A0A5K4F3M1_SCHMA Loading...

MFS domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F3M1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 708 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	30.7	Very low	29.4	Very low	224 Å²	224	151.5 Å²	151.5	100%	1.103	81%	0.813	S	S	*	*				0	75.1	0	-67.8	164.9	172.1	0	0	106.3
2	N	31.3	Very low	29.1	Very low	157 Å²	157	155.3 Å²	155.3	84%	0.84	82%	0.817	S	S	*	*				72.9	120.9	65.4	-55.7	23.7	0	0	0	110.4
3	S	32.4	Very low	29	Very low	100 Å²	100	151.5 Å²	151.5	70%	0.699	81%	0.811	S	S	*	*			cis	-165.2	168.5	-18.1	43.1	0	0	0	0	106
4	Y	30.3	Very low	29	Very low	204 Å²	204	152.5 Å²	152.5	80%	0.8	81%	0.814	S	S	*	*			cis	-143.2	141.9	20.2	-114.8	-83.5	0	0	0	109.8
5	N	27.9	Very low	28.9	Very low	165 Å²	165	153.7 Å²	153.7	88%	0.882	81%	0.812	S	S	*	*			trans	-158.4	60.6	164.3	-158.2	8.3	0	0	0	112.7
6	S	30.4	Very low	28.8	Very low	92 Å²	92	149.8 Å²	149.8	64%	0.643	80%	0.801	S	S	*	*			trans	-175.1	113.2	165	56.4	0	0	0	0	113.5
7	E	28.5	Very low	28.8	Very low	181 Å²	181	153.6 Å²	153.6	85%	0.846	80%	0.804	S	S	*	*			trans	-126.2	101.2	133.3	-76.1	-157.7	125.6	0	0	106.2
8	I	30.3	Very low	28.9	Very low	139 Å²	139	151.4 Å²	151.4	71%	0.713	80%	0.798	S	S	*	*				88.1	104.5	95.9	-74.7	164.2	0	0	0	111.9
9	T	25.5	Very low	29	Very low	137 Å²	137	148.1 Å²	148.1	84%	0.84	79%	0.788	S	S	*	*			trans	-82.6	117.5	168.9	46.3	0	0	0	0	111.4
10	S	28	Very low	29.1	Very low	111 Å²	111	148.9 Å²	148.9	78%	0.776	79%	0.787	S	S	*	*			trans	-161.4	138.1	150.8	-79.4	0	0	0	0	106.1
11	I	28	Very low	29.1	Very low	157 Å²	157	147.2 Å²	147.2	81%	0.805	78%	0.782	S	S	*	*			cis	-131.6	158	34.4	-71.1	162.5	0	0	0	111.5
12	K	25.8	Very low	29.1	Very low	196 Å²	196	144 Å²	144	85%	0.852	77%	0.768	S	S	*	*			trans	-128	163.7	166.7	-112.2	-174.7	-179.8	-179.4	0	110.2
13	S	27.4	Very low	28.8	Very low	106 Å²	106	140.9 Å²	140.9	74%	0.741	76%	0.759	S	S	*	*			trans	69.9	148	-165.2	82.4	0	0	0	0	112
14	I	29.5	Very low	28.5	Very low	166 Å²	166	141.2 Å²	141.2	85%	0.851	76%	0.761	S	S	*	*			cis	-111.8	155.5	30.9	-73.4	164	0	0	0	114
15	H	27.2	Very low	28.4	Very low	171 Å²	171	138.4 Å²	138.4	79%	0.792	76%	0.76	S	S	*	*			trans	-80.1	154.9	172.8	-81.8	-78.2	0	0	0	113
16	S	27.6	Very low	28.4	Very low	91 Å²	91	134.7 Å²	134.7	64%	0.636	75%	0.747	S	S	*	*				148.1	144.3	101.9	67.5	0	0	0	0	114.8
17	Y	28.7	Very low	28.2	Very low	214 Å²	214	135.6 Å²	135.6	84%	0.839	75%	0.753	S	S	*	*			trans	55.3	150	159	-61.2	-63.2	0	0	0	119.1
18	T	30.4	Very low	28.2	Very low	115 Å²	115	133.1 Å²	133.1	71%	0.706	76%	0.755	S	S	*	*			cis	-153.6	151.6	9.2	-18.6	0	0	0	0	111.2
19	S	31	Very low	28.2	Very low	87 Å²	87	135.4 Å²	135.4	61%	0.608	76%	0.763	S	S	*	*			trans	40.1	146	143.6	59.3	0	0	0	0	122.6
20	H	31.3	Very low	28.6	Very low	164 Å²	164	133.6 Å²	133.6	76%	0.759	75%	0.754	S	S	*	*			cis	-166.7	144.3	-5.7	-102.2	-39.3	0	0	0	107.2
21	V	30	Very low	28.6	Very low	115 Å²	115	133 Å²	133	70%	0.697	75%	0.75	S	S	*	*				67.8	129.6	70.2	163.2	0	0	0	0	112
22	I	29.6	Very low	28.5	Very low	155 Å²	155	131.7 Å²	131.7	80%	0.795	75%	0.749	S	S	*	*			cis	-150.4	-177.1	2.1	-128.5	168.9	0	0	0	113
23	S	24.8	Very low	28.6	Very low	93 Å²	93	129.6 Å²	129.6	65%	0.65	75%	0.747	S	S	*	*			trans	-98.1	178	-173.4	55.4	0	0	0	0	116.4
24	S	27.4	Very low	28.5	Very low	106 Å²	106	129.1 Å²	129.1	74%	0.741	74%	0.744	S	S	*	*			trans	82.6	153.3	161.9	87	0	0	0	0	117.5
25	N	27.5	Very low	28.7	Very low	145 Å²	145	129.7 Å²	129.7	78%	0.775	75%	0.748	S	S	*	*			cis	-154.5	161.5	1.6	-144.2	-3.6	0	0	0	115.4
26	S	27.3	Very low	28.7	Very low	88 Å²	88	132.2 Å²	132.2	62%	0.615	75%	0.751	S	S	*	*			trans	52.7	120.7	147.2	62.4	0	0	0	0	124.7
27	S	25.7	Very low	29.1	Very low	111 Å²	111	133 Å²	133	78%	0.776	75%	0.753	S	S	*	*				67.6	122.6	129.5	66.8	0	0	0	0	124.2
28	S	30.3	Very low	29.3	Very low	128 Å²	128	128.3 Å²	128.3	90%	0.895	75%	0.749	S	S	*	*				-170.8	178.9	126.1	38.5	0	0	0	0	110.7
29	Q	28.8	Very low	29	Very low	187 Å²	187	127.3 Å²	127.3	87%	0.874	75%	0.747	S	S	*	*			trans	-121.1	-158.1	-163.9	-139.2	-165.5	5.3	0	0	112.6
30	P	35.3	Very low	29.1	Very low	99 Å²	99	131.5 Å²	131.5	64%	0.643	76%	0.761	S	S	*	*			trans	-120.4	-171.4	-130.4	43.8	-27.3	0	0	0	116.5
31	S	26.3	Very low	28.9	Very low	100 Å²	100	129.8 Å²	129.8	70%	0.699	76%	0.762	S	S	*	*			trans	98.7	139.1	155.3	77.5	0	0	0	0	119.5
32	T	26	Very low	28.9	Very low	129 Å²	129	127.3 Å²	127.3	79%	0.791	76%	0.76	S	S	*	*			trans	56.6	138.7	169	47.9	0	0	0	0	117.2
33	D	28.5	Very low	28.8	Very low	151 Å²	151	128.2 Å²	128.2	81%	0.807	77%	0.765	S	S	*	*			cis	-153.9	-171.8	38.4	-144.6	-30.8	0	0	0	114.2
34	S	26.5	Very low	29	Very low	97 Å²	97	128.8 Å²	128.8	68%	0.678	77%	0.767	S	S	*	*			trans	-64	152.4	-171.2	65.5	0	0	0	0	117.7
35	L	31.7	Very low	29.1	Very low	177 Å²	177	132.2 Å²	132.2	93%	0.927	77%	0.771	S	S	*	*			trans	-162	150.2	144.7	-109.4	162.8	0	0	0	112.3
36	R	28.1	Very low	29.1	Very low	225 Å²	225	132.3 Å²	132.3	85%	0.849	77%	0.771	S	S	*	*			trans	-150.9	164	-172.4	-147.6	-154.9	-176	-170.1	3	107.3
37	P	37	Very low	28.9	Very low	106 Å²	106	137.6 Å²	137.6	69%	0.688	78%	0.783	S	S	*	*			cis	-104	-133	-41.8	25.6	-1.8	0	0	0	108.6
38	P	31.2	Very low	28.9	Very low	116 Å²	116	137.2 Å²	137.2	75%	0.753	78%	0.78	S	S	*	*			cis	-129.1	163.6	46.9	37.2	-20.3	0	0	0	115.7
39	S	25	Very low	28.8	Very low	95 Å²	95	139.1 Å²	139.1	66%	0.664	78%	0.779	S	S	*	*			trans	-76	139.8	167.4	48.9	0	0	0	0	112.2
40	I	32.8	Very low	28.9	Very low	174 Å²	174	136 Å²	136	89%	0.892	77%	0.774	S	S	*	*			trans	-95.5	103.7	165.5	-61.3	178.8	0	0	0	109.2
41	T	27.3	Very low	28.3	Very low	128 Å²	128	136.7 Å²	136.7	79%	0.785	78%	0.78	S	S	*	*			trans	-106.4	120.8	166	47.9	0	0	0	0	108.8
42	G	29.6	Very low	28.2	Very low	64 Å²	64	138.4 Å²	138.4	66%	0.66	79%	0.787	S	S	*	*			trans	-177.6	66.7	-176.2	0	0	0	0	0	117
43	L	28.3	Very low	28.3	Very low	173 Å²	173	140.6 Å²	140.6	91%	0.906	79%	0.788	S	S	*	*				-175.8	130.1	123.6	-121.8	74.3	0	0	0	110.8
44	P	29	Very low	28.3	Very low	105 Å²	105	141.9 Å²	141.9	68%	0.682	79%	0.793	S	S	*	*			trans	-111.2	164.8	174.7	40.3	-32.7	0	0	0	113.4
45	Q	28.7	Very low	28.3	Very low	178 Å²	178	145.3 Å²	145.3	83%	0.832	80%	0.801	S	S	*	*			trans	69.5	144.1	173.1	-46.5	-179.3	7.4	0	0	113.8
46	L	26.8	Very low	28	Very low	148 Å²	148	144 Å²	144	78%	0.775	79%	0.794	S	S	*	*			cis	-124.2	159.4	19.4	-86	84.6	0	0	0	114.5
47	K	24.8	Very low	28.2	Very low	198 Å²	198	141 Å²	141	86%	0.861	79%	0.793	S	S	*	*			trans	-101.2	164	149.2	-82.5	-177.8	173.3	179.2	0	108.6
48	S	25.9	Very low	27.8	Very low	103 Å²	103	142.3 Å²	142.3	72%	0.72	80%	0.795	S	S	*	*			trans	62.3	130.5	-171	73.6	0	0	0	0	113
49	L	28.1	Very low	27.8	Very low	168 Å²	168	145.5 Å²	145.5	88%	0.88	80%	0.797	S	S	*	*				-147.4	157.3	66.4	-90.9	151.5	0	0	0	112.6
50	T	29.2	Very low	27.8	Very low	123 Å²	123	148 Å²	148	76%	0.755	80%	0.803	S	S	*	*			trans	-100.4	144.5	171.8	47.6	0	0	0	0	111.1
51	S	23.8	Very low	27.9	Very low	112 Å²	112	145 Å²	145	78%	0.783	79%	0.794	S	S	*	*			trans	47	97.8	150.7	-51.6	0	0	0	0	118.2
52	T	25	Very low	27.8	Very low	136 Å²	136	147 Å²	147	83%	0.834	80%	0.797	S	S	*	*				-171	169.8	118.8	-55.3	0	0	0	0	107.3
53	E	26.9	Very low	27.7	Very low	175 Å²	175	150.9 Å²	150.9	82%	0.818	80%	0.801	S	S	*	*			trans	63.2	72.9	165.4	-51.3	-160.1	136.6	0	0	118.9
54	I	28.6	Very low	27.7	Very low	179 Å²	179	148.5 Å²	148.5	92%	0.918	79%	0.794	S	S	*	*			trans	-126.6	90.5	135.9	-59.5	-177.2	0	0	0	107.6
55	M	27.1	Very low	27.4	Very low	169 Å²	169	153.8 Å²	153.8	83%	0.833	80%	0.802	S	S	*	*			trans	-150	111.8	173.8	-143.8	-180	-161.5	0	0	112.1
56	N	25.8	Very low	27.5	Very low	148 Å²	148	150.9 Å²	150.9	79%	0.791	80%	0.801	S	S	*	*			trans	67.7	172.5	167.7	-62.8	-28.1	0	0	0	118.7
57	I	31	Very low	27.4	Very low	162 Å²	162	150.1 Å²	150.1	83%	0.831	80%	0.798	S	S	*	*			trans	84.6	112.8	-170.7	-58.8	175.8	0	0	0	112.3
58	N	29	Very low	27.6	Very low	134 Å²	134	147.9 Å²	147.9	72%	0.717	80%	0.795	S	S	*	*			cis	-166.5	169.6	-0.8	-151.5	-14	0	0	0	114.4
59	K	30.9	Very low	27.8	Very low	183 Å²	183	150.5 Å²	150.5	80%	0.796	79%	0.794	S	S	*	*			trans	115.4	88	152.9	-66.1	-178.5	177.1	177.8	0	121
60	N	26.3	Very low	27.8	Very low	148 Å²	148	150 Å²	150	79%	0.791	79%	0.786	S	S	*	*				75.1	157.8	118.7	-71.2	16.7	0	0	0	123.6
61	P	33	Very low	27.8	Very low	110 Å²	110	154.1 Å²	154.1	71%	0.714	79%	0.79	S	S	*	*			trans	-128.5	-161.5	-158.5	44.2	-26.3	0	0	0	115.2
62	M	26.1	Very low	27.8	Very low	172 Å²	172	156.6 Å²	156.6	85%	0.847	79%	0.792	S	S	*	*			trans	76.3	141.5	-174.5	-53.3	-103	-151.6	0	0	112.6
63	I	27.9	Very low	28	Very low	144 Å²	144	158.5 Å²	158.5	74%	0.738	79%	0.789	S	S	*	*			cis	-151.2	167.3	-1.4	-130.5	168.6	0	0	0	106.3
64	T	27.8	Very low	28.1	Very low	124 Å²	124	157.8 Å²	157.8	76%	0.761	79%	0.786	S	S	*	*			cis	-147.1	-162.6	38	-28.2	0	0	0	0	110.8
65	Y	23.8	Very low	27.9	Very low	216 Å²	216	157.2 Å²	157.2	85%	0.847	78%	0.782	S	S	*	*			trans	-115.1	156.3	168.9	-86.4	-102.5	0	0	0	112.3
66	S	29.1	Very low	28	Very low	116 Å²	116	154.5 Å²	154.5	81%	0.811	78%	0.778	S	S	*	*			trans	-143.2	155	140.4	-168.1	0	0	0	0	109
67	N	26.1	Very low	28	Very low	132 Å²	132	154.5 Å²	154.5	71%	0.706	78%	0.778	S	S	*	*			trans	-90.3	150.6	-172.1	-55.3	-69.9	0	0	0	112.2
68	D	29.2	Very low	27.9	Very low	152 Å²	152	154.6 Å²	154.6	81%	0.813	78%	0.778	S	S	*	*				-151.6	175.6	111.7	-125.5	-37	0	0	0	112.5
69	K	28.4	Very low	27.6	Very low	157 Å²	157	155.3 Å²	155.3	68%	0.683	78%	0.781	S	S	*	*			trans	-109.9	164.4	-149.2	-56.7	164.6	-173.6	165.3	0	116.5
70	H	29.5	Very low	27.5	Very low	157 Å²	157	152.7 Å²	152.7	73%	0.727	78%	0.78	S	S	*	*			trans	67.9	129	162.7	-55.1	-71.4	0	0	0	115.7
71	Y	29.2	Very low	27.6	Very low	210 Å²	210	151.1 Å²	151.1	82%	0.824	78%	0.781	S	S	*	*			cis	-142	155.3	21.5	-108.2	-84.5	0	0	0	112.3
72	I	23.4	Very low	27.1	Very low	164 Å²	164	151.8 Å²	151.8	84%	0.841	78%	0.783	S	S	*	*			trans	-125.2	130.3	164.6	-63.9	174.7	0	0	0	108.6
73	K	28.9	Very low	27.3	Very low	177 Å²	177	152.3 Å²	152.3	77%	0.77	78%	0.783	S	S	*	*			trans	-152.9	122.8	156.7	-107.9	-167.9	174.5	-178	0	112.2
74	H	29.3	Very low	27.3	Very low	160 Å²	160	150.5 Å²	150.5	74%	0.741	78%	0.778	S	S	*	*			trans	44.5	111.7	159.6	-57.8	-71.5	0	0	0	121.1
75	I	24.2	Very low	27.1	Very low	166 Å²	166	150.3 Å²	150.3	85%	0.851	78%	0.778	S	S	*	*			trans	-119.1	133.5	138.2	-63.8	171.8	0	0	0	107
76	P	29.7	Very low	27.3	Very low	113 Å²	113	151.1 Å²	151.1	73%	0.734	78%	0.781	S	S	*	*			trans	-112.4	150.2	156.6	35.2	-26.5	0	0	0	111.8
77	N	24.8	Very low	27.2	Very low	148 Å²	148	150.8 Å²	150.8	79%	0.791	77%	0.774	S	S	*	*			trans	-69	157.1	-178.4	-50.7	-52.7	0	0	0	113.1
78	I	28.3	Very low	27.3	Very low	164 Å²	164	150 Å²	150	84%	0.841	77%	0.774	S	S	*	*			trans	-146.8	139.1	136	-97.2	143.6	0	0	0	108.6
79	I	24.6	Very low	27.2	Very low	149 Å²	149	149.1 Å²	149.1	76%	0.764	77%	0.769	S	S	*	*			trans	-132.7	161.5	169.5	-68.8	177.2	0	0	0	106.2
80	T	27.5	Very low	27.2	Very low	128 Å²	128	147.9 Å²	147.9	79%	0.785	77%	0.77	S	S	*	*			trans	80	145.8	-174.8	79.8	0	0	0	0	113.7
81	S	29	Very low	27.1	Very low	115 Å²	115	145.7 Å²	145.7	80%	0.804	77%	0.768	S	S	*	*			cis	-143.1	171.2	0.5	52.8	0	0	0	0	112.2
82	T	22.8	Very low	27.1	Very low	124 Å²	124	140.9 Å²	140.9	76%	0.761	76%	0.761	S	S	*	*			trans	-86.5	145.9	-179.9	49	0	0	0	0	113.3
83	H	29.8	Very low	27.3	Very low	182 Å²	182	139.3 Å²	139.3	84%	0.843	75%	0.754	S	S	*	*			trans	-153.6	129.3	146.1	-111.6	-69.5	0	0	0	116.1
84	T	28.7	Very low	27.2	Very low	106 Å²	106	136.8 Å²	136.8	65%	0.65	75%	0.749	S	S	*	*			trans	-12.8	121.5	160.5	49.5	0	0	0	0	122
85	T	22.5	Very low	27.1	Very low	121 Å²	121	135.9 Å²	135.9	74%	0.742	75%	0.749	S	S	*	*				20.3	133.5	126.4	54	0	0	0	0	121.9
86	Y	28.4	Very low	27	Very low	232 Å²	232	137.1 Å²	137.1	91%	0.91	75%	0.749	S	S	*	*			trans	-144.3	172.2	141.3	-98.9	-74.3	0	0	0	111
87	T	27.7	Very low	26.9	Very low	110 Å²	110	138.6 Å²	138.6	68%	0.675	76%	0.756	S	S	*	*			trans	-128.9	143.8	-152	50.4	0	0	0	0	116.8
88	T	26.9	Very low	26.8	Very low	115 Å²	115	138.6 Å²	138.6	71%	0.706	76%	0.756	S	S	*	*			trans	51.2	125.5	143.7	57.3	0	0	0	0	121.6
89	N	28.1	Very low	26.7	Very low	133 Å²	133	139 Å²	139	71%	0.711	76%	0.755	S	S	*	*				178.8	138.7	108.6	-91.8	-22.9	0	0	0	114.2
90	N	27.8	Very low	26.7	Very low	132 Å²	132	138.3 Å²	138.3	71%	0.706	75%	0.751	S	S	*	*			trans	55.1	145.8	135	-60.4	-7.1	0	0	0	121.5
91	T	28.7	Very low	26.4	Very low	111 Å²	111	140.8 Å²	140.8	68%	0.681	75%	0.751	S	S	*	*			cis	-166.2	161.8	-0.7	12.7	0	0	0	0	112.9
92	T	28.7	Very low	26.3	Very low	109 Å²	109	144.3 Å²	144.3	67%	0.669	76%	0.755	S	S	*	*			trans	68.9	126.3	145.3	49.8	0	0	0	0	124.1
93	N	27.4	Very low	26.4	Very low	131 Å²	131	143.6 Å²	143.6	70%	0.701	75%	0.75	S	S	*	*			trans	74.3	115.7	134	-60.5	16.3	0	0	0	119.8
94	N	26.6	Very low	26.2	Very low	124 Å²	124	142.4 Å²	142.4	66%	0.663	75%	0.751	S	S	*	*				112.3	153.3	84.7	-86.7	40.5	0	0	0	108.1
95	D	27.1	Very low	26	Very low	140 Å²	140	141 Å²	141	75%	0.749	76%	0.757	S	S	*	*			cis	-150.7	176.4	-0.8	-110.6	-35.1	0	0	0	110.8
96	F	22.9	Very low	26.2	Very low	192 Å²	192	144.6 Å²	144.6	84%	0.842	77%	0.765	S	S	*	*			trans	-82.8	144.3	167.6	-94.7	-108.4	0	0	0	112.2
97	T	27.6	Very low	25.9	Very low	145 Å²	145	141.2 Å²	141.2	89%	0.89	76%	0.762	S	S	*	*				-175.6	165	125.7	26.5	0	0	0	0	112.9
98	D	22.1	Very low	25.8	Very low	148 Å²	148	144 Å²	144	79%	0.791	77%	0.772	S	S	*	*			trans	-89.3	-166.1	-176.4	-63.6	-85.1	0	0	0	114.8
99	E	25.3	Very low	25.6	Very low	173 Å²	173	144.4 Å²	144.4	81%	0.808	77%	0.774	S	S	*	*			trans	84.3	150.7	165.7	-58	-152.4	148.9	0	0	118.4
100	I	24.6	Very low	25.6	Very low	133 Å²	133	143.9 Å²	143.9	68%	0.682	78%	0.776	S	S	*	*			cis	-164.4	154.7	-39.7	-116.1	165.5	0	0	0	107.6
101	F	22.8	Very low	25.5	Very low	180 Å²	180	144.2 Å²	144.2	79%	0.789	78%	0.783	S	S	*	*			trans	2.4	130.6	167.5	-71.7	-106.1	0	0	0	121.1
102	Q	25.5	Very low	25.5	Very low	189 Å²	189	146.5 Å²	146.5	88%	0.883	79%	0.79	S	S	*	*				-170	-173.6	100.5	-107	-177.3	9.3	0	0	114
103	T	25.7	Very low	25.5	Very low	109 Å²	109	146.9 Å²	146.9	67%	0.669	79%	0.794	S	S	*	*			trans	-122.4	150.1	-149.8	50.4	0	0	0	0	116.7
104	N	25.1	Very low	25.3	Very low	158 Å²	158	148.2 Å²	148.2	85%	0.845	80%	0.801	S	S	*	*			trans	65.2	108.6	148.4	-62.2	-3.7	0	0	0	120.4
105	G	24	Very low	25.3	Very low	76 Å²	76	150 Å²	150	78%	0.784	81%	0.811	S	S	*	*				114.9	108.4	101.1	0	0	0	0	0	118.8
106	Q	26.5	Very low	25.3	Very low	196 Å²	196	150.1 Å²	150.1	92%	0.916	81%	0.81	S	S	*	*			trans	-157.9	143.7	142.9	-113	170.9	20.2	0	0	110.2
107	L	22.2	Very low	25.4	Very low	161 Å²	161	149.4 Å²	149.4	84%	0.843	81%	0.809	S	S	*	*			trans	-85.3	140	168	-82	78.2	0	0	0	109.4
108	L	26	Very low	25.4	Very low	168 Å²	168	150.9 Å²	150.9	88%	0.88	81%	0.805	S	S	*	*			trans	-153.4	142.9	147	-113.7	164.4	0	0	0	109.8
109	T	22.3	Very low	25.6	Very low	124 Å²	124	150.6 Å²	150.6	76%	0.761	80%	0.803	S	S	*	*			trans	-103.8	118.9	-165.9	48.9	0	0	0	0	112.2
110	T	27.9	Very low	25.6	Very low	123 Å²	123	149.3 Å²	149.3	76%	0.755	80%	0.802	S	S	*	*			trans	-138.9	103.6	167.7	50.7	0	0	0	0	111.5
111	T	26.4	Very low	25.6	Very low	139 Å²	139	151.9 Å²	151.9	85%	0.853	81%	0.811	S	S	*	*			trans	21.6	111	145	54.4	0	0	0	0	118.4
112	I	29.3	Very low	25.7	Very low	158 Å²	158	154.4 Å²	154.4	81%	0.81	82%	0.815	S	S	*	*			trans	-110.4	132.4	159.8	-61	174.6	0	0	0	107.1
113	P	28.1	Very low	25.6	Very low	117 Å²	117	152.8 Å²	152.8	76%	0.76	81%	0.813	S	S	*	*			trans	-76.2	151	172.7	-10.4	27.2	0	0	0	112.2	D115	P113-D115 PolarHBondContact O-N 3.21Å
114	D	24.3	Very low	25.6	Very low	159 Å²	159	157.7 Å²	157.7	85%	0.85	83%	0.825	S	S	*	*			trans	-68.9	121.8	179	-52.3	-84.5	0	0	0	112.9
115	D	25.5	Very low	25.6	Very low	163 Å²	163	157.6 Å²	157.6	87%	0.872	82%	0.82	S	S	*	*			trans	-170	62	151.1	-114.5	-20.8	0	0	0	113.3	P113	P113-D115 PolarHBondContact O-N 3.21Å
116	I	26.4	Very low	25.7	Very low	141 Å²	141	164.2 Å²	164.2	72%	0.723	82%	0.823	S	S	*	*			trans	-133.9	77.8	164.4	-49.6	-179	0	0	0	111	L119	I116-L119 HydrophobicContact CG2-CB 4.36Å; I116-L119 HydrophobicContact CG2-CD1 4.33Å
117	H	26.1	Very low	25.7	Very low	178 Å²	178	159.7 Å²	159.7	82%	0.824	81%	0.813	S	S	*	*			trans	-104.7	153.9	150.4	-100.6	-88.8	0	0	0	109.3
118	H	27.8	Very low	26.1	Very low	175 Å²	175	156 Å²	156	81%	0.81	80%	0.797	S	S	*	*			trans	73.8	32.6	-179.9	-63.9	-80.1	0	0	0	118.7	N120	H118-N120 PolarHBondContact O-N 3.46Å
119	L	24.9	Very low	26.1	Very low	143 Å²	143	153.3 Å²	153.3	75%	0.749	78%	0.783	S	S	*	*			trans	-78.1	59.2	154.7	-128.8	170.5	0	0	0	110.7	I116	I116-L119 HydrophobicContact CG2-CB 4.36Å; I116-L119 HydrophobicContact CG2-CD1 4.33Å
120	N	25.5	Very low	26.6	Very low	146 Å²	146	153.6 Å²	153.6	78%	0.781	78%	0.776	S	S	*	*			trans	-145.7	60.3	-168.2	-142.6	-7.7	0	0	0	113.2	H118	H118-N120 PolarHBondContact O-N 3.46Å
121	Q	24.9	Very low	26.9	Very low	187 Å²	187	152.7 Å²	152.7	87%	0.874	77%	0.765	S	S	*	*			trans	-149.7	2.1	173.5	-124.7	173.1	21.6	0	0	115.7	N123	Q121-N123 PolarHBondContact O-N 3.3Å
122	W	24.9	Very low	27	Very low	232 Å²	232	150.5 Å²	150.5	88%	0.879	75%	0.748	S	S	*	*			trans	-93.3	55	-176.2	-84.5	70.4	0	0	0	113.1
123	N	24.9	Very low	27.1	Very low	155 Å²	155	147.9 Å²	147.9	83%	0.829	74%	0.736	S	S	*	*	S	Bend	trans	-149.7	36.7	-177.6	-121.4	-16.6	0	0	0	116.6	Q121	Q121-N123 PolarHBondContact O-N 3.3Å
124	F	25.4	Very low	27.5	Very low	213 Å²	213	148.6 Å²	148.6	93%	0.934	73%	0.729	S	S	*	*	S	Bend	trans	-149.3	26.8	168.9	-128.1	-81	0	0	0	116.7
125	Q	24	Very low	27.7	Very low	156 Å²	156	147.5 Å²	147.5	73%	0.729	72%	0.716	S	S	*	*			trans	-130.7	8	-176.1	-143.9	167.3	-1.1	0	0	115.5	S127	Q125-S127 PolarHBondContact O-N 3.5Å
126	Y	27	Very low	28	Very low	215 Å²	215	145 Å²	145	84%	0.843	71%	0.707	S	S	*	*	S	Bend	trans	-84.9	3.9	-174	-113.4	-79.1	0	0	0	115.9
127	S	27.1	Very low	28.3	Very low	101 Å²	101	145.2 Å²	145.2	71%	0.706	71%	0.709	S	S	*	*	S	Bend	trans	-106.6	-21.7	-170.5	-166.2	0	0	0	0	114.7	Q125	Q125-S127 PolarHBondContact O-N 3.5Å
128	T	29	Very low	28.6	Very low	84 Å²	84	141 Å²	141	52%	0.515	69%	0.692	S	S	.	*	S	Bend	trans	-99.6	-30.7	-166.9	43.3	0	0	0	0	115.3
129	N	25.9	Very low	28.6	Very low	110 Å²	110	139.9 Å²	139.9	59%	0.588	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.2	-35.1	-172.7	-72.1	-8.1	0	0	0	113.8	I131 N132	N129-I131 PolarHBondContact O-N 3.14Å; N129-N132 PolarHBondContact O-N 3.01Å; N129-N132 VanDerWaalsContact O-N 3.09Å
130	H	32.8	Very low	28.8	Very low	131 Å²	131	140.7 Å²	140.7	61%	0.606	70%	0.698	S	S	*	*	H	α-helix	trans	-61.7	-16.9	179.9	-100.4	-59.2	0	0	0	114.6	N132 H134	H130-N132 VanDerWaalsContact C-N 3.32Å; H130-H134 PolarHBondContact O-CD2 3.13Å
131	I	35.5	Very low	29	Very low	103 Å²	103	136.9 Å²	136.9	53%	0.528	69%	0.693	S	S	.	*	H	α-helix	trans	-74.4	-21.4	178.3	-68.7	163.9	0	0	0	112.2	N129	N129-I131 PolarHBondContact O-N 3.14Å
132	N	28.8	Very low	29.4	Very low	93 Å²	93	134.2 Å²	134.2	50%	0.497	69%	0.689	S	S	.	*	H	α-helix	trans	-94.5	-37.5	-178	-73.5	-27.2	0	0	0	113.3	N129 H130 H134 K135	N129-N132 PolarHBondContact O-N 3.01Å; N129-N132 VanDerWaalsContact O-N 3.09Å; H130-N132 VanDerWaalsContact C-N 3.32Å; N132-H134 PolarHBondContact O-N 2.67Å; N132-K135 WeakPolarHBondContact O-CB 3.31Å; N132-K135 PolarHBondContact O-N 2.97Å
133	D	30.1	Very low	30.1	Very low	103 Å²	103	129.7 Å²	129.7	55%	0.551	68%	0.676	S	S	*	*	H	α-helix	trans	-67.9	-23.4	176.7	-66.1	-38.3	0	0	0	112.9	K135 T136	D133-K135 PolarHBondContact O-N 2.94Å; D133-T136 PolarHBondContact O-OG1 3.14Å; D133-T136 VanDerWaalsContact O-OG1 3.1Å
134	H	36.3	Very low	31.2	Very low	133 Å²	133	127.3 Å²	127.3	62%	0.616	66%	0.659	S	S	*	*	H	α-helix	trans	-71.7	-12.7	168.8	-88.5	-64.1	0	0	0	114.3	H130 N132	H130-H134 PolarHBondContact O-CD2 3.13Å; N132-H134 PolarHBondContact O-N 2.67Å
135	K	30.1	Very low	32.9	Very low	135 Å²	135	120.4 Å²	120.4	59%	0.587	64%	0.636	S	S	*	*	H	α-helix	trans	-90.1	-23.7	176.3	-68	175.4	-179	168.2	0	113.4	N132 D133	N132-K135 WeakPolarHBondContact O-CB 3.31Å; N132-K135 PolarHBondContact O-N 2.97Å; D133-K135 PolarHBondContact O-N 2.94Å
136	T	30	Very low	34.7	Very low	110 Å²	110	113.8 Å²	113.8	68%	0.675	61%	0.61	S	S	*	*	H	α-helix	trans	-85	-21.3	-176.9	48.6	0	0	0	0	113.5	D133 N138	D133-T136 PolarHBondContact O-OG1 3.14Å; D133-T136 VanDerWaalsContact O-OG1 3.1Å; T136-N138 VanDerWaalsContact C-N 3.35Å
137	L	34.4	Very low	36.8	Very low	147 Å²	147	106.4 Å²	106.4	77%	0.77	59%	0.588	S	S	*	*	S	Bend	trans	-80.6	-6.3	173.8	-92.4	149	0	0	0	114.8	N139	L137-N139 VanDerWaalsContact C-N 3.3Å; L137-N139 PolarHBondContact O-N 2.8Å; L137-N139 VanDerWaalsContact O-N 3.13Å
138	N	31.2	Very low	38.8	Very low	88 Å²	88	102.9 Å²	102.9	47%	0.471	57%	0.568	S	S	.	*	T	Hydrogen-bonded Turn	trans	-76.6	3.2	-164.3	-101.4	-3.3	0	0	0	117.1	T136 F143	T136-N138 VanDerWaalsContact C-N 3.35Å; N138-F143 HydrophobicContact CB-CE2 4.49Å; N138-F143 WeakPolarHBondContact OD1-CE2 3.49Å; N138-F143 VanDerWaalsContact OD1-CZ 3.3Å; N138-F143 WeakPolarHBondContact OD1-CZ 3.37Å
139	N	28.9	Very low	41.4	Very low	153 Å²	153	109 Å²	109	82%	0.818	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.1	4.9	-163.6	-109.7	6.7	0	0	0	116.6	L137	L137-N139 VanDerWaalsContact C-N 3.3Å; L137-N139 PolarHBondContact O-N 2.8Å; L137-N139 VanDerWaalsContact O-N 3.13Å
140	N	28.3	Very low	44.5	Very low	160 Å²	160	105.1 Å²	105.1	86%	0.856	56%	0.56	S	S	*	*	S	Bend	trans	-143.3	97	-177.9	-87.7	-50.9	0	0	0	114.9
141	G	29.4	Very low	47.3	Very low	66 Å²	66	98.9 Å²	98.9	68%	0.68	53%	0.531	S	S	*	.	S	Bend	trans	81.7	125.4	146.1	0	0	0	0	0	119.3
142	T	33	Very low	50	Low	130 Å²	130	96.5 Å²	96.5	80%	0.798	52%	0.516	S	S	*	.			trans	58.6	69.4	163.8	54.3	0	0	0	0	116.7	F144	T142-F144 PolarHBondContact O-N 2.61Å
143	F	40.1	Very low	53.2	Low	137 Å²	137	95.4 Å²	95.4	60%	0.601	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	14.3	-176.8	-131.1	-89.6	0	0	0	117.4	N138 I541	N138-F143 HydrophobicContact CB-CE2 4.49Å; N138-F143 WeakPolarHBondContact OD1-CE2 3.49Å; N138-F143 VanDerWaalsContact OD1-CZ 3.3Å; N138-F143 WeakPolarHBondContact OD1-CZ 3.37Å; F143-I541 HydrophobicContact CE1-CG2 4.36Å
144	F	49	Very low	56.2	Low	106 Å²	106	90.5 Å²	90.5	47%	0.465	48%	0.483	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.9	-14.5	-170	-105.2	-71.3	0	0	0	115.5	T142 Y152 I534 L538	T142-F144 PolarHBondContact O-N 2.61Å; F144-Y152 PolarHBondContact O-OH 3.44Å; F144-I534 HydrophobicContact CE1-CG2 4.01Å; F144-I534 HydrophobicContact CZ-CG2 4.07Å; F144-L538 HydrophobicContact CE1-CD2 4.32Å; F144-L538 HydrophobicContact CE1-CG 4.27Å; F144-L538 HydrophobicContact CE2-CD2 4.22Å; F144-L538 HydrophobicContact CZ-CD1 3.99Å; F144-L538 HydrophobicContact CZ-CD2 3.66Å; F144-L538 HydrophobicContact CZ-CG 3.81Å
145	C	59.8	Low	59.1	Low	67 Å²	67	84.2 Å²	84.2	45%	0.453	45%	0.454	S	S	.	.			trans	-141.1	115.6	-178.6	-58.2	0	0	0	0	109.5	Y152	C145-Y152 HydrophobicContact CB-CE2 4.18Å
146	G	61.7	Low	62.2	Low	18 Å²	18	84 Å²	84	19%	0.186	45%	0.453	C	S	.	.			trans	-56.3	164.5	160.7	0	0	0	0	0	111.8	G148 R151 E378	G146-G148 PolarHBondContact O-N 2.85Å; G146-R151 VanDerWaalsContact N-NH2 3.14Å; G146-R151 PolarHBondContact O-NH1 2.76Å; G146-R151 PolarHBondContact O-NH2 3.47Å; G146-E378 PolarHBondContact N-OE1 3.2Å
147	P	71.3	Confident	65.4	Low	59 Å²	59	79.4 Å²	79.4	38%	0.383	43%	0.425	S	S	.	.	S	Bend	trans	-55.8	133.5	-166.4	23.4	-35.3	0	0	0	113	R151 R445 E446 F449	P147-R151 PolarHBondContact O-NH1 3.15Å; P147-R445 HydrophobicContact CB-CB 4.06Å; P147-E446 WeakPolarHBondContact O-CA 3.16Å; P147-E446 VanDerWaalsContact O-CB 3.3Å; P147-E446 WeakPolarHBondContact O-CB 3.23Å; P147-E446 WeakPolarHBondContact O-CG 3.16Å; P147-F449 HydrophobicContact CG-CB 3.7Å; P147-F449 HydrophobicContact CG-CD1 4.35Å; P147-F449 HydrophobicContact CG-CD2 4.41Å; P147-F449 HydrophobicContact CG-CG 3.93Å
148	G	68.4	Low	68.3	Low	28 Å²	28	72.4 Å²	72.4	29%	0.289	39%	0.388	S	S	.	.			trans	101.2	-174.6	179	0	0	0	0	0	114.4	G146 E446	G146-G148 PolarHBondContact O-N 2.85Å; G148-E446 VanDerWaalsContact CA-OE2 3.24Å; G148-E446 WeakPolarHBondContact CA-OE2 3.41Å
149	R	84.6	Confident	71.5	Confident	212 Å²	212	68.9 Å²	68.9	80%	0.8	37%	0.37	S	S	*	.	S	Bend	trans	-146.5	-7.8	-173	-69.4	-172.8	178.6	176.3	-0.5	113.8	R151 Y152 L153 E446	R149-R151 PolarHBondContact O-N 3.42Å; R149-Y152 PolarHBondContact O-N 3.22Å; R149-L153 PolarHBondContact O-N 2.85Å; R149-E446 PolarHBondContact N-OE1 3.03Å; R149-E446 PolarHBondContact N-OE2 3.44Å
150	K	90.7	Very high	74.7	Confident	28 Å²	28	63.3 Å²	63.3	12%	0.122	34%	0.341	C	S	.	.	H	α-helix	trans	-69.9	-33.6	-167.8	-167.9	169.9	-178.7	176.2	0	112.8	Y152 L153 I154 W373 L431 D439 L442 E446	K150-Y152 VanDerWaalsContact C-N 3.32Å; K150-Y152 PolarHBondContact O-N 2.99Å; K150-L153 WeakPolarHBondContact O-CB 3.39Å; K150-L153 PolarHBondContact O-N 3.39Å; K150-L153 VanDerWaalsContact O-N 3.14Å; K150-I154 HydrophobicContact CG-CD1 4.35Å; K150-I154 WeakPolarHBondContact O-CG1 3.43Å; K150-I154 PolarHBondContact O-N 2.93Å; K150-W373 HydrophobicContact CB-CZ3 4.23Å; K150-W373 HydrophobicContact CD-CH2 4.03Å; K150-W373 HydrophobicContact CD-CZ3 4.29Å; K150-W373 HydrophobicContact CG-CH2 4.41Å; K150-W373 HydrophobicContact CG-CZ3 4.25Å; K150-L431 WeakPolarHBondContact CE-O 3.34Å; K150-L431 PolarHBondContact NZ-O 3.13Å; K150-D439 WeakPolarHBondContact CD-OD2 3.28Å; K150-D439 VanDerWaalsContact CE-OD2 3.29Å; K150-D439 WeakPolarHBondContact CE-OD2 3.12Å; K150-D439 IonicContact NZ-OD1 3.28Å; K150-D439 PolarHBondContact NZ-OD1 3.15Å; K150-D439 IonicContact NZ-OD2 2.6Å; K150-D439 PolarHBondContact NZ-OD2 2.83Å; K150-L442 HydrophobicContact CB-CD1 4.05Å; K150-L442 HydrophobicContact CD-CD1 4.17Å; K150-E446 PolarHBondContact N-OE1 3.27Å; K150-E446 VanDerWaalsContact N-OE1 3.09Å; K150-E446 PolarHBondContact N-OE2 3.36Å; K150-E446 VanDerWaalsContact N-OE2 3.07Å
151	R	91.6	Very high	77.9	Confident	1 Å²	1	55.7 Å²	55.7	0%	0.004	30%	0.3	C	S	.	.	H	α-helix	trans	-60.8	-35.6	173.3	62.3	-161.2	-172.8	-81.9	-0.3	114.1	G146 P147 R149 I154 A155 W373 E378 L382 E446	G146-R151 VanDerWaalsContact N-NH2 3.14Å; G146-R151 PolarHBondContact O-NH1 2.76Å; G146-R151 PolarHBondContact O-NH2 3.47Å; P147-R151 PolarHBondContact O-NH1 3.15Å; R149-R151 PolarHBondContact O-N 3.42Å; R151-I154 PolarHBondContact O-N 3.42Å; R151-A155 PolarHBondContact O-N 2.96Å; R151-W373 HydrophobicContact CB-CB 4.39Å; R151-W373 HydrophobicContact CB-CE3 4.31Å; R151-W373 VanDerWaalsContact CB-O 3.26Å; R151-W373 WeakPolarHBondContact CB-O 3.5Å; R151-E378 IonicContact CZ-OE1 2.78Å; R151-E378 IonicContact CZ-OE2 3.12Å; R151-E378 IonicContact NE-OE2 2.82Å; R151-E378 PolarHBondContact NE-OE2 3.11Å; R151-E378 VanDerWaalsContact NH2-CD 3.27Å; R151-E378 IonicContact NH2-OE1 2.63Å; R151-E378 PolarHBondContact NH2-OE1 3.24Å; R151-E378 IonicContact NH2-OE2 2.98Å; R151-E378 PolarHBondContact NH2-OE2 2.97Å; R151-L382 HydrophobicContact CB-CD1 4.29Å; R151-L382 HydrophobicContact CB-CD2 4.37Å; R151-L382 HydrophobicContact CG-CD1 4.1Å; R151-L382 HydrophobicContact CG-CD2 4.24Å; R151-E446 IonicContact CZ-OE1 3.81Å; R151-E446 PolarHBondContact N-OE1 3.47Å; R151-E446 IonicContact NH1-OE1 3.65Å; R151-E446 PolarHBondContact NH1-OE1 3.13Å
152	Y	93.3	Very high	81.1	Confident	53 Å²	53	52.6 Å²	52.6	21%	0.208	27%	0.269	C	S	.	.	H	α-helix	trans	-72.3	-34.6	173.4	-69.2	-84.6	0	0	0	112.4	F144 C145 R149 K150 I154 A155 F156 E378 T381 L382 L385	F144-Y152 PolarHBondContact O-OH 3.44Å; C145-Y152 HydrophobicContact CB-CE2 4.18Å; R149-Y152 PolarHBondContact O-N 3.22Å; K150-Y152 VanDerWaalsContact C-N 3.32Å; K150-Y152 PolarHBondContact O-N 2.99Å; Y152-I154 VanDerWaalsContact C-N 3.33Å; Y152-A155 PolarHBondContact O-N 3.31Å; Y152-F156 WeakPolarHBondContact O-CB 3.44Å; Y152-F156 PolarHBondContact O-N 3.38Å; Y152-E378 PolarHBondContact OH-OE2 3.33Å; Y152-T381 HydrophobicContact CE1-CG2 4.36Å; Y152-L382 HydrophobicContact CD1-CD2 3.7Å; Y152-L382 HydrophobicContact CD2-CD2 4.4Å; Y152-L382 HydrophobicContact CE1-CD2 3.82Å; Y152-L382 HydrophobicContact CE1-CG 4.47Å; Y152-L382 HydrophobicContact CE2-CD2 4.49Å; Y152-L382 HydrophobicContact CG-CD2 4.01Å; Y152-L385 HydrophobicContact CD1-CD1 4.02Å; Y152-L385 HydrophobicContact CE1-CD1 4.24Å
153	L	94	Very high	84.1	Confident	70 Å²	70	47.5 Å²	47.5	37%	0.366	24%	0.237	S	C	.	.	H	α-helix	trans	-62.6	-40.3	170.3	176.9	63.9	0	0	0	111.4	R149 K150 F156 L157	R149-L153 PolarHBondContact O-N 2.85Å; K150-L153 WeakPolarHBondContact O-CB 3.39Å; K150-L153 PolarHBondContact O-N 3.39Å; K150-L153 VanDerWaalsContact O-N 3.14Å; L153-F156 PolarHBondContact O-N 2.85Å; L153-L157 HydrophobicContact CD1-CD1 4.15Å; L153-L157 HydrophobicContact CD1-CG 4.28Å; L153-L157 HydrophobicContact CG-CD1 4.05Å; L153-L157 WeakPolarHBondContact O-CB 3.26Å; L153-L157 WeakPolarHBondContact O-CG 3.19Å; L153-L157 PolarHBondContact O-N 3.3Å
154	I	94.7	Very high	86.7	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-62.9	-48.7	174.6	-70.5	166.3	0	0	0	110.6	K150 R151 Y152 F156 L157 C158 I369 W373 W428 I432	K150-I154 HydrophobicContact CG-CD1 4.35Å; K150-I154 WeakPolarHBondContact O-CG1 3.43Å; K150-I154 PolarHBondContact O-N 2.93Å; R151-I154 PolarHBondContact O-N 3.42Å; Y152-I154 VanDerWaalsContact C-N 3.33Å; I154-F156 VanDerWaalsContact C-N 3.32Å; I154-F156 PolarHBondContact O-N 3.15Å; I154-L157 PolarHBondContact O-N 3.26Å; I154-L157 VanDerWaalsContact O-N 3.14Å; I154-C158 PolarHBondContact O-N 3.33Å; I154-C158 PolarHBondContact O-SG 3.1Å; I154-I369 HydrophobicContact CG2-CG2 3.85Å; I154-W373 HydrophobicContact CD1-CB 4.39Å; I154-W373 HydrophobicContact CD1-CD2 3.26Å; I154-W373 HydrophobicContact CD1-CE3 3.6Å; I154-W373 HydrophobicContact CD1-CG 3.63Å; I154-W373 HydrophobicContact CD1-CH2 4.12Å; I154-W373 HydrophobicContact CD1-CZ2 3.83Å; I154-W373 HydrophobicContact CD1-CZ3 4.02Å; I154-W428 HydrophobicContact CG2-CH2 4.37Å; I154-I432 HydrophobicContact CD1-CD1 4.19Å; I154-I432 HydrophobicContact CD1-CG2 3.96Å; I154-I432 HydrophobicContact CG1-CD1 3.44Å; I154-I432 VanDerWaalsContact CG1-CD1 3.44Å; I154-I432 HydrophobicContact CG1-CG1 4.05Å; I154-I432 HydrophobicContact CG1-CG2 3.84Å
155	A	95.6	Very high	88.8	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-59.1	-42.2	177.4	0	0	0	0	0	112.4	R151 Y152 C158 C159 L382 L385 S386	R151-A155 PolarHBondContact O-N 2.96Å; Y152-A155 PolarHBondContact O-N 3.31Å; A155-C158 PolarHBondContact O-N 3.06Å; A155-C159 VanDerWaalsContact O-CB 3.31Å; A155-C159 WeakPolarHBondContact O-CB 3.43Å; A155-C159 PolarHBondContact O-N 3.26Å; A155-L382 HydrophobicContact CB-CD2 4.05Å; A155-L385 HydrophobicContact CB-CB 4.13Å; A155-S386 WeakPolarHBondContact CA-OG 3.32Å; A155-S386 WeakPolarHBondContact CB-OG 3.46Å
156	F	96.1	Very high	90.3	Very high	131 Å²	131	34.4 Å²	34.4	58%	0.575	17%	0.174	S	C	*	.	H	α-helix	trans	-63.9	-40.4	174.1	177.7	-96.6	0	0	0	112.9	Y152 L153 I154 C159 T160	Y152-F156 WeakPolarHBondContact O-CB 3.44Å; Y152-F156 PolarHBondContact O-N 3.38Å; L153-F156 PolarHBondContact O-N 2.85Å; I154-F156 VanDerWaalsContact C-N 3.32Å; I154-F156 PolarHBondContact O-N 3.15Å; F156-C159 WeakPolarHBondContact O-CB 3.26Å; F156-C159 PolarHBondContact O-N 3.24Å; F156-T160 HydrophobicContact CD1-CG2 4.46Å; F156-T160 HydrophobicContact CE1-CG2 3.94Å; F156-T160 HydrophobicContact CE2-CG2 4.23Å; F156-T160 HydrophobicContact CZ-CG2 3.81Å; F156-T160 PolarHBondContact O-N 3.36Å; F156-T160 PolarHBondContact O-OG1 3.47Å
157	L	96.6	Very high	91.5	Very high	14 Å²	14	33.6 Å²	33.6	7%	0.073	17%	0.165	C	C	.	.	H	α-helix	trans	-67.9	-42.8	177	-75.5	171	0	0	0	111.9	L153 I154 C159 T160 C161 W424 W428 I432	L153-L157 HydrophobicContact CD1-CD1 4.15Å; L153-L157 HydrophobicContact CD1-CG 4.28Å; L153-L157 HydrophobicContact CG-CD1 4.05Å; L153-L157 WeakPolarHBondContact O-CB 3.26Å; L153-L157 WeakPolarHBondContact O-CG 3.19Å; L153-L157 PolarHBondContact O-N 3.3Å; I154-L157 PolarHBondContact O-N 3.26Å; I154-L157 VanDerWaalsContact O-N 3.14Å; L157-C159 VanDerWaalsContact C-N 3.3Å; L157-C159 PolarHBondContact O-N 3.45Å; L157-T160 WeakPolarHBondContact CA-OG1 3.39Å; L157-T160 PolarHBondContact O-N 2.82Å; L157-T160 PolarHBondContact O-OG1 3.3Å; L157-C161 PolarHBondContact O-N 3.06Å; L157-W424 HydrophobicContact CB-CZ2 4.22Å; L157-W424 VanDerWaalsContact O-CZ2 3.28Å; L157-W424 WeakPolarHBondContact O-CZ2 3.49Å; L157-W424 PolarHBondContact O-NE1 2.67Å; L157-W428 HydrophobicContact CB-CE3 3.74Å; L157-W428 HydrophobicContact CB-CZ3 3.63Å; L157-W428 HydrophobicContact CD1-CE3 4.09Å; L157-W428 HydrophobicContact CD1-CZ3 4.34Å; L157-W428 HydrophobicContact CG-CE3 4.47Å; L157-I432 HydrophobicContact CD1-CD1 3.96Å; L157-I432 HydrophobicContact CD1-CG1 3.78Å
158	C	96.9	Very high	92.3	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-58.8	-41.6	171.7	-67.7	0	0	0	0	111.9	I154 A155 C161 L162 V366	I154-C158 PolarHBondContact O-N 3.33Å; I154-C158 PolarHBondContact O-SG 3.1Å; A155-C158 PolarHBondContact O-N 3.06Å; C158-C161 PolarHBondContact O-SG 3.49Å; C158-L162 WeakPolarHBondContact O-CB 3.43Å; C158-L162 WeakPolarHBondContact O-CD1 3.25Å; C158-L162 WeakPolarHBondContact O-CG 3.26Å; C158-L162 PolarHBondContact O-N 3.08Å; C158-L162 VanDerWaalsContact O-N 3.12Å; C158-V366 HydrophobicContact CB-CG1 4.02Å; C158-V366 HydrophobicContact CB-CG2 4.15Å
159	C	96.9	Very high	93	Very high	13 Å²	13	32.3 Å²	32.3	9%	0.088	14%	0.144	C	C	.	.	H	α-helix	trans	-63.4	-41.2	176	-171.6	0	0	0	0	112.3	A155 F156 L157 T163 L385 S386 G389	A155-C159 VanDerWaalsContact O-CB 3.31Å; A155-C159 WeakPolarHBondContact O-CB 3.43Å; A155-C159 PolarHBondContact O-N 3.26Å; F156-C159 WeakPolarHBondContact O-CB 3.26Å; F156-C159 PolarHBondContact O-N 3.24Å; L157-C159 VanDerWaalsContact C-N 3.3Å; L157-C159 PolarHBondContact O-N 3.45Å; C159-T163 WeakPolarHBondContact O-CB 3.33Å; C159-T163 PolarHBondContact O-N 3.33Å; C159-T163 PolarHBondContact O-OG1 2.64Å; C159-L385 VanDerWaalsContact CB-O 3.26Å; C159-L385 WeakPolarHBondContact CB-O 3.48Å; C159-L385 PolarHBondContact SG-O 3.15Å; C159-L385 VanDerWaalsContact SG-O 3.4Å; C159-S386 VanDerWaalsContact CA-O 3.24Å; C159-S386 WeakPolarHBondContact CA-O 3.39Å; C159-S386 PolarHBondContact N-O 3.16Å; C159-G389 WeakPolarHBondContact O-CA 3.45Å; C159-G389 PolarHBondContact SG-N 2.79Å; C159-G389 VanDerWaalsContact SG-N 3.37Å
160	T	96.5	Very high	92.6	Very high	36 Å²	36	22.7 Å²	22.7	22%	0.221	11%	0.109	C	C	.	.	H	α-helix	trans	-70.4	-41.1	179.2	44.1	0	0	0	0	112.9	F156 L157 L162 T163 I164 W424	F156-T160 HydrophobicContact CD1-CG2 4.46Å; F156-T160 HydrophobicContact CE1-CG2 3.94Å; F156-T160 HydrophobicContact CE2-CG2 4.23Å; F156-T160 HydrophobicContact CZ-CG2 3.81Å; F156-T160 PolarHBondContact O-N 3.36Å; F156-T160 PolarHBondContact O-OG1 3.47Å; L157-T160 WeakPolarHBondContact CA-OG1 3.39Å; L157-T160 PolarHBondContact O-N 2.82Å; L157-T160 PolarHBondContact O-OG1 3.3Å; T160-L162 PolarHBondContact O-N 3.04Å; T160-T163 WeakPolarHBondContact O-CB 3.43Å; T160-T163 PolarHBondContact O-N 3.49Å; T160-I164 WeakPolarHBondContact O-CD1 3.28Å; T160-I164 VanDerWaalsContact O-CG1 3.22Å; T160-I164 WeakPolarHBondContact O-CG1 3.48Å; T160-I164 PolarHBondContact O-N 2.93Å; T160-W424 PolarHBondContact OG1-NE1 3.12Å; T160-W424 VanDerWaalsContact OG1-NE1 3.1Å
161	C	96.3	Very high	91.9	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-65.9	-39.1	174	61.9	0	0	0	0	112.8	L157 C158 T163 I164 V165 V321 W424	L157-C161 PolarHBondContact O-N 3.06Å; C158-C161 PolarHBondContact O-SG 3.49Å; C161-T163 VanDerWaalsContact C-N 3.32Å; C161-T163 PolarHBondContact O-N 3.03Å; C161-I164 PolarHBondContact O-N 3.27Å; C161-V165 WeakPolarHBondContact O-CB 3.49Å; C161-V165 WeakPolarHBondContact O-CG2 3.4Å; C161-V165 PolarHBondContact O-N 3.47Å; C161-V321 HydrophobicContact CB-CG2 3.86Å; C161-W424 HydrophobicContact CB-CD2 3.83Å; C161-W424 HydrophobicContact CB-CE3 3.97Å; C161-W424 HydrophobicContact CB-CH2 3.69Å; C161-W424 HydrophobicContact CB-CZ2 3.48Å; C161-W424 VanDerWaalsContact CB-CZ2 3.48Å; C161-W424 HydrophobicContact CB-CZ3 3.92Å; C161-W424 VanDerWaalsContact SG-CZ2 3.57Å
162	L	96.1	Very high	90.9	Very high	2 Å²	2	21.5 Å²	21.5	1%	0.01	10%	0.104	C	C	.	.	H	α-helix	trans	-59.3	-44	172.5	-83.7	164.3	0	0	0	111.3	C158 T160 I166 L362 I363 S386 V390	C158-L162 WeakPolarHBondContact O-CB 3.43Å; C158-L162 WeakPolarHBondContact O-CD1 3.25Å; C158-L162 WeakPolarHBondContact O-CG 3.26Å; C158-L162 PolarHBondContact O-N 3.08Å; C158-L162 VanDerWaalsContact O-N 3.12Å; T160-L162 PolarHBondContact O-N 3.04Å; L162-I166 HydrophobicContact CD2-CD1 3.77Å; L162-I166 VanDerWaalsContact O-CB 3.25Å; L162-I166 WeakPolarHBondContact O-CB 3.31Å; L162-I166 WeakPolarHBondContact O-CG1 3.41Å; L162-I166 PolarHBondContact O-N 2.88Å; L162-L362 HydrophobicContact CD2-CD2 3.78Å; L162-L362 HydrophobicContact CG-CD2 4.02Å; L162-I363 HydrophobicContact CD2-CD1 4.32Å; L162-I363 HydrophobicContact CD2-CG1 3.97Å; L162-S386 VanDerWaalsContact CD1-O 3.28Å; L162-S386 WeakPolarHBondContact CD1-O 3.33Å; L162-V390 HydrophobicContact CD1-CG2 4.49Å; L162-V390 HydrophobicContact CD2-CG2 3.97Å
