact CD2-CB 3.55Å; F588-L600 HydrophobicContact CD2-CD2 4.44Å; F588-L600 HydrophobicContact CE2-CB 3.51Å; F588-L600 HydrophobicContact CE2-CD2 3.54Å; F588-L600 HydrophobicContact CE2-CG 4.08Å; F588-L600 HydrophobicContact CG-CB 4.19Å; F588-L600 HydrophobicContact CZ-CB 4.08Å; F588-L600 HydrophobicContact CZ-CD2 3.79Å; F588-L600 HydrophobicContact CZ-CG 4.35Å; L600-Y672 HydrophobicContact CD2-CD1 3.83Å; L600-Y672 HydrophobicContact CD2-CE1 4.32Å; L600-Y672 HydrophobicContact CG-CD1 3.93Å; L600-Y672 HydrophobicContact CG-CE1 3.99Å; L600-H673 HydrophobicContact CD2-CB 4.38Å; L600-F676 HydrophobicContact CD1-CE2 4.3Å; L600-F676 HydrophobicContact CD1-CZ 3.91Å; L600-F676 HydrophobicContact CD2-CE2 4.27Å; L600-F676 HydrophobicContact CG-CZ 4.47Å
601	L	93.9	Very high	86.6	Confident	0 Å²	0	39 Å²	39	0%	0	20%	0.2	C	C	.	.			trans	-137.2	131.2	168.2	-169.7	76.4	0	0	0	108.4	T194 G195 N582 Y599 P604 L731 W756 F758	T194-L601 PolarHBondContact OG1-O 3.4Å; G195-L601 PolarHBondContact N-O 2.98Å; N582-L601 WeakPolarHBondContact OD1-CD1 3.27Å; Y599-L601 HydrophobicContact CD1-CB 3.69Å; Y599-L601 HydrophobicContact CE1-CB 3.78Å; Y599-L601 HydrophobicContact CE1-CD1 4.18Å; Y599-L601 HydrophobicContact CE1-CD2 4.38Å; Y599-L601 HydrophobicContact CE1-CG 4.34Å; Y599-L601 PolarHBondContact O-N 3.2Å; L601-P604 HydrophobicContact CD2-CG 4.39Å; L601-L731 HydrophobicContact CB-CD1 4.25Å; L601-L731 HydrophobicContact CD2-CD1 4.08Å; L601-W756 HydrophobicContact CD2-CD2 3.78Å; L601-W756 HydrophobicContact CD2-CE3 4.03Å; L601-W756 HydrophobicContact CD2-CG 4.25Å; L601-W756 HydrophobicContact CD2-CH2 4.39Å; L601-W756 HydrophobicContact CD2-CZ2 4.11Å; L601-W756 HydrophobicContact CD2-CZ3 4.32Å; L601-F758 HydrophobicContact CD2-CE1 4.08Å
602	G	94.8	Very high	88.3	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.193	C	C	.	.			trans	-60.8	151.7	168.8	0	0	0	0	0	111.6	D193 N582 P604 W607 Y672	D193-G602 WeakPolarHBondContact OD1-CA 3.3Å; N582-G602 PolarHBondContact ND2-O 2.94Å; G602-P604 WeakPolarHBondContact O-CD 3.39Å; G602-P604 VanDerWaalsContact O-N 3.07Å; G602-W607 VanDerWaalsContact CA-NE1 3.33Å; G602-Y672 PolarHBondContact N-OH 3.29Å
603	N	96.5	Very high	89.9	Confident	0 Å²	0	33 Å²	33	0%	0	17%	0.173	C	C	.	.			trans	-62.4	110.9	177	176.1	-25.5	0	0	0	107.4	F192 D193 T194 V605 V606 W607 S724 F725	F192-N603 PolarHBondContact O-ND2 2.86Å; D193-N603 PolarHBondContact OD1-N 3.01Å; T194-N603 PolarHBondContact OG1-N 2.82Å; T194-N603 VanDerWaalsContact OG1-N 3.1Å; N603-V605 PolarHBondContact O-N 3.14Å; N603-V605 VanDerWaalsContact O-N 3.12Å; N603-V605 PolarHBondContact OD1-N 3.35Å; N603-V606 HydrophobicContact CB-CB 4.04Å; N603-V606 HydrophobicContact CB-CG2 3.94Å; N603-V606 WeakPolarHBondContact O-CB 3.31Å; N603-V606 PolarHBondContact O-N 3.29Å; N603-W607 VanDerWaalsContact O-CD1 3.3Å; N603-W607 PolarHBondContact O-N 2.65Å; N603-S724 PolarHBondContact ND2-OG 3.17Å; N603-S724 WeakPolarHBondContact OD1-CB 3.21Å; N603-S724 PolarHBondContact OD1-OG 3.25Å; N603-F725 PolarHBondContact ND2-N 3.41Å
604	P	95.6	Very high	91.6	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-59.9	-33.9	-166.9	-25.3	34.3	0	0	0	112.8	L601 G602 W607 W608 F728 W752 W756	L601-P604 HydrophobicContact CD2-CG 4.39Å; G602-P604 WeakPolarHBondContact O-CD 3.39Å; G602-P604 VanDerWaalsContact O-N 3.07Å; P604-W607 PolarHBondContact O-N 3.43Å; P604-W608 WeakPolarHBondContact O-CB 3.46Å; P604-W608 PolarHBondContact O-N 3.2Å; P604-F728 HydrophobicContact CG-CE1 4.06Å; P604-F728 HydrophobicContact CG-CE2 4.03Å; P604-F728 HydrophobicContact CG-CZ 3.78Å; P604-W752 HydrophobicContact CB-CE3 3.93Å; P604-W752 HydrophobicContact CB-CZ3 3.87Å; P604-W752 HydrophobicContact CG-CE3 4.47Å; P604-W756 HydrophobicContact CB-CH2 3.65Å; P604-W756 HydrophobicContact CB-CZ2 4.19Å; P604-W756 HydrophobicContact CG-CH2 3.3Å; P604-W756 HydrophobicContact CG-CZ2 3.92Å; P604-W756 HydrophobicContact CG-CZ3 3.95Å
605	V	96.4	Very high	93.3	Very high	28 Å²	28	24.1 Å²	24.1	17%	0.17	13%	0.132	C	C	.	.	H	α-helix	trans	-64.2	-45.7	175.8	-179.1	0	0	0	0	111	N603 I609 T720 W752	N603-V605 PolarHBondContact O-N 3.14Å; N603-V605 VanDerWaalsContact O-N 3.12Å; N603-V605 PolarHBondContact OD1-N 3.35Å; V605-I609 HydrophobicContact CG1-CD1 3.75Å; V605-I609 HydrophobicContact CG1-CG1 4.49Å; V605-I609 VanDerWaalsContact O-CB 3.29Å; V605-I609 WeakPolarHBondContact O-CB 3.45Å; V605-I609 WeakPolarHBondContact O-CD1 3.45Å; V605-I609 WeakPolarHBondContact O-CG1 3.33Å; V605-I609 PolarHBondContact O-N 2.86Å; V605-T720 HydrophobicContact CG1-CG2 3.88Å; V605-W752 HydrophobicContact CG2-CH2 3.64Å; V605-W752 HydrophobicContact CG2-CZ3 3.88Å
606	V	96.9	Very high	94.5	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-62.6	-43.9	176.2	171.8	0	0	0	0	110.9	L189 D193 N603 I609 N610 V721	L189-V606 HydrophobicContact CB-CG1 4.19Å; L189-V606 HydrophobicContact CD2-CB 4.43Å; L189-V606 HydrophobicContact CD2-CG1 4.02Å; L189-V606 HydrophobicContact CD2-CG2 4.08Å; D193-V606 HydrophobicContact CB-CG1 4.38Å; N603-V606 HydrophobicContact CB-CB 4.04Å; N603-V606 HydrophobicContact CB-CG2 3.94Å; N603-V606 WeakPolarHBondContact O-CB 3.31Å; N603-V606 PolarHBondContact O-N 3.29Å; V606-I609 PolarHBondContact O-N 3.29Å; V606-N610 WeakPolarHBondContact O-CB 3.44Å; V606-N610 VanDerWaalsContact O-CG 3.24Å; V606-N610 PolarHBondContact O-N 3.24Å; V606-N610 PolarHBondContact O-ND2 2.8Å; V606-V721 HydrophobicContact CG2-CG1 4.21Å; V606-V721 HydrophobicContact CG2-CG2 4.45Å
607	W	96.6	Very high	95.2	Very high	5 Å²	5	21.1 Å²	21.1	2%	0.019	12%	0.121	C	C	.	.	H	α-helix	trans	-71.4	-37.6	-176.6	-76.1	53.7	0	0	0	112.6	D193 W579 N582 G602 N603 P604 N610 L611 Y672 Y675 F676 M679	D193-W607 PolarHBondContact OD1-NE1 3.09Å; W579-W607 WeakPolarHBondContact O-CZ3 3.41Å; N582-W607 HydrophobicContact CB-CB 4.49Å; N582-W607 HydrophobicContact CB-CE3 4.45Å; G602-W607 VanDerWaalsContact CA-NE1 3.33Å; N603-W607 VanDerWaalsContact O-CD1 3.3Å; N603-W607 PolarHBondContact O-N 2.65Å; P604-W607 PolarHBondContact O-N 3.43Å; W607-N610 WeakPolarHBondContact O-CB 3.46Å; W607-N610 PolarHBondContact O-N 3.08Å; W607-L611 WeakPolarHBondContact O-CB 3.19Å; W607-L611 PolarHBondContact O-N 3.26Å; W607-Y672 HydrophobicContact CH2-CE1 4.1Å; W607-Y672 AromaticContact CH2-CE2 3.92Å; W607-Y672 HydrophobicContact CH2-CE2 3.92Å; W607-Y672 AromaticContact CH2-CZ 3.46Å; W607-Y672 VanDerWaalsContact CH2-CZ 3.46Å; W607-Y672 WeakPolarHBondContact CH2-OH 3.31Å; W607-Y672 WeakPolarHBondContact CZ2-OH 3.44Å; W607-Y672 AromaticContact CZ3-CE2 3.74Å; W607-Y672 HydrophobicContact CZ3-CE2 3.74Å; W607-Y672 AromaticContact CZ3-CZ 3.7Å; W607-Y672 WeakPolarHBondContact CZ3-OH 3.28Å; W607-Y675 HydrophobicContact CE3-CD1 4.28Å; W607-Y675 HydrophobicContact CE3-CE1 4.18Å; W607-Y675 AromaticContact CH2-CD1 3.67Å; W607-Y675 HydrophobicContact CH2-CD1 3.67Å; W607-Y675 HydrophobicContact CH2-CE1 4.28Å; W607-Y675 AromaticContact CZ3-CD1 3.4Å; W607-Y675 HydrophobicContact CZ3-CD1 3.4Å; W607-Y675 VanDerWaalsContact CZ3-CD1 3.4Å; W607-Y675 AromaticContact CZ3-CE1 3.74Å; W607-Y675 HydrophobicContact CZ3-CE1 3.74Å; W607-F676 HydrophobicContact CH2-CE1 4.44Å; W607-F676 HydrophobicContact CH2-CE2 4.08Å; W607-F676 AromaticContact CH2-CZ 4Å; W607-F676 HydrophobicContact CH2-CZ 4Å; W607-F676 AromaticContact CZ2-CE1 3.84Å; W607-F676 HydrophobicContact CZ2-CE1 3.84Å; W607-F676 HydrophobicContact CZ2-CE2 4.24Å; W607-F676 AromaticContact CZ2-CZ 3.7Å; W607-F676 HydrophobicContact CZ2-CZ 3.7Å; W607-M679 HydrophobicContact CD2-CG 4.35Å; W607-M679 HydrophobicContact CH2-CG 4.24Å; W607-M679 HydrophobicContact CZ2-CB 4.41Å; W607-M679 HydrophobicContact CZ2-CE 3.94Å; W607-M679 HydrophobicContact CZ2-CG 3.75Å
608	W	96.7	Very high	95.6	Very high	100 Å²	100	25 Å²	25	38%	0.379	14%	0.142	S	C	.	.	H	α-helix	trans	-73.8	-35.8	174.4	-64	-10.5	0	0	0	112.6	I581 P604 N610 L611 A612 W752 M753	I581-W608 PolarHBondContact O-NE1 3.45Å; P604-W608 WeakPolarHBondContact O-CB 3.46Å; P604-W608 PolarHBondContact O-N 3.2Å; W608-N610 VanDerWaalsContact C-N 3.3Å; W608-N610 PolarHBondContact O-N 2.81Å; W608-L611 PolarHBondContact O-N 2.79Å; W608-A612 VanDerWaalsContact O-CB 3.32Å; W608-A612 WeakPolarHBondContact O-CB 3.44Å; W608-A612 PolarHBondContact O-N 2.9Å; W608-W752 HydrophobicContact CE3-CZ3 4.49Å; W608-W752 AromaticContact CH2-CE3 3.8Å; W608-W752 HydrophobicContact CH2-CE3 3.8Å; W608-W752 HydrophobicContact CH2-CZ3 4.49Å; W608-W752 AromaticContact CZ3-CE3 3.73Å; W608-W752 HydrophobicContact CZ3-CE3 3.73Å; W608-W752 AromaticContact CZ3-CZ3 3.99Å; W608-W752 HydrophobicContact CZ3-CZ3 3.99Å; W608-M753 HydrophobicContact CZ2-CE 4.14Å
609	I	96.6	Very high	95.9	Very high	38 Å²	38	30.1 Å²	30.1	20%	0.195	17%	0.168	C	C	.	.	H	α-helix	trans	-60.4	-42.3	168.9	-72.5	169	0	0	0	110.2	V605 V606 S613 T686 L690 L717	V605-I609 HydrophobicContact CG1-CD1 3.75Å; V605-I609 HydrophobicContact CG1-CG1 4.49Å; V605-I609 VanDerWaalsContact O-CB 3.29Å; V605-I609 WeakPolarHBondContact O-CB 3.45Å; V605-I609 WeakPolarHBondContact O-CD1 3.45Å; V605-I609 WeakPolarHBondContact O-CG1 3.33Å; V605-I609 PolarHBondContact O-N 2.86Å; V606-I609 PolarHBondContact O-N 3.29Å; I609-S613 WeakPolarHBondContact O-CB 3.36Å; I609-S613 PolarHBondContact O-N 2.91Å; I609-S613 PolarHBondContact O-OG 3.01Å; I609-T686 HydrophobicContact CG2-CG2 3.89Å; I609-L690 HydrophobicContact CG2-CD1 4.04Å; I609-L717 HydrophobicContact CD1-CD1 4.03Å
610	N	97.1	Very high	96	Very high	4 Å²	4	31.1 Å²	31.1	2%	0.021	17%	0.173	C	C	.	.	H	α-helix	trans	-61.7	-46.3	175.4	-80.6	-17.7	0	0	0	112.6	V606 W607 W608 S613 L614 S683 T686	V606-N610 WeakPolarHBondContact O-CB 3.44Å; V606-N610 VanDerWaalsContact O-CG 3.24Å; V606-N610 PolarHBondContact O-N 3.24Å; V606-N610 PolarHBondContact O-ND2 2.8Å; W607-N610 WeakPolarHBondContact O-CB 3.46Å; W607-N610 PolarHBondContact O-N 3.08Å; W608-N610 VanDerWaalsContact C-N 3.3Å; W608-N610 PolarHBondContact O-N 2.81Å; N610-S613 PolarHBondContact O-N 2.77Å; N610-L614 PolarHBondContact O-N 3.07Å; N610-S683 PolarHBondContact ND2-OG 3.28Å; N610-S683 WeakPolarHBondContact OD1-CA 3.5Å; N610-T686 WeakPolarHBondContact CA-OG1 3.5Å; N610-T686 VanDerWaalsContact OD1-CB 3.3Å; N610-T686 WeakPolarHBondContact OD1-CB 3.15Å; N610-T686 PolarHBondContact OD1-OG1 3.2Å
611	L	96.4	Very high	96.1	Very high	69 Å²	69	32.6 Å²	32.6	36%	0.361	18%	0.182	S	C	.	.	H	α-helix	trans	-65.4	-42.4	178.6	-176.6	60	0	0	0	112.3	P580 I581 W607 W608 L614 G615	P580-L611 HydrophobicContact CB-CD1 4.11Å; I581-L611 HydrophobicContact CG1-CD2 3.91Å; W607-L611 WeakPolarHBondContact O-CB 3.19Å; W607-L611 PolarHBondContact O-N 3.26Å; W608-L611 PolarHBondContact O-N 2.79Å; L611-L614 PolarHBondContact O-N 2.79Å; L611-G615 PolarHBondContact O-N 2.72Å
612	A	97	Very high	96.1	Very high	67 Å²	67	34.8 Å²	34.8	55%	0.554	20%	0.201	S	C	*	.	H	α-helix	trans	-65.9	-40.7	175.1	0	0	0	0	0	111.9	W608 L614 G615 L616	W608-A612 VanDerWaalsContact O-CB 3.32Å; W608-A612 WeakPolarHBondContact O-CB 3.44Å; W608-A612 PolarHBondContact O-N 2.9Å; A612-L614 VanDerWaalsContact C-N 3.32Å; A612-L614 PolarHBondContact O-N 3.31Å; A612-G615 PolarHBondContact O-N 3.33Å; A612-L616 PolarHBondContact O-N 3.21Å
613	S	96.5	Very high	96	Very high	4 Å²	4	39.4 Å²	39.4	3%	0.028	23%	0.228	C	C	.	.	H	α-helix	trans	-67.3	-31.1	178.7	-60.2	0	0	0	0	112.6	I609 N610 L616 Y617	I609-S613 WeakPolarHBondContact O-CB 3.36Å; I609-S613 PolarHBondContact O-N 2.91Å; I609-S613 PolarHBondContact O-OG 3.01Å; N610-S613 PolarHBondContact O-N 2.77Å; S613-L616 PolarHBondContact O-N 2.79Å; S613-Y617 VanDerWaalsContact O-CB 3.22Å; S613-Y617 WeakPolarHBondContact O-CB 3.36Å; S613-Y617 PolarHBondContact O-N 3.23Å
614	L	96.1	Very high	95.7	Very high	19 Å²	19	40.3 Å²	40.3	10%	0.099	24%	0.235	C	C	.	.	H	α-helix	trans	-62.9	-42.5	171.3	-179.3	65.7	0	0	0	111.9	N610 L611 A612 L618 L653 W656 L685	N610-L614 PolarHBondContact O-N 3.07Å; L611-L614 PolarHBondContact O-N 2.79Å; A612-L614 VanDerWaalsContact C-N 3.32Å; A612-L614 PolarHBondContact O-N 3.31Å; L614-L618 WeakPolarHBondContact O-CG 3.08Å; L614-L618 PolarHBondContact O-N 2.89Å; L614-L653 HydrophobicContact CD1-CD1 3.69Å; L614-W656 HydrophobicContact CD1-CE3 4.49Å; L614-W656 HydrophobicContact CD2-CD2 4.41Å; L614-W656 HydrophobicContact CD2-CE3 4.37Å; L614-W656 HydrophobicContact CD2-CH2 3.62Å; L614-W656 HydrophobicContact CD2-CZ2 3.63Å; L614-W656 HydrophobicContact CD2-CZ3 4Å; L614-L685 HydrophobicContact CD1-CD2 3.78Å
615	G	96	Very high	95.5	Very high	34 Å²	34	42.8 Å²	42.8	35%	0.351	25%	0.252	S	S	.	.	H	α-helix	trans	-66.7	-46.2	174.4	0	0	0	0	0	112.6	L611 A612 Y617 L618 I619	L611-G615 PolarHBondContact O-N 2.72Å; A612-G615 PolarHBondContact O-N 3.33Å; G615-Y617 VanDerWaalsContact C-N 3.33Å; G615-Y617 PolarHBondContact O-N 3.01Å; G615-L618 PolarHBondContact O-N 3.4Å; G615-I619 WeakPolarHBondContact O-CG1 3.39Å; G615-I619 PolarHBondContact O-N 3.15Å
616	L	96.6	Very high	95.3	Very high	48 Å²	48	46 Å²	46	25%	0.251	27%	0.267	S	S	.	.	H	α-helix	trans	-57.4	-44.1	174.8	172	65.9	0	0	0	112	A612 S613 L618 I619 M620 T689 L690 L693	A612-L616 PolarHBondContact O-N 3.21Å; S613-L616 PolarHBondContact O-N 2.79Å; L616-L618 PolarHBondContact O-N 3.03Å; L616-I619 PolarHBondContact O-N 3.44Å; L616-M620 HydrophobicContact CD1-CG 4.04Å; L616-M620 HydrophobicContact CD1-SD 3.87Å; L616-M620 HydrophobicContact CD2-SD 4.23Å; L616-M620 HydrophobicContact CG-CG 4.34Å; L616-M620 HydrophobicContact CG-SD 3.75Å; L616-M620 WeakPolarHBondContact O-CG 3.42Å; L616-M620 PolarHBondContact O-N 3.04Å; L616-T689 HydrophobicContact CB-CG2 4.43Å; L616-T689 HydrophobicContact CD2-CG2 3.84Å; L616-T689 HydrophobicContact CG-CG2 3.89Å; L616-L690 HydrophobicContact CD2-CD2 4.2Å; L616-L693 HydrophobicContact CD2-CD2 3.99Å