163	T	95.8	Very high	89.5	Confident	22 Å²	22	20.4 Å²	20.4	14%	0.135	10%	0.101	C	C	.	.	H	α-helix	trans	-62.2	-43.9	176.8	-55.5	0	0	0	0	112.1	C159 T160 C161 G167 G389 L392 I396	C159-T163 WeakPolarHBondContact O-CB 3.33Å; C159-T163 PolarHBondContact O-N 3.33Å; C159-T163 PolarHBondContact O-OG1 2.64Å; T160-T163 WeakPolarHBondContact O-CB 3.43Å; T160-T163 PolarHBondContact O-N 3.49Å; C161-T163 VanDerWaalsContact C-N 3.32Å; C161-T163 PolarHBondContact O-N 3.03Å; T163-G167 VanDerWaalsContact O-CA 3.32Å; T163-G167 WeakPolarHBondContact O-CA 3.35Å; T163-G167 PolarHBondContact O-N 3.16Å; T163-G389 VanDerWaalsContact OG1-CA 3.29Å; T163-G389 WeakPolarHBondContact OG1-CA 3.3Å; T163-L392 HydrophobicContact CG2-CB 3.76Å; T163-I396 HydrophobicContact CG2-CD1 4.07Å
164	I	94.8	Very high	87.9	Confident	13 Å²	13	17.1 Å²	17.1	7%	0.067	9%	0.085	C	C	.	.	H	α-helix	trans	-65.1	-56	179.6	-67.5	160.9	0	0	0	110.2	T160 C161 G167 M168 Y417 L420 W424	T160-I164 WeakPolarHBondContact O-CD1 3.28Å; T160-I164 VanDerWaalsContact O-CG1 3.22Å; T160-I164 WeakPolarHBondContact O-CG1 3.48Å; T160-I164 PolarHBondContact O-N 2.93Å; C161-I164 PolarHBondContact O-N 3.27Å; I164-G167 PolarHBondContact O-N 2.77Å; I164-M168 HydrophobicContact CG2-SD 4.43Å; I164-M168 WeakPolarHBondContact O-CG 3.36Å; I164-M168 PolarHBondContact O-N 3.46Å; I164-Y417 HydrophobicContact CG2-CD1 4.22Å; I164-Y417 WeakPolarHBondContact O-CD1 3.31Å; I164-L420 HydrophobicContact CD1-CD2 4.32Å; I164-L420 HydrophobicContact CD1-CG 3.89Å; I164-L420 HydrophobicContact CG1-CD2 3.93Å; I164-L420 HydrophobicContact CG1-CG 4.03Å; I164-W424 HydrophobicContact CD1-CB 4.11Å; I164-W424 HydrophobicContact CD1-CG 4.31Å
165	V	93.7	Very high	86.6	Confident	2 Å²	2	17.2 Å²	17.2	1%	0.012	9%	0.085	C	C	.	.	H	α-helix	trans	-72.2	-35	-171.4	173	0	0	0	0	112.7	C161 V321 T324 E359 L362	C161-V165 WeakPolarHBondContact O-CB 3.49Å; C161-V165 WeakPolarHBondContact O-CG2 3.4Å; C161-V165 PolarHBondContact O-N 3.47Å; V165-V321 HydrophobicContact CG2-CG1 4.11Å; V165-V321 HydrophobicContact CG2-CG2 4.31Å; V165-T324 HydrophobicContact CG1-CG2 3.99Å; V165-E359 HydrophobicContact CG1-CG 3.71Å; V165-L362 HydrophobicContact CB-CD1 3.86Å; V165-L362 HydrophobicContact CG1-CD1 3.71Å; V165-L362 HydrophobicContact CG2-CD1 3.92Å
166	I	90.2	Very high	85.1	Confident	21 Å²	21	18.2 Å²	18.2	11%	0.108	9%	0.09	C	C	.	.	H	α-helix	trans	-79.6	-32.5	174.4	-61.6	172.9	0	0	0	110.3	L162 R169 V390 P394	L162-I166 HydrophobicContact CD2-CD1 3.77Å; L162-I166 VanDerWaalsContact O-CB 3.25Å; L162-I166 WeakPolarHBondContact O-CB 3.31Å; L162-I166 WeakPolarHBondContact O-CG1 3.41Å; L162-I166 PolarHBondContact O-N 2.88Å; I166-R169 WeakPolarHBondContact O-CB 3.37Å; I166-R169 PolarHBondContact O-N 2.82Å; I166-V390 HydrophobicContact CD1-CB 4.07Å; I166-V390 HydrophobicContact CD1-CG1 4.16Å; I166-V390 HydrophobicContact CD1-CG2 3.78Å; I166-P394 HydrophobicContact CG2-CG 4.4Å
167	G	88.3	Confident	83.4	Confident	0 Å²	0	12.4 Å²	12.4	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-60.5	-42	172.9	0	0	0	0	0	113.1	T163 I164 R169 S170 G393	T163-G167 VanDerWaalsContact O-CA 3.32Å; T163-G167 WeakPolarHBondContact O-CA 3.35Å; T163-G167 PolarHBondContact O-N 3.16Å; I164-G167 PolarHBondContact O-N 2.77Å; G167-R169 PolarHBondContact O-N 2.94Å; G167-R169 VanDerWaalsContact O-N 3.13Å; G167-S170 WeakPolarHBondContact O-CB 3.09Å; G167-S170 PolarHBondContact O-N 2.67Å; G167-S170 PolarHBondContact O-OG 2.98Å; G167-G393 WeakPolarHBondContact CA-O 3.4Å
168	M	87.7	Confident	81.8	Confident	2 Å²	2	12 Å²	12	1%	0.01	6%	0.064	C	C	.	.	H	α-helix	trans	-46.5	-41.3	173.6	-82.2	165.6	48.9	0	0	112.9	I164 S170 E171 T324 C325 N328 Y417	I164-M168 HydrophobicContact CG2-SD 4.43Å; I164-M168 WeakPolarHBondContact O-CG 3.36Å; I164-M168 PolarHBondContact O-N 3.46Å; M168-S170 PolarHBondContact O-N 2.72Å; M168-E171 WeakPolarHBondContact O-CB 3.27Å; M168-E171 WeakPolarHBondContact O-CG 3.11Å; M168-E171 PolarHBondContact O-N 2.78Å; M168-T324 HydrophobicContact CE-CG2 3.78Å; M168-C325 VanDerWaalsContact SD-SG 3.67Å; M168-N328 HydrophobicContact CE-CB 3.78Å; M168-N328 VanDerWaalsContact CE-CG 3.47Å; M168-Y417 HydrophobicContact CG-CD1 3.61Å; M168-Y417 HydrophobicContact CG-CG 3.62Å
169	R	81.9	Confident	80.1	Confident	59 Å²	59	12.2 Å²	12.2	22%	0.223	7%	0.065	C	C	.	.	G	3₁₀ helix	trans	-56.1	-21.9	-178.3	-59.1	179.3	178.6	178.2	-3.4	113.3	I166 G167 M172 E359	I166-R169 WeakPolarHBondContact O-CB 3.37Å; I166-R169 PolarHBondContact O-N 2.82Å; G167-R169 PolarHBondContact O-N 2.94Å; G167-R169 VanDerWaalsContact O-N 3.13Å; R169-M172 WeakPolarHBondContact O-CB 3.17Å; R169-E359 IonicContact CZ-OE2 3.81Å; R169-E359 VanDerWaalsContact CZ-OE2 3.31Å; R169-E359 IonicContact NE-OE2 2.72Å; R169-E359 PolarHBondContact NE-OE2 2.76Å; R169-E359 VanDerWaalsContact NE-OE2 3.12Å; R169-E359 IonicContact NH2-OE2 3.44Å; R169-E359 PolarHBondContact NH2-OE2 3.42Å
170	S	76.6	Confident	78.4	Confident	9 Å²	9	14.4 Å²	14.4	6%	0.063	8%	0.075	C	C	.	.	G	3₁₀ helix	trans	-65.2	-34	174.8	-46.3	0	0	0	0	113.6	G167 M168 M172 G397	G167-S170 WeakPolarHBondContact O-CB 3.09Å; G167-S170 PolarHBondContact O-N 2.67Å; G167-S170 PolarHBondContact O-OG 2.98Å; M168-S170 PolarHBondContact O-N 2.72Å; S170-M172 PolarHBondContact O-N 2.8Å; S170-M172 VanDerWaalsContact O-N 3.15Å; S170-G397 WeakPolarHBondContact OG-CA 3.49Å
171	E	75.9	Confident	76.6	Confident	0 Å²	0	14 Å²	14	0%	0	7%	0.072	C	C	.	.	G	3₁₀ helix	trans	-70	-9.7	-175.9	82.7	-155.3	159.8	0	0	113.7	M168 L173 G174 N328 V413 F414	M168-E171 WeakPolarHBondContact O-CB 3.27Å; M168-E171 WeakPolarHBondContact O-CG 3.11Å; M168-E171 PolarHBondContact O-N 2.78Å; E171-L173 PolarHBondContact O-N 3.23Å; E171-G174 PolarHBondContact O-N 2.91Å; E171-N328 PolarHBondContact OE1-ND2 2.95Å; E171-N328 PolarHBondContact OE1-OD1 3.08Å; E171-N328 VanDerWaalsContact OE1-OD1 3.12Å; E171-N328 PolarHBondContact OE2-ND2 3.36Å; E171-V413 HydrophobicContact CB-CB 4.06Å; E171-V413 HydrophobicContact CB-CG1 3.42Å; E171-V413 VanDerWaalsContact CB-CG1 3.42Å; E171-F414 HydrophobicContact CB-CE2 4.22Å; E171-F414 HydrophobicContact CB-CZ 4.39Å; E171-F414 HydrophobicContact CG-CD1 4Å; E171-F414 HydrophobicContact CG-CD2 4.14Å; E171-F414 HydrophobicContact CG-CE1 3.63Å; E171-F414 HydrophobicContact CG-CE2 3.76Å; E171-F414 HydrophobicContact CG-CG 4.24Å; E171-F414 HydrophobicContact CG-CZ 3.51Å; E171-F414 WeakPolarHBondContact OE2-CA 3.09Å
172	M	71.9	Confident	74.7	Confident	5 Å²	5	16 Å²	16	3%	0.025	8%	0.084	C	C	.	.	H	α-helix	trans	-69.6	-20.1	-174.1	-166.8	157.9	-171.2	0	0	113.5	R169 S170 G174 I175 I176 V289 E290	R169-M172 WeakPolarHBondContact O-CB 3.17Å; S170-M172 PolarHBondContact O-N 2.8Å; S170-M172 VanDerWaalsContact O-N 3.15Å; M172-G174 VanDerWaalsContact C-N 3.29Å; M172-G174 PolarHBondContact O-N 3.37Å; M172-I175 PolarHBondContact O-N 3.08Å; M172-I176 HydrophobicContact CE-CD1 4.44Å; M172-I176 HydrophobicContact CG-CD1 3.83Å; M172-I176 HydrophobicContact CG-CG1 4.13Å; M172-I176 WeakPolarHBondContact O-CB 3.49Å; M172-I176 WeakPolarHBondContact O-CG1 3.44Å; M172-I176 PolarHBondContact O-N 2.98Å; M172-V289 VanDerWaalsContact CE-C 3.47Å; M172-V289 HydrophobicContact CE-CB 3.95Å; M172-V289 HydrophobicContact CE-CG1 3.52Å; M172-E290 VanDerWaalsContact CE-CA 3.45Å; M172-E290 HydrophobicContact CE-CB 4.09Å; M172-E290 HydrophobicContact SD-CB 4.16Å; M172-E290 HydrophobicContact SD-CG 4.03Å
173	L	64.1	Low	72.5	Confident	29 Å²	29	18 Å²	18	15%	0.152	10%	0.095	C	C	.	.	H	α-helix	trans	-51.3	-46.6	170.3	-89.1	130	0	0	0	112	E171 I176 T177 R276	E171-L173 PolarHBondContact O-N 3.23Å; L173-I176 PolarHBondContact O-N 3.07Å; L173-T177 PolarHBondContact O-N 3.4Å; L173-T177 PolarHBondContact O-OG1 3.31Å; L173-R276 HydrophobicContact CD2-CB 3.93Å
174	G	60.2	Low	70.1	Confident	2 Å²	2	20.4 Å²	20.4	2%	0.021	11%	0.11	C	C	.	.	H	α-helix	trans	-55	-54.9	179.7	0	0	0	0	0	113.4	E171 M172 T177 N178	E171-G174 PolarHBondContact O-N 2.91Å; M172-G174 VanDerWaalsContact C-N 3.29Å; M172-G174 PolarHBondContact O-N 3.37Å; G174-T177 PolarHBondContact O-N 2.93Å; G174-N178 WeakPolarHBondContact O-CB 3.46Å; G174-N178 PolarHBondContact O-N 2.72Å
175	I	66.7	Low	67.5	Low	2 Å²	2	27.4 Å²	27.4	1%	0.01	14%	0.135	C	C	.	.	H	α-helix	trans	-63.3	-46.2	178.6	-72.8	-177.5	0	0	0	111.4	M172 T177 N178 L179 L331 I348 W410 F414	M172-I175 PolarHBondContact O-N 3.08Å; I175-T177 VanDerWaalsContact C-N 3.28Å; I175-T177 PolarHBondContact O-N 3.31Å; I175-N178 PolarHBondContact O-N 2.82Å; I175-L179 HydrophobicContact CG2-CD1 3.71Å; I175-L179 HydrophobicContact CG2-CG 4.18Å; I175-L179 WeakPolarHBondContact O-CB 3.36Å; I175-L179 WeakPolarHBondContact O-CG 3.46Å; I175-L179 PolarHBondContact O-N 3.48Å; I175-L331 HydrophobicContact CD1-CB 4.12Å; I175-I348 HydrophobicContact CG2-CD1 4.23Å; I175-W410 HydrophobicContact CD1-CZ3 4.05Å; I175-W410 HydrophobicContact CG1-CE3 3.77Å; I175-W410 HydrophobicContact CG1-CH2 4.31Å; I175-W410 HydrophobicContact CG1-CZ3 3.58Å; I175-F414 HydrophobicContact CB-CZ 4.45Å; I175-F414 HydrophobicContact CD1-CE1 3.56Å; I175-F414 HydrophobicContact CD1-CE2 3.98Å; I175-F414 HydrophobicContact CD1-CZ 3.21Å; I175-F414 HydrophobicContact CG1-CE1 4.38Å; I175-F414 HydrophobicContact CG1-CE2 3.96Å; I175-F414 HydrophobicContact CG1-CZ 3.53Å
176	I	64.8	Low	65.2	Low	20 Å²	20	31 Å²	31	10%	0.103	15%	0.154	C	C	.	.	H	α-helix	trans	-56.8	-44.3	-178.5	-76.9	176.8	0	0	0	110.9	M172 L173 N180 N286 E290	M172-I176 HydrophobicContact CE-CD1 4.44Å; M172-I176 HydrophobicContact CG-CD1 3.83Å; M172-I176 HydrophobicContact CG-CG1 4.13Å; M172-I176 WeakPolarHBondContact O-CB 3.49Å; M172-I176 WeakPolarHBondContact O-CG1 3.44Å; M172-I176 PolarHBondContact O-N 2.98Å; L173-I176 PolarHBondContact O-N 3.07Å; I176-N180 PolarHBondContact O-N 3.47Å; I176-N286 HydrophobicContact CG1-CB 4.31Å; I176-N286 HydrophobicContact CG2-CB 4.07Å; I176-N286 PolarHBondContact O-ND2 3.22Å; I176-N286 VanDerWaalsContact O-ND2 3.16Å; I176-E290 HydrophobicContact CD1-CB 4.22Å
177	T	60.4	Low	62.7	Low	9 Å²	9	34.4 Å²	34.4	6%	0.055	18%	0.175	C	C	.	.	H	α-helix	trans	-79.4	-26.5	-178.2	-53.7	0	0	0	0	113.3	L173 G174 I175 N180 N181 E274	L173-T177 PolarHBondContact O-N 3.4Å; L173-T177 PolarHBondContact O-OG1 3.31Å; G174-T177 PolarHBondContact O-N 2.93Å; I175-T177 VanDerWaalsContact C-N 3.28Å; I175-T177 PolarHBondContact O-N 3.31Å; T177-N180 PolarHBondContact O-N 3.06Å; T177-N181 WeakPolarHBondContact O-CB 3.31Å; T177-N181 PolarHBondContact O-N 3.08Å; T177-N181 PolarHBondContact O-ND2 3.4Å; T177-N181 VanDerWaalsContact O-ND2 3.11Å; T177-E274 HydrophobicContact CG2-CB 3.59Å; T177-E274 HydrophobicContact CG2-CG 4.2Å; T177-E274 PolarHBondContact OG1-O 3.09Å; T177-E274 VanDerWaalsContact OG1-O 3.09Å
178	N	62.4	Low	60.2	Low	7 Å²	7	41 Å²	41	4%	0.037	20%	0.204	C	C	.	.	H	α-helix	trans	-73.4	-36.5	174.1	-151.7	28.2	0	0	0	112.3	G174 I175 N181 T182 L268 E335 W410	G174-N178 WeakPolarHBondContact O-CB 3.46Å; G174-N178 PolarHBondContact O-N 2.72Å; I175-N178 PolarHBondContact O-N 2.82Å; N178-N181 PolarHBondContact O-N 2.78Å; N178-T182 WeakPolarHBondContact O-CB 3.17Å; N178-T182 PolarHBondContact O-N 3.46Å; N178-T182 PolarHBondContact O-OG1 3.23Å; N178-L268 WeakPolarHBondContact OD1-CD2 3.16Å; N178-E335 PolarHBondContact ND2-OE1 3.32Å; N178-E335 PolarHBondContact ND2-OE2 2.96Å; N178-W410 PolarHBondContact ND2-NE1 2.84Å
179	L	61.6	Low	57.8	Low	4 Å²	4	42.5 Å²	42.5	2%	0.021	22%	0.22	C	C	.	.	H	α-helix	trans	-60.4	-43.3	169.3	-71.8	170.7	0	0	0	111.6	I175 T182 N183 I341 L345 I348	I175-L179 HydrophobicContact CG2-CD1 3.71Å; I175-L179 HydrophobicContact CG2-CG 4.18Å; I175-L179 WeakPolarHBondContact O-CB 3.36Å; I175-L179 WeakPolarHBondContact O-CG 3.46Å; I175-L179 PolarHBondContact O-N 3.48Å; L179-T182 PolarHBondContact O-N 3.06Å; L179-N183 PolarHBondContact O-N 3.46Å; L179-N183 PolarHBondContact O-ND2 3.02Å; L179-I341 HydrophobicContact CD2-CD1 4.24Å; L179-L345 HydrophobicContact CD1-CD2 3.85Å; L179-L345 HydrophobicContact CD2-CD2 3.89Å; L179-L345 HydrophobicContact CD2-CG 4.42Å; L179-L345 HydrophobicContact CG-CD2 4.44Å; L179-I348 HydrophobicContact CD1-CD1 4.31Å; L179-I348 HydrophobicContact CD2-CD1 4.24Å
180	N	60.5	Low	55.8	Low	58 Å²	58	44.4 Å²	44.4	31%	0.31	23%	0.234	S	C	.	.	H	α-helix	trans	-60.5	-47.7	173.6	-84.4	-12.4	0	0	0	112.4	I176 T177 T182 N183 T184 N286	I176-N180 PolarHBondContact O-N 3.47Å; T177-N180 PolarHBondContact O-N 3.06Å; N180-T182 PolarHBondContact O-N 2.83Å; N180-N183 PolarHBondContact O-N 3.06Å; N180-T184 PolarHBondContact O-N 3.01Å; N180-T184 PolarHBondContact O-OG1 3.04Å; N180-N286 VanDerWaalsContact CG-ND2 3.27Å; N180-N286 PolarHBondContact ND2-ND2 2.89Å; N180-N286 PolarHBondContact OD1-ND2 3.49Å
181	N	59	Low	53.8	Low	28 Å²	28	50.6 Å²	50.6	15%	0.15	26%	0.26	C	S	.	.	H	α-helix	trans	-59.9	-32.8	176.8	-97.5	-89.1	0	0	0	113.3	T177 N178 T184 R185 K271 E274	T177-N181 WeakPolarHBondContact O-CB 3.31Å; T177-N181 PolarHBondContact O-N 3.08Å; T177-N181 PolarHBondContact O-ND2 3.4Å; T177-N181 VanDerWaalsContact O-ND2 3.11Å; N178-N181 PolarHBondContact O-N 2.78Å; N181-T184 PolarHBondContact O-OG1 2.95Å; N181-R185 WeakPolarHBondContact O-CG 3.35Å; N181-R185 PolarHBondContact O-N 3.26Å; N181-K271 PolarHBondContact ND2-NZ 3.12Å; N181-K271 VanDerWaalsContact ND2-NZ 3.16Å; N181-K271 PolarHBondContact OD1-NZ 3.28Å; N181-E274 PolarHBondContact ND2-OE1 3.43Å; N181-E274 PolarHBondContact OD1-OE1 3.44Å
182	T	55.5	Low	51.8	Low	42 Å²	42	59.1 Å²	59.1	26%	0.258	29%	0.293	S	S	.	.	H	α-helix	trans	-76.7	-41.2	178.6	-53.8	0	0	0	0	111.2	N178 L179 N180 R185 I186 I341	N178-T182 WeakPolarHBondContact O-CB 3.17Å; N178-T182 PolarHBondContact O-N 3.46Å; N178-T182 PolarHBondContact O-OG1 3.23Å; L179-T182 PolarHBondContact O-N 3.06Å; N180-T182 PolarHBondContact O-N 2.83Å; T182-R185 PolarHBondContact O-N 3.04Å; T182-I186 PolarHBondContact O-N 2.86Å; T182-I341 HydrophobicContact CG2-CD1 3.79Å
183	N	51	Low	50.2	Low	43 Å²	43	62.4 Å²	62.4	23%	0.23	31%	0.313	C	S	.	.	H	α-helix	trans	-62.3	-47.8	174.8	-76.5	-49.8	0	0	0	112.3	L179 N180 R185 I186 T187	L179-N183 PolarHBondContact O-N 3.46Å; L179-N183 PolarHBondContact O-ND2 3.02Å; N180-N183 PolarHBondContact O-N 3.06Å; N183-R185 VanDerWaalsContact C-N 3.31Å; N183-R185 PolarHBondContact O-N 3.33Å; N183-I186 PolarHBondContact O-N 3.46Å; N183-T187 PolarHBondContact O-N 3.24Å; N183-T187 PolarHBondContact O-OG1 2.93Å
184	T	45.7	Very low	49	Very low	73 Å²	73	64.8 Å²	64.8	45%	0.448	33%	0.329	S	S	.	.	H	α-helix	trans	-62.8	-36.3	179.9	49.4	0	0	0	0	112.5	N180 N181 I186 T187 F188	N180-T184 PolarHBondContact O-N 3.01Å; N180-T184 PolarHBondContact O-OG1 3.04Å; N181-T184 PolarHBondContact O-OG1 2.95Å; T184-I186 VanDerWaalsContact C-N 3.32Å; T184-I186 PolarHBondContact O-N 3.11Å; T184-T187 PolarHBondContact O-N 3.17Å; T184-F188 WeakPolarHBondContact O-CD2 3.49Å; T184-F188 PolarHBondContact O-N 3.47Å
185	R	39.5	Very low	47.9	Very low	161 Å²	161	70 Å²	70	61%	0.608	36%	0.357	S	S	*	.	H	α-helix	trans	-60.5	-37.9	172	-82.9	-178.5	170.7	-175.5	-1.2	113.2	N181 T182 N183 G189	N181-R185 WeakPolarHBondContact O-CG 3.35Å; N181-R185 PolarHBondContact O-N 3.26Å; T182-R185 PolarHBondContact O-N 3.04Å; N183-R185 VanDerWaalsContact C-N 3.31Å; N183-R185 PolarHBondContact O-N 3.33Å; R185-G189 PolarHBondContact O-N 3.22Å
186	I	44.9	Very low	46.3	Very low	78 Å²	78	76 Å²	76	40%	0.4	38%	0.383	S	S	.	.	H	α-helix	trans	-70	-43	175.5	-65.4	168.4	0	0	0	110.2	T182 N183 T184 F188 G189 I190 I341	T182-I186 PolarHBondContact O-N 2.86Å; N183-I186 PolarHBondContact O-N 3.46Å; T184-I186 VanDerWaalsContact C-N 3.32Å; T184-I186 PolarHBondContact O-N 3.11Å; I186-F188 PolarHBondContact O-N 3Å; I186-G189 PolarHBondContact O-N 3.01Å; I186-I190 HydrophobicContact CG2-CD1 3.76Å; I186-I190 HydrophobicContact CG2-CG1 4.36Å; I186-I190 WeakPolarHBondContact O-CG1 3.38Å; I186-I190 PolarHBondContact O-N 3.31Å; I186-I341 HydrophobicContact CD1-CB 4.37Å; I186-I341 HydrophobicContact CD1-CG2 4.25Å
187	T	38.9	Very low	44.7	Very low	91 Å²	91	83.9 Å²	83.9	56%	0.558	41%	0.412	S	S	*	.	H	α-helix	trans	-61.9	-42.7	176.6	-46.9	0	0	0	0	112.5	N183 T184 K191	N183-T187 PolarHBondContact O-N 3.24Å; N183-T187 PolarHBondContact O-OG1 2.93Å; T184-T187 PolarHBondContact O-N 3.17Å; T187-K191 PolarHBondContact O-N 3.31Å
188	F	35.2	Very low	43.5	Very low	139 Å²	139	90.2 Å²	90.2	61%	0.61	44%	0.441	S	S	*	.	H	α-helix	trans	-69.9	-36.7	173.7	-88.5	-76.6	0	0	0	112.6	T184 I186 K191 Y192	T184-F188 WeakPolarHBondContact O-CD2 3.49Å; T184-F188 PolarHBondContact O-N 3.47Å; I186-F188 PolarHBondContact O-N 3Å; F188-K191 PolarHBondContact O-N 3.01Å; F188-Y192 WeakPolarHBondContact O-CB 3.47Å; F188-Y192 PolarHBondContact O-N 3.29Å
189	G	37.7	Very low	42.1	Very low	33 Å²	33	97.5 Å²	97.5	34%	0.34	47%	0.472	S	S	.	.	H	α-helix	trans	-60.1	-48.2	174.2	0	0	0	0	0	112	R185 I186 Y192 T193	R185-G189 PolarHBondContact O-N 3.22Å; I186-G189 PolarHBondContact O-N 3.01Å; G189-Y192 PolarHBondContact O-N 3Å; G189-Y192 VanDerWaalsContact O-N 3.15Å; G189-T193 PolarHBondContact O-N 3.17Å; G189-T193 PolarHBondContact O-OG1 2.89Å
190	I	38.7	Very low	40.7	Very low	99 Å²	99	102 Å²	102	51%	0.508	50%	0.497	S	S	.	.	H	α-helix	trans	-62.3	-42.3	175.2	-67.2	168	0	0	0	111	I186 Y192 T193 T194	I186-I190 HydrophobicContact CG2-CD1 3.76Å; I186-I190 HydrophobicContact CG2-CG1 4.36Å; I186-I190 WeakPolarHBondContact O-CG1 3.38Å; I186-I190 PolarHBondContact O-N 3.31Å; I190-Y192 VanDerWaalsContact C-N 3.3Å; I190-Y192 PolarHBondContact O-N 3.36Å; I190-T193 WeakPolarHBondContact CA-OG1 3.43Å; I190-T193 PolarHBondContact O-N 3.47Å; I190-T193 PolarHBondContact O-OG1 2.59Å; I190-T193 VanDerWaalsContact O-OG1 3.08Å; I190-T194 WeakPolarHBondContact O-CG2 3.34Å; I190-T194 PolarHBondContact O-N 3.39Å; I190-T194 PolarHBondContact O-OG1 3.28Å; I190-T194 VanDerWaalsContact O-OG1 3.06Å
191	K	34.7	Very low	39.2	Very low	140 Å²	140	106.2 Å²	106.2	61%	0.609	52%	0.518	S	S	*	.	H	α-helix	trans	-64.1	-32.4	173.8	-100.3	-171.1	171.8	-174.8	0	113.5	T187 F188 T194 N195	T187-K191 PolarHBondContact O-N 3.31Å; F188-K191 PolarHBondContact O-N 3.01Å; K191-T194 PolarHBondContact O-OG1 3.36Å; K191-N195 VanDerWaalsContact O-CB 3.31Å; K191-N195 WeakPolarHBondContact O-CB 3.32Å; K191-N195 PolarHBondContact O-N 3.28Å; K191-N195 VanDerWaalsContact O-N 3.1Å
192	Y	33.6	Very low	37.8	Very low	179 Å²	179	112.3 Å²	112.3	70%	0.702	55%	0.546	S	S	*	.	H	α-helix	trans	-76.8	-36.8	175.9	-105.6	-85.3	0	0	0	112.4	F188 G189 I190 K196	F188-Y192 WeakPolarHBondContact O-CB 3.47Å; F188-Y192 PolarHBondContact O-N 3.29Å; G189-Y192 PolarHBondContact O-N 3Å; G189-Y192 VanDerWaalsContact O-N 3.15Å; I190-Y192 VanDerWaalsContact C-N 3.3Å; I190-Y192 PolarHBondContact O-N 3.36Å; Y192-K196 VanDerWaalsContact O-CB 3.26Å; Y192-K196 WeakPolarHBondContact O-CB 3.36Å; Y192-K196 PolarHBondContact O-N 2.88Å
193	T	38.3	Very low	36.4	Very low	74 Å²	74	118.9 Å²	118.9	45%	0.454	57%	0.573	S	S	.	*	H	α-helix	trans	-69.4	-42.7	174.1	54	0	0	0	0	111.2	G189 I190 K196 Y197	G189-T193 PolarHBondContact O-N 3.17Å; G189-T193 PolarHBondContact O-OG1 2.89Å; I190-T193 WeakPolarHBondContact CA-OG1 3.43Å; I190-T193 PolarHBondContact O-N 3.47Å; I190-T193 PolarHBondContact O-OG1 2.59Å; I190-T193 VanDerWaalsContact O-OG1 3.08Å; T193-K196 PolarHBondContact O-N 3.49Å; T193-K196 VanDerWaalsContact O-N 3.15Å; T193-Y197 WeakPolarHBondContact O-CD2 3.45Å; T193-Y197 PolarHBondContact O-N 3.17Å
194	T	39.7	Very low	35.1	Very low	78 Å²	78	125.1 Å²	125.1	48%	0.479	61%	0.605	S	S	.	*	H	α-helix	trans	-64.6	-44	175.5	55.7	0	0	0	0	112.3	I190 K191 K196 Y197 H198	I190-T194 WeakPolarHBondContact O-CG2 3.34Å; I190-T194 PolarHBondContact O-N 3.39Å; I190-T194 PolarHBondContact O-OG1 3.28Å; I190-T194 VanDerWaalsContact O-OG1 3.06Å; K191-T194 PolarHBondContact O-OG1 3.36Å; T194-K196 PolarHBondContact O-N 3.01Å; T194-Y197 PolarHBondContact O-N 3.08Å; T194-H198 WeakPolarHBondContact O-CB 3.47Å; T194-H198 PolarHBondContact O-N 3.32Å
195	N	36.4	Very low	34.3	Very low	113 Å²	113	128.2 Å²	128.2	60%	0.604	62%	0.619	S	S	*	*	H	α-helix	trans	-63.9	-27.1	172.6	-89.4	-5.8	0	0	0	113.5	K191 K199	K191-N195 VanDerWaalsContact O-CB 3.31Å; K191-N195 WeakPolarHBondContact O-CB 3.32Å; K191-N195 PolarHBondContact O-N 3.28Å; K191-N195 VanDerWaalsContact O-N 3.1Å; N195-K199 PolarHBondContact O-N 3.09Å
196	K	32.9	Very low	33.8	Very low	127 Å²	127	126 Å²	126	55%	0.552	63%	0.626	S	S	*	*	H	α-helix	trans	-76.4	-48.4	175.1	-168.6	170.5	-169.9	-79.8	0	111.4	Y192 T193 T194 H198 K199 D200	Y192-K196 VanDerWaalsContact O-CB 3.26Å; Y192-K196 WeakPolarHBondContact O-CB 3.36Å; Y192-K196 PolarHBondContact O-N 2.88Å; T193-K196 PolarHBondContact O-N 3.49Å; T193-K196 VanDerWaalsContact O-N 3.15Å; T194-K196 PolarHBondContact O-N 3.01Å; K196-H198 PolarHBondContact O-N 3.31Å; K196-K199 PolarHBondContact O-N 3.42Å; K196-D200 WeakPolarHBondContact CE-OD2 3.41Å; K196-D200 WeakPolarHBondContact CG-OD2 3.22Å; K196-D200 IonicContact NZ-OD1 3.82Å; K196-D200 IonicContact NZ-OD2 2.67Å; K196-D200 PolarHBondContact NZ-OD2 3.42Å; K196-D200 WeakPolarHBondContact O-CB 3.17Å; K196-D200 PolarHBondContact O-N 3.11Å
197	Y	32.3	Very low	32.9	Very low	185 Å²	185	128.8 Å²	128.8	73%	0.725	64%	0.642	S	S	*	*	H	α-helix	trans	-57.4	-33.1	173.1	-79.4	-65.4	0	0	0	112.5	T193 T194	T193-Y197 WeakPolarHBondContact O-CD2 3.45Å; T193-Y197 PolarHBondContact O-N 3.17Å; T194-Y197 PolarHBondContact O-N 3.08Å
198	H	34.7	Very low	32.2	Very low	143 Å²	143	132.3 Å²	132.3	66%	0.662	65%	0.653	S	S	*	*	H	α-helix	trans	-77.1	-19	176.4	-143.7	-23.9	0	0	0	114.3	T194 K196	T194-H198 WeakPolarHBondContact O-CB 3.47Å; T194-H198 PolarHBondContact O-N 3.32Å; K196-H198 PolarHBondContact O-N 3.31Å
199	K	33.4	Very low	31.8	Very low	160 Å²	160	133 Å²	133	70%	0.696	66%	0.661	S	S	*	*	H	α-helix	trans	-95.8	-35.6	175.9	-83.5	-165.1	168.2	-162.5	0	113.7	N195 K196 L201 H202	N195-K199 PolarHBondContact O-N 3.09Å; K196-K199 PolarHBondContact O-N 3.42Å; K199-L201 PolarHBondContact O-N 3.36Å; K199-L201 VanDerWaalsContact O-N 3.14Å; K199-H202 PolarHBondContact O-N 3.34Å; K199-H202 VanDerWaalsContact O-N 3.13Å
200	D	31.9	Very low	31.1	Very low	99 Å²	99	138.8 Å²	138.8	53%	0.529	68%	0.684	S	S	.	*	T	Hydrogen-bonded Turn	trans	-69.3	-7.8	179.9	-68.8	0.9	0	0	0	112.2	K196	K196-D200 WeakPolarHBondContact CE-OD2 3.41Å; K196-D200 WeakPolarHBondContact CG-OD2 3.22Å; K196-D200 IonicContact NZ-OD1 3.82Å; K196-D200 IonicContact NZ-OD2 2.67Å; K196-D200 PolarHBondContact NZ-OD2 3.42Å; K196-D200 WeakPolarHBondContact O-CB 3.17Å; K196-D200 PolarHBondContact O-N 3.11Å
201	L	30.2	Very low	30.5	Very low	145 Å²	145	138 Å²	138	76%	0.759	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.9	-3.4	172.7	-141.9	78.1	0	0	0	114.5	K199	K199-L201 PolarHBondContact O-N 3.36Å; K199-L201 VanDerWaalsContact O-N 3.14Å
202	H	28	Very low	29.9	Very low	157 Å²	157	136.1 Å²	136.1	73%	0.727	71%	0.705	S	S	*	*	S	Bend	trans	-131.2	46.3	-173.5	-94.7	-69	0	0	0	113.6	K199	K199-H202 PolarHBondContact O-N 3.34Å; K199-H202 VanDerWaalsContact O-N 3.13Å
203	H	26.5	Very low	29.5	Very low	179 Å²	179	135.8 Å²	135.8	83%	0.829	71%	0.712	S	S	*	*			trans	-139	86	166	-85.4	-56.6	0	0	0	113.2
204	L	24.8	Very low	29	Very low	175 Å²	175	141 Å²	141	92%	0.916	73%	0.731	S	S	*	*			trans	-123.3	144.9	154.4	-95.6	165.7	0	0	0	109
205	D	29	Very low	28.4	Very low	137 Å²	137	145 Å²	145	73%	0.733	75%	0.748	S	S	*	*			trans	64.2	119.9	177.2	-138.2	-21.7	0	0	0	118.4
206	P	28	Very low	28	Very low	116 Å²	116	148.7 Å²	148.7	75%	0.753	76%	0.762	S	S	*	*			trans	-108.7	108.1	173.3	35.7	-25.1	0	0	0	112.7
207	N	26.3	Very low	27.7	Very low	136 Å²	136	150.5 Å²	150.5	73%	0.727	77%	0.77	S	S	*	*			trans	-141.4	124.2	170.6	-99.9	-59.1	0	0	0	115.7
208	M	24.8	Very low	27.6	Very low	164 Å²	164	150 Å²	150	81%	0.808	78%	0.78	S	S	*	*			trans	39.9	131.9	152	-63.4	-155.2	174.8	0	0	124.2
209	M	25.2	Very low	27.7	Very low	155 Å²	155	152 Å²	152	76%	0.764	79%	0.787	S	S	*	*			trans	79.7	119.4	140.1	-79.3	-169.6	172.4	0	0	122.5
210	N	24	Very low	27.8	Very low	153 Å²	153	151.5 Å²	151.5	82%	0.818	79%	0.787	S	S	*	*			trans	54.3	117.8	130.7	-57.4	-7.9	0	0	0	120.8
211	G	25.3	Very low	28.1	Very low	84 Å²	84	151.8 Å²	151.8	87%	0.866	79%	0.788	S	S	*	*			trans	175.1	122.4	159.5	0	0	0	0	0	111.4
212	S	23.2	Very low	28.7	Very low	100 Å²	100	151.7 Å²	151.7	70%	0.699	78%	0.782	S	S	*	*			trans	-122.2	146.1	-179.7	61.2	0	0	0	0	111.3
213	M	24.4	Very low	29.1	Very low	171 Å²	171	150.8 Å²	150.8	84%	0.842	78%	0.778	S	S	*	*			trans	71.5	148.4	-172.7	-59.4	169.3	-72.5	0	0	111.6
214	E	27.6	Very low	29.7	Very low	184 Å²	184	150.7 Å²	150.7	86%	0.86	77%	0.77	S	S	*	*			cis	-143.5	166.5	31.5	-140.3	149.5	-138.8	0	0	112.4
215	L	28	Very low	30.5	Very low	161 Å²	161	147.4 Å²	147.4	84%	0.843	75%	0.753	S	S	*	*			trans	-91.6	170.4	164.2	-92.5	107.5	0	0	0	110.1
216	E	26.9	Very low	31	Very low	191 Å²	191	145.5 Å²	145.5	89%	0.893	74%	0.739	S	S	*	*			trans	75.9	74.2	175.3	-53.3	-163.3	107.4	0	0	117.2
217	K	28.2	Very low	31.6	Very low	166 Å²	166	146.3 Å²	146.3	72%	0.722	73%	0.733	S	S	*	*			trans	-152.1	4.6	153.8	-120.6	166.7	-171.5	174.3	0	119.2	K219	K217-K219 PolarHBondContact O-N 2.82Å
218	D	30.1	Very low	32.3	Very low	173 Å²	173	146.2 Å²	146.2	93%	0.925	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.1	46.3	-173.3	-78.2	-13.4	0	0	0	116.3
219	K	35.8	Very low	33.1	Very low	186 Å²	186	144.9 Å²	144.9	81%	0.809	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-137.6	-22.6	174.6	-81.9	-167.7	174.3	179.3	0	117.7	K217	K217-K219 PolarHBondContact O-N 2.82Å
220	E	36.2	Very low	33.7	Very low	150 Å²	150	145.1 Å²	145.1	70%	0.701	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.9	-30.7	-176.5	-65.9	-173.8	133.1	0	0	113.8	K222	E220-K222 VanDerWaalsContact C-N 3.28Å; E220-K222 PolarHBondContact O-N 3.06Å
221	D	38.4	Very low	34.2	Very low	104 Å²	104	145.8 Å²	145.8	56%	0.556	72%	0.718	S	S	*	*	H	α-helix	trans	-72.9	-18.9	-179.1	-72.3	-47.2	0	0	0	113.9	R224 L225	D221-R224 PolarHBondContact O-N 3.48Å; D221-L225 PolarHBondContact O-N 3.26Å
222	K	41.7	Very low	34.7	Very low	143 Å²	143	150 Å²	150	62%	0.622	72%	0.715	S	S	*	*	H	α-helix	trans	-69.2	-39.7	-178.7	-161.8	-177	179.7	-140.3	0	112.7	E220 R224 L225 E226	E220-K222 VanDerWaalsContact C-N 3.28Å; E220-K222 PolarHBondContact O-N 3.06Å; K222-R224 PolarHBondContact O-N 3.22Å; K222-L225 PolarHBondContact O-N 3.3Å; K222-E226 WeakPolarHBondContact CE-OE1 3.32Å; K222-E226 IonicContact NZ-OE1 3.42Å; K222-E226 PolarHBondContact NZ-OE1 3.4Å; K222-E226 VanDerWaalsContact NZ-OE1 3.12Å; K222-E226 PolarHBondContact O-N 2.93Å
223	E	38	Very low	35.1	Very low	138 Å²	138	153.4 Å²	153.4	65%	0.645	72%	0.72	S	S	*	*	H	α-helix	trans	-69.1	-23.2	177.5	-63.6	-171	160	0	0	112.1	Q227	E223-Q227 WeakPolarHBondContact O-CG 3.45Å; E223-Q227 PolarHBondContact O-N 3.28Å
224	R	37.4	Very low	35.2	Very low	178 Å²	178	153.8 Å²	153.8	67%	0.672	72%	0.719	S	S	*	*	H	α-helix	trans	-75.9	-39.1	175.6	-68.2	-174.2	171.9	-157.3	-2.5	113.1	D221 K222 Q227 Q228	D221-R224 PolarHBondContact O-N 3.48Å; K222-R224 PolarHBondContact O-N 3.22Å; R224-Q227 PolarHBondContact O-N 3.47Å; R224-Q228 PolarHBondContact O-N 3.5Å
225	L	41.4	Very low	35.4	Very low	105 Å²	105	154.6 Å²	154.6	55%	0.55	72%	0.723	S	S	.	*	H	α-helix	trans	-66.2	-41.4	174.5	-102.3	77.8	0	0	0	112	D221 K222 Q227 Q228 Q229	D221-L225 PolarHBondContact O-N 3.26Å; K222-L225 PolarHBondContact O-N 3.3Å; L225-Q227 PolarHBondContact O-N 3.43Å; L225-Q228 PolarHBondContact O-N 3.46Å; L225-Q229 PolarHBondContact O-N 3.28Å; L225-Q229 VanDerWaalsContact O-N 3.11Å
226	E	40.3	Very low	35.3	Very low	97 Å²	97	151 Å²	151	45%	0.453	73%	0.725	S	S	.	*	H	α-helix	trans	-65.9	-28	179.8	-68.6	179.1	-165.4	0	0	111.8	K222	K222-E226 WeakPolarHBondContact CE-OE1 3.32Å; K222-E226 IonicContact NZ-OE1 3.42Å; K222-E226 PolarHBondContact NZ-OE1 3.4Å; K222-E226 VanDerWaalsContact NZ-OE1 3.12Å; K222-E226 PolarHBondContact O-N 2.93Å
227	Q	39.9	Very low	35.2	Very low	133 Å²	133	145.5 Å²	145.5	62%	0.621	72%	0.719	S	S	*	*	H	α-helix	trans	-75.2	-36.3	171	-72.5	176.7	18.3	0	0	113.7	E223 R224 L225 Q230	E223-Q227 WeakPolarHBondContact O-CG 3.45Å; E223-Q227 PolarHBondContact O-N 3.28Å; R224-Q227 PolarHBondContact O-N 3.47Å; L225-Q227 PolarHBondContact O-N 3.43Å; Q227-Q230 PolarHBondContact O-N 2.71Å
228	Q	41.7	Very low	35	Very low	134 Å²	134	146.6 Å²	146.6	63%	0.626	73%	0.727	S	S	*	*	H	α-helix	trans	-69.9	-36.4	177.7	-75.3	-174.6	-21.5	0	0	112.8	R224 L225 Q230 Q231	R224-Q228 PolarHBondContact O-N 3.5Å; L225-Q228 PolarHBondContact O-N 3.46Å; Q228-Q230 VanDerWaalsContact C-N 3.26Å; Q228-Q230 PolarHBondContact O-N 3.43Å; Q228-Q231 PolarHBondContact O-N 3.09Å
229	Q	41.4	Very low	34.8	Very low	137 Å²	137	147.3 Å²	147.3	64%	0.64	73%	0.725	S	S	*	*	H	α-helix	trans	-67.6	-23.9	177.1	-70.9	-172.9	-10.3	0	0	113.4	L225 Q231	L225-Q229 PolarHBondContact O-N 3.28Å; L225-Q229 VanDerWaalsContact O-N 3.11Å; Q229-Q231 VanDerWaalsContact C-N 3.34Å
230	Q	37.8	Very low	34.3	Very low	159 Å²	159	148.1 Å²	148.1	74%	0.743	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.7	-12.9	174.8	-68.7	-177.2	14.2	0	0	113.7	Q227 Q228	Q227-Q230 PolarHBondContact O-N 2.71Å; Q228-Q230 VanDerWaalsContact C-N 3.26Å; Q228-Q230 PolarHBondContact O-N 3.43Å
231	Q	35.5	Very low	33.8	Very low	167 Å²	167	150.1 Å²	150.1	78%	0.78	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.9	-1.2	176.9	-70.7	-172.5	-24.3	0	0	114.1	Q228 Q229	Q228-Q231 PolarHBondContact O-N 3.09Å; Q229-Q231 VanDerWaalsContact C-N 3.34Å
232	Q	34.2	Very low	33.1	Very low	173 Å²	173	154.3 Å²	154.3	81%	0.808	76%	0.757	S	S	*	*	S	Bend	trans	-107.5	18.2	179.3	-67.7	-172.2	-22.5	0	0	114
233	Q	31.6	Very low	32.3	Very low	172 Å²	172	157.2 Å²	157.2	80%	0.804	77%	0.773	S	S	*	*	S	Bend	trans	-113.6	17.1	177.2	-67.8	-166.1	-16.8	0	0	114.1
234	Q	28.2	Very low	31.6	Very low	179 Å²	179	158.9 Å²	158.9	84%	0.836	78%	0.78	S	S	*	*	S	Bend	trans	-144.2	74.8	176.7	-68.9	-170	-18.5	0	0	112.5
235	E	30.1	Very low	31.1	Very low	201 Å²	201	157.3 Å²	157.3	94%	0.939	78%	0.784	S	S	*	*			trans	-177.6	127	145.7	-106.3	165.6	-156.7	0	0	111.5
236	G	27.8	Very low	30.3	Very low	86 Å²	86	159.6 Å²	159.6	89%	0.887	80%	0.797	S	S	*	*			trans	76.5	150.2	167.7	0	0	0	0	0	118.2
237	G	23.7	Very low	29.6	Very low	74 Å²	74	162.4 Å²	162.4	76%	0.763	81%	0.813	S	S	*	*			cis	152.2	59.3	-10.1	0	0	0	0	0	117.6
238	E	24.7	Very low	28.8	Very low	190 Å²	190	163.7 Å²	163.7	89%	0.888	82%	0.824	S	S	*	*			trans	66.4	164.7	161.9	-61	-177.9	137.5	0	0	119.1
239	E	24.7	Very low	28.1	Very low	188 Å²	188	166.4 Å²	166.4	88%	0.879	84%	0.837	S	S	*	*			trans	50.9	103.2	168.1	-65.7	-178	178.3	0	0	121
240	E	26.2	Very low	27.4	Very low	202 Å²	202	169.1 Å²	169.1	94%	0.944	85%	0.85	S	S	*	*				-152.7	152.5	110	-117.3	173.6	-167.3	0	0	110.3
241	Q	24.8	Very low	26.8	Very low	192 Å²	192	168.6 Å²	168.6	90%	0.897	85%	0.851	S	S	*	*			trans	-110.4	157.5	-173.1	-80.8	-173.3	-21.5	0	0	113.5
242	E	23.9	Very low	26.3	Very low	192 Å²	192	168.2 Å²	168.2	90%	0.897	85%	0.849	S	S	*	*			trans	-36.2	123	173	-58.5	165	150.8	0	0	115.1
243	E	26.2	Very low	26.1	Very low	205 Å²	205	167.8 Å²	167.8	96%	0.958	85%	0.851	S	S	*	*			trans	-138.2	116.1	137.9	-142.8	170.6	-140.5	0	0	109.1
244	E	23.4	Very low	25.9	Very low	172 Å²	172	166.8 Å²	166.8	80%	0.804	85%	0.851	S	S	*	*			trans	-106.2	166.4	-172	-160.1	-174.4	-160.9	0	0	110.4
245	I	25.7	Very low	25.8	Very low	145 Å²	145	161.5 Å²	161.5	74%	0.744	83%	0.834	S	S	*	*			trans	72.1	81.1	166.5	-42	164.2	0	0	0	115.8
246	N	23.9	Very low	25.7	Very low	154 Å²	154	157.1 Å²	157.1	82%	0.824	82%	0.817	S	S	*	*			trans	-162.3	72.1	132.1	-144.3	-12.3	0	0	0	115
247	I	25.6	Very low	25.7	Very low	156 Å²	156	164.2 Å²	164.2	80%	0.8	82%	0.817	S	S	*	*			trans	-139.5	77	167.7	-49.6	179.2	0	0	0	109.8
248	D	23.1	Very low	26	Very low	159 Å²	159	168 Å²	168	85%	0.85	82%	0.818	S	S	*	*			trans	-132.8	23.1	-174.2	-120.9	-15.4	0	0	0	114.6
249	E	27.1	Very low	26	Very low	191 Å²	191	166.7 Å²	166.7	89%	0.893	81%	0.806	S	S	*	*	S	Bend	trans	-141.3	-0.1	-179.9	-135.5	173.1	-172.4	0	0	119.5
250	E	26.8	Very low	26.2	Very low	194 Å²	194	166.5 Å²	166.5	91%	0.907	81%	0.805	S	S	*	*	S	Bend	trans	-127.2	9.3	-176.1	-137	179.3	-170.2	0	0	118.3
251	L	25.6	Very low	26.3	Very low	149 Å²	149	164.1 Å²	164.1	78%	0.78	80%	0.799	S	S	*	*	S	Bend	trans	-102.2	2.5	178.4	-98.9	166.1	0	0	0	115.7	I253	L251-I253 PolarHBondContact O-N 2.92Å
252	H	26.3	Very low	26.8	Very low	159 Å²	159	161.5 Å²	161.5	74%	0.736	79%	0.789	S	S	*	*	S	Bend	trans	-82.7	-2.8	-162.2	-127.4	-60.2	0	0	0	116.8
253	I	29.9	Very low	27.1	Very low	164 Å²	164	160.5 Å²	160.5	84%	0.841	78%	0.777	S	S	*	*	S	Bend	trans	-101.1	-27.6	-167.8	-68.6	178.8	0	0	0	114.6	L251	L251-I253 PolarHBondContact O-N 2.92Å
254	N	26.4	Very low	27.3	Very low	150 Å²	150	154.9 Å²	154.9	80%	0.802	76%	0.759	S	S	*	*	S	Bend	trans	-111.6	-6.7	-167	-127.1	-13.6	0	0	0	116.1
255	S	26.1	Very low	28	Very low	69 Å²	69	151.6 Å²	151.6	48%	0.483	75%	0.746	S	S	.	*	S	Bend	trans	-85.4	-20.8	-176.5	49.4	0	0	0	0	114.6	R257	S255-R257 VanDerWaalsContact C-N 3.28Å; S255-R257 PolarHBondContact O-N 3.09Å
256	N	27.5	Very low	28.3	Very low	109 Å²	109	149.7 Å²	149.7	58%	0.583	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.1	-6.4	-173.3	-83.1	-32.4	0	0	0	115.7
257	R	29	Very low	29.5	Very low	234 Å²	234	144.9 Å²	144.9	88%	0.883	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88	-1.2	-174.6	-121.4	175.9	-175	171.1	2.1	116	S255	S255-R257 VanDerWaalsContact C-N 3.28Å; S255-R257 PolarHBondContact O-N 3.09Å
258	I	30.2	Very low	30.5	Very low	153 Å²	153	140.1 Å²	140.1	79%	0.785	70%	0.696	S	S	*	*	S	Bend	trans	-106.5	-7.7	179.8	-59.6	-177.9	0	0	0	112.4	H260	I258-H260 PolarHBondContact O-N 3.4Å; I258-H260 VanDerWaalsContact O-N 3.14Å
259	Y	24.8	Very low	32	Very low	164 Å²	164	134.3 Å²	134.3	64%	0.643	66%	0.664	S	S	*	*	G	3₁₀ helix	trans	-74.7	2.6	-177.6	-84	-74.9	0	0	0	116.3	N261	Y259-N261 PolarHBondContact O-N 2.96Å
260	H	28.2	Very low	33.3	Very low	184 Å²	184	131 Å²	131	85%	0.852	65%	0.647	S	S	*	*	G	3₁₀ helix	trans	-88.8	5.7	-176.6	-99.8	-67.8	0	0	0	116.4	I258 I262	I258-H260 PolarHBondContact O-N 3.4Å; I258-H260 VanDerWaalsContact O-N 3.14Å; H260-I262 VanDerWaalsContact C-N 3.27Å; H260-I262 PolarHBondContact O-N 3.19Å
261	N	28.9	Very low	34.1	Very low	152 Å²	152	125.1 Å²	125.1	81%	0.813	62%	0.619	S	S	*	*	G	3₁₀ helix	trans	-92.8	25.2	172.5	-130.2	-20.1	0	0	0	113.5	Y259 R263	Y259-N261 PolarHBondContact O-N 2.96Å; N261-R263 VanDerWaalsContact C-N 3.3Å; N261-R263 PolarHBondContact O-N 3.46Å
262	I	34.6	Very low	35.1	Very low	137 Å²	137	121.6 Å²	121.6	70%	0.703	61%	0.605	S	S	*	*			trans	-66.5	91.9	162.8	-60	171.6	0	0	0	107.5	H260	H260-I262 VanDerWaalsContact C-N 3.27Å; H260-I262 PolarHBondContact O-N 3.19Å
263	R	30.3	Very low	36.3	Very low	170 Å²	170	116.2 Å²	116.2	64%	0.642	59%	0.585	S	S	*	*			trans	-54.6	133.3	156.3	-85.9	-168.9	175.4	-150.5	1	107.5	N261 L265	N261-R263 VanDerWaalsContact C-N 3.3Å; N261-R263 PolarHBondContact O-N 3.46Å; R263-L265 PolarHBondContact O-N 3.28Å
264	P	30.5	Very low	37.4	Very low	88 Å²	88	112.9 Å²	112.9	57%	0.571	57%	0.566	S	S	*	*			trans	-61.8	141.3	177.2	28.2	-35.2	0	0	0	109.5	T266	P264-T266 PolarHBondContact O-N 3.45Å
265	L	37.5	Very low	38.6	Very low	102 Å²	102	112.9 Å²	112.9	53%	0.534	56%	0.561	S	S	.	*	G	3₁₀ helix	trans	-58.9	-18	-175.7	-167.3	64.6	0	0	0	113	R263 S267	R263-L265 PolarHBondContact O-N 3.28Å; L265-S267 PolarHBondContact O-N 2.95Å
266	T	32.3	Very low	39.9	Very low	105 Å²	105	111.2 Å²	111.2	64%	0.644	54%	0.544	S	S	*	.	G	3₁₀ helix	trans	-67.9	9.9	-176.7	52.1	0	0	0	0	116.2	P264 F270	P264-T266 PolarHBondContact O-N 3.45Å; T266-F270 VanDerWaalsContact O-CD2 3.31Å; T266-F270 WeakPolarHBondContact O-CD2 3.44Å
267	S	49.2	Very low	41.3	Very low	54 Å²	54	111.7 Å²	111.7	38%	0.378	54%	0.541	S	S	.	.	G	3₁₀ helix	trans	-121.5	-0.5	-179.4	119.2	0	0	0	0	116.4	L265	L265-S267 PolarHBondContact O-N 2.95Å
268	L	46.9	Very low	42.5	Very low	55 Å²	55	100.8 Å²	100.8	29%	0.288	50%	0.5	S	S	.	.	S	Bend	trans	-77	-41.2	177.4	-95.7	160	0	0	0	112.5	N178 F270 K271 W410	N178-L268 WeakPolarHBondContact OD1-CD2 3.16Å; L268-F270 PolarHBondContact O-N 2.72Å; L268-K271 PolarHBondContact O-N 3.49Å; L268-W410 PolarHBondContact O-NE1 3.25Å
269	I	53	Low	43.8	Very low	37 Å²	37	93.7 Å²	93.7	19%	0.19	46%	0.464	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58	-31.6	174.8	-71.4	166.1	0	0	0	112.1	G409 W410	I269-G409 CarbonylContact O-C 3.41Å; I269-G409 VanDerWaalsContact O-CA 3.25Å; I269-G409 WeakPolarHBondContact O-CA 3.45Å; I269-W410 HydrophobicContact CG1-CZ2 4.31Å; I269-W410 PolarHBondContact O-N 3.46Å; I269-W410 VanDerWaalsContact O-N 3.11Å
270	F	55	Low	45.6	Very low	122 Å²	122	87.6 Å²	87.6	54%	0.535	44%	0.44	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	6.7	-172.9	-64.9	-76.8	0	0	0	114.9	T266 L268 W408	T266-F270 VanDerWaalsContact O-CD2 3.31Å; T266-F270 WeakPolarHBondContact O-CD2 3.44Å; L268-F270 PolarHBondContact O-N 2.72Å; F270-W408 WeakPolarHBondContact CD1-O 3.17Å; F270-W408 VanDerWaalsContact CE1-O 3.28Å; F270-W408 WeakPolarHBondContact CE1-O 3.39Å
271	K	44.1	Very low	47	Very low	70 Å²	70	80.7 Å²	80.7	30%	0.304	41%	0.411	S	S	.	.	P	Polyproline II helix	trans	-86.3	131.7	175.5	-163.5	-161	170.6	-151.2	0	110.4	N181 L268 E274	N181-K271 PolarHBondContact ND2-NZ 3.12Å; N181-K271 VanDerWaalsContact ND2-NZ 3.16Å; N181-K271 PolarHBondContact OD1-NZ 3.28Å; L268-K271 PolarHBondContact O-N 3.49Å; K271-E274 IonicContact NZ-OE1 3.63Å; K271-E274 PolarHBondContact NZ-OE1 3.03Å
272	P	46.1	Very low	48.4	Very low	76 Å²	76	80.5 Å²	80.5	49%	0.494	41%	0.405	S	S	.	.	P	Polyproline II helix	trans	-68.8	158.6	171.2	28.9	-35.7	0	0	0	112.5
273	S	52.9	Low	49.8	Very low	45 Å²	45	74.8 Å²	74.8	32%	0.315	38%	0.376	S	S	.	.	P	Polyproline II helix	trans	-81.7	153.3	-179.5	54.4	0	0	0	0	113.2	E405	S273-E405 WeakPolarHBondContact CB-OE2 3.04Å; S273-E405 PolarHBondContact OG-OE2 2.92Å
274	E	51.7	Low	51.6	Low	95 Å²	95	71.2 Å²	71.2	44%	0.444	37%	0.369	S	S	.	.			trans	-104.7	169.7	171.4	-56.8	152.3	-147.3	0	0	110.3	T177 N181 K271	T177-E274 HydrophobicContact CG2-CB 3.59Å; T177-E274 HydrophobicContact CG2-CG 4.2Å; T177-E274 PolarHBondContact OG1-O 3.09Å; T177-E274 VanDerWaalsContact OG1-O 3.09Å; N181-E274 PolarHBondContact ND2-OE1 3.43Å; N181-E274 PolarHBondContact OD1-OE1 3.44Å; K271-E274 IonicContact NZ-OE1 3.63Å; K271-E274 PolarHBondContact NZ-OE1 3.03Å
275	H	52.7	Low	53.2	Low	149 Å²	149	72.8 Å²	72.8	69%	0.69	37%	0.367	S	S	*	.	P	Polyproline II helix	trans	-59.6	140.4	-161.6	-43.5	-54.1	0	0	0	116.3	V511	H275-V511 HydrophobicContact CB-CG2 4.23Å; H275-V511 WeakPolarHBondContact ND1-CG2 3.12Å
276	R	53.3	Low	54.6	Low	34 Å²	34	68.1 Å²	68.1	13%	0.128	34%	0.342	C	S	.	.	P	Polyproline II helix	trans	-72.9	123.5	175.5	-171.1	-170.9	-86.7	-100.3	8	111.5	L173 E290	L173-R276 HydrophobicContact CD2-CB 3.93Å; R276-E290 IonicContact CZ-OE1 3.08Å; R276-E290 VanDerWaalsContact NH1-CD 3.3Å; R276-E290 IonicContact NH1-OE1 2.73Å; R276-E290 PolarHBondContact NH1-OE1 3.31Å; R276-E290 IonicContact NH1-OE2 2.66Å; R276-E290 PolarHBondContact NH1-OE2 3.36Å; R276-E290 IonicContact NH2-OE1 2.78Å; R276-E290 PolarHBondContact NH2-OE1 3.27Å; R276-E290 VanDerWaalsContact NH2-OE1 3.08Å
277	K	56.7	Low	56.5	Low	119 Å²	119	63.5 Å²	63.5	52%	0.517	31%	0.314	S	S	.	.	P	Polyproline II helix	trans	-83.8	162	168.2	-68.7	-174.6	175.1	-176.8	0	111.3	E282	K277-E282 IonicContact NZ-OE2 2.69Å; K277-E282 PolarHBondContact NZ-OE2 3.24Å
278	M	53.6	Low	57.8	Low	5 Å²	5	64.7 Å²	64.7	3%	0.025	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-67.2	135.4	176.7	-167.4	172.2	-173.7	0	0	110.7	T281 C498 S501 A630 V634 H635 W645	M278-T281 HydrophobicContact CB-CG2 4.42Å; M278-T281 PolarHBondContact O-OG1 3.19Å; M278-C498 HydrophobicContact CE-CB 4.46Å; M278-S501 WeakPolarHBondContact CA-OG 3.35Å; M278-A630 HydrophobicContact CE-CB 4.05Å; M278-V634 HydrophobicContact CE-CB 4.47Å; M278-V634 HydrophobicContact CE-CG2 4.39Å; M278-V634 HydrophobicContact SD-CB 4.42Å; M278-V634 HydrophobicContact SD-CG1 4.35Å; M278-H635 PolarHBondContact SD-NE2 3.15Å; M278-W645 HydrophobicContact CE-CH2 3.58Å; M278-W645 HydrophobicContact CE-CZ2 3.91Å; M278-W645 HydrophobicContact CE-CZ3 4.35Å; M278-W645 HydrophobicContact SD-CH2 4.14Å; M278-W645 HydrophobicContact SD-CZ2 3.9Å
279	P	57.3	Low	59.2	Low	5 Å²	5	62.1 Å²	62.1	3%	0.032	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	156.9	-178.4	-24	32.3	0	0	0	114	T281 D287 V497 S631	P279-T281 PolarHBondContact O-N 3.39Å; P279-D287 WeakPolarHBondContact CA-OD1 3.37Å; P279-V497 HydrophobicContact CG-CG1 3.53Å; P279-S631 VanDerWaalsContact O-CB 3.22Å; P279-S631 WeakPolarHBondContact O-CB 3.47Å; P279-S631 PolarHBondContact O-OG 3.35Å
280	W	62.8	Low	60.3	Low	36 Å²	36	61.6 Å²	61.6	14%	0.136	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	66.4	18.8	174	-44.8	108.1	0	0	0	115.2	D287 N291 I624 T627 F628	W280-D287 WeakPolarHBondContact CA-OD2 3.13Å; W280-D287 HydrophobicContact CE3-CB 4.16Å; W280-D287 HydrophobicContact CZ3-CB 4.39Å; W280-D287 VanDerWaalsContact N-CG 3.31Å; W280-D287 PolarHBondContact N-OD2 3.34Å; W280-N291 HydrophobicContact CH2-CB 3.94Å; W280-N291 HydrophobicContact CZ2-CB 4.23Å; W280-N291 VanDerWaalsContact CZ2-ND2 3.27Å; W280-N291 WeakPolarHBondContact CZ2-ND2 3.21Å; W280-N291 WeakPolarHBondContact CZ2-OD1 3.16Å; W280-I624 HydrophobicContact CZ2-CG2 4.1Å; W280-T627 PolarHBondContact NE1-OG1 3.19Å; W280-T627 VanDerWaalsContact NE1-OG1 3.13Å; W280-F628 HydrophobicContact CB-CD2 4.2Å; W280-F628 HydrophobicContact CD2-CD2 4.05Å; W280-F628 AromaticContact CG-CD2 3.91Å; W280-F628 HydrophobicContact CG-CD2 3.91Å
281	T	58.2	Low	61.6	Low	39 Å²	39	56.2 Å²	56.2	24%	0.239	28%	0.275	C	S	.	.	S	Bend	trans	-101.3	-100.9	178.4	59.9	0	0	0	0	111.2	M278 P279	M278-T281 HydrophobicContact CB-CG2 4.42Å; M278-T281 PolarHBondContact O-OG1 3.19Å; P279-T281 PolarHBondContact O-N 3.39Å
282	E	58.3	Low	63.6	Low	148 Å²	148	53.1 Å²	53.1	69%	0.692	26%	0.263	S	S	*	.	S	Bend	trans	-91.5	-16.6	-177.4	-60.2	178.1	156.2	0	0	112.8	K277	K277-E282 IonicContact NZ-OE2 2.69Å; K277-E282 PolarHBondContact NZ-OE2 3.24Å
283	T	63.4	Low	65.7	Low	17 Å²	17	49.8 Å²	49.8	10%	0.104	24%	0.24	C	C	.	.			trans	-102.5	24.4	-164.6	-8.6	0	0	0	0	114.2	K285 N286 D287	T283-K285 PolarHBondContact O-N 3.32Å; T283-N286 HydrophobicContact CG2-CB 4Å; T283-N286 WeakPolarHBondContact O-CA 3.45Å; T283-N286 WeakPolarHBondContact O-CB 3.28Å; T283-N286 PolarHBondContact O-N 3.17Å; T283-D287 VanDerWaalsContact C-OD2 3.24Å; T283-D287 PolarHBondContact O-N 3.43Å
284	I	67.3	Low	67.4	Low	95 Å²	95	48.9 Å²	48.9	49%	0.487	23%	0.231	S	C	.	.	H	α-helix	trans	-47.2	-39.5	-167.4	-61.5	173.1	0	0	0	113.9	N286 D287 I288	I284-N286 VanDerWaalsContact C-N 3.34Å; I284-N286 PolarHBondContact O-N 3.02Å; I284-D287 WeakPolarHBondContact CA-OD2 3.3Å; I284-D287 PolarHBondContact N-OD2 3.19Å; I284-D287 PolarHBondContact O-N 2.99Å; I284-I288 HydrophobicContact CG2-CD1 3.97Å; I284-I288 HydrophobicContact CG2-CG1 4.48Å; I284-I288 VanDerWaalsContact O-CG1 3.26Å; I284-I288 WeakPolarHBondContact O-CG1 3.44Å; I284-I288 PolarHBondContact O-N 3.34Å
285	K	65.2	Low	69.3	Low	120 Å²	120	49 Å²	49	52%	0.522	23%	0.23	S	C	.	.	H	α-helix	trans	-59.7	-41.7	175.8	-76.9	-169.2	175.4	-174.4	0	112.8	T283 V289	T283-K285 PolarHBondContact O-N 3.32Å; K285-V289 WeakPolarHBondContact O-CG2 3.39Å; K285-V289 PolarHBondContact O-N 3.27Å
286	N	66.3	Low	71.2	Confident	4 Å²	4	42.1 Å²	42.1	2%	0.021	20%	0.199	C	C	.	.	H	α-helix	trans	-79	-35.8	179.7	-57.8	1.3	0	0	0	110.9	I176 N180 T283 I284 I288 V289 E290	I176-N286 HydrophobicContact CG1-CB 4.31Å; I176-N286 HydrophobicContact CG2-CB 4.07Å; I176-N286 PolarHBondContact O-ND2 3.22Å; I176-N286 VanDerWaalsContact O-ND2 3.16Å; N180-N286 VanDerWaalsContact CG-ND2 3.27Å; N180-N286 PolarHBondContact ND2-ND2 2.89Å; N180-N286 PolarHBondContact OD1-ND2 3.49Å; T283-N286 HydrophobicContact CG2-CB 4Å; T283-N286 WeakPolarHBondContact O-CA 3.45Å; T283-N286 WeakPolarHBondContact O-CB 3.28Å; T283-N286 PolarHBondContact O-N 3.17Å; I284-N286 VanDerWaalsContact C-N 3.34Å; I284-N286 PolarHBondContact O-N 3.02Å; N286-I288 PolarHBondContact O-N 3.23Å; N286-V289 WeakPolarHBondContact O-CA 3.48Å; N286-V289 WeakPolarHBondContact O-CB 3.34Å; N286-V289 PolarHBondContact O-N 3.04Å; N286-E290 PolarHBondContact O-N 3.44Å
287	D	72.2	Confident	73.2	Confident	8 Å²	8	41.1 Å²	41.1	4%	0.043	20%	0.195	C	C	.	.	H	α-helix	trans	-58.1	-39.2	172	-58.1	-40.5	0	0	0	110.6	P279 W280 T283 I284 E290 N291	P279-D287 WeakPolarHBondContact CA-OD1 3.37Å; W280-D287 WeakPolarHBondContact CA-OD2 3.13Å; W280-D287 HydrophobicContact CE3-CB 4.16Å; W280-D287 HydrophobicContact CZ3-CB 4.39Å; W280-D287 VanDerWaalsContact N-CG 3.31Å; W280-D287 PolarHBondContact N-OD2 3.34Å; T283-D287 VanDerWaalsContact C-OD2 3.24Å; T283-D287 PolarHBondContact O-N 3.43Å; I284-D287 WeakPolarHBondContact CA-OD2 3.3Å; I284-D287 PolarHBondContact N-OD2 3.19Å; I284-D287 PolarHBondContact O-N 2.99Å; D287-E290 PolarHBondContact O-N 3.33Å; D287-N291 WeakPolarHBondContact O-CB 3.35Å; D287-N291 PolarHBondContact O-N 2.79Å; D287-N291 PolarHBondContact O-ND2 3.5Å
288	I	77	Confident	74.9	Confident	80 Å²	80	37.1 Å²	37.1	41%	0.41	18%	0.179	S	C	.	.	H	α-helix	trans	-62.7	-39.3	172.7	-72.7	164	0	0	0	111.5	I284 N286 S292 I349	I284-I288 HydrophobicContact CG2-CD1 3.97Å; I284-I288 HydrophobicContact CG2-CG1 4.48Å; I284-I288 VanDerWaalsContact O-CG1 3.26Å; I284-I288 WeakPolarHBondContact O-CG1 3.44Å; I284-I288 PolarHBondContact O-N 3.34Å; N286-I288 PolarHBondContact O-N 3.23Å; I288-S292 VanDerWaalsContact O-CB 3.32Å; I288-S292 WeakPolarHBondContact O-CB 3.47Å; I288-S292 PolarHBondContact O-N 3.48Å; I288-I349 HydrophobicContact CG2-CD1 4.37Å
289	V	76.9	Confident	76.9	Confident	1 Å²	1	42.3 Å²	42.3	1%	0.006	21%	0.206	C	C	.	.	H	α-helix	trans	-65.5	-46.7	175.6	-165.7	0	0	0	0	110.6	M172 K285 N286 N291 S292 L345 I348 I349 R352	M172-V289 VanDerWaalsContact CE-C 3.47Å; M172-V289 HydrophobicContact CE-CB 3.95Å; M172-V289 HydrophobicContact CE-CG1 3.52Å; K285-V289 WeakPolarHBondContact O-CG2 3.39Å; K285-V289 PolarHBondContact O-N 3.27Å; N286-V289 WeakPolarHBondContact O-CA 3.48Å; N286-V289 WeakPolarHBondContact O-CB 3.34Å; N286-V289 PolarHBondContact O-N 3.04Å; V289-N291 PolarHBondContact O-N 2.92Å; V289-S292 PolarHBondContact O-N 3.46Å; V289-S292 PolarHBondContact O-OG 3.28Å; V289-L345 HydrophobicContact CG2-CD2 4.45Å; V289-I348 HydrophobicContact CG1-CG2 3.53Å; V289-I349 HydrophobicContact CG1-CG1 4.47Å; V289-I349 HydrophobicContact CG2-CD1 4.4Å; V289-I349 HydrophobicContact CG2-CG1 4.03Å; V289-R352 HydrophobicContact CG1-CG 4.2Å
290	E	75.8	Confident	78.7	Confident	25 Å²	25	42.8 Å²	42.8	12%	0.117	21%	0.209	C	C	.	.	H	α-helix	trans	-62.9	-40.3	178.9	-164.9	163.9	-154.7	0	0	111.7	M172 I176 R276 N286 D287 F294	M172-E290 VanDerWaalsContact CE-CA 3.45Å; M172-E290 HydrophobicContact CE-CB 4.09Å; M172-E290 HydrophobicContact SD-CB 4.16Å; M172-E290 HydrophobicContact SD-CG 4.03Å; I176-E290 HydrophobicContact CD1-CB 4.22Å; R276-E290 IonicContact CZ-OE1 3.08Å; R276-E290 VanDerWaalsContact NH1-CD 3.3Å; R276-E290 IonicContact NH1-OE1 2.73Å; R276-E290 PolarHBondContact NH1-OE1 3.31Å; R276-E290 IonicContact NH1-OE2 2.66Å; R276-E290 PolarHBondContact NH1-OE2 3.36Å; R276-E290 IonicContact NH2-OE1 2.78Å; R276-E290 PolarHBondContact NH2-OE1 3.27Å; R276-E290 VanDerWaalsContact NH2-OE1 3.08Å; N286-E290 PolarHBondContact O-N 3.44Å; D287-E290 PolarHBondContact O-N 3.33Å; E290-F294 WeakPolarHBondContact O-CD2 3.41Å
291	N	82.4	Confident	80.3	Confident	9 Å²	9	41.1 Å²	41.1	5%	0.048	20%	0.203	C	C	.	.	H	α-helix	trans	-81.9	-16.7	-179.7	-71.7	-87.2	0	0	0	114.6	W280 D287 V289 V293 F294 F295	W280-N291 HydrophobicContact CH2-CB 3.94Å; W280-N291 HydrophobicContact CZ2-CB 4.23Å; W280-N291 VanDerWaalsContact CZ2-ND2 3.27Å; W280-N291 WeakPolarHBondContact CZ2-ND2 3.21Å; W280-N291 WeakPolarHBondContact CZ2-OD1 3.16Å; D287-N291 WeakPolarHBondContact O-CB 3.35Å; D287-N291 PolarHBondContact O-N 2.79Å; D287-N291 PolarHBondContact O-ND2 3.5Å; V289-N291 PolarHBondContact O-N 2.92Å; N291-V293 VanDerWaalsContact C-N 3.28Å; N291-V293 PolarHBondContact O-N 3.29Å; N291-F294 PolarHBondContact O-N 3.37Å; N291-F295 HydrophobicContact CB-CD2 4.19Å; N291-F295 HydrophobicContact CB-CE2 3.8Å; N291-F295 WeakPolarHBondContact O-CD2 3.38Å; N291-F295 PolarHBondContact O-N 2.93Å
292	S	86.3	Confident	82.1	Confident	6 Å²	6	40.3 Å²	40.3	4%	0.042	20%	0.198	C	C	.	.	H	α-helix	trans	-57.3	-39.1	178.2	66.1	0	0	0	0	113	I288 V289 F295 A296 R352	I288-S292 VanDerWaalsContact O-CB 3.32Å; I288-S292 WeakPolarHBondContact O-CB 3.47Å; I288-S292 PolarHBondContact O-N 3.48Å; V289-S292 PolarHBondContact O-N 3.46Å; V289-S292 PolarHBondContact O-OG 3.28Å; S292-F295 PolarHBondContact O-N 3.12Å; S292-A296 PolarHBondContact O-N 3.2Å; S292-R352 VanDerWaalsContact OG-CB 3.25Å; S292-R352 WeakPolarHBondContact OG-CB 3.41Å
293	V	89	Confident	83.9	Confident	5 Å²	5	37.5 Å²	37.5	3%	0.03	19%	0.187	C	C	.	.	H	α-helix	trans	-58.4	-49.8	173.2	-173.5	0	0	0	0	110.2	N291 F295 A296 Y297 R352 G356	N291-V293 VanDerWaalsContact C-N 3.28Å; N291-V293 PolarHBondContact O-N 3.29Å; V293-F295 PolarHBondContact O-N 3.05Å; V293-A296 PolarHBondContact O-N 3.06Å; V293-Y297 VanDerWaalsContact O-CB 3.23Å; V293-Y297 WeakPolarHBondContact O-CB 3.44Å; V293-Y297 PolarHBondContact O-N 3.17Å; V293-R352 HydrophobicContact CG2-CB 3.85Å; V293-R352 VanDerWaalsContact CG2-CD 3.43Å; V293-R352 HydrophobicContact CG2-CG 4.24Å; V293-G356 WeakPolarHBondContact O-CA 3.37Å
294	F	88.9	Confident	85.5	Confident	26 Å²	26	36.7 Å²	36.7	11%	0.114	18%	0.182	C	C	.	.	H	α-helix	trans	-67.7	-34.3	-176.9	-65	-83.3	0	0	0	112.7	E290 N291 Y297 L298 T620 I624	E290-F294 WeakPolarHBondContact O-CD2 3.41Å; N291-F294 PolarHBondContact O-N 3.37Å; F294-Y297 PolarHBondContact O-N 3.34Å; F294-L298 VanDerWaalsContact O-CB 3.23Å; F294-L298 WeakPolarHBondContact O-CB 3.42Å; F294-L298 PolarHBondContact O-N 3.32Å; F294-T620 HydrophobicContact CB-CG2 4.06Å; F294-T620 HydrophobicContact CD1-CG2 4.14Å; F294-T620 WeakPolarHBondContact O-CG2 3.47Å; F294-I624 HydrophobicContact CB-CD1 3.78Å; F294-I624 HydrophobicContact CB-CG1 3.85Å
295	F	91.2	Very high	86.8	Confident	98 Å²	98	32.1 Å²	32.1	43%	0.43	16%	0.159	S	C	.	.	H	α-helix	trans	-66	-40.5	173.2	-71.2	-59.6	0	0	0	112.8	N291 S292 V293 I299 I624	N291-F295 HydrophobicContact CB-CD2 4.19Å; N291-F295 HydrophobicContact CB-CE2 3.8Å; N291-F295 WeakPolarHBondContact O-CD2 3.38Å; N291-F295 PolarHBondContact O-N 2.93Å; S292-F295 PolarHBondContact O-N 3.12Å; V293-F295 PolarHBondContact O-N 3.05Å; F295-I299 PolarHBondContact O-N 3.43Å; F295-I624 HydrophobicContact CD1-CD1 4.14Å; F295-I624 HydrophobicContact CE1-CD1 4.13Å
296	A	94	Very high	88.2	Confident	4 Å²	4	31 Å²	31	3%	0.033	15%	0.152	C	C	.	.	H	α-helix	trans	-70.8	-37.1	175.3	0	0	0	0	0	112.5	S292 V293 I299 T300 L353 L357	S292-A296 PolarHBondContact O-N 3.2Å; V293-A296 PolarHBondContact O-N 3.06Å; A296-I299 PolarHBondContact O-N 3.11Å; A296-T300 WeakPolarHBondContact O-CB 3.3Å; A296-T300 PolarHBondContact O-N 2.91Å; A296-T300 PolarHBondContact O-OG1 2.82Å; A296-L353 HydrophobicContact CB-CD2 4.01Å; A296-L353 VanDerWaalsContact CB-O 3.29Å; A296-L353 WeakPolarHBondContact CB-O 3.44Å; A296-L357 HydrophobicContact CB-CD2 3.88Å; A296-L357 HydrophobicContact CB-CG 4.03Å
297	Y	93.4	Very high	89.5	Confident	14 Å²	14	33.1 Å²	33.1	6%	0.055	16%	0.163	C	C	.	.	H	α-helix	trans	-63.8	-41.8	174.8	-173.5	-77.3	0	0	0	112.2	V293 F294 I299 T300 S301 G356 E359 I363 N616 T620	V293-Y297 VanDerWaalsContact O-CB 3.23Å; V293-Y297 WeakPolarHBondContact O-CB 3.44Å; V293-Y297 PolarHBondContact O-N 3.17Å; F294-Y297 PolarHBondContact O-N 3.34Å; Y297-I299 PolarHBondContact O-N 2.92Å; Y297-T300 PolarHBondContact O-N 2.99Å; Y297-S301 WeakPolarHBondContact CD1-OG 3.49Å; Y297-S301 WeakPolarHBondContact O-CB 3.37Å; Y297-S301 PolarHBondContact O-N 3.15Å; Y297-S301 PolarHBondContact O-OG 3.41Å; Y297-G356 VanDerWaalsContact CA-O 3.23Å; Y297-G356 WeakPolarHBondContact CA-O 3.47Å; Y297-G356 PolarHBondContact N-O 2.95Å; Y297-E359 VanDerWaalsContact CD2-C 3.48Å; Y297-E359 HydrophobicContact CD2-CB 3.58Å; Y297-E359 HydrophobicContact CE2-CB 3.9Å; Y297-E359 VanDerWaalsContact CE2-O 3.31Å; Y297-E359 WeakPolarHBondContact CE2-O 3.31Å; Y297-I363 WeakPolarHBondContact OH-CD1 3.32Å; Y297-N616 WeakPolarHBondContact CE1-ND2 3.37Å; Y297-N616 WeakPolarHBondContact CE1-OD1 3.02Å; Y297-N616 VanDerWaalsContact OH-CG 3.32Å; Y297-N616 PolarHBondContact OH-ND2 3.13Å; Y297-N616 PolarHBondContact OH-OD1 2.93Å; Y297-T620 HydrophobicContact CD1-CG2 3.94Å; Y297-T620 WeakPolarHBondContact CD1-OG1 3.02Å; Y297-T620 WeakPolarHBondContact CE1-OG1 3.49Å
298	L	93.8	Very high	90.5	Very high	34 Å²	34	32.7 Å²	32.7	18%	0.178	16%	0.161	C	C	.	.	H	α-helix	trans	-55.1	-50.1	175.5	171.5	64.8	0	0	0	111.7	F294 P302 S617 T620 F621	F294-L298 VanDerWaalsContact O-CB 3.23Å; F294-L298 WeakPolarHBondContact O-CB 3.42Å; F294-L298 PolarHBondContact O-N 3.32Å; L298-P302 WeakPolarHBondContact O-CD 3.42Å; L298-S617 WeakPolarHBondContact CD1-O 3.42Å; L298-S617 WeakPolarHBondContact CD1-OG 3.45Å; L298-S617 PolarHBondContact O-OG 2.93Å; L298-T620 HydrophobicContact CB-CG2 4.15Å; L298-F621 HydrophobicContact CD1-CB 3.81Å
299	I	95.1	Very high	91.2	Very high	114 Å²	114	29.4 Å²	29.4	59%	0.585	14%	0.144	S	C	*	.	H	α-helix	trans	-70.4	-37.6	-179	-64.5	169.5	0	0	0	111.4	F295 A296 Y297 P302 I303	F295-I299 PolarHBondContact O-N 3.43Å; A296-I299 PolarHBondContact O-N 3.11Å; Y297-I299 PolarHBondContact O-N 2.92Å; I299-P302 WeakPolarHBondContact O-CD 3.41Å; I299-I303 HydrophobicContact CG2-CD1 4.49Å
300	T	95.6	Very high	91.7	Very high	16 Å²	16	30.7 Å²	30.7	10%	0.098	15%	0.151	C	C	.	.	H	α-helix	trans	-89.6	-18.6	-170.5	-42.5	0	0	0	0	113.5	A296 Y297 I303 G304 L357	A296-T300 WeakPolarHBondContact O-CB 3.3Å; A296-T300 PolarHBondContact O-N 2.91Å; A296-T300 PolarHBondContact O-OG1 2.82Å; Y297-T300 PolarHBondContact O-N 2.99Å; T300-I303 HydrophobicContact CG2-CB 4.32Å; T300-I303 WeakPolarHBondContact O-CB 3.21Å; T300-I303 PolarHBondContact O-N 3.13Å; T300-I303 VanDerWaalsContact O-N 3.08Å; T300-G304 PolarHBondContact O-N 2.84Å; T300-L357 WeakPolarHBondContact CB-O 3.26Å; T300-L357 WeakPolarHBondContact CG2-O 3.44Å; T300-L357 WeakPolarHBondContact OG1-CD2 3.2Å
301	S	96.1	Very high	92.3	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-56.6	-45.4	178	-67	0	0	0	0	114.4	Y297 I303 G305 G360 G613 N616	Y297-S301 WeakPolarHBondContact CD1-OG 3.49Å; Y297-S301 WeakPolarHBondContact O-CB 3.37Å; Y297-S301 PolarHBondContact O-N 3.15Å; Y297-S301 PolarHBondContact O-OG 3.41Å; S301-I303 VanDerWaalsContact C-N 3.34Å; S301-I303 PolarHBondContact O-N 3.16Å; S301-G305 PolarHBondContact O-N 3.44Å; S301-G360 WeakPolarHBondContact CA-O 3.44Å; S301-G360 PolarHBondContact OG-O 2.95Å; S301-G613 CarbonylContact C-O 3.51Å; S301-G613 VanDerWaalsContact CB-O 3.3Å; S301-G613 WeakPolarHBondContact CB-O 3.41Å; S301-G613 WeakPolarHBondContact O-CA 3.35Å; S301-N616 PolarHBondContact OG-ND2 2.84Å
302	P	96.4	Very high	92.7	Very high	23 Å²	23	38.6 Å²	38.6	15%	0.149	18%	0.184	C	C	.	.	H	α-helix	trans	-68	-32.4	174.3	-20.3	35.3	0	0	0	112.9	L298 I299 G305 Y306 F614	L298-P302 WeakPolarHBondContact O-CD 3.42Å; I299-P302 WeakPolarHBondContact O-CD 3.41Å; P302-G305 PolarHBondContact O-N 3.34Å; P302-Y306 PolarHBondContact O-N 2.91Å; P302-F614 HydrophobicContact CB-CD1 4.05Å; P302-F614 HydrophobicContact CB-CE1 3.72Å; P302-F614 HydrophobicContact CB-CE2 4.3Å; P302-F614 HydrophobicContact CB-CG 4.48Å; P302-F614 HydrophobicContact CB-CZ 3.84Å; P302-F614 HydrophobicContact CG-CD1 4.12Å; P302-F614 HydrophobicContact CG-CE1 4.13Å
303	I	96.5	Very high	93.1	Very high	88 Å²	88	38.3 Å²	38.3	45%	0.451	18%	0.182	S	C	.	.	H	α-helix	trans	-67.7	-48.2	177.9	-57.4	175.6	0	0	0	109.9	I299 T300 S301 G305 Y306 L307	I299-I303 HydrophobicContact CG2-CD1 4.49Å; T300-I303 HydrophobicContact CG2-CB 4.32Å; T300-I303 WeakPolarHBondContact O-CB 3.21Å; T300-I303 PolarHBondContact O-N 3.13Å; T300-I303 VanDerWaalsContact O-N 3.08Å; S301-I303 VanDerWaalsContact C-N 3.34Å; S301-I303 PolarHBondContact O-N 3.16Å; I303-G305 VanDerWaalsContact C-N 3.28Å; I303-G305 PolarHBondContact O-N 3.29Å; I303-Y306 WeakPolarHBondContact O-CB 3.31Å; I303-Y306 PolarHBondContact O-N 3.31Å; I303-Y306 VanDerWaalsContact O-N 3.16Å; I303-L307 HydrophobicContact CG2-CD1 4.47Å; I303-L307 WeakPolarHBondContact O-CG 3.34Å; I303-L307 PolarHBondContact O-N 3.08Å
304	G	95.3	Very high	93.3	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-57.7	-42	171.9	0	0	0	0	0	112	T300 Y306 L307 T308 C361	T300-G304 PolarHBondContact O-N 2.84Å; G304-Y306 PolarHBondContact O-N 3.19Å; G304-L307 PolarHBondContact O-N 3.18Å; G304-T308 WeakPolarHBondContact O-CG2 3.46Å; G304-T308 PolarHBondContact O-N 3.35Å; G304-T308 VanDerWaalsContact O-N 3.08Å; G304-C361 VanDerWaalsContact CA-SG 3.5Å
305	G	94.9	Very high	93.6	Very high	0 Å²	0	43 Å²	43	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-57.8	-46.4	172.4	0	0	0	0	0	113.5	S301 P302 I303 T308 G609 L610	S301-G305 PolarHBondContact O-N 3.44Å; P302-G305 PolarHBondContact O-N 3.34Å; I303-G305 VanDerWaalsContact C-N 3.28Å; I303-G305 PolarHBondContact O-N 3.29Å; G305-T308 PolarHBondContact O-N 2.6Å; G305-T308 PolarHBondContact O-OG1 2.82Å; G305-G609 WeakPolarHBondContact CA-O 3.25Å; G305-L610 PolarHBondContact O-N 3.43Å
306	Y	94.8	Very high	93.8	Very high	97 Å²	97	39.6 Å²	39.6	38%	0.38	19%	0.189	S	C	.	.	H	α-helix	trans	-60.3	-43.2	172.9	172.8	-89.7	0	0	0	112.4	P302 I303 G304 T308 V309 I467 W469	P302-Y306 PolarHBondContact O-N 2.91Å; I303-Y306 WeakPolarHBondContact O-CB 3.31Å; I303-Y306 PolarHBondContact O-N 3.31Å; I303-Y306 VanDerWaalsContact O-N 3.16Å; G304-Y306 PolarHBondContact O-N 3.19Å; Y306-T308 VanDerWaalsContact C-N 3.3Å; Y306-T308 PolarHBondContact O-N 3.12Å; Y306-V309 WeakPolarHBondContact O-CB 3.12Å; Y306-V309 PolarHBondContact O-N 3.45Å; Y306-I467 HydrophobicContact CD2-CD1 3.45Å; Y306-I467 VanDerWaalsContact CD2-CD1 3.45Å; Y306-I467 HydrophobicContact CE2-CD1 3.56Å; Y306-W469 HydrophobicContact CD2-CH2 4.24Å; Y306-W469 HydrophobicContact CD2-CZ2 4.03Å; Y306-W469 HydrophobicContact CE2-CZ2 4.38Å
307	L	94.5	Very high	94	Very high	47 Å²	47	39.4 Å²	39.4	25%	0.246	19%	0.187	C	C	.	.	H	α-helix	trans	-59.8	-39.1	178.4	-69.2	173	0	0	0	111.7	I303 G304 V309 N310 Y311 L316	I303-L307 HydrophobicContact CG2-CD1 4.47Å; I303-L307 WeakPolarHBondContact O-CG 3.34Å; I303-L307 PolarHBondContact O-N 3.08Å; G304-L307 PolarHBondContact O-N 3.18Å; L307-V309 PolarHBondContact O-N 2.89Å; L307-V309 VanDerWaalsContact O-N 3.08Å; L307-N310 PolarHBondContact O-N 3.33Å; L307-Y311 HydrophobicContact CB-CD2 4.39Å; L307-Y311 HydrophobicContact CD2-CD2 3.55Å; L307-Y311 HydrophobicContact CD2-CE2 3.65Å; L307-Y311 HydrophobicContact CD2-CG 4.38Å; L307-Y311 WeakPolarHBondContact O-CA 3.49Å; L307-Y311 WeakPolarHBondContact O-CB 3.42Å; L307-Y311 PolarHBondContact O-N 3.38Å; L307-L316 HydrophobicContact CB-CD2 3.66Å; L307-L316 HydrophobicContact CD1-CD1 4.02Å; L307-L316 HydrophobicContact CD1-CD2 4.48Å
308	T	93.1	Very high	94.1	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-61.7	-16.7	175.7	67.5	0	0	0	0	114.9	G304 G305 Y306 L316 R371 G609	G304-T308 WeakPolarHBondContact O-CG2 3.46Å; G304-T308 PolarHBondContact O-N 3.35Å; G304-T308 VanDerWaalsContact O-N 3.08Å; G305-T308 PolarHBondContact O-N 2.6Å; G305-T308 PolarHBondContact O-OG1 2.82Å; Y306-T308 VanDerWaalsContact C-N 3.3Å; Y306-T308 PolarHBondContact O-N 3.12Å; T308-L316 HydrophobicContact CG2-CD2 4.01Å; T308-R371 PolarHBondContact O-NH1 2.69Å; T308-R371 PolarHBondContact O-NH2 2.99Å; T308-G609 WeakPolarHBondContact OG1-CA 3.31Å
309	V	90.6	Very high	94.3	Very high	11 Å²	11	38.3 Å²	38.3	7%	0.067	18%	0.184	C	C	.	.	H	α-helix	trans	-75.8	-39.5	178.6	-177.1	0	0	0	0	111.3	Y306 L307 T465 I467 F607 L610	Y306-V309 WeakPolarHBondContact O-CB 3.12Å; Y306-V309 PolarHBondContact O-N 3.45Å; L307-V309 PolarHBondContact O-N 2.89Å; L307-V309 VanDerWaalsContact O-N 3.08Å; V309-T465 HydrophobicContact CG1-CG2 4.1Å; V309-I467 HydrophobicContact CB-CD1 4.42Å; V309-I467 HydrophobicContact CG1-CD1 4.3Å; V309-I467 HydrophobicContact CG1-CG1 4.13Å; V309-I467 HydrophobicContact CG2-CD1 4.29Å; V309-F607 HydrophobicContact CG1-CD1 4.16Å; V309-F607 HydrophobicContact CG1-CE1 3.99Å; V309-F607 HydrophobicContact CG2-CD1 4.11Å; V309-L610 HydrophobicContact CG2-CB 3.88Å; V309-L610 HydrophobicContact CG2-CD2 4.31Å
310	N	87	Confident	94.3	Very high	27 Å²	27	33.1 Å²	33.1	14%	0.144	16%	0.158	C	C	.	.	H	α-helix	trans	-117.5	-16.1	-169.6	-60.4	-45.9	0	0	0	114.3	L307 N463 T465	L307-N310 PolarHBondContact O-N 3.33Å; N310-N463 PolarHBondContact OD1-O 3.41Å; N310-T465 PolarHBondContact OD1-N 3.27Å
311	Y	89.6	Confident	94.4	Very high	147 Å²	147	32.3 Å²	32.3	58%	0.576	15%	0.153	S	C	*	.	S	Bend	trans	-117.2	159.2	-179.2	-63.2	-91.2	0	0	0	111.9	L307 S313	L307-Y311 HydrophobicContact CB-CD2 4.39Å; L307-Y311 HydrophobicContact CD2-CD2 3.55Å; L307-Y311 HydrophobicContact CD2-CE2 3.65Å; L307-Y311 HydrophobicContact CD2-CG 4.38Å; L307-Y311 WeakPolarHBondContact O-CA 3.49Å; L307-Y311 WeakPolarHBondContact O-CB 3.42Å; L307-Y311 PolarHBondContact O-N 3.38Å; Y311-S313 PolarHBondContact O-N 2.85Å; Y311-S313 VanDerWaalsContact O-N 3.13Å
312	D	91.4	Very high	94.5	Very high	53 Å²	53	33.3 Å²	33.3	28%	0.283	16%	0.161	S	C	.	.			trans	-63.4	113	-176.7	-171.4	-66.8	0	0	0	111.6	S314 F315 L316 E434 K438	D312-S314 VanDerWaalsContact C-N 3.27Å; D312-S314 PolarHBondContact O-N 3.16Å; D312-S314 WeakPolarHBondContact OD1-CA 3.49Å; D312-S314 WeakPolarHBondContact OD1-CB 3.42Å; D312-S314 PolarHBondContact OD1-N 3.46Å; D312-F315 HydrophobicContact CB-CB 4.07Å; D312-F315 PolarHBondContact O-N 3.02Å; D312-F315 PolarHBondContact OD1-N 3.28Å; D312-L316 PolarHBondContact O-N 3.21Å; D312-E434 WeakPolarHBondContact CA-OE1 3.22Å; D312-E434 WeakPolarHBondContact OD1-CB 3.36Å; D312-E434 WeakPolarHBondContact OD2-CB 3Å; D312-K438 IonicContact OD2-NZ 2.74Å; D312-K438 PolarHBondContact OD2-NZ 2.89Å
313	S	93.5	Very high	94.5	Very high	0 Å²	0	36 Å²	36	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-69.6	-24.1	-173.9	-52.3	0	0	0	0	112.8	Y311 L317 G368 R371 E434	Y311-S313 PolarHBondContact O-N 2.85Å; Y311-S313 VanDerWaalsContact O-N 3.13Å; S313-L317 PolarHBondContact O-N 3.49Å; S313-G368 PolarHBondContact OG-O 2.97Å; S313-R371 PolarHBondContact OG-NH2 3.38Å; S313-E434 PolarHBondContact N-OE1 3.41Å; S313-E434 PolarHBondContact OG-OE1 2.83Å; S313-E434 VanDerWaalsContact OG-OE1 3.12Å
314	S	94.4	Very high	94.5	Very high	4 Å²	4	31.8 Å²	31.8	3%	0.028	15%	0.152	C	C	.	.	H	α-helix	trans	-74.9	-44	174.4	-174.9	0	0	0	0	110.8	D312 L316 L317 G318 W428 I432	D312-S314 VanDerWaalsContact C-N 3.27Å; D312-S314 PolarHBondContact O-N 3.16Å; D312-S314 WeakPolarHBondContact OD1-CA 3.49Å; D312-S314 WeakPolarHBondContact OD1-CB 3.42Å; D312-S314 PolarHBondContact OD1-N 3.46Å; S314-L316 VanDerWaalsContact C-N 3.33Å; S314-L316 PolarHBondContact O-N 3.41Å; S314-L317 PolarHBondContact O-N 2.97Å; S314-G318 PolarHBondContact O-N 3.03Å; S314-G318 VanDerWaalsContact O-N 3.11Å; S314-W428 PolarHBondContact O-NE1 3.49Å; S314-W428 WeakPolarHBondContact OG-CZ2 3.33Å; S314-W428 PolarHBondContact OG-NE1 3.46Å; S314-I432 PolarHBondContact OG-O 3.22Å
315	F	94.8	Very high	94.4	Very high	127 Å²	127	31.8 Å²	31.8	56%	0.557	15%	0.152	S	C	*	.	H	α-helix	trans	-62.6	-40.3	175.1	-176.4	-101.5	0	0	0	112	D312 G318 S319 W429	D312-F315 HydrophobicContact CB-CB 4.07Å; D312-F315 PolarHBondContact O-N 3.02Å; D312-F315 PolarHBondContact OD1-N 3.28Å; F315-G318 PolarHBondContact O-N 2.84Å; F315-S319 WeakPolarHBondContact CE1-OG 3.49Å; F315-S319 WeakPolarHBondContact CZ-OG 3.32Å; F315-S319 VanDerWaalsContact O-CB 3.29Å; F315-S319 WeakPolarHBondContact O-CB 3.48Å; F315-S319 PolarHBondContact O-N 3.12Å; F315-S319 PolarHBondContact O-OG 3.38Å; F315-W429 AromaticContact CD2-NE1 3.87Å
316	L	95.9	Very high	94.5	Very high	26 Å²	26	32.6 Å²	32.6	14%	0.136	16%	0.16	C	C	.	.	H	α-helix	trans	-62.8	-43.8	177.3	-171.8	62.5	0	0	0	112.3	L307 T308 D312 S314 S319 S320 C361 S365	L307-L316 HydrophobicContact CB-CD2 3.66Å; L307-L316 HydrophobicContact CD1-CD1 4.02Å; L307-L316 HydrophobicContact CD1-CD2 4.48Å; T308-L316 HydrophobicContact CG2-CD2 4.01Å; D312-L316 PolarHBondContact O-N 3.21Å; S314-L316 VanDerWaalsContact C-N 3.33Å; S314-L316 PolarHBondContact O-N 3.41Å; L316-S319 PolarHBondContact O-N 3.15Å; L316-S320 VanDerWaalsContact O-CB 3.3Å; L316-S320 WeakPolarHBondContact O-CB 3.39Å; L316-S320 PolarHBondContact O-N 2.67Å; L316-C361 HydrophobicContact CD1-CB 4.35Å; L316-C361 HydrophobicContact CG-CB 4.32Å; L316-S365 WeakPolarHBondContact CD2-OG 3.48Å; L316-S365 VanDerWaalsContact CG-OG 3.3Å; L316-S365 WeakPolarHBondContact CG-OG 3.18Å
317	L	96.8	Very high	94.4	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-62.5	-48.8	176.3	-177	58.3	0	0	0	112	S313 S314 S319 S320 V321 L362 V366 I369 W424 W428	S313-L317 PolarHBondContact O-N 3.49Å; S314-L317 PolarHBondContact O-N 2.97Å; L317-S319 VanDerWaalsContact C-N 3.3Å; L317-S319 PolarHBondContact O-N 3.16Å; L317-S320 WeakPolarHBondContact O-CB 3.47Å; L317-S320 PolarHBondContact O-N 2.66Å; L317-V321 HydrophobicContact CD1-CG2 4.44Å; L317-V321 WeakPolarHBondContact O-CG2 3.43Å; L317-V321 PolarHBondContact O-N 3.46Å; L317-V321 VanDerWaalsContact O-N 3.13Å; L317-L362 HydrophobicContact CD1-CD2 3.75Å; L317-L362 HydrophobicContact CD1-CG 3.74Å; L317-V366 HydrophobicContact CD1-CG2 4.06Å; L317-V366 HydrophobicContact CD2-CG2 3.95Å; L317-I369 HydrophobicContact CB-CD1 3.98Å; L317-I369 HydrophobicContact CD2-CD1 3.55Å; L317-I369 HydrophobicContact CG-CD1 4.41Å; L317-W424 HydrophobicContact CD2-CH2 4.1Å; L317-W424 HydrophobicContact CG-CH2 4.09Å; L317-W428 HydrophobicContact CD2-CH2 3.89Å; L317-W428 HydrophobicContact CD2-CZ2 3.78Å; L317-W428 HydrophobicContact CD2-CZ3 4.39Å
318	G	96.9	Very high	94.3	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-62	-38	179	0	0	0	0	0	112.8	S314 F315 A322 C425 W429	S314-G318 PolarHBondContact O-N 3.03Å; S314-G318 VanDerWaalsContact O-N 3.11Å; F315-G318 PolarHBondContact O-N 2.84Å; G318-A322 VanDerWaalsContact O-CB 3.24Å; G318-A322 WeakPolarHBondContact O-CB 3.35Å; G318-A322 PolarHBondContact O-N 2.89Å; G318-C425 PolarHBondContact O-SG 2.93Å; G318-W429 VanDerWaalsContact C-CZ2 3.43Å
319	S	96.4	Very high	94.3	Very high	24 Å²	24	30.5 Å²	30.5	17%	0.168	16%	0.155	C	C	.	.	H	α-helix	trans	-71.1	-40.3	178	-57.2	0	0	0	0	112.5	F315 L316 L317 A322 I323	F315-S319 WeakPolarHBondContact CE1-OG 3.49Å; F315-S319 WeakPolarHBondContact CZ-OG 3.32Å; F315-S319 VanDerWaalsContact O-CB 3.29Å; F315-S319 WeakPolarHBondContact O-CB 3.48Å; F315-S319 PolarHBondContact O-N 3.12Å; F315-S319 PolarHBondContact O-OG 3.38Å; L316-S319 PolarHBondContact O-N 3.15Å; L317-S319 VanDerWaalsContact C-N 3.3Å; L317-S319 PolarHBondContact O-N 3.16Å; S319-A322 PolarHBondContact O-N 3.47Å; S319-I323 VanDerWaalsContact O-CG1 3.29Å; S319-I323 WeakPolarHBondContact O-CG1 3.48Å; S319-I323 PolarHBondContact O-N 3.32Å
320	S	96.7	Very high	94.3	Very high	5 Å²	5	34.8 Å²	34.8	4%	0.035	17%	0.172	C	C	.	.	H	α-helix	trans	-54.1	-55.9	172.7	166.7	0	0	0	0	111	L316 L317 A322 I323 T324 A358 L362	L316-S320 VanDerWaalsContact O-CB 3.3Å; L316-S320 WeakPolarHBondContact O-CB 3.39Å; L316-S320 PolarHBondContact O-N 2.67Å; L317-S320 WeakPolarHBondContact O-CB 3.47Å; L317-S320 PolarHBondContact O-N 2.66Å; S320-A322 PolarHBondContact O-N 3.16Å; S320-I323 PolarHBondContact O-N 2.92Å; S320-T324 PolarHBondContact O-N 3.46Å; S320-T324 PolarHBondContact O-OG1 3.3Å; S320-A358 WeakPolarHBondContact CB-O 3.35Å; S320-A358 PolarHBondContact OG-O 3.38Å; S320-L362 WeakPolarHBondContact OG-CB 3.38Å
321	V	97	Very high	94.3	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-63.3	-40.7	179.5	-179.8	0	0	0	0	111.4	C161 V165 L317 I323 T324 C325 L362 W424	C161-V321 HydrophobicContact CB-CG2 3.86Å; V165-V321 HydrophobicContact CG2-CG1 4.11Å; V165-V321 HydrophobicContact CG2-CG2 4.31Å; L317-V321 HydrophobicContact CD1-CG2 4.44Å; L317-V321 WeakPolarHBondContact O-CG2 3.43Å; L317-V321 PolarHBondContact O-N 3.46Å; L317-V321 VanDerWaalsContact O-N 3.13Å; V321-I323 PolarHBondContact O-N 3.47Å; V321-T324 PolarHBondContact O-N 2.92Å; V321-C325 WeakPolarHBondContact O-CB 3.35Å; V321-C325 PolarHBondContact O-N 2.97Å; V321-C325 PolarHBondContact O-SG 3.31Å; V321-C325 VanDerWaalsContact O-SG 3.4Å; V321-L362 HydrophobicContact CG2-CD1 4.07Å; V321-L362 HydrophobicContact CG2-CG 4.37Å; V321-W424 HydrophobicContact CB-CE3 4.24Å; V321-W424 HydrophobicContact CB-CZ3 4.1Å; V321-W424 HydrophobicContact CG1-CE3 3.95Å; V321-W424 HydrophobicContact CG1-CZ3 4.31Å; V321-W424 HydrophobicContact CG2-CE3 4.32Å; V321-W424 HydrophobicContact CG2-CZ3 3.89Å
322	A	97.3	Very high	94.1	Very high	20 Å²	20	26.5 Å²	26.5	17%	0.165	14%	0.138	C	C	.	.	H	α-helix	trans	-63.2	-40.7	179.6	0	0	0	0	0	112.7	G318 S319 S320 G326 C425 W429	G318-A322 VanDerWaalsContact O-CB 3.24Å; G318-A322 WeakPolarHBondContact O-CB 3.35Å; G318-A322 PolarHBondContact O-N 2.89Å; S319-A322 PolarHBondContact O-N 3.47Å; S320-A322 PolarHBondContact O-N 3.16Å; A322-G326 WeakPolarHBondContact O-CA 3.29Å; A322-G326 PolarHBondContact O-N 3.01Å; A322-C425 HydrophobicContact CB-CB 4.42Å; A322-C425 PolarHBondContact N-SG 3.36Å; A322-C425 VanDerWaalsContact N-SG 3.41Å; A322-W429 HydrophobicContact CB-CH2 3.75Å; A322-W429 HydrophobicContact CB-CZ2 4.4Å
323	I	96.5	Very high	93.8	Very high	80 Å²	80	27.3 Å²	27.3	41%	0.41	14%	0.142	S	C	.	.	H	α-helix	trans	-69.4	-48.7	176.6	-65.5	164.2	0	0	0	110.1	S319 S320 V321 C325 G326 M327 I354 A358	S319-I323 VanDerWaalsContact O-CG1 3.29Å; S319-I323 WeakPolarHBondContact O-CG1 3.48Å; S319-I323 PolarHBondContact O-N 3.32Å; S320-I323 PolarHBondContact O-N 2.92Å; V321-I323 PolarHBondContact O-N 3.47Å; I323-C325 PolarHBondContact O-N 3.36Å; I323-G326 PolarHBondContact O-N 2.86Å; I323-M327 HydrophobicContact CG2-CG 4.32Å; I323-M327 WeakPolarHBondContact O-CB 3.41Å; I323-M327 WeakPolarHBondContact O-CG 3.17Å; I323-M327 PolarHBondContact O-N 3.48Å; I323-I354 HydrophobicContact CG2-CG2 4.02Å; I323-A358 HydrophobicContact CB-CB 3.81Å; I323-A358 HydrophobicContact CG2-CB 3.64Å
324	T	96	Very high	93.4	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-59	-47.6	-179	-64	0	0	0	0	112.5	V165 M168 S320 V321 N328 Q355 A358 E359	V165-T324 HydrophobicContact CG1-CG2 3.99Å; M168-T324 HydrophobicContact CE-CG2 3.78Å; S320-T324 PolarHBondContact O-N 3.46Å; S320-T324 PolarHBondContact O-OG1 3.3Å; V321-T324 PolarHBondContact O-N 2.92Å; T324-N328 PolarHBondContact O-N 3.38Å; T324-N328 VanDerWaalsContact O-N 3.13Å; T324-Q355 HydrophobicContact CG2-CB 4.48Å; T324-Q355 HydrophobicContact CG2-CG 4.44Å; T324-Q355 PolarHBondContact O-NE2 2.69Å; T324-A358 WeakPolarHBondContact OG1-CB 3.48Å; T324-E359 HydrophobicContact CG2-CG 3.58Å; T324-E359 WeakPolarHBondContact CG2-OE1 3.34Å; T324-E359 WeakPolarHBondContact OG1-CG 3.22Å
325	C	95.2	Very high	92.4	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-74	-33.9	179.1	-63.7	0	0	0	0	112.2	M168 V321 I323 N328 L329 A418 L422	M168-C325 VanDerWaalsContact SD-SG 3.67Å; V321-C325 WeakPolarHBondContact O-CB 3.35Å; V321-C325 PolarHBondContact O-N 2.97Å; V321-C325 PolarHBondContact O-SG 3.31Å; V321-C325 VanDerWaalsContact O-SG 3.4Å; I323-C325 PolarHBondContact O-N 3.36Å; C325-N328 WeakPolarHBondContact O-CB 3.2Å; C325-N328 PolarHBondContact O-N 2.72Å; C325-L329 PolarHBondContact O-N 3.01Å; C325-A418 VanDerWaalsContact O-CB 3.31Å; C325-A418 WeakPolarHBondContact O-CB 3.11Å; C325-L422 HydrophobicContact CB-CG 4.29Å
326	G	95.3	Very high	91.5	Very high	16 Å²	16	25.6 Å²	25.6	17%	0.165	14%	0.141	C	C	.	.	H	α-helix	trans	-62.2	-45.4	172.2	0	0	0	0	0	112.7	A322 I323 N328 L329 F330	A322-G326 WeakPolarHBondContact O-CA 3.29Å; A322-G326 PolarHBondContact O-N 3.01Å; I323-G326 PolarHBondContact O-N 2.86Å; G326-N328 VanDerWaalsContact C-N 3.28Å; G326-N328 PolarHBondContact O-N 3.42Å; G326-L329 WeakPolarHBondContact O-CB 3.41Å; G326-L329 PolarHBondContact O-N 3.32Å; G326-F330 WeakPolarHBondContact O-CD2 3.32Å; G326-F330 WeakPolarHBondContact O-CE2 3.48Å
327	M	94.1	Very high	90.5	Very high	43 Å²	43	28.8 Å²	28.8	21%	0.212	16%	0.157	C	C	.	.	H	α-helix	trans	-63.5	-33.7	173.2	-68.4	-56.7	99.4	0	0	112.3	I323 L329 F330 L351 I354 Q355	I323-M327 HydrophobicContact CG2-CG 4.32Å; I323-M327 WeakPolarHBondContact O-CB 3.41Å; I323-M327 WeakPolarHBondContact O-CG 3.17Å; I323-M327 PolarHBondContact O-N 3.48Å; M327-L329 PolarHBondContact O-N 3.39Å; M327-F330 HydrophobicContact CE-CD2 4.36Å; M327-F330 HydrophobicContact CE-CE2 4.33Å; M327-F330 PolarHBondContact O-N 3.03Å; M327-F330 VanDerWaalsContact O-N 3.12Å; M327-L351 HydrophobicContact CB-CD2 4.47Å; M327-L351 HydrophobicContact SD-CD2 3.69Å; M327-I354 HydrophobicContact CG-CB 4.18Å; M327-I354 HydrophobicContact CG-CG2 3.67Å; M327-I354 HydrophobicContact SD-CB 4.3Å; M327-I354 HydrophobicContact SD-CD1 4.28Å; M327-I354 HydrophobicContact SD-CG2 3.85Å; M327-Q355 HydrophobicContact CB-CG 3.58Å; M327-Q355 HydrophobicContact CG-CG 4.33Å