617	Y	97.1	Very high	94.9	Very high	7 Å²	7	46.7 Å²	46.7	3%	0.027	27%	0.273	C	S	.	.	H	α-helix	trans	-56.4	-47.6	177.9	170	-95.9	0	0	0	111.8	S613 G615 I619 M620 V621 L645 G649 G650 L653 L685	S613-Y617 VanDerWaalsContact O-CB 3.22Å; S613-Y617 WeakPolarHBondContact O-CB 3.36Å; S613-Y617 PolarHBondContact O-N 3.23Å; G615-Y617 VanDerWaalsContact C-N 3.33Å; G615-Y617 PolarHBondContact O-N 3.01Å; Y617-I619 VanDerWaalsContact C-N 3.3Å; Y617-I619 PolarHBondContact O-N 3.49Å; Y617-M620 PolarHBondContact O-N 2.79Å; Y617-V621 HydrophobicContact CD1-CG2 4.38Å; Y617-V621 HydrophobicContact CD2-CG2 4.2Å; Y617-V621 HydrophobicContact CE1-CG2 3.81Å; Y617-V621 HydrophobicContact CE2-CG2 3.62Å; Y617-V621 WeakPolarHBondContact O-CG2 3.39Å; Y617-V621 PolarHBondContact O-N 3.17Å; Y617-L645 HydrophobicContact CD2-CD1 3.6Å; Y617-L645 HydrophobicContact CD2-CG 4.14Å; Y617-L645 HydrophobicContact CE2-CD1 3.63Å; Y617-L645 HydrophobicContact CE2-CG 3.76Å; Y617-L645 WeakPolarHBondContact CE2-O 3.45Å; Y617-L645 PolarHBondContact OH-O 2.71Å; Y617-G649 PolarHBondContact OH-O 2.84Å; Y617-G650 WeakPolarHBondContact OH-CA 3.03Å; Y617-G650 PolarHBondContact OH-N 2.79Å; Y617-L653 HydrophobicContact CD1-CD2 4.37Å; Y617-L653 HydrophobicContact CE1-CB 4.15Å; Y617-L653 HydrophobicContact CE1-CD2 3.74Å; Y617-L653 HydrophobicContact CE1-CG 4.48Å; Y617-L685 HydrophobicContact CD1-CD1 4.31Å; Y617-L685 HydrophobicContact CD1-CD2 4.1Å; Y617-L685 HydrophobicContact CD2-CD1 3.58Å; Y617-L685 HydrophobicContact CD2-CG 4.26Å; Y617-L685 HydrophobicContact CE1-CD1 4.39Å; Y617-L685 HydrophobicContact CE2-CD1 3.66Å; Y617-L685 HydrophobicContact CG-CD1 3.93Å; Y617-L685 HydrophobicContact CG-CD2 4.14Å; Y617-L685 HydrophobicContact CG-CG 4.19Å
618	L	96.5	Very high	94.5	Very high	92 Å²	92	50.2 Å²	50.2	48%	0.482	29%	0.292	S	S	.	.	H	α-helix	trans	-62	-38.3	178.6	-67.3	172.7	0	0	0	111.9	L614 G615 L616 A622 L653	L614-L618 WeakPolarHBondContact O-CG 3.08Å; L614-L618 PolarHBondContact O-N 2.89Å; G615-L618 PolarHBondContact O-N 3.4Å; L616-L618 PolarHBondContact O-N 3.03Å; L618-A622 VanDerWaalsContact O-CB 3.29Å; L618-A622 WeakPolarHBondContact O-CB 2.87Å; L618-A622 PolarHBondContact O-N 3.39Å; L618-L653 HydrophobicContact CD2-CD2 3.93Å
619	I	96	Very high	94.2	Very high	109 Å²	109	53.6 Å²	53.6	56%	0.559	31%	0.312	S	S	*	.	H	α-helix	trans	-65.6	-47.2	174.7	-64	166.1	0	0	0	110.7	G615 L616 Y617 V621 A622 V623	G615-I619 WeakPolarHBondContact O-CG1 3.39Å; G615-I619 PolarHBondContact O-N 3.15Å; L616-I619 PolarHBondContact O-N 3.44Å; Y617-I619 VanDerWaalsContact C-N 3.3Å; Y617-I619 PolarHBondContact O-N 3.49Å; I619-V621 PolarHBondContact O-N 2.96Å; I619-A622 PolarHBondContact O-N 3.08Å; I619-V623 HydrophobicContact CG2-CG2 4.38Å; I619-V623 WeakPolarHBondContact O-CB 3.43Å; I619-V623 WeakPolarHBondContact O-CG2 3.44Å; I619-V623 PolarHBondContact O-N 2.8Å
620	M	93.9	Very high	94	Very high	29 Å²	29	61.4 Å²	61.4	14%	0.143	34%	0.339	C	S	.	.	H	α-helix	trans	-62.4	-42.1	179.6	-71.3	174.2	61.6	0	0	112	L616 Y617 S624 L645 T689 T692 L693	L616-M620 HydrophobicContact CD1-CG 4.04Å; L616-M620 HydrophobicContact CD1-SD 3.87Å; L616-M620 HydrophobicContact CD2-SD 4.23Å; L616-M620 HydrophobicContact CG-CG 4.34Å; L616-M620 HydrophobicContact CG-SD 3.75Å; L616-M620 WeakPolarHBondContact O-CG 3.42Å; L616-M620 PolarHBondContact O-N 3.04Å; Y617-M620 PolarHBondContact O-N 2.79Å; M620-S624 VanDerWaalsContact O-CB 3.31Å; M620-S624 WeakPolarHBondContact O-CB 3.17Å; M620-S624 PolarHBondContact O-N 2.86Å; M620-L645 HydrophobicContact CB-CD2 3.65Å; M620-L645 HydrophobicContact CE-CD1 4.35Å; M620-T689 HydrophobicContact SD-CG2 3.72Å; M620-T692 HydrophobicContact CE-CG2 3.78Å; M620-L693 HydrophobicContact CE-CB 4.34Å; M620-L693 HydrophobicContact SD-CB 4.33Å; M620-L693 HydrophobicContact SD-CD1 4.41Å
621	V	94.6	Very high	93.4	Very high	31 Å²	31	64.4 Å²	64.4	19%	0.188	37%	0.37	C	S	.	.	H	α-helix	trans	-62.9	-49.9	173.7	170.6	0	0	0	0	110.6	Y617 I619 V623 S624 S625 L645 T646	Y617-V621 HydrophobicContact CD1-CG2 4.38Å; Y617-V621 HydrophobicContact CD2-CG2 4.2Å; Y617-V621 HydrophobicContact CE1-CG2 3.81Å; Y617-V621 HydrophobicContact CE2-CG2 3.62Å; Y617-V621 WeakPolarHBondContact O-CG2 3.39Å; Y617-V621 PolarHBondContact O-N 3.17Å; I619-V621 PolarHBondContact O-N 2.96Å; V621-V623 PolarHBondContact O-N 2.83Å; V621-S624 PolarHBondContact O-N 3.34Å; V621-S625 WeakPolarHBondContact O-CB 3.49Å; V621-S625 PolarHBondContact O-N 2.69Å; V621-S625 PolarHBondContact O-OG 2.93Å; V621-L645 HydrophobicContact CB-CD2 4.42Å; V621-L645 HydrophobicContact CG2-CD2 3.65Å; V621-L645 HydrophobicContact CG2-CG 3.72Å; V621-T646 HydrophobicContact CG1-CG2 4.5Å
622	A	94.4	Very high	92.9	Very high	47 Å²	47	65.7 Å²	65.7	39%	0.388	38%	0.377	S	S	.	.	H	α-helix	trans	-58.5	-46.7	-179.3	0	0	0	0	0	112.1	L618 I619 I626	L618-A622 VanDerWaalsContact O-CB 3.29Å; L618-A622 WeakPolarHBondContact O-CB 2.87Å; L618-A622 PolarHBondContact O-N 3.39Å; I619-A622 PolarHBondContact O-N 3.08Å; A622-I626 WeakPolarHBondContact O-CB 3.42Å; A622-I626 WeakPolarHBondContact O-CD1 3.36Å; A622-I626 WeakPolarHBondContact O-CG1 3.16Å; A622-I626 PolarHBondContact O-N 3.12Å
623	V	92	Very high	92	Very high	96 Å²	96	68 Å²	68	58%	0.582	39%	0.389	S	S	*	.	H	α-helix	trans	-61	-46	176.5	170.7	0	0	0	0	111.3	I619 V621 I626 A627	I619-V623 HydrophobicContact CG2-CG2 4.38Å; I619-V623 WeakPolarHBondContact O-CB 3.43Å; I619-V623 WeakPolarHBondContact O-CG2 3.44Å; I619-V623 PolarHBondContact O-N 2.8Å; V621-V623 PolarHBondContact O-N 2.83Å; V623-I626 PolarHBondContact O-N 3.24Å; V623-A627 WeakPolarHBondContact O-CB 3.18Å; V623-A627 PolarHBondContact O-N 3.5Å
624	S	90.1	Very high	91.2	Very high	19 Å²	19	69.9 Å²	69.9	13%	0.133	40%	0.398	C	S	.	.	H	α-helix	trans	-67.6	-43.9	-178.7	-161.6	0	0	0	0	112.5	M620 V621 I626 A627 I628 S642	M620-S624 VanDerWaalsContact O-CB 3.31Å; M620-S624 WeakPolarHBondContact O-CB 3.17Å; M620-S624 PolarHBondContact O-N 2.86Å; V621-S624 PolarHBondContact O-N 3.34Å; S624-I626 PolarHBondContact O-N 3.18Å; S624-A627 PolarHBondContact O-N 3.41Å; S624-I628 WeakPolarHBondContact O-CG1 3.38Å; S624-I628 PolarHBondContact O-N 2.95Å; S624-S642 VanDerWaalsContact OG-CB 3.29Å; S624-S642 WeakPolarHBondContact OG-CB 3.47Å; S624-S642 PolarHBondContact OG-OG 3.32Å
625	S	91.2	Very high	90.6	Very high	52 Å²	52	74.2 Å²	74.2	36%	0.364	42%	0.418	S	S	.	.	H	α-helix	trans	-62.1	-41.6	175.6	-59.2	0	0	0	0	111.9	V621 Q629	V621-S625 WeakPolarHBondContact O-CB 3.49Å; V621-S625 PolarHBondContact O-N 2.69Å; V621-S625 PolarHBondContact O-OG 2.93Å; S625-Q629 VanDerWaalsContact O-CB 3.23Å; S625-Q629 WeakPolarHBondContact O-CB 3.35Å; S625-Q629 PolarHBondContact O-N 2.81Å
626	I	92.8	Very high	90	Very high	96 Å²	96	78.4 Å²	78.4	49%	0.492	43%	0.429	S	S	.	.	H	α-helix	trans	-66.3	-38.3	175.7	-69.3	166.1	0	0	0	111.2	A622 V623 S624 R630	A622-I626 WeakPolarHBondContact O-CB 3.42Å; A622-I626 WeakPolarHBondContact O-CD1 3.36Å; A622-I626 WeakPolarHBondContact O-CG1 3.16Å; A622-I626 PolarHBondContact O-N 3.12Å; V623-I626 PolarHBondContact O-N 3.24Å; S624-I626 PolarHBondContact O-N 3.18Å; I626-R630 HydrophobicContact CG2-CG 4.46Å; I626-R630 WeakPolarHBondContact O-CB 3.42Å; I626-R630 VanDerWaalsContact O-CG 3.3Å; I626-R630 WeakPolarHBondContact O-CG 3.46Å; I626-R630 PolarHBondContact O-N 2.93Å
627	A	89.1	Confident	89.3	Confident	15 Å²	15	79.6 Å²	79.6	12%	0.124	43%	0.432	C	S	.	.	H	α-helix	trans	-64.5	-44.6	177.3	0	0	0	0	0	112.3	V623 S624 R630 G631 I632	V623-A627 WeakPolarHBondContact O-CB 3.18Å; V623-A627 PolarHBondContact O-N 3.5Å; S624-A627 PolarHBondContact O-N 3.41Å; A627-R630 PolarHBondContact O-N 3.48Å; A627-G631 PolarHBondContact O-N 3.4Å; A627-I632 HydrophobicContact CB-CB 4.47Å; A627-I632 HydrophobicContact CB-CD1 4.14Å; A627-I632 WeakPolarHBondContact O-CB 3.31Å; A627-I632 PolarHBondContact O-N 3.44Å
628	I	87.9	Confident	88.7	Confident	79 Å²	79	82 Å²	82	41%	0.405	44%	0.441	S	S	.	.	H	α-helix	trans	-64.5	-47.9	175.4	-69.1	170.6	0	0	0	110.6	S624 R630 G631 L634 S642	S624-I628 WeakPolarHBondContact O-CG1 3.38Å; S624-I628 PolarHBondContact O-N 2.95Å; I628-R630 PolarHBondContact O-N 3.21Å; I628-G631 PolarHBondContact O-N 3.09Å; I628-L634 HydrophobicContact CG1-CD1 3.97Å; I628-S642 VanDerWaalsContact CD1-OG 3.31Å; I628-S642 WeakPolarHBondContact CD1-OG 3.3Å
629	Q	90.9	Very high	88.1	Confident	171 Å²	171	80.5 Å²	80.5	80%	0.799	43%	0.433	S	S	*	.	H	α-helix	trans	-63.3	-24.9	179.6	-168.4	64.4	29.8	0	0	113.1	S625	S625-Q629 VanDerWaalsContact O-CB 3.23Å; S625-Q629 WeakPolarHBondContact O-CB 3.35Å; S625-Q629 PolarHBondContact O-N 2.81Å
630	R	91.3	Very high	87.6	Confident	201 Å²	201	79.8 Å²	79.8	76%	0.758	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	1.5	173.3	-74.2	-177.8	173.9	-154.6	-1.5	114.2	I626 A627 I628 I632	I626-R630 HydrophobicContact CG2-CG 4.46Å; I626-R630 WeakPolarHBondContact O-CB 3.42Å; I626-R630 VanDerWaalsContact O-CG 3.3Å; I626-R630 WeakPolarHBondContact O-CG 3.46Å; I626-R630 PolarHBondContact O-N 2.93Å; A627-R630 PolarHBondContact O-N 3.48Å; I628-R630 PolarHBondContact O-N 3.21Å; R630-I632 VanDerWaalsContact C-N 3.28Å; R630-I632 HydrophobicContact CB-CD1 4.47Å; R630-I632 HydrophobicContact CB-CG1 4.12Å; R630-I632 PolarHBondContact O-N 3.44Å
631	G	85.2	Confident	87.3	Confident	67 Å²	67	79.3 Å²	79.3	69%	0.691	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.3	25	-180	0	0	0	0	0	114.2	A627 I628 S633	A627-G631 PolarHBondContact O-N 3.4Å; I628-G631 PolarHBondContact O-N 3.09Å; G631-S633 PolarHBondContact O-N 3.13Å
632	I	86.2	Confident	87.1	Confident	96 Å²	96	77.9 Å²	77.9	49%	0.492	42%	0.416	S	S	.	.			trans	-67.6	126.8	177.8	-58.5	-178.3	0	0	0	108.6	A627 R630 L634	A627-I632 HydrophobicContact CB-CB 4.47Å; A627-I632 HydrophobicContact CB-CD1 4.14Å; A627-I632 WeakPolarHBondContact O-CB 3.31Å; A627-I632 PolarHBondContact O-N 3.44Å; R630-I632 VanDerWaalsContact C-N 3.28Å; R630-I632 HydrophobicContact CB-CD1 4.47Å; R630-I632 HydrophobicContact CB-CG1 4.12Å; R630-I632 PolarHBondContact O-N 3.44Å; I632-L634 VanDerWaalsContact C-N 3.33Å; I632-L634 PolarHBondContact O-N 2.73Å
633	S	78.6	Confident	86.8	Confident	117 Å²	117	80.6 Å²	80.6	82%	0.818	42%	0.424	S	S	*	.			trans	-69.8	84.3	-178.5	56	0	0	0	0	111.9	G631	G631-S633 PolarHBondContact O-N 3.13Å
634	L	79.8	Confident	86.8	Confident	42 Å²	42	77.6 Å²	77.6	22%	0.22	41%	0.405	C	S	.	.			trans	-72.1	138.1	173.6	-65.7	176.7	0	0	0	110.7	I628 I632 R638 L639	I628-L634 HydrophobicContact CG1-CD1 3.97Å; I632-L634 VanDerWaalsContact C-N 3.33Å; I632-L634 PolarHBondContact O-N 2.73Å; L634-R638 HydrophobicContact CB-CB 4.33Å; L634-R638 HydrophobicContact CD2-CB 4.42Å; L634-L639 HydrophobicContact CB-CD2 3.82Å; L634-L639 HydrophobicContact CB-CG 3.96Å; L634-L639 HydrophobicContact CD1-CD2 4.06Å
635	Q	82.8	Confident	86.8	Confident	111 Å²	111	76.9 Å²	76.9	52%	0.519	40%	0.399	S	S	.	.			trans	-68	147.1	172.3	-175.5	177.5	3.6	0	0	109.9	K637 R638 L639	Q635-K637 VanDerWaalsContact C-N 3.34Å; Q635-K637 PolarHBondContact O-N 2.99Å; Q635-K637 VanDerWaalsContact O-N 3.12Å; Q635-R638 WeakPolarHBondContact O-CA 3.32Å; Q635-R638 WeakPolarHBondContact O-CB 3.27Å; Q635-R638 PolarHBondContact O-N 2.89Å; Q635-L639 PolarHBondContact O-N 3.2Å
636	Q	82.9	Confident	86.8	Confident	121 Å²	121	77.1 Å²	77.1	57%	0.565	40%	0.398	S	S	*	.	H	α-helix	trans	-43	-51.3	-174.7	-176	60.5	25.6	0	0	114.5	R638 L639 E640	Q636-R638 PolarHBondContact O-N 3.34Å; Q636-R638 VanDerWaalsContact O-N 3.17Å; Q636-L639 WeakPolarHBondContact O-CB 3.48Å; Q636-L639 PolarHBondContact O-N 2.98Å; Q636-E640 WeakPolarHBondContact CG-OE1 3.36Å; Q636-E640 PolarHBondContact NE2-OE1 2.86Å; Q636-E640 PolarHBondContact O-N 3.33Å
637	K	82.1	Confident	86.7	Confident	74 Å²	74	74.7 Å²	74.7	32%	0.322	40%	0.398	S	S	.	.	H	α-helix	trans	-50.8	-38.4	174.6	178.2	-173	166.1	-167	0	113.6	Q635 H641 R695 D698	Q635-K637 VanDerWaalsContact C-N 3.34Å; Q635-K637 PolarHBondContact O-N 2.99Å; Q635-K637 VanDerWaalsContact O-N 3.12Å; K637-H641 VanDerWaalsContact CE-CE1 3.44Å; K637-H641 WeakPolarHBondContact CE-CE1 3.39Å; K637-H641 WeakPolarHBondContact O-CB 3.49Å; K637-H641 PolarHBondContact O-CD2 2.77Å; K637-H641 PolarHBondContact O-N 2.73Å; K637-R695 VanDerWaalsContact CE-O 3.28Å; K637-R695 WeakPolarHBondContact CE-O 3.44Å; K637-R695 PolarHBondContact NZ-O 2.6Å; K637-D698 VanDerWaalsContact NZ-CG 3.31Å; K637-D698 IonicContact NZ-OD1 3.88Å; K637-D698 IonicContact NZ-OD2 2.79Å; K637-D698 PolarHBondContact NZ-OD2 2.85Å
638	R	83.6	Confident	86.7	Confident	56 Å²	56	74.4 Å²	74.4	21%	0.211	40%	0.396	C	S	.	.	H	α-helix	trans	-80.1	-26.2	-179.8	-67	-167	-78.3	-79.6	-0.1	113	L634 Q635 Q636 S642	L634-R638 HydrophobicContact CB-CB 4.33Å; L634-R638 HydrophobicContact CD2-CB 4.42Å; Q635-R638 WeakPolarHBondContact O-CA 3.32Å; Q635-R638 WeakPolarHBondContact O-CB 3.27Å; Q635-R638 PolarHBondContact O-N 2.89Å; Q636-R638 PolarHBondContact O-N 3.34Å; Q636-R638 VanDerWaalsContact O-N 3.17Å; R638-S642 PolarHBondContact O-N 2.76Å; R638-S642 VanDerWaalsContact O-N 3.13Å
639	L	84.4	Confident	87	Confident	62 Å²	62	70.6 Å²	70.6	33%	0.325	38%	0.376	S	S	.	.	H	α-helix	trans	-68.5	-48.8	167.9	-66.7	170.8	0	0	0	110.1	L634 Q635 Q636 H641 S642 D643	L634-L639 HydrophobicContact CB-CD2 3.82Å; L634-L639 HydrophobicContact CB-CG 3.96Å; L634-L639 HydrophobicContact CD1-CD2 4.06Å; Q635-L639 PolarHBondContact O-N 3.2Å; Q636-L639 WeakPolarHBondContact O-CB 3.48Å; Q636-L639 PolarHBondContact O-N 2.98Å; L639-H641 VanDerWaalsContact C-N 3.33Å; L639-H641 PolarHBondContact O-N 2.84Å; L639-S642 CarbonylContact O-C 3.27Å; L639-S642 WeakPolarHBondContact O-CA 3.46Å; L639-S642 VanDerWaalsContact O-CB 3.24Å; L639-S642 WeakPolarHBondContact O-CB 3.43Å; L639-S642 PolarHBondContact O-N 3.26Å; L639-D643 PolarHBondContact O-N 2.87Å
640	E	86.7	Confident	87.2	Confident	93 Å²	93	63.6 Å²	63.6	44%	0.435	35%	0.35	S	S	.	.	H	α-helix	trans	-59	-41.5	177.1	-69.6	167.3	-168.9	0	0	112.4	Q636 S642 D643 I644	Q636-E640 WeakPolarHBondContact CG-OE1 3.36Å; Q636-E640 PolarHBondContact NE2-OE1 2.86Å; Q636-E640 PolarHBondContact O-N 3.33Å; E640-S642 VanDerWaalsContact C-N 3.31Å; E640-S642 PolarHBondContact O-N 3.47Å; E640-D643 PolarHBondContact O-N 2.9Å; E640-I644 WeakPolarHBondContact O-CD1 3.2Å; E640-I644 VanDerWaalsContact O-CG1 3.28Å; E640-I644 WeakPolarHBondContact O-CG1 3.47Å; E640-I644 PolarHBondContact O-N 2.97Å
641	H	87.6	Confident	87.5	Confident	19 Å²	19	55.2 Å²	55.2	9%	0.088	32%	0.32	C	S	.	.	H	α-helix	trans	-62.4	-34.9	171	-70.8	173.7	0	0	0	113.1	K637 L639 L645 T692 N696	K637-H641 VanDerWaalsContact CE-CE1 3.44Å; K637-H641 WeakPolarHBondContact CE-CE1 3.39Å; K637-H641 WeakPolarHBondContact O-CB 3.49Å; K637-H641 PolarHBondContact O-CD2 2.77Å; K637-H641 PolarHBondContact O-N 2.73Å; L639-H641 VanDerWaalsContact C-N 3.33Å; L639-H641 PolarHBondContact O-N 2.84Å; H641-L645 VanDerWaalsContact O-CB 3.28Å; H641-L645 WeakPolarHBondContact O-CB 3.41Å; H641-L645 PolarHBondContact O-N 2.79Å; H641-T692 HydrophobicContact CB-CG2 4.08Å; H641-N696 PolarHBondContact ND1-ND2 2.72Å; H641-N696 PolarHBondContact ND1-OD1 2.95Å