328	N	92.1	Very high	89.2	Confident	0 Å²	0	31 Å²	31	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-63.4	-32.5	179.2	-142.7	57.6	0	0	0	112.7	M168 E171 T324 C325 G326 F330 L331 P332 Q355 F414 A418	M168-N328 HydrophobicContact CE-CB 3.78Å; M168-N328 VanDerWaalsContact CE-CG 3.47Å; E171-N328 PolarHBondContact OE1-ND2 2.95Å; E171-N328 PolarHBondContact OE1-OD1 3.08Å; E171-N328 VanDerWaalsContact OE1-OD1 3.12Å; E171-N328 PolarHBondContact OE2-ND2 3.36Å; T324-N328 PolarHBondContact O-N 3.38Å; T324-N328 VanDerWaalsContact O-N 3.13Å; C325-N328 WeakPolarHBondContact O-CB 3.2Å; C325-N328 PolarHBondContact O-N 2.72Å; G326-N328 VanDerWaalsContact C-N 3.28Å; G326-N328 PolarHBondContact O-N 3.42Å; N328-F330 PolarHBondContact O-N 3.32Å; N328-L331 PolarHBondContact O-N 3.23Å; N328-L331 WeakPolarHBondContact OD1-CD1 3.5Å; N328-P332 WeakPolarHBondContact O-CD 3.5Å; N328-Q355 PolarHBondContact OD1-NE2 3.33Å; N328-F414 PolarHBondContact ND2-O 3.29Å; N328-A418 HydrophobicContact CB-CB 4.26Å
329	L	91.9	Very high	88.1	Confident	57 Å²	57	38.7 Å²	38.7	30%	0.298	22%	0.222	S	C	.	.	H	α-helix	trans	-60	-30.3	175.8	-158.3	81.2	0	0	0	112.5	C325 G326 M327 Y415 A418	C325-L329 PolarHBondContact O-N 3.01Å; G326-L329 WeakPolarHBondContact O-CB 3.41Å; G326-L329 PolarHBondContact O-N 3.32Å; M327-L329 PolarHBondContact O-N 3.39Å; L329-Y415 HydrophobicContact CD1-CD1 3.92Å; L329-Y415 HydrophobicContact CG-CD1 4.43Å; L329-A418 HydrophobicContact CB-CB 4.14Å; L329-A418 HydrophobicContact CD1-CB 3.74Å
330	F	90.8	Very high	87.4	Confident	101 Å²	101	42.3 Å²	42.3	44%	0.443	24%	0.239	S	C	.	.	H	α-helix	trans	-86	-17.5	-178.6	-64.6	-77.5	0	0	0	113.9	G326 M327 N328 L333 V334 L351	G326-F330 WeakPolarHBondContact O-CD2 3.32Å; G326-F330 WeakPolarHBondContact O-CE2 3.48Å; M327-F330 HydrophobicContact CE-CD2 4.36Å; M327-F330 HydrophobicContact CE-CE2 4.33Å; M327-F330 PolarHBondContact O-N 3.03Å; M327-F330 VanDerWaalsContact O-N 3.12Å; N328-F330 PolarHBondContact O-N 3.32Å; F330-L333 HydrophobicContact CD1-CD2 4.45Å; F330-L333 WeakPolarHBondContact O-CB 3.35Å; F330-L333 PolarHBondContact O-N 3.46Å; F330-V334 PolarHBondContact O-N 2.83Å; F330-L351 HydrophobicContact CB-CD1 3.93Å; F330-L351 HydrophobicContact CB-CD2 4.23Å
331	L	88.2	Confident	86.4	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-59.7	-44.1	-176.4	-79.8	172.8	0	0	0	113.5	I175 N328 L333 V334 I348 L351 F414	I175-L331 HydrophobicContact CD1-CB 4.12Å; N328-L331 PolarHBondContact O-N 3.23Å; N328-L331 WeakPolarHBondContact OD1-CD1 3.5Å; L331-L333 VanDerWaalsContact C-N 3.31Å; L331-L333 PolarHBondContact O-N 3.13Å; L331-V334 PolarHBondContact O-N 3.36Å; L331-I348 HydrophobicContact CD2-CB 4.48Å; L331-I348 HydrophobicContact CD2-CG1 4.45Å; L331-I348 HydrophobicContact CD2-CG2 4Å; L331-L351 HydrophobicContact CD2-CB 3.9Å; L331-L351 HydrophobicContact CD2-CD1 3.82Å; L331-L351 HydrophobicContact CG-CB 4.45Å; L331-L351 HydrophobicContact CG-CD1 4.18Å; L331-F414 HydrophobicContact CB-CD1 3.81Å; L331-F414 HydrophobicContact CB-CE1 3.92Å; L331-F414 HydrophobicContact CD1-CD1 3.98Å; L331-F414 HydrophobicContact CD1-CE1 3.69Å; L331-F414 HydrophobicContact CG-CE1 4.45Å
332	P	84.6	Confident	85.6	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-65.9	-28.9	172.4	-22.5	34.6	0	0	0	114	N328 V334 E335 W410 F414 Y415	N328-P332 WeakPolarHBondContact O-CD 3.5Å; P332-V334 VanDerWaalsContact C-N 3.34Å; P332-E335 PolarHBondContact O-N 3.07Å; P332-W410 HydrophobicContact CB-CH2 4.48Å; P332-W410 HydrophobicContact CB-CZ3 4.21Å; P332-W410 HydrophobicContact CG-CZ3 4.39Å; P332-F414 HydrophobicContact CG-CB 3.52Å; P332-F414 HydrophobicContact CG-CD2 4.25Å; P332-F414 HydrophobicContact CG-CG 3.86Å; P332-Y415 HydrophobicContact CB-CE1 4.26Å; P332-Y415 HydrophobicContact CB-CE2 4.34Å; P332-Y415 HydrophobicContact CG-CD1 4.5Å; P332-Y415 HydrophobicContact CG-CE1 4.06Å; P332-Y415 HydrophobicContact CG-CE2 4.48Å
333	L	85.1	Confident	85	Confident	71 Å²	71	48.5 Å²	48.5	37%	0.372	28%	0.275	S	S	.	.	H	α-helix	trans	-68.8	-31.7	178.3	-86.6	72.5	0	0	0	111.8	F330 L331 E335 T336 I337 Y415	F330-L333 HydrophobicContact CD1-CD2 4.45Å; F330-L333 WeakPolarHBondContact O-CB 3.35Å; F330-L333 PolarHBondContact O-N 3.46Å; L331-L333 VanDerWaalsContact C-N 3.31Å; L331-L333 PolarHBondContact O-N 3.13Å; L333-E335 PolarHBondContact O-N 3.25Å; L333-T336 PolarHBondContact O-N 3.35Å; L333-T336 PolarHBondContact O-OG1 3.31Å; L333-I337 WeakPolarHBondContact O-CG1 3.48Å; L333-I337 PolarHBondContact O-N 3.4Å; L333-Y415 HydrophobicContact CD1-CE1 4.08Å; L333-Y415 WeakPolarHBondContact CD1-OH 3.26Å
334	V	84.7	Confident	84.3	Confident	7 Å²	7	46.1 Å²	46.1	4%	0.042	26%	0.261	C	S	.	.	H	α-helix	trans	-60.2	-30.6	178.5	179.1	0	0	0	0	111.8	F330 L331 P332 T336 I337 K344 M347 I348 L351	F330-V334 PolarHBondContact O-N 2.83Å; L331-V334 PolarHBondContact O-N 3.36Å; P332-V334 VanDerWaalsContact C-N 3.34Å; V334-T336 VanDerWaalsContact C-N 3.28Å; V334-T336 PolarHBondContact O-N 3.41Å; V334-I337 PolarHBondContact O-N 3.24Å; V334-K344 HydrophobicContact CG1-CB 4.16Å; V334-K344 HydrophobicContact CG1-CG 4.26Å; V334-K344 WeakPolarHBondContact O-CE 3.37Å; V334-M347 HydrophobicContact CG1-CB 3.61Å; V334-M347 HydrophobicContact CG1-SD 4.33Å; V334-M347 HydrophobicContact CG2-CB 4.1Å; V334-I348 HydrophobicContact CB-CG1 4.24Å; V334-I348 HydrophobicContact CG1-CD1 4.46Å; V334-I348 HydrophobicContact CG1-CG1 3.87Å; V334-L351 HydrophobicContact CG2-CD1 3.61Å
335	E	73.6	Confident	83.6	Confident	14 Å²	14	46.8 Å²	46.8	7%	0.065	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-21.4	173.9	-86.4	-149.3	-157	0	0	114.4	N178 P332 L333 K344 W410	N178-E335 PolarHBondContact ND2-OE1 3.32Å; N178-E335 PolarHBondContact ND2-OE2 2.96Å; P332-E335 PolarHBondContact O-N 3.07Å; L333-E335 PolarHBondContact O-N 3.25Å; E335-K344 WeakPolarHBondContact O-CE 3.33Å; E335-K344 PolarHBondContact O-NZ 3.02Å; E335-W410 HydrophobicContact CB-CH2 4.18Å; E335-W410 HydrophobicContact CB-CZ2 4.46Å; E335-W410 HydrophobicContact CG-CH2 3.92Å; E335-W410 HydrophobicContact CG-CZ2 4.16Å; E335-W410 WeakPolarHBondContact OE1-CZ2 3.24Å
336	T	76.9	Confident	83.2	Confident	74 Å²	74	51.7 Å²	51.7	45%	0.454	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-14	174.2	68.9	0	0	0	0	113.2	L333 V334 G338	L333-T336 PolarHBondContact O-N 3.35Å; L333-T336 PolarHBondContact O-OG1 3.31Å; V334-T336 VanDerWaalsContact C-N 3.28Å; V334-T336 PolarHBondContact O-N 3.41Å; T336-G338 PolarHBondContact O-N 3.27Å; T336-G338 VanDerWaalsContact O-N 3.08Å
337	I	74.9	Confident	82.8	Confident	92 Å²	92	54.9 Å²	54.9	47%	0.472	30%	0.302	S	S	.	.	S	Bend	trans	-81.5	91.1	-175.9	-61.1	173.2	0	0	0	110.6	L333 V334 K344 M347	L333-I337 WeakPolarHBondContact O-CG1 3.48Å; L333-I337 PolarHBondContact O-N 3.4Å; V334-I337 PolarHBondContact O-N 3.24Å; I337-K344 WeakPolarHBondContact O-CE 3.28Å; I337-M347 HydrophobicContact CD1-SD 4.36Å; I337-M347 HydrophobicContact CG2-SD 4.45Å
338	G	69.4	Low	82.6	Confident	47 Å²	47	52.9 Å²	52.9	49%	0.485	29%	0.292	S	S	.	.			trans	67.5	-168	170.4	0	0	0	0	0	115.4	T336 K344	T336-G338 PolarHBondContact O-N 3.27Å; T336-G338 VanDerWaalsContact O-N 3.08Å; G338-K344 WeakPolarHBondContact O-CE 3.19Å; G338-K344 PolarHBondContact O-NZ 3.44Å
339	N	73.8	Confident	82.4	Confident	162 Å²	162	55 Å²	55	87%	0.866	30%	0.303	S	S	*	.	S	Bend	trans	-110.2	-6.1	-176.9	-72.4	-16.2	0	0	0	114.4	I341	N339-I341 PolarHBondContact O-N 3.13Å
340	N	80.7	Confident	82.5	Confident	99 Å²	99	56.9 Å²	56.9	53%	0.529	31%	0.312	S	S	.	.			trans	-79.3	107	-176.6	-173.6	-24.7	0	0	0	111.5	N342 A343 K344	N340-N342 VanDerWaalsContact C-N 3.29Å; N340-N342 PolarHBondContact O-N 2.95Å; N340-N342 PolarHBondContact OD1-N 3.42Å; N340-A343 HydrophobicContact CB-CB 4.07Å; N340-A343 PolarHBondContact O-N 3.04Å; N340-A343 PolarHBondContact OD1-N 3.02Å; N340-K344 PolarHBondContact O-N 2.81Å
341	I	76.8	Confident	82.5	Confident	24 Å²	24	53.2 Å²	53.2	12%	0.123	30%	0.297	C	S	.	.	H	α-helix	trans	-60.7	-33.7	-178	-166.6	61.3	0	0	0	113.4	L179 T182 I186 N339 K344 L345	L179-I341 HydrophobicContact CD2-CD1 4.24Å; T182-I341 HydrophobicContact CG2-CD1 3.79Å; I186-I341 HydrophobicContact CD1-CB 4.37Å; I186-I341 HydrophobicContact CD1-CG2 4.25Å; N339-I341 PolarHBondContact O-N 3.13Å; I341-K344 PolarHBondContact O-N 3.04Å; I341-L345 HydrophobicContact CG1-CD1 4.48Å; I341-L345 WeakPolarHBondContact O-CG 3.18Å; I341-L345 PolarHBondContact O-N 3.44Å
342	N	80.5	Confident	82.7	Confident	90 Å²	90	53.4 Å²	53.4	48%	0.481	30%	0.298	S	S	.	.	H	α-helix	trans	-72.3	-39.5	-179.9	-67.5	-30.4	0	0	0	111.1	N340 L345 I346	N340-N342 VanDerWaalsContact C-N 3.29Å; N340-N342 PolarHBondContact O-N 2.95Å; N340-N342 PolarHBondContact OD1-N 3.42Å; N342-L345 PolarHBondContact O-N 2.91Å; N342-I346 VanDerWaalsContact O-CG1 3.31Å; N342-I346 WeakPolarHBondContact O-CG1 3.18Å; N342-I346 PolarHBondContact O-N 2.98Å
343	A	83.4	Confident	83.1	Confident	42 Å²	42	56.3 Å²	56.3	35%	0.347	31%	0.313	S	S	.	.	H	α-helix	trans	-62.4	-42.5	174.6	0	0	0	0	0	111.6	N340 I346 M347	N340-A343 HydrophobicContact CB-CB 4.07Å; N340-A343 PolarHBondContact O-N 3.04Å; N340-A343 PolarHBondContact OD1-N 3.02Å; A343-I346 PolarHBondContact O-N 3.43Å; A343-M347 WeakPolarHBondContact O-CG 3.2Å; A343-M347 PolarHBondContact O-N 3.1Å
344	K	81.5	Confident	83.6	Confident	29 Å²	29	56.4 Å²	56.4	13%	0.126	31%	0.313	C	S	.	.	H	α-helix	trans	-61.9	-46.8	175	-69.2	-174.9	179	176.4	0	112.4	V334 E335 I337 G338 N340 I341 I346 M347 I348	V334-K344 HydrophobicContact CG1-CB 4.16Å; V334-K344 HydrophobicContact CG1-CG 4.26Å; V334-K344 WeakPolarHBondContact O-CE 3.37Å; E335-K344 WeakPolarHBondContact O-CE 3.33Å; E335-K344 PolarHBondContact O-NZ 3.02Å; I337-K344 WeakPolarHBondContact O-CE 3.28Å; G338-K344 WeakPolarHBondContact O-CE 3.19Å; G338-K344 PolarHBondContact O-NZ 3.44Å; N340-K344 PolarHBondContact O-N 2.81Å; I341-K344 PolarHBondContact O-N 3.04Å; K344-I346 VanDerWaalsContact C-N 3.34Å; K344-I346 PolarHBondContact O-N 3.39Å; K344-M347 PolarHBondContact O-N 3.14Å; K344-I348 VanDerWaalsContact O-CG1 3.29Å; K344-I348 WeakPolarHBondContact O-CG1 3.42Å; K344-I348 PolarHBondContact O-N 2.92Å
345	L	81.8	Confident	84.1	Confident	14 Å²	14	56 Å²	56	7%	0.073	31%	0.311	C	S	.	.	H	α-helix	trans	-58.1	-45	176.2	-77.4	168.7	0	0	0	111.9	L179 V289 I341 N342 I348 I349	L179-L345 HydrophobicContact CD1-CD2 3.85Å; L179-L345 HydrophobicContact CD2-CD2 3.89Å; L179-L345 HydrophobicContact CD2-CG 4.42Å; L179-L345 HydrophobicContact CG-CD2 4.44Å; V289-L345 HydrophobicContact CG2-CD2 4.45Å; I341-L345 HydrophobicContact CG1-CD1 4.48Å; I341-L345 WeakPolarHBondContact O-CG 3.18Å; I341-L345 PolarHBondContact O-N 3.44Å; N342-L345 PolarHBondContact O-N 2.91Å; L345-I348 PolarHBondContact O-N 2.99Å; L345-I349 WeakPolarHBondContact O-CB 3.34Å; L345-I349 WeakPolarHBondContact O-CD1 3.2Å; L345-I349 VanDerWaalsContact O-CG1 3.25Å; L345-I349 WeakPolarHBondContact O-CG1 3.29Å; L345-I349 PolarHBondContact O-N 3.14Å
346	I	87	Confident	85.1	Confident	103 Å²	103	55.4 Å²	55.4	53%	0.528	31%	0.308	S	S	.	.	H	α-helix	trans	-63	-45.1	177.4	-67.9	165	0	0	0	111.1	N342 A343 K344 I349 L350	N342-I346 VanDerWaalsContact O-CG1 3.31Å; N342-I346 WeakPolarHBondContact O-CG1 3.18Å; N342-I346 PolarHBondContact O-N 2.98Å; A343-I346 PolarHBondContact O-N 3.43Å; K344-I346 VanDerWaalsContact C-N 3.34Å; K344-I346 PolarHBondContact O-N 3.39Å; I346-I349 PolarHBondContact O-N 3.21Å; I346-L350 HydrophobicContact CG2-CD1 3.96Å; I346-L350 HydrophobicContact CG2-CG 4.43Å; I346-L350 WeakPolarHBondContact O-CG 3.29Å; I346-L350 PolarHBondContact O-N 2.9Å
347	M	88	Confident	85.9	Confident	84 Å²	84	55.9 Å²	55.9	41%	0.414	31%	0.307	S	S	.	.	H	α-helix	trans	-63.3	-41.5	177.3	-76.6	-175.3	175.2	0	0	113	V334 I337 A343 K344 L350 L351	V334-M347 HydrophobicContact CG1-CB 3.61Å; V334-M347 HydrophobicContact CG1-SD 4.33Å; V334-M347 HydrophobicContact CG2-CB 4.1Å; I337-M347 HydrophobicContact CD1-SD 4.36Å; I337-M347 HydrophobicContact CG2-SD 4.45Å; A343-M347 WeakPolarHBondContact O-CG 3.2Å; A343-M347 PolarHBondContact O-N 3.1Å; K344-M347 PolarHBondContact O-N 3.14Å; M347-L350 PolarHBondContact O-N 3.45Å; M347-L351 WeakPolarHBondContact O-CG 3.44Å; M347-L351 PolarHBondContact O-N 3.03Å
348	I	88	Confident	86.9	Confident	1 Å²	1	52 Å²	52	1%	0.005	29%	0.289	C	S	.	.	H	α-helix	trans	-63.6	-43.1	175.7	-65.7	166.3	0	0	0	110.3	I175 L179 V289 L331 V334 K344 L345 L351 R352	I175-I348 HydrophobicContact CG2-CD1 4.23Å; L179-I348 HydrophobicContact CD1-CD1 4.31Å; L179-I348 HydrophobicContact CD2-CD1 4.24Å; V289-I348 HydrophobicContact CG1-CG2 3.53Å; L331-I348 HydrophobicContact CD2-CB 4.48Å; L331-I348 HydrophobicContact CD2-CG1 4.45Å; L331-I348 HydrophobicContact CD2-CG2 4Å; V334-I348 HydrophobicContact CB-CG1 4.24Å; V334-I348 HydrophobicContact CG1-CD1 4.46Å; V334-I348 HydrophobicContact CG1-CG1 3.87Å; K344-I348 VanDerWaalsContact O-CG1 3.29Å; K344-I348 WeakPolarHBondContact O-CG1 3.42Å; K344-I348 PolarHBondContact O-N 2.92Å; L345-I348 PolarHBondContact O-N 2.99Å; I348-L351 PolarHBondContact O-N 2.93Å; I348-R352 HydrophobicContact CG2-CG 4.25Å; I348-R352 VanDerWaalsContact O-CB 3.31Å; I348-R352 WeakPolarHBondContact O-CB 3.44Å; I348-R352 VanDerWaalsContact O-CG 3.23Å; I348-R352 WeakPolarHBondContact O-CG 3.3Å; I348-R352 PolarHBondContact O-N 3.37Å
349	I	89.6	Confident	88.1	Confident	45 Å²	45	49.9 Å²	49.9	23%	0.231	27%	0.266	C	S	.	.	H	α-helix	trans	-62.5	-42.8	176.4	-69.9	165.3	0	0	0	110.9	I288 V289 L345 I346 R352 L353	I288-I349 HydrophobicContact CG2-CD1 4.37Å; V289-I349 HydrophobicContact CG1-CG1 4.47Å; V289-I349 HydrophobicContact CG2-CD1 4.4Å; V289-I349 HydrophobicContact CG2-CG1 4.03Å; L345-I349 WeakPolarHBondContact O-CB 3.34Å; L345-I349 WeakPolarHBondContact O-CD1 3.2Å; L345-I349 VanDerWaalsContact O-CG1 3.25Å; L345-I349 WeakPolarHBondContact O-CG1 3.29Å; L345-I349 PolarHBondContact O-N 3.14Å; I346-I349 PolarHBondContact O-N 3.21Å; I349-R352 PolarHBondContact O-N 3.46Å; I349-L353 HydrophobicContact CG2-CD1 3.92Å; I349-L353 HydrophobicContact CG2-CG 4.32Å; I349-L353 WeakPolarHBondContact O-CB 3.39Å; I349-L353 VanDerWaalsContact O-CG 3.26Å; I349-L353 WeakPolarHBondContact O-CG 3.38Å; I349-L353 PolarHBondContact O-N 2.95Å
350	L	92.4	Very high	89.1	Confident	95 Å²	95	42.1 Å²	42.1	50%	0.497	23%	0.225	S	C	.	.	H	α-helix	trans	-63.5	-44.5	177.3	-72.3	170.4	0	0	0	112.4	I346 M347 L353 I354	I346-L350 HydrophobicContact CG2-CD1 3.96Å; I346-L350 HydrophobicContact CG2-CG 4.43Å; I346-L350 WeakPolarHBondContact O-CG 3.29Å; I346-L350 PolarHBondContact O-N 2.9Å; M347-L350 PolarHBondContact O-N 3.45Å; L350-L353 PolarHBondContact O-N 3.33Å; L350-I354 WeakPolarHBondContact O-CG1 3.41Å; L350-I354 PolarHBondContact O-N 3.21Å
351	L	92.7	Very high	89.8	Confident	24 Å²	24	38 Å²	38	13%	0.126	20%	0.204	C	C	.	.	H	α-helix	trans	-62	-44.3	174.5	-72.3	174.4	0	0	0	111.7	M327 F330 L331 V334 M347 I348 I354 Q355	M327-L351 HydrophobicContact CB-CD2 4.47Å; M327-L351 HydrophobicContact SD-CD2 3.69Å; F330-L351 HydrophobicContact CB-CD1 3.93Å; F330-L351 HydrophobicContact CB-CD2 4.23Å; L331-L351 HydrophobicContact CD2-CB 3.9Å; L331-L351 HydrophobicContact CD2-CD1 3.82Å; L331-L351 HydrophobicContact CG-CB 4.45Å; L331-L351 HydrophobicContact CG-CD1 4.18Å; V334-L351 HydrophobicContact CG2-CD1 3.61Å; M347-L351 WeakPolarHBondContact O-CG 3.44Å; M347-L351 PolarHBondContact O-N 3.03Å; I348-L351 PolarHBondContact O-N 2.93Å; L351-I354 PolarHBondContact O-N 3.42Å; L351-Q355 WeakPolarHBondContact O-CG 3.27Å; L351-Q355 PolarHBondContact O-N 2.9Å
352	R	91.4	Very high	90.7	Very high	5 Å²	5	37.1 Å²	37.1	2%	0.019	20%	0.199	C	C	.	.	H	α-helix	trans	-65.9	-35.4	178.4	-74	-79.5	177.4	-166.9	2.9	112.7	V289 S292 V293 I348 I349 Q355 G356	V289-R352 HydrophobicContact CG1-CG 4.2Å; S292-R352 VanDerWaalsContact OG-CB 3.25Å; S292-R352 WeakPolarHBondContact OG-CB 3.41Å; V293-R352 HydrophobicContact CG2-CB 3.85Å; V293-R352 VanDerWaalsContact CG2-CD 3.43Å; V293-R352 HydrophobicContact CG2-CG 4.24Å; I348-R352 HydrophobicContact CG2-CG 4.25Å; I348-R352 VanDerWaalsContact O-CB 3.31Å; I348-R352 WeakPolarHBondContact O-CB 3.44Å; I348-R352 VanDerWaalsContact O-CG 3.23Å; I348-R352 WeakPolarHBondContact O-CG 3.3Å; I348-R352 PolarHBondContact O-N 3.37Å; I349-R352 PolarHBondContact O-N 3.46Å; R352-Q355 PolarHBondContact O-N 2.97Å; R352-G356 PolarHBondContact O-N 3.29Å
353	L	93.7	Very high	91.4	Very high	61 Å²	61	33.9 Å²	33.9	32%	0.319	18%	0.181	S	C	.	.	H	α-helix	trans	-62.1	-49.7	170.1	-75.2	167.7	0	0	0	110.8	A296 I349 L350 Q355 G356 L357	A296-L353 HydrophobicContact CB-CD2 4.01Å; A296-L353 VanDerWaalsContact CB-O 3.29Å; A296-L353 WeakPolarHBondContact CB-O 3.44Å; I349-L353 HydrophobicContact CG2-CD1 3.92Å; I349-L353 HydrophobicContact CG2-CG 4.32Å; I349-L353 WeakPolarHBondContact O-CB 3.39Å; I349-L353 VanDerWaalsContact O-CG 3.26Å; I349-L353 WeakPolarHBondContact O-CG 3.38Å; I349-L353 PolarHBondContact O-N 2.95Å; L350-L353 PolarHBondContact O-N 3.33Å; L353-Q355 VanDerWaalsContact C-N 3.31Å; L353-Q355 PolarHBondContact O-N 3.5Å; L353-G356 PolarHBondContact O-N 2.93Å; L353-G356 VanDerWaalsContact O-N 3.08Å; L353-L357 WeakPolarHBondContact O-CG 3.47Å; L353-L357 PolarHBondContact O-N 3.48Å
354	I	95.2	Very high	92	Very high	72 Å²	72	31.9 Å²	31.9	37%	0.369	17%	0.165	S	C	.	.	H	α-helix	trans	-61.4	-39.6	178.8	-62.5	163.2	0	0	0	111.3	I323 M327 L350 L351 L357 A358	I323-I354 HydrophobicContact CG2-CG2 4.02Å; M327-I354 HydrophobicContact CG-CB 4.18Å; M327-I354 HydrophobicContact CG-CG2 3.67Å; M327-I354 HydrophobicContact SD-CB 4.3Å; M327-I354 HydrophobicContact SD-CD1 4.28Å; M327-I354 HydrophobicContact SD-CG2 3.85Å; L350-I354 WeakPolarHBondContact O-CG1 3.41Å; L350-I354 PolarHBondContact O-N 3.21Å; L351-I354 PolarHBondContact O-N 3.42Å; I354-L357 PolarHBondContact O-N 3.26Å; I354-A358 PolarHBondContact O-N 3.37Å
355	Q	94.5	Very high	92.7	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-58.7	-48.6	171	-73.3	-176.6	-49.6	0	0	111.8	T324 M327 N328 L351 R352 L353 L357 A358 E359	T324-Q355 HydrophobicContact CG2-CB 4.48Å; T324-Q355 HydrophobicContact CG2-CG 4.44Å; T324-Q355 PolarHBondContact O-NE2 2.69Å; M327-Q355 HydrophobicContact CB-CG 3.58Å; M327-Q355 HydrophobicContact CG-CG 4.33Å; N328-Q355 PolarHBondContact OD1-NE2 3.33Å; L351-Q355 WeakPolarHBondContact O-CG 3.27Å; L351-Q355 PolarHBondContact O-N 2.9Å; R352-Q355 PolarHBondContact O-N 2.97Å; L353-Q355 VanDerWaalsContact C-N 3.31Å; L353-Q355 PolarHBondContact O-N 3.5Å; Q355-L357 PolarHBondContact O-N 3.12Å; Q355-A358 PolarHBondContact O-N 3.01Å; Q355-E359 WeakPolarHBondContact O-CB 3.47Å; Q355-E359 VanDerWaalsContact O-CG 3.3Å; Q355-E359 WeakPolarHBondContact O-CG 3.3Å; Q355-E359 PolarHBondContact O-N 2.92Å
356	G	94	Very high	93.5	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-62.5	-38.4	178.4	0	0	0	0	0	113.9	V293 Y297 R352 L353 G360	V293-G356 WeakPolarHBondContact O-CA 3.37Å; Y297-G356 VanDerWaalsContact CA-O 3.23Å; Y297-G356 WeakPolarHBondContact CA-O 3.47Å; Y297-G356 PolarHBondContact N-O 2.95Å; R352-G356 PolarHBondContact O-N 3.29Å; L353-G356 PolarHBondContact O-N 2.93Å; L353-G356 VanDerWaalsContact O-N 3.08Å; G356-G360 PolarHBondContact O-N 2.95Å
357	L	95.5	Very high	93.9	Very high	84 Å²	84	24.9 Å²	24.9	44%	0.44	13%	0.13	S	C	.	.	H	α-helix	trans	-59	-49.3	172.6	-64	177.8	0	0	0	110.3	A296 T300 L353 I354 Q355	A296-L357 HydrophobicContact CB-CD2 3.88Å; A296-L357 HydrophobicContact CB-CG 4.03Å; T300-L357 WeakPolarHBondContact CB-O 3.26Å; T300-L357 WeakPolarHBondContact CG2-O 3.44Å; T300-L357 WeakPolarHBondContact OG1-CD2 3.2Å; L353-L357 WeakPolarHBondContact O-CG 3.47Å; L353-L357 PolarHBondContact O-N 3.48Å; I354-L357 PolarHBondContact O-N 3.26Å; Q355-L357 PolarHBondContact O-N 3.12Å
358	A	95.8	Very high	94.2	Very high	10 Å²	10	20.9 Å²	20.9	8%	0.083	11%	0.111	C	C	.	.	H	α-helix	trans	-66.9	-42.9	179.8	0	0	0	0	0	113	S320 I323 T324 I354 Q355 G360 C361	S320-A358 WeakPolarHBondContact CB-O 3.35Å; S320-A358 PolarHBondContact OG-O 3.38Å; I323-A358 HydrophobicContact CB-CB 3.81Å; I323-A358 HydrophobicContact CG2-CB 3.64Å; T324-A358 WeakPolarHBondContact OG1-CB 3.48Å; I354-A358 PolarHBondContact O-N 3.37Å; Q355-A358 PolarHBondContact O-N 3.01Å; A358-G360 VanDerWaalsContact C-N 3.32Å; A358-G360 PolarHBondContact O-N 3.29Å; A358-C361 PolarHBondContact O-N 3.4Å
359	E	94.5	Very high	94.5	Very high	3 Å²	3	20.9 Å²	20.9	1%	0.014	11%	0.11	C	C	.	.	H	α-helix	trans	-63.7	-33.3	178.7	-75.5	-178.2	-138.4	0	0	112.6	V165 R169 Y297 T324 Q355 C361 L362	V165-E359 HydrophobicContact CG1-CG 3.71Å; R169-E359 IonicContact CZ-OE2 3.81Å; R169-E359 VanDerWaalsContact CZ-OE2 3.31Å; R169-E359 IonicContact NE-OE2 2.72Å; R169-E359 PolarHBondContact NE-OE2 2.76Å; R169-E359 VanDerWaalsContact NE-OE2 3.12Å; R169-E359 IonicContact NH2-OE2 3.44Å; R169-E359 PolarHBondContact NH2-OE2 3.42Å; Y297-E359 VanDerWaalsContact CD2-C 3.48Å; Y297-E359 HydrophobicContact CD2-CB 3.58Å; Y297-E359 HydrophobicContact CE2-CB 3.9Å; Y297-E359 VanDerWaalsContact CE2-O 3.31Å; Y297-E359 WeakPolarHBondContact CE2-O 3.31Å; T324-E359 HydrophobicContact CG2-CG 3.58Å; T324-E359 WeakPolarHBondContact CG2-OE1 3.34Å; T324-E359 WeakPolarHBondContact OG1-CG 3.22Å; Q355-E359 WeakPolarHBondContact O-CB 3.47Å; Q355-E359 VanDerWaalsContact O-CG 3.3Å; Q355-E359 WeakPolarHBondContact O-CG 3.3Å; Q355-E359 PolarHBondContact O-N 2.92Å; E359-C361 PolarHBondContact O-N 3.37Å; E359-L362 WeakPolarHBondContact O-CB 3.4Å; E359-L362 PolarHBondContact O-N 3.09Å
360	G	94.6	Very high	94.8	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-57.6	-31.4	178.1	0	0	0	0	0	113.3	S301 G356 A358 L362 P364	S301-G360 WeakPolarHBondContact CA-O 3.44Å; S301-G360 PolarHBondContact OG-O 2.95Å; G356-G360 PolarHBondContact O-N 2.95Å; A358-G360 VanDerWaalsContact C-N 3.32Å; A358-G360 PolarHBondContact O-N 3.29Å; G360-L362 VanDerWaalsContact C-N 3.31Å; G360-L362 PolarHBondContact O-N 3.5Å; G360-P364 VanDerWaalsContact O-CD 3.27Å; G360-P364 WeakPolarHBondContact O-CD 3.49Å; G360-P364 WeakPolarHBondContact O-CG 3.49Å
361	C	95.6	Very high	94.8	Very high	12 Å²	12	14.5 Å²	14.5	8%	0.081	8%	0.077	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-15.8	176.2	-67.5	0	0	0	0	114.3	G304 L316 A358 E359 S365	G304-C361 VanDerWaalsContact CA-SG 3.5Å; L316-C361 HydrophobicContact CD1-CB 4.35Å; L316-C361 HydrophobicContact CG-CB 4.32Å; A358-C361 PolarHBondContact O-N 3.4Å; E359-C361 PolarHBondContact O-N 3.37Å; C361-S365 WeakPolarHBondContact O-CB 3.29Å; C361-S365 PolarHBondContact O-N 3.08Å; C361-S365 PolarHBondContact O-OG 2.98Å
362	L	95.1	Very high	94.8	Very high	5 Å²	5	13.6 Å²	13.6	3%	0.026	7%	0.072	C	C	.	.	H	α-helix	trans	-69.4	-59.2	-164.2	-161.6	169.1	0	0	0	112.3	L162 V165 L317 S320 V321 E359 G360 S365 V366	L162-L362 HydrophobicContact CD2-CD2 3.78Å; L162-L362 HydrophobicContact CG-CD2 4.02Å; V165-L362 HydrophobicContact CB-CD1 3.86Å; V165-L362 HydrophobicContact CG1-CD1 3.71Å; V165-L362 HydrophobicContact CG2-CD1 3.92Å; L317-L362 HydrophobicContact CD1-CD2 3.75Å; L317-L362 HydrophobicContact CD1-CG 3.74Å; S320-L362 WeakPolarHBondContact OG-CB 3.38Å; V321-L362 HydrophobicContact CG2-CD1 4.07Å; V321-L362 HydrophobicContact CG2-CG 4.37Å; E359-L362 WeakPolarHBondContact O-CB 3.4Å; E359-L362 PolarHBondContact O-N 3.09Å; G360-L362 VanDerWaalsContact C-N 3.31Å; G360-L362 PolarHBondContact O-N 3.5Å; L362-S365 PolarHBondContact O-N 3.36Å; L362-V366 HydrophobicContact CD2-CG2 4.3Å; L362-V366 PolarHBondContact O-N 2.88Å; L362-V366 VanDerWaalsContact O-N 3.13Å
363	I	95.1	Very high	94.8	Very high	22 Å²	22	13.4 Å²	13.4	11%	0.113	7%	0.071	C	C	.	.	H	α-helix	trans	-63.3	-43.6	179.6	-54.2	-172.5	0	0	0	112.1	L162 Y297 S365 V366 F367 M612	L162-I363 HydrophobicContact CD2-CD1 4.32Å; L162-I363 HydrophobicContact CD2-CG1 3.97Å; Y297-I363 WeakPolarHBondContact OH-CD1 3.32Å; I363-S365 VanDerWaalsContact C-N 3.28Å; I363-S365 PolarHBondContact O-N 2.92Å; I363-V366 PolarHBondContact O-N 3.3Å; I363-F367 HydrophobicContact CG2-CD2 4.04Å; I363-F367 HydrophobicContact CG2-CE2 4Å; I363-F367 WeakPolarHBondContact O-CD2 3.33Å; I363-F367 PolarHBondContact O-N 3.36Å; I363-M612 HydrophobicContact CG2-CE 3.68Å; I363-M612 HydrophobicContact CG2-CG 3.97Å; I363-M612 HydrophobicContact CG2-SD 4.13Å
364	P	96.4	Very high	94.8	Very high	0 Å²	0	10.5 Å²	10.5	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-53.4	-43.3	172.3	-29.8	38.4	0	0	0	113.3	G360 F367 G368 G609	G360-P364 VanDerWaalsContact O-CD 3.27Å; G360-P364 WeakPolarHBondContact O-CD 3.49Å; G360-P364 WeakPolarHBondContact O-CG 3.49Å; P364-F367 PolarHBondContact O-N 2.83Å; P364-G368 PolarHBondContact O-N 3.39Å; P364-G609 WeakPolarHBondContact O-CA 3.43Å
365	S	96.5	Very high	94.5	Very high	0 Å²	0	7 Å²	7	0%	0	4%	0.038	C	C	.	.	H	α-helix	trans	-63.7	-41.5	178.4	-57	0	0	0	0	112.6	L316 C361 L362 I363 F367 G368 I369	L316-S365 WeakPolarHBondContact CD2-OG 3.48Å; L316-S365 VanDerWaalsContact CG-OG 3.3Å; L316-S365 WeakPolarHBondContact CG-OG 3.18Å; C361-S365 WeakPolarHBondContact O-CB 3.29Å; C361-S365 PolarHBondContact O-N 3.08Å; C361-S365 PolarHBondContact O-OG 2.98Å; L362-S365 PolarHBondContact O-N 3.36Å; I363-S365 VanDerWaalsContact C-N 3.28Å; I363-S365 PolarHBondContact O-N 2.92Å; S365-F367 VanDerWaalsContact C-N 3.31Å; S365-F367 PolarHBondContact O-N 3.08Å; S365-G368 CarbonylContact O-C 3.54Å; S365-G368 WeakPolarHBondContact O-CA 3.41Å; S365-G368 PolarHBondContact O-N 3.1Å; S365-G368 VanDerWaalsContact O-N 3.09Å; S365-I369 WeakPolarHBondContact O-CD1 3.44Å; S365-I369 VanDerWaalsContact O-CG1 3.31Å; S365-I369 WeakPolarHBondContact O-CG1 3.47Å; S365-I369 PolarHBondContact O-N 2.78Å
366	V	97.1	Very high	94.1	Very high	0 Å²	0	10.1 Å²	10.1	0%	0	5%	0.054	C	C	.	.	H	α-helix	trans	-55.9	-45.4	174.2	172.1	0	0	0	0	110.9	C158 L317 L362 I363 I369 L370	C158-V366 HydrophobicContact CB-CG1 4.02Å; C158-V366 HydrophobicContact CB-CG2 4.15Å; L317-V366 HydrophobicContact CD1-CG2 4.06Å; L317-V366 HydrophobicContact CD2-CG2 3.95Å; L362-V366 HydrophobicContact CD2-CG2 4.3Å; L362-V366 PolarHBondContact O-N 2.88Å; L362-V366 VanDerWaalsContact O-N 3.13Å; I363-V366 PolarHBondContact O-N 3.3Å; V366-I369 PolarHBondContact O-N 2.98Å; V366-L370 HydrophobicContact CG1-CD1 3.71Å; V366-L370 HydrophobicContact CG1-CG 4.35Å; V366-L370 WeakPolarHBondContact O-CB 3.25Å; V366-L370 VanDerWaalsContact O-CG 3.27Å; V366-L370 WeakPolarHBondContact O-CG 3.48Å; V366-L370 PolarHBondContact O-N 2.72Å
367	F	96.6	Very high	93.8	Very high	0 Å²	0	14.2 Å²	14.2	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-71.2	-30.2	176.5	-80.5	-99	0	0	0	113.5	I363 P364 S365 I369 R371 V383 V387 A597 V600 I601 S608 M612	I363-F367 HydrophobicContact CG2-CD2 4.04Å; I363-F367 HydrophobicContact CG2-CE2 4Å; I363-F367 WeakPolarHBondContact O-CD2 3.33Å; I363-F367 PolarHBondContact O-N 3.36Å; P364-F367 PolarHBondContact O-N 2.83Å; S365-F367 VanDerWaalsContact C-N 3.31Å; S365-F367 PolarHBondContact O-N 3.08Å; F367-I369 VanDerWaalsContact C-N 3.33Å; F367-R371 PolarHBondContact O-N 3.5Å; F367-V383 HydrophobicContact CE1-CG1 4.23Å; F367-V383 HydrophobicContact CZ-CG1 4.16Å; F367-V387 HydrophobicContact CE2-CG1 4.05Å; F367-V387 HydrophobicContact CZ-CG1 4.26Å; F367-A597 WeakPolarHBondContact CE1-O 3.32Å; F367-A597 HydrophobicContact CZ-CB 4.33Å; F367-V600 HydrophobicContact CD1-CB 4.1Å; F367-V600 HydrophobicContact CD1-CG1 4.12Å; F367-V600 HydrophobicContact CE1-CB 4.09Å; F367-V600 HydrophobicContact CE1-CG2 4.38Å; F367-I601 HydrophobicContact CD1-CD1 4.07Å; F367-I601 HydrophobicContact CD1-CG1 3.84Å; F367-I601 HydrophobicContact CE1-CD1 4.47Å; F367-I601 HydrophobicContact CE1-CG1 4.32Å; F367-S608 PolarHBondContact O-OG 2.91Å; F367-M612 HydrophobicContact CB-CB 4.01Å; F367-M612 HydrophobicContact CB-CG 4.11Å; F367-M612 HydrophobicContact CD1-SD 4.44Å; F367-M612 HydrophobicContact CD2-CB 4.37Å; F367-M612 HydrophobicContact CD2-CG 3.59Å; F367-M612 HydrophobicContact CD2-SD 3.78Å; F367-M612 HydrophobicContact CE1-SD 4.38Å; F367-M612 HydrophobicContact CE2-CG 4.14Å; F367-M612 HydrophobicContact CE2-SD 3.69Å; F367-M612 HydrophobicContact CG-CB 4.1Å; F367-M612 HydrophobicContact CG-CG 3.82Å; F367-M612 HydrophobicContact CG-SD 4.16Å; F367-M612 HydrophobicContact CZ-SD 4.01Å
368	G	94.1	Very high	93.6	Very high	0 Å²	0	11 Å²	11	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-70.1	-22.6	171.4	0	0	0	0	0	114.5	S313 P364 S365 R371 F372	S313-G368 PolarHBondContact OG-O 2.97Å; P364-G368 PolarHBondContact O-N 3.39Å; S365-G368 CarbonylContact O-C 3.54Å; S365-G368 WeakPolarHBondContact O-CA 3.41Å; S365-G368 PolarHBondContact O-N 3.1Å; S365-G368 VanDerWaalsContact O-N 3.09Å; G368-R371 VanDerWaalsContact O-CG 3.29Å; G368-R371 WeakPolarHBondContact O-CG 3.4Å; G368-R371 PolarHBondContact O-NE 2.84Å; G368-R371 PolarHBondContact O-NH2 2.86Å; G368-F372 WeakPolarHBondContact O-CD2 3.41Å; G368-F372 WeakPolarHBondContact O-CE2 3.48Å
369	I	94.8	Very high	93.5	Very high	0 Å²	0	11.3 Å²	11.3	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-84.6	-51.6	170.3	-63	150.3	0	0	0	110	I154 L317 S365 V366 F367 R371 F372 W428	I154-I369 HydrophobicContact CG2-CG2 3.85Å; L317-I369 HydrophobicContact CB-CD1 3.98Å; L317-I369 HydrophobicContact CD2-CD1 3.55Å; L317-I369 HydrophobicContact CG-CD1 4.41Å; S365-I369 WeakPolarHBondContact O-CD1 3.44Å; S365-I369 VanDerWaalsContact O-CG1 3.31Å; S365-I369 WeakPolarHBondContact O-CG1 3.47Å; S365-I369 PolarHBondContact O-N 2.78Å; V366-I369 PolarHBondContact O-N 2.98Å; F367-I369 VanDerWaalsContact C-N 3.33Å; I369-R371 PolarHBondContact O-N 3.45Å; I369-R371 VanDerWaalsContact O-N 3.13Å; I369-F372 PolarHBondContact O-N 3.18Å; I369-W428 HydrophobicContact CD1-CH2 3.85Å; I369-W428 HydrophobicContact CD1-CZ2 3.53Å; I369-W428 HydrophobicContact CG1-CZ2 4.47Å
370	L	95	Very high	93.6	Very high	1 Å²	1	11.5 Å²	11.5	1%	0.005	6%	0.059	C	C	.	.	H	α-helix	trans	-60.9	-27.5	-171.6	-72	171.2	0	0	0	114	V366 F372 W373 S374 V383 I601	V366-L370 HydrophobicContact CG1-CD1 3.71Å; V366-L370 HydrophobicContact CG1-CG 4.35Å; V366-L370 WeakPolarHBondContact O-CB 3.25Å; V366-L370 VanDerWaalsContact O-CG 3.27Å; V366-L370 WeakPolarHBondContact O-CG 3.48Å; V366-L370 PolarHBondContact O-N 2.72Å; L370-F372 PolarHBondContact O-N 2.94Å; L370-W373 PolarHBondContact O-N 3.44Å; L370-W373 VanDerWaalsContact O-N 3.12Å; L370-S374 VanDerWaalsContact O-CB 3.29Å; L370-S374 WeakPolarHBondContact O-CB 3.39Å; L370-S374 PolarHBondContact O-N 3.01Å; L370-S374 PolarHBondContact O-OG 3.25Å; L370-V383 HydrophobicContact CD1-CG2 4.27Å; L370-I601 HydrophobicContact CB-CD1 3.67Å
371	R	92.7	Very high	93.6	Very high	6 Å²	6	12.1 Å²	12.1	2%	0.023	6%	0.063	C	C	.	.	H	α-helix	trans	-54.1	-32.8	171.2	59.8	173.4	176.9	-176.8	-3.4	113.3	T308 S313 F367 G368 I369 E434 L458 I601 P605 N606 S608	T308-R371 PolarHBondContact O-NH1 2.69Å; T308-R371 PolarHBondContact O-NH2 2.99Å; S313-R371 PolarHBondContact OG-NH2 3.38Å; F367-R371 PolarHBondContact O-N 3.5Å; G368-R371 VanDerWaalsContact O-CG 3.29Å; G368-R371 WeakPolarHBondContact O-CG 3.4Å; G368-R371 PolarHBondContact O-NE 2.84Å; G368-R371 PolarHBondContact O-NH2 2.86Å; I369-R371 PolarHBondContact O-N 3.45Å; I369-R371 VanDerWaalsContact O-N 3.13Å; R371-E434 IonicContact NH2-OE1 3.59Å; R371-L458 HydrophobicContact CB-CD2 4.17Å; R371-L458 WeakPolarHBondContact O-CD2 3.31Å; R371-I601 HydrophobicContact CB-CG2 4.35Å; R371-P605 VanDerWaalsContact CB-O 3.28Å; R371-P605 WeakPolarHBondContact CB-O 3.49Å; R371-P605 WeakPolarHBondContact CD-O 3.4Å; R371-N606 PolarHBondContact NH1-O 2.78Å; R371-S608 WeakPolarHBondContact CD-OG 3.41Å
372	F	91.8	Very high	93.7	Very high	4 Å²	4	11.5 Å²	11.5	2%	0.018	6%	0.059	C	C	.	.	H	α-helix	trans	-90.8	-13.9	179.7	-55.5	-61.6	0	0	0	114.1	G368 I369 L370 E434 K435 P436 I454 L458	G368-F372 WeakPolarHBondContact O-CD2 3.41Å; G368-F372 WeakPolarHBondContact O-CE2 3.48Å; I369-F372 PolarHBondContact O-N 3.18Å; L370-F372 PolarHBondContact O-N 2.94Å; F372-E434 HydrophobicContact CD2-CG 3.81Å; F372-E434 HydrophobicContact CE2-CG 3.55Å; F372-K435 HydrophobicContact CD1-CG 4.32Å; F372-K435 HydrophobicContact CD2-CG 4.15Å; F372-K435 HydrophobicContact CE1-CD 4.33Å; F372-K435 HydrophobicContact CE1-CG 4.19Å; F372-K435 HydrophobicContact CE2-CG 4.01Å; F372-K435 HydrophobicContact CG-CG 4.3Å; F372-K435 HydrophobicContact CZ-CD 4.29Å; F372-K435 HydrophobicContact CZ-CG 4.05Å; F372-P436 VanDerWaalsContact O-CG 3.29Å; F372-P436 WeakPolarHBondContact O-CG 3.36Å; F372-I454 WeakPolarHBondContact O-CD1 3.33Å; F372-L458 HydrophobicContact CD1-CD2 4Å; F372-L458 HydrophobicContact CD1-CG 3.94Å; F372-L458 HydrophobicContact CE1-CD1 4.41Å; F372-L458 HydrophobicContact CE1-CD2 4.36Å; F372-L458 HydrophobicContact CE1-CG 3.86Å
373	W	92.6	Very high	93.7	Very high	1 Å²	1	11.3 Å²	11.3	0%	0.004	6%	0.058	C	C	.	.	H	α-helix	trans	-122.2	-2.9	-170	-69.6	95.8	0	0	0	115	K150 R151 I154 L370 P375 E434 P436 D439 L442 L450	K150-W373 HydrophobicContact CB-CZ3 4.23Å; K150-W373 HydrophobicContact CD-CH2 4.03Å; K150-W373 HydrophobicContact CD-CZ3 4.29Å; K150-W373 HydrophobicContact CG-CH2 4.41Å; K150-W373 HydrophobicContact CG-CZ3 4.25Å; R151-W373 HydrophobicContact CB-CB 4.39Å; R151-W373 HydrophobicContact CB-CE3 4.31Å; R151-W373 VanDerWaalsContact CB-O 3.26Å; R151-W373 WeakPolarHBondContact CB-O 3.5Å; I154-W373 HydrophobicContact CD1-CB 4.39Å; I154-W373 HydrophobicContact CD1-CD2 3.26Å; I154-W373 HydrophobicContact CD1-CE3 3.6Å; I154-W373 HydrophobicContact CD1-CG 3.63Å; I154-W373 HydrophobicContact CD1-CH2 4.12Å; I154-W373 HydrophobicContact CD1-CZ2 3.83Å; I154-W373 HydrophobicContact CD1-CZ3 4.02Å; L370-W373 PolarHBondContact O-N 3.44Å; L370-W373 VanDerWaalsContact O-N 3.12Å; W373-P375 VanDerWaalsContact O-CD 3.25Å; W373-P375 WeakPolarHBondContact O-CD 3.25Å; W373-E434 PolarHBondContact NE1-O 3Å; W373-P436 HydrophobicContact CD2-CG 3.9Å; W373-P436 HydrophobicContact CE3-CG 4.05Å; W373-P436 HydrophobicContact CH2-CB 4.12Å; W373-P436 HydrophobicContact CH2-CG 4.07Å; W373-P436 HydrophobicContact CZ2-CB 4.26Å; W373-P436 HydrophobicContact CZ2-CG 3.91Å; W373-P436 HydrophobicContact CZ3-CB 4.36Å; W373-P436 HydrophobicContact CZ3-CG 4.14Å; W373-D439 HydrophobicContact CH2-CB 4.48Å; W373-L442 HydrophobicContact CH2-CD1 4.2Å; W373-L442 HydrophobicContact CH2-CD2 4.12Å; W373-L442 HydrophobicContact CZ3-CD1 3.98Å; W373-L442 HydrophobicContact CZ3-CD2 4.2Å; W373-L450 HydrophobicContact CE3-CD1 3.99Å; W373-L450 HydrophobicContact CZ3-CD1 4.01Å
374	S	92.4	Very high	93.8	Very high	0 Å²	0	10.2 Å²	10.2	0%	0	5%	0.053	C	C	.	.			trans	-109.1	95.1	-178.8	-64.7	0	0	0	0	113.1	L370 R379	L370-S374 VanDerWaalsContact O-CB 3.29Å; L370-S374 WeakPolarHBondContact O-CB 3.39Å; L370-S374 PolarHBondContact O-N 3.01Å; L370-S374 PolarHBondContact O-OG 3.25Å; S374-R379 PolarHBondContact O-NE 2.87Å; S374-R379 VanDerWaalsContact O-NE 3.09Å; S374-R379 PolarHBondContact O-NH2 3.46Å
375	P	90.3	Very high	93.9	Very high	0 Å²	0	12.9 Å²	12.9	0%	0	7%	0.066	C	C	.	.			trans	-54.4	147.7	169.9	-21.9	30.8	0	0	0	112.1	W373 N377 E378 R379 F449 L450 T453	W373-P375 VanDerWaalsContact O-CD 3.25Å; W373-P375 WeakPolarHBondContact O-CD 3.25Å; P375-N377 PolarHBondContact O-N 2.89Å; P375-N377 VanDerWaalsContact O-N 3.12Å; P375-E378 PolarHBondContact O-N 3.44Å; P375-E378 VanDerWaalsContact O-N 3.1Å; P375-R379 WeakPolarHBondContact O-CB 3.41Å; P375-R379 PolarHBondContact O-N 2.92Å; P375-F449 HydrophobicContact CB-CE1 4.25Å; P375-F449 HydrophobicContact CB-CZ 4.39Å; P375-F449 HydrophobicContact CG-CE1 3.81Å; P375-F449 HydrophobicContact CG-CZ 4.43Å; P375-L450 HydrophobicContact CG-CD2 3.98Å; P375-T453 HydrophobicContact CB-CG2 3.83Å
376	I	86.4	Confident	93.9	Very high	65 Å²	65	12.9 Å²	12.9	33%	0.333	7%	0.066	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-35.5	-173.1	-60.2	172.6	0	0	0	112.9
377	N	87.8	Confident	93.8	Very high	86 Å²	86	13.8 Å²	13.8	46%	0.46	7%	0.072	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-6.3	-175.8	-62	-4.7	0	0	0	114.6	P375	P375-N377 PolarHBondContact O-N 2.89Å; P375-N377 VanDerWaalsContact O-N 3.12Å
378	E	91.2	Very high	93.8	Very high	15 Å²	15	14.5 Å²	14.5	7%	0.07	8%	0.075	C	C	.	.	S	Bend	trans	-124	8.3	178.7	-62.8	173.1	-170	0	0	111.2	G146 R151 Y152 P375 S380 T381 L382 D537	G146-E378 PolarHBondContact N-OE1 3.2Å; R151-E378 IonicContact CZ-OE1 2.78Å; R151-E378 IonicContact CZ-OE2 3.12Å; R151-E378 IonicContact NE-OE2 2.82Å; R151-E378 PolarHBondContact NE-OE2 3.11Å; R151-E378 VanDerWaalsContact NH2-CD 3.27Å; R151-E378 IonicContact NH2-OE1 2.63Å; R151-E378 PolarHBondContact NH2-OE1 3.24Å; R151-E378 IonicContact NH2-OE2 2.98Å; R151-E378 PolarHBondContact NH2-OE2 2.97Å; Y152-E378 PolarHBondContact OH-OE2 3.33Å; P375-E378 PolarHBondContact O-N 3.44Å; P375-E378 VanDerWaalsContact O-N 3.1Å; E378-S380 PolarHBondContact O-N 3.41Å; E378-T381 PolarHBondContact O-N 2.97Å; E378-L382 HydrophobicContact CB-CD1 4.04Å; E378-L382 WeakPolarHBondContact O-CB 3.26Å; E378-L382 WeakPolarHBondContact O-CG 3.24Å; E378-L382 PolarHBondContact O-N 3.41Å; E378-D537 WeakPolarHBondContact CA-OD2 3.42Å
379	R	93.5	Very high	93.8	Very high	17 Å²	17	14.5 Å²	14.5	6%	0.064	8%	0.075	C	C	.	.	H	α-helix	trans	-68.8	-39.3	-166.1	-173.6	166.9	-72.7	175.4	-3.5	111.6	S374 P375 V383 V598 D602	S374-R379 PolarHBondContact O-NE 2.87Å; S374-R379 VanDerWaalsContact O-NE 3.09Å; S374-R379 PolarHBondContact O-NH2 3.46Å; P375-R379 WeakPolarHBondContact O-CB 3.41Å; P375-R379 PolarHBondContact O-N 2.92Å; R379-V383 HydrophobicContact CG-CG2 4.39Å; R379-V383 WeakPolarHBondContact O-CB 3.46Å; R379-V383 VanDerWaalsContact O-CG2 3.25Å; R379-V383 WeakPolarHBondContact O-CG2 3.29Å; R379-V383 PolarHBondContact O-N 2.92Å; R379-V598 HydrophobicContact CB-CG1 4.5Å; R379-V598 HydrophobicContact CG-CG1 3.95Å; R379-D602 WeakPolarHBondContact CD-OD1 3.49Å; R379-D602 IonicContact CZ-OD1 3.41Å; R379-D602 IonicContact NE-OD1 3.72Å; R379-D602 IonicContact NH1-OD1 3.83Å; R379-D602 PolarHBondContact NH1-OD1 3.06Å
380	S	95.4	Very high	93.7	Very high	7 Å²	7	15.9 Å²	15.9	5%	0.049	8%	0.084	C	C	.	.	H	α-helix	trans	-67.1	-45.4	-179	-35.2	0	0	0	0	109.9	E378 C384 G533 D537	E378-S380 PolarHBondContact O-N 3.41Å; S380-C384 WeakPolarHBondContact O-CB 3.19Å; S380-C384 PolarHBondContact O-N 3.09Å; S380-C384 PolarHBondContact O-SG 2.93Å; S380-C384 VanDerWaalsContact O-SG 3.34Å; S380-G533 WeakPolarHBondContact CB-O 3.4Å; S380-D537 WeakPolarHBondContact CB-OD1 3.1Å; S380-D537 PolarHBondContact N-OD1 3.44Å; S380-D537 VanDerWaalsContact N-OD1 3.12Å; S380-D537 PolarHBondContact N-OD2 2.92Å; S380-D537 PolarHBondContact OG-OD1 3.12Å
381	T	96.1	Very high	93.6	Very high	13 Å²	13	16 Å²	16	8%	0.08	9%	0.085	C	C	.	.	H	α-helix	trans	-60.9	-49.2	175.9	-59	0	0	0	0	111.6	Y152 E378 C384 L385 G533 I534 D537	Y152-T381 HydrophobicContact CE1-CG2 4.36Å; E378-T381 PolarHBondContact O-N 2.97Å; T381-C384 PolarHBondContact O-N 3.13Å; T381-L385 HydrophobicContact CG2-CD1 3.76Å; T381-L385 HydrophobicContact CG2-CG 4.23Å; T381-L385 VanDerWaalsContact O-CB 3.23Å; T381-L385 WeakPolarHBondContact O-CB 3.35Å; T381-L385 WeakPolarHBondContact O-CG 3.2Å; T381-L385 PolarHBondContact O-N 3.29Å; T381-G533 PolarHBondContact OG1-O 3.46Å; T381-I534 HydrophobicContact CG2-CG1 4.04Å; T381-D537 WeakPolarHBondContact CB-OD2 3.44Å; T381-D537 PolarHBondContact N-OD2 3.35Å; T381-D537 PolarHBondContact OG1-OD2 3.44Å
382	L	95.9	Very high	93.7	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-67.8	-38.8	-178.1	-71.3	167.2	0	0	0	113	R151 Y152 A155 E378 S386	R151-L382 HydrophobicContact CB-CD1 4.29Å; R151-L382 HydrophobicContact CB-CD2 4.37Å; R151-L382 HydrophobicContact CG-CD1 4.1Å; R151-L382 HydrophobicContact CG-CD2 4.24Å; Y152-L382 HydrophobicContact CD1-CD2 3.7Å; Y152-L382 HydrophobicContact CD2-CD2 4.4Å; Y152-L382 HydrophobicContact CE1-CD2 3.82Å; Y152-L382 HydrophobicContact CE1-CG 4.47Å; Y152-L382 HydrophobicContact CE2-CD2 4.49Å; Y152-L382 HydrophobicContact CG-CD2 4.01Å; A155-L382 HydrophobicContact CB-CD2 4.05Å; E378-L382 HydrophobicContact CB-CD1 4.04Å; E378-L382 WeakPolarHBondContact O-CB 3.26Å; E378-L382 WeakPolarHBondContact O-CG 3.24Å; E378-L382 PolarHBondContact O-N 3.41Å; L382-S386 WeakPolarHBondContact O-CB 3.31Å; L382-S386 PolarHBondContact O-N 3.4Å; L382-S386 PolarHBondContact O-OG 2.79Å
383	V	96.8	Very high	93.7	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-67	-50.7	174	171.9	0	0	0	0	110.6	F367 L370 R379 L385 S386 V387 A597 V598 I601	F367-V383 HydrophobicContact CE1-CG1 4.23Å; F367-V383 HydrophobicContact CZ-CG1 4.16Å; L370-V383 HydrophobicContact CD1-CG2 4.27Å; R379-V383 HydrophobicContact CG-CG2 4.39Å; R379-V383 WeakPolarHBondContact O-CB 3.46Å; R379-V383 VanDerWaalsContact O-CG2 3.25Å; R379-V383 WeakPolarHBondContact O-CG2 3.29Å; R379-V383 PolarHBondContact O-N 2.92Å; V383-L385 PolarHBondContact O-N 3.24Å; V383-S386 WeakPolarHBondContact O-CB 3.3Å; V383-S386 PolarHBondContact O-N 3.26Å; V383-S386 VanDerWaalsContact O-N 3.16Å; V383-V387 PolarHBondContact O-N 3.13Å; V383-A597 HydrophobicContact CG1-CB 4.35Å; V383-V598 HydrophobicContact CB-CG2 4.25Å; V383-V598 HydrophobicContact CG1-CG2 4.21Å; V383-I601 HydrophobicContact CG2-CD1 3.65Å
384	C	97.2	Very high	93.5	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-56.8	-51	177.3	-79.2	0	0	0	0	111.7	S380 T381 S386 V387 I388 V529	S380-C384 WeakPolarHBondContact O-CB 3.19Å; S380-C384 PolarHBondContact O-N 3.09Å; S380-C384 PolarHBondContact O-SG 2.93Å; S380-C384 VanDerWaalsContact O-SG 3.34Å; T381-C384 PolarHBondContact O-N 3.13Å; C384-S386 PolarHBondContact O-N 2.94Å; C384-V387 PolarHBondContact O-N 3.09Å; C384-V387 VanDerWaalsContact O-N 3.13Å; C384-I388 VanDerWaalsContact O-CG1 3.3Å; C384-I388 WeakPolarHBondContact O-CG1 3.44Å; C384-I388 PolarHBondContact O-N 2.89Å; C384-I388 VanDerWaalsContact O-N 3.08Å; C384-V529 HydrophobicContact CB-CG1 3.71Å; C384-V529 WeakPolarHBondContact CB-O 3.43Å; C384-V529 WeakPolarHBondContact O-CG1 3.32Å; C384-V529 PolarHBondContact SG-O 2.86Å; C384-V529 VanDerWaalsContact SG-O 3.36Å
385	L	96.9	Very high	93.6	Very high	55 Å²	55	19.2 Å²	19.2	29%	0.288	10%	0.103	S	C	.	.	H	α-helix	trans	-54.5	-38	177.8	-77.5	174.6	0	0	0	112.5	Y152 A155 C159 T381 V383 I388 P530	Y152-L385 HydrophobicContact CD1-CD1 4.02Å; Y152-L385 HydrophobicContact CE1-CD1 4.24Å; A155-L385 HydrophobicContact CB-CB 4.13Å; C159-L385 VanDerWaalsContact CB-O 3.26Å; C159-L385 WeakPolarHBondContact CB-O 3.48Å; C159-L385 PolarHBondContact SG-O 3.15Å; C159-L385 VanDerWaalsContact SG-O 3.4Å; T381-L385 HydrophobicContact CG2-CD1 3.76Å; T381-L385 HydrophobicContact CG2-CG 4.23Å; T381-L385 VanDerWaalsContact O-CB 3.23Å; T381-L385 WeakPolarHBondContact O-CB 3.35Å; T381-L385 WeakPolarHBondContact O-CG 3.2Å; T381-L385 PolarHBondContact O-N 3.29Å; V383-L385 PolarHBondContact O-N 3.24Å; L385-I388 HydrophobicContact CD2-CD1 4.07Å; L385-P530 HydrophobicContact CD2-CB 4.3Å
386	S	96.8	Very high	93.7	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-68.1	-45.6	177.4	-56.4	0	0	0	0	112.6	A155 C159 L162 L382 V383 C384	A155-S386 WeakPolarHBondContact CA-OG 3.32Å; A155-S386 WeakPolarHBondContact CB-OG 3.46Å; C159-S386 VanDerWaalsContact CA-O 3.24Å; C159-S386 WeakPolarHBondContact CA-O 3.39Å; C159-S386 PolarHBondContact N-O 3.16Å; L162-S386 VanDerWaalsContact CD1-O 3.28Å; L162-S386 WeakPolarHBondContact CD1-O 3.33Å; L382-S386 WeakPolarHBondContact O-CB 3.31Å; L382-S386 PolarHBondContact O-N 3.4Å; L382-S386 PolarHBondContact O-OG 2.79Å; V383-S386 WeakPolarHBondContact O-CB 3.3Å; V383-S386 PolarHBondContact O-N 3.26Å; V383-S386 VanDerWaalsContact O-N 3.16Å; C384-S386 PolarHBondContact O-N 2.94Å
387	V	95.6	Very high	93.7	Very high	19 Å²	19	19.7 Å²	19.7	12%	0.115	11%	0.106	C	C	.	.	H	α-helix	trans	-86.3	-5.8	-172.5	-55.3	0	0	0	0	114.4	F367 V383 C384 G389 V390 V529 V593	F367-V387 HydrophobicContact CE2-CG1 4.05Å; F367-V387 HydrophobicContact CZ-CG1 4.26Å; V383-V387 PolarHBondContact O-N 3.13Å; C384-V387 PolarHBondContact O-N 3.09Å; C384-V387 VanDerWaalsContact O-N 3.13Å; V387-G389 PolarHBondContact O-N 2.98Å; V387-G389 VanDerWaalsContact O-N 3.1Å; V387-V390 WeakPolarHBondContact O-CB 3.09Å; V387-V390 WeakPolarHBondContact O-CG2 3.48Å; V387-V390 PolarHBondContact O-N 3.35Å; V387-V390 VanDerWaalsContact O-N 3.08Å; V387-V529 HydrophobicContact CG2-CG1 4.35Å; V387-V593 HydrophobicContact CG2-CG1 3.48Å; V387-V593 VanDerWaalsContact CG2-CG1 3.48Å
388	I	95.8	Very high	93.5	Very high	15 Å²	15	16.5 Å²	16.5	8%	0.077	9%	0.088	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.1	-32.6	169.8	-78.7	163.8	0	0	0	112.3	C384 L385 V390 S391 L392 V529 P530	C384-I388 VanDerWaalsContact O-CG1 3.3Å; C384-I388 WeakPolarHBondContact O-CG1 3.44Å; C384-I388 PolarHBondContact O-N 2.89Å; C384-I388 VanDerWaalsContact O-N 3.08Å; L385-I388 HydrophobicContact CD2-CD1 4.07Å; I388-V390 PolarHBondContact O-N 2.98Å; I388-V390 VanDerWaalsContact O-N 3.09Å; I388-S391 WeakPolarHBondContact O-CA 3.49Å; I388-S391 PolarHBondContact O-N 3.28Å; I388-L392 HydrophobicContact CG2-CD1 3.58Å; I388-L392 HydrophobicContact CG2-CD2 4.38Å; I388-L392 HydrophobicContact CG2-CG 3.6Å; I388-L392 PolarHBondContact O-N 3.32Å; I388-V529 HydrophobicContact CD1-CG1 4.42Å; I388-V529 HydrophobicContact CG1-CB 3.85Å; I388-V529 HydrophobicContact CG1-CG1 3.59Å; I388-P530 HydrophobicContact CD1-CB 3.67Å; I388-P530 VanDerWaalsContact CD1-CD 3.48Å; I388-P530 HydrophobicContact CD1-CG 3.66Å
389	G	94.3	Very high	93.2	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-57.2	-26.4	179.6	0	0	0	0	0	114.4	C159 T163 V387 S391 L392 G393	C159-G389 WeakPolarHBondContact O-CA 3.45Å; C159-G389 PolarHBondContact SG-N 2.79Å; C159-G389 VanDerWaalsContact SG-N 3.37Å; T163-G389 VanDerWaalsContact OG1-CA 3.29Å; T163-G389 WeakPolarHBondContact OG1-CA 3.3Å; V387-G389 PolarHBondContact O-N 2.98Å; V387-G389 VanDerWaalsContact O-N 3.1Å; G389-S391 PolarHBondContact O-N 2.85Å; G389-L392 PolarHBondContact O-N 2.82Å; G389-G393 PolarHBondContact O-N 2.91Å
390	V	93.2	Very high	93	Very high	30 Å²	30	19.9 Å²	19.9	18%	0.182	11%	0.113	C	C	.	.	H	α-helix	trans	-62.8	-31.2	172.5	-178.1	0	0	0	0	111.9	L162 I166 V387 I388 P394 F492	L162-V390 HydrophobicContact CD1-CG2 4.49Å; L162-V390 HydrophobicContact CD2-CG2 3.97Å; I166-V390 HydrophobicContact CD1-CB 4.07Å; I166-V390 HydrophobicContact CD1-CG1 4.16Å; I166-V390 HydrophobicContact CD1-CG2 3.78Å; V387-V390 WeakPolarHBondContact O-CB 3.09Å; V387-V390 WeakPolarHBondContact O-CG2 3.48Å; V387-V390 PolarHBondContact O-N 3.35Å; V387-V390 VanDerWaalsContact O-N 3.08Å; I388-V390 PolarHBondContact O-N 2.98Å; I388-V390 VanDerWaalsContact O-N 3.09Å; V390-P394 WeakPolarHBondContact O-CD 3.37Å; V390-F492 HydrophobicContact CG1-CE1 4.35Å; V390-F492 HydrophobicContact CG1-CE2 4.43Å; V390-F492 HydrophobicContact CG1-CZ 3.98Å; V390-F492 WeakPolarHBondContact O-CZ 3.34Å
391	S	93.2	Very high	92.5	Very high	2 Å²	2	19.7 Å²	19.7	1%	0.014	11%	0.111	C	C	.	.	H	α-helix	trans	-94.3	-31.9	178.9	-53	0	0	0	0	112.7	I388 G389 L395 R525 S526	I388-S391 WeakPolarHBondContact O-CA 3.49Å; I388-S391 PolarHBondContact O-N 3.28Å; G389-S391 PolarHBondContact O-N 2.85Å; S391-L395 WeakPolarHBondContact O-CB 3.33Å; S391-L395 PolarHBondContact O-N 3.16Å; S391-R525 VanDerWaalsContact OG-CD 3.32Å; S391-R525 WeakPolarHBondContact OG-CD 3.27Å; S391-R525 WeakPolarHBondContact OG-CG 3.5Å; S391-R525 PolarHBondContact OG-NE 2.91Å; S391-S526 WeakPolarHBondContact CB-OG 3.26Å
392	L	94.9	Very high	91.7	Very high	42 Å²	42	20.9 Å²	20.9	22%	0.22	12%	0.122	C	C	.	.	H	α-helix	trans	-69.5	-31.9	172.8	-67.7	-179.9	0	0	0	112.8	T163 I388 G389 L395 I396	T163-L392 HydrophobicContact CG2-CB 3.76Å; I388-L392 HydrophobicContact CG2-CD1 3.58Å; I388-L392 HydrophobicContact CG2-CD2 4.38Å; I388-L392 HydrophobicContact CG2-CG 3.6Å; I388-L392 PolarHBondContact O-N 3.32Å; G389-L392 PolarHBondContact O-N 2.82Å; L392-L395 HydrophobicContact CD2-CD2 3.92Å; L392-L395 PolarHBondContact O-N 2.89Å; L392-I396 HydrophobicContact CB-CD1 4.24Å; L392-I396 WeakPolarHBondContact O-CB 3.23Å; L392-I396 WeakPolarHBondContact O-CG1 3.45Å; L392-I396 PolarHBondContact O-N 2.8Å
393	G	92.5	Very high	91.2	Very high	1 Å²	1	24.5 Å²	24.5	1%	0.01	14%	0.139	C	C	.	.	H	α-helix	trans	-51.8	-60.9	178.6	0	0	0	0	0	112.5	G167 G389 G397	G167-G393 WeakPolarHBondContact CA-O 3.4Å; G389-G393 PolarHBondContact O-N 2.91Å; G393-G397 WeakPolarHBondContact O-CA 3.38Å; G393-G397 PolarHBondContact O-N 2.71Å
394	P	88.4	Confident	90.7	Very high	7 Å²	7	25.4 Å²	25.4	5%	0.045	14%	0.144	C	C	.	.	H	α-helix	trans	-65.9	-37.4	175.9	-22.8	34.8	0	0	0	113.7	I166 V390 I396 L398 F492 F522	I166-P394 HydrophobicContact CG2-CG 4.4Å; V390-P394 WeakPolarHBondContact O-CD 3.37Å; P394-I396 PolarHBondContact O-N 2.9Å; P394-L398 HydrophobicContact CB-CD1 4.29Å; P394-L398 WeakPolarHBondContact O-CB 3.45Å; P394-L398 WeakPolarHBondContact O-CG 3.24Å; P394-L398 PolarHBondContact O-N 3.1Å; P394-L398 VanDerWaalsContact O-N 3.08Å; P394-F492 HydrophobicContact CG-CZ 4.11Å; P394-F522 HydrophobicContact CB-CD1 4Å; P394-F522 HydrophobicContact CB-CD2 3.97Å; P394-F522 HydrophobicContact CB-CE1 4.02Å; P394-F522 HydrophobicContact CB-CE2 4Å; P394-F522 HydrophobicContact CB-CG 3.99Å; P394-F522 HydrophobicContact CB-CZ 4.04Å; P394-F522 HydrophobicContact CG-CD1 4.3Å; P394-F522 HydrophobicContact CG-CE1 4.2Å
395	L	93.3	Very high	89.9	Confident	29 Å²	29	25.9 Å²	25.9	15%	0.152	15%	0.146	C	C	.	.	H	α-helix	trans	-58.8	-44.4	180	175.6	61.1	0	0	0	112.8	S391 L392 P399 S519 F522 L523	S391-L395 WeakPolarHBondContact O-CB 3.33Å; S391-L395 PolarHBondContact O-N 3.16Å; L392-L395 HydrophobicContact CD2-CD2 3.92Å; L392-L395 PolarHBondContact O-N 2.89Å; L395-P399 WeakPolarHBondContact O-CD 3.49Å; L395-S519 VanDerWaalsContact CD1-O 3.3Å; L395-S519 WeakPolarHBondContact CD1-O 3.35Å; L395-F522 HydrophobicContact CB-CB 3.82Å; L395-F522 HydrophobicContact CD1-CB 4.37Å; L395-L523 HydrophobicContact CD1-CB 3.91Å; L395-L523 HydrophobicContact CD2-CB 4.21Å; L395-L523 HydrophobicContact CD2-CD1 4.09Å
396	I	92	Very high	89.1	Confident	76 Å²	76	28.6 Å²	28.6	39%	0.39	16%	0.156	S	C	.	.	H	α-helix	trans	-89.8	-41.7	-177.4	-60.5	173.5	0	0	0	109.8	T163 L392 P394 P399 V400	T163-I396 HydrophobicContact CG2-CD1 4.07Å; L392-I396 HydrophobicContact CB-CD1 4.24Å; L392-I396 WeakPolarHBondContact O-CB 3.23Å; L392-I396 WeakPolarHBondContact O-CG1 3.45Å; L392-I396 PolarHBondContact O-N 2.8Å; P394-I396 PolarHBondContact O-N 2.9Å; I396-P399 WeakPolarHBondContact O-CD 3.37Å; I396-V400 HydrophobicContact CG2-CG2 3.97Å; I396-V400 WeakPolarHBondContact O-CB 3.48Å; I396-V400 WeakPolarHBondContact O-CG2 3.22Å; I396-V400 PolarHBondContact O-N 3.16Å; I396-V400 VanDerWaalsContact O-N 3.11Å
397	G	87.8	Confident	88.6	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-63.3	-47.5	-176.7	0	0	0	0	0	113.7	S170 G393 V400 C401 Y417	S170-G397 WeakPolarHBondContact OG-CA 3.49Å; G393-G397 WeakPolarHBondContact O-CA 3.38Å; G393-G397 PolarHBondContact O-N 2.71Å; G397-V400 PolarHBondContact O-N 3.47Å; G397-C401 WeakPolarHBondContact O-CB 3.32Å; G397-C401 PolarHBondContact O-N 3.11Å; G397-C401 PolarHBondContact O-SG 3.36Å; G397-Y417 WeakPolarHBondContact CA-OH 3.23Å
398	L	83.3	Confident	88	Confident	18 Å²	18	41.4 Å²	41.4	9%	0.094	21%	0.206	C	C	.	.	H	α-helix	trans	-61.3	-46.7	-175.1	-66.1	169.2	0	0	0	112.8	P394 A402 I515 F522	P394-L398 HydrophobicContact CB-CD1 4.29Å; P394-L398 WeakPolarHBondContact O-CB 3.45Å; P394-L398 WeakPolarHBondContact O-CG 3.24Å; P394-L398 PolarHBondContact O-N 3.1Å; P394-L398 VanDerWaalsContact O-N 3.08Å; L398-A402 WeakPolarHBondContact O-CB 3.42Å; L398-A402 PolarHBondContact O-N 2.99Å; L398-I515 HydrophobicContact CB-CG2 4.27Å; L398-F522 HydrophobicContact CD1-CE2 4.35Å
399	P	84.9	Confident	87.2	Confident	45 Å²	45	40.7 Å²	40.7	29%	0.292	20%	0.202	S	C	.	.	H	α-helix	trans	-74.2	-39.2	176.1	-18.5	34	0	0	0	113.7	L395 I396 A402 E403 I515	L395-P399 WeakPolarHBondContact O-CD 3.49Å; I396-P399 WeakPolarHBondContact O-CD 3.37Å; P399-A402 PolarHBondContact O-N 3.42Å; P399-E403 PolarHBondContact O-N 3.13Å; P399-E403 VanDerWaalsContact O-N 3.08Å; P399-I515 HydrophobicContact CG-CG2 4.25Å
400	V	88.3	Confident	86.5	Confident	59 Å²	59	40.9 Å²	40.9	36%	0.358	20%	0.203	S	C	.	.	H	α-helix	trans	-71.1	-42.3	-175.5	172.8	0	0	0	0	111.5	I396 G397 E403 I404	I396-V400 HydrophobicContact CG2-CG2 3.97Å; I396-V400 WeakPolarHBondContact O-CB 3.48Å; I396-V400 WeakPolarHBondContact O-CG2 3.22Å; I396-V400 PolarHBondContact O-N 3.16Å; I396-V400 VanDerWaalsContact O-N 3.11Å; G397-V400 PolarHBondContact O-N 3.47Å; V400-E403 PolarHBondContact O-N 2.96Å; V400-I404 HydrophobicContact CG1-CD1 3.64Å; V400-I404 HydrophobicContact CG1-CG1 4.47Å; V400-I404 WeakPolarHBondContact O-CB 3.28Å; V400-I404 WeakPolarHBondContact O-CD1 3.44Å; V400-I404 VanDerWaalsContact O-CG1 3.28Å; V400-I404 WeakPolarHBondContact O-CG1 3.25Å; V400-I404 PolarHBondContact O-N 3.35Å
401	C	85.1	Confident	86	Confident	3 Å²	3	39.4 Å²	39.4	2%	0.02	19%	0.194	C	C	.	.	H	α-helix	trans	-61.8	-44.8	174.8	-63.5	0	0	0	0	111.1	G397 E403 I404 E405 V413	G397-C401 WeakPolarHBondContact O-CB 3.32Å; G397-C401 PolarHBondContact O-N 3.11Å; G397-C401 PolarHBondContact O-SG 3.36Å; C401-E403 PolarHBondContact O-N 3.41Å; C401-I404 PolarHBondContact O-N 3.18Å; C401-E405 WeakPolarHBondContact O-CB 3.47Å; C401-E405 WeakPolarHBondContact O-CG 3.22Å; C401-E405 PolarHBondContact O-N 3.41Å; C401-V413 HydrophobicContact CB-CG1 4.03Å; C401-V413 WeakPolarHBondContact SG-CG1 3.4Å
402	A	79.4	Confident	85.7	Confident	37 Å²	37	40.9 Å²	40.9	31%	0.306	20%	0.203	S	C	.	.	H	α-helix	trans	-61.1	-44.5	179.4	0	0	0	0	0	113	L398 P399 E405 K406 I515	L398-A402 WeakPolarHBondContact O-CB 3.42Å; L398-A402 PolarHBondContact O-N 2.99Å; P399-A402 PolarHBondContact O-N 3.42Å; A402-E405 PolarHBondContact O-N 2.83Å; A402-K406 VanDerWaalsContact O-CB 3.26Å; A402-K406 WeakPolarHBondContact O-CB 3.36Å; A402-K406 PolarHBondContact O-N 3.25Å; A402-I515 HydrophobicContact CB-CD1 4.44Å
403	E	84.7	Confident	85.4	Confident	76 Å²	76	38.9 Å²	38.9	36%	0.355	19%	0.193	S	C	.	.	H	α-helix	trans	-71.1	-29.6	178.4	-84.1	-71.7	121	0	0	113.4	P399 V400 C401 K406 K407	P399-E403 PolarHBondContact O-N 3.13Å; P399-E403 VanDerWaalsContact O-N 3.08Å; V400-E403 PolarHBondContact O-N 2.96Å; C401-E403 PolarHBondContact O-N 3.41Å; E403-K406 WeakPolarHBondContact OE1-CD 3.05Å; E403-K406 IonicContact OE1-NZ 3.05Å; E403-K406 PolarHBondContact OE1-NZ 3.45Å; E403-K407 WeakPolarHBondContact O-CD 3.26Å; E403-K407 WeakPolarHBondContact O-CG 3.11Å; E403-K407 PolarHBondContact O-N 3.03Å; E403-K407 WeakPolarHBondContact OE2-CE 3.39Å; E403-K407 IonicContact OE2-NZ 2.61Å; E403-K407 PolarHBondContact OE2-NZ 3.05Å
404	I	87.2	Confident	85.3	Confident	20 Å²	20	38.9 Å²	38.9	10%	0.103	19%	0.192	C	C	.	.	H	α-helix	trans	-73.1	-45.9	171.7	-67.2	166.1	0	0	0	110.6	V400 C401 K406 K407 W408 G409 V412 V413 I416	V400-I404 HydrophobicContact CG1-CD1 3.64Å; V400-I404 HydrophobicContact CG1-CG1 4.47Å; V400-I404 WeakPolarHBondContact O-CB 3.28Å; V400-I404 WeakPolarHBondContact O-CD1 3.44Å; V400-I404 VanDerWaalsContact O-CG1 3.28Å; V400-I404 WeakPolarHBondContact O-CG1 3.25Å; V400-I404 PolarHBondContact O-N 3.35Å; C401-I404 PolarHBondContact O-N 3.18Å; I404-K406 PolarHBondContact O-N 3.38Å; I404-K407 PolarHBondContact O-N 3.5Å; I404-W408 HydrophobicContact CG1-CE3 4.43Å; I404-W408 HydrophobicContact CG1-CZ3 4.48Å; I404-W408 HydrophobicContact CG2-CE3 4.07Å; I404-W408 PolarHBondContact O-N 2.63Å; I404-G409 PolarHBondContact O-N 2.91Å; I404-V412 HydrophobicContact CG2-CB 4.38Å; I404-V412 HydrophobicContact CG2-CG1 4.23Å; I404-V413 HydrophobicContact CB-CG2 3.91Å; I404-V413 HydrophobicContact CG2-CG2 3.53Å; I404-I416 HydrophobicContact CD1-CD1 3.92Å; I404-I416 HydrophobicContact CG2-CD1 4.4Å
405	E	80.6	Confident	85.4	Confident	9 Å²	9	42.1 Å²	42.1	4%	0.042	20%	0.204	C	C	.	.	H	α-helix	trans	-53.4	-41.7	175.1	-84.1	179.8	-138.9	0	0	111.8	S273 C401 A402 K407 G409 W410 V413	S273-E405 WeakPolarHBondContact CB-OE2 3.04Å; S273-E405 PolarHBondContact OG-OE2 2.92Å; C401-E405 WeakPolarHBondContact O-CB 3.47Å; C401-E405 WeakPolarHBondContact O-CG 3.22Å; C401-E405 PolarHBondContact O-N 3.41Å; A402-E405 PolarHBondContact O-N 2.83Å; E405-K407 VanDerWaalsContact C-N 3.34Å; E405-K407 PolarHBondContact O-N 3.36Å; E405-G409 WeakPolarHBondContact O-CA 3.4Å; E405-G409 PolarHBondContact O-N 2.94Å; E405-W410 HydrophobicContact CG-CB 3.98Å; E405-V413 HydrophobicContact CG-CG2 4.07Å
406	K	80	Confident	85.4	Confident	113 Å²	113	44.1 Å²	44.1	49%	0.491	21%	0.214	S	C	.	.	H	α-helix	trans	-69.9	-22.2	179.7	-169.7	173.3	178.3	-178.8	0	114.2	A402 E403 I404 E512	A402-K406 VanDerWaalsContact O-CB 3.26Å; A402-K406 WeakPolarHBondContact O-CB 3.36Å; A402-K406 PolarHBondContact O-N 3.25Å; E403-K406 WeakPolarHBondContact OE1-CD 3.05Å; E403-K406 IonicContact OE1-NZ 3.05Å; E403-K406 PolarHBondContact OE1-NZ 3.45Å; I404-K406 PolarHBondContact O-N 3.38Å; K406-E512 IonicContact NZ-OE1 2.76Å; K406-E512 IonicContact NZ-OE2 3.2Å; K406-E512 PolarHBondContact NZ-OE2 3.42Å
407	K	86.1	Confident	85.4	Confident	139 Å²	139	41.3 Å²	41.3	60%	0.604	20%	0.199	S	C	*	.	H	α-helix	trans	-113.4	-41.2	-173	-74.2	169.2	176.2	154.2	0	114.5	E403 I404 E405	E403-K407 WeakPolarHBondContact O-CD 3.26Å; E403-K407 WeakPolarHBondContact O-CG 3.11Å; E403-K407 PolarHBondContact O-N 3.03Å; E403-K407 WeakPolarHBondContact OE2-CE 3.39Å; E403-K407 IonicContact OE2-NZ 2.61Å; E403-K407 PolarHBondContact OE2-NZ 3.05Å; I404-K407 PolarHBondContact O-N 3.5Å; E405-K407 VanDerWaalsContact C-N 3.34Å; E405-K407 PolarHBondContact O-N 3.36Å
408	W	83.1	Confident	85.7	Confident	148 Å²	148	41.3 Å²	41.3	56%	0.561	20%	0.199	S	C	*	.	H	α-helix	trans	-126	1	-174.3	-56.1	-34.6	0	0	0	112.9	F270 I404 V412 I416	F270-W408 WeakPolarHBondContact CD1-O 3.17Å; F270-W408 VanDerWaalsContact CE1-O 3.28Å; F270-W408 WeakPolarHBondContact CE1-O 3.39Å; I404-W408 HydrophobicContact CG1-CE3 4.43Å; I404-W408 HydrophobicContact CG1-CZ3 4.48Å; I404-W408 HydrophobicContact CG2-CE3 4.07Å; I404-W408 PolarHBondContact O-N 2.63Å; W408-V412 HydrophobicContact CB-CB 4.12Å; W408-V412 HydrophobicContact CB-CG1 4.06Å; W408-V412 HydrophobicContact CB-CG2 4.09Å; W408-V412 HydrophobicContact CE3-CG1 4.14Å; W408-V412 VanDerWaalsContact O-CG2 3.26Å; W408-V412 WeakPolarHBondContact O-CG2 3.33Å; W408-I416 HydrophobicContact CZ3-CD1 4.45Å
409	G	78.4	Confident	86.3	Confident	1 Å²	1	44.4 Å²	44.4	1%	0.01	22%	0.215	C	C	.	.			trans	82.1	166.5	179.3	0	0	0	0	0	114.4	I269 I404 E405	I269-G409 CarbonylContact O-C 3.41Å; I269-G409 VanDerWaalsContact O-CA 3.25Å; I269-G409 WeakPolarHBondContact O-CA 3.45Å; I404-G409 PolarHBondContact O-N 2.91Å; E405-G409 WeakPolarHBondContact O-CA 3.4Å; E405-G409 PolarHBondContact O-N 2.94Å
410	W	79.5	Confident	86.8	Confident	3 Å²	3	46.2 Å²	46.2	1%	0.011	22%	0.222	C	C	.	.	H	α-helix	trans	-66.1	-42	-171.4	62	-92.1	0	0	0	113.2	I175 N178 L268 I269 P332 E335 E405 V412 V413 F414	I175-W410 HydrophobicContact CD1-CZ3 4.05Å; I175-W410 HydrophobicContact CG1-CE3 3.77Å; I175-W410 HydrophobicContact CG1-CH2 4.31Å; I175-W410 HydrophobicContact CG1-CZ3 3.58Å; N178-W410 PolarHBondContact ND2-NE1 2.84Å; L268-W410 PolarHBondContact O-NE1 3.25Å; I269-W410 HydrophobicContact CG1-CZ2 4.31Å; I269-W410 PolarHBondContact O-N 3.46Å; I269-W410 VanDerWaalsContact O-N 3.11Å; P332-W410 HydrophobicContact CB-CH2 4.48Å; P332-W410 HydrophobicContact CB-CZ3 4.21Å; P332-W410 HydrophobicContact CG-CZ3 4.39Å; E335-W410 HydrophobicContact CB-CH2 4.18Å; E335-W410 HydrophobicContact CB-CZ2 4.46Å; E335-W410 HydrophobicContact CG-CH2 3.92Å; E335-W410 HydrophobicContact CG-CZ2 4.16Å; E335-W410 WeakPolarHBondContact OE1-CZ2 3.24Å; E405-W410 HydrophobicContact CG-CB 3.98Å; W410-V412 PolarHBondContact O-N 3.44Å; W410-V412 VanDerWaalsContact O-N 3.09Å; W410-V413 WeakPolarHBondContact O-CB 3.34Å; W410-V413 WeakPolarHBondContact O-CG2 3.4Å; W410-V413 PolarHBondContact O-N 2.79Å; W410-F414 AromaticContact CE3-CD2 3.97Å; W410-F414 HydrophobicContact CE3-CD2 3.97Å; W410-F414 AromaticContact CE3-CE2 3.65Å; W410-F414 HydrophobicContact CE3-CE2 3.65Å; W410-F414 HydrophobicContact CZ3-CD2 4.37Å; W410-F414 HydrophobicContact CZ3-CE2 4.17Å; W410-F414 WeakPolarHBondContact O-CD2 3.39Å
411	G	82.8	Confident	87.2	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-63.4	-22.5	-174.6	0	0	0	0	0	113.8	Y415	G411-Y415 WeakPolarHBondContact O-CD2 3.4Å
412	V	87.2	Confident	87.7	Confident	33 Å²	33	46 Å²	46	20%	0.2	22%	0.218	C	C	.	.	H	α-helix	trans	-71.6	-30.4	176.6	176.6	0	0	0	0	112	I404 W408 W410 Y415 I416	I404-V412 HydrophobicContact CG2-CB 4.38Å; I404-V412 HydrophobicContact CG2-CG1 4.23Å; W408-V412 HydrophobicContact CB-CB 4.12Å; W408-V412 HydrophobicContact CB-CG1 4.06Å; W408-V412 HydrophobicContact CB-CG2 4.09Å; W408-V412 HydrophobicContact CE3-CG1 4.14Å; W408-V412 VanDerWaalsContact O-CG2 3.26Å; W408-V412 WeakPolarHBondContact O-CG2 3.33Å; W410-V412 PolarHBondContact O-N 3.44Å; W410-V412 VanDerWaalsContact O-N 3.09Å; V412-Y415 PolarHBondContact O-N 2.69Å; V412-I416 HydrophobicContact CG1-CD1 3.81Å; V412-I416 HydrophobicContact CG1-CG1 4.37Å; V412-I416 WeakPolarHBondContact O-CG1 3.29Å; V412-I416 PolarHBondContact O-N 3.01Å
413	V	88.4	Confident	88.6	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-60.4	-50.6	176.5	-172.4	0	0	0	0	110.7	E171 C401 I404 E405 W410 Y415 I416 Y417	E171-V413 HydrophobicContact CB-CB 4.06Å; E171-V413 HydrophobicContact CB-CG1 3.42Å; E171-V413 VanDerWaalsContact CB-CG1 3.42Å; C401-V413 HydrophobicContact CB-CG1 4.03Å; C401-V413 WeakPolarHBondContact SG-CG1 3.4Å; I404-V413 HydrophobicContact CB-CG2 3.91Å; I404-V413 HydrophobicContact CG2-CG2 3.53Å; E405-V413 HydrophobicContact CG-CG2 4.07Å; W410-V413 WeakPolarHBondContact O-CB 3.34Å; W410-V413 WeakPolarHBondContact O-CG2 3.4Å; W410-V413 PolarHBondContact O-N 2.79Å; V413-Y415 VanDerWaalsContact C-N 3.31Å; V413-Y415 PolarHBondContact O-N 3.38Å; V413-I416 PolarHBondContact O-N 2.91Å; V413-I416 VanDerWaalsContact O-N 3.07Å; V413-Y417 HydrophobicContact CG1-CD2 3.83Å; V413-Y417 HydrophobicContact CG1-CE2 3.95Å; V413-Y417 PolarHBondContact O-N 2.92Å
414	F	90.3	Very high	89.2	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-54.8	-45.3	178.8	-70.2	-98.4	0	0	0	112	E171 I175 N328 L331 P332 W410 A418	E171-F414 HydrophobicContact CB-CE2 4.22Å; E171-F414 HydrophobicContact CB-CZ 4.39Å; E171-F414 HydrophobicContact CG-CD1 4Å; E171-F414 HydrophobicContact CG-CD2 4.14Å; E171-F414 HydrophobicContact CG-CE1 3.63Å; E171-F414 HydrophobicContact CG-CE2 3.76Å; E171-F414 HydrophobicContact CG-CG 4.24Å; E171-F414 HydrophobicContact CG-CZ 3.51Å; E171-F414 WeakPolarHBondContact OE2-CA 3.09Å; I175-F414 HydrophobicContact CB-CZ 4.45Å; I175-F414 HydrophobicContact CD1-CE1 3.56Å; I175-F414 HydrophobicContact CD1-CE2 3.98Å; I175-F414 HydrophobicContact CD1-CZ 3.21Å; I175-F414 HydrophobicContact CG1-CE1 4.38Å; I175-F414 HydrophobicContact CG1-CE2 3.96Å; I175-F414 HydrophobicContact CG1-CZ 3.53Å; N328-F414 PolarHBondContact ND2-O 3.29Å; L331-F414 HydrophobicContact CB-CD1 3.81Å; L331-F414 HydrophobicContact CB-CE1 3.92Å; L331-F414 HydrophobicContact CD1-CD1 3.98Å; L331-F414 HydrophobicContact CD1-CE1 3.69Å; L331-F414 HydrophobicContact CG-CE1 4.45Å; P332-F414 HydrophobicContact CG-CB 3.52Å; P332-F414 HydrophobicContact CG-CD2 4.25Å; P332-F414 HydrophobicContact CG-CG 3.86Å; W410-F414 AromaticContact CE3-CD2 3.97Å; W410-F414 HydrophobicContact CE3-CD2 3.97Å; W410-F414 AromaticContact CE3-CE2 3.65Å; W410-F414 HydrophobicContact CE3-CE2 3.65Å; W410-F414 HydrophobicContact CZ3-CD2 4.37Å; W410-F414 HydrophobicContact CZ3-CE2 4.17Å; W410-F414 WeakPolarHBondContact O-CD2 3.39Å; F414-A418 WeakPolarHBondContact O-CB 3.29Å; F414-A418 PolarHBondContact O-N 3.09Å
415	Y	91.8	Very high	89.7	Confident	76 Å²	76	44.5 Å²	44.5	30%	0.298	21%	0.206	S	C	.	.	H	α-helix	trans	-66.3	-38.9	177.9	-63.1	-45.6	0	0	0	112.6	L329 P332 L333 G411 V412 V413 N419	L329-Y415 HydrophobicContact CD1-CD1 3.92Å; L329-Y415 HydrophobicContact CG-CD1 4.43Å; P332-Y415 HydrophobicContact CB-CE1 4.26Å; P332-Y415 HydrophobicContact CB-CE2 4.34Å; P332-Y415 HydrophobicContact CG-CD1 4.5Å; P332-Y415 HydrophobicContact CG-CE1 4.06Å; P332-Y415 HydrophobicContact CG-CE2 4.48Å; L333-Y415 HydrophobicContact CD1-CE1 4.08Å; L333-Y415 WeakPolarHBondContact CD1-OH 3.26Å; G411-Y415 WeakPolarHBondContact O-CD2 3.4Å; V412-Y415 PolarHBondContact O-N 2.69Å; V413-Y415 VanDerWaalsContact C-N 3.31Å; V413-Y415 PolarHBondContact O-N 3.38Å; Y415-N419 WeakPolarHBondContact O-CB 3.28Å; Y415-N419 PolarHBondContact O-N 3.46Å; Y415-N419 VanDerWaalsContact O-N 3.08Å; Y415-N419 PolarHBondContact O-ND2 3.21Å
416	I	93.1	Very high	90.4	Very high	70 Å²	70	48.1 Å²	48.1	36%	0.359	23%	0.225	S	C	.	.	H	α-helix	trans	-63.5	-51.5	177.9	-72.5	167.2	0	0	0	110.4	I404 W408 V412 V413 N419 L420	I404-I416 HydrophobicContact CD1-CD1 3.92Å; I404-I416 HydrophobicContact CG2-CD1 4.4Å; W408-I416 HydrophobicContact CZ3-CD1 4.45Å; V412-I416 HydrophobicContact CG1-CD1 3.81Å; V412-I416 HydrophobicContact CG1-CG1 4.37Å; V412-I416 WeakPolarHBondContact O-CG1 3.29Å; V412-I416 PolarHBondContact O-N 3.01Å; V413-I416 PolarHBondContact O-N 2.91Å; V413-I416 VanDerWaalsContact O-N 3.07Å; I416-N419 PolarHBondContact O-N 3Å; I416-L420 VanDerWaalsContact O-CB 3.31Å; I416-L420 WeakPolarHBondContact O-CB 3.41Å; I416-L420 PolarHBondContact O-N 3.07Å
417	Y	91.8	Very high	91.2	Very high	17 Å²	17	48.4 Å²	48.4	7%	0.067	23%	0.226	C	C	.	.	H	α-helix	trans	-67.2	-39	179.4	-84.1	-84.3	0	0	0	113	I164 M168 G397 V413 N419 L420 G421	I164-Y417 HydrophobicContact CG2-CD1 4.22Å; I164-Y417 WeakPolarHBondContact O-CD1 3.31Å; M168-Y417 HydrophobicContact CG-CD1 3.61Å; M168-Y417 HydrophobicContact CG-CG 3.62Å; G397-Y417 WeakPolarHBondContact CA-OH 3.23Å; V413-Y417 HydrophobicContact CG1-CD2 3.83Å; V413-Y417 HydrophobicContact CG1-CE2 3.95Å; V413-Y417 PolarHBondContact O-N 2.92Å; Y417-N419 PolarHBondContact O-N 2.86Å; Y417-L420 PolarHBondContact O-N 3.4Å; Y417-G421 PolarHBondContact O-N 2.91Å
418	A	94.1	Very high	91.6	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-57.1	-50.3	175.7	0	0	0	0	0	111.6	C325 N328 L329 F414 G421 L422	C325-A418 VanDerWaalsContact O-CB 3.31Å; C325-A418 WeakPolarHBondContact O-CB 3.11Å; N328-A418 HydrophobicContact CB-CB 4.26Å; L329-A418 HydrophobicContact CB-CB 4.14Å; L329-A418 HydrophobicContact CD1-CB 3.74Å; F414-A418 WeakPolarHBondContact O-CB 3.29Å; F414-A418 PolarHBondContact O-N 3.09Å; A418-G421 PolarHBondContact O-N 3.37Å; A418-L422 WeakPolarHBondContact O-CB 3.41Å; A418-L422 VanDerWaalsContact O-CG 3.26Å; A418-L422 WeakPolarHBondContact O-CG 3.3Å; A418-L422 PolarHBondContact O-N 3.32Å
419	N	95.5	Very high	92.2	Very high	83 Å²	83	40.2 Å²	40.2	44%	0.444	19%	0.192	S	C	.	.	H	α-helix	trans	-67.2	-40.2	179	-78.1	-83.3	0	0	0	112	Y415 I416 Y417 G421 L422 I423	Y415-N419 WeakPolarHBondContact O-CB 3.28Å; Y415-N419 PolarHBondContact O-N 3.46Å; Y415-N419 VanDerWaalsContact O-N 3.08Å; Y415-N419 PolarHBondContact O-ND2 3.21Å; I416-N419 PolarHBondContact O-N 3Å; Y417-N419 PolarHBondContact O-N 2.86Å; N419-G421 VanDerWaalsContact C-N 3.35Å; N419-G421 PolarHBondContact O-N 3.38Å; N419-L422 PolarHBondContact O-N 3.49Å; N419-I423 WeakPolarHBondContact O-CB 3.37Å; N419-I423 WeakPolarHBondContact O-CD1 3.25Å; N419-I423 WeakPolarHBondContact O-CG1 3.4Å; N419-I423 PolarHBondContact O-N 2.98Å
420	L	96	Very high	92.9	Very high	83 Å²	83	48.7 Å²	48.7	44%	0.435	22%	0.223	S	C	.	.	H	α-helix	trans	-60.6	-42.6	178.3	-176	60.5	0	0	0	112.1	I164 I416 Y417 W424	I164-L420 HydrophobicContact CD1-CD2 4.32Å; I164-L420 HydrophobicContact CD1-CG 3.89Å; I164-L420 HydrophobicContact CG1-CD2 3.93Å; I164-L420 HydrophobicContact CG1-CG 4.03Å; I416-L420 VanDerWaalsContact O-CB 3.31Å; I416-L420 WeakPolarHBondContact O-CB 3.41Å; I416-L420 PolarHBondContact O-N 3.07Å; Y417-L420 PolarHBondContact O-N 3.4Å; L420-W424 WeakPolarHBondContact O-CB 3.46Å; L420-W424 PolarHBondContact O-N 3.15Å
421	G	96.1	Very high	93.5	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-69.3	-41.1	175.3	0	0	0	0	0	113.8	Y417 A418 N419 I423 W424 C425	Y417-G421 PolarHBondContact O-N 2.91Å; A418-G421 PolarHBondContact O-N 3.37Å; N419-G421 VanDerWaalsContact C-N 3.35Å; N419-G421 PolarHBondContact O-N 3.38Å; G421-I423 PolarHBondContact O-N 3.41Å; G421-W424 WeakPolarHBondContact O-CB 3.46Å; G421-W424 PolarHBondContact O-N 3.49Å; G421-W424 VanDerWaalsContact O-N 3.17Å; G421-C425 PolarHBondContact O-N 2.89Å; G421-C425 PolarHBondContact O-SG 3.22Å; G421-C425 VanDerWaalsContact O-SG 3.35Å
422	L	96.8	Very high	93.9	Very high	57 Å²	57	51.8 Å²	51.8	30%	0.298	24%	0.24	S	C	.	.	H	α-helix	trans	-64.7	-39.2	175.9	-70.1	169.7	0	0	0	112.1	C325 A418 N419 W424 C425 I426	C325-L422 HydrophobicContact CB-CG 4.29Å; A418-L422 WeakPolarHBondContact O-CB 3.41Å; A418-L422 VanDerWaalsContact O-CG 3.26Å; A418-L422 WeakPolarHBondContact O-CG 3.3Å; A418-L422 PolarHBondContact O-N 3.32Å; N419-L422 PolarHBondContact O-N 3.49Å; L422-W424 VanDerWaalsContact C-N 3.35Å; L422-C425 PolarHBondContact O-N 3.38Å; L422-I426 WeakPolarHBondContact O-CG1 3.24Å; L422-I426 PolarHBondContact O-N 2.78Å
423	I	97.4	Very high	94.1	Very high	86 Å²	86	53.1 Å²	53.1	44%	0.441	25%	0.246	S	C	.	.	H	α-helix	trans	-62.2	-43	171.6	-70.4	165.1	0	0	0	110.4	N419 G421 C425 I426 F427	N419-I423 WeakPolarHBondContact O-CB 3.37Å; N419-I423 WeakPolarHBondContact O-CD1 3.25Å; N419-I423 WeakPolarHBondContact O-CG1 3.4Å; N419-I423 PolarHBondContact O-N 2.98Å; G421-I423 PolarHBondContact O-N 3.41Å; I423-C425 VanDerWaalsContact C-N 3.35Å; I423-C425 PolarHBondContact O-N 3.38Å; I423-I426 PolarHBondContact O-N 3.32Å; I423-F427 HydrophobicContact CG2-CD2 3.95Å; I423-F427 HydrophobicContact CG2-CE2 3.7Å; I423-F427 VanDerWaalsContact O-CD2 3.3Å; I423-F427 WeakPolarHBondContact O-CD2 3.41Å; I423-F427 PolarHBondContact O-N 2.86Å
424	W	97.9	Very high	94	Very high	15 Å²	15	53.4 Å²	53.4	6%	0.057	25%	0.247	C	C	.	.	H	α-helix	trans	-58.8	-42.8	175.3	-179	99.9	0	0	0	112	L157 T160 C161 I164 L317 V321 L420 G421 L422 I426 F427 W428	L157-W424 HydrophobicContact CB-CZ2 4.22Å; L157-W424 VanDerWaalsContact O-CZ2 3.28Å; L157-W424 WeakPolarHBondContact O-CZ2 3.49Å; L157-W424 PolarHBondContact O-NE1 2.67Å; T160-W424 PolarHBondContact OG1-NE1 3.12Å; T160-W424 VanDerWaalsContact OG1-NE1 3.1Å; C161-W424 HydrophobicContact CB-CD2 3.83Å; C161-W424 HydrophobicContact CB-CE3 3.97Å; C161-W424 HydrophobicContact CB-CH2 3.69Å; C161-W424 HydrophobicContact CB-CZ2 3.48Å; C161-W424 VanDerWaalsContact CB-CZ2 3.48Å; C161-W424 HydrophobicContact CB-CZ3 3.92Å; C161-W424 VanDerWaalsContact SG-CZ2 3.57Å; I164-W424 HydrophobicContact CD1-CB 4.11Å; I164-W424 HydrophobicContact CD1-CG 4.31Å; L317-W424 HydrophobicContact CD2-CH2 4.1Å; L317-W424 HydrophobicContact CG-CH2 4.09Å; V321-W424 HydrophobicContact CB-CE3 4.24Å; V321-W424 HydrophobicContact CB-CZ3 4.1Å; V321-W424 HydrophobicContact CG1-CE3 3.95Å; V321-W424 HydrophobicContact CG1-CZ3 4.31Å; V321-W424 HydrophobicContact CG2-CE3 4.32Å; V321-W424 HydrophobicContact CG2-CZ3 3.89Å; L420-W424 WeakPolarHBondContact O-CB 3.46Å; L420-W424 PolarHBondContact O-N 3.15Å; G421-W424 WeakPolarHBondContact O-CB 3.46Å; G421-W424 PolarHBondContact O-N 3.49Å; G421-W424 VanDerWaalsContact O-N 3.17Å; L422-W424 VanDerWaalsContact C-N 3.35Å; W424-I426 VanDerWaalsContact C-N 3.32Å; W424-I426 PolarHBondContact O-N 3.3Å; W424-F427 PolarHBondContact O-N 2.82Å; W424-F427 VanDerWaalsContact O-N 3.13Å; W424-W428 HydrophobicContact CD2-CB 4.4Å; W424-W428 HydrophobicContact CE3-CB 4.06Å; W424-W428 HydrophobicContact CH2-CB 3.79Å; W424-W428 AromaticContact CH2-CD2 3.4Å; W424-W428 HydrophobicContact CH2-CD2 3.4Å; W424-W428 VanDerWaalsContact CH2-CD2 3.4Å; W424-W428 AromaticContact CH2-CE3 3.48Å; W424-W428 HydrophobicContact CH2-CE3 3.48Å; W424-W428 VanDerWaalsContact CH2-CE3 3.48Å; W424-W428 AromaticContact CH2-CG 3.52Å; W424-W428 HydrophobicContact CH2-CG 3.52Å; W424-W428 HydrophobicContact CH2-CZ3 4.27Å; W424-W428 HydrophobicContact CZ2-CB 4.16Å; W424-W428 AromaticContact CZ2-CD2 3.78Å; W424-W428 HydrophobicContact CZ2-CD2 3.78Å; W424-W428 AromaticContact CZ2-CE3 3.33Å; W424-W428 HydrophobicContact CZ2-CE3 3.33Å; W424-W428 HydrophobicContact CZ2-CG 4.13Å; W424-W428 HydrophobicContact CZ2-CZ3 4.02Å; W424-W428 HydrophobicContact CZ3-CB 3.74Å; W424-W428 HydrophobicContact CZ3-CD2 4.19Å; W424-W428 AromaticContact CZ3-CG 3.8Å; W424-W428 HydrophobicContact CZ3-CG 3.8Å; W424-W428 WeakPolarHBondContact O-CB 3.32Å; W424-W428 PolarHBondContact O-N 3.13Å