642	S	88.6	Confident	88.1	Confident	2 Å²	2	52.1 Å²	52.1	1%	0.014	29%	0.287	C	S	.	.	H	α-helix	trans	-68.9	-42.3	175.7	-167.2	0	0	0	0	112	S624 I628 R638 L639 E640 L645 T646	S624-S642 VanDerWaalsContact OG-CB 3.29Å; S624-S642 WeakPolarHBondContact OG-CB 3.47Å; S624-S642 PolarHBondContact OG-OG 3.32Å; I628-S642 VanDerWaalsContact CD1-OG 3.31Å; I628-S642 WeakPolarHBondContact CD1-OG 3.3Å; R638-S642 PolarHBondContact O-N 2.76Å; R638-S642 VanDerWaalsContact O-N 3.13Å; L639-S642 CarbonylContact O-C 3.27Å; L639-S642 WeakPolarHBondContact O-CA 3.46Å; L639-S642 VanDerWaalsContact O-CB 3.24Å; L639-S642 WeakPolarHBondContact O-CB 3.43Å; L639-S642 PolarHBondContact O-N 3.26Å; E640-S642 VanDerWaalsContact C-N 3.31Å; E640-S642 PolarHBondContact O-N 3.47Å; S642-L645 PolarHBondContact O-N 2.95Å; S642-T646 WeakPolarHBondContact O-CB 2.99Å; S642-T646 WeakPolarHBondContact O-CG2 3.05Å; S642-T646 PolarHBondContact O-N 3.1Å; S642-T646 PolarHBondContact O-OG1 3.4Å
643	D	88.6	Confident	88.6	Confident	104 Å²	104	48.9 Å²	48.9	56%	0.556	27%	0.271	S	S	*	.	H	α-helix	trans	-65.8	-40.7	178.1	-66.3	-23.1	0	0	0	111.6	L639 E640 G647	L639-D643 PolarHBondContact O-N 2.87Å; E640-D643 PolarHBondContact O-N 2.9Å; D643-G647 WeakPolarHBondContact O-CA 3.18Å; D643-G647 PolarHBondContact O-N 3.49Å
644	I	91.9	Very high	89.5	Confident	33 Å²	33	45.9 Å²	45.9	17%	0.169	25%	0.246	C	C	.	.	I	π-helix	trans	-60.6	-45.4	172.3	-71.9	162.6	0	0	0	110.7	S177 E640 G648 G649 V688	S177-I644 WeakPolarHBondContact O-CD1 3.38Å; E640-I644 WeakPolarHBondContact O-CD1 3.2Å; E640-I644 VanDerWaalsContact O-CG1 3.28Å; E640-I644 WeakPolarHBondContact O-CG1 3.47Å; E640-I644 PolarHBondContact O-N 2.97Å; I644-G648 CarbonylContact O-C 3.59Å; I644-G648 VanDerWaalsContact O-CA 3.25Å; I644-G648 WeakPolarHBondContact O-CA 3.25Å; I644-G648 PolarHBondContact O-N 3.16Å; I644-G649 PolarHBondContact O-N 2.57Å; I644-V688 HydrophobicContact CG2-CG1 3.88Å
645	L	91.6	Very high	90.3	Very high	4 Å²	4	43.9 Å²	43.9	2%	0.021	24%	0.235	C	C	.	.	I	π-helix	trans	-68.8	-50.4	-177.4	-165.4	76.3	0	0	0	111.4	Y617 M620 V621 H641 S642 G649 G650	Y617-L645 HydrophobicContact CD2-CD1 3.6Å; Y617-L645 HydrophobicContact CD2-CG 4.14Å; Y617-L645 HydrophobicContact CE2-CD1 3.63Å; Y617-L645 HydrophobicContact CE2-CG 3.76Å; Y617-L645 WeakPolarHBondContact CE2-O 3.45Å; Y617-L645 PolarHBondContact OH-O 2.71Å; M620-L645 HydrophobicContact CB-CD2 3.65Å; M620-L645 HydrophobicContact CE-CD1 4.35Å; V621-L645 HydrophobicContact CB-CD2 4.42Å; V621-L645 HydrophobicContact CG2-CD2 3.65Å; V621-L645 HydrophobicContact CG2-CG 3.72Å; H641-L645 VanDerWaalsContact O-CB 3.28Å; H641-L645 WeakPolarHBondContact O-CB 3.41Å; H641-L645 PolarHBondContact O-N 2.79Å; S642-L645 PolarHBondContact O-N 2.95Å; L645-G649 CarbonylContact O-C 3.54Å; L645-G649 WeakPolarHBondContact O-CA 3.3Å; L645-G649 PolarHBondContact O-N 3.2Å; L645-G650 PolarHBondContact O-N 2.82Å
646	T	90.9	Very high	91.1	Very high	56 Å²	56	40 Å²	40	34%	0.344	22%	0.216	S	C	.	.	I	π-helix	trans	-73.2	-41.9	-176.5	55.2	0	0	0	0	113	V621 S642 G650	V621-T646 HydrophobicContact CG1-CG2 4.5Å; S642-T646 WeakPolarHBondContact O-CB 2.99Å; S642-T646 WeakPolarHBondContact O-CG2 3.05Å; S642-T646 PolarHBondContact O-N 3.1Å; S642-T646 PolarHBondContact O-OG1 3.4Å; T646-G650 WeakPolarHBondContact O-CA 3.07Å; T646-G650 PolarHBondContact O-N 3.02Å
647	G	89	Confident	91.7	Very high	46 Å²	46	37.8 Å²	37.8	47%	0.474	21%	0.207	S	C	.	.	I	π-helix	trans	-83	-61.2	179.3	0	0	0	0	0	112.9	D643 L651	D643-G647 WeakPolarHBondContact O-CA 3.18Å; D643-G647 PolarHBondContact O-N 3.49Å; G647-L651 PolarHBondContact O-N 3.35Å
648	G	91	Very high	92.5	Very high	8 Å²	8	35.6 Å²	35.6	8%	0.082	20%	0.199	C	C	.	.	I	π-helix	trans	-69.3	-50	-177.5	0	0	0	0	0	112.7	I644 G650 L651 L652	I644-G648 CarbonylContact O-C 3.59Å; I644-G648 VanDerWaalsContact O-CA 3.25Å; I644-G648 WeakPolarHBondContact O-CA 3.25Å; I644-G648 PolarHBondContact O-N 3.16Å; G648-G650 VanDerWaalsContact C-N 3.33Å; G648-L651 PolarHBondContact O-N 2.82Å; G648-L652 WeakPolarHBondContact O-CG 3.36Å; G648-L652 PolarHBondContact O-N 2.89Å
649	G	94	Very high	93.1	Very high	0 Å²	0	33 Å²	33	0%	0	19%	0.189	C	C	.	.	I	π-helix	trans	-63.8	-36.9	172.8	0	0	0	0	0	112.7	Y617 I644 L645 L651 L652 L653	Y617-G649 PolarHBondContact OH-O 2.84Å; I644-G649 PolarHBondContact O-N 2.57Å; L645-G649 CarbonylContact O-C 3.54Å; L645-G649 WeakPolarHBondContact O-CA 3.3Å; L645-G649 PolarHBondContact O-N 3.2Å; G649-L651 PolarHBondContact O-N 3.3Å; G649-L652 PolarHBondContact O-N 2.92Å; G649-L653 PolarHBondContact O-N 2.94Å
650	G	95.3	Very high	93.7	Very high	23 Å²	23	30.8 Å²	30.8	24%	0.237	18%	0.177	C	C	.	.	H	α-helix	trans	-61.7	-41.5	176.7	0	0	0	0	0	113.2	Y617 L645 T646 G648 L653 L654	Y617-G650 WeakPolarHBondContact OH-CA 3.03Å; Y617-G650 PolarHBondContact OH-N 2.79Å; L645-G650 PolarHBondContact O-N 2.82Å; T646-G650 WeakPolarHBondContact O-CA 3.07Å; T646-G650 PolarHBondContact O-N 3.02Å; G648-G650 VanDerWaalsContact C-N 3.33Å; G650-L653 PolarHBondContact O-N 2.73Å; G650-L654 WeakPolarHBondContact O-CB 3.45Å; G650-L654 PolarHBondContact O-N 2.86Å
651	L	96.1	Very high	94.1	Very high	25 Å²	25	28.8 Å²	28.8	13%	0.131	18%	0.176	C	C	.	.	H	α-helix	trans	-63.3	-39.5	173.9	-178	65.4	0	0	0	112.2	L176 M220 V221 L262 N266 G647 G648 G649 G655	L176-L651 HydrophobicContact CD1-CD2 4.49Å; L176-L651 HydrophobicContact CD2-CD2 4.11Å; M220-L651 HydrophobicContact CE-CD1 4.1Å; M220-L651 HydrophobicContact CE-CD2 3.92Å; M220-L651 HydrophobicContact CE-CG 4.36Å; V221-L651 HydrophobicContact CG2-CD2 4.26Å; L262-L651 HydrophobicContact CD1-CD1 4.06Å; N266-L651 HydrophobicContact CB-CD1 4.46Å; G647-L651 PolarHBondContact O-N 3.35Å; G648-L651 PolarHBondContact O-N 2.82Å; G649-L651 PolarHBondContact O-N 3.3Å; L651-G655 PolarHBondContact O-N 2.78Å
652	L	97.5	Very high	94.4	Very high	2 Å²	2	29.7 Å²	29.7	1%	0.01	18%	0.183	C	C	.	.	H	α-helix	trans	-70.8	-40.9	177.6	-66.9	171.5	0	0	0	112.1	I172 L176 G648 G649 G655 W656 F681 M684 L685 V688	I172-L652 HydrophobicContact CG2-CD2 4.4Å; L176-L652 HydrophobicContact CD1-CD1 4.07Å; L176-L652 HydrophobicContact CD1-CD2 4.06Å; L176-L652 HydrophobicContact CD1-CG 3.94Å; G648-L652 WeakPolarHBondContact O-CG 3.36Å; G648-L652 PolarHBondContact O-N 2.89Å; G649-L652 PolarHBondContact O-N 2.92Å; L652-G655 PolarHBondContact O-N 2.96Å; L652-W656 PolarHBondContact O-N 3.43Å; L652-F681 HydrophobicContact CD2-CD1 4.16Å; L652-M684 HydrophobicContact CD1-CB 3.9Å; L652-M684 HydrophobicContact CD2-CB 3.75Å; L652-M684 HydrophobicContact CD2-CE 3.88Å; L652-M684 HydrophobicContact CD2-CG 4.5Å; L652-M684 HydrophobicContact CD2-SD 4.05Å; L652-M684 HydrophobicContact CG-CB 4.42Å; L652-L685 HydrophobicContact CB-CB 4.25Å; L652-L685 HydrophobicContact CB-CD1 4.17Å; L652-V688 HydrophobicContact CD1-CG2 4.03Å
653	L	97.6	Very high	94.7	Very high	28 Å²	28	29.7 Å²	29.7	15%	0.147	18%	0.183	C	C	.	.	H	α-helix	trans	-62.6	-42.6	172.6	176.9	62.6	0	0	0	111.4	L614 Y617 L618 G649 G650 G655 W656 L657 L685	L614-L653 HydrophobicContact CD1-CD1 3.69Å; Y617-L653 HydrophobicContact CD1-CD2 4.37Å; Y617-L653 HydrophobicContact CE1-CB 4.15Å; Y617-L653 HydrophobicContact CE1-CD2 3.74Å; Y617-L653 HydrophobicContact CE1-CG 4.48Å; L618-L653 HydrophobicContact CD2-CD2 3.93Å; G649-L653 PolarHBondContact O-N 2.94Å; G650-L653 PolarHBondContact O-N 2.73Å; L653-G655 VanDerWaalsContact C-N 3.31Å; L653-G655 PolarHBondContact O-N 3.12Å; L653-W656 HydrophobicContact CD1-CE3 3.95Å; L653-W656 PolarHBondContact O-N 3.5Å; L653-L657 HydrophobicContact CD1-CD1 4.39Å; L653-L657 HydrophobicContact CD1-CG 4.24Å; L653-L657 HydrophobicContact CG-CD1 4.08Å; L653-L657 HydrophobicContact CG-CG 4.39Å; L653-L657 WeakPolarHBondContact O-CB 3.27Å; L653-L657 WeakPolarHBondContact O-CG 3.48Å; L653-L657 PolarHBondContact O-N 3.17Å; L653-L685 HydrophobicContact CB-CD2 4.25Å; L653-L685 HydrophobicContact CD1-CD2 4.45Å
654	L	97.3	Very high	94.9	Very high	55 Å²	55	30.9 Å²	30.9	29%	0.288	18%	0.181	S	C	.	.	H	α-helix	trans	-60.6	-42.3	173.8	-179.6	62.2	0	0	0	111	L262 L265 G650 W656 L657 L658	L262-L654 HydrophobicContact CD1-CB 4.22Å; L262-L654 HydrophobicContact CD1-CD2 3.93Å; L262-L654 HydrophobicContact CD1-CG 3.8Å; L265-L654 HydrophobicContact CB-CD2 4.36Å; L265-L654 HydrophobicContact CD1-CD1 4.15Å; L265-L654 HydrophobicContact CD1-CD2 4.03Å; G650-L654 WeakPolarHBondContact O-CB 3.45Å; G650-L654 PolarHBondContact O-N 2.86Å; L654-W656 PolarHBondContact O-N 3.17Å; L654-L657 PolarHBondContact O-N 3.48Å; L654-L658 HydrophobicContact CD1-CD1 3.96Å; L654-L658 HydrophobicContact CD1-CD2 4.49Å; L654-L658 HydrophobicContact CD1-CG 4Å; L654-L658 HydrophobicContact CG-CD1 3.98Å; L654-L658 HydrophobicContact CG-CG 4.38Å; L654-L658 WeakPolarHBondContact O-CB 3.31Å; L654-L658 VanDerWaalsContact O-CG 3.24Å; L654-L658 WeakPolarHBondContact O-CG 3.2Å; L654-L658 PolarHBondContact O-N 3.44Å
655	G	97.5	Very high	94.8	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-57.3	-47.2	173	0	0	0	0	0	113	L651 L652 L653 H659	L651-G655 PolarHBondContact O-N 2.78Å; L652-G655 PolarHBondContact O-N 2.96Å; L653-G655 VanDerWaalsContact C-N 3.31Å; L653-G655 PolarHBondContact O-N 3.12Å; G655-H659 PolarHBondContact O-N 2.95Å; G655-H659 PolarHBondContact O-ND1 3.01Å
656	W	98.1	Very high	94.6	Very high	30 Å²	30	38.6 Å²	38.6	11%	0.114	23%	0.225	C	C	.	.	H	α-helix	trans	-60.9	-50.8	175.1	179.1	83	0	0	0	112.2	L614 L652 L653 L654 L658 H659 Y660 Y675 F681	L614-W656 HydrophobicContact CD1-CE3 4.49Å; L614-W656 HydrophobicContact CD2-CD2 4.41Å; L614-W656 HydrophobicContact CD2-CE3 4.37Å; L614-W656 HydrophobicContact CD2-CH2 3.62Å; L614-W656 HydrophobicContact CD2-CZ2 3.63Å; L614-W656 HydrophobicContact CD2-CZ3 4Å; L652-W656 PolarHBondContact O-N 3.43Å; L653-W656 HydrophobicContact CD1-CE3 3.95Å; L653-W656 PolarHBondContact O-N 3.5Å; L654-W656 PolarHBondContact O-N 3.17Å; W656-L658 VanDerWaalsContact C-N 3.35Å; W656-L658 PolarHBondContact O-N 3.29Å; W656-H659 CarbonylContact O-C 3.55Å; W656-H659 PolarHBondContact O-N 2.92Å; W656-Y660 AromaticContact CE2-CD1 3.94Å; W656-Y660 AromaticContact CH2-CD1 3.55Å; W656-Y660 HydrophobicContact CH2-CD1 3.55Å; W656-Y660 AromaticContact CH2-CE1 3.82Å; W656-Y660 HydrophobicContact CH2-CE1 3.82Å; W656-Y660 AromaticContact CZ2-CD1 3.38Å; W656-Y660 HydrophobicContact CZ2-CD1 3.38Å; W656-Y660 AromaticContact CZ2-CE1 3.67Å; W656-Y660 HydrophobicContact CZ2-CE1 3.67Å; W656-Y660 HydrophobicContact CZ2-CG 4.24Å; W656-Y660 HydrophobicContact CZ3-CD1 4.24Å; W656-Y660 VanDerWaalsContact O-CB 3.28Å; W656-Y660 WeakPolarHBondContact O-CB 3.34Å; W656-Y660 PolarHBondContact O-N 2.81Å; W656-Y675 AromaticContact NE1-CE2 3.75Å; W656-Y675 AromaticContact NE1-CZ 3.72Å; W656-Y675 PolarHBondContact NE1-OH 3.03Å; W656-F681 HydrophobicContact CB-CB 3.99Å
657	L	97.4	Very high	94	Very high	73 Å²	73	39.3 Å²	39.3	38%	0.382	24%	0.244	S	C	.	.	H	α-helix	trans	-56.4	-47	179.5	-75.9	170.9	0	0	0	111.7	L653 L654 H659 Y660 A661	L653-L657 HydrophobicContact CD1-CD1 4.39Å; L653-L657 HydrophobicContact CD1-CG 4.24Å; L653-L657 HydrophobicContact CG-CD1 4.08Å; L653-L657 HydrophobicContact CG-CG 4.39Å; L653-L657 WeakPolarHBondContact O-CB 3.27Å; L653-L657 WeakPolarHBondContact O-CG 3.48Å; L653-L657 PolarHBondContact O-N 3.17Å; L654-L657 PolarHBondContact O-N 3.48Å; L657-H659 VanDerWaalsContact C-N 3.32Å; L657-H659 PolarHBondContact O-N 3.39Å; L657-Y660 PolarHBondContact O-N 2.91Å; L657-A661 VanDerWaalsContact O-CB 3.24Å; L657-A661 WeakPolarHBondContact O-CB 3.34Å; L657-A661 PolarHBondContact O-N 2.83Å
658	L	97.1	Very high	93.8	Very high	28 Å²	28	39 Å²	39	15%	0.147	23%	0.228	C	C	.	.	H	α-helix	trans	-68.3	-29.5	-178.7	-68	178.1	0	0	0	113.4	F258 F261 L262 L265 L654 W656 P662	F258-L658 WeakPolarHBondContact CD2-O 3.41Å; F258-L658 VanDerWaalsContact CG-O 3.29Å; F258-L658 WeakPolarHBondContact CG-O 3.29Å; F261-L658 HydrophobicContact CD1-CD1 3.76Å; F261-L658 HydrophobicContact CD1-CD2 3.55Å; F261-L658 HydrophobicContact CD1-CG 4.28Å; F261-L658 HydrophobicContact CE1-CD1 4.49Å; F261-L658 HydrophobicContact CE1-CD2 3.81Å; L262-L658 HydrophobicContact CB-CD1 3.91Å; L262-L658 HydrophobicContact CD1-CD1 4.16Å; L265-L658 HydrophobicContact CD1-CD1 4.35Å; L654-L658 HydrophobicContact CD1-CD1 3.96Å; L654-L658 HydrophobicContact CD1-CD2 4.49Å; L654-L658 HydrophobicContact CD1-CG 4Å; L654-L658 HydrophobicContact CG-CD1 3.98Å; L654-L658 HydrophobicContact CG-CG 4.38Å; L654-L658 WeakPolarHBondContact O-CB 3.31Å; L654-L658 VanDerWaalsContact O-CG 3.24Å; L654-L658 WeakPolarHBondContact O-CG 3.2Å; L654-L658 PolarHBondContact O-N 3.44Å; W656-L658 VanDerWaalsContact C-N 3.35Å; W656-L658 PolarHBondContact O-N 3.29Å; L658-P662 WeakPolarHBondContact O-CD 3.28Å; L658-P662 WeakPolarHBondContact O-CG 3.32Å
659	H	96.7	Very high	93.5	Very high	1 Å²	1	39.8 Å²	39.8	1%	0.005	23%	0.232	C	C	.	.	H	α-helix	trans	-91.4	1.1	176.7	-66.3	80.4	0	0	0	113.6	V259 G655 W656 L657 F663 P677 A678 F681	V259-H659 PolarHBondContact N-NE2 3.17Å; G655-H659 PolarHBondContact O-N 2.95Å; G655-H659 PolarHBondContact O-ND1 3.01Å; W656-H659 CarbonylContact O-C 3.55Å; W656-H659 PolarHBondContact O-N 2.92Å; L657-H659 VanDerWaalsContact C-N 3.32Å; L657-H659 PolarHBondContact O-N 3.39Å; H659-F663 VanDerWaalsContact O-CE2 3.27Å; H659-F663 WeakPolarHBondContact O-CE2 3.21Å; H659-P677 HydrophobicContact CB-CB 4.41Å; H659-A678 HydrophobicContact CB-CB 3.94Å; H659-F681 AromaticContact CE1-CE2 3.5Å; H659-F681 AromaticContact CE1-CZ 3.9Å; H659-F681 AromaticContact CG-CE2 3.93Å; H659-F681 AromaticContact ND1-CD2 3.98Å; H659-F681 AromaticContact ND1-CE2 3.35Å; H659-F681 VanDerWaalsContact ND1-CE2 3.35Å; H659-F681 WeakPolarHBondContact ND1-CE2 3.32Å