425	C	97.1	Very high	93.9	Very high	1 Å²	1	54.4 Å²	54.4	1%	0.007	25%	0.251	C	S	.	.	H	α-helix	trans	-60.1	-39.2	176.7	-66	0	0	0	0	112.8	G318 A322 G421 L422 I423 F427 W428 W429	G318-C425 PolarHBondContact O-SG 2.93Å; A322-C425 HydrophobicContact CB-CB 4.42Å; A322-C425 PolarHBondContact N-SG 3.36Å; A322-C425 VanDerWaalsContact N-SG 3.41Å; G421-C425 PolarHBondContact O-N 2.89Å; G421-C425 PolarHBondContact O-SG 3.22Å; G421-C425 VanDerWaalsContact O-SG 3.35Å; L422-C425 PolarHBondContact O-N 3.38Å; I423-C425 VanDerWaalsContact C-N 3.35Å; I423-C425 PolarHBondContact O-N 3.38Å; C425-F427 VanDerWaalsContact C-N 3.32Å; C425-F427 PolarHBondContact O-N 2.88Å; C425-W428 PolarHBondContact O-N 3.06Å; C425-W429 HydrophobicContact CB-CE3 4.05Å; C425-W429 HydrophobicContact CB-CH2 4.28Å; C425-W429 HydrophobicContact CB-CZ3 3.84Å; C425-W429 PolarHBondContact O-N 2.8Å
426	I	95.9	Very high	93.7	Very high	86 Å²	86	50.9 Å²	50.9	44%	0.441	24%	0.238	S	C	.	.	H	α-helix	trans	-62.8	-39.1	176.4	-64.9	166.9	0	0	0	111.1	L422 I423 W424 R430	L422-I426 WeakPolarHBondContact O-CG1 3.24Å; L422-I426 PolarHBondContact O-N 2.78Å; I423-I426 PolarHBondContact O-N 3.32Å; W424-I426 VanDerWaalsContact C-N 3.32Å; W424-I426 PolarHBondContact O-N 3.3Å; I426-R430 WeakPolarHBondContact O-CB 3.48Å; I426-R430 WeakPolarHBondContact O-CD 3.37Å; I426-R430 VanDerWaalsContact O-CG 3.27Å; I426-R430 WeakPolarHBondContact O-CG 3.45Å
427	F	95.2	Very high	93.2	Very high	118 Å²	118	50.8 Å²	50.8	52%	0.518	24%	0.238	S	C	.	.	H	α-helix	trans	-70.8	-44.8	173.8	-76.7	-69	0	0	0	111.9	I423 W424 C425 R430 L431	I423-F427 HydrophobicContact CG2-CD2 3.95Å; I423-F427 HydrophobicContact CG2-CE2 3.7Å; I423-F427 VanDerWaalsContact O-CD2 3.3Å; I423-F427 WeakPolarHBondContact O-CD2 3.41Å; I423-F427 PolarHBondContact O-N 2.86Å; W424-F427 PolarHBondContact O-N 2.82Å; W424-F427 VanDerWaalsContact O-N 3.13Å; C425-F427 VanDerWaalsContact C-N 3.32Å; C425-F427 PolarHBondContact O-N 2.88Å; F427-R430 PolarHBondContact O-N 2.72Å; F427-L431 HydrophobicContact CB-CD1 4.34Å; F427-L431 HydrophobicContact CD1-CD1 4.41Å; F427-L431 VanDerWaalsContact O-CB 3.3Å; F427-L431 WeakPolarHBondContact O-CB 3.38Å; F427-L431 WeakPolarHBondContact O-CG 3.26Å; F427-L431 PolarHBondContact O-N 3.18Å
428	W	96.3	Very high	92.8	Very high	0 Å²	0	54 Å²	54	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-54.8	-59.1	-179.7	-179.7	-99.1	0	0	0	111.9	I154 L157 S314 L317 I369 W424 C425 R430 L431 I432	I154-W428 HydrophobicContact CG2-CH2 4.37Å; L157-W428 HydrophobicContact CB-CE3 3.74Å; L157-W428 HydrophobicContact CB-CZ3 3.63Å; L157-W428 HydrophobicContact CD1-CE3 4.09Å; L157-W428 HydrophobicContact CD1-CZ3 4.34Å; L157-W428 HydrophobicContact CG-CE3 4.47Å; S314-W428 PolarHBondContact O-NE1 3.49Å; S314-W428 WeakPolarHBondContact OG-CZ2 3.33Å; S314-W428 PolarHBondContact OG-NE1 3.46Å; L317-W428 HydrophobicContact CD2-CH2 3.89Å; L317-W428 HydrophobicContact CD2-CZ2 3.78Å; L317-W428 HydrophobicContact CD2-CZ3 4.39Å; I369-W428 HydrophobicContact CD1-CH2 3.85Å; I369-W428 HydrophobicContact CD1-CZ2 3.53Å; I369-W428 HydrophobicContact CG1-CZ2 4.47Å; W424-W428 HydrophobicContact CD2-CB 4.4Å; W424-W428 HydrophobicContact CE3-CB 4.06Å; W424-W428 HydrophobicContact CH2-CB 3.79Å; W424-W428 AromaticContact CH2-CD2 3.4Å; W424-W428 HydrophobicContact CH2-CD2 3.4Å; W424-W428 VanDerWaalsContact CH2-CD2 3.4Å; W424-W428 AromaticContact CH2-CE3 3.48Å; W424-W428 HydrophobicContact CH2-CE3 3.48Å; W424-W428 VanDerWaalsContact CH2-CE3 3.48Å; W424-W428 AromaticContact CH2-CG 3.52Å; W424-W428 HydrophobicContact CH2-CG 3.52Å; W424-W428 HydrophobicContact CH2-CZ3 4.27Å; W424-W428 HydrophobicContact CZ2-CB 4.16Å; W424-W428 AromaticContact CZ2-CD2 3.78Å; W424-W428 HydrophobicContact CZ2-CD2 3.78Å; W424-W428 AromaticContact CZ2-CE3 3.33Å; W424-W428 HydrophobicContact CZ2-CE3 3.33Å; W424-W428 HydrophobicContact CZ2-CG 4.13Å; W424-W428 HydrophobicContact CZ2-CZ3 4.02Å; W424-W428 HydrophobicContact CZ3-CB 3.74Å; W424-W428 HydrophobicContact CZ3-CD2 4.19Å; W424-W428 AromaticContact CZ3-CG 3.8Å; W424-W428 HydrophobicContact CZ3-CG 3.8Å; W424-W428 WeakPolarHBondContact O-CB 3.32Å; W424-W428 PolarHBondContact O-N 3.13Å; C425-W428 PolarHBondContact O-N 3.06Å; W428-R430 PolarHBondContact O-N 3.2Å; W428-R430 VanDerWaalsContact O-N 3.16Å; W428-L431 PolarHBondContact O-N 3.16Å; W428-L431 VanDerWaalsContact O-N 3.1Å; W428-I432 HydrophobicContact CD2-CB 4.22Å; W428-I432 HydrophobicContact CD2-CG1 4.25Å; W428-I432 HydrophobicContact CE3-CB 4.23Å; W428-I432 HydrophobicContact CE3-CG1 3.81Å; W428-I432 HydrophobicContact CH2-CB 4.09Å; W428-I432 HydrophobicContact CH2-CG1 4.14Å; W428-I432 HydrophobicContact CH2-CG2 3.67Å; W428-I432 HydrophobicContact CZ2-CB 4.03Å; W428-I432 HydrophobicContact CZ2-CG2 3.69Å; W428-I432 HydrophobicContact CZ3-CB 4.2Å; W428-I432 HydrophobicContact CZ3-CG1 3.78Å; W428-I432 HydrophobicContact CZ3-CG2 4.2Å; W428-I432 PolarHBondContact O-N 2.75Å
429	W	94.6	Very high	92.2	Very high	116 Å²	116	54.4 Å²	54.4	44%	0.439	25%	0.254	S	S	.	.	H	α-helix	trans	-65.2	-18.8	-179.1	-68.6	-46.2	0	0	0	114.2	F315 G318 A322 C425	F315-W429 AromaticContact CD2-NE1 3.87Å; G318-W429 VanDerWaalsContact C-CZ2 3.43Å; A322-W429 HydrophobicContact CB-CH2 3.75Å; A322-W429 HydrophobicContact CB-CZ2 4.4Å; C425-W429 HydrophobicContact CB-CE3 4.05Å; C425-W429 HydrophobicContact CB-CH2 4.28Å; C425-W429 HydrophobicContact CB-CZ3 3.84Å; C425-W429 PolarHBondContact O-N 2.8Å
430	R	92.7	Very high	91.5	Very high	178 Å²	178	60.5 Å²	60.5	67%	0.672	28%	0.277	S	S	*	.	H	α-helix	trans	-89.9	-16.7	175.8	-76.3	178.9	165.4	172.3	-3.8	113.9	I426 F427 W428 K441	I426-R430 WeakPolarHBondContact O-CB 3.48Å; I426-R430 WeakPolarHBondContact O-CD 3.37Å; I426-R430 VanDerWaalsContact O-CG 3.27Å; I426-R430 WeakPolarHBondContact O-CG 3.45Å; F427-R430 PolarHBondContact O-N 2.72Å; W428-R430 PolarHBondContact O-N 3.2Å; W428-R430 VanDerWaalsContact O-N 3.16Å; R430-K441 PolarHBondContact O-NZ 2.67Å
431	L	91.9	Very high	90.8	Very high	60 Å²	60	63.8 Å²	63.8	31%	0.314	29%	0.288	S	S	.	.	H	α-helix	trans	-114.3	-36.2	-172.7	-65.2	175.5	0	0	0	113.4	K150 F427 W428	K150-L431 WeakPolarHBondContact CE-O 3.34Å; K150-L431 PolarHBondContact NZ-O 3.13Å; F427-L431 HydrophobicContact CB-CD1 4.34Å; F427-L431 HydrophobicContact CD1-CD1 4.41Å; F427-L431 VanDerWaalsContact O-CB 3.3Å; F427-L431 WeakPolarHBondContact O-CB 3.38Å; F427-L431 WeakPolarHBondContact O-CG 3.26Å; F427-L431 PolarHBondContact O-N 3.18Å; W428-L431 PolarHBondContact O-N 3.16Å; W428-L431 VanDerWaalsContact O-N 3.1Å
432	I	92.4	Very high	90.3	Very high	8 Å²	8	64.8 Å²	64.8	4%	0.041	29%	0.293	C	S	.	.			trans	-118	106.1	-165.7	-51.1	-50.3	0	0	0	113.2	I154 L157 S314 W428	I154-I432 HydrophobicContact CD1-CD1 4.19Å; I154-I432 HydrophobicContact CD1-CG2 3.96Å; I154-I432 HydrophobicContact CG1-CD1 3.44Å; I154-I432 VanDerWaalsContact CG1-CD1 3.44Å; I154-I432 HydrophobicContact CG1-CG1 4.05Å; I154-I432 HydrophobicContact CG1-CG2 3.84Å; L157-I432 HydrophobicContact CD1-CD1 3.96Å; L157-I432 HydrophobicContact CD1-CG1 3.78Å; S314-I432 PolarHBondContact OG-O 3.22Å; W428-I432 HydrophobicContact CD2-CB 4.22Å; W428-I432 HydrophobicContact CD2-CG1 4.25Å; W428-I432 HydrophobicContact CE3-CB 4.23Å; W428-I432 HydrophobicContact CE3-CG1 3.81Å; W428-I432 HydrophobicContact CH2-CB 4.09Å; W428-I432 HydrophobicContact CH2-CG1 4.14Å; W428-I432 HydrophobicContact CH2-CG2 3.67Å; W428-I432 HydrophobicContact CZ2-CB 4.03Å; W428-I432 HydrophobicContact CZ2-CG2 3.69Å; W428-I432 HydrophobicContact CZ3-CB 4.2Å; W428-I432 HydrophobicContact CZ3-CG1 3.78Å; W428-I432 HydrophobicContact CZ3-CG2 4.2Å; W428-I432 PolarHBondContact O-N 2.75Å
433	D	90.1	Very high	89.8	Confident	61 Å²	61	66.2 Å²	66.2	33%	0.326	30%	0.301	S	S	.	.			trans	-79	146.8	161.7	-54.6	-89.2	0	0	0	110.8	K438 D439	D433-K438 HydrophobicContact CB-CB 4.02Å; D433-D439 HydrophobicContact CB-CB 4.19Å
434	E	88.3	Confident	89.2	Confident	7 Å²	7	70.4 Å²	70.4	3%	0.033	32%	0.316	C	S	.	.	S	Bend	trans	-58	-51.1	-179.8	173.4	-166.5	-128.4	0	0	113.7	D312 S313 R371 F372 W373 K438	D312-E434 WeakPolarHBondContact CA-OE1 3.22Å; D312-E434 WeakPolarHBondContact OD1-CB 3.36Å; D312-E434 WeakPolarHBondContact OD2-CB 3Å; S313-E434 PolarHBondContact N-OE1 3.41Å; S313-E434 PolarHBondContact OG-OE1 2.83Å; S313-E434 VanDerWaalsContact OG-OE1 3.12Å; R371-E434 IonicContact NH2-OE1 3.59Å; F372-E434 HydrophobicContact CD2-CG 3.81Å; F372-E434 HydrophobicContact CE2-CG 3.55Å; W373-E434 PolarHBondContact NE1-O 3Å; E434-K438 IonicContact OE2-NZ 2.88Å; E434-K438 PolarHBondContact OE2-NZ 2.82Å
435	K	87.8	Confident	88.7	Confident	21 Å²	21	78.7 Å²	78.7	9%	0.091	35%	0.347	C	S	.	.	S	Bend	trans	-109.3	134.5	-172.5	-59.4	-174.8	-179.2	-178.6	0	109.7	F372 N437 K438 N461	F372-K435 HydrophobicContact CD1-CG 4.32Å; F372-K435 HydrophobicContact CD2-CG 4.15Å; F372-K435 HydrophobicContact CE1-CD 4.33Å; F372-K435 HydrophobicContact CE1-CG 4.19Å; F372-K435 HydrophobicContact CE2-CG 4.01Å; F372-K435 HydrophobicContact CG-CG 4.3Å; F372-K435 HydrophobicContact CZ-CD 4.29Å; F372-K435 HydrophobicContact CZ-CG 4.05Å; K435-N437 WeakPolarHBondContact CB-OD1 3.42Å; K435-N437 PolarHBondContact O-N 2.97Å; K435-K438 HydrophobicContact CB-CD 4.2Å; K435-K438 HydrophobicContact CB-CG 4.3Å; K435-K438 WeakPolarHBondContact O-CB 3.33Å; K435-K438 PolarHBondContact O-N 3.08Å; K435-N461 PolarHBondContact NZ-O 3.47Å
436	P	86.7	Confident	88.2	Confident	2 Å²	2	78.9 Å²	78.9	1%	0.013	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.2	-22.5	178.8	-28.6	33.5	0	0	0	115.7	F372 W373 L442 L447 L450	F372-P436 VanDerWaalsContact O-CG 3.29Å; F372-P436 WeakPolarHBondContact O-CG 3.36Å; W373-P436 HydrophobicContact CD2-CG 3.9Å; W373-P436 HydrophobicContact CE3-CG 4.05Å; W373-P436 HydrophobicContact CH2-CB 4.12Å; W373-P436 HydrophobicContact CH2-CG 4.07Å; W373-P436 HydrophobicContact CZ2-CB 4.26Å; W373-P436 HydrophobicContact CZ2-CG 3.91Å; W373-P436 HydrophobicContact CZ3-CB 4.36Å; W373-P436 HydrophobicContact CZ3-CG 4.14Å; P436-L442 HydrophobicContact CB-CD2 3.76Å; P436-L442 WeakPolarHBondContact O-CD2 3.41Å; P436-L447 HydrophobicContact CB-CD1 4.16Å; P436-L447 WeakPolarHBondContact O-CD1 3.24Å; P436-L450 HydrophobicContact CB-CD1 3.97Å; P436-L450 HydrophobicContact CG-CD1 3.91Å
437	N	82.1	Confident	87.8	Confident	67 Å²	67	76.5 Å²	76.5	36%	0.358	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-17.4	177.3	57.8	4	0	0	0	114.5	K435 L459	K435-N437 WeakPolarHBondContact CB-OD1 3.42Å; K435-N437 PolarHBondContact O-N 2.97Å; N437-L459 PolarHBondContact ND2-O 3.5Å
438	K	83.2	Confident	87.4	Confident	84 Å²	84	75.4 Å²	75.4	37%	0.365	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-30.8	169.6	-67.7	170.5	172.6	170.7	0	111.6	D312 D433 E434 K435 K440	D312-K438 IonicContact OD2-NZ 2.74Å; D312-K438 PolarHBondContact OD2-NZ 2.89Å; D433-K438 HydrophobicContact CB-CB 4.02Å; E434-K438 IonicContact OE2-NZ 2.88Å; E434-K438 PolarHBondContact OE2-NZ 2.82Å; K435-K438 HydrophobicContact CB-CD 4.2Å; K435-K438 HydrophobicContact CB-CG 4.3Å; K435-K438 WeakPolarHBondContact O-CB 3.33Å; K435-K438 PolarHBondContact O-N 3.08Å; K438-K440 PolarHBondContact O-N 3.02Å; K438-K440 VanDerWaalsContact O-N 3.12Å
439	D	83.1	Confident	87	Confident	9 Å²	9	77.9 Å²	77.9	5%	0.048	35%	0.346	C	S	.	.			trans	-73.9	96.7	-167.5	-179.7	8.2	0	0	0	114.1	K150 W373 D433 K441 L442	K150-D439 WeakPolarHBondContact CD-OD2 3.28Å; K150-D439 VanDerWaalsContact CE-OD2 3.29Å; K150-D439 WeakPolarHBondContact CE-OD2 3.12Å; K150-D439 IonicContact NZ-OD1 3.28Å; K150-D439 PolarHBondContact NZ-OD1 3.15Å; K150-D439 IonicContact NZ-OD2 2.6Å; K150-D439 PolarHBondContact NZ-OD2 2.83Å; W373-D439 HydrophobicContact CH2-CB 4.48Å; D433-D439 HydrophobicContact CB-CB 4.19Å; D439-K441 PolarHBondContact O-N 3.3Å; D439-K441 VanDerWaalsContact O-N 3.16Å; D439-K441 WeakPolarHBondContact OD1-CA 3.28Å; D439-K441 WeakPolarHBondContact OD1-CB 3.42Å; D439-K441 PolarHBondContact OD1-N 3.43Å; D439-L442 HydrophobicContact CB-CB 4.1Å; D439-L442 WeakPolarHBondContact O-CB 3.47Å; D439-L442 PolarHBondContact O-N 3.46Å; D439-L442 PolarHBondContact OD1-N 2.87Å; D439-L442 WeakPolarHBondContact OD2-CB 3.41Å
440	K	79.5	Confident	86.7	Confident	211 Å²	211	72.4 Å²	72.4	92%	0.917	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-13.2	176.3	-61.7	-177.2	-178.6	-179.9	0	114.2	K438	K438-K440 PolarHBondContact O-N 3.02Å; K438-K440 VanDerWaalsContact O-N 3.12Å
441	K	82.4	Confident	86.4	Confident	153 Å²	153	67.7 Å²	67.7	67%	0.665	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.6	-3.7	-180	-59.2	173	-174.5	171.6	0	112.3	R430 D439	R430-K441 PolarHBondContact O-NZ 2.67Å; D439-K441 PolarHBondContact O-N 3.3Å; D439-K441 VanDerWaalsContact O-N 3.16Å; D439-K441 WeakPolarHBondContact OD1-CA 3.28Å; D439-K441 WeakPolarHBondContact OD1-CB 3.42Å; D439-K441 PolarHBondContact OD1-N 3.43Å
442	L	85	Confident	86.1	Confident	20 Å²	20	70.2 Å²	70.2	11%	0.105	33%	0.328	C	S	.	.	S	Bend	trans	-71.1	137.8	-177.7	-163.2	54.4	0	0	0	111.7	K150 W373 P436 D439 K444 E446 L447 L450	K150-L442 HydrophobicContact CB-CD1 4.05Å; K150-L442 HydrophobicContact CD-CD1 4.17Å; W373-L442 HydrophobicContact CH2-CD1 4.2Å; W373-L442 HydrophobicContact CH2-CD2 4.12Å; W373-L442 HydrophobicContact CZ3-CD1 3.98Å; W373-L442 HydrophobicContact CZ3-CD2 4.2Å; P436-L442 HydrophobicContact CB-CD2 3.76Å; P436-L442 WeakPolarHBondContact O-CD2 3.41Å; D439-L442 HydrophobicContact CB-CB 4.1Å; D439-L442 WeakPolarHBondContact O-CB 3.47Å; D439-L442 PolarHBondContact O-N 3.46Å; D439-L442 PolarHBondContact OD1-N 2.87Å; D439-L442 WeakPolarHBondContact OD2-CB 3.41Å; L442-K444 PolarHBondContact O-N 2.87Å; L442-E446 HydrophobicContact CD1-CB 4.03Å; L442-E446 HydrophobicContact CD1-CG 3.91Å; L442-E446 HydrophobicContact CG-CB 4.39Å; L442-L447 HydrophobicContact CD2-CB 3.81Å; L442-L447 HydrophobicContact CD2-CD1 4.09Å; L442-L447 HydrophobicContact CD2-CG 4.49Å; L442-L447 HydrophobicContact CG-CB 4.18Å; L442-L450 HydrophobicContact CD2-CD1 4.28Å
443	N	85.9	Confident	85.6	Confident	88 Å²	88	71.7 Å²	71.7	47%	0.471	34%	0.338	S	S	.	.			trans	-65.5	128.8	172.5	-177.1	-21.7	0	0	0	109.6	R445 E446 L447	N443-R445 PolarHBondContact O-N 3.41Å; N443-R445 PolarHBondContact OD1-N 3.13Å; N443-E446 HydrophobicContact CB-CB 4.36Å; N443-E446 PolarHBondContact O-N 3.4Å; N443-L447 PolarHBondContact O-N 3.27Å
444	K	85.8	Confident	85.3	Confident	174 Å²	174	69.1 Å²	69.1	76%	0.757	32%	0.324	S	S	*	.	H	α-helix	trans	-49.2	-33	177.3	-65	-175.1	178.3	-176.3	0	113.1	L442 N448	L442-K444 PolarHBondContact O-N 2.87Å; K444-N448 WeakPolarHBondContact O-CB 3.37Å; K444-N448 PolarHBondContact O-N 2.63Å
445	R	86	Confident	84.8	Confident	188 Å²	188	71 Å²	71	71%	0.709	34%	0.338	S	S	*	.	H	α-helix	trans	-69.4	-40.9	174.9	-63.7	-175.2	-177.4	166.4	1.4	113.3	P147 N443 F449	P147-R445 HydrophobicContact CB-CB 4.06Å; N443-R445 PolarHBondContact O-N 3.41Å; N443-R445 PolarHBondContact OD1-N 3.13Å; R445-F449 WeakPolarHBondContact O-CB 3.27Å; R445-F449 PolarHBondContact O-N 2.94Å; R445-F449 VanDerWaalsContact O-N 3.13Å
446	E	88	Confident	84.1	Confident	6 Å²	6	74.3 Å²	74.3	3%	0.028	36%	0.357	C	S	.	.	H	α-helix	trans	-70.5	-40.8	176.9	-171.9	160.6	-157.3	0	0	110.4	P147 G148 R149 K150 R151 L442 N443 F449 L450	P147-E446 WeakPolarHBondContact O-CA 3.16Å; P147-E446 VanDerWaalsContact O-CB 3.3Å; P147-E446 WeakPolarHBondContact O-CB 3.23Å; P147-E446 WeakPolarHBondContact O-CG 3.16Å; G148-E446 VanDerWaalsContact CA-OE2 3.24Å; G148-E446 WeakPolarHBondContact CA-OE2 3.41Å; R149-E446 PolarHBondContact N-OE1 3.03Å; R149-E446 PolarHBondContact N-OE2 3.44Å; K150-E446 PolarHBondContact N-OE1 3.27Å; K150-E446 VanDerWaalsContact N-OE1 3.09Å; K150-E446 PolarHBondContact N-OE2 3.36Å; K150-E446 VanDerWaalsContact N-OE2 3.07Å; R151-E446 IonicContact CZ-OE1 3.81Å; R151-E446 PolarHBondContact N-OE1 3.47Å; R151-E446 IonicContact NH1-OE1 3.65Å; R151-E446 PolarHBondContact NH1-OE1 3.13Å; L442-E446 HydrophobicContact CD1-CB 4.03Å; L442-E446 HydrophobicContact CD1-CG 3.91Å; L442-E446 HydrophobicContact CG-CB 4.39Å; N443-E446 HydrophobicContact CB-CB 4.36Å; N443-E446 PolarHBondContact O-N 3.4Å; E446-F449 PolarHBondContact O-N 3.32Å; E446-L450 HydrophobicContact CG-CD1 4.02Å; E446-L450 WeakPolarHBondContact O-CB 3.45Å; E446-L450 VanDerWaalsContact O-CG 3.3Å; E446-L450 WeakPolarHBondContact O-CG 3.37Å; E446-L450 PolarHBondContact O-N 3.49Å
447	L	87.5	Confident	83.5	Confident	35 Å²	35	79.6 Å²	79.6	18%	0.183	38%	0.376	C	S	.	.	H	α-helix	trans	-60.1	-46.5	174.9	178.1	56.5	0	0	0	112.5	P436 L442 N443 L450 K451	P436-L447 HydrophobicContact CB-CD1 4.16Å; P436-L447 WeakPolarHBondContact O-CD1 3.24Å; L442-L447 HydrophobicContact CD2-CB 3.81Å; L442-L447 HydrophobicContact CD2-CD1 4.09Å; L442-L447 HydrophobicContact CD2-CG 4.49Å; L442-L447 HydrophobicContact CG-CB 4.18Å; N443-L447 PolarHBondContact O-N 3.27Å; L447-L450 PolarHBondContact O-N 3.32Å; L447-K451 HydrophobicContact CD1-CD 4.35Å; L447-K451 HydrophobicContact CD1-CG 4.36Å; L447-K451 HydrophobicContact CG-CD 4.37Å; L447-K451 WeakPolarHBondContact O-CG 3.48Å; L447-K451 PolarHBondContact O-N 3.44Å
448	N	86.9	Confident	83.3	Confident	96 Å²	96	76.5 Å²	76.5	51%	0.513	36%	0.359	S	S	.	.	H	α-helix	trans	-67	-41.5	179.4	-75.8	4.7	0	0	0	111.6	K444 L450 K451 T452	K444-N448 WeakPolarHBondContact O-CB 3.37Å; K444-N448 PolarHBondContact O-N 2.63Å; N448-L450 PolarHBondContact O-N 3.39Å; N448-K451 PolarHBondContact O-N 2.87Å; N448-T452 PolarHBondContact O-N 3.01Å; N448-T452 PolarHBondContact O-OG1 3.27Å
449	F	88	Confident	82.8	Confident	51 Å²	51	72.8 Å²	72.8	22%	0.224	34%	0.344	C	S	.	.	H	α-helix	trans	-58.7	-46.6	174.1	175.7	-114.9	0	0	0	112.1	P147 P375 R445 E446 K451 T452 T453	P147-F449 HydrophobicContact CG-CB 3.7Å; P147-F449 HydrophobicContact CG-CD1 4.35Å; P147-F449 HydrophobicContact CG-CD2 4.41Å; P147-F449 HydrophobicContact CG-CG 3.93Å; P375-F449 HydrophobicContact CB-CE1 4.25Å; P375-F449 HydrophobicContact CB-CZ 4.39Å; P375-F449 HydrophobicContact CG-CE1 3.81Å; P375-F449 HydrophobicContact CG-CZ 4.43Å; R445-F449 WeakPolarHBondContact O-CB 3.27Å; R445-F449 PolarHBondContact O-N 2.94Å; R445-F449 VanDerWaalsContact O-N 3.13Å; E446-F449 PolarHBondContact O-N 3.32Å; F449-K451 PolarHBondContact O-N 3.19Å; F449-T452 WeakPolarHBondContact CA-OG1 3.35Å; F449-T452 PolarHBondContact O-N 2.87Å; F449-T452 VanDerWaalsContact O-N 3.16Å; F449-T452 PolarHBondContact O-OG1 2.82Å; F449-T453 PolarHBondContact O-N 3.01Å; F449-T453 VanDerWaalsContact O-N 3.07Å; F449-T453 PolarHBondContact O-OG1 2.75Å
450	L	88	Confident	82.1	Confident	1 Å²	1	77.6 Å²	77.6	1%	0.005	36%	0.364	C	S	.	.	H	α-helix	trans	-61.5	-42.3	175.8	-71.2	165.5	0	0	0	112	W373 P375 P436 L442 E446 L447 N448 T452 T453 I454	W373-L450 HydrophobicContact CE3-CD1 3.99Å; W373-L450 HydrophobicContact CZ3-CD1 4.01Å; P375-L450 HydrophobicContact CG-CD2 3.98Å; P436-L450 HydrophobicContact CB-CD1 3.97Å; P436-L450 HydrophobicContact CG-CD1 3.91Å; L442-L450 HydrophobicContact CD2-CD1 4.28Å; E446-L450 HydrophobicContact CG-CD1 4.02Å; E446-L450 WeakPolarHBondContact O-CB 3.45Å; E446-L450 VanDerWaalsContact O-CG 3.3Å; E446-L450 WeakPolarHBondContact O-CG 3.37Å; E446-L450 PolarHBondContact O-N 3.49Å; L447-L450 PolarHBondContact O-N 3.32Å; N448-L450 PolarHBondContact O-N 3.39Å; L450-T452 VanDerWaalsContact C-N 3.3Å; L450-T452 PolarHBondContact O-N 2.74Å; L450-T453 PolarHBondContact O-N 2.71Å; L450-I454 HydrophobicContact CD2-CD1 3.7Å; L450-I454 WeakPolarHBondContact O-CB 3.48Å; L450-I454 PolarHBondContact O-N 2.71Å
451	K	85.9	Confident	81.6	Confident	79 Å²	79	69.2 Å²	69.2	34%	0.343	33%	0.33	S	S	.	.	H	α-helix	trans	-62.2	-31.6	173.9	-76.3	175.4	170.2	-177.9	0	113.9	L447 N448 F449 L459	L447-K451 HydrophobicContact CD1-CD 4.35Å; L447-K451 HydrophobicContact CD1-CG 4.36Å; L447-K451 HydrophobicContact CG-CD 4.37Å; L447-K451 WeakPolarHBondContact O-CG 3.48Å; L447-K451 PolarHBondContact O-N 3.44Å; N448-K451 PolarHBondContact O-N 2.87Å; F449-K451 PolarHBondContact O-N 3.19Å; K451-L459 HydrophobicContact CG-CD1 4.2Å
452	T	84.8	Confident	80.5	Confident	114 Å²	114	69.5 Å²	69.5	70%	0.699	33%	0.333	S	S	*	.	H	α-helix	trans	-82.2	-22.1	177.5	49.5	0	0	0	0	114	N448 F449 L450	N448-T452 PolarHBondContact O-N 3.01Å; N448-T452 PolarHBondContact O-OG1 3.27Å; F449-T452 WeakPolarHBondContact CA-OG1 3.35Å; F449-T452 PolarHBondContact O-N 2.87Å; F449-T452 VanDerWaalsContact O-N 3.16Å; F449-T452 PolarHBondContact O-OG1 2.82Å; L450-T452 VanDerWaalsContact C-N 3.3Å; L450-T452 PolarHBondContact O-N 2.74Å
453	T	82.5	Confident	79.2	Confident	38 Å²	38	74.2 Å²	74.2	23%	0.233	36%	0.358	C	S	.	.	H	α-helix	trans	-112.3	-13	-173	-47.9	0	0	0	0	113.9	P375 F449 L450	P375-T453 HydrophobicContact CB-CG2 3.83Å; F449-T453 PolarHBondContact O-N 3.01Å; F449-T453 VanDerWaalsContact O-N 3.07Å; F449-T453 PolarHBondContact O-OG1 2.75Å; L450-T453 PolarHBondContact O-N 2.71Å
454	I	83.5	Confident	78.3	Confident	8 Å²	8	79.6 Å²	79.6	4%	0.041	37%	0.374	C	S	.	.	S	Bend	trans	-114.9	136.8	176.1	-57.8	-179.5	0	0	0	108.6	F372 L450 N456 L458 L459	F372-I454 WeakPolarHBondContact O-CD1 3.33Å; L450-I454 HydrophobicContact CD2-CD1 3.7Å; L450-I454 WeakPolarHBondContact O-CB 3.48Å; L450-I454 PolarHBondContact O-N 2.71Å; I454-N456 PolarHBondContact O-N 3.3Å; I454-L458 HydrophobicContact CG2-CB 4.43Å; I454-L458 HydrophobicContact CG2-CD2 3.78Å; I454-L459 HydrophobicContact CB-CD1 4.3Å; I454-L459 HydrophobicContact CB-CG 4.43Å; I454-L459 HydrophobicContact CG2-CD1 4.44Å; I454-L459 HydrophobicContact CG2-CD2 4.05Å; I454-L459 HydrophobicContact CG2-CG 4.04Å
455	S	78.2	Confident	78	Confident	46 Å²	46	71.6 Å²	71.6	32%	0.322	34%	0.339	S	S	.	.			trans	-53.9	129.4	-176.8	-179.7	0	0	0	0	112.4	R457 L458 L459 Y676	S455-R457 PolarHBondContact O-N 2.87Å; S455-R457 PolarHBondContact OG-N 3.49Å; S455-L458 WeakPolarHBondContact O-CA 3.45Å; S455-L458 VanDerWaalsContact O-CB 3.25Å; S455-L458 WeakPolarHBondContact O-CB 3.22Å; S455-L458 PolarHBondContact O-N 3.37Å; S455-L459 PolarHBondContact O-N 3.48Å; S455-L459 VanDerWaalsContact O-N 3.13Å; S455-Y676 VanDerWaalsContact CB-OH 3.29Å; S455-Y676 WeakPolarHBondContact CB-OH 3.42Å
456	N	73.7	Confident	77.9	Confident	91 Å²	91	70.8 Å²	70.8	49%	0.487	34%	0.341	S	S	.	.	H	α-helix	trans	-59.1	-33.4	171.9	-76.1	-33.6	0	0	0	111.8	I454 L458 L459 F460	I454-N456 PolarHBondContact O-N 3.3Å; N456-L458 PolarHBondContact O-N 2.9Å; N456-L458 VanDerWaalsContact O-N 3.13Å; N456-L459 PolarHBondContact O-N 3.42Å; N456-F460 HydrophobicContact CB-CD2 4.07Å; N456-F460 HydrophobicContact CB-CE2 4.4Å; N456-F460 WeakPolarHBondContact O-CD2 3.43Å; N456-F460 PolarHBondContact O-N 2.86Å; N456-F460 WeakPolarHBondContact OD1-CE2 3.42Å
457	R	72.5	Confident	78	Confident	112 Å²	112	71.4 Å²	71.4	42%	0.423	34%	0.344	S	S	.	.	H	α-helix	trans	-60	-20.4	172.1	-66.9	-158.3	-112.4	-161.3	-5.2	113	S455 N461 Y676 T679 D682	S455-R457 PolarHBondContact O-N 2.87Å; S455-R457 PolarHBondContact OG-N 3.49Å; R457-N461 WeakPolarHBondContact O-CB 3.48Å; R457-Y676 HydrophobicContact CB-CD1 3.8Å; R457-Y676 HydrophobicContact CB-CE1 4.01Å; R457-Y676 HydrophobicContact CB-CG 4.22Å; R457-T679 HydrophobicContact CG-CG2 4.49Å; R457-D682 IonicContact CZ-OD2 3.99Å; R457-D682 IonicContact NH1-OD1 2.82Å; R457-D682 PolarHBondContact NH1-OD1 2.92Å; R457-D682 IonicContact NH1-OD2 2.72Å; R457-D682 PolarHBondContact NH1-OD2 2.95Å
458	L	78.9	Confident	78.2	Confident	2 Å²	2	71.1 Å²	71.1	1%	0.01	34%	0.344	C	S	.	.	H	α-helix	trans	-88.7	-51.5	173	-164.3	73.6	0	0	0	111.8	R371 F372 I454 S455 N456 F460 N461 P605 N606 Y676	R371-L458 HydrophobicContact CB-CD2 4.17Å; R371-L458 WeakPolarHBondContact O-CD2 3.31Å; F372-L458 HydrophobicContact CD1-CD2 4Å; F372-L458 HydrophobicContact CD1-CG 3.94Å; F372-L458 HydrophobicContact CE1-CD1 4.41Å; F372-L458 HydrophobicContact CE1-CD2 4.36Å; F372-L458 HydrophobicContact CE1-CG 3.86Å; I454-L458 HydrophobicContact CG2-CB 4.43Å; I454-L458 HydrophobicContact CG2-CD2 3.78Å; S455-L458 WeakPolarHBondContact O-CA 3.45Å; S455-L458 VanDerWaalsContact O-CB 3.25Å; S455-L458 WeakPolarHBondContact O-CB 3.22Å; S455-L458 PolarHBondContact O-N 3.37Å; N456-L458 PolarHBondContact O-N 2.9Å; N456-L458 VanDerWaalsContact O-N 3.13Å; L458-F460 VanDerWaalsContact C-N 3.32Å; L458-F460 PolarHBondContact O-N 3.36Å; L458-N461 PolarHBondContact O-N 2.98Å; L458-P605 HydrophobicContact CD1-CB 4.15Å; L458-P605 HydrophobicContact CD2-CB 4.29Å; L458-N606 VanDerWaalsContact CD1-CA 3.5Å; L458-N606 HydrophobicContact CD1-CB 3.91Å; L458-Y676 HydrophobicContact CB-CE1 3.84Å; L458-Y676 HydrophobicContact CD1-CE1 3.85Å; L458-Y676 HydrophobicContact CG-CE1 4.47Å
459	L	73.6	Confident	78.6	Confident	6 Å²	6	71.7 Å²	71.7	3%	0.031	34%	0.339	C	S	.	.	H	α-helix	trans	-65.3	-34.1	-172.7	-66.1	174.2	0	0	0	113.1	N437 K451 I454 S455 N456	N437-L459 PolarHBondContact ND2-O 3.5Å; K451-L459 HydrophobicContact CG-CD1 4.2Å; I454-L459 HydrophobicContact CB-CD1 4.3Å; I454-L459 HydrophobicContact CB-CG 4.43Å; I454-L459 HydrophobicContact CG2-CD1 4.44Å; I454-L459 HydrophobicContact CG2-CD2 4.05Å; I454-L459 HydrophobicContact CG2-CG 4.04Å; S455-L459 PolarHBondContact O-N 3.48Å; S455-L459 VanDerWaalsContact O-N 3.13Å; N456-L459 PolarHBondContact O-N 3.42Å
460	F	68.1	Low	78.8	Confident	111 Å²	111	76.8 Å²	76.8	49%	0.487	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104	7.8	-179.1	-61.2	-76.3	0	0	0	113.5	N456 L458 H462	N456-F460 HydrophobicContact CB-CD2 4.07Å; N456-F460 HydrophobicContact CB-CE2 4.4Å; N456-F460 WeakPolarHBondContact O-CD2 3.43Å; N456-F460 PolarHBondContact O-N 2.86Å; N456-F460 WeakPolarHBondContact OD1-CE2 3.42Å; L458-F460 VanDerWaalsContact C-N 3.32Å; L458-F460 PolarHBondContact O-N 3.36Å; F460-H462 PolarHBondContact O-N 3.3Å
461	N	68.6	Low	79	Confident	35 Å²	35	81.5 Å²	81.5	19%	0.187	39%	0.386	C	S	.	.			trans	-59.3	129.2	178	-166	11.9	0	0	0	111	K435 R457 L458 T465 N606	K435-N461 PolarHBondContact NZ-O 3.47Å; R457-N461 WeakPolarHBondContact O-CB 3.48Å; L458-N461 PolarHBondContact O-N 2.98Å; N461-T465 PolarHBondContact ND2-OG1 2.92Å; N461-N606 PolarHBondContact ND2-ND2 3.42Å; N461-N606 VanDerWaalsContact ND2-ND2 3.14Å; N461-N606 PolarHBondContact ND2-OD1 2.87Å
462	H	59.2	Low	79.4	Confident	159 Å²	159	77.9 Å²	77.9	74%	0.736	37%	0.37	S	S	*	.			trans	-72.4	157.4	176.2	-71.6	-81.1	0	0	0	110.8	F460 Y464	F460-H462 PolarHBondContact O-N 3.3Å; H462-Y464 PolarHBondContact O-N 2.85Å
463	N	58.4	Low	79.8	Confident	119 Å²	119	76.6 Å²	76.6	64%	0.636	36%	0.355	S	S	*	.	S	Bend	trans	-70.2	8.1	-168.5	-58.1	-5	0	0	0	115.2	N310	N310-N463 PolarHBondContact OD1-O 3.41Å
464	Y	66.7	Low	80.3	Confident	201 Å²	201	79.3 Å²	79.3	79%	0.788	37%	0.372	S	S	*	.			trans	-127.2	94.8	177.8	-170.3	-101.3	0	0	0	110.1	H462	H462-Y464 PolarHBondContact O-N 2.85Å
465	T	78.6	Confident	80.9	Confident	5 Å²	5	79.3 Å²	79.3	3%	0.031	37%	0.372	C	S	.	.			trans	-104.1	122.1	178.1	-63.9	0	0	0	0	109.7	V309 N310 N461 I467 N606 F607 S677	V309-T465 HydrophobicContact CG1-CG2 4.1Å; N310-T465 PolarHBondContact OD1-N 3.27Å; N461-T465 PolarHBondContact ND2-OG1 2.92Å; T465-I467 PolarHBondContact O-N 3.48Å; T465-N606 VanDerWaalsContact CG2-ND2 3.3Å; T465-N606 WeakPolarHBondContact CG2-ND2 3.36Å; T465-F607 HydrophobicContact CG2-CE1 3.48Å; T465-F607 VanDerWaalsContact CG2-CE1 3.48Å; T465-F607 HydrophobicContact CG2-CZ 3.43Å; T465-F607 VanDerWaalsContact CG2-CZ 3.43Å; T465-S677 WeakPolarHBondContact CG2-OG 3.33Å
466	K	84.7	Confident	81.7	Confident	172 Å²	172	85.8 Å²	85.8	75%	0.748	39%	0.39	S	S	*	.			trans	-70.3	116	173.3	-173.6	178.4	178.9	-177.3	0	109.3	P468	K466-P468 WeakPolarHBondContact O-CD 3.34Å
467	I	90.5	Very high	82.7	Confident	19 Å²	19	82.1 Å²	82.1	10%	0.097	37%	0.371	C	S	.	.			trans	-79.3	123.1	-177.1	-60.5	173.8	0	0	0	110.3	Y306 V309 T465 W469 I472 F607 L610	Y306-I467 HydrophobicContact CD2-CD1 3.45Å; Y306-I467 VanDerWaalsContact CD2-CD1 3.45Å; Y306-I467 HydrophobicContact CE2-CD1 3.56Å; V309-I467 HydrophobicContact CB-CD1 4.42Å; V309-I467 HydrophobicContact CG1-CD1 4.3Å; V309-I467 HydrophobicContact CG1-CG1 4.13Å; V309-I467 HydrophobicContact CG2-CD1 4.29Å; T465-I467 PolarHBondContact O-N 3.48Å; I467-W469 VanDerWaalsContact C-N 3.27Å; I467-W469 HydrophobicContact CB-CD2 4.4Å; I467-W469 HydrophobicContact CB-CZ2 4.37Å; I467-W469 HydrophobicContact CD1-CH2 4.36Å; I467-W469 HydrophobicContact CD1-CZ2 3.89Å; I467-W469 HydrophobicContact CG2-CD2 3.64Å; I467-W469 HydrophobicContact CG2-CE3 3.97Å; I467-W469 HydrophobicContact CG2-CG 4.07Å; I467-W469 HydrophobicContact CG2-CH2 4.35Å; I467-W469 HydrophobicContact CG2-CZ2 4.04Å; I467-W469 HydrophobicContact CG2-CZ3 4.31Å; I467-W469 PolarHBondContact O-N 3.21Å; I467-I472 HydrophobicContact CG2-CD1 3.72Å; I467-F607 HydrophobicContact CB-CE1 4.47Å; I467-F607 HydrophobicContact CG1-CE1 4.03Å; I467-L610 HydrophobicContact CD1-CD2 4.2Å; I467-L610 HydrophobicContact CG2-CD2 3.61Å
468	P	91.3	Very high	83.8	Confident	28 Å²	28	77.1 Å²	77.1	18%	0.182	35%	0.353	C	S	.	.			trans	-84.4	63	-178.7	33.7	-34.4	0	0	0	112.1	K466 Q470 Q471 I472 F607 W674	K466-P468 WeakPolarHBondContact O-CD 3.34Å; P468-Q470 VanDerWaalsContact C-N 3.35Å; P468-Q470 PolarHBondContact O-N 2.87Å; P468-Q470 VanDerWaalsContact O-N 3.16Å; P468-Q471 HydrophobicContact CB-CB 4.33Å; P468-Q471 PolarHBondContact O-N 2.9Å; P468-I472 HydrophobicContact CG-CD1 4.21Å; P468-I472 HydrophobicContact CG-CG1 4.3Å; P468-I472 PolarHBondContact O-N 2.98Å; P468-I472 VanDerWaalsContact O-N 3.07Å; P468-F607 HydrophobicContact CG-CE2 4.25Å; P468-F607 HydrophobicContact CG-CZ 4.33Å; P468-W674 HydrophobicContact CB-CB 4.22Å; P468-W674 HydrophobicContact CG-CB 3.89Å; P468-W674 HydrophobicContact CG-CE3 4.18Å; P468-W674 HydrophobicContact CG-CG 4.48Å
469	W	94	Very high	84.6	Confident	108 Å²	108	82 Å²	82	41%	0.409	37%	0.372	S	S	.	.	H	α-helix	trans	-45.6	-49.2	-171.7	-67.2	112.4	0	0	0	115	Y306 I467 Q471 I472 F473 L610 F614	Y306-W469 HydrophobicContact CD2-CH2 4.24Å; Y306-W469 HydrophobicContact CD2-CZ2 4.03Å; Y306-W469 HydrophobicContact CE2-CZ2 4.38Å; I467-W469 VanDerWaalsContact C-N 3.27Å; I467-W469 HydrophobicContact CB-CD2 4.4Å; I467-W469 HydrophobicContact CB-CZ2 4.37Å; I467-W469 HydrophobicContact CD1-CH2 4.36Å; I467-W469 HydrophobicContact CD1-CZ2 3.89Å; I467-W469 HydrophobicContact CG2-CD2 3.64Å; I467-W469 HydrophobicContact CG2-CE3 3.97Å; I467-W469 HydrophobicContact CG2-CG 4.07Å; I467-W469 HydrophobicContact CG2-CH2 4.35Å; I467-W469 HydrophobicContact CG2-CZ2 4.04Å; I467-W469 HydrophobicContact CG2-CZ3 4.31Å; I467-W469 PolarHBondContact O-N 3.21Å; W469-Q471 VanDerWaalsContact C-N 3.33Å; W469-Q471 PolarHBondContact O-N 3.23Å; W469-I472 PolarHBondContact O-N 2.86Å; W469-F473 HydrophobicContact CE3-CD2 4.49Å; W469-F473 AromaticContact CE3-CE2 3.67Å; W469-F473 HydrophobicContact CE3-CE2 3.67Å; W469-F473 HydrophobicContact CE3-CZ 4.27Å; W469-F473 HydrophobicContact CZ3-CE2 4.24Å; W469-F473 HydrophobicContact CZ3-CZ 4.41Å; W469-F473 VanDerWaalsContact O-CD2 3.23Å; W469-F473 WeakPolarHBondContact O-CD2 3.44Å; W469-F473 PolarHBondContact O-N 3.27Å; W469-L610 HydrophobicContact CH2-CD1 4.1Å; W469-L610 HydrophobicContact CZ3-CD1 4.21Å; W469-L610 HydrophobicContact CZ3-CD2 4.43Å; W469-F614 AromaticContact CZ3-CE2 3.89Å; W469-F614 HydrophobicContact CZ3-CE2 3.89Å; W469-F614 AromaticContact CZ3-CZ 3.96Å; W469-F614 HydrophobicContact CZ3-CZ 3.96Å
470	Q	93.4	Very high	85.7	Confident	159 Å²	159	81.7 Å²	81.7	74%	0.743	37%	0.37	S	S	*	.	H	α-helix	trans	-63.8	-36.3	-178.7	-174.2	-179.9	0.7	0	0	112.7	P468 T474	P468-Q470 VanDerWaalsContact C-N 3.35Å; P468-Q470 PolarHBondContact O-N 2.87Å; P468-Q470 VanDerWaalsContact O-N 3.16Å; Q470-T474 WeakPolarHBondContact O-CB 3.27Å; Q470-T474 WeakPolarHBondContact O-CG2 3.09Å; Q470-T474 PolarHBondContact O-N 3.13Å; Q470-T474 VanDerWaalsContact O-N 3.13Å; Q470-T474 PolarHBondContact O-OG1 3.3Å
471	Q	92.4	Very high	87	Confident	100 Å²	100	76.4 Å²	76.4	47%	0.467	35%	0.347	S	S	.	.	H	α-helix	trans	-77.1	-33.3	-179.3	-64.8	172.3	-34.3	0	0	111.2	P468 W469 S475 W674	P468-Q471 HydrophobicContact CB-CB 4.33Å; P468-Q471 PolarHBondContact O-N 2.9Å; W469-Q471 VanDerWaalsContact C-N 3.33Å; W469-Q471 PolarHBondContact O-N 3.23Å; Q471-S475 WeakPolarHBondContact O-CB 3.33Å; Q471-S475 PolarHBondContact O-N 3.11Å; Q471-W674 HydrophobicContact CB-CB 4.1Å; Q471-W674 HydrophobicContact CB-CG 3.86Å; Q471-W674 VanDerWaalsContact OE1-CB 3.29Å
472	I	93.5	Very high	88.4	Confident	3 Å²	3	75.9 Å²	75.9	2%	0.015	34%	0.344	C	S	.	.	H	α-helix	trans	-62.6	-53.7	170.9	-64.1	166.1	0	0	0	109.9	I467 P468 W469 T474 S475 L610 W674	I467-I472 HydrophobicContact CG2-CD1 3.72Å; P468-I472 HydrophobicContact CG-CD1 4.21Å; P468-I472 HydrophobicContact CG-CG1 4.3Å; P468-I472 PolarHBondContact O-N 2.98Å; P468-I472 VanDerWaalsContact O-N 3.07Å; W469-I472 PolarHBondContact O-N 2.86Å; I472-T474 PolarHBondContact O-N 3.44Å; I472-S475 PolarHBondContact O-N 3.41Å; I472-L610 HydrophobicContact CD1-CD2 3.89Å; I472-W674 HydrophobicContact CB-CH2 4.49Å; I472-W674 HydrophobicContact CD1-CZ3 4.36Å; I472-W674 HydrophobicContact CG1-CD2 4.32Å; I472-W674 HydrophobicContact CG1-CE3 3.78Å; I472-W674 HydrophobicContact CG1-CH2 3.9Å; I472-W674 HydrophobicContact CG1-CZ2 4.38Å; I472-W674 HydrophobicContact CG1-CZ3 3.57Å
473	F	93.6	Very high	90.1	Very high	86 Å²	86	73.2 Å²	73.2	38%	0.377	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.2	3.5	-178.3	-66.7	-56	0	0	0	115.1	W469 Y479 F614	W469-F473 HydrophobicContact CE3-CD2 4.49Å; W469-F473 AromaticContact CE3-CE2 3.67Å; W469-F473 HydrophobicContact CE3-CE2 3.67Å; W469-F473 HydrophobicContact CE3-CZ 4.27Å; W469-F473 HydrophobicContact CZ3-CE2 4.24Å; W469-F473 HydrophobicContact CZ3-CZ 4.41Å; W469-F473 VanDerWaalsContact O-CD2 3.23Å; W469-F473 WeakPolarHBondContact O-CD2 3.44Å; W469-F473 PolarHBondContact O-N 3.27Å; F473-Y479 WeakPolarHBondContact O-CE2 3.3Å; F473-Y479 PolarHBondContact O-OH 2.96Å; F473-Y479 VanDerWaalsContact O-OH 3.13Å; F473-F614 HydrophobicContact CE1-CD1 4.22Å; F473-F614 HydrophobicContact CE1-CE1 4.14Å; F473-F614 HydrophobicContact CE1-CG 4.45Å; F473-F614 HydrophobicContact CE1-CZ 4.31Å; F473-F614 HydrophobicContact CZ-CD1 4.31Å; F473-F614 AromaticContact CZ-CE1 3.78Å; F473-F614 HydrophobicContact CZ-CE1 3.78Å; F473-F614 HydrophobicContact CZ-CE2 4.06Å; F473-F614 AromaticContact CZ-CZ 3.65Å; F473-F614 HydrophobicContact CZ-CZ 3.65Å
474	T	93.8	Very high	92	Very high	96 Å²	96	67.5 Å²	67.5	59%	0.589	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.3	-3.5	168	52.9	0	0	0	0	113.7	Q470 I472 R476	Q470-T474 WeakPolarHBondContact O-CB 3.27Å; Q470-T474 WeakPolarHBondContact O-CG2 3.09Å; Q470-T474 PolarHBondContact O-N 3.13Å; Q470-T474 VanDerWaalsContact O-N 3.13Å; Q470-T474 PolarHBondContact O-OG1 3.3Å; I472-T474 PolarHBondContact O-N 3.44Å; T474-R476 PolarHBondContact O-N 3.35Å
475	S	94.6	Very high	93.4	Very high	8 Å²	8	59 Å²	59	6%	0.056	27%	0.267	C	S	.	.			trans	-74.4	114.9	-179.5	179	0	0	0	0	112	Q471 I472 P477 V478 Y479 Q672	Q471-S475 WeakPolarHBondContact O-CB 3.33Å; Q471-S475 PolarHBondContact O-N 3.11Å; I472-S475 PolarHBondContact O-N 3.41Å; S475-P477 WeakPolarHBondContact OG-CD 3.2Å; S475-V478 WeakPolarHBondContact O-CB 3.38Å; S475-V478 PolarHBondContact O-N 3.1Å; S475-Y479 WeakPolarHBondContact O-CD2 3.25Å; S475-Y479 PolarHBondContact O-N 3Å; S475-Q672 PolarHBondContact OG-OE1 3.4Å
476	R	95.7	Very high	94.3	Very high	181 Å²	181	59.3 Å²	59.3	68%	0.683	27%	0.27	S	S	*	.	H	α-helix	trans	-57.4	-40.6	177.9	-57.5	177.6	-177.1	161.8	-0.5	113.3	T474 V478 Y479 A480 F666	T474-R476 PolarHBondContact O-N 3.35Å; R476-V478 VanDerWaalsContact C-N 3.32Å; R476-V478 PolarHBondContact O-N 3.43Å; R476-Y479 PolarHBondContact O-N 3.35Å; R476-A480 PolarHBondContact O-N 2.94Å; R476-F666 HydrophobicContact CB-CB 4.29Å
477	P	95.3	Very high	94.9	Very high	15 Å²	15	51.3 Å²	51.3	10%	0.097	24%	0.236	C	C	.	.	H	α-helix	trans	-60.1	-33.3	171.2	-28.5	35.9	0	0	0	115.1	S475 A480 I481 L603	S475-P477 WeakPolarHBondContact OG-CD 3.2Å; P477-A480 WeakPolarHBondContact O-CB 3.29Å; P477-A480 PolarHBondContact O-N 3.24Å; P477-I481 WeakPolarHBondContact O-CG1 3.37Å; P477-I481 PolarHBondContact O-N 3.43Å; P477-I481 VanDerWaalsContact O-N 3.08Å; P477-L603 HydrophobicContact CB-CD1 3.46Å; P477-L603 VanDerWaalsContact CB-CD1 3.46Å; P477-L603 HydrophobicContact CB-CD2 3.74Å; P477-L603 HydrophobicContact CB-CG 4.27Å; P477-L603 HydrophobicContact CG-CD1 4.05Å
478	V	95.8	Very high	95.2	Very high	6 Å²	6	51 Å²	51	4%	0.036	23%	0.234	C	C	.	.	H	α-helix	trans	-64.2	-47.2	174.9	174.4	0	0	0	0	109.8	S475 R476 A480 I481 L482 L603 V611 W674	S475-V478 WeakPolarHBondContact O-CB 3.38Å; S475-V478 PolarHBondContact O-N 3.1Å; R476-V478 VanDerWaalsContact C-N 3.32Å; R476-V478 PolarHBondContact O-N 3.43Å; V478-A480 VanDerWaalsContact C-N 3.31Å; V478-A480 PolarHBondContact O-N 2.92Å; V478-I481 WeakPolarHBondContact O-CB 3.3Å; V478-I481 PolarHBondContact O-N 3.19Å; V478-I481 VanDerWaalsContact O-N 3.12Å; V478-L482 HydrophobicContact CG1-CD1 4.48Å; V478-L482 HydrophobicContact CG1-CG 4.45Å; V478-L482 WeakPolarHBondContact O-CG 3.14Å; V478-L482 PolarHBondContact O-N 3.18Å; V478-L603 HydrophobicContact CG2-CD2 3.8Å; V478-V611 HydrophobicContact CG1-CG1 4.4Å; V478-W674 HydrophobicContact CG2-CH2 3.91Å; V478-W674 HydrophobicContact CG2-CZ2 3.89Å
479	Y	95.9	Very high	95.4	Very high	105 Å²	105	51.3 Å²	51.3	41%	0.412	23%	0.234	S	C	.	.	H	α-helix	trans	-59.6	-39.5	174.1	-76.5	-75.6	0	0	0	112.9	F473 S475 R476 I481 L482 F483	F473-Y479 WeakPolarHBondContact O-CE2 3.3Å; F473-Y479 PolarHBondContact O-OH 2.96Å; F473-Y479 VanDerWaalsContact O-OH 3.13Å; S475-Y479 WeakPolarHBondContact O-CD2 3.25Å; S475-Y479 PolarHBondContact O-N 3Å; R476-Y479 PolarHBondContact O-N 3.35Å; Y479-I481 VanDerWaalsContact C-N 3.28Å; Y479-I481 PolarHBondContact O-N 3.47Å; Y479-L482 HydrophobicContact CD1-CD1 4.11Å; Y479-L482 HydrophobicContact CE1-CD1 4.38Å; Y479-L482 PolarHBondContact O-N 3.28Å; Y479-F483 WeakPolarHBondContact O-CD2 3.38Å; Y479-F483 PolarHBondContact O-N 2.95Å
480	A	96.5	Very high	95.5	Very high	0 Å²	0	48 Å²	48	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-58.4	-40.7	175	0	0	0	0	0	112.3	R476 P477 V478 T484 Y663 F666	R476-A480 PolarHBondContact O-N 2.94Å; P477-A480 WeakPolarHBondContact O-CB 3.29Å; P477-A480 PolarHBondContact O-N 3.24Å; V478-A480 VanDerWaalsContact C-N 3.31Å; V478-A480 PolarHBondContact O-N 2.92Å; A480-T484 PolarHBondContact O-N 3.03Å; A480-T484 PolarHBondContact O-OG1 2.75Å; A480-Y663 HydrophobicContact CB-CD2 4.15Å; A480-F666 HydrophobicContact CB-CB 4.2Å
481	I	95.8	Very high	95.6	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-64.3	-49.3	173.3	-70.8	170.1	0	0	0	110.8	P477 V478 Y479 F483 T484 Y485 N599 V600 L603 A615	P477-I481 WeakPolarHBondContact O-CG1 3.37Å; P477-I481 PolarHBondContact O-N 3.43Å; P477-I481 VanDerWaalsContact O-N 3.08Å; V478-I481 WeakPolarHBondContact O-CB 3.3Å; V478-I481 PolarHBondContact O-N 3.19Å; V478-I481 VanDerWaalsContact O-N 3.12Å; Y479-I481 VanDerWaalsContact C-N 3.28Å; Y479-I481 PolarHBondContact O-N 3.47Å; I481-F483 VanDerWaalsContact C-N 3.35Å; I481-F483 PolarHBondContact O-N 3.5Å; I481-T484 WeakPolarHBondContact CA-OG1 3.36Å; I481-T484 PolarHBondContact O-N 3.36Å; I481-T484 PolarHBondContact O-OG1 3.5Å; I481-Y485 HydrophobicContact CG2-CD2 3.81Å; I481-Y485 HydrophobicContact CG2-CE2 3.98Å; I481-Y485 PolarHBondContact O-N 3.16Å; I481-N599 HydrophobicContact CD1-CB 4.46Å; I481-V600 HydrophobicContact CD1-CG2 4.23Å; I481-V600 HydrophobicContact CG2-CG2 3.84Å; I481-L603 HydrophobicContact CD1-CD2 3.74Å; I481-A615 HydrophobicContact CG2-CB 4.28Å
482	L	96.4	Very high	95.7	Very high	23 Å²	23	36.6 Å²	36.6	12%	0.12	17%	0.168	C	C	.	.	H	α-helix	trans	-55	-47.8	178.9	-64.8	-179.5	0	0	0	111.6	V478 Y479 T484 Y485 A486 F614 A615 V618	V478-L482 HydrophobicContact CG1-CD1 4.48Å; V478-L482 HydrophobicContact CG1-CG 4.45Å; V478-L482 WeakPolarHBondContact O-CG 3.14Å; V478-L482 PolarHBondContact O-N 3.18Å; Y479-L482 HydrophobicContact CD1-CD1 4.11Å; Y479-L482 HydrophobicContact CE1-CD1 4.38Å; Y479-L482 PolarHBondContact O-N 3.28Å; L482-T484 PolarHBondContact O-N 3.32Å; L482-Y485 PolarHBondContact O-N 2.85Å; L482-A486 VanDerWaalsContact O-CB 3.31Å; L482-A486 WeakPolarHBondContact O-CB 3.26Å; L482-A486 PolarHBondContact O-N 3.3Å; L482-F614 HydrophobicContact CD2-CB 4.13Å; L482-A615 VanDerWaalsContact CD2-CA 3.49Å; L482-A615 HydrophobicContact CD2-CB 3.98Å; L482-V618 HydrophobicContact CD2-CG2 4.34Å
483	F	96	Very high	95.6	Very high	103 Å²	103	37.4 Å²	37.4	45%	0.452	17%	0.172	S	C	.	.	H	α-helix	trans	-66.1	-35.3	179	-78.7	-66.6	0	0	0	113.4	Y479 I481 A487 T662	Y479-F483 WeakPolarHBondContact O-CD2 3.38Å; Y479-F483 PolarHBondContact O-N 2.95Å; I481-F483 VanDerWaalsContact C-N 3.35Å; I481-F483 PolarHBondContact O-N 3.5Å; F483-A487 WeakPolarHBondContact O-CB 3.4Å; F483-A487 PolarHBondContact O-N 3.05Å; F483-T662 HydrophobicContact CB-CG2 4.1Å; F483-T662 HydrophobicContact CD2-CG2 3.72Å; F483-T662 HydrophobicContact CG-CG2 4.15Å
484	T	97.1	Very high	95.5	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-70	-40.7	175.3	44.1	0	0	0	0	113.5	A480 I481 L482 D488 F559 Y596 A659 Y663	A480-T484 PolarHBondContact O-N 3.03Å; A480-T484 PolarHBondContact O-OG1 2.75Å; I481-T484 WeakPolarHBondContact CA-OG1 3.36Å; I481-T484 PolarHBondContact O-N 3.36Å; I481-T484 PolarHBondContact O-OG1 3.5Å; L482-T484 PolarHBondContact O-N 3.32Å; T484-D488 WeakPolarHBondContact O-CB 3.48Å; T484-D488 PolarHBondContact O-N 3Å; T484-F559 HydrophobicContact CG2-CD2 4.09Å; T484-F559 HydrophobicContact CG2-CE2 3.45Å; T484-F559 VanDerWaalsContact CG2-CE2 3.45Å; T484-F559 HydrophobicContact CG2-CZ 3.9Å; T484-F559 WeakPolarHBondContact O-CZ 3.33Å; T484-Y596 WeakPolarHBondContact OG1-CB 3.31Å; T484-A659 HydrophobicContact CG2-CB 4.25Å; T484-Y663 HydrophobicContact CG2-CD2 3.44Å; T484-Y663 VanDerWaalsContact CG2-CD2 3.44Å; T484-Y663 HydrophobicContact CG2-CE2 4.31Å; T484-Y663 HydrophobicContact CG2-CG 3.79Å
485	Y	97.2	Very high	95.5	Very high	23 Å²	23	29 Å²	29	9%	0.09	13%	0.127	C	C	.	.	H	α-helix	trans	-64	-42.4	172.9	-89.9	-79.8	0	0	0	111.4	I481 L482 A487 D488 D489 Y596 A597 V600 M612 A615	I481-Y485 HydrophobicContact CG2-CD2 3.81Å; I481-Y485 HydrophobicContact CG2-CE2 3.98Å; I481-Y485 PolarHBondContact O-N 3.16Å; L482-Y485 PolarHBondContact O-N 2.85Å; Y485-A487 PolarHBondContact O-N 3.12Å; Y485-D488 PolarHBondContact O-N 3.25Å; Y485-D489 WeakPolarHBondContact O-CB 3.32Å; Y485-D489 PolarHBondContact O-N 3.47Å; Y485-Y596 AromaticContact CD1-CE2 3.8Å; Y485-Y596 HydrophobicContact CD1-CE2 3.8Å; Y485-Y596 AromaticContact CD2-CD2 3.76Å; Y485-Y596 HydrophobicContact CD2-CD2 3.76Å; Y485-Y596 AromaticContact CD2-CE2 3.83Å; Y485-Y596 HydrophobicContact CD2-CE2 3.83Å; Y485-Y596 HydrophobicContact CE1-CD2 4.41Å; Y485-Y596 AromaticContact CE1-CE2 3.62Å; Y485-Y596 HydrophobicContact CE1-CE2 3.62Å; Y485-Y596 AromaticContact CE2-CD2 3.64Å; Y485-Y596 HydrophobicContact CE2-CD2 3.64Å; Y485-Y596 AromaticContact CE2-CE2 3.7Å; Y485-Y596 HydrophobicContact CE2-CE2 3.7Å; Y485-Y596 HydrophobicContact CG-CD2 4.24Å; Y485-Y596 AromaticContact CG-CE2 3.89Å; Y485-Y596 HydrophobicContact CG-CE2 3.89Å; Y485-Y596 AromaticContact CZ-CD2 3.99Å; Y485-Y596 AromaticContact CZ-CE2 3.59Å; Y485-A597 WeakPolarHBondContact OH-CB 3.47Å; Y485-V600 HydrophobicContact CE2-CG2 3.96Å; Y485-M612 HydrophobicContact CD1-CE 4.01Å; Y485-M612 HydrophobicContact CE1-CE 3.47Å; Y485-M612 VanDerWaalsContact CE1-CE 3.47Å; Y485-M612 HydrophobicContact CE1-SD 4.11Å; Y485-M612 HydrophobicContact CE2-CE 4.3Å; Y485-M612 HydrophobicContact CE2-SD 4.13Å; Y485-M612 PolarHBondContact OH-SD 3Å; Y485-M612 VanDerWaalsContact OH-SD 3.33Å; Y485-A615 HydrophobicContact CD2-CB 3.69Å; Y485-A615 HydrophobicContact CE2-CB 4.22Å; Y485-A615 HydrophobicContact CG-CB 3.94Å
486	A	97.2	Very high	95.1	Very high	11 Å²	11	29.7 Å²	29.7	9%	0.091	13%	0.132	C	C	.	.	H	α-helix	trans	-57.5	-48	176.4	0	0	0	0	0	113.1	L482 W490 V618 T622	L482-A486 VanDerWaalsContact O-CB 3.31Å; L482-A486 WeakPolarHBondContact O-CB 3.26Å; L482-A486 PolarHBondContact O-N 3.3Å; A486-W490 WeakPolarHBondContact O-CB 3.07Å; A486-W490 PolarHBondContact O-N 3.29Å; A486-V618 HydrophobicContact CB-CG1 4.03Å; A486-T622 VanDerWaalsContact CA-OG1 3.31Å; A486-T622 WeakPolarHBondContact CA-OG1 3.04Å; A486-T622 HydrophobicContact CB-CG2 4.03Å; A486-T622 PolarHBondContact O-OG1 3.49Å; A486-T622 VanDerWaalsContact O-OG1 3.11Å
487	A	97.3	Very high	94.6	Very high	4 Å²	4	21.8 Å²	21.8	3%	0.033	10%	0.104	C	C	.	.	H	α-helix	trans	-70	-38.5	179.1	0	0	0	0	0	112.8	F483 Y485 T491 F559 S655 Q656 A659	F483-A487 WeakPolarHBondContact O-CB 3.4Å; F483-A487 PolarHBondContact O-N 3.05Å; Y485-A487 PolarHBondContact O-N 3.12Å; A487-T491 PolarHBondContact O-N 2.89Å; A487-T491 PolarHBondContact O-OG1 2.91Å; A487-F559 HydrophobicContact CB-CE1 4.33Å; A487-S655 WeakPolarHBondContact CB-O 3.44Å; A487-Q656 PolarHBondContact O-NE2 3.22Å; A487-Q656 PolarHBondContact O-OE1 2.72Å; A487-A659 HydrophobicContact CB-CB 3.38Å
488	D	97	Very high	94.3	Very high	11 Å²	11	21 Å²	21	6%	0.059	10%	0.099	C	C	.	.	H	α-helix	trans	-63.3	-44.7	178	-170.7	49.2	0	0	0	111.8	T484 Y485 T491 F492 R525 F559 K562 S589 Y596	T484-D488 WeakPolarHBondContact O-CB 3.48Å; T484-D488 PolarHBondContact O-N 3Å; Y485-D488 PolarHBondContact O-N 3.25Å; D488-T491 PolarHBondContact O-N 3.4Å; D488-T491 PolarHBondContact O-OG1 3.35Å; D488-F492 VanDerWaalsContact O-CB 3.24Å; D488-F492 WeakPolarHBondContact O-CB 3.28Å; D488-F492 PolarHBondContact O-N 3.07Å; D488-R525 IonicContact OD1-CZ 3.31Å; D488-R525 IonicContact OD1-NH1 3.9Å; D488-R525 PolarHBondContact OD1-NH1 3.41Å; D488-R525 IonicContact OD1-NH2 3.12Å; D488-R525 IonicContact OD2-CZ 2.86Å; D488-R525 IonicContact OD2-NH1 3.19Å; D488-R525 PolarHBondContact OD2-NH1 3.12Å; D488-R525 IonicContact OD2-NH2 2.67Å; D488-R525 PolarHBondContact OD2-NH2 2.74Å; D488-F559 HydrophobicContact CB-CE1 4.01Å; D488-F559 HydrophobicContact CB-CZ 4.2Å; D488-K562 IonicContact OD1-NZ 3.92Å; D488-K562 PolarHBondContact OD1-NZ 3.35Å; D488-S589 PolarHBondContact OD1-OG 3.31Å; D488-Y596 PolarHBondContact OD2-OH 3.1Å
489	D	94.8	Very high	94.1	Very high	36 Å²	36	20.8 Å²	20.8	19%	0.193	10%	0.098	C	C	.	.	H	α-helix	trans	-69.9	-43.2	-178.7	-160.3	111.4	0	0	0	112.5	Y485 T491 F492 Q493 S619 G623	Y485-D489 WeakPolarHBondContact O-CB 3.32Å; Y485-D489 PolarHBondContact O-N 3.47Å; D489-T491 PolarHBondContact O-N 3Å; D489-T491 VanDerWaalsContact O-N 3.16Å; D489-F492 PolarHBondContact O-N 2.94Å; D489-F492 VanDerWaalsContact O-N 3.17Å; D489-Q493 WeakPolarHBondContact O-CB 3.44Å; D489-Q493 PolarHBondContact O-N 3.43Å; D489-S619 PolarHBondContact OD1-OG 3.34Å; D489-G623 WeakPolarHBondContact OD2-CA 3.4Å
490	W	95.5	Very high	93.7	Very high	38 Å²	38	16.3 Å²	16.3	14%	0.144	8%	0.081	C	C	.	.	H	α-helix	trans	-47.9	-47.7	173.3	179.7	-63.8	0	0	0	112	A486 I494 T622 L625 S626 I629	A486-W490 WeakPolarHBondContact O-CB 3.07Å; A486-W490 PolarHBondContact O-N 3.29Å; W490-I494 WeakPolarHBondContact O-CG1 3.41Å; W490-I494 PolarHBondContact O-N 3.08Å; W490-T622 HydrophobicContact CE3-CG2 4.34Å; W490-L625 HydrophobicContact CZ3-CD2 4.26Å; W490-L625 HydrophobicContact CZ3-CG 4.36Å; W490-S626 VanDerWaalsContact CD2-CB 3.44Å; W490-S626 VanDerWaalsContact CG-CB 3.43Å; W490-S626 WeakPolarHBondContact O-CB 3.36Å; W490-S626 PolarHBondContact O-OG 3.43Å; W490-I629 HydrophobicContact CH2-CD1 3.65Å; W490-I629 HydrophobicContact CZ2-CD1 4.36Å; W490-I629 HydrophobicContact CZ3-CD1 4.41Å
491	T	96.3	Very high	93.2	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-80.5	-38.4	-179.1	37.1	0	0	0	0	112.6	A487 D488 D489 Q493 I494 S495 K562 F566 A652 Q656	A487-T491 PolarHBondContact O-N 2.89Å; A487-T491 PolarHBondContact O-OG1 2.91Å; D488-T491 PolarHBondContact O-N 3.4Å; D488-T491 PolarHBondContact O-OG1 3.35Å; D489-T491 PolarHBondContact O-N 3Å; D489-T491 VanDerWaalsContact O-N 3.16Å; T491-Q493 VanDerWaalsContact C-N 3.33Å; T491-Q493 PolarHBondContact O-N 2.88Å; T491-I494 PolarHBondContact O-N 2.87Å; T491-S495 WeakPolarHBondContact O-CB 3.32Å; T491-S495 PolarHBondContact O-N 3.38Å; T491-S495 PolarHBondContact O-OG 2.81Å; T491-K562 WeakPolarHBondContact OG1-CE 3.28Å; T491-K562 PolarHBondContact OG1-NZ 2.97Å; T491-F566 HydrophobicContact CG2-CD1 4.11Å; T491-F566 HydrophobicContact CG2-CD2 4.32Å; T491-F566 HydrophobicContact CG2-CE1 3.72Å; T491-F566 HydrophobicContact CG2-CE2 3.95Å; T491-F566 HydrophobicContact CG2-CG 4.39Å; T491-F566 HydrophobicContact CG2-CZ 3.63Å; T491-A652 HydrophobicContact CG2-CB 3.83Å; T491-A652 WeakPolarHBondContact CG2-O 3.32Å; T491-Q656 HydrophobicContact CG2-CG 4.06Å; T491-Q656 PolarHBondContact OG1-NE2 3.43Å; T491-Q656 PolarHBondContact OG1-OE1 3.39Å
492	F	93.8	Very high	93.1	Very high	19 Å²	19	16.7 Å²	16.7	8%	0.083	8%	0.083	C	C	.	.	H	α-helix	trans	-59.2	-43.6	174.8	-178.3	-94.9	0	0	0	111.7	V390 P394 D488 D489 S495 S496 F522	V390-F492 HydrophobicContact CG1-CE1 4.35Å; V390-F492 HydrophobicContact CG1-CE2 4.43Å; V390-F492 HydrophobicContact CG1-CZ 3.98Å; V390-F492 WeakPolarHBondContact O-CZ 3.34Å; P394-F492 HydrophobicContact CG-CZ 4.11Å; D488-F492 VanDerWaalsContact O-CB 3.24Å; D488-F492 WeakPolarHBondContact O-CB 3.28Å; D488-F492 PolarHBondContact O-N 3.07Å; D489-F492 PolarHBondContact O-N 2.94Å; D489-F492 VanDerWaalsContact O-N 3.17Å; F492-S495 CarbonylContact O-C 3.56Å; F492-S495 WeakPolarHBondContact O-CA 3.35Å; F492-S495 WeakPolarHBondContact O-CB 3.39Å; F492-S495 PolarHBondContact O-N 3.2Å; F492-S495 VanDerWaalsContact O-N 3.15Å; F492-S496 WeakPolarHBondContact O-CB 3.29Å; F492-S496 PolarHBondContact O-N 3.23Å; F492-F522 HydrophobicContact CD2-CE1 4.43Å; F492-F522 HydrophobicContact CE2-CD1 4.27Å; F492-F522 AromaticContact CE2-CE1 3.83Å; F492-F522 HydrophobicContact CE2-CE1 3.83Å; F492-F522 HydrophobicContact CZ-CE1 4.18Å
493	Q	91.3	Very high	92.9	Very high	21 Å²	21	15.6 Å²	15.6	10%	0.098	8%	0.077	C	C	.	.	H	α-helix	trans	-72	-35.3	179.6	-163.9	69.8	-13.1	0	0	112.4	D489 T491 S495 S496 V497 G623 T627	D489-Q493 WeakPolarHBondContact O-CB 3.44Å; D489-Q493 PolarHBondContact O-N 3.43Å; T491-Q493 VanDerWaalsContact C-N 3.33Å; T491-Q493 PolarHBondContact O-N 2.88Å; Q493-S495 VanDerWaalsContact C-N 3.32Å; Q493-S496 PolarHBondContact O-N 2.65Å; Q493-V497 HydrophobicContact CG-CG2 4.19Å; Q493-V497 WeakPolarHBondContact O-CB 3.3Å; Q493-V497 PolarHBondContact O-N 3.06Å; Q493-G623 WeakPolarHBondContact CG-O 3.41Å; Q493-T627 HydrophobicContact CB-CG2 4.49Å; Q493-T627 HydrophobicContact CG-CG2 3.62Å
494	I	92.7	Very high	92.6	Very high	4 Å²	4	12.8 Å²	12.8	2%	0.021	7%	0.065	C	C	.	.	I	π-helix	trans	-60.3	-42.6	166.4	-78.8	173	0	0	0	110.7	W490 T491 C498 M499 F566 A652	W490-I494 WeakPolarHBondContact O-CG1 3.41Å; W490-I494 PolarHBondContact O-N 3.08Å; T491-I494 PolarHBondContact O-N 2.87Å; I494-C498 HydrophobicContact CG2-CB 4.31Å; I494-C498 WeakPolarHBondContact O-CA 3.32Å; I494-C498 WeakPolarHBondContact O-CB 3.48Å; I494-C498 PolarHBondContact O-N 2.95Å; I494-C498 VanDerWaalsContact O-N 3.08Å; I494-M499 HydrophobicContact CG2-CE 3.91Å; I494-M499 WeakPolarHBondContact O-CG 3.29Å; I494-M499 PolarHBondContact O-N 3.46Å; I494-F566 HydrophobicContact CG2-CE1 4.19Å; I494-A652 HydrophobicContact CD1-CB 3.82Å
495	S	93.4	Very high	92.3	Very high	1 Å²	1	15.2 Å²	15.2	1%	0.007	8%	0.076	C	C	.	.	I	π-helix	trans	-67	-33.6	177.6	-62.1	0	0	0	0	114	T491 F492 Q493 M499 L586	T491-S495 WeakPolarHBondContact O-CB 3.32Å; T491-S495 PolarHBondContact O-N 3.38Å; T491-S495 PolarHBondContact O-OG 2.81Å; F492-S495 CarbonylContact O-C 3.56Å; F492-S495 WeakPolarHBondContact O-CA 3.35Å; F492-S495 WeakPolarHBondContact O-CB 3.39Å; F492-S495 PolarHBondContact O-N 3.2Å; F492-S495 VanDerWaalsContact O-N 3.15Å; Q493-S495 VanDerWaalsContact C-N 3.32Å; S495-M499 WeakPolarHBondContact O-CB 3.35Å; S495-L586 WeakPolarHBondContact OG-CD1 3.19Å
496	S	86.7	Confident	92.1	Very high	23 Å²	23	15.5 Å²	15.5	16%	0.161	8%	0.079	C	C	.	.	I	π-helix	trans	-83.1	-41.8	-179.5	-166.3	0	0	0	0	113.4	F492 Q493	F492-S496 WeakPolarHBondContact O-CB 3.29Å; F492-S496 PolarHBondContact O-N 3.23Å; Q493-S496 PolarHBondContact O-N 2.65Å
497	V	83.9	Confident	92	Very high	14 Å²	14	17 Å²	17	9%	0.085	8%	0.083	C	C	.	.	I	π-helix	trans	-103.1	-55.7	-171	-172.1	0	0	0	0	111.3	P279 Q493 T627	P279-V497 HydrophobicContact CG-CG1 3.53Å; Q493-V497 HydrophobicContact CG-CG2 4.19Å; Q493-V497 WeakPolarHBondContact O-CB 3.3Å; Q493-V497 PolarHBondContact O-N 3.06Å; V497-T627 HydrophobicContact CB-CG2 4.22Å; V497-T627 HydrophobicContact CG2-CG2 4.49Å
498	C	89.7	Confident	91.7	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	12%	0.119	C	C	.	.	I	π-helix	trans	-73.2	-31.4	-172.2	-59.9	0	0	0	0	113	M278 I494 Q500 S501 F502 W645	M278-C498 HydrophobicContact CE-CB 4.46Å; I494-C498 HydrophobicContact CG2-CB 4.31Å; I494-C498 WeakPolarHBondContact O-CA 3.32Å; I494-C498 WeakPolarHBondContact O-CB 3.48Å; I494-C498 PolarHBondContact O-N 2.95Å; I494-C498 VanDerWaalsContact O-N 3.08Å; C498-Q500 VanDerWaalsContact C-N 3.27Å; C498-Q500 PolarHBondContact O-N 3.04Å; C498-S501 PolarHBondContact O-N 2.63Å; C498-S501 VanDerWaalsContact O-N 3.15Å; C498-F502 PolarHBondContact O-N 3.47Å; C498-W645 HydrophobicContact CB-CH2 3.89Å; C498-W645 HydrophobicContact CB-CZ3 3.98Å; C498-W645 VanDerWaalsContact O-CH2 3.22Å; C498-W645 WeakPolarHBondContact O-CH2 3.48Å
499	M	90.8	Very high	91.3	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-64.4	-27.1	-178.5	-69.7	-67.1	106.1	0	0	114	I494 S495 S501 F502 Y503 L518 L569 L582 W645 L649	I494-M499 HydrophobicContact CG2-CE 3.91Å; I494-M499 WeakPolarHBondContact O-CG 3.29Å; I494-M499 PolarHBondContact O-N 3.46Å; S495-M499 WeakPolarHBondContact O-CB 3.35Å; M499-S501 VanDerWaalsContact C-N 3.3Å; M499-S501 PolarHBondContact O-N 3.18Å; M499-F502 HydrophobicContact CE-CB 3.96Å; M499-F502 HydrophobicContact CE-CD1 4.26Å; M499-F502 HydrophobicContact CE-CG 4.08Å; M499-F502 PolarHBondContact O-N 3.32Å; M499-F502 HydrophobicContact SD-CB 4.15Å; M499-F502 HydrophobicContact SD-CD1 3.72Å; M499-F502 HydrophobicContact SD-CE1 4.41Å; M499-F502 HydrophobicContact SD-CG 4.12Å; M499-Y503 VanDerWaalsContact O-CD2 3.28Å; M499-Y503 WeakPolarHBondContact O-CD2 3.37Å; M499-Y503 PolarHBondContact O-N 3.41Å; M499-Y503 VanDerWaalsContact O-N 3.12Å; M499-L518 HydrophobicContact CB-CD1 4.49Å; M499-L518 HydrophobicContact CB-CD2 3.7Å; M499-L569 HydrophobicContact SD-CD2 4.06Å; M499-L582 HydrophobicContact CB-CD2 4.38Å; M499-L582 HydrophobicContact CG-CD2 3.84Å; M499-L582 HydrophobicContact SD-CD2 4.08Å; M499-W645 HydrophobicContact CE-CE3 4.42Å; M499-W645 HydrophobicContact CE-CZ3 4.03Å; M499-L649 HydrophobicContact CE-CD2 3.93Å
500	Q	87.8	Confident	91	Very high	12 Å²	12	26.1 Å²	26.1	6%	0.056	13%	0.131	C	C	.	.	H	α-helix	trans	-58.7	-45.6	173.6	-67	-177	21	0	0	110.8	C498 Q504 L518	C498-Q500 VanDerWaalsContact C-N 3.27Å; C498-Q500 PolarHBondContact O-N 3.04Å; Q500-Q504 VanDerWaalsContact O-CD 3.31Å; Q500-Q504 WeakPolarHBondContact O-CG 3.33Å; Q500-Q504 PolarHBondContact O-N 3.47Å; Q500-L518 HydrophobicContact CB-CD1 4.35Å; Q500-L518 HydrophobicContact CG-CD1 3.45Å; Q500-L518 VanDerWaalsContact CG-CD1 3.45Å
501	S	86.8	Confident	90.3	Very high	2 Å²	2	26.5 Å²	26.5	1%	0.014	14%	0.138	C	C	.	.	H	α-helix	trans	-71	-34.9	175.1	-54.4	0	0	0	0	112.9	M278 C498 M499 Y503 Q504 Q505	M278-S501 WeakPolarHBondContact CA-OG 3.35Å; C498-S501 PolarHBondContact O-N 2.63Å; C498-S501 VanDerWaalsContact O-N 3.15Å; M499-S501 VanDerWaalsContact C-N 3.3Å; M499-S501 PolarHBondContact O-N 3.18Å; S501-Y503 PolarHBondContact O-N 3.31Å; S501-Q504 PolarHBondContact O-N 3.44Å; S501-Q505 WeakPolarHBondContact O-CB 3.48Å; S501-Q505 WeakPolarHBondContact O-CG 3.42Å; S501-Q505 PolarHBondContact O-N 3.31Å
502	F	92.7	Very high	89.6	Confident	6 Å²	6	32.6 Å²	32.6	3%	0.026	17%	0.166	C	C	.	.	H	α-helix	trans	-57.9	-48.6	176.5	174.8	-111.2	0	0	0	112.4	C498 M499 Q504 Q505 I506 Y507 L569 A578 W645 L649	C498-F502 PolarHBondContact O-N 3.47Å; M499-F502 HydrophobicContact CE-CB 3.96Å; M499-F502 HydrophobicContact CE-CD1 4.26Å; M499-F502 HydrophobicContact CE-CG 4.08Å; M499-F502 PolarHBondContact O-N 3.32Å; M499-F502 HydrophobicContact SD-CB 4.15Å; M499-F502 HydrophobicContact SD-CD1 3.72Å; M499-F502 HydrophobicContact SD-CE1 4.41Å; M499-F502 HydrophobicContact SD-CG 4.12Å; F502-Q504 PolarHBondContact O-N 3.01Å; F502-Q505 PolarHBondContact O-N 3.41Å; F502-I506 HydrophobicContact CD2-CB 4.41Å; F502-I506 HydrophobicContact CD2-CG1 3.62Å; F502-I506 HydrophobicContact CE2-CB 4.31Å; F502-I506 HydrophobicContact CE2-CG1 3.67Å; F502-I506 HydrophobicContact CE2-CG2 4.49Å; F502-I506 HydrophobicContact CG-CG1 4.47Å; F502-I506 VanDerWaalsContact O-CB 3.3Å; F502-I506 WeakPolarHBondContact O-CB 3.48Å; F502-I506 WeakPolarHBondContact O-CG1 3.31Å; F502-I506 PolarHBondContact O-N 2.89Å; F502-Y507 AromaticContact CE1-CE2 3.9Å; F502-Y507 HydrophobicContact CE1-CE2 3.9Å; F502-Y507 HydrophobicContact CZ-CE2 4.23Å; F502-L569 HydrophobicContact CE1-CD1 4.05Å; F502-L569 HydrophobicContact CE1-CG 4.39Å; F502-L569 HydrophobicContact CZ-CD1 4.47Å; F502-A578 HydrophobicContact CE1-CB 4.24Å; F502-W645 HydrophobicContact CB-CD2 4.24Å; F502-W645 HydrophobicContact CB-CE3 4.11Å; F502-W645 HydrophobicContact CB-CH2 3.95Å; F502-W645 HydrophobicContact CB-CZ2 4.06Å; F502-W645 HydrophobicContact CB-CZ3 3.97Å; F502-W645 HydrophobicContact CD2-CB 4.02Å; F502-W645 AromaticContact CD2-CD2 3.59Å; F502-W645 HydrophobicContact CD2-CD2 3.59Å; F502-W645 AromaticContact CD2-CE3 3.78Å; F502-W645 HydrophobicContact CD2-CE3 3.78Å; F502-W645 AromaticContact CD2-CG 3.7Å; F502-W645 HydrophobicContact CD2-CG 3.7Å; F502-W645 HydrophobicContact CD2-CZ3 4.48Å; F502-W645 HydrophobicContact CE2-CB 4.04Å; F502-W645 HydrophobicContact CE2-CD2 4.47Å; F502-W645 HydrophobicContact CE2-CG 4.22Å; F502-W645 HydrophobicContact CG-CD2 4.37Å; F502-W645 HydrophobicContact CG-CE3 4.31Å; F502-L649 HydrophobicContact CE2-CD1 4.26Å; F502-L649 HydrophobicContact CZ-CD1 4.39Å
503	Y	93.1	Very high	89.3	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-65.8	-39.8	-178.2	-81.9	-113.1	0	0	0	112.1	M499 S501 Y507 N508 T514 F517 L518 E575 A578 T579 L582	M499-Y503 VanDerWaalsContact O-CD2 3.28Å; M499-Y503 WeakPolarHBondContact O-CD2 3.37Å; M499-Y503 PolarHBondContact O-N 3.41Å; M499-Y503 VanDerWaalsContact O-N 3.12Å; S501-Y503 PolarHBondContact O-N 3.31Å; Y503-Y507 HydrophobicContact CD1-CD2 4.36Å; Y503-Y507 WeakPolarHBondContact O-CB 3.37Å; Y503-Y507 PolarHBondContact O-N 3.13Å; Y503-Y507 VanDerWaalsContact O-N 3.09Å; Y503-N508 PolarHBondContact O-N 3.18Å; Y503-T514 HydrophobicContact CG-CG2 4.42Å; Y503-F517 HydrophobicContact CD1-CB 4.33Å; Y503-F517 HydrophobicContact CD1-CD2 4.23Å; Y503-F517 HydrophobicContact CE1-CB 3.89Å; Y503-F517 HydrophobicContact CE1-CD2 4.28Å; Y503-F517 HydrophobicContact CE1-CG 4.19Å; Y503-L518 HydrophobicContact CD2-CD2 4.41Å; Y503-L518 HydrophobicContact CE2-CD2 4.02Å; Y503-E575 HydrophobicContact CD1-CB 4.03Å; Y503-E575 HydrophobicContact CE1-CB 4.1Å; Y503-A578 HydrophobicContact CE1-CB 4.28Å; Y503-A578 PolarHBondContact OH-O 3.1Å; Y503-T579 WeakPolarHBondContact OH-CA 3.28Å; Y503-T579 PolarHBondContact OH-N 3.47Å; Y503-T579 PolarHBondContact OH-OG1 2.95Å; Y503-L582 HydrophobicContact CE2-CD2 4.45Å
504	Q	88.7	Confident	89.1	Confident	43 Å²	43	35.4 Å²	35.4	20%	0.201	18%	0.175	C	C	.	.	H	α-helix	trans	-65.2	-48.1	174.9	-68.7	165.5	-3.7	0	0	111.6	Q500 S501 F502 N508 V509	Q500-Q504 VanDerWaalsContact O-CD 3.31Å; Q500-Q504 WeakPolarHBondContact O-CG 3.33Å; Q500-Q504 PolarHBondContact O-N 3.47Å; S501-Q504 PolarHBondContact O-N 3.44Å; F502-Q504 PolarHBondContact O-N 3.01Å; Q504-N508 WeakPolarHBondContact O-CA 3.36Å; Q504-N508 PolarHBondContact O-N 3.06Å; Q504-N508 VanDerWaalsContact O-N 3.09Å; Q504-N508 PolarHBondContact O-OD1 2.95Å; Q504-V509 WeakPolarHBondContact CG-O 3.31Å
505	Q	91.2	Very high	88.7	Confident	51 Å²	51	36.6 Å²	36.6	24%	0.238	18%	0.182	C	C	.	.	H	α-helix	trans	-76.2	-29.3	-173.9	-72.7	178.7	2.6	0	0	114.2	S501 F502 H635 L641	S501-Q505 WeakPolarHBondContact O-CB 3.48Å; S501-Q505 WeakPolarHBondContact O-CG 3.42Å; S501-Q505 PolarHBondContact O-N 3.31Å; F502-Q505 PolarHBondContact O-N 3.41Å; Q505-H635 PolarHBondContact NE2-CE1 2.94Å; Q505-H635 VanDerWaalsContact NE2-CE1 3.32Å; Q505-H635 PolarHBondContact NE2-NE2 2.87Å; Q505-H635 VanDerWaalsContact NE2-NE2 3.16Å; Q505-L641 HydrophobicContact CB-CD1 4.41Å; Q505-L641 HydrophobicContact CB-CD2 4.15Å; Q505-L641 WeakPolarHBondContact O-CD2 3.15Å
506	I	94.3	Very high	88.6	Confident	29 Å²	29	42.4 Å²	42.4	15%	0.149	21%	0.207	C	C	.	.	H	α-helix	trans	-100.1	-34	-175.5	-60.6	-54.3	0	0	0	112.9	F502 L641 K642 W645	F502-I506 HydrophobicContact CD2-CB 4.41Å; F502-I506 HydrophobicContact CD2-CG1 3.62Å; F502-I506 HydrophobicContact CE2-CB 4.31Å; F502-I506 HydrophobicContact CE2-CG1 3.67Å; F502-I506 HydrophobicContact CE2-CG2 4.49Å; F502-I506 HydrophobicContact CG-CG1 4.47Å; F502-I506 VanDerWaalsContact O-CB 3.3Å; F502-I506 WeakPolarHBondContact O-CB 3.48Å; F502-I506 WeakPolarHBondContact O-CG1 3.31Å; F502-I506 PolarHBondContact O-N 2.89Å; I506-L641 HydrophobicContact CD1-CG 4.06Å; I506-K642 HydrophobicContact CD1-CG 3.92Å; I506-W645 HydrophobicContact CD1-CG 4.38Å; I506-W645 HydrophobicContact CG1-CG 4.38Å
507	Y	93.9	Very high	88.8	Confident	43 Å²	43	42.1 Å²	42.1	17%	0.169	20%	0.203	C	C	.	.	H	α-helix	trans	-117.9	-0.5	-175.3	-52.6	-64.6	0	0	0	113.8	F502 Y503 V509 A572 S574 E575 A578	F502-Y507 AromaticContact CE1-CE2 3.9Å; F502-Y507 HydrophobicContact CE1-CE2 3.9Å; F502-Y507 HydrophobicContact CZ-CE2 4.23Å; Y503-Y507 HydrophobicContact CD1-CD2 4.36Å; Y503-Y507 WeakPolarHBondContact O-CB 3.37Å; Y503-Y507 PolarHBondContact O-N 3.13Å; Y503-Y507 VanDerWaalsContact O-N 3.09Å; Y507-V509 PolarHBondContact O-N 2.95Å; Y507-A572 WeakPolarHBondContact OH-CB 3.41Å; Y507-A572 PolarHBondContact OH-O 3.46Å; Y507-S574 VanDerWaalsContact CE1-C 3.49Å; Y507-E575 HydrophobicContact CD2-CB 3.83Å; Y507-E575 HydrophobicContact CE2-CB 4.45Å; Y507-E575 HydrophobicContact CG-CB 3.92Å; Y507-A578 HydrophobicContact CE2-CB 3.79Å
508	N	90.7	Very high	89.1	Confident	149 Å²	149	41.6 Å²	41.6	80%	0.797	20%	0.2	S	C	*	.			trans	53.7	33.6	-176.8	-62.3	-39.3	0	0	0	113.6	Y503 Q504	Y503-N508 PolarHBondContact O-N 3.18Å; Q504-N508 WeakPolarHBondContact O-CA 3.36Å; Q504-N508 PolarHBondContact O-N 3.06Å; Q504-N508 VanDerWaalsContact O-N 3.09Å; Q504-N508 PolarHBondContact O-OD1 2.95Å
509	V	89	Confident	89.2	Confident	9 Å²	9	42.8 Å²	42.8	6%	0.055	21%	0.208	C	C	.	.			trans	-81	140.6	179.2	-179.4	0	0	0	0	110.3	Q504 Y507 R513 F517 E575	Q504-V509 WeakPolarHBondContact CG-O 3.31Å; Y507-V509 PolarHBondContact O-N 2.95Å; V509-R513 HydrophobicContact CG1-CB 3.76Å; V509-R513 HydrophobicContact CG1-CG 3.9Å; V509-F517 HydrophobicContact CG1-CD2 4.3Å; V509-F517 HydrophobicContact CG1-CE2 4.24Å; V509-E575 HydrophobicContact CG2-CB 4.04Å; V509-E575 HydrophobicContact CG2-CG 4.03Å
510	D	88	Confident	89.4	Confident	85 Å²	85	47 Å²	47	46%	0.455	23%	0.227	S	C	.	.			trans	-68.7	167.8	177.5	63.9	-81.2	0	0	0	113.2	E512 R513 T514	D510-E512 PolarHBondContact OD2-N 3.3Å; D510-E512 VanDerWaalsContact OD2-N 3.16Å; D510-R513 WeakPolarHBondContact OD1-CB 3.23Å; D510-R513 VanDerWaalsContact OD2-CB 3.27Å; D510-R513 WeakPolarHBondContact OD2-CB 3.34Å; D510-R513 PolarHBondContact OD2-N 3.09Å; D510-T514 WeakPolarHBondContact O-CB 3.18Å; D510-T514 PolarHBondContact O-N 2.8Å; D510-T514 PolarHBondContact O-OG1 3.37Å
511	V	80.8	Confident	89.8	Confident	46 Å²	46	46.6 Å²	46.6	28%	0.279	23%	0.225	S	C	.	.	H	α-helix	trans	-64.2	-44.5	-177.6	176.5	0	0	0	0	112.6	H275 T514 I515	H275-V511 HydrophobicContact CB-CG2 4.23Å; H275-V511 WeakPolarHBondContact ND1-CG2 3.12Å; V511-T514 PolarHBondContact O-N 3.25Å; V511-I515 HydrophobicContact CG1-CD1 3.81Å; V511-I515 HydrophobicContact CG1-CG1 4.43Å; V511-I515 WeakPolarHBondContact O-CG1 3.47Å; V511-I515 PolarHBondContact O-N 3.22Å
512	E	81.8	Confident	90.2	Very high	128 Å²	128	46.6 Å²	46.6	60%	0.598	22%	0.224	S	C	*	.	H	α-helix	trans	-67.5	-45.9	-173.1	-166.9	166.1	126.6	0	0	110.3	K406 D510 T514 I515 F516	K406-E512 IonicContact NZ-OE1 2.76Å; K406-E512 IonicContact NZ-OE2 3.2Å; K406-E512 PolarHBondContact NZ-OE2 3.42Å; D510-E512 PolarHBondContact OD2-N 3.3Å; D510-E512 VanDerWaalsContact OD2-N 3.16Å; E512-T514 PolarHBondContact O-N 3.19Å; E512-I515 PolarHBondContact O-N 3.13Å; E512-F516 PolarHBondContact O-N 2.88Å
513	R	87.4	Confident	90.4	Very high	96 Å²	96	49.9 Å²	49.9	36%	0.362	24%	0.242	S	C	.	.	H	α-helix	trans	-68	-31.5	174.3	-164.3	174.8	178.2	-113.6	-5.9	112.7	V509 D510 F516 F517 E575	V509-R513 HydrophobicContact CG1-CB 3.76Å; V509-R513 HydrophobicContact CG1-CG 3.9Å; D510-R513 WeakPolarHBondContact OD1-CB 3.23Å; D510-R513 VanDerWaalsContact OD2-CB 3.27Å; D510-R513 WeakPolarHBondContact OD2-CB 3.34Å; D510-R513 PolarHBondContact OD2-N 3.09Å; R513-F516 PolarHBondContact O-N 3.31Å; R513-F517 HydrophobicContact CG-CD2 4.14Å; R513-F517 HydrophobicContact CG-CE2 3.65Å; R513-F517 HydrophobicContact CG-CZ 4.36Å; R513-F517 WeakPolarHBondContact O-CD2 3.23Å; R513-F517 PolarHBondContact O-N 3.21Å; R513-E575 IonicContact CZ-OE1 2.64Å; R513-E575 IonicContact NH1-OE1 2.72Å; R513-E575 PolarHBondContact NH1-OE1 3Å; R513-E575 IonicContact NH2-OE1 3.19Å; R513-E575 PolarHBondContact NH2-OE1 2.88Å
514	T	87.7	Confident	90.6	Very high	2 Å²	2	50.8 Å²	50.8	1%	0.012	25%	0.248	C	C	.	.	H	α-helix	trans	-66.2	-43.8	172.1	-63.8	0	0	0	0	111.8	Y503 D510 V511 E512 F516 F517 L518	Y503-T514 HydrophobicContact CG-CG2 4.42Å; D510-T514 WeakPolarHBondContact O-CB 3.18Å; D510-T514 PolarHBondContact O-N 2.8Å; D510-T514 PolarHBondContact O-OG1 3.37Å; V511-T514 PolarHBondContact O-N 3.25Å; E512-T514 PolarHBondContact O-N 3.19Å; T514-F516 VanDerWaalsContact C-N 3.32Å; T514-F516 PolarHBondContact O-N 3.04Å; T514-F517 PolarHBondContact O-N 2.69Å; T514-L518 HydrophobicContact CG2-CD1 3.91Å; T514-L518 HydrophobicContact CG2-CG 4.34Å; T514-L518 WeakPolarHBondContact O-CG 3.44Å; T514-L518 PolarHBondContact O-N 2.97Å
515	I	85.3	Confident	91	Very high	30 Å²	30	49.2 Å²	49.2	15%	0.154	24%	0.24	C	C	.	.	H	α-helix	trans	-62.9	-40.5	175.5	-68.1	166.7	0	0	0	110.5	L398 P399 A402 V511 E512 L518 S519	L398-I515 HydrophobicContact CB-CG2 4.27Å; P399-I515 HydrophobicContact CG-CG2 4.25Å; A402-I515 HydrophobicContact CB-CD1 4.44Å; V511-I515 HydrophobicContact CG1-CD1 3.81Å; V511-I515 HydrophobicContact CG1-CG1 4.43Å; V511-I515 WeakPolarHBondContact O-CG1 3.47Å; V511-I515 PolarHBondContact O-N 3.22Å; E512-I515 PolarHBondContact O-N 3.13Å; I515-L518 PolarHBondContact O-N 2.95Å; I515-S519 PolarHBondContact O-N 2.88Å; I515-S519 PolarHBondContact O-OG 3.32Å
516	F	90.1	Very high	91.3	Very high	122 Å²	122	47.2 Å²	47.2	54%	0.535	23%	0.232	S	C	.	.	H	α-helix	trans	-58.2	-49	173.1	178.3	-102.5	0	0	0	112.1	E512 R513 T514 S519 F520	E512-F516 PolarHBondContact O-N 2.88Å; R513-F516 PolarHBondContact O-N 3.31Å; T514-F516 VanDerWaalsContact C-N 3.32Å; T514-F516 PolarHBondContact O-N 3.04Å; F516-S519 WeakPolarHBondContact O-CB 3.45Å; F516-S519 PolarHBondContact O-N 3.27Å; F516-F520 HydrophobicContact CD1-CE2 4.07Å; F516-F520 HydrophobicContact CD2-CE2 4.49Å; F516-F520 AromaticContact CE1-CE2 3.67Å; F516-F520 HydrophobicContact CE1-CE2 3.67Å; F516-F520 HydrophobicContact CE1-CZ 4.11Å; F516-F520 HydrophobicContact CE2-CE2 4.12Å; F516-F520 HydrophobicContact CE2-CZ 4.26Å; F516-F520 HydrophobicContact CG-CE2 4.47Å; F516-F520 AromaticContact CZ-CE2 3.7Å; F516-F520 HydrophobicContact CZ-CE2 3.7Å; F516-F520 AromaticContact CZ-CZ 3.76Å; F516-F520 HydrophobicContact CZ-CZ 3.76Å; F516-F520 VanDerWaalsContact O-CD2 3.28Å; F516-F520 WeakPolarHBondContact O-CD2 3.34Å; F516-F520 WeakPolarHBondContact O-CE2 3.27Å
517	F	91.8	Very high	91.4	Very high	17 Å²	17	50.9 Å²	50.9	8%	0.075	25%	0.25	C	S	.	.	H	α-helix	trans	-62.3	-43.8	176.5	-75.2	-53.1	0	0	0	113.1	Y503 V509 R513 T514 S519 F520 P521 E575 I576 T579	Y503-F517 HydrophobicContact CD1-CB 4.33Å; Y503-F517 HydrophobicContact CD1-CD2 4.23Å; Y503-F517 HydrophobicContact CE1-CB 3.89Å; Y503-F517 HydrophobicContact CE1-CD2 4.28Å; Y503-F517 HydrophobicContact CE1-CG 4.19Å; V509-F517 HydrophobicContact CG1-CD2 4.3Å; V509-F517 HydrophobicContact CG1-CE2 4.24Å; R513-F517 HydrophobicContact CG-CD2 4.14Å; R513-F517 HydrophobicContact CG-CE2 3.65Å; R513-F517 HydrophobicContact CG-CZ 4.36Å; R513-F517 WeakPolarHBondContact O-CD2 3.23Å; R513-F517 PolarHBondContact O-N 3.21Å; T514-F517 PolarHBondContact O-N 2.69Å; F517-S519 PolarHBondContact O-N 2.71Å; F517-F520 PolarHBondContact O-N 3.03Å; F517-P521 WeakPolarHBondContact O-CD 3.3Å; F517-E575 HydrophobicContact CD2-CG 4.17Å; F517-E575 HydrophobicContact CE1-CG 4.35Å; F517-E575 HydrophobicContact CE2-CB 4.15Å; F517-E575 HydrophobicContact CE2-CG 3.35Å; F517-E575 HydrophobicContact CZ-CB 4.49Å; F517-E575 HydrophobicContact CZ-CG 3.47Å; F517-E575 VanDerWaalsContact CZ-CG 3.47Å; F517-I576 HydrophobicContact CE1-CG1 4.2Å; F517-I576 HydrophobicContact CZ-CG1 4.33Å; F517-T579 HydrophobicContact CB-CG2 4.4Å; F517-T579 WeakPolarHBondContact CB-OG1 3.46Å; F517-T579 HydrophobicContact CD1-CG2 4.12Å; F517-T579 WeakPolarHBondContact CD1-OG1 3.44Å; F517-T579 WeakPolarHBondContact CG-OG1 3.27Å; F517-T579 WeakPolarHBondContact O-CG2 3.3Å
518	L	90.2	Very high	91.6	Very high	3 Å²	3	51.7 Å²	51.7	2%	0.016	25%	0.254	C	S	.	.	H	α-helix	trans	-69.8	-15.6	179.9	-65.4	176.4	0	0	0	113.9	M499 Q500 Y503 T514 I515 F520 P521 F522 L582	M499-L518 HydrophobicContact CB-CD1 4.49Å; M499-L518 HydrophobicContact CB-CD2 3.7Å; Q500-L518 HydrophobicContact CB-CD1 4.35Å; Q500-L518 HydrophobicContact CG-CD1 3.45Å; Q500-L518 VanDerWaalsContact CG-CD1 3.45Å; Y503-L518 HydrophobicContact CD2-CD2 4.41Å; Y503-L518 HydrophobicContact CE2-CD2 4.02Å; T514-L518 HydrophobicContact CG2-CD1 3.91Å; T514-L518 HydrophobicContact CG2-CG 4.34Å; T514-L518 WeakPolarHBondContact O-CG 3.44Å; T514-L518 PolarHBondContact O-N 2.97Å; I515-L518 PolarHBondContact O-N 2.95Å; L518-F520 VanDerWaalsContact C-N 3.32Å; L518-F520 PolarHBondContact O-N 3.26Å; L518-P521 WeakPolarHBondContact O-CD 3.46Å; L518-F522 WeakPolarHBondContact O-CD2 3.39Å; L518-L582 HydrophobicContact CD2-CD2 3.96Å
519	S	91.7	Very high	91.9	Very high	25 Å²	25	44.6 Å²	44.6	18%	0.175	22%	0.217	C	C	.	.	H	α-helix	trans	-65.2	-33.8	172.2	-59.4	0	0	0	0	112.2	L395 I515 F516 F517 F522 L523	L395-S519 VanDerWaalsContact CD1-O 3.3Å; L395-S519 WeakPolarHBondContact CD1-O 3.35Å; I515-S519 PolarHBondContact O-N 2.88Å; I515-S519 PolarHBondContact O-OG 3.32Å; F516-S519 WeakPolarHBondContact O-CB 3.45Å; F516-S519 PolarHBondContact O-N 3.27Å; F517-S519 PolarHBondContact O-N 2.71Å; S519-F522 PolarHBondContact O-N 3Å; S519-L523 WeakPolarHBondContact O-CB 3.1Å; S519-L523 PolarHBondContact O-N 3.06Å
520	F	95.4	Very high	92.3	Very high	90 Å²	90	45.4 Å²	45.4	40%	0.395	22%	0.222	S	C	.	.	H	α-helix	trans	-65.9	-43.8	-178.7	-66.6	-91.3	0	0	0	113.6	F516 F517 L518 F522 L523 S524 T579	F516-F520 HydrophobicContact CD1-CE2 4.07Å; F516-F520 HydrophobicContact CD2-CE2 4.49Å; F516-F520 AromaticContact CE1-CE2 3.67Å; F516-F520 HydrophobicContact CE1-CE2 3.67Å; F516-F520 HydrophobicContact CE1-CZ 4.11Å; F516-F520 HydrophobicContact CE2-CE2 4.12Å; F516-F520 HydrophobicContact CE2-CZ 4.26Å; F516-F520 HydrophobicContact CG-CE2 4.47Å; F516-F520 AromaticContact CZ-CE2 3.7Å; F516-F520 HydrophobicContact CZ-CE2 3.7Å; F516-F520 AromaticContact CZ-CZ 3.76Å; F516-F520 HydrophobicContact CZ-CZ 3.76Å; F516-F520 VanDerWaalsContact O-CD2 3.28Å; F516-F520 WeakPolarHBondContact O-CD2 3.34Å; F516-F520 WeakPolarHBondContact O-CE2 3.27Å; F517-F520 PolarHBondContact O-N 3.03Å; L518-F520 VanDerWaalsContact C-N 3.32Å; L518-F520 PolarHBondContact O-N 3.26Å; F520-F522 PolarHBondContact O-N 3.44Å; F520-L523 PolarHBondContact O-N 3.47Å; F520-S524 WeakPolarHBondContact O-CB 3.39Å; F520-S524 PolarHBondContact O-N 2.98Å; F520-T579 HydrophobicContact CB-CG2 3.86Å; F520-T579 HydrophobicContact CD2-CG2 4.18Å; F520-T579 HydrophobicContact CG-CG2 4.26Å
521	P	96.2	Very high	92.7	Very high	2 Å²	2	44.7 Å²	44.7	1%	0.013	22%	0.217	C	C	.	.	H	α-helix	trans	-59.6	-42.4	173	-27.6	32.6	0	0	0	115.3	F517 L518 S524 R525 L582 S583 L586	F517-P521 WeakPolarHBondContact O-CD 3.3Å; L518-P521 WeakPolarHBondContact O-CD 3.46Å; P521-S524 WeakPolarHBondContact O-CB 3.47Å; P521-S524 PolarHBondContact O-N 2.77Å; P521-R525 PolarHBondContact O-N 2.82Å; P521-L582 HydrophobicContact CB-CD2 4.36Å; P521-L582 HydrophobicContact CB-CG 3.96Å; P521-L582 HydrophobicContact CG-CB 4.06Å; P521-L582 HydrophobicContact CG-CD2 3.76Å; P521-L582 HydrophobicContact CG-CG 3.65Å; P521-S583 WeakPolarHBondContact CD-OG 3.15Å; P521-L586 HydrophobicContact CB-CB 4.26Å; P521-L586 HydrophobicContact CB-CD2 3.75Å; P521-L586 HydrophobicContact CB-CG 4.5Å; P521-L586 WeakPolarHBondContact O-CB 3.46Å