660	Y	96.6	Very high	93.3	Very high	17 Å²	17	40.3 Å²	40.3	7%	0.067	23%	0.234	C	C	.	.	H	α-helix	trans	-124.8	-51.2	-178.6	-176.9	-130.3	0	0	0	113.6	P576 W579 P580 W656 L657 P662 F663 Y664 Y675	P576-Y660 HydrophobicContact CB-CE2 4.21Å; P576-Y660 PolarHBondContact O-OH 2.97Å; P576-Y660 VanDerWaalsContact O-OH 3.13Å; W579-Y660 HydrophobicContact CE3-CD2 4.08Å; W579-Y660 AromaticContact CE3-CE2 3.77Å; W579-Y660 HydrophobicContact CE3-CE2 3.77Å; W579-Y660 HydrophobicContact CZ3-CD2 4.28Å; W579-Y660 HydrophobicContact CZ3-CE2 4.24Å; P580-Y660 WeakPolarHBondContact CD-OH 3.48Å; P580-Y660 HydrophobicContact CG-CE1 4.2Å; P580-Y660 HydrophobicContact CG-CE2 4.11Å; P580-Y660 VanDerWaalsContact CG-OH 3.29Å; P580-Y660 WeakPolarHBondContact CG-OH 3.26Å; W656-Y660 AromaticContact CE2-CD1 3.94Å; W656-Y660 AromaticContact CH2-CD1 3.55Å; W656-Y660 HydrophobicContact CH2-CD1 3.55Å; W656-Y660 AromaticContact CH2-CE1 3.82Å; W656-Y660 HydrophobicContact CH2-CE1 3.82Å; W656-Y660 AromaticContact CZ2-CD1 3.38Å; W656-Y660 HydrophobicContact CZ2-CD1 3.38Å; W656-Y660 AromaticContact CZ2-CE1 3.67Å; W656-Y660 HydrophobicContact CZ2-CE1 3.67Å; W656-Y660 HydrophobicContact CZ2-CG 4.24Å; W656-Y660 HydrophobicContact CZ3-CD1 4.24Å; W656-Y660 VanDerWaalsContact O-CB 3.28Å; W656-Y660 WeakPolarHBondContact O-CB 3.34Å; W656-Y660 PolarHBondContact O-N 2.81Å; L657-Y660 PolarHBondContact O-N 2.91Å; Y660-P662 VanDerWaalsContact C-CD 3.46Å; Y660-F663 PolarHBondContact O-N 3.21Å; Y660-F663 VanDerWaalsContact O-N 3.16Å; Y660-Y664 HydrophobicContact CD1-CE2 4.31Å; Y660-Y664 AromaticContact CE1-CE2 3.75Å; Y660-Y664 HydrophobicContact CE1-CE2 3.75Å; Y660-Y664 HydrophobicContact CE2-CE2 4.04Å; Y660-Y664 AromaticContact CZ-CE2 3.6Å; Y660-Y664 PolarHBondContact OH-OH 3.37Å; Y660-Y675 AromaticContact CD2-CD2 3.55Å; Y660-Y675 HydrophobicContact CD2-CD2 3.55Å; Y660-Y675 AromaticContact CD2-CE2 3.63Å; Y660-Y675 HydrophobicContact CD2-CE2 3.63Å; Y660-Y675 AromaticContact CE2-CD2 3.83Å; Y660-Y675 HydrophobicContact CE2-CD2 3.83Å; Y660-Y675 AromaticContact CE2-CE2 3.87Å; Y660-Y675 HydrophobicContact CE2-CE2 3.87Å; Y660-Y675 HydrophobicContact CG-CD2 4.29Å; Y660-Y675 AromaticContact CG-CE2 4Å; Y660-Y675 HydrophobicContact CG-CE2 4Å
661	A	95.8	Very high	93	Very high	50 Å²	50	42.8 Å²	42.8	41%	0.413	24%	0.237	S	C	.	.	G	3₁₀ helix	trans	-58.4	-38.6	-174	0	0	0	0	0	114.5	L657 F663 Y664	L657-A661 VanDerWaalsContact O-CB 3.24Å; L657-A661 WeakPolarHBondContact O-CB 3.34Å; L657-A661 PolarHBondContact O-N 2.83Å; A661-F663 PolarHBondContact O-N 3.04Å; A661-F663 VanDerWaalsContact O-N 3.15Å; A661-Y664 PolarHBondContact O-N 2.89Å; A661-Y664 VanDerWaalsContact O-N 3.16Å
662	P	94.8	Very high	92.8	Very high	38 Å²	38	41.8 Å²	41.8	25%	0.247	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-58.4	-29.2	178.4	-28.1	37.8	0	0	0	114.3	F258 L658 Y660 Y664 V665 M666	F258-P662 HydrophobicContact CD1-CG 4.24Å; F258-P662 HydrophobicContact CE1-CB 3.8Å; F258-P662 HydrophobicContact CE1-CG 3.72Å; F258-P662 HydrophobicContact CE2-CB 4.3Å; F258-P662 HydrophobicContact CE2-CG 4.33Å; F258-P662 HydrophobicContact CZ-CB 3.52Å; F258-P662 HydrophobicContact CZ-CG 3.78Å; L658-P662 WeakPolarHBondContact O-CD 3.28Å; L658-P662 WeakPolarHBondContact O-CG 3.32Å; Y660-P662 VanDerWaalsContact C-CD 3.46Å; P662-Y664 PolarHBondContact O-N 2.82Å; P662-V665 PolarHBondContact O-N 2.95Å; P662-M666 HydrophobicContact CB-CE 4.37Å; P662-M666 WeakPolarHBondContact O-CG 3.2Å; P662-M666 PolarHBondContact O-N 2.88Å
663	F	93.6	Very high	92.5	Very high	3 Å²	3	42 Å²	42	1%	0.013	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-67.5	-19.8	-179	-68.3	-59.8	0	0	0	113.7	V255 F258 P576 W579 H659 Y660 A661 V665 M666 L670 H674	V255-F663 HydrophobicContact CG1-CZ 4.42Å; V255-F663 HydrophobicContact CG2-CZ 4.24Å; F258-F663 HydrophobicContact CE2-CE2 4.24Å; F258-F663 HydrophobicContact CE2-CZ 4.05Å; P576-F663 HydrophobicContact CG-CB 4.11Å; W579-F663 HydrophobicContact CH2-CB 3.84Å; W579-F663 HydrophobicContact CH2-CD2 4.22Å; W579-F663 AromaticContact CH2-CG 3.96Å; W579-F663 HydrophobicContact CH2-CG 3.96Å; W579-F663 HydrophobicContact CZ3-CB 3.88Å; W579-F663 AromaticContact CZ3-CD2 3.81Å; W579-F663 HydrophobicContact CZ3-CD2 3.81Å; W579-F663 AromaticContact CZ3-CG 3.96Å; W579-F663 HydrophobicContact CZ3-CG 3.96Å; H659-F663 VanDerWaalsContact O-CE2 3.27Å; H659-F663 WeakPolarHBondContact O-CE2 3.21Å; Y660-F663 PolarHBondContact O-N 3.21Å; Y660-F663 VanDerWaalsContact O-N 3.16Å; A661-F663 PolarHBondContact O-N 3.04Å; A661-F663 VanDerWaalsContact O-N 3.15Å; F663-V665 VanDerWaalsContact C-N 3.26Å; F663-V665 PolarHBondContact O-N 3.18Å; F663-M666 HydrophobicContact CD1-SD 3.63Å; F663-M666 HydrophobicContact CE1-SD 3.85Å; F663-L670 HydrophobicContact CB-CD1 4.32Å; F663-L670 HydrophobicContact CD1-CD2 3.74Å; F663-L670 HydrophobicContact CE1-CD2 4.25Å; F663-L670 WeakPolarHBondContact O-CD1 3.48Å; F663-H674 HydrophobicContact CE1-CB 4.22Å; F663-H674 AromaticContact CE1-CD2 3.54Å; F663-H674 HydrophobicContact CE2-CB 4.14Å; F663-H674 HydrophobicContact CZ-CB 3.91Å; F663-H674 AromaticContact CZ-CD2 3.76Å
664	Y	92.5	Very high	92.4	Very high	129 Å²	129	41.5 Å²	41.5	51%	0.506	23%	0.229	S	C	.	.	G	3₁₀ helix	trans	-70.7	-20.4	171.6	-76.2	-98.4	0	0	0	113.5	P576 Y660 A661 P662	P576-Y664 HydrophobicContact CB-CD1 4.39Å; P576-Y664 HydrophobicContact CB-CD2 3.9Å; P576-Y664 HydrophobicContact CB-CE1 4.25Å; P576-Y664 HydrophobicContact CB-CE2 3.72Å; P576-Y664 HydrophobicContact CB-CG 4.25Å; P576-Y664 HydrophobicContact CG-CD2 4.47Å; P576-Y664 HydrophobicContact CG-CG 4.47Å; Y660-Y664 HydrophobicContact CD1-CE2 4.31Å; Y660-Y664 AromaticContact CE1-CE2 3.75Å; Y660-Y664 HydrophobicContact CE1-CE2 3.75Å; Y660-Y664 HydrophobicContact CE2-CE2 4.04Å; Y660-Y664 AromaticContact CZ-CE2 3.6Å; Y660-Y664 PolarHBondContact OH-OH 3.37Å; A661-Y664 PolarHBondContact O-N 2.89Å; A661-Y664 VanDerWaalsContact O-N 3.16Å; P662-Y664 PolarHBondContact O-N 2.82Å
665	V	90.7	Very high	92.3	Very high	131 Å²	131	39.3 Å²	39.3	79%	0.794	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.3	-12.3	-178.6	-170.5	0	0	0	0	111.6	P662 F663 G667	P662-V665 PolarHBondContact O-N 2.95Å; F663-V665 VanDerWaalsContact C-N 3.26Å; F663-V665 PolarHBondContact O-N 3.18Å; V665-G667 PolarHBondContact O-N 3.49Å
666	M	86.4	Confident	92.3	Very high	67 Å²	67	39.3 Å²	39.3	33%	0.33	22%	0.217	S	C	.	.			trans	-81.3	97	-176.7	-74.7	-170.3	-177.6	0	0	112.9	F258 P662 F663 R668	F258-M666 HydrophobicContact CZ-CE 3.79Å; P662-M666 HydrophobicContact CB-CE 4.37Å; P662-M666 WeakPolarHBondContact O-CG 3.2Å; P662-M666 PolarHBondContact O-N 2.88Å; F663-M666 HydrophobicContact CD1-SD 3.63Å; F663-M666 HydrophobicContact CE1-SD 3.85Å; M666-R668 HydrophobicContact CB-CG 4.28Å; M666-R668 PolarHBondContact O-N 3.13Å
667	G	78.9	Confident	92.2	Very high	71 Å²	71	38 Å²	38	73%	0.732	21%	0.213	S	C	*	.			trans	-72.1	50	173.3	0	0	0	0	0	115.5	V665	V665-G667 PolarHBondContact O-N 3.49Å
668	R	84.4	Confident	92.2	Very high	40 Å²	40	34.5 Å²	34.5	15%	0.151	20%	0.195	C	C	.	.	S	Bend	trans	-129.8	175.5	176.9	69	172.2	-165.1	151.7	15.4	110.7	N562 L565 M666 L670 H674	N562-R668 WeakPolarHBondContact OD1-CD 3.49Å; N562-R668 PolarHBondContact OD1-NH1 2.83Å; L565-R668 CarbonylContact O-C 3.21Å; L565-R668 VanDerWaalsContact O-CA 3.31Å; L565-R668 WeakPolarHBondContact O-CA 3.4Å; L565-R668 WeakPolarHBondContact O-CB 3.38Å; M666-R668 HydrophobicContact CB-CG 4.28Å; M666-R668 PolarHBondContact O-N 3.13Å; R668-L670 HydrophobicContact CG-CD2 4.28Å; R668-H674 PolarHBondContact NH2-CD2 3.18Å; R668-H674 PolarHBondContact NH2-NE2 3.44Å
669	V	86.1	Confident	92.2	Very high	25 Å²	25	33.2 Å²	33.2	15%	0.152	19%	0.188	C	C	.	.			trans	-59.1	135.6	169.8	172.7	0	0	0	0	111.2	L565 P567 N573 Y671	L565-V669 PolarHBondContact O-N 2.82Å; P567-V669 HydrophobicContact CB-CG2 4.11Å; N573-V669 WeakPolarHBondContact OD1-CG1 3.28Å; V669-Y671 HydrophobicContact CG1-CD2 4.16Å; V669-Y671 HydrophobicContact CG1-CE1 4.12Å; V669-Y671 HydrophobicContact CG1-CE2 3.44Å; V669-Y671 VanDerWaalsContact CG1-CE2 3.44Å; V669-Y671 VanDerWaalsContact CG1-CZ 3.41Å; V669-Y671 WeakPolarHBondContact CG1-OH 3.5Å
670	L	88.8	Confident	92.2	Very high	11 Å²	11	33.2 Å²	33.2	6%	0.058	19%	0.188	C	C	.	.			trans	-136.1	142.4	178.7	-62.6	174.2	0	0	0	111.5	S574 P576 W579 F663 R668	S574-L670 PolarHBondContact N-O 2.83Å; S574-L670 PolarHBondContact OG-O 3.36Å; P576-L670 HydrophobicContact CG-CD1 4.09Å; W579-L670 HydrophobicContact CH2-CB 4.37Å; W579-L670 HydrophobicContact CH2-CD1 4.28Å; W579-L670 HydrophobicContact CZ2-CB 4Å; F663-L670 HydrophobicContact CB-CD1 4.32Å; F663-L670 HydrophobicContact CD1-CD2 3.74Å; F663-L670 HydrophobicContact CE1-CD2 4.25Å; F663-L670 WeakPolarHBondContact O-CD1 3.48Å; R668-L670 HydrophobicContact CG-CD2 4.28Å
671	Y	89.4	Confident	92.3	Very high	75 Å²	75	32.5 Å²	32.5	29%	0.294	19%	0.185	S	C	.	.			trans	-131.4	151.5	-176.6	-64.1	-61.3	0	0	0	111.3	W94 S574 V669 H673 H674	W94-Y671 HydrophobicContact CH2-CD2 4.24Å; W94-Y671 HydrophobicContact CH2-CG 4.46Å; W94-Y671 HydrophobicContact CZ2-CD2 4.01Å; W94-Y671 HydrophobicContact CZ2-CE2 4.24Å; W94-Y671 HydrophobicContact CZ2-CG 4.22Å; S574-Y671 VanDerWaalsContact OG-C 3.22Å; S574-Y671 WeakPolarHBondContact OG-CA 3.36Å; V669-Y671 HydrophobicContact CG1-CD2 4.16Å; V669-Y671 HydrophobicContact CG1-CE1 4.12Å; V669-Y671 HydrophobicContact CG1-CE2 3.44Å; V669-Y671 VanDerWaalsContact CG1-CE2 3.44Å; V669-Y671 VanDerWaalsContact CG1-CZ 3.41Å; V669-Y671 WeakPolarHBondContact CG1-OH 3.5Å; Y671-H673 PolarHBondContact O-N 2.84Å; Y671-H674 PolarHBondContact N-ND1 3.28Å; Y671-H674 WeakPolarHBondContact O-CB 3.23Å; Y671-H674 PolarHBondContact O-N 2.89Å; Y671-H674 PolarHBondContact O-ND1 2.69Å
672	Y	90.9	Very high	92.4	Very high	3 Å²	3	30.3 Å²	30.3	1%	0.012	17%	0.166	C	C	.	.	G	3₁₀ helix	trans	-47.8	-33.6	-178.1	178.3	-98.6	0	0	0	114.6	S574 W579 N582 Q584 L600 G602 W607 H674 Y675 F676	S574-Y672 PolarHBondContact OG-N 3.02Å; S574-Y672 VanDerWaalsContact OG-N 3.07Å; W579-Y672 HydrophobicContact CB-CD2 4.44Å; W579-Y672 AromaticContact CD1-CD2 3.94Å; W579-Y672 HydrophobicContact CG-CD2 4.47Å; N582-Y672 PolarHBondContact OD1-OH 2.79Å; Q584-Y672 WeakPolarHBondContact O-CD2 3.4Å; L600-Y672 HydrophobicContact CD2-CD1 3.83Å; L600-Y672 HydrophobicContact CD2-CE1 4.32Å; L600-Y672 HydrophobicContact CG-CD1 3.93Å; L600-Y672 HydrophobicContact CG-CE1 3.99Å; G602-Y672 PolarHBondContact N-OH 3.29Å; W607-Y672 HydrophobicContact CH2-CE1 4.1Å; W607-Y672 AromaticContact CH2-CE2 3.92Å; W607-Y672 HydrophobicContact CH2-CE2 3.92Å; W607-Y672 AromaticContact CH2-CZ 3.46Å; W607-Y672 VanDerWaalsContact CH2-CZ 3.46Å; W607-Y672 WeakPolarHBondContact CH2-OH 3.31Å; W607-Y672 WeakPolarHBondContact CZ2-OH 3.44Å; W607-Y672 AromaticContact CZ3-CE2 3.74Å; W607-Y672 HydrophobicContact CZ3-CE2 3.74Å; W607-Y672 AromaticContact CZ3-CZ 3.7Å; W607-Y672 WeakPolarHBondContact CZ3-OH 3.28Å; Y672-H674 PolarHBondContact O-N 3.26Å; Y672-H674 VanDerWaalsContact O-N 3.08Å; Y672-Y675 PolarHBondContact O-N 3.12Å; Y672-F676 AromaticContact CD1-CE2 3.76Å; Y672-F676 HydrophobicContact CD1-CE2 3.76Å; Y672-F676 HydrophobicContact CD1-CZ 4.42Å; Y672-F676 AromaticContact CE1-CE2 3.5Å; Y672-F676 HydrophobicContact CE1-CE2 3.5Å; Y672-F676 AromaticContact CE1-CZ 3.75Å; Y672-F676 HydrophobicContact CE1-CZ 3.75Å
673	H	92.9	Very high	92.5	Very high	7 Å²	7	28.5 Å²	28.5	3%	0.032	16%	0.155	C	C	.	.	G	3₁₀ helix	trans	-57.6	-24.7	176.4	77.5	-112	0	0	0	114.2	W94 I199 D206 K253 L600 Y671 Y675 F676	W94-H673 AromaticContact CH2-CE1 3.6Å; W94-H673 AromaticContact CH2-ND1 3.28Å; W94-H673 VanDerWaalsContact CH2-ND1 3.28Å; W94-H673 WeakPolarHBondContact CH2-ND1 3.02Å; W94-H673 AromaticContact CZ3-ND1 3.58Å; I199-H673 HydrophobicContact CD1-CB 3.85Å; D206-H673 IonicContact OD1-CD2 2.62Å; D206-H673 PolarHBondContact OD1-CD2 2.82Å; D206-H673 IonicContact OD2-CD2 2.7Å; K253-H673 PolarHBondContact NZ-NE2 2.95Å; L600-H673 HydrophobicContact CD2-CB 4.38Å; Y671-H673 PolarHBondContact O-N 2.84Å; H673-Y675 PolarHBondContact O-N 2.84Å; H673-F676 WeakPolarHBondContact O-CD2 3.49Å; H673-F676 PolarHBondContact O-N 2.88Å
674	H	93.9	Very high	92.7	Very high	18 Å²	18	28.3 Å²	28.3	8%	0.083	15%	0.154	C	C	.	.	G	3₁₀ helix	trans	-64.1	-23	-179	-72.7	80.5	0	0	0	113.5	W579 F663 R668 Y671 Y672	W579-H674 HydrophobicContact CH2-CB 3.99Å; W579-H674 HydrophobicContact CZ2-CB 4.4Å; W579-H674 HydrophobicContact CZ3-CB 4.33Å; F663-H674 HydrophobicContact CE1-CB 4.22Å; F663-H674 AromaticContact CE1-CD2 3.54Å; F663-H674 HydrophobicContact CE2-CB 4.14Å; F663-H674 HydrophobicContact CZ-CB 3.91Å; F663-H674 AromaticContact CZ-CD2 3.76Å; R668-H674 PolarHBondContact NH2-CD2 3.18Å; R668-H674 PolarHBondContact NH2-NE2 3.44Å; Y671-H674 PolarHBondContact N-ND1 3.28Å; Y671-H674 WeakPolarHBondContact O-CB 3.23Å; Y671-H674 PolarHBondContact O-N 2.89Å; Y671-H674 PolarHBondContact O-ND1 2.69Å; Y672-H674 PolarHBondContact O-N 3.26Å; Y672-H674 VanDerWaalsContact O-N 3.08Å
675	Y	96.1	Very high	93	Very high	8 Å²	8	22.2 Å²	22.2	3%	0.031	13%	0.13	C	C	.	.	G	3₁₀ helix	trans	-79.5	-19.1	-179.7	-172.2	-115	0	0	0	113.8	W579 P580 W607 W656 Y660 Y672 H673 A678 M679	W579-Y675 HydrophobicContact CB-CD1 4Å; W579-Y675 HydrophobicContact CB-CD2 4.14Å; W579-Y675 HydrophobicContact CB-CG 3.65Å; W579-Y675 AromaticContact CE3-CD2 3.99Å; W579-Y675 HydrophobicContact CE3-CD2 3.99Å; W579-Y675 HydrophobicContact CE3-CG 4.17Å; W579-Y675 HydrophobicContact CG-CG 4.43Å; P580-Y675 HydrophobicContact CG-CE1 4.49Å; P580-Y675 HydrophobicContact CG-CE2 3.92Å; W607-Y675 HydrophobicContact CE3-CD1 4.28Å; W607-Y675 HydrophobicContact CE3-CE1 4.18Å; W607-Y675 AromaticContact CH2-CD1 3.67Å; W607-Y675 HydrophobicContact CH2-CD1 3.67Å; W607-Y675 HydrophobicContact CH2-CE1 4.28Å; W607-Y675 AromaticContact CZ3-CD1 3.4Å; W607-Y675 HydrophobicContact CZ3-CD1 3.4Å; W607-Y675 VanDerWaalsContact CZ3-CD1 3.4Å; W607-Y675 AromaticContact CZ3-CE1 3.74Å; W607-Y675 HydrophobicContact CZ3-CE1 3.74Å; W656-Y675 AromaticContact NE1-CE2 3.75Å; W656-Y675 AromaticContact NE1-CZ 3.72Å; W656-Y675 PolarHBondContact NE1-OH 3.03Å; Y660-Y675 AromaticContact CD2-CD2 3.55Å; Y660-Y675 HydrophobicContact CD2-CD2 3.55Å; Y660-Y675 AromaticContact CD2-CE2 3.63Å; Y660-Y675 HydrophobicContact CD2-CE2 3.63Å; Y660-Y675 AromaticContact CE2-CD2 3.83Å; Y660-Y675 HydrophobicContact CE2-CD2 3.83Å; Y660-Y675 AromaticContact CE2-CE2 3.87Å; Y660-Y675 HydrophobicContact CE2-CE2 3.87Å; Y660-Y675 HydrophobicContact CG-CD2 4.29Å; Y660-Y675 AromaticContact CG-CE2 4Å; Y660-Y675 HydrophobicContact CG-CE2 4Å; Y672-Y675 PolarHBondContact O-N 3.12Å; H673-Y675 PolarHBondContact O-N 2.84Å; Y675-A678 HydrophobicContact CD2-CB 3.92Å; Y675-A678 HydrophobicContact CE2-CB 3.86Å; Y675-A678 CarbonylContact O-C 3.57Å; Y675-A678 WeakPolarHBondContact O-CA 3.46Å; Y675-A678 WeakPolarHBondContact O-CB 3.37Å; Y675-A678 PolarHBondContact O-N 2.82Å; Y675-M679 HydrophobicContact CD1-CB 3.92Å; Y675-M679 HydrophobicContact CE1-CB 3.86Å; Y675-M679 HydrophobicContact CE1-CG 4.28Å; Y675-M679 PolarHBondContact O-N 2.8Å
676	F	96.4	Very high	93.3	Very high	0 Å²	0	16 Å²	16	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-57.6	-41.9	-171.2	-82	-96.7	0	0	0	114.6	I199 M210 L600 W607 Y672 H673 A678 M679 L680	I199-F676 HydrophobicContact CG2-CD1 4.04Å; I199-F676 HydrophobicContact CG2-CE1 4.26Å; M210-F676 HydrophobicContact CE-CB 4.43Å; M210-F676 HydrophobicContact SD-CB 3.67Å; L600-F676 HydrophobicContact CD1-CE2 4.3Å; L600-F676 HydrophobicContact CD1-CZ 3.91Å; L600-F676 HydrophobicContact CD2-CE2 4.27Å; L600-F676 HydrophobicContact CG-CZ 4.47Å; W607-F676 HydrophobicContact CH2-CE1 4.44Å; W607-F676 HydrophobicContact CH2-CE2 4.08Å; W607-F676 AromaticContact CH2-CZ 4Å; W607-F676 HydrophobicContact CH2-CZ 4Å; W607-F676 AromaticContact CZ2-CE1 3.84Å; W607-F676 HydrophobicContact CZ2-CE1 3.84Å; W607-F676 HydrophobicContact CZ2-CE2 4.24Å; W607-F676 AromaticContact CZ2-CZ 3.7Å; W607-F676 HydrophobicContact CZ2-CZ 3.7Å; Y672-F676 AromaticContact CD1-CE2 3.76Å; Y672-F676 HydrophobicContact CD1-CE2 3.76Å; Y672-F676 HydrophobicContact CD1-CZ 4.42Å; Y672-F676 AromaticContact CE1-CE2 3.5Å; Y672-F676 HydrophobicContact CE1-CE2 3.5Å; Y672-F676 AromaticContact CE1-CZ 3.75Å; Y672-F676 HydrophobicContact CE1-CZ 3.75Å; H673-F676 WeakPolarHBondContact O-CD2 3.49Å; H673-F676 PolarHBondContact O-N 2.88Å; F676-A678 VanDerWaalsContact C-N 3.27Å; F676-A678 PolarHBondContact O-N 3.29Å; F676-M679 HydrophobicContact CD1-CE 3.73Å; F676-M679 HydrophobicContact CE1-CE 3.83Å; F676-M679 WeakPolarHBondContact O-CB 3.42Å; F676-M679 PolarHBondContact O-N 2.88Å; F676-M679 VanDerWaalsContact O-N 3.12Å; F676-L680 WeakPolarHBondContact O-CG 3.47Å; F676-L680 PolarHBondContact O-N 3.47Å
677	P	96.9	Very high	93.8	Very high	3 Å²	3	12.9 Å²	12.9	2%	0.019	8%	0.077	C	C	.	.	H	α-helix	trans	-55.9	-38.8	171.5	-27.2	36	0	0	0	113.6	M210 I213 H659 F681	M210-P677 HydrophobicContact CG-CG 4.13Å; I213-P677 HydrophobicContact CD1-CB 4.01Å; I213-P677 HydrophobicContact CD1-CG 4.27Å; H659-P677 HydrophobicContact CB-CB 4.41Å; P677-F681 WeakPolarHBondContact O-CD2 3.48Å
678	A	97.3	Very high	94.6	Very high	0 Å²	0	9.5 Å²	9.5	0%	0	4%	0.042	C	C	.	.	H	α-helix	trans	-71.7	-40.2	174.5	0	0	0	0	0	111.8	H659 Y675 F676 L680 F681 S682	H659-A678 HydrophobicContact CB-CB 3.94Å; Y675-A678 HydrophobicContact CD2-CB 3.92Å; Y675-A678 HydrophobicContact CE2-CB 3.86Å; Y675-A678 CarbonylContact O-C 3.57Å; Y675-A678 WeakPolarHBondContact O-CA 3.46Å; Y675-A678 WeakPolarHBondContact O-CB 3.37Å; Y675-A678 PolarHBondContact O-N 2.82Å; F676-A678 VanDerWaalsContact C-N 3.27Å; F676-A678 PolarHBondContact O-N 3.29Å; A678-L680 PolarHBondContact O-N 2.85Å; A678-F681 WeakPolarHBondContact O-CB 3.26Å; A678-F681 PolarHBondContact O-N 3.25Å; A678-S682 PolarHBondContact O-N 2.92Å
679	M	96.6	Very high	95.1	Very high	1 Å²	1	7.6 Å²	7.6	1%	0.005	4%	0.035	C	C	.	.	H	α-helix	trans	-58	-35.1	177.4	-170.5	-82.8	-77.3	0	0	112.5	L190 D193 C196 W607 Y675 F676 S682 S683	L190-M679 HydrophobicContact CD2-CE 4.35Å; L190-M679 HydrophobicContact CD2-SD 3.95Å; D193-M679 WeakPolarHBondContact OD2-CE 3.44Å; C196-M679 HydrophobicContact CB-CE 4.15Å; W607-M679 HydrophobicContact CD2-CG 4.35Å; W607-M679 HydrophobicContact CH2-CG 4.24Å; W607-M679 HydrophobicContact CZ2-CB 4.41Å; W607-M679 HydrophobicContact CZ2-CE 3.94Å; W607-M679 HydrophobicContact CZ2-CG 3.75Å; Y675-M679 HydrophobicContact CD1-CB 3.92Å; Y675-M679 HydrophobicContact CE1-CB 3.86Å; Y675-M679 HydrophobicContact CE1-CG 4.28Å; Y675-M679 PolarHBondContact O-N 2.8Å; F676-M679 HydrophobicContact CD1-CE 3.73Å; F676-M679 HydrophobicContact CE1-CE 3.83Å; F676-M679 WeakPolarHBondContact O-CB 3.42Å; F676-M679 PolarHBondContact O-N 2.88Å; F676-M679 VanDerWaalsContact O-N 3.12Å; M679-S682 PolarHBondContact O-N 3.46Å; M679-S683 WeakPolarHBondContact O-CB 3.35Å; M679-S683 PolarHBondContact O-N 3.32Å; M679-S683 PolarHBondContact O-OG 2.91Å; M679-S683 PolarHBondContact SD-OG 2.94Å
680	L	97.7	Very high	95.6	Very high	1 Å²	1	7.7 Å²	7.7	1%	0.005	4%	0.035	C	C	.	.	H	α-helix	trans	-59.5	-48.2	171.7	-64.5	176.3	0	0	0	112	L165 L190 M210 M214 F676 A678 S682 S683 M684	L165-L680 HydrophobicContact CB-CD2 4.48Å; L165-L680 HydrophobicContact CD2-CD1 4.42Å; L190-L680 HydrophobicContact CD1-CD2 3.95Å; L190-L680 HydrophobicContact CD2-CD2 3.72Å; L190-L680 HydrophobicContact CG-CD2 4.47Å; M210-L680 HydrophobicContact CB-CD1 3.99Å; M210-L680 HydrophobicContact CG-CD1 4Å; M210-L680 HydrophobicContact SD-CD1 3.82Å; M210-L680 HydrophobicContact SD-CG 4.43Å; M214-L680 HydrophobicContact CG-CD1 3.74Å; M214-L680 HydrophobicContact SD-CB 4.06Å; M214-L680 HydrophobicContact SD-CD1 3.95Å; F676-L680 WeakPolarHBondContact O-CG 3.47Å; F676-L680 PolarHBondContact O-N 3.47Å; A678-L680 PolarHBondContact O-N 2.85Å; L680-S682 VanDerWaalsContact C-N 3.34Å; L680-S682 PolarHBondContact O-N 2.78Å; L680-S683 PolarHBondContact O-N 2.95Å; L680-M684 WeakPolarHBondContact O-CG 3.49Å; L680-M684 PolarHBondContact O-N 2.56Å
681	F	98.2	Very high	95.8	Very high	2 Å²	2	7.3 Å²	7.3	1%	0.009	3%	0.033	C	C	.	.	H	α-helix	trans	-62.9	-39.4	174.6	-68.6	-75.4	0	0	0	112.5	I213 V217 L262 L652 W656 H659 P677 A678 M684 L685	I213-F681 HydrophobicContact CG2-CE2 4.25Å; I213-F681 HydrophobicContact CG2-CZ 4.27Å; V217-F681 HydrophobicContact CG1-CE1 4.37Å; V217-F681 HydrophobicContact CG2-CE1 3.86Å; V217-F681 HydrophobicContact CG2-CZ 3.77Å; L262-F681 HydrophobicContact CD2-CE1 3.74Å; L262-F681 HydrophobicContact CD2-CZ 3.69Å; L652-F681 HydrophobicContact CD2-CD1 4.16Å; W656-F681 HydrophobicContact CB-CB 3.99Å; H659-F681 AromaticContact CE1-CE2 3.5Å; H659-F681 AromaticContact CE1-CZ 3.9Å; H659-F681 AromaticContact CG-CE2 3.93Å; H659-F681 AromaticContact ND1-CD2 3.98Å; H659-F681 AromaticContact ND1-CE2 3.35Å; H659-F681 VanDerWaalsContact ND1-CE2 3.35Å; H659-F681 WeakPolarHBondContact ND1-CE2 3.32Å; P677-F681 WeakPolarHBondContact O-CD2 3.48Å; A678-F681 WeakPolarHBondContact O-CB 3.26Å; A678-F681 PolarHBondContact O-N 3.25Å; F681-M684 HydrophobicContact CD1-CE 3.74Å; F681-M684 HydrophobicContact CE1-CE 4.19Å; F681-M684 HydrophobicContact CG-CE 4.27Å; F681-M684 PolarHBondContact O-N 2.86Å; F681-L685 WeakPolarHBondContact O-CB 3.3Å; F681-L685 PolarHBondContact O-N 3.46Å
682	S	97.4	Very high	95.9	Very high	3 Å²	3	4.1 Å²	4.1	2%	0.021	2%	0.021	C	C	.	.	H	α-helix	trans	-62.4	-42.3	176.2	-172.7	0	0	0	0	111.7	A678 M679 L680 L685 T686	A678-S682 PolarHBondContact O-N 2.92Å; M679-S682 PolarHBondContact O-N 3.46Å; L680-S682 VanDerWaalsContact C-N 3.34Å; L680-S682 PolarHBondContact O-N 2.78Å; S682-L685 WeakPolarHBondContact O-CB 3.48Å; S682-L685 PolarHBondContact O-N 3.49Å; S682-T686 PolarHBondContact O-N 3.26Å; S682-T686 PolarHBondContact O-OG1 2.9Å
683	S	97.8	Very high	96	Very high	0 Å²	0	7.8 Å²	7.8	0%	0	4%	0.04	C	C	.	.	H	α-helix	trans	-69.5	-35.2	179	-55.4	0	0	0	0	112.9	N610 M679 L680 G687	N610-S683 PolarHBondContact ND2-OG 3.28Å; N610-S683 WeakPolarHBondContact OD1-CA 3.5Å; M679-S683 WeakPolarHBondContact O-CB 3.35Å; M679-S683 PolarHBondContact O-N 3.32Å; M679-S683 PolarHBondContact O-OG 2.91Å; M679-S683 PolarHBondContact SD-OG 2.94Å; L680-S683 PolarHBondContact O-N 2.95Å; S683-G687 PolarHBondContact O-N 2.88Å
684	M	98.1	Very high	95.8	Very high	0 Å²	0	9 Å²	9	0%	0	5%	0.047	C	C	.	.	H	α-helix	trans	-64.3	-43.5	169.6	-71.1	-170.3	-75.7	0	0	111.5	A169 I172 V173 T186 M214 L652 L680 F681 T686 G687 V688	A169-M684 HydrophobicContact CB-CG 3.97Å; A169-M684 HydrophobicContact CB-SD 4.12Å; I172-M684 HydrophobicContact CB-SD 3.86Å; I172-M684 HydrophobicContact CD1-CE 4.46Å; I172-M684 HydrophobicContact CD1-SD 3.95Å; I172-M684 HydrophobicContact CG2-SD 3.57Å; I172-M684 VanDerWaalsContact CG2-SD 3.57Å; V173-M684 HydrophobicContact CG2-CB 3.57Å; V173-M684 HydrophobicContact CG2-CG 3.69Å; V173-M684 HydrophobicContact CG2-SD 4.28Å; T186-M684 HydrophobicContact CG2-CB 4.34Å; T186-M684 HydrophobicContact CG2-CG 3.76Å; M214-M684 HydrophobicContact CE-CE 3.83Å; M214-M684 HydrophobicContact CE-SD 3.88Å; M214-M684 HydrophobicContact SD-CE 3.8Å; L652-M684 HydrophobicContact CD1-CB 3.9Å; L652-M684 HydrophobicContact CD2-CB 3.75Å; L652-M684 HydrophobicContact CD2-CE 3.88Å; L652-M684 HydrophobicContact CD2-CG 4.5Å; L652-M684 HydrophobicContact CD2-SD 4.05Å; L652-M684 HydrophobicContact CG-CB 4.42Å; L680-M684 WeakPolarHBondContact O-CG 3.49Å; L680-M684 PolarHBondContact O-N 2.56Å; F681-M684 HydrophobicContact CD1-CE 3.74Å; F681-M684 HydrophobicContact CE1-CE 4.19Å; F681-M684 HydrophobicContact CG-CE 4.27Å; F681-M684 PolarHBondContact O-N 2.86Å; M684-T686 VanDerWaalsContact C-N 3.35Å; M684-T686 PolarHBondContact O-N 2.85Å; M684-G687 PolarHBondContact O-N 2.6Å; M684-V688 WeakPolarHBondContact O-CG2 3.49Å; M684-V688 PolarHBondContact O-N 2.82Å
685	L	97.8	Very high	95.5	Very high	1 Å²	1	11.7 Å²	11.7	1%	0.005	6%	0.056	C	C	.	.	H	α-helix	trans	-63.8	-39.8	178.1	-173.4	61.9	0	0	0	111.8	L614 Y617 L652 L653 F681 S682 V688 T689	L614-L685 HydrophobicContact CD1-CD2 3.78Å; Y617-L685 HydrophobicContact CD1-CD1 4.31Å; Y617-L685 HydrophobicContact CD1-CD2 4.1Å; Y617-L685 HydrophobicContact CD2-CD1 3.58Å; Y617-L685 HydrophobicContact CD2-CG 4.26Å; Y617-L685 HydrophobicContact CE1-CD1 4.39Å; Y617-L685 HydrophobicContact CE2-CD1 3.66Å; Y617-L685 HydrophobicContact CG-CD1 3.93Å; Y617-L685 HydrophobicContact CG-CD2 4.14Å; Y617-L685 HydrophobicContact CG-CG 4.19Å; L652-L685 HydrophobicContact CB-CB 4.25Å; L652-L685 HydrophobicContact CB-CD1 4.17Å; L653-L685 HydrophobicContact CB-CD2 4.25Å; L653-L685 HydrophobicContact CD1-CD2 4.45Å; F681-L685 WeakPolarHBondContact O-CB 3.3Å; F681-L685 PolarHBondContact O-N 3.46Å; S682-L685 WeakPolarHBondContact O-CB 3.48Å; S682-L685 PolarHBondContact O-N 3.49Å; L685-V688 PolarHBondContact O-N 2.79Å; L685-T689 VanDerWaalsContact O-CB 3.31Å; L685-T689 WeakPolarHBondContact O-CB 3.48Å; L685-T689 PolarHBondContact O-N 2.82Å; L685-T689 PolarHBondContact O-OG1 3.4Å
686	T	97.5	Very high	95.1	Very high	1 Å²	1	12.8 Å²	12.8	1%	0.006	6%	0.062	C	C	.	.	H	α-helix	trans	-56.7	-49.9	173.1	-64.2	0	0	0	0	112.2	L189 I609 N610 S682 M684 V688 T689 L690	L189-T686 HydrophobicContact CD1-CG2 3.53Å; I609-T686 HydrophobicContact CG2-CG2 3.89Å; N610-T686 WeakPolarHBondContact CA-OG1 3.5Å; N610-T686 VanDerWaalsContact OD1-CB 3.3Å; N610-T686 WeakPolarHBondContact OD1-CB 3.15Å; N610-T686 PolarHBondContact OD1-OG1 3.2Å; S682-T686 PolarHBondContact O-N 3.26Å; S682-T686 PolarHBondContact O-OG1 2.9Å; M684-T686 VanDerWaalsContact C-N 3.35Å; M684-T686 PolarHBondContact O-N 2.85Å; T686-V688 PolarHBondContact O-N 3.42Å; T686-T689 PolarHBondContact O-N 2.93Å; T686-L690 HydrophobicContact CG2-CD1 3.59Å; T686-L690 HydrophobicContact CG2-CG 4.14Å; T686-L690 WeakPolarHBondContact O-CB 3.5Å; T686-L690 WeakPolarHBondContact O-CG 3.42Å; T686-L690 PolarHBondContact O-N 2.86Å
687	G	96.5	Very high	94.4	Very high	0 Å²	0	13.2 Å²	13.2	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-60.6	-42	179.9	0	0	0	0	0	113.1	A182 S683 M684 D691	A182-G687 WeakPolarHBondContact CB-O 3.15Å; S683-G687 PolarHBondContact O-N 2.88Å; M684-G687 PolarHBondContact O-N 2.6Å; G687-D691 VanDerWaalsContact O-CB 3.27Å; G687-D691 WeakPolarHBondContact O-CB 3.38Å; G687-D691 PolarHBondContact O-N 2.86Å
688	V	96	Very high	93.6	Very high	1 Å²	1	15.5 Å²	15.5	1%	0.006	8%	0.078	C	C	.	.	H	α-helix	trans	-63.6	-46.4	173.6	178.3	0	0	0	0	111.2	V173 I644 L652 M684 L685 T686 T692	V173-V688 HydrophobicContact CG1-CG2 3.86Å; V173-V688 HydrophobicContact CG2-CG2 4.43Å; I644-V688 HydrophobicContact CG2-CG1 3.88Å; L652-V688 HydrophobicContact CD1-CG2 4.03Å; M684-V688 WeakPolarHBondContact O-CG2 3.49Å; M684-V688 PolarHBondContact O-N 2.82Å; L685-V688 PolarHBondContact O-N 2.79Å; T686-V688 PolarHBondContact O-N 3.42Å; V688-T692 VanDerWaalsContact O-CB 3.23Å; V688-T692 WeakPolarHBondContact O-CB 3.32Å; V688-T692 PolarHBondContact O-N 3.01Å; V688-T692 PolarHBondContact O-OG1 3.32Å
689	T	95.7	Very high	92.7	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-68.1	-48	-173.9	-55.4	0	0	0	0	111.9	L616 M620 L685 T686 T692 L693	L616-T689 HydrophobicContact CB-CG2 4.43Å; L616-T689 HydrophobicContact CD2-CG2 3.84Å; L616-T689 HydrophobicContact CG-CG2 3.89Å; M620-T689 HydrophobicContact SD-CG2 3.72Å; L685-T689 VanDerWaalsContact O-CB 3.31Å; L685-T689 WeakPolarHBondContact O-CB 3.48Å; L685-T689 PolarHBondContact O-N 2.82Å; L685-T689 PolarHBondContact O-OG1 3.4Å; T686-T689 PolarHBondContact O-N 2.93Å; T689-T692 PolarHBondContact O-N 3.36Å; T689-L693 WeakPolarHBondContact O-CB 3.33Å; T689-L693 PolarHBondContact O-N 2.95Å
690	L	94.8	Very high	91.9	Very high	27 Å²	27	27.9 Å²	27.9	14%	0.141	14%	0.143	C	C	.	.	H	α-helix	trans	-68.8	-39.4	-178.8	-65.2	179.4	0	0	0	112.3	I609 L616 T686 L693 L694 L717	I609-L690 HydrophobicContact CG2-CD1 4.04Å; L616-L690 HydrophobicContact CD2-CD2 4.2Å; T686-L690 HydrophobicContact CG2-CD1 3.59Å; T686-L690 HydrophobicContact CG2-CG 4.14Å; T686-L690 WeakPolarHBondContact O-CB 3.5Å; T686-L690 WeakPolarHBondContact O-CG 3.42Å; T686-L690 PolarHBondContact O-N 2.86Å; L690-L693 PolarHBondContact O-N 3.08Å; L690-L694 WeakPolarHBondContact O-CG 3.39Å; L690-L694 PolarHBondContact O-N 2.86Å; L690-L717 HydrophobicContact CD1-CD1 4.45Å; L690-L717 HydrophobicContact CD1-CD2 3.74Å
691	D	93.8	Very high	91.2	Very high	3 Å²	3	31.3 Å²	31.3	2%	0.016	16%	0.161	C	C	.	.	H	α-helix	trans	-67.5	-39	175.1	-168.6	59.6	0	0	0	111.5	S179 T181 A182 I185 G687 L694 R695 Q714	S179-D691 WeakPolarHBondContact CB-OD2 3.33Å; S179-D691 PolarHBondContact OG-OD2 3.24Å; T181-D691 VanDerWaalsContact CB-OD1 3.26Å; T181-D691 WeakPolarHBondContact CB-OD1 3.41Å; T181-D691 PolarHBondContact OG1-OD1 3.07Å; T181-D691 PolarHBondContact OG1-OD2 2.97Å; A182-D691 HydrophobicContact CB-CB 3.7Å; I185-D691 HydrophobicContact CD1-CB 4.36Å; G687-D691 VanDerWaalsContact O-CB 3.27Å; G687-D691 WeakPolarHBondContact O-CB 3.38Å; G687-D691 PolarHBondContact O-N 2.86Å; D691-L694 PolarHBondContact O-N 3.24Å; D691-R695 VanDerWaalsContact O-CB 3.28Å; D691-R695 WeakPolarHBondContact O-CB 3.48Å; D691-R695 WeakPolarHBondContact O-CG 3.35Å; D691-R695 PolarHBondContact O-N 3.36Å; D691-R695 IonicContact OD1-NE 2.67Å; D691-R695 WeakPolarHBondContact OD2-CD 3.47Å; D691-R695 IonicContact OD2-CZ 3.8Å; D691-R695 IonicContact OD2-NE 3.57Å; D691-R695 PolarHBondContact OD2-NE 3.38Å; D691-R695 IonicContact OD2-NH2 3.64Å; D691-Q714 PolarHBondContact OD1-NE2 2.83Å; D691-Q714 VanDerWaalsContact OD1-NE2 3.08Å
692	T	92	Very high	90.4	Very high	7 Å²	7	36 Å²	36	4%	0.043	19%	0.193	C	C	.	.	H	α-helix	trans	-65.4	-38.1	174.1	-56.9	0	0	0	0	111.7	M620 H641 V688 T689 N696	M620-T692 HydrophobicContact CE-CG2 3.78Å; H641-T692 HydrophobicContact CB-CG2 4.08Å; V688-T692 VanDerWaalsContact O-CB 3.23Å; V688-T692 WeakPolarHBondContact O-CB 3.32Å; V688-T692 PolarHBondContact O-N 3.01Å; V688-T692 PolarHBondContact O-OG1 3.32Å; T689-T692 PolarHBondContact O-N 3.36Å; T692-N696 WeakPolarHBondContact O-CB 3.34Å; T692-N696 PolarHBondContact O-N 3.16Å; T692-N696 PolarHBondContact O-ND2 3.45Å
693	L	91.9	Very high	89.6	Confident	81 Å²	81	42.6 Å²	42.6	42%	0.424	22%	0.223	S	C	.	.	H	α-helix	trans	-62.1	-52.9	173.7	-178.9	70.3	0	0	0	110.8	L616 M620 T689 L690 R695 N696 A697	L616-L693 HydrophobicContact CD2-CD2 3.99Å; M620-L693 HydrophobicContact CE-CB 4.34Å; M620-L693 HydrophobicContact SD-CB 4.33Å; M620-L693 HydrophobicContact SD-CD1 4.41Å; T689-L693 WeakPolarHBondContact O-CB 3.33Å; T689-L693 PolarHBondContact O-N 2.95Å; L690-L693 PolarHBondContact O-N 3.08Å; L693-R695 VanDerWaalsContact C-N 3.33Å; L693-R695 PolarHBondContact O-N 2.91Å; L693-N696 CarbonylContact O-C 3.57Å; L693-N696 PolarHBondContact O-N 3.33Å; L693-N696 VanDerWaalsContact O-N 3.07Å; L693-A697 PolarHBondContact O-N 2.8Å
694	L	89.8	Confident	88.8	Confident	31 Å²	31	45.9 Å²	45.9	16%	0.162	25%	0.245	C	C	.	.	H	α-helix	trans	-65.4	-34	-177.4	-68	172.5	0	0	0	112.6	L690 D691 N696 A697 Q710 Q714	L690-L694 WeakPolarHBondContact O-CG 3.39Å; L690-L694 PolarHBondContact O-N 2.86Å; D691-L694 PolarHBondContact O-N 3.24Å; L694-N696 VanDerWaalsContact C-N 3.26Å; L694-N696 PolarHBondContact O-N 2.61Å; L694-A697 VanDerWaalsContact O-CB 3.31Å; L694-A697 WeakPolarHBondContact O-CB 3.42Å; L694-A697 PolarHBondContact O-N 2.99Å; L694-Q710 HydrophobicContact CB-CG 4.15Å; L694-Q714 HydrophobicContact CD1-CG 3.89Å
695	R	87.4	Confident	88.2	Confident	75 Å²	75	53.4 Å²	53.4	28%	0.283	27%	0.274	S	S	.	.	H	α-helix	trans	-70.5	-17.6	173.7	-73.4	172.4	177.7	-105.2	-4.4	114.2	S179 T181 K637 D691 L693	S179-R695 PolarHBondContact OG-NH2 2.41Å; T181-R695 PolarHBondContact OG1-NH2 3.27Å; K637-R695 VanDerWaalsContact CE-O 3.28Å; K637-R695 WeakPolarHBondContact CE-O 3.44Å; K637-R695 PolarHBondContact NZ-O 2.6Å; D691-R695 VanDerWaalsContact O-CB 3.28Å; D691-R695 WeakPolarHBondContact O-CB 3.48Å; D691-R695 WeakPolarHBondContact O-CG 3.35Å; D691-R695 PolarHBondContact O-N 3.36Å; D691-R695 IonicContact OD1-NE 2.67Å; D691-R695 WeakPolarHBondContact OD2-CD 3.47Å; D691-R695 IonicContact OD2-CZ 3.8Å; D691-R695 IonicContact OD2-NE 3.57Å; D691-R695 PolarHBondContact OD2-NE 3.38Å; D691-R695 IonicContact OD2-NH2 3.64Å; L693-R695 VanDerWaalsContact C-N 3.33Å; L693-R695 PolarHBondContact O-N 2.91Å
696	N	86.4	Confident	87.5	Confident	31 Å²	31	53.5 Å²	53.5	17%	0.166	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.2	9.2	175.5	-72.5	-51.1	0	0	0	112.9	H641 T692 L693 L694 D698 L699	H641-N696 PolarHBondContact ND1-ND2 2.72Å; H641-N696 PolarHBondContact ND1-OD1 2.95Å; T692-N696 WeakPolarHBondContact O-CB 3.34Å; T692-N696 PolarHBondContact O-N 3.16Å; T692-N696 PolarHBondContact O-ND2 3.45Å; L693-N696 CarbonylContact O-C 3.57Å; L693-N696 PolarHBondContact O-N 3.33Å; L693-N696 VanDerWaalsContact O-N 3.07Å; L694-N696 VanDerWaalsContact C-N 3.26Å; L694-N696 PolarHBondContact O-N 2.61Å; N696-D698 VanDerWaalsContact C-OD1 3.26Å; N696-D698 VanDerWaalsContact CA-OD1 3.3Å; N696-D698 WeakPolarHBondContact CA-OD1 3.47Å; N696-D698 PolarHBondContact O-N 3.02Å; N696-L699 HydrophobicContact CB-CD1 4.37Å; N696-L699 WeakPolarHBondContact O-CB 3.41Å; N696-L699 PolarHBondContact O-N 3.2Å; N696-L699 VanDerWaalsContact O-N 3.13Å
697	A	82.9	Confident	86.8	Confident	9 Å²	9	55.6 Å²	55.6	7%	0.074	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-64	-15.2	174.4	0	0	0	0	0	113.4	L693 L694 L699 L700 L701 L709	L693-A697 PolarHBondContact O-N 2.8Å; L694-A697 VanDerWaalsContact O-CB 3.31Å; L694-A697 WeakPolarHBondContact O-CB 3.42Å; L694-A697 PolarHBondContact O-N 2.99Å; A697-L699 PolarHBondContact O-N 3.32Å; A697-L700 PolarHBondContact O-N 2.09Å; A697-L701 PolarHBondContact O-N 3.12Å; A697-L709 HydrophobicContact CB-CD2 4.21Å
698	D	79.4	Confident	86.4	Confident	52 Å²	52	64 Å²	64	28%	0.278	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-65.4	-12.5	171.7	63	-22.1	0	0	0	113.7	K637 N696 L700 S706	K637-D698 VanDerWaalsContact NZ-CG 3.31Å; K637-D698 IonicContact NZ-OD1 3.88Å; K637-D698 IonicContact NZ-OD2 2.79Å; K637-D698 PolarHBondContact NZ-OD2 2.85Å; N696-D698 VanDerWaalsContact C-OD1 3.26Å; N696-D698 VanDerWaalsContact CA-OD1 3.3Å; N696-D698 WeakPolarHBondContact CA-OD1 3.47Å; N696-D698 PolarHBondContact O-N 3.02Å; D698-L700 VanDerWaalsContact C-N 3.33Å; D698-S706 PolarHBondContact N-OG 2.8Å
699	L	79.4	Confident	86	Confident	107 Å²	107	67.9 Å²	67.9	56%	0.56	34%	0.338	S	S	*	.	G	3₁₀ helix	trans	-75.6	-19.3	167.4	-68.1	173.5	0	0	0	113.7	N696 A697	N696-L699 HydrophobicContact CB-CD1 4.37Å; N696-L699 WeakPolarHBondContact O-CB 3.41Å; N696-L699 PolarHBondContact O-N 3.2Å; N696-L699 VanDerWaalsContact O-N 3.13Å; A697-L699 PolarHBondContact O-N 3.32Å
700	L	79.9	Confident	85.5	Confident	153 Å²	153	69.9 Å²	69.9	80%	0.801	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.8	-28.6	-175.3	-64.2	174.8	0	0	0	112.9	A697 D698	A697-L700 PolarHBondContact O-N 2.09Å; D698-L700 VanDerWaalsContact C-N 3.33Å
701	L	82.8	Confident	85.2	Confident	73 Å²	73	75 Å²	75	38%	0.382	37%	0.365	S	S	.	.	S	Bend	trans	-135.1	134.4	-175.6	-64.6	176.2	0	0	0	111.5	A697 S706 L709	A697-L701 PolarHBondContact O-N 3.12Å; L701-S706 WeakPolarHBondContact O-CB 3.47Å; L701-L709 HydrophobicContact CD1-CB 4.36Å; L701-L709 HydrophobicContact CD1-CD2 3.66Å
702	C	81.6	Confident	85	Confident	102 Å²	102	76.5 Å²	76.5	69%	0.689	38%	0.381	S	S	*	.			trans	-63.5	155.4	170	-61	0	0	0	0	111.6	Y705 S706	C702-Y705 WeakPolarHBondContact O-CB 3.28Å; C702-Y705 PolarHBondContact O-N 3.37Å; C702-S706 PolarHBondContact O-N 3.35Å
703	Q	79.4	Confident	84.9	Confident	140 Å²	140	77.3 Å²	77.3	65%	0.654	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	145.3	162.9	-66.1	-169.4	-59.6	0	0	109.9	D707	Q703-D707 PolarHBondContact NE2-OD1 2.92Å; Q703-D707 PolarHBondContact NE2-OD2 2.03Å; Q703-D707 VanDerWaalsContact NE2-OD2 3.17Å
704	P	82.1	Confident	84.8	Confident	69 Å²	69	74.7 Å²	74.7	45%	0.448	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	cis	-84.2	-5.6	5.1	35.1	-37.1	0	0	0	114.9	S706 D707 W708	P704-S706 PolarHBondContact O-N 2.9Å; P704-D707 PolarHBondContact O-N 2.84Å; P704-D707 VanDerWaalsContact O-N 3.16Å; P704-W708 PolarHBondContact O-N 3.09Å; P704-W708 VanDerWaalsContact O-N 3.15Å
705	Y	84.3	Confident	84.9	Confident	158 Å²	158	79.5 Å²	79.5	62%	0.62	40%	0.399	S	S	*	.	H	α-helix	trans	-62.9	-36	-171.6	-60.8	-82.2	0	0	0	113.7	C702 W708 L709	C702-Y705 WeakPolarHBondContact O-CB 3.28Å; C702-Y705 PolarHBondContact O-N 3.37Å; Y705-W708 PolarHBondContact O-N 3Å; Y705-L709 WeakPolarHBondContact O-CB 3.34Å; Y705-L709 PolarHBondContact O-N 2.87Å
706	S	82.9	Confident	85.2	Confident	4 Å²	4	80.3 Å²	80.3	3%	0.028	41%	0.413	C	S	.	.	H	α-helix	trans	-57.3	-48.7	172.1	173.8	0	0	0	0	112.3	D698 L701 C702 P704 W708 L709 Q710	D698-S706 PolarHBondContact N-OG 2.8Å; L701-S706 WeakPolarHBondContact O-CB 3.47Å; C702-S706 PolarHBondContact O-N 3.35Å; P704-S706 PolarHBondContact O-N 2.9Å; S706-W708 VanDerWaalsContact C-N 3.27Å; S706-W708 PolarHBondContact O-N 3.46Å; S706-L709 PolarHBondContact O-N 3.28Å; S706-Q710 PolarHBondContact O-N 3.06Å
707	D	83.4	Confident	85.6	Confident	44 Å²	44	80 Å²	80	24%	0.235	41%	0.411	C	S	.	.	H	α-helix	trans	-65.9	-32.4	-179	-55.5	9	0	0	0	112	Q703 P704 R711	Q703-D707 PolarHBondContact NE2-OD1 2.92Å; Q703-D707 PolarHBondContact NE2-OD2 2.03Å; Q703-D707 VanDerWaalsContact NE2-OD2 3.17Å; P704-D707 PolarHBondContact O-N 2.84Å; P704-D707 VanDerWaalsContact O-N 3.16Å; D707-R711 WeakPolarHBondContact O-CG 3.33Å; D707-R711 PolarHBondContact O-N 2.94Å; D707-R711 VanDerWaalsContact O-N 3.17Å; D707-R711 PolarHBondContact O-NE 2.71Å
708	W	87.8	Confident	86.1	Confident	176 Å²	176	81.7 Å²	81.7	67%	0.667	42%	0.419	S	S	*	.	H	α-helix	trans	-69.6	-43.5	173.6	-74.4	39.9	0	0	0	110.9	P704 Y705 S706 G712	P704-W708 PolarHBondContact O-N 3.09Å; P704-W708 VanDerWaalsContact O-N 3.15Å; Y705-W708 PolarHBondContact O-N 3Å; S706-W708 VanDerWaalsContact C-N 3.27Å; S706-W708 PolarHBondContact O-N 3.46Å; W708-G712 PolarHBondContact O-N 2.89Å
709	L	87.3	Confident	86.8	Confident	83 Å²	83	85.9 Å²	85.9	44%	0.435	43%	0.434	S	S	.	.	H	α-helix	trans	-65.1	-39.8	175.8	-179	60.4	0	0	0	111.9	A697 L701 Y705 S706 G713	A697-L709 HydrophobicContact CB-CD2 4.21Å; L701-L709 HydrophobicContact CD1-CB 4.36Å; L701-L709 HydrophobicContact CD1-CD2 3.66Å; Y705-L709 WeakPolarHBondContact O-CB 3.34Å; Y705-L709 PolarHBondContact O-N 2.87Å; S706-L709 PolarHBondContact O-N 3.28Å; L709-G713 WeakPolarHBondContact O-CA 3.43Å; L709-G713 PolarHBondContact O-N 2.83Å
710	Q	86.3	Confident	87.6	Confident	42 Å²	42	83.4 Å²	83.4	20%	0.196	42%	0.424	C	S	.	.	H	α-helix	trans	-61	-53.7	175.6	-177.3	-178.9	9.1	0	0	111.1	L694 S706 Q714	L694-Q710 HydrophobicContact CB-CG 4.15Å; S706-Q710 PolarHBondContact O-N 3.06Å; Q710-Q714 WeakPolarHBondContact O-CB 3.23Å; Q710-Q714 VanDerWaalsContact O-CG 3.28Å; Q710-Q714 WeakPolarHBondContact O-CG 3.36Å; Q710-Q714 PolarHBondContact O-N 2.78Å
711	R	87.5	Confident	88.4	Confident	136 Å²	136	76.3 Å²	76.3	51%	0.513	39%	0.387	S	S	.	.	H	α-helix	trans	-65.5	-42.7	-179.8	-71.3	-176.2	-68.7	-105.7	-1.6	112	D707 Q714 M715	D707-R711 WeakPolarHBondContact O-CG 3.33Å; D707-R711 PolarHBondContact O-N 2.94Å; D707-R711 VanDerWaalsContact O-N 3.17Å; D707-R711 PolarHBondContact O-NE 2.71Å; R711-Q714 PolarHBondContact O-N 2.98Å; R711-M715 WeakPolarHBondContact O-CB 3.45Å; R711-M715 WeakPolarHBondContact O-CG 3.32Å; R711-M715 PolarHBondContact O-N 2.91Å
712	G	90.8	Very high	89	Confident	34 Å²	34	76.8 Å²	76.8	35%	0.351	39%	0.39	S	S	.	.	H	α-helix	trans	-62.1	-48.3	176.8	0	0	0	0	0	112.1	W708 Q714 M715 V716	W708-G712 PolarHBondContact O-N 2.89Å; G712-Q714 PolarHBondContact O-N 2.9Å; G712-M715 PolarHBondContact O-N 2.75Å; G712-V716 WeakPolarHBondContact O-CB 3.06Å; G712-V716 WeakPolarHBondContact O-CG2 3Å; G712-V716 PolarHBondContact O-N 2.93Å
713	G	89.8	Confident	89.7	Confident	23 Å²	23	78 Å²	78	24%	0.237	38%	0.38	C	S	.	.	H	α-helix	trans	-61.7	-40.8	177.4	0	0	0	0	0	113.1	L709 L717	L709-G713 WeakPolarHBondContact O-CA 3.43Å; L709-G713 PolarHBondContact O-N 2.83Å; G713-L717 VanDerWaalsContact O-CB 3.27Å; G713-L717 WeakPolarHBondContact O-CB 3.5Å; G713-L717 PolarHBondContact O-N 2.89Å
714	Q	89.2	Confident	90.6	Very high	27 Å²	27	71.6 Å²	71.6	13%	0.126	35%	0.351	C	S	.	.	H	α-helix	trans	-63.2	-45.3	173.5	-73.4	173.3	-7.8	0	0	111.9	I185 D691 L694 Q710 R711 G712 L717 L718	I185-Q714 HydrophobicContact CD1-CG 4.47Å; D691-Q714 PolarHBondContact OD1-NE2 2.83Å; D691-Q714 VanDerWaalsContact OD1-NE2 3.08Å; L694-Q714 HydrophobicContact CD1-CG 3.89Å; Q710-Q714 WeakPolarHBondContact O-CB 3.23Å; Q710-Q714 VanDerWaalsContact O-CG 3.28Å; Q710-Q714 WeakPolarHBondContact O-CG 3.36Å; Q710-Q714 PolarHBondContact O-N 2.78Å; R711-Q714 PolarHBondContact O-N 2.98Å; G712-Q714 PolarHBondContact O-N 2.9Å; Q714-L717 PolarHBondContact O-N 3.28Å; Q714-L718 VanDerWaalsContact O-CG 3.3Å; Q714-L718 WeakPolarHBondContact O-CG 3.23Å; Q714-L718 PolarHBondContact O-N 2.92Å
715	M	91.4	Very high	91.3	Very high	131 Å²	131	69.4 Å²	69.4	65%	0.645	33%	0.334	S	S	*	.	H	α-helix	trans	-66.2	-41.4	178.2	-72.8	-59.8	-60.2	0	0	112.8	R711 G712 L718 F719	R711-M715 WeakPolarHBondContact O-CB 3.45Å; R711-M715 WeakPolarHBondContact O-CG 3.32Å; R711-M715 PolarHBondContact O-N 2.91Å; G712-M715 PolarHBondContact O-N 2.75Å; M715-L718 PolarHBondContact O-N 3.38Å; M715-F719 WeakPolarHBondContact O-CB 3.43Å; M715-F719 PolarHBondContact O-N 2.92Å
716	V	94.4	Very high	91.8	Very high	93 Å²	93	69.4 Å²	69.4	56%	0.564	33%	0.334	S	S	*	.	H	α-helix	trans	-62.6	-47.1	175	169.2	0	0	0	0	110.4	G712 L718 F719 T720	G712-V716 WeakPolarHBondContact O-CB 3.06Å; G712-V716 WeakPolarHBondContact O-CG2 3Å; G712-V716 PolarHBondContact O-N 2.93Å; V716-L718 PolarHBondContact O-N 3.04Å; V716-F719 PolarHBondContact O-N 2.86Å; V716-T720 WeakPolarHBondContact O-CB 3.31Å; V716-T720 PolarHBondContact O-N 3.36Å; V716-T720 PolarHBondContact O-OG1 3.18Å; V716-T720 VanDerWaalsContact O-OG1 3.1Å
717	L	93.9	Very high	92.3	Very high	25 Å²	25	71.6 Å²	71.6	13%	0.131	35%	0.346	C	S	.	.	H	α-helix	trans	-58.3	-47.3	177.9	178.9	61.4	0	0	0	112	I185 I609 L690 G713 Q714 T720 V721	I185-L717 HydrophobicContact CD1-CD2 4.15Å; I185-L717 HydrophobicContact CG1-CD2 4.14Å; I185-L717 HydrophobicContact CG2-CD2 3.78Å; I609-L717 HydrophobicContact CD1-CD1 4.03Å; L690-L717 HydrophobicContact CD1-CD1 4.45Å; L690-L717 HydrophobicContact CD1-CD2 3.74Å; G713-L717 VanDerWaalsContact O-CB 3.27Å; G713-L717 WeakPolarHBondContact O-CB 3.5Å; G713-L717 PolarHBondContact O-N 2.89Å; Q714-L717 PolarHBondContact O-N 3.28Å; L717-T720 PolarHBondContact O-N 2.84Å; L717-V721 HydrophobicContact CD1-CG2 4.4Å; L717-V721 VanDerWaalsContact O-CG2 3.3Å; L717-V721 WeakPolarHBondContact O-CG2 3.42Å; L717-V721 PolarHBondContact O-N 2.77Å
718	L	93.5	Very high	92.9	Very high	44 Å²	44	69.5 Å²	69.5	23%	0.23	33%	0.334	C	S	.	.	H	α-helix	trans	-64.5	-40.5	177.9	-69.4	172.2	0	0	0	112.1	L184 A188 Q714 M715 V716 V721 L722	L184-L718 HydrophobicContact CD2-CD1 4.29Å; A188-L718 HydrophobicContact CB-CD2 3.4Å; Q714-L718 VanDerWaalsContact O-CG 3.3Å; Q714-L718 WeakPolarHBondContact O-CG 3.23Å; Q714-L718 PolarHBondContact O-N 2.92Å; M715-L718 PolarHBondContact O-N 3.38Å; V716-L718 PolarHBondContact O-N 3.04Å; L718-V721 PolarHBondContact O-N 3.37Å; L718-L722 WeakPolarHBondContact O-CB 3.5Å; L718-L722 PolarHBondContact O-N 2.84Å
719	F	95.5	Very high	93.2	Very high	139 Å²	139	64 Å²	64	61%	0.61	32%	0.316	S	S	*	.	H	α-helix	trans	-66.3	-43.4	176	-177.3	-96.7	0	0	0	112.2	M715 V716 V721 L722 Y723	M715-F719 WeakPolarHBondContact O-CB 3.43Å; M715-F719 PolarHBondContact O-N 2.92Å; V716-F719 PolarHBondContact O-N 2.86Å; F719-V721 VanDerWaalsContact C-N 3.34Å; F719-V721 PolarHBondContact O-N 3.36Å; F719-L722 PolarHBondContact O-N 2.85Å; F719-Y723 VanDerWaalsContact O-CB 3.27Å; F719-Y723 WeakPolarHBondContact O-CB 3.2Å; F719-Y723 PolarHBondContact O-N 3.44Å
720	T	96	Very high	93.4	Very high	56 Å²	56	61.1 Å²	61.1	34%	0.344	30%	0.303	S	S	.	.	H	α-helix	trans	-60.9	-41	176.2	-67.3	0	0	0	0	111.9	V605 V716 L717 S724	V605-T720 HydrophobicContact CG1-CG2 3.88Å; V716-T720 WeakPolarHBondContact O-CB 3.31Å; V716-T720 PolarHBondContact O-N 3.36Å; V716-T720 PolarHBondContact O-OG1 3.18Å; V716-T720 VanDerWaalsContact O-OG1 3.1Å; L717-T720 PolarHBondContact O-N 2.84Å; T720-S724 WeakPolarHBondContact O-CB 3.42Å; T720-S724 PolarHBondContact O-N 2.99Å; T720-S724 PolarHBondContact O-OG 2.97Å
721	V	96.3	Very high	93.7	Very high	3 Å²	3	59.1 Å²	59.1	2%	0.018	29%	0.293	C	S	.	.	H	α-helix	trans	-68.8	-40.7	176.6	169.4	0	0	0	0	111.8	L189 F192 V606 L717 L718 F719 S724 F725	L189-V721 HydrophobicContact CD2-CG2 3.73Å; F192-V721 HydrophobicContact CB-CG1 3.69Å; F192-V721 HydrophobicContact CD2-CG1 4.04Å; F192-V721 HydrophobicContact CG-CG1 4.3Å; V606-V721 HydrophobicContact CG2-CG1 4.21Å; V606-V721 HydrophobicContact CG2-CG2 4.45Å; L717-V721 HydrophobicContact CD1-CG2 4.4Å; L717-V721 VanDerWaalsContact O-CG2 3.3Å; L717-V721 WeakPolarHBondContact O-CG2 3.42Å; L717-V721 PolarHBondContact O-N 2.77Å; L718-V721 PolarHBondContact O-N 3.37Å; F719-V721 VanDerWaalsContact C-N 3.34Å; F719-V721 PolarHBondContact O-N 3.36Å; V721-S724 PolarHBondContact O-OG 3.28Å; V721-F725 WeakPolarHBondContact O-CB 3.44Å; V721-F725 PolarHBondContact O-N 3Å
722	L	96.1	Very high	93.9	Very high	84 Å²	84	52.7 Å²	52.7	44%	0.44	27%	0.269	S	S	.	.	H	α-helix	trans	-66.4	-40.7	175.3	-179.8	62	0	0	0	112	F192 L718 F719 F725 Y726	F192-L722 HydrophobicContact CD1-CD1 4.28Å; F192-L722 HydrophobicContact CE1-CD1 3.74Å; F192-L722 HydrophobicContact CE2-CD1 4.35Å; F192-L722 HydrophobicContact CZ-CD1 3.79Å; L718-L722 WeakPolarHBondContact O-CB 3.5Å; L718-L722 PolarHBondContact O-N 2.84Å; F719-L722 PolarHBondContact O-N 2.85Å; L722-F725 PolarHBondContact O-N 2.67Å; L722-Y726 PolarHBondContact O-N 2.98Å
723	Y	96.7	Very high	94	Very high	127 Å²	127	52.2 Å²	52.2	50%	0.498	26%	0.257	S	S	.	.	H	α-helix	trans	-70.5	-41	178.6	-177.8	-107.3	0	0	0	112.1	F719 F725 Y726 L727	F719-Y723 VanDerWaalsContact O-CB 3.27Å; F719-Y723 WeakPolarHBondContact O-CB 3.2Å; F719-Y723 PolarHBondContact O-N 3.44Å; Y723-F725 VanDerWaalsContact C-N 3.31Å; Y723-F725 PolarHBondContact O-N 3.14Å; Y723-Y726 WeakPolarHBondContact O-CB 3.28Å; Y723-Y726 PolarHBondContact O-N 3.39Å; Y723-L727 HydrophobicContact CD1-CD1 4.25Å; Y723-L727 HydrophobicContact CE1-CD1 3.73Å; Y723-L727 HydrophobicContact CE1-CG 4.3Å; Y723-L727 PolarHBondContact O-N 2.98Å
724	S	96.6	Very high	93.9	Very high	5 Å²	5	51.8 Å²	51.8	4%	0.035	25%	0.252	C	S	.	.	H	α-helix	trans	-65.4	-36.6	174.2	75.7	0	0	0	0	111.6	N603 T720 V721 L727 F728	N603-S724 PolarHBondContact ND2-OG 3.17Å; N603-S724 WeakPolarHBondContact OD1-CB 3.21Å; N603-S724 PolarHBondContact OD1-OG 3.25Å; T720-S724 WeakPolarHBondContact O-CB 3.42Å; T720-S724 PolarHBondContact O-N 2.99Å; T720-S724 PolarHBondContact O-OG 2.97Å; V721-S724 PolarHBondContact O-OG 3.28Å; S724-L727 PolarHBondContact O-N 3.31Å; S724-F728 VanDerWaalsContact O-CD2 3.27Å; S724-F728 WeakPolarHBondContact O-CD2 3.35Å; S724-F728 PolarHBondContact O-N 3.5Å
725	F	96.8	Very high	93.9	Very high	23 Å²	23	51 Å²	51	10%	0.101	25%	0.249	C	C	.	.	H	α-helix	trans	-63	-43.3	170	173.3	-104.5	0	0	0	112.5	F192 T194 I197 N603 V721 L722 Y723 L727 F728 H729 Y733	F192-F725 HydrophobicContact CB-CB 3.8Å; F192-F725 HydrophobicContact CB-CD2 4.4Å; F192-F725 HydrophobicContact CB-CG 4.05Å; F192-F725 HydrophobicContact CD1-CB 4.17Å; F192-F725 AromaticContact CD1-CD1 3.58Å; F192-F725 HydrophobicContact CD1-CD1 3.58Å; F192-F725 HydrophobicContact CD1-CD2 4.43Å; F192-F725 HydrophobicContact CD1-CE1 4.07Å; F192-F725 AromaticContact CD1-CG 3.78Å; F192-F725 HydrophobicContact CD1-CG 3.78Å; F192-F725 HydrophobicContact CE1-CD1 4.19Å; F192-F725 HydrophobicContact CE1-CE1 4.46Å; F192-F725 HydrophobicContact CG-CB 4.31Å; F192-F725 HydrophobicContact CG-CG 4.35Å; F192-F725 WeakPolarHBondContact O-CD2 3.27Å; T194-F725 HydrophobicContact CG2-CD2 4.06Å; T194-F725 HydrophobicContact CG2-CE2 4.4Å; I197-F725 HydrophobicContact CD1-CD2 4.32Å; I197-F725 HydrophobicContact CD1-CE2 3.48Å; I197-F725 VanDerWaalsContact CD1-CE2 3.48Å; I197-F725 HydrophobicContact CD1-CZ 4.12Å; N603-F725 PolarHBondContact ND2-N 3.41Å; V721-F725 WeakPolarHBondContact O-CB 3.44Å; V721-F725 PolarHBondContact O-N 3Å; L722-F725 PolarHBondContact O-N 2.67Å; Y723-F725 VanDerWaalsContact C-N 3.31Å; Y723-F725 PolarHBondContact O-N 3.14Å; F725-L727 PolarHBondContact O-N 3.29Å; F725-F728 PolarHBondContact O-N 2.83Å; F725-H729 HydrophobicContact CD2-CB 4.36Å; F725-H729 HydrophobicContact CE1-CB 4.4Å; F725-H729 HydrophobicContact CE2-CB 3.89Å; F725-H729 HydrophobicContact CZ-CB 3.92Å; F725-H729 VanDerWaalsContact O-CB 3.32Å; F725-H729 WeakPolarHBondContact O-CB 3.49Å; F725-H729 PolarHBondContact O-N 2.94Å; F725-Y733 AromaticContact CZ-CE2 3.89Å; F725-Y733 HydrophobicContact CZ-CE2 3.89Å
726	Y	95.4	Very high	93.6	Very high	158 Å²	158	49.9 Å²	49.9	62%	0.62	25%	0.25	S	C	*	.	H	α-helix	trans	-56.4	-39	174.6	175.8	-97	0	0	0	112.3	L722 Y723 H729	L722-Y726 PolarHBondContact O-N 2.98Å; Y723-Y726 WeakPolarHBondContact O-CB 3.28Å; Y723-Y726 PolarHBondContact O-N 3.39Å; Y726-H729 PolarHBondContact O-CE1 3.47Å; Y726-H729 PolarHBondContact O-ND1 2.78Å
727	L	94.4	Very high	93.1	Very high	50 Å²	50	46.7 Å²	46.7	26%	0.262	24%	0.235	S	C	.	.	H	α-helix	trans	-69.8	-47.2	174.4	-64.8	177.1	0	0	0	113	Y723 S724 F725 P730 L750	Y723-L727 HydrophobicContact CD1-CD1 4.25Å; Y723-L727 HydrophobicContact CE1-CD1 3.73Å; Y723-L727 HydrophobicContact CE1-CG 4.3Å; Y723-L727 PolarHBondContact O-N 2.98Å; S724-L727 PolarHBondContact O-N 3.31Å; F725-L727 PolarHBondContact O-N 3.29Å; L727-P730 WeakPolarHBondContact O-CD 3.46Å; L727-L750 HydrophobicContact CB-CD1 4.33Å; L727-L750 HydrophobicContact CB-CD2 3.99Å; L727-L750 HydrophobicContact CD1-CD2 4.2Å; L727-L750 HydrophobicContact CD2-CD2 4.48Å; L727-L750 HydrophobicContact CG-CD2 4.46Å; L727-L750 VanDerWaalsContact O-CD1 3.27Å; L727-L750 WeakPolarHBondContact O-CD1 3.43Å
728	F	94.9	Very high	92.7	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-92	-7.4	-169.7	-72.2	-70.1	0	0	0	115.3	T194 P604 S724 F725 P730 L731 L750 W752 W756	T194-F728 HydrophobicContact CG2-CB 3.86Å; T194-F728 WeakPolarHBondContact CG2-O 3.32Å; P604-F728 HydrophobicContact CG-CE1 4.06Å; P604-F728 HydrophobicContact CG-CE2 4.03Å; P604-F728 HydrophobicContact CG-CZ 3.78Å; S724-F728 VanDerWaalsContact O-CD2 3.27Å; S724-F728 WeakPolarHBondContact O-CD2 3.35Å; S724-F728 PolarHBondContact O-N 3.5Å; F725-F728 PolarHBondContact O-N 2.83Å; F728-P730 VanDerWaalsContact C-N 3.3Å; F728-P730 WeakPolarHBondContact O-CD 3.49Å; F728-P730 VanDerWaalsContact O-N 3.12Å; F728-L731 HydrophobicContact CB-CD1 4.22Å; F728-L731 HydrophobicContact CD1-CD1 3.67Å; F728-L731 HydrophobicContact CG-CD1 4.39Å; F728-L731 WeakPolarHBondContact O-CB 3.24Å; F728-L731 WeakPolarHBondContact O-CG 3.32Å; F728-L731 PolarHBondContact O-N 3.33Å; F728-L750 HydrophobicContact CD1-CB 4.45Å; F728-L750 HydrophobicContact CE1-CB 3.82Å; F728-L750 HydrophobicContact CE1-CD2 4.42Å; F728-L750 HydrophobicContact CZ-CB 4.38Å; F728-L750 HydrophobicContact CZ-CD2 4.32Å; F728-W752 AromaticContact CE2-CH2 3.73Å; F728-W752 HydrophobicContact CE2-CH2 3.73Å; F728-W752 AromaticContact CE2-CZ2 3.78Å; F728-W752 HydrophobicContact CE2-CZ2 3.78Å; F728-W752 HydrophobicContact CE2-CZ3 4.24Å; F728-W752 HydrophobicContact CZ-CD2 4.13Å; F728-W752 AromaticContact CZ-CE2 3.78Å; F728-W752 HydrophobicContact CZ-CE3 4.32Å; F728-W752 AromaticContact CZ-CH2 3.95Å; F728-W752 HydrophobicContact CZ-CH2 3.95Å; F728-W752 AromaticContact CZ-CZ2 3.69Å; F728-W752 HydrophobicContact CZ-CZ2 3.69Å; F728-W752 HydrophobicContact CZ-CZ3 4.25Å; F728-W756 HydrophobicContact CE1-CZ3 4.5Å
729	H	93.7	Very high	92.2	Very high	60 Å²	60	47.2 Å²	47.2	28%	0.278	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.7	-30.8	-178.5	79.9	-93.2	0	0	0	116.3	F725 Y726 L731 S732 Y733	F725-H729 HydrophobicContact CD2-CB 4.36Å; F725-H729 HydrophobicContact CE1-CB 4.4Å; F725-H729 HydrophobicContact CE2-CB 3.89Å; F725-H729 HydrophobicContact CZ-CB 3.92Å; F725-H729 VanDerWaalsContact O-CB 3.32Å; F725-H729 WeakPolarHBondContact O-CB 3.49Å; F725-H729 PolarHBondContact O-N 2.94Å; Y726-H729 PolarHBondContact O-CE1 3.47Å; Y726-H729 PolarHBondContact O-ND1 2.78Å; H729-L731 PolarHBondContact O-N 3.37Å; H729-S732 PolarHBondContact O-N 2.84Å; H729-Y733 HydrophobicContact CB-CD2 4.12Å; H729-Y733 HydrophobicContact CB-CE2 4.26Å; H729-Y733 AromaticContact CD2-CD2 3.8Å; H729-Y733 PolarHBondContact O-N 2.79Å
730	P	93.1	Very high	91.7	Very high	24 Å²	24	40.8 Å²	40.8	16%	0.156	21%	0.213	C	C	.	.	H	α-helix	trans	-60.7	-25.7	176.9	-25.1	37.3	0	0	0	113.3	L727 F728 S732 G734 M735 M747	L727-P730 WeakPolarHBondContact O-CD 3.46Å; F728-P730 VanDerWaalsContact C-N 3.3Å; F728-P730 WeakPolarHBondContact O-CD 3.49Å; F728-P730 VanDerWaalsContact O-N 3.12Å; P730-S732 PolarHBondContact O-N 2.9Å; P730-G734 CarbonylContact O-C 3.56Å; P730-G734 VanDerWaalsContact O-CA 3.23Å; P730-G734 WeakPolarHBondContact O-CA 3.47Å; P730-G734 PolarHBondContact O-N 3.38Å; P730-M735 HydrophobicContact CB-CG 3.57Å; P730-M735 WeakPolarHBondContact O-CG 3.26Å; P730-M747 HydrophobicContact CB-CE 4.23Å; P730-M747 HydrophobicContact CB-SD 4.13Å; P730-M747 HydrophobicContact CG-CE 4.48Å; P730-M747 HydrophobicContact CG-SD 4.18Å
731	L	91.3	Very high	91	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-61.2	-29.5	175.1	-59.4	173.9	0	0	0	112.3	Y599 L601 F728 H729 M735 M747 F758	Y599-L731 HydrophobicContact CD1-CD2 4.41Å; Y599-L731 PolarHBondContact N-O 2.95Å; Y599-L731 VanDerWaalsContact N-O 3.16Å; Y599-L731 VanDerWaalsContact O-O 3.08Å; L601-L731 HydrophobicContact CB-CD1 4.25Å; L601-L731 HydrophobicContact CD2-CD1 4.08Å; F728-L731 HydrophobicContact CB-CD1 4.22Å; F728-L731 HydrophobicContact CD1-CD1 3.67Å; F728-L731 HydrophobicContact CG-CD1 4.39Å; F728-L731 WeakPolarHBondContact O-CB 3.24Å; F728-L731 WeakPolarHBondContact O-CG 3.32Å; F728-L731 PolarHBondContact O-N 3.33Å; H729-L731 PolarHBondContact O-N 3.37Å; L731-M735 HydrophobicContact CD2-CE 3.88Å; L731-M735 HydrophobicContact CD2-SD 3.71Å; L731-M747 HydrophobicContact CD2-CE 4.13Å; L731-M747 HydrophobicContact CG-CE 4.3Å; L731-F758 HydrophobicContact CD2-CB 3.99Å; L731-F758 HydrophobicContact CD2-CD1 3.72Å; L731-F758 HydrophobicContact CD2-CD2 3.85Å; L731-F758 HydrophobicContact CD2-CE1 4.05Å; L731-F758 HydrophobicContact CD2-CE2 4.19Å; L731-F758 HydrophobicContact CD2-CG 3.61Å; L731-F758 HydrophobicContact CD2-CZ 4.28Å
732	S	91.9	Very high	90.4	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-96.3	-49.2	177.3	-169.8	0	0	0	0	113.2	I197 T198 Q201 H729 P730 G734	I197-S732 VanDerWaalsContact CG2-OG 3.28Å; I197-S732 WeakPolarHBondContact CG2-OG 3.43Å; T198-S732 WeakPolarHBondContact CA-OG 3.13Å; T198-S732 PolarHBondContact N-OG 2.96Å; T198-S732 VanDerWaalsContact N-OG 3.16Å; T198-S732 WeakPolarHBondContact OG1-CA 3.21Å; T198-S732 WeakPolarHBondContact OG1-CB 3.25Å; T198-S732 PolarHBondContact OG1-OG 2.93Å; Q201-S732 PolarHBondContact OE1-OG 3.04Å; H729-S732 PolarHBondContact O-N 2.84Å; P730-S732 PolarHBondContact O-N 2.9Å; S732-G734 VanDerWaalsContact C-N 3.29Å; S732-G734 PolarHBondContact O-N 2.86Å
733	Y	92.4	Very high	89.8	Confident	24 Å²	24	47.8 Å²	47.8	9%	0.094	25%	0.25	C	C	.	.	H	α-helix	trans	-90.7	14	-176.6	-52.2	-36.9	0	0	0	113.9	T81 Y84 I197 Y596 F725 H729	T81-Y733 WeakPolarHBondContact CA-OH 3.39Å; T81-Y733 WeakPolarHBondContact CB-OH 3.36Å; T81-Y733 WeakPolarHBondContact O-CE1 3.46Å; T81-Y733 PolarHBondContact O-OH 2.91Å; Y84-Y733 AromaticContact CD1-CD1 3.97Å; Y84-Y733 HydrophobicContact CD1-CD1 3.97Å; Y84-Y733 AromaticContact CD1-CD2 3.64Å; Y84-Y733 HydrophobicContact CD1-CD2 3.64Å; Y84-Y733 HydrophobicContact CD1-CE1 4.01Å; Y84-Y733 AromaticContact CD1-CE2 3.71Å; Y84-Y733 HydrophobicContact CD1-CE2 3.71Å; Y84-Y733 AromaticContact CD1-CG 3.81Å; Y84-Y733 HydrophobicContact CD1-CG 3.81Å; Y84-Y733 AromaticContact CD1-CZ 3.91Å; Y84-Y733 AromaticContact CE1-CD2 3.84Å; Y84-Y733 HydrophobicContact CE1-CD2 3.84Å; Y84-Y733 HydrophobicContact CE1-CE2 4.21Å; Y84-Y733 HydrophobicContact CE1-CG 4.15Å; I197-Y733 HydrophobicContact CG2-CE1 3.73Å; Y596-Y733 PolarHBondContact OH-O 2.77Å; F725-Y733 AromaticContact CZ-CE2 3.89Å; F725-Y733 HydrophobicContact CZ-CE2 3.89Å; H729-Y733 HydrophobicContact CB-CD2 4.12Å; H729-Y733 HydrophobicContact CB-CE2 4.26Å; H729-Y733 AromaticContact CD2-CD2 3.8Å; H729-Y733 PolarHBondContact O-N 2.79Å
734	G	88.8	Confident	89.1	Confident	14 Å²	14	50.2 Å²	50.2	14%	0.144	27%	0.266	C	S	.	.			trans	93	151.4	172.2	0	0	0	0	0	116	R597 P730 S732	R597-G734 WeakPolarHBondContact O-CA 2.93Å; P730-G734 CarbonylContact O-C 3.56Å; P730-G734 VanDerWaalsContact O-CA 3.23Å; P730-G734 WeakPolarHBondContact O-CA 3.47Å; P730-G734 PolarHBondContact O-N 3.38Å; S732-G734 VanDerWaalsContact C-N 3.29Å; S732-G734 PolarHBondContact O-N 2.86Å
735	M	89.3	Confident	88.5	Confident	11 Å²	11	50.6 Å²	50.6	5%	0.054	27%	0.269	C	S	.	.	B	Isolated β-bridge	trans	-127.1	155	175.9	-65.5	163.7	-66.1	0	0	110.8	Y596 R597 P730 L731 M747 F758	Y596-M735 CarbonylContact C-O 3.55Å; Y596-M735 WeakPolarHBondContact CA-O 3.21Å; R597-M735 HydrophobicContact CB-CE 4.39Å; R597-M735 PolarHBondContact N-O 2.57Å; R597-M735 PolarHBondContact O-N 2.98Å; P730-M735 HydrophobicContact CB-CG 3.57Å; P730-M735 WeakPolarHBondContact O-CG 3.26Å; L731-M735 HydrophobicContact CD2-CE 3.88Å; L731-M735 HydrophobicContact CD2-SD 3.71Å; M735-M747 HydrophobicContact CG-CG 4.37Å; M735-M747 HydrophobicContact SD-CE 3.88Å; M735-M747 HydrophobicContact SD-CG 4.02Å; M735-M747 HydrophobicContact SD-SD 4.4Å; M735-F758 HydrophobicContact CE-CB 4.09Å; M735-F758 HydrophobicContact SD-CB 4.48Å; M735-F758 HydrophobicContact SD-CD2 4.38Å
736	T	85.4	Confident	87.9	Confident	108 Å²	108	54.3 Å²	54.3	66%	0.663	30%	0.303	S	S	*	.			trans	-143.4	142.7	174.6	52.2	0	0	0	0	109.7	Y596	Y596-T736 HydrophobicContact CD2-CG2 4.08Å
737	G	83.9	Confident	87.6	Confident	25 Å²	25	47.7 Å²	47.7	26%	0.258	28%	0.279	S	S	.	.	S	Bend	trans	105.6	-170.9	-178.5	0	0	0	0	0	113	E593 R597	E593-G737 CarbonylContact O-C 3.58Å; E593-G737 WeakPolarHBondContact O-CA 3.33Å; E593-G737 PolarHBondContact O-N 3.03Å; E593-G737 VanDerWaalsContact O-O 3.11Å; R597-G737 PolarHBondContact NH1-O 3.28Å; R597-G737 PolarHBondContact NH2-O 3.38Å
738	P	84.1	Confident	87.2	Confident	41 Å²	41	46.7 Å²	46.7	27%	0.266	28%	0.277	S	S	.	.	S	Bend	trans	-57.9	156.6	-172	20.5	-31.8	0	0	0	114.2	R597 E742 S745	R597-P738 PolarHBondContact NH2-O 2.95Å; P738-E742 HydrophobicContact CB-CB 4.15Å; P738-E742 HydrophobicContact CB-CG 4.39Å; P738-E742 VanDerWaalsContact CB-OE1 3.31Å; P738-E742 WeakPolarHBondContact CB-OE1 3.42Å; P738-E742 WeakPolarHBondContact CB-OE2 3.15Å; P738-S745 WeakPolarHBondContact O-CB 3.21Å; P738-S745 PolarHBondContact O-OG 2.9Å
739	L	83.9	Confident	86.9	Confident	40 Å²	40	50 Å²	50	21%	0.209	31%	0.311	C	S	.	.			trans	-66.7	151.6	178.9	-71	163.9	0	0	0	110.8	H741 E742 S745	L739-H741 PolarHBondContact O-N 3.39Å; L739-E742 PolarHBondContact N-OE1 3.35Å; L739-E742 WeakPolarHBondContact O-CB 3.44Å; L739-E742 PolarHBondContact O-N 2.85Å; L739-S745 WeakPolarHBondContact O-CB 3.36Å
740	A	83.9	Confident	86.7	Confident	3 Å²	3	48.2 Å²	48.2	3%	0.025	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	3.4	179.3	0	0	0	0	0	114.5	M747 K751 F758	A740-M747 HydrophobicContact CB-CB 3.93Å; A740-K751 HydrophobicContact CB-CB 4.26Å; A740-F758 HydrophobicContact CB-CD2 3.46Å; A740-F758 VanDerWaalsContact CB-CD2 3.46Å; A740-F758 HydrophobicContact CB-CE2 3.41Å; A740-F758 VanDerWaalsContact CB-CE2 3.41Å; A740-F758 HydrophobicContact CB-CG 4.48Å; A740-F758 HydrophobicContact CB-CZ 4.43Å; A740-F758 WeakPolarHBondContact CB-O 3.44Å; A740-F758 PolarHBondContact N-O 3.34Å
741	H	82.9	Confident	86.6	Confident	98 Å²	98	48.8 Å²	48.8	45%	0.454	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-19.4	167.6	-67	-117.5	0	0	0	112.5	L739 K751 W756	L739-H741 PolarHBondContact O-N 3.39Å; H741-K751 PolarHBondContact CE1-NZ 2.83Å; H741-K751 PolarHBondContact ND1-NZ 3.47Å; H741-W756 PolarHBondContact NE2-O 3.16Å
742	E	83.1	Confident	86.6	Confident	62 Å²	62	54 Å²	54	29%	0.29	32%	0.323	S	S	.	.	S	Bend	trans	-92.1	132.1	-176.5	-63	167.4	-108.7	0	0	110.4	P738 L739 E744 S745 A748	P738-E742 HydrophobicContact CB-CB 4.15Å; P738-E742 HydrophobicContact CB-CG 4.39Å; P738-E742 VanDerWaalsContact CB-OE1 3.31Å; P738-E742 WeakPolarHBondContact CB-OE1 3.42Å; P738-E742 WeakPolarHBondContact CB-OE2 3.15Å; L739-E742 PolarHBondContact N-OE1 3.35Å; L739-E742 WeakPolarHBondContact O-CB 3.44Å; L739-E742 PolarHBondContact O-N 2.85Å; E742-E744 PolarHBondContact O-N 2.8Å; E742-S745 WeakPolarHBondContact O-CB 3.21Å; E742-S745 PolarHBondContact O-N 3.07Å; E742-A748 WeakPolarHBondContact O-CB 3.36Å
743	P	83.1	Confident	86.6	Confident	130 Å²	130	55.8 Å²	55.8	84%	0.844	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-21.7	-178.6	-26.2	35.3	0	0	0	115.1	S745	P743-S745 VanDerWaalsContact C-N 3.34Å
744	E	82.4	Confident	86.4	Confident	179 Å²	179	61.1 Å²	61.1	84%	0.836	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84	-8.3	179.5	-58	-172.3	-174.9	0	0	113	E742	E742-E744 PolarHBondContact O-N 2.8Å
745	S	84.5	Confident	86.4	Confident	13 Å²	13	61.4 Å²	61.4	9%	0.091	36%	0.362	C	S	.	.			trans	-77	128.4	178.2	-173	0	0	0	0	112.2	P738 L739 E742 P743 M747 A748	P738-S745 WeakPolarHBondContact O-CB 3.21Å; P738-S745 PolarHBondContact O-OG 2.9Å; L739-S745 WeakPolarHBondContact O-CB 3.36Å; E742-S745 WeakPolarHBondContact O-CB 3.21Å; E742-S745 PolarHBondContact O-N 3.07Å; P743-S745 VanDerWaalsContact C-N 3.34Å; S745-M747 PolarHBondContact O-N 2.75Å; S745-M747 PolarHBondContact OG-N 3.03Å; S745-A748 VanDerWaalsContact O-CB 3.24Å; S745-A748 WeakPolarHBondContact O-CB 3.37Å; S745-A748 PolarHBondContact O-N 3.17Å
746	A	84.1	Confident	86.5	Confident	100 Å²	100	60.9 Å²	60.9	83%	0.826	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-19.8	172.1	0	0	0	0	0	113.3
747	M	87.6	Confident	86.4	Confident	20 Å²	20	58 Å²	58	10%	0.099	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.6	-7.5	177.6	-61.6	-59.3	-66.8	0	0	113.7	P730 L731 M735 A740 S745 G749 L750 F758	P730-M747 HydrophobicContact CB-CE 4.23Å; P730-M747 HydrophobicContact CB-SD 4.13Å; P730-M747 HydrophobicContact CG-CE 4.48Å; P730-M747 HydrophobicContact CG-SD 4.18Å; L731-M747 HydrophobicContact CD2-CE 4.13Å; L731-M747 HydrophobicContact CG-CE 4.3Å; M735-M747 HydrophobicContact CG-CG 4.37Å; M735-M747 HydrophobicContact SD-CE 3.88Å; M735-M747 HydrophobicContact SD-CG 4.02Å; M735-M747 HydrophobicContact SD-SD 4.4Å; A740-M747 HydrophobicContact CB-CB 3.93Å; S745-M747 PolarHBondContact O-N 2.75Å; S745-M747 PolarHBondContact OG-N 3.03Å; M747-G749 PolarHBondContact O-N 3.27Å; M747-L750 HydrophobicContact CE-CD1 3.73Å; M747-L750 WeakPolarHBondContact O-CB 3.38Å; M747-L750 PolarHBondContact O-N 2.95Å; M747-L750 HydrophobicContact SD-CD1 4.06Å; M747-F758 HydrophobicContact CB-CD2 4.28Å; M747-F758 HydrophobicContact CB-CE2 4.05Å; M747-F758 HydrophobicContact CE-CE2 4.23Å
748	A	87.4	Confident	86.3	Confident	29 Å²	29	57 Å²	57	24%	0.24	33%	0.327	C	S	.	.	G	3₁₀ helix	trans	-60.2	-42.2	-174.9	0	0	0	0	0	113	E742 S745 L750 K751	E742-A748 WeakPolarHBondContact O-CB 3.36Å; S745-A748 VanDerWaalsContact O-CB 3.24Å; S745-A748 WeakPolarHBondContact O-CB 3.37Å; S745-A748 PolarHBondContact O-N 3.17Å; A748-L750 PolarHBondContact O-N 2.64Å; A748-L750 VanDerWaalsContact O-N 3.08Å; A748-K751 WeakPolarHBondContact O-CB 3.42Å; A748-K751 PolarHBondContact O-N 3.23Å; A748-K751 VanDerWaalsContact O-N 3.09Å
749	G	87.5	Confident	86.4	Confident	69 Å²	69	57.8 Å²	57.8	71%	0.711	33%	0.33	S	S	*	.	G	3₁₀ helix	trans	-65.5	-7.9	175.2	0	0	0	0	0	115	M747	M747-G749 PolarHBondContact O-N 3.27Å
750	L	89.7	Confident	86.5	Confident	22 Å²	22	58.7 Å²	58.7	12%	0.115	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-102.6	-2.7	176.9	-58.4	178.9	0	0	0	112.8	L727 F728 M747 A748 W752 W756	L727-L750 HydrophobicContact CB-CD1 4.33Å; L727-L750 HydrophobicContact CB-CD2 3.99Å; L727-L750 HydrophobicContact CD1-CD2 4.2Å; L727-L750 HydrophobicContact CD2-CD2 4.48Å; L727-L750 HydrophobicContact CG-CD2 4.46Å; L727-L750 VanDerWaalsContact O-CD1 3.27Å; L727-L750 WeakPolarHBondContact O-CD1 3.43Å; F728-L750 HydrophobicContact CD1-CB 4.45Å; F728-L750 HydrophobicContact CE1-CB 3.82Å; F728-L750 HydrophobicContact CE1-CD2 4.42Å; F728-L750 HydrophobicContact CZ-CB 4.38Å; F728-L750 HydrophobicContact CZ-CD2 4.32Å; M747-L750 HydrophobicContact CE-CD1 3.73Å; M747-L750 WeakPolarHBondContact O-CB 3.38Å; M747-L750 PolarHBondContact O-N 2.95Å; M747-L750 HydrophobicContact SD-CD1 4.06Å; A748-L750 PolarHBondContact O-N 2.64Å; A748-L750 VanDerWaalsContact O-N 3.08Å; L750-W752 PolarHBondContact O-N 3.23Å; L750-W756 WeakPolarHBondContact O-CZ3 3.46Å
751	K	90.9	Very high	86.7	Confident	37 Å²	37	61.8 Å²	61.8	16%	0.161	35%	0.354	C	S	.	.			trans	-80.9	76.4	176.6	-164.3	-153.2	178	-155.2	0	111.4	A740 H741 A748 M753 D754 W756	A740-K751 HydrophobicContact CB-CB 4.26Å; H741-K751 PolarHBondContact CE1-NZ 2.83Å; H741-K751 PolarHBondContact ND1-NZ 3.47Å; A748-K751 WeakPolarHBondContact O-CB 3.42Å; A748-K751 PolarHBondContact O-N 3.23Å; A748-K751 VanDerWaalsContact O-N 3.09Å; K751-M753 VanDerWaalsContact C-N 3.34Å; K751-M753 PolarHBondContact O-N 2.99Å; K751-D754 WeakPolarHBondContact CE-O 3.29Å; K751-D754 PolarHBondContact NZ-O 2.94Å; K751-D754 VanDerWaalsContact NZ-O 3.1Å; K751-D754 IonicContact NZ-OD1 3.85Å; K751-D754 PolarHBondContact NZ-OD1 2.87Å; K751-W756 WeakPolarHBondContact CE-O 3.33Å; K751-W756 HydrophobicContact CG-CB 4.29Å
752	W	92.8	Very high	86.9	Confident	108 Å²	108	59.6 Å²	59.6	41%	0.409	35%	0.348	S	S	.	.			trans	-78.3	-11.1	-175.3	-54.4	-13.2	0	0	0	115.1	P604 V605 W608 F728 L750 W756	P604-W752 HydrophobicContact CB-CE3 3.93Å; P604-W752 HydrophobicContact CB-CZ3 3.87Å; P604-W752 HydrophobicContact CG-CE3 4.47Å; V605-W752 HydrophobicContact CG2-CH2 3.64Å; V605-W752 HydrophobicContact CG2-CZ3 3.88Å; W608-W752 HydrophobicContact CE3-CZ3 4.49Å; W608-W752 AromaticContact CH2-CE3 3.8Å; W608-W752 HydrophobicContact CH2-CE3 3.8Å; W608-W752 HydrophobicContact CH2-CZ3 4.49Å; W608-W752 AromaticContact CZ3-CE3 3.73Å; W608-W752 HydrophobicContact CZ3-CE3 3.73Å; W608-W752 AromaticContact CZ3-CZ3 3.99Å; W608-W752 HydrophobicContact CZ3-CZ3 3.99Å; F728-W752 AromaticContact CE2-CH2 3.73Å; F728-W752 HydrophobicContact CE2-CH2 3.73Å; F728-W752 AromaticContact CE2-CZ2 3.78Å; F728-W752 HydrophobicContact CE2-CZ2 3.78Å; F728-W752 HydrophobicContact CE2-CZ3 4.24Å; F728-W752 HydrophobicContact CZ-CD2 4.13Å; F728-W752 AromaticContact CZ-CE2 3.78Å; F728-W752 HydrophobicContact CZ-CE3 4.32Å; F728-W752 AromaticContact CZ-CH2 3.95Å; F728-W752 HydrophobicContact CZ-CH2 3.95Å; F728-W752 AromaticContact CZ-CZ2 3.69Å; F728-W752 HydrophobicContact CZ-CZ2 3.69Å; F728-W752 HydrophobicContact CZ-CZ3 4.25Å; L750-W752 PolarHBondContact O-N 3.23Å; W752-W756 HydrophobicContact CB-CE3 4.41Å; W752-W756 HydrophobicContact CB-CH2 3.81Å; W752-W756 HydrophobicContact CB-CZ3 3.57Å; W752-W756 HydrophobicContact CD2-CH2 4.44Å; W752-W756 HydrophobicContact CD2-CZ3 4.33Å; W752-W756 HydrophobicContact CE3-CH2 4.24Å; W752-W756 HydrophobicContact CG-CH2 4.31Å; W752-W756 AromaticContact CG-CZ3 3.93Å; W752-W756 HydrophobicContact CG-CZ3 3.93Å
753	M	90.9	Very high	87.1	Confident	38 Å²	38	59.5 Å²	59.5	19%	0.187	35%	0.351	C	S	.	.	S	Bend	trans	-136.6	142.7	172.5	-73.1	-166.2	-75.3	0	0	110.7	N582 Y583 W608 K751 S755 W756	N582-M753 VanDerWaalsContact O-CE 3.23Å; N582-M753 WeakPolarHBondContact O-CE 3.2Å; Y583-M753 HydrophobicContact CD2-SD 4.32Å; W608-M753 HydrophobicContact CZ2-CE 4.14Å; K751-M753 VanDerWaalsContact C-N 3.34Å; K751-M753 PolarHBondContact O-N 2.99Å; M753-S755 PolarHBondContact O-N 2.99Å; M753-W756 HydrophobicContact CB-CD2 4.24Å; M753-W756 HydrophobicContact CB-CG 4.38Å; M753-W756 HydrophobicContact CE-CZ2 3.47Å; M753-W756 VanDerWaalsContact CE-CZ2 3.47Å; M753-W756 WeakPolarHBondContact O-CB 3.09Å; M753-W756 PolarHBondContact O-N 3Å; M753-W756 VanDerWaalsContact O-N 3.09Å
754	D	88.2	Confident	87.4	Confident	137 Å²	137	54.8 Å²	54.8	73%	0.733	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-25	-172.8	-82.1	-52.1	0	0	0	115.2	K751 W756	K751-D754 WeakPolarHBondContact CE-O 3.29Å; K751-D754 PolarHBondContact NZ-O 2.94Å; K751-D754 VanDerWaalsContact NZ-O 3.1Å; K751-D754 IonicContact NZ-OD1 3.85Å; K751-D754 PolarHBondContact NZ-OD1 2.87Å; D754-W756 VanDerWaalsContact C-N 3.25Å; D754-W756 PolarHBondContact O-N 2.63Å
755	S	89.3	Confident	87.8	Confident	19 Å²	19	45.9 Å²	45.9	13%	0.133	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	5.9	176	44.8	0	0	0	0	114.4	Y583 M753	Y583-S755 WeakPolarHBondContact CE2-OG 3.24Å; Y583-S755 WeakPolarHBondContact O-CB 3.36Å; Y583-S755 PolarHBondContact O-OG 2.79Å; M753-S755 PolarHBondContact O-N 2.99Å
756	W	90.9	Very high	88	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	30%	0.296	C	S	.	.			trans	-92.4	121.3	168.4	-65.6	-6.4	0	0	0	110	N582 L601 P604 F728 H741 L750 K751 W752 M753 D754 F758	N582-W756 PolarHBondContact O-NE1 3.43Å; L601-W756 HydrophobicContact CD2-CD2 3.78Å; L601-W756 HydrophobicContact CD2-CE3 4.03Å; L601-W756 HydrophobicContact CD2-CG 4.25Å; L601-W756 HydrophobicContact CD2-CH2 4.39Å; L601-W756 HydrophobicContact CD2-CZ2 4.11Å; L601-W756 HydrophobicContact CD2-CZ3 4.32Å; P604-W756 HydrophobicContact CB-CH2 3.65Å; P604-W756 HydrophobicContact CB-CZ2 4.19Å; P604-W756 HydrophobicContact CG-CH2 3.3Å; P604-W756 HydrophobicContact CG-CZ2 3.92Å; P604-W756 HydrophobicContact CG-CZ3 3.95Å; F728-W756 HydrophobicContact CE1-CZ3 4.5Å; H741-W756 PolarHBondContact NE2-O 3.16Å; L750-W756 WeakPolarHBondContact O-CZ3 3.46Å; K751-W756 WeakPolarHBondContact CE-O 3.33Å; K751-W756 HydrophobicContact CG-CB 4.29Å; W752-W756 HydrophobicContact CB-CE3 4.41Å; W752-W756 HydrophobicContact CB-CH2 3.81Å; W752-W756 HydrophobicContact CB-CZ3 3.57Å; W752-W756 HydrophobicContact CD2-CH2 4.44Å; W752-W756 HydrophobicContact CD2-CZ3 4.33Å; W752-W756 HydrophobicContact CE3-CH2 4.24Å; W752-W756 HydrophobicContact CG-CH2 4.31Å; W752-W756 AromaticContact CG-CZ3 3.93Å; W752-W756 HydrophobicContact CG-CZ3 3.93Å; M753-W756 HydrophobicContact CB-CD2 4.24Å; M753-W756 HydrophobicContact CB-CG 4.38Å; M753-W756 HydrophobicContact CE-CZ2 3.47Å; M753-W756 VanDerWaalsContact CE-CZ2 3.47Å; M753-W756 WeakPolarHBondContact O-CB 3.09Å; M753-W756 PolarHBondContact O-N 3Å; M753-W756 VanDerWaalsContact O-N 3.09Å; D754-W756 VanDerWaalsContact C-N 3.25Å; D754-W756 PolarHBondContact O-N 2.63Å; W756-F758 HydrophobicContact CB-CD1 4.01Å; W756-F758 HydrophobicContact CB-CE1 3.69Å; W756-F758 HydrophobicContact CD2-CE1 4.2Å; W756-F758 AromaticContact CE3-CE1 3.84Å; W756-F758 HydrophobicContact CE3-CE1 3.84Å; W756-F758 HydrophobicContact CE3-CZ 4.17Å; W756-F758 HydrophobicContact CG-CE1 4.19Å
757	E	83.8	Confident	88.4	Confident	48 Å²	48	44.2 Å²	44.2	22%	0.224	25%	0.252	C	S	.	.			trans	-127.5	67	-168.8	-50.4	175.6	-149	0	0	111.5	R587 Y599	R587-E757 IonicContact CZ-OE2 2.73Å; R587-E757 PolarHBondContact NE-O 2.95Å; R587-E757 IonicContact NH1-OE2 2.82Å; R587-E757 PolarHBondContact NH1-OE2 3.45Å; R587-E757 IonicContact NH2-OE2 2.79Å; R587-E757 PolarHBondContact NH2-OE2 3.38Å; Y599-E757 WeakPolarHBondContact CE2-O 3.47Å; Y599-E757 PolarHBondContact OH-N 2.89Å
758	F	81.4	Confident	88.4	Confident	3 Å²	3	46.4 Å²	46.4	1%	0.013	27%	0.266	C	S	.	.			trans	-115.7	0	-175.1	51.8	-112.5	0	0	0	114.6	R597 Y599 L601 L731 M735 A740 M747 W756	R597-F758 VanDerWaalsContact CZ-OXT 3.23Å; R597-F758 PolarHBondContact NE-OXT 3.08Å; R597-F758 PolarHBondContact NH2-OXT 3.14Å; Y599-F758 HydrophobicContact CD1-CB 3.93Å; Y599-F758 AromaticContact CD1-CD1 3.72Å; Y599-F758 HydrophobicContact CD1-CD1 3.72Å; Y599-F758 HydrophobicContact CD1-CG 4.29Å; Y599-F758 HydrophobicContact CD2-CB 3.92Å; Y599-F758 HydrophobicContact CE1-CB 4.43Å; Y599-F758 AromaticContact CE1-CD1 3.75Å; Y599-F758 HydrophobicContact CE1-CD1 3.75Å; Y599-F758 HydrophobicContact CE2-CB 4.43Å; Y599-F758 HydrophobicContact CG-CB 3.65Å; Y599-F758 HydrophobicContact CG-CD1 4.34Å; Y599-F758 HydrophobicContact CG-CG 4.49Å; L601-F758 HydrophobicContact CD2-CE1 4.08Å; L731-F758 HydrophobicContact CD2-CB 3.99Å; L731-F758 HydrophobicContact CD2-CD1 3.72Å; L731-F758 HydrophobicContact CD2-CD2 3.85Å; L731-F758 HydrophobicContact CD2-CE1 4.05Å; L731-F758 HydrophobicContact CD2-CE2 4.19Å; L731-F758 HydrophobicContact CD2-CG 3.61Å; L731-F758 HydrophobicContact CD2-CZ 4.28Å; M735-F758 HydrophobicContact CE-CB 4.09Å; M735-F758 HydrophobicContact SD-CB 4.48Å; M735-F758 HydrophobicContact SD-CD2 4.38Å; A740-F758 HydrophobicContact CB-CD2 3.46Å; A740-F758 VanDerWaalsContact CB-CD2 3.46Å; A740-F758 HydrophobicContact CB-CE2 3.41Å; A740-F758 VanDerWaalsContact CB-CE2 3.41Å; A740-F758 HydrophobicContact CB-CG 4.48Å; A740-F758 HydrophobicContact CB-CZ 4.43Å; A740-F758 WeakPolarHBondContact CB-O 3.44Å; A740-F758 PolarHBondContact N-O 3.34Å; M747-F758 HydrophobicContact CB-CD2 4.28Å; M747-F758 HydrophobicContact CB-CE2 4.05Å; M747-F758 HydrophobicContact CE-CE2 4.23Å; W756-F758 HydrophobicContact CB-CD1 4.01Å; W756-F758 HydrophobicContact CB-CE1 3.69Å; W756-F758 HydrophobicContact CD2-CE1 4.2Å; W756-F758 AromaticContact CE3-CE1 3.84Å; W756-F758 HydrophobicContact CE3-CE1 3.84Å; W756-F758 HydrophobicContact CE3-CZ 4.17Å; W756-F758 HydrophobicContact CG-CE1 4.19Å

Retrieved 758 of 758 residues in 201.9 ms (Link to these results)

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