522	F	94.8	Very high	93.4	Very high	2 Å²	2	42.5 Å²	42.5	1%	0.009	20%	0.204	C	C	.	.	H	α-helix	trans	-72.3	-33.4	178.2	-65.1	-64	0	0	0	112.4	P394 L395 L398 F492 L518 S519 F520 S526 L586	P394-F522 HydrophobicContact CB-CD1 4Å; P394-F522 HydrophobicContact CB-CD2 3.97Å; P394-F522 HydrophobicContact CB-CE1 4.02Å; P394-F522 HydrophobicContact CB-CE2 4Å; P394-F522 HydrophobicContact CB-CG 3.99Å; P394-F522 HydrophobicContact CB-CZ 4.04Å; P394-F522 HydrophobicContact CG-CD1 4.3Å; P394-F522 HydrophobicContact CG-CE1 4.2Å; L395-F522 HydrophobicContact CB-CB 3.82Å; L395-F522 HydrophobicContact CD1-CB 4.37Å; L398-F522 HydrophobicContact CD1-CE2 4.35Å; F492-F522 HydrophobicContact CD2-CE1 4.43Å; F492-F522 HydrophobicContact CE2-CD1 4.27Å; F492-F522 AromaticContact CE2-CE1 3.83Å; F492-F522 HydrophobicContact CE2-CE1 3.83Å; F492-F522 HydrophobicContact CZ-CE1 4.18Å; L518-F522 WeakPolarHBondContact O-CD2 3.39Å; S519-F522 PolarHBondContact O-N 3Å; F520-F522 PolarHBondContact O-N 3.44Å; F522-S526 VanDerWaalsContact O-CB 3.29Å; F522-S526 WeakPolarHBondContact O-CB 3.25Å; F522-S526 PolarHBondContact O-N 3.24Å; F522-S526 PolarHBondContact O-OG 2.83Å; F522-L586 HydrophobicContact CD1-CD2 3.99Å; F522-L586 HydrophobicContact CE1-CD2 3.94Å
523	L	96.6	Very high	94.1	Very high	76 Å²	76	36.4 Å²	36.4	40%	0.398	18%	0.176	S	C	.	.	H	α-helix	trans	-62.3	-47.4	169.3	179.2	61	0	0	0	111.1	L395 S519 F520 R525 S526 M527	L395-L523 HydrophobicContact CD1-CB 3.91Å; L395-L523 HydrophobicContact CD2-CB 4.21Å; L395-L523 HydrophobicContact CD2-CD1 4.09Å; S519-L523 WeakPolarHBondContact O-CB 3.1Å; S519-L523 PolarHBondContact O-N 3.06Å; F520-L523 PolarHBondContact O-N 3.47Å; L523-R525 PolarHBondContact O-N 3.49Å; L523-S526 PolarHBondContact O-N 3.1Å; L523-S526 VanDerWaalsContact O-N 3.16Å; L523-M527 HydrophobicContact CD1-CG 4.26Å; L523-M527 HydrophobicContact CD1-SD 4.26Å; L523-M527 HydrophobicContact CG-SD 4.24Å; L523-M527 WeakPolarHBondContact O-CG 3.37Å; L523-M527 PolarHBondContact O-N 3.07Å
524	S	97.6	Very high	94.5	Very high	18 Å²	18	34.5 Å²	34.5	13%	0.126	17%	0.172	C	C	.	.	H	α-helix	trans	-56.3	-50.1	177.4	-176.7	0	0	0	0	111.8	F520 P521 S526 M527 F528 S583 G587	F520-S524 WeakPolarHBondContact O-CB 3.39Å; F520-S524 PolarHBondContact O-N 2.98Å; P521-S524 WeakPolarHBondContact O-CB 3.47Å; P521-S524 PolarHBondContact O-N 2.77Å; S524-S526 PolarHBondContact O-N 3Å; S524-M527 PolarHBondContact O-N 3.16Å; S524-F528 WeakPolarHBondContact O-CB 3.11Å; S524-F528 VanDerWaalsContact O-CD2 3.23Å; S524-F528 WeakPolarHBondContact O-CD2 3.49Å; S524-F528 PolarHBondContact O-N 3.04Å; S524-S583 VanDerWaalsContact CB-O 3.29Å; S524-S583 WeakPolarHBondContact CB-O 3.42Å; S524-S583 PolarHBondContact OG-O 3.34Å; S524-G587 WeakPolarHBondContact OG-CA 3.23Å
525	R	97.4	Very high	94.9	Very high	10 Å²	10	40.2 Å²	40.2	4%	0.038	20%	0.197	C	C	.	.	H	α-helix	trans	-60.5	-44.4	175	-168.5	170	168.7	134.6	0.9	111.8	S391 D488 P521 L523 M527 F528 V529 L586 S589	S391-R525 VanDerWaalsContact OG-CD 3.32Å; S391-R525 WeakPolarHBondContact OG-CD 3.27Å; S391-R525 WeakPolarHBondContact OG-CG 3.5Å; S391-R525 PolarHBondContact OG-NE 2.91Å; D488-R525 IonicContact OD1-CZ 3.31Å; D488-R525 IonicContact OD1-NH1 3.9Å; D488-R525 PolarHBondContact OD1-NH1 3.41Å; D488-R525 IonicContact OD1-NH2 3.12Å; D488-R525 IonicContact OD2-CZ 2.86Å; D488-R525 IonicContact OD2-NH1 3.19Å; D488-R525 PolarHBondContact OD2-NH1 3.12Å; D488-R525 IonicContact OD2-NH2 2.67Å; D488-R525 PolarHBondContact OD2-NH2 2.74Å; P521-R525 PolarHBondContact O-N 2.82Å; L523-R525 PolarHBondContact O-N 3.49Å; R525-M527 VanDerWaalsContact C-N 3.27Å; R525-M527 PolarHBondContact O-N 3.17Å; R525-F528 PolarHBondContact O-N 3.47Å; R525-V529 HydrophobicContact CG-CG2 4.14Å; R525-V529 WeakPolarHBondContact O-CG2 3.15Å; R525-V529 PolarHBondContact O-N 3.09Å; R525-L586 HydrophobicContact CB-CB 4.14Å; R525-L586 WeakPolarHBondContact CB-O 3.42Å; R525-L586 WeakPolarHBondContact CG-O 3.36Å; R525-S589 PolarHBondContact NH1-OG 3.38Å
526	S	96.5	Very high	95.4	Very high	10 Å²	10	38.9 Å²	38.9	7%	0.07	19%	0.19	C	C	.	.	H	α-helix	trans	-62.7	-31.1	179.5	-57.8	0	0	0	0	113.3	S391 F522 L523 S524 P530	S391-S526 WeakPolarHBondContact CB-OG 3.26Å; F522-S526 VanDerWaalsContact O-CB 3.29Å; F522-S526 WeakPolarHBondContact O-CB 3.25Å; F522-S526 PolarHBondContact O-N 3.24Å; F522-S526 PolarHBondContact O-OG 2.83Å; L523-S526 PolarHBondContact O-N 3.1Å; L523-S526 VanDerWaalsContact O-N 3.16Å; S524-S526 PolarHBondContact O-N 3Å; S526-P530 WeakPolarHBondContact O-CD 3.37Å; S526-P530 WeakPolarHBondContact O-CG 3.46Å
527	M	97.1	Very high	95.6	Very high	106 Å²	106	33.3 Å²	33.3	52%	0.522	17%	0.166	S	C	.	.	H	α-helix	trans	-78.8	-37.9	172.7	-69.1	-178	72.5	0	0	112.8	L523 S524 R525 P530 I531	L523-M527 HydrophobicContact CD1-CG 4.26Å; L523-M527 HydrophobicContact CD1-SD 4.26Å; L523-M527 HydrophobicContact CG-SD 4.24Å; L523-M527 WeakPolarHBondContact O-CG 3.37Å; L523-M527 PolarHBondContact O-N 3.07Å; S524-M527 PolarHBondContact O-N 3.16Å; R525-M527 VanDerWaalsContact C-N 3.27Å; R525-M527 PolarHBondContact O-N 3.17Å; M527-P530 VanDerWaalsContact O-CD 3.3Å; M527-P530 WeakPolarHBondContact O-CD 3.27Å; M527-P530 WeakPolarHBondContact O-CG 3.2Å; M527-I531 VanDerWaalsContact O-CD1 3.27Å; M527-I531 WeakPolarHBondContact O-CD1 3.29Å; M527-I531 VanDerWaalsContact O-CG1 3.24Å; M527-I531 WeakPolarHBondContact O-CG1 3.46Å
528	F	97.5	Very high	95.7	Very high	59 Å²	59	35.1 Å²	35.1	26%	0.259	18%	0.176	S	C	.	.	H	α-helix	trans	-80.8	-28.8	-173.7	-82.7	-129	0	0	0	113.7	S524 R525 I531 G532 G587 L591	S524-F528 WeakPolarHBondContact O-CB 3.11Å; S524-F528 VanDerWaalsContact O-CD2 3.23Å; S524-F528 WeakPolarHBondContact O-CD2 3.49Å; S524-F528 PolarHBondContact O-N 3.04Å; R525-F528 PolarHBondContact O-N 3.47Å; F528-I531 PolarHBondContact O-N 3.41Å; F528-G532 PolarHBondContact O-N 3.37Å; F528-G587 WeakPolarHBondContact CB-O 3.37Å; F528-G587 WeakPolarHBondContact CD1-O 3.37Å; F528-G587 WeakPolarHBondContact CG-O 3.25Å; F528-L591 HydrophobicContact CB-CG 4.33Å; F528-L591 HydrophobicContact CD1-CD1 3.85Å; F528-L591 HydrophobicContact CD1-CD2 4.47Å; F528-L591 HydrophobicContact CD1-CG 3.88Å; F528-L591 HydrophobicContact CE1-CD1 4.33Å; F528-L591 WeakPolarHBondContact O-CD2 3.41Å
529	V	97.4	Very high	95.9	Very high	1 Å²	1	37.1 Å²	37.1	1%	0.006	19%	0.187	C	C	.	.	H	α-helix	trans	-57.2	-52.7	174	173.9	0	0	0	0	113.6	C384 V387 I388 R525 I531 G532 G533 G590 V593	C384-V529 HydrophobicContact CB-CG1 3.71Å; C384-V529 WeakPolarHBondContact CB-O 3.43Å; C384-V529 WeakPolarHBondContact O-CG1 3.32Å; C384-V529 PolarHBondContact SG-O 2.86Å; C384-V529 VanDerWaalsContact SG-O 3.36Å; V387-V529 HydrophobicContact CG2-CG1 4.35Å; I388-V529 HydrophobicContact CD1-CG1 4.42Å; I388-V529 HydrophobicContact CG1-CB 3.85Å; I388-V529 HydrophobicContact CG1-CG1 3.59Å; R525-V529 HydrophobicContact CG-CG2 4.14Å; R525-V529 WeakPolarHBondContact O-CG2 3.15Å; R525-V529 PolarHBondContact O-N 3.09Å; V529-I531 PolarHBondContact O-N 3.2Å; V529-G532 PolarHBondContact O-N 3.46Å; V529-G533 PolarHBondContact O-N 2.9Å; V529-G533 VanDerWaalsContact O-N 3.13Å; V529-G590 WeakPolarHBondContact CA-O 3.36Å; V529-G590 VanDerWaalsContact CG2-CA 3.42Å; V529-V593 HydrophobicContact CG1-CB 4.4Å; V529-V593 HydrophobicContact CG1-CG1 4.2Å; V529-V593 HydrophobicContact CG2-CB 4.41Å; V529-V593 HydrophobicContact CG2-CG2 3.98Å
530	P	96.3	Very high	95.9	Very high	26 Å²	26	40 Å²	40	17%	0.169	19%	0.194	C	C	.	.	H	α-helix	trans	-66.5	-37.5	178.5	23.3	-29.9	0	0	0	111.9	L385 I388 S526 M527 G532 G533 I534	L385-P530 HydrophobicContact CD2-CB 4.3Å; I388-P530 HydrophobicContact CD1-CB 3.67Å; I388-P530 VanDerWaalsContact CD1-CD 3.48Å; I388-P530 HydrophobicContact CD1-CG 3.66Å; S526-P530 WeakPolarHBondContact O-CD 3.37Å; S526-P530 WeakPolarHBondContact O-CG 3.46Å; M527-P530 VanDerWaalsContact O-CD 3.3Å; M527-P530 WeakPolarHBondContact O-CD 3.27Å; M527-P530 WeakPolarHBondContact O-CG 3.2Å; P530-G532 VanDerWaalsContact C-N 3.3Å; P530-G532 PolarHBondContact O-N 2.86Å; P530-G533 PolarHBondContact O-N 2.99Å; P530-I534 WeakPolarHBondContact O-CB 3.36Å; P530-I534 VanDerWaalsContact O-CG1 3.31Å; P530-I534 WeakPolarHBondContact O-CG1 3.3Å; P530-I534 PolarHBondContact O-N 3.15Å
531	I	96.7	Very high	95.7	Very high	69 Å²	69	39.2 Å²	39.2	35%	0.354	19%	0.193	S	C	.	.	H	α-helix	trans	-58.2	-45.3	174.1	-68.4	171.7	0	0	0	109.9	M527 F528 V529 G533 I534 F535 L591	M527-I531 VanDerWaalsContact O-CD1 3.27Å; M527-I531 WeakPolarHBondContact O-CD1 3.29Å; M527-I531 VanDerWaalsContact O-CG1 3.24Å; M527-I531 WeakPolarHBondContact O-CG1 3.46Å; F528-I531 PolarHBondContact O-N 3.41Å; V529-I531 PolarHBondContact O-N 3.2Å; I531-G533 PolarHBondContact O-N 2.97Å; I531-I534 PolarHBondContact O-N 2.84Å; I531-F535 HydrophobicContact CG2-CD2 3.77Å; I531-F535 HydrophobicContact CG2-CE2 3.93Å; I531-F535 WeakPolarHBondContact O-CB 3.44Å; I531-F535 VanDerWaalsContact O-CD2 3.3Å; I531-F535 WeakPolarHBondContact O-CD2 3.28Å; I531-F535 PolarHBondContact O-N 3.29Å; I531-L591 HydrophobicContact CG2-CD2 4.27Å
532	G	96.4	Very high	95.5	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-57.8	-48.2	176.2	0	0	0	0	0	112.7	F528 V529 P530 F535 A536 L591 A594	F528-G532 PolarHBondContact O-N 3.37Å; V529-G532 PolarHBondContact O-N 3.46Å; P530-G532 VanDerWaalsContact C-N 3.3Å; P530-G532 PolarHBondContact O-N 2.86Å; G532-F535 PolarHBondContact O-N 3.27Å; G532-A536 VanDerWaalsContact O-CB 3.26Å; G532-A536 WeakPolarHBondContact O-CB 3.36Å; G532-A536 PolarHBondContact O-N 3.35Å; G532-L591 VanDerWaalsContact CA-CD2 3.5Å; G532-A594 WeakPolarHBondContact O-CB 3.37Å
533	G	96.1	Very high	95.4	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-61.6	-48	178.4	0	0	0	0	0	112.6	S380 T381 V529 P530 I531 F535 A536 D537	S380-G533 WeakPolarHBondContact CB-O 3.4Å; T381-G533 PolarHBondContact OG1-O 3.46Å; V529-G533 PolarHBondContact O-N 2.9Å; V529-G533 VanDerWaalsContact O-N 3.13Å; P530-G533 PolarHBondContact O-N 2.99Å; I531-G533 PolarHBondContact O-N 2.97Å; G533-F535 PolarHBondContact O-N 3.24Å; G533-A536 PolarHBondContact O-N 3.46Å; G533-D537 PolarHBondContact O-N 2.62Å
534	I	96.2	Very high	95.2	Very high	56 Å²	56	51.4 Å²	51.4	29%	0.287	26%	0.26	S	S	.	.	H	α-helix	trans	-62.4	-44.6	179.3	-70.7	166.5	0	0	0	111.2	F144 T381 P530 I531 L538	F144-I534 HydrophobicContact CE1-CG2 4.01Å; F144-I534 HydrophobicContact CZ-CG2 4.07Å; T381-I534 HydrophobicContact CG2-CG1 4.04Å; P530-I534 WeakPolarHBondContact O-CB 3.36Å; P530-I534 VanDerWaalsContact O-CG1 3.31Å; P530-I534 WeakPolarHBondContact O-CG1 3.3Å; P530-I534 PolarHBondContact O-N 3.15Å; I531-I534 PolarHBondContact O-N 2.84Å; I534-L538 HydrophobicContact CG2-CD1 4.04Å; I534-L538 VanDerWaalsContact O-CB 3.29Å; I534-L538 WeakPolarHBondContact O-CB 3.35Å; I534-L538 VanDerWaalsContact O-CG 3.3Å; I534-L538 WeakPolarHBondContact O-CG 3.45Å; I534-L538 PolarHBondContact O-N 3.2Å
535	F	96	Very high	94.9	Very high	123 Å²	123	53.8 Å²	53.8	54%	0.539	27%	0.271	S	S	.	.	H	α-helix	trans	-71.2	-32.5	178.6	-86.5	-108.4	0	0	0	112.6	I531 G532 G533 L539 F554	I531-F535 HydrophobicContact CG2-CD2 3.77Å; I531-F535 HydrophobicContact CG2-CE2 3.93Å; I531-F535 WeakPolarHBondContact O-CB 3.44Å; I531-F535 VanDerWaalsContact O-CD2 3.3Å; I531-F535 WeakPolarHBondContact O-CD2 3.28Å; I531-F535 PolarHBondContact O-N 3.29Å; G532-F535 PolarHBondContact O-N 3.27Å; G533-F535 PolarHBondContact O-N 3.24Å; F535-L539 WeakPolarHBondContact O-CB 3.11Å; F535-L539 PolarHBondContact O-N 2.92Å; F535-F554 HydrophobicContact CB-CE1 4.28Å; F535-F554 HydrophobicContact CB-CZ 3.86Å
536	A	95.9	Very high	94.7	Very high	1 Å²	1	55.6 Å²	55.6	1%	0.008	29%	0.285	C	S	.	.	H	α-helix	trans	-66	-46.2	174.4	0	0	0	0	0	111.9	G532 G533 L539 R540 I550 F554 A594	G532-A536 VanDerWaalsContact O-CB 3.26Å; G532-A536 WeakPolarHBondContact O-CB 3.36Å; G532-A536 PolarHBondContact O-N 3.35Å; G533-A536 PolarHBondContact O-N 3.46Å; A536-L539 PolarHBondContact O-N 3.26Å; A536-R540 WeakPolarHBondContact O-CB 3.36Å; A536-R540 PolarHBondContact O-N 3.25Å; A536-I550 HydrophobicContact CB-CG2 4Å; A536-F554 HydrophobicContact CB-CD2 4.07Å; A536-F554 HydrophobicContact CB-CE2 3.79Å; A536-F554 HydrophobicContact CB-CZ 4.15Å; A536-A594 HydrophobicContact CB-CB 4.2Å
537	D	94.3	Very high	94.5	Very high	6 Å²	6	58.2 Å²	58.2	3%	0.032	29%	0.294	C	S	.	.	H	α-helix	trans	-67	-42.6	176.1	-69.4	-24.7	0	0	0	111.4	E378 S380 T381 G533 L539 R540 I541	E378-D537 WeakPolarHBondContact CA-OD2 3.42Å; S380-D537 WeakPolarHBondContact CB-OD1 3.1Å; S380-D537 PolarHBondContact N-OD1 3.44Å; S380-D537 VanDerWaalsContact N-OD1 3.12Å; S380-D537 PolarHBondContact N-OD2 2.92Å; S380-D537 PolarHBondContact OG-OD1 3.12Å; T381-D537 WeakPolarHBondContact CB-OD2 3.44Å; T381-D537 PolarHBondContact N-OD2 3.35Å; T381-D537 PolarHBondContact OG1-OD2 3.44Å; G533-D537 PolarHBondContact O-N 2.62Å; D537-L539 VanDerWaalsContact C-N 3.34Å; D537-L539 PolarHBondContact O-N 3.03Å; D537-R540 PolarHBondContact O-N 3.37Å; D537-R540 VanDerWaalsContact O-N 3.16Å; D537-I541 WeakPolarHBondContact O-CG1 3.35Å; D537-I541 PolarHBondContact O-N 3.4Å
538	L	93.8	Very high	94.3	Very high	54 Å²	54	54.2 Å²	54.2	28%	0.283	28%	0.275	S	S	.	.	H	α-helix	trans	-58.2	-43.9	172.8	-83.3	175.1	0	0	0	112.3	F144 I534 R540 I541 N542	F144-L538 HydrophobicContact CE1-CD2 4.32Å; F144-L538 HydrophobicContact CE1-CG 4.27Å; F144-L538 HydrophobicContact CE2-CD2 4.22Å; F144-L538 HydrophobicContact CZ-CD1 3.99Å; F144-L538 HydrophobicContact CZ-CD2 3.66Å; F144-L538 HydrophobicContact CZ-CG 3.81Å; I534-L538 HydrophobicContact CG2-CD1 4.04Å; I534-L538 VanDerWaalsContact O-CB 3.29Å; I534-L538 WeakPolarHBondContact O-CB 3.35Å; I534-L538 VanDerWaalsContact O-CG 3.3Å; I534-L538 WeakPolarHBondContact O-CG 3.45Å; I534-L538 PolarHBondContact O-N 3.2Å; L538-R540 VanDerWaalsContact C-N 3.28Å; L538-R540 PolarHBondContact O-N 3.46Å; L538-I541 PolarHBondContact O-N 2.99Å; L538-N542 VanDerWaalsContact O-CB 3.31Å; L538-N542 WeakPolarHBondContact O-CB 3.35Å; L538-N542 PolarHBondContact O-N 3.34Å; L538-N542 PolarHBondContact O-ND2 2.79Å
539	L	94.9	Very high	94.3	Very high	45 Å²	45	54.7 Å²	54.7	24%	0.236	28%	0.283	C	S	.	.	H	α-helix	trans	-66.2	-35	178.4	-172.8	64.7	0	0	0	110.9	F535 A536 D537 T543 L545 I550 L553 F554	F535-L539 WeakPolarHBondContact O-CB 3.11Å; F535-L539 PolarHBondContact O-N 2.92Å; A536-L539 PolarHBondContact O-N 3.26Å; D537-L539 VanDerWaalsContact C-N 3.34Å; D537-L539 PolarHBondContact O-N 3.03Å; L539-T543 HydrophobicContact CD1-CG2 3.77Å; L539-T543 WeakPolarHBondContact O-CB 3.08Å; L539-T543 PolarHBondContact O-N 3.03Å; L539-T543 VanDerWaalsContact O-N 3.12Å; L539-T543 PolarHBondContact O-OG1 2.83Å; L539-L545 HydrophobicContact CD1-CD1 4.03Å; L539-L545 HydrophobicContact CD2-CD1 4.02Å; L539-L545 HydrophobicContact CG-CD1 3.99Å; L539-I550 HydrophobicContact CB-CD1 4.37Å; L539-I550 HydrophobicContact CD2-CD1 4.46Å; L539-I550 HydrophobicContact CD2-CG1 4.03Å; L539-I550 HydrophobicContact CD2-CG2 4.37Å; L539-I550 HydrophobicContact CG-CD1 4.2Å; L539-I550 HydrophobicContact CG-CG1 4.27Å; L539-L553 HydrophobicContact CD2-CD2 4.06Å; L539-F554 HydrophobicContact CD2-CE2 4.28Å
540	R	91.9	Very high	94.2	Very high	86 Å²	86	54.8 Å²	54.8	33%	0.325	28%	0.284	S	S	.	.	H	α-helix	trans	-71.9	-30.6	176.8	-178.7	56.8	-172.2	161.6	8.9	113.7	A536 D537 L538 L545 I550	A536-R540 WeakPolarHBondContact O-CB 3.36Å; A536-R540 PolarHBondContact O-N 3.25Å; D537-R540 PolarHBondContact O-N 3.37Å; D537-R540 VanDerWaalsContact O-N 3.16Å; L538-R540 VanDerWaalsContact C-N 3.28Å; L538-R540 PolarHBondContact O-N 3.46Å; R540-L545 PolarHBondContact NH1-O 2.91Å; R540-I550 HydrophobicContact CB-CD1 3.63Å; R540-I550 HydrophobicContact CG-CD1 4.35Å
541	I	90.9	Very high	94.2	Very high	73 Å²	73	53.9 Å²	53.9	37%	0.374	28%	0.277	S	S	.	.	H	α-helix	trans	-82.7	-41.8	177.5	-68.2	165.2	0	0	0	111.2	F143 D537 L538	F143-I541 HydrophobicContact CE1-CG2 4.36Å; D537-I541 WeakPolarHBondContact O-CG1 3.35Å; D537-I541 PolarHBondContact O-N 3.4Å; L538-I541 PolarHBondContact O-N 2.99Å
542	N	92.2	Very high	94.2	Very high	115 Å²	115	52.7 Å²	52.7	62%	0.615	27%	0.269	S	S	*	.	H	α-helix	trans	-91.3	-6.4	-172.7	-63.3	-58.3	0	0	0	114.5	L538	L538-N542 VanDerWaalsContact O-CB 3.31Å; L538-N542 WeakPolarHBondContact O-CB 3.35Å; L538-N542 PolarHBondContact O-N 3.34Å; L538-N542 PolarHBondContact O-ND2 2.79Å
543	T	92.7	Very high	94.2	Very high	49 Å²	49	56.6 Å²	56.6	30%	0.301	29%	0.29	S	S	.	.	S	Bend	trans	-138.9	154.4	179.7	78.2	0	0	0	0	112.5	L539 L545	L539-T543 HydrophobicContact CD1-CG2 3.77Å; L539-T543 WeakPolarHBondContact O-CB 3.08Å; L539-T543 PolarHBondContact O-N 3.03Å; L539-T543 VanDerWaalsContact O-N 3.12Å; L539-T543 PolarHBondContact O-OG1 2.83Å; T543-L545 PolarHBondContact O-N 2.94Å; T543-L545 VanDerWaalsContact O-N 3.08Å; T543-L545 WeakPolarHBondContact OG1-CG 3.15Å; T543-L545 PolarHBondContact OG1-N 3.39Å
544	N	91.2	Very high	94.2	Very high	173 Å²	173	57.8 Å²	57.8	93%	0.925	30%	0.295	S	S	*	.			trans	-76.5	14.5	177.6	-64.6	-10.7	0	0	0	113.7
545	L	92.4	Very high	94.2	Very high	67 Å²	67	55.1 Å²	55.1	35%	0.351	28%	0.281	S	S	.	.			trans	-66.8	137.4	-179.4	-67.4	176.2	0	0	0	111.4	L539 R540 T543 T549 I550	L539-L545 HydrophobicContact CD1-CD1 4.03Å; L539-L545 HydrophobicContact CD2-CD1 4.02Å; L539-L545 HydrophobicContact CG-CD1 3.99Å; R540-L545 PolarHBondContact NH1-O 2.91Å; T543-L545 PolarHBondContact O-N 2.94Å; T543-L545 VanDerWaalsContact O-N 3.08Å; T543-L545 WeakPolarHBondContact OG1-CG 3.15Å; T543-L545 PolarHBondContact OG1-N 3.39Å; L545-T549 HydrophobicContact CD2-CG2 4.19Å; L545-I550 HydrophobicContact CB-CD1 4.07Å; L545-I550 HydrophobicContact CB-CG1 3.86Å
546	S	92.6	Very high	94.3	Very high	48 Å²	48	49.7 Å²	49.7	34%	0.336	26%	0.26	S	S	.	.			trans	-67.2	152.2	177.6	87.6	0	0	0	0	111.2	T548 T549 I550	S546-T548 VanDerWaalsContact C-N 3.26Å; S546-T548 PolarHBondContact O-N 3.38Å; S546-T549 WeakPolarHBondContact O-CB 3.28Å; S546-T549 PolarHBondContact O-N 2.89Å; S546-T549 WeakPolarHBondContact OG-CB 3.33Å; S546-T549 PolarHBondContact OG-N 3Å; S546-T549 PolarHBondContact OG-OG1 3.48Å; S546-I550 WeakPolarHBondContact O-CG1 3.26Å; S546-I550 PolarHBondContact O-N 3.37Å
547	R	91.7	Very high	94.3	Very high	66 Å²	66	54.2 Å²	54.2	25%	0.249	28%	0.283	C	S	.	.	H	α-helix	trans	-56	-43.6	175	-66.9	179.2	-67.6	136.6	-0.4	111	T549 I550 H551 D602 S669	R547-T549 VanDerWaalsContact C-N 3.32Å; R547-T549 PolarHBondContact O-N 3.16Å; R547-I550 PolarHBondContact O-N 2.91Å; R547-H551 WeakPolarHBondContact O-CB 3.31Å; R547-H551 PolarHBondContact O-N 2.97Å; R547-H551 PolarHBondContact O-ND1 3.01Å; R547-D602 WeakPolarHBondContact CD-OD2 3.36Å; R547-D602 IonicContact CZ-OD2 3.69Å; R547-D602 IonicContact NE-OD2 3.19Å; R547-D602 IonicContact NH1-OD1 2.71Å; R547-D602 PolarHBondContact NH1-OD1 3.03Å; R547-D602 IonicContact NH1-OD2 3.23Å; R547-D602 PolarHBondContact NH1-OD2 3.17Å; R547-S669 VanDerWaalsContact CZ-O 3.28Å; R547-S669 PolarHBondContact NH1-O 2.99Å; R547-S669 VanDerWaalsContact NH1-O 3.15Å; R547-S669 PolarHBondContact NH2-O 3.42Å
548	T	94.4	Very high	94.5	Very high	21 Å²	21	53.9 Å²	53.9	13%	0.129	28%	0.282	C	S	.	.	H	α-helix	trans	-56.8	-42.8	173.4	-54.2	0	0	0	0	112.2	S546 K552 S669	S546-T548 VanDerWaalsContact C-N 3.26Å; S546-T548 PolarHBondContact O-N 3.38Å; T548-K552 HydrophobicContact CG2-CD 4.14Å; T548-K552 VanDerWaalsContact O-CB 3.24Å; T548-K552 WeakPolarHBondContact O-CB 3.16Å; T548-K552 VanDerWaalsContact O-CG 3.26Å; T548-K552 WeakPolarHBondContact O-CG 3.43Å; T548-K552 PolarHBondContact O-N 3Å; T548-S669 PolarHBondContact OG1-N 3.4Å
549	T	96	Very high	94.6	Very high	70 Å²	70	51.3 Å²	51.3	43%	0.429	27%	0.268	S	S	.	.	H	α-helix	trans	-66	-44.6	177.9	-50.1	0	0	0	0	111.6	L545 S546 R547 K552 L553	L545-T549 HydrophobicContact CD2-CG2 4.19Å; S546-T549 WeakPolarHBondContact O-CB 3.28Å; S546-T549 PolarHBondContact O-N 2.89Å; S546-T549 WeakPolarHBondContact OG-CB 3.33Å; S546-T549 PolarHBondContact OG-N 3Å; S546-T549 PolarHBondContact OG-OG1 3.48Å; R547-T549 VanDerWaalsContact C-N 3.32Å; R547-T549 PolarHBondContact O-N 3.16Å; T549-K552 PolarHBondContact O-N 3.32Å; T549-L553 WeakPolarHBondContact O-CB 3.39Å; T549-L553 PolarHBondContact O-N 3.38Å
550	I	95.7	Very high	94.8	Very high	3 Å²	3	49.6 Å²	49.6	2%	0.015	26%	0.261	C	S	.	.	H	α-helix	trans	-64.3	-50.3	178.6	-65.2	175	0	0	0	109.9	A536 L539 R540 L545 S546 R547 K552 L553 F554	A536-I550 HydrophobicContact CB-CG2 4Å; L539-I550 HydrophobicContact CB-CD1 4.37Å; L539-I550 HydrophobicContact CD2-CD1 4.46Å; L539-I550 HydrophobicContact CD2-CG1 4.03Å; L539-I550 HydrophobicContact CD2-CG2 4.37Å; L539-I550 HydrophobicContact CG-CD1 4.2Å; L539-I550 HydrophobicContact CG-CG1 4.27Å; R540-I550 HydrophobicContact CB-CD1 3.63Å; R540-I550 HydrophobicContact CG-CD1 4.35Å; L545-I550 HydrophobicContact CB-CD1 4.07Å; L545-I550 HydrophobicContact CB-CG1 3.86Å; S546-I550 WeakPolarHBondContact O-CG1 3.26Å; S546-I550 PolarHBondContact O-N 3.37Å; R547-I550 PolarHBondContact O-N 2.91Å; I550-K552 VanDerWaalsContact C-N 3.32Å; I550-K552 PolarHBondContact O-N 2.93Å; I550-L553 WeakPolarHBondContact O-CB 3.4Å; I550-L553 PolarHBondContact O-N 3.02Å; I550-L553 VanDerWaalsContact O-N 3.09Å; I550-F554 HydrophobicContact CG2-CD2 3.84Å; I550-F554 HydrophobicContact CG2-CE2 3.94Å; I550-F554 WeakPolarHBondContact O-CD2 3.45Å; I550-F554 PolarHBondContact O-N 2.66Å
551	H	95.5	Very high	95.1	Very high	6 Å²	6	48 Å²	48	3%	0.028	26%	0.259	C	S	.	.	H	α-helix	trans	-63.2	-36.7	179.2	-64.7	154.8	0	0	0	112.6	R547 A555 A594 G595 D602 S669	R547-H551 WeakPolarHBondContact O-CB 3.31Å; R547-H551 PolarHBondContact O-N 2.97Å; R547-H551 PolarHBondContact O-ND1 3.01Å; H551-A555 VanDerWaalsContact O-CB 3.26Å; H551-A555 WeakPolarHBondContact O-CB 3.47Å; H551-A555 PolarHBondContact O-N 3.47Å; H551-A594 PolarHBondContact CD2-O 3.18Å; H551-G595 WeakPolarHBondContact O-CA 3.31Å; H551-D602 IonicContact CE1-OD2 2.71Å; H551-D602 PolarHBondContact CE1-OD2 3.19Å; H551-S669 PolarHBondContact ND1-OG 3.13Å
552	K	96.8	Very high	95.4	Very high	45 Å²	45	44.5 Å²	44.5	20%	0.196	24%	0.241	C	C	.	.	H	α-helix	trans	-65.4	-37.6	172	-79.3	-176.7	-179.2	-170.8	0	112.6	T548 T549 I550 G556 Y663 L664 L665 S667	T548-K552 HydrophobicContact CG2-CD 4.14Å; T548-K552 VanDerWaalsContact O-CB 3.24Å; T548-K552 WeakPolarHBondContact O-CB 3.16Å; T548-K552 VanDerWaalsContact O-CG 3.26Å; T548-K552 WeakPolarHBondContact O-CG 3.43Å; T548-K552 PolarHBondContact O-N 3Å; T549-K552 PolarHBondContact O-N 3.32Å; I550-K552 VanDerWaalsContact C-N 3.32Å; I550-K552 PolarHBondContact O-N 2.93Å; K552-G556 WeakPolarHBondContact O-CA 3.45Å; K552-G556 PolarHBondContact O-N 3.02Å; K552-Y663 HydrophobicContact CG-CD1 4.38Å; K552-Y663 HydrophobicContact CG-CE1 4.32Å; K552-L664 HydrophobicContact CB-CD2 3.92Å; K552-L664 WeakPolarHBondContact CD-O 3.44Å; K552-L664 WeakPolarHBondContact CE-O 3.32Å; K552-L664 HydrophobicContact CG-CD2 4.36Å; K552-L664 PolarHBondContact NZ-O 3.35Å; K552-L664 WeakPolarHBondContact O-CD2 3.23Å; K552-L665 PolarHBondContact NZ-O 3.22Å; K552-S667 WeakPolarHBondContact CE-O 3.43Å; K552-S667 WeakPolarHBondContact CE-OG 3.35Å; K552-S667 WeakPolarHBondContact CG-OG 3.42Å; K552-S667 PolarHBondContact NZ-O 3.36Å
553	L	96.7	Very high	95.6	Very high	82 Å²	82	39 Å²	39	43%	0.429	21%	0.212	S	C	.	.	H	α-helix	trans	-63.8	-52.3	175.7	180	64.9	0	0	0	111.6	L539 T549 I550 G556 L557	L539-L553 HydrophobicContact CD2-CD2 4.06Å; T549-L553 WeakPolarHBondContact O-CB 3.39Å; T549-L553 PolarHBondContact O-N 3.38Å; I550-L553 WeakPolarHBondContact O-CB 3.4Å; I550-L553 PolarHBondContact O-N 3.02Å; I550-L553 VanDerWaalsContact O-N 3.09Å; L553-G556 PolarHBondContact O-N 2.92Å; L553-L557 HydrophobicContact CD1-CD1 3.73Å; L553-L557 HydrophobicContact CD1-CG 4.17Å; L553-L557 HydrophobicContact CG-CD1 4.07Å; L553-L557 WeakPolarHBondContact O-CB 3.46Å; L553-L557 WeakPolarHBondContact O-CG 3.47Å; L553-L557 PolarHBondContact O-N 3.33Å
554	F	96.9	Very high	95.9	Very high	25 Å²	25	41.1 Å²	41.1	11%	0.11	22%	0.22	C	C	.	.	H	α-helix	trans	-65.6	-46.8	-178.5	-83.5	-86.4	0	0	0	112.7	F535 A536 L539 I550 G558 L591 A594	F535-F554 HydrophobicContact CB-CE1 4.28Å; F535-F554 HydrophobicContact CB-CZ 3.86Å; A536-F554 HydrophobicContact CB-CD2 4.07Å; A536-F554 HydrophobicContact CB-CE2 3.79Å; A536-F554 HydrophobicContact CB-CZ 4.15Å; L539-F554 HydrophobicContact CD2-CE2 4.28Å; I550-F554 HydrophobicContact CG2-CD2 3.84Å; I550-F554 HydrophobicContact CG2-CE2 3.94Å; I550-F554 WeakPolarHBondContact O-CD2 3.45Å; I550-F554 PolarHBondContact O-N 2.66Å; F554-G558 PolarHBondContact O-N 3.12Å; F554-L591 HydrophobicContact CD1-CB 4.38Å; F554-L591 HydrophobicContact CE1-CD2 4.44Å; F554-A594 HydrophobicContact CB-CB 4.49Å; F554-A594 HydrophobicContact CD1-CB 4.18Å; F554-A594 HydrophobicContact CG-CB 4.33Å
555	A	96.8	Very high	96.2	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-65.7	-43.3	175.7	0	0	0	0	0	111.8	H551 G558 F559 Y663	H551-A555 VanDerWaalsContact O-CB 3.26Å; H551-A555 WeakPolarHBondContact O-CB 3.47Å; H551-A555 PolarHBondContact O-N 3.47Å; A555-G558 PolarHBondContact O-N 2.98Å; A555-F559 HydrophobicContact CB-CD2 4.26Å; A555-F559 HydrophobicContact CB-CE2 4.41Å; A555-F559 WeakPolarHBondContact O-CB 3.18Å; A555-F559 VanDerWaalsContact O-CD2 3.26Å; A555-F559 WeakPolarHBondContact O-CD2 3.41Å; A555-F559 PolarHBondContact O-N 2.97Å; A555-Y663 HydrophobicContact CB-CD1 3.5Å; A555-Y663 VanDerWaalsContact CB-CD1 3.5Å; A555-Y663 HydrophobicContact CB-CE1 3.51Å; A555-Y663 HydrophobicContact CB-CG 4.26Å
556	G	96.8	Very high	96.5	Very high	9 Å²	9	31.4 Å²	31.4	9%	0.093	17%	0.167	C	C	.	.	H	α-helix	trans	-60.3	-52	-179.5	0	0	0	0	0	112.8	K552 L553 G560	K552-G556 WeakPolarHBondContact O-CA 3.45Å; K552-G556 PolarHBondContact O-N 3.02Å; L553-G556 PolarHBondContact O-N 2.92Å; G556-G560 PolarHBondContact O-N 3.31Å
557	L	96.7	Very high	96.7	Very high	95 Å²	95	32.4 Å²	32.4	50%	0.497	17%	0.167	S	C	.	.	H	α-helix	trans	-61.4	-46.1	175.2	-71.4	172.5	0	0	0	111.6	L553 L561	L553-L557 HydrophobicContact CD1-CD1 3.73Å; L553-L557 HydrophobicContact CD1-CG 4.17Å; L553-L557 HydrophobicContact CG-CD1 4.07Å; L553-L557 WeakPolarHBondContact O-CB 3.46Å; L553-L557 WeakPolarHBondContact O-CG 3.47Å; L553-L557 PolarHBondContact O-N 3.33Å; L557-L561 VanDerWaalsContact O-CB 3.28Å; L557-L561 WeakPolarHBondContact O-CB 3.3Å; L557-L561 WeakPolarHBondContact O-CG 3.11Å; L557-L561 PolarHBondContact O-N 2.96Å
558	G	97.1	Very high	97	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-64.4	-51.3	-175.4	0	0	0	0	0	113.4	F554 A555 K562 F588	F554-G558 PolarHBondContact O-N 3.12Å; A555-G558 PolarHBondContact O-N 2.98Å; G558-K562 WeakPolarHBondContact O-CB 3.49Å; G558-K562 PolarHBondContact O-N 3.16Å; G558-K562 VanDerWaalsContact O-N 3.13Å; G558-F588 WeakPolarHBondContact CA-O 3.15Å
559	F	97.6	Very high	97.2	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-68.2	-41.1	176.8	-75.3	-69.1	0	0	0	112.4	T484 A487 D488 A555 G563 A592 Y596 Q656 A659 M660	T484-F559 HydrophobicContact CG2-CD2 4.09Å; T484-F559 HydrophobicContact CG2-CE2 3.45Å; T484-F559 VanDerWaalsContact CG2-CE2 3.45Å; T484-F559 HydrophobicContact CG2-CZ 3.9Å; T484-F559 WeakPolarHBondContact O-CZ 3.33Å; A487-F559 HydrophobicContact CB-CE1 4.33Å; D488-F559 HydrophobicContact CB-CE1 4.01Å; D488-F559 HydrophobicContact CB-CZ 4.2Å; A555-F559 HydrophobicContact CB-CD2 4.26Å; A555-F559 HydrophobicContact CB-CE2 4.41Å; A555-F559 WeakPolarHBondContact O-CB 3.18Å; A555-F559 VanDerWaalsContact O-CD2 3.26Å; A555-F559 WeakPolarHBondContact O-CD2 3.41Å; A555-F559 PolarHBondContact O-N 2.97Å; F559-G563 PolarHBondContact O-N 2.88Å; F559-A592 HydrophobicContact CD2-CB 4.2Å; F559-A592 HydrophobicContact CE2-CB 4.07Å; F559-A592 HydrophobicContact CZ-CB 4.47Å; F559-Y596 AromaticContact CE2-CD1 3.64Å; F559-Y596 HydrophobicContact CE2-CD1 3.64Å; F559-Y596 HydrophobicContact CE2-CE1 4.24Å; F559-Y596 HydrophobicContact CE2-CG 4.17Å; F559-Y596 AromaticContact CZ-CD1 3.78Å; F559-Y596 HydrophobicContact CZ-CD1 3.78Å; F559-Y596 AromaticContact CZ-CE1 3.97Å; F559-Y596 HydrophobicContact CZ-CE1 3.97Å; F559-Y596 HydrophobicContact CZ-CG 4.33Å; F559-Q656 HydrophobicContact CD1-CB 4.48Å; F559-Q656 WeakPolarHBondContact O-CB 3.23Å; F559-A659 HydrophobicContact CD1-CB 4.45Å; F559-M660 HydrophobicContact CB-CB 3.91Å
560	G	97.6	Very high	97.2	Very high	8 Å²	8	27.1 Å²	27.1	8%	0.082	15%	0.149	C	C	.	.	H	α-helix	trans	-63.1	-50.5	-179.8	0	0	0	0	0	113.3	G556 G563 I564 F657 M660	G556-G560 PolarHBondContact O-N 3.31Å; G560-G563 PolarHBondContact O-N 2.93Å; G560-I564 WeakPolarHBondContact O-CG1 3.44Å; G560-I564 PolarHBondContact O-N 2.83Å; G560-I564 VanDerWaalsContact O-N 3.16Å; G560-F657 WeakPolarHBondContact O-CE1 3.44Å; G560-M660 WeakPolarHBondContact CA-SD 3.46Å
561	L	97.9	Very high	97.2	Very high	52 Å²	52	33.9 Å²	33.9	27%	0.272	18%	0.175	S	C	.	.	H	α-helix	trans	-66.6	-39.7	178.7	-69	170.8	0	0	0	111.7	L557 G563 I564 F565 F588	L557-L561 VanDerWaalsContact O-CB 3.28Å; L557-L561 WeakPolarHBondContact O-CB 3.3Å; L557-L561 WeakPolarHBondContact O-CG 3.11Å; L557-L561 PolarHBondContact O-N 2.96Å; L561-G563 VanDerWaalsContact C-N 3.33Å; L561-G563 PolarHBondContact O-N 2.73Å; L561-I564 HydrophobicContact CD2-CD1 4.48Å; L561-I564 PolarHBondContact O-N 2.66Å; L561-F565 HydrophobicContact CB-CD2 4.35Å; L561-F565 HydrophobicContact CB-CE2 4.11Å; L561-F565 WeakPolarHBondContact O-CD2 3.46Å; L561-F565 PolarHBondContact O-N 2.97Å; L561-F588 HydrophobicContact CB-CB 4.09Å; L561-F588 HydrophobicContact CB-CD1 4.31Å; L561-F588 HydrophobicContact CB-CD2 4.17Å; L561-F588 HydrophobicContact CB-CG 3.92Å; L561-F588 HydrophobicContact CD1-CD1 3.44Å; L561-F588 VanDerWaalsContact CD1-CD1 3.44Å; L561-F588 HydrophobicContact CD1-CD2 4.28Å; L561-F588 HydrophobicContact CD1-CE1 3.46Å; L561-F588 VanDerWaalsContact CD1-CE1 3.46Å; L561-F588 HydrophobicContact CD1-CE2 4.29Å; L561-F588 HydrophobicContact CD1-CG 3.89Å; L561-F588 HydrophobicContact CD1-CZ 3.91Å
562	K	97.6	Very high	97.3	Very high	1 Å²	1	34 Å²	34	0%	0.004	18%	0.177	C	C	.	.	H	α-helix	trans	-58.5	-42.8	173.7	-178.1	-173.8	-177.1	-166.1	0	112.1	D488 T491 G558 I564 F565 F566 A585 S589 Q656	D488-K562 IonicContact OD1-NZ 3.92Å; D488-K562 PolarHBondContact OD1-NZ 3.35Å; T491-K562 WeakPolarHBondContact OG1-CE 3.28Å; T491-K562 PolarHBondContact OG1-NZ 2.97Å; G558-K562 WeakPolarHBondContact O-CB 3.49Å; G558-K562 PolarHBondContact O-N 3.16Å; G558-K562 VanDerWaalsContact O-N 3.13Å; K562-I564 PolarHBondContact O-N 3.05Å; K562-F565 PolarHBondContact O-N 3.08Å; K562-F566 HydrophobicContact CG-CD2 4.07Å; K562-F566 HydrophobicContact CG-CE2 4.15Å; K562-F566 WeakPolarHBondContact O-CD2 3.49Å; K562-F566 PolarHBondContact O-N 3.08Å; K562-A585 HydrophobicContact CG-CB 4.31Å; K562-S589 VanDerWaalsContact CD-OG 3.27Å; K562-S589 WeakPolarHBondContact CD-OG 3.05Å; K562-S589 WeakPolarHBondContact CE-OG 3.47Å; K562-S589 PolarHBondContact NZ-OG 3.33Å; K562-Q656 HydrophobicContact CD-CG 4.2Å; K562-Q656 VanDerWaalsContact CD-OE1 3.3Å; K562-Q656 VanDerWaalsContact CE-OE1 3.26Å; K562-Q656 HydrophobicContact CG-CG 4.24Å
563	G	97.8	Very high	97.2	Very high	0 Å²	0	37 Å²	37	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-58.1	-46.5	173.2	0	0	0	0	0	112.6	F559 G560 L561 F565 F566 I567 A653	F559-G563 PolarHBondContact O-N 2.88Å; G560-G563 PolarHBondContact O-N 2.93Å; L561-G563 VanDerWaalsContact C-N 3.33Å; L561-G563 PolarHBondContact O-N 2.73Å; G563-F565 PolarHBondContact O-N 3.2Å; G563-F566 PolarHBondContact O-N 2.77Å; G563-I567 PolarHBondContact O-N 3.12Å; G563-A653 VanDerWaalsContact O-CB 3.28Å; G563-A653 WeakPolarHBondContact O-CB 3.08Å
564	I	98.3	Very high	97.1	Very high	92 Å²	92	34.4 Å²	34.4	47%	0.472	19%	0.19	S	C	.	.	H	α-helix	trans	-60.7	-46.7	177	-65.3	167.2	0	0	0	111.2	G560 L561 K562 F566 I567 A568 F657	G560-I564 WeakPolarHBondContact O-CG1 3.44Å; G560-I564 PolarHBondContact O-N 2.83Å; G560-I564 VanDerWaalsContact O-N 3.16Å; L561-I564 HydrophobicContact CD2-CD1 4.48Å; L561-I564 PolarHBondContact O-N 2.66Å; K562-I564 PolarHBondContact O-N 3.05Å; I564-F566 PolarHBondContact O-N 3.04Å; I564-I567 PolarHBondContact O-N 3.35Å; I564-A568 PolarHBondContact O-N 3.47Å; I564-F657 HydrophobicContact CG1-CE1 4.18Å; I564-F657 HydrophobicContact CG1-CZ 3.91Å
565	F	98.2	Very high	97.1	Very high	37 Å²	37	34.9 Å²	34.9	16%	0.162	19%	0.192	C	C	.	.	H	α-helix	trans	-68.4	-31.3	180	-69.6	-57.6	0	0	0	113.3	L561 K562 G563 A568 L569 L581 L584 A585 F588	L561-F565 HydrophobicContact CB-CD2 4.35Å; L561-F565 HydrophobicContact CB-CE2 4.11Å; L561-F565 WeakPolarHBondContact O-CD2 3.46Å; L561-F565 PolarHBondContact O-N 2.97Å; K562-F565 PolarHBondContact O-N 3.08Å; G563-F565 PolarHBondContact O-N 3.2Å; F565-A568 PolarHBondContact O-N 3.49Å; F565-L569 WeakPolarHBondContact O-CB 3.39Å; F565-L569 PolarHBondContact O-N 2.81Å; F565-L581 HydrophobicContact CD1-CD2 3.83Å; F565-L581 HydrophobicContact CE1-CD2 4.35Å; F565-L584 HydrophobicContact CD1-CB 4.15Å; F565-L584 HydrophobicContact CD1-CD1 4.38Å; F565-L584 HydrophobicContact CD2-CB 3.92Å; F565-L584 HydrophobicContact CE1-CB 4.09Å; F565-L584 HydrophobicContact CE1-CD1 3.8Å; F565-L584 HydrophobicContact CE2-CB 3.88Å; F565-L584 HydrophobicContact CG-CB 4.09Å; F565-L584 HydrophobicContact CZ-CB 3.96Å; F565-L584 HydrophobicContact CZ-CD1 4.02Å; F565-L584 HydrophobicContact CZ-CG 4.49Å; F565-A585 HydrophobicContact CB-CB 3.72Å; F565-F588 HydrophobicContact CD2-CD2 4.12Å; F565-F588 AromaticContact CE2-CD2 3.54Å; F565-F588 HydrophobicContact CE2-CD2 3.54Å; F565-F588 AromaticContact CE2-CE2 3.7Å; F565-F588 HydrophobicContact CE2-CE2 3.7Å; F565-F588 HydrophobicContact CZ-CE2 4.29Å
566	F	97.6	Very high	97	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-66.6	-37.2	172	-97.5	-102	0	0	0	112.7	T491 I494 K562 G563 I564 L582 A585 L649 A652 A653	T491-F566 HydrophobicContact CG2-CD1 4.11Å; T491-F566 HydrophobicContact CG2-CD2 4.32Å; T491-F566 HydrophobicContact CG2-CE1 3.72Å; T491-F566 HydrophobicContact CG2-CE2 3.95Å; T491-F566 HydrophobicContact CG2-CG 4.39Å; T491-F566 HydrophobicContact CG2-CZ 3.63Å; I494-F566 HydrophobicContact CG2-CE1 4.19Å; K562-F566 HydrophobicContact CG-CD2 4.07Å; K562-F566 HydrophobicContact CG-CE2 4.15Å; K562-F566 WeakPolarHBondContact O-CD2 3.49Å; K562-F566 PolarHBondContact O-N 3.08Å; G563-F566 PolarHBondContact O-N 2.77Å; I564-F566 PolarHBondContact O-N 3.04Å; F566-L582 HydrophobicContact CZ-CD1 4.46Å; F566-A585 HydrophobicContact CD2-CB 3.82Å; F566-A585 HydrophobicContact CE2-CB 3.88Å; F566-L649 HydrophobicContact CD1-CD2 3.66Å; F566-L649 HydrophobicContact CE1-CD2 4Å; F566-A652 HydrophobicContact CD1-CB 3.88Å; F566-A652 HydrophobicContact CE1-CB 4.12Å; F566-A653 HydrophobicContact CB-CB 3.93Å
567	I	98	Very high	97	Very high	68 Å²	68	45.2 Å²	45.2	35%	0.349	24%	0.235	S	C	.	.	H	α-helix	trans	-64	-50.2	171.3	-64.9	174	0	0	0	109.8	G563 I564 L569 G570 Y571 A653 F657	G563-I567 PolarHBondContact O-N 3.12Å; I564-I567 PolarHBondContact O-N 3.35Å; I567-L569 VanDerWaalsContact C-N 3.26Å; I567-L569 PolarHBondContact O-N 3.42Å; I567-G570 PolarHBondContact O-N 3.49Å; I567-G570 VanDerWaalsContact O-N 3.09Å; I567-Y571 WeakPolarHBondContact O-CD2 3.46Å; I567-A653 HydrophobicContact CD1-CB 4.16Å; I567-A653 HydrophobicContact CG1-CB 3.56Å; I567-F657 HydrophobicContact CD1-CE2 3.95Å
568	A	97.8	Very high	97.1	Very high	34 Å²	34	40.7 Å²	40.7	28%	0.281	21%	0.212	S	C	.	.	H	α-helix	trans	-58.8	-36	-179	0	0	0	0	0	112.9	I564 F565 G570 Y571 A572 L581	I564-A568 PolarHBondContact O-N 3.47Å; F565-A568 PolarHBondContact O-N 3.49Å; A568-G570 PolarHBondContact O-N 3.25Å; A568-Y571 CarbonylContact O-C 3.43Å; A568-Y571 PolarHBondContact O-N 3.48Å; A568-A572 PolarHBondContact O-N 2.97Å; A568-L581 HydrophobicContact CB-CD1 4.16Å; A568-L581 HydrophobicContact CB-CD2 3.96Å
569	L	97.5	Very high	97.1	Very high	1 Å²	1	41.1 Å²	41.1	1%	0.005	22%	0.215	C	C	.	.	H	α-helix	trans	-57.6	-34.3	176.6	-179.1	58.4	0	0	0	112.8	M499 F502 F565 I567 Y571 A572 A578 L581 L582 L649	M499-L569 HydrophobicContact SD-CD2 4.06Å; F502-L569 HydrophobicContact CE1-CD1 4.05Å; F502-L569 HydrophobicContact CE1-CG 4.39Å; F502-L569 HydrophobicContact CZ-CD1 4.47Å; F565-L569 WeakPolarHBondContact O-CB 3.39Å; F565-L569 PolarHBondContact O-N 2.81Å; I567-L569 VanDerWaalsContact C-N 3.26Å; I567-L569 PolarHBondContact O-N 3.42Å; L569-Y571 PolarHBondContact O-N 2.98Å; L569-Y571 VanDerWaalsContact O-N 3.15Å; L569-A572 HydrophobicContact CD1-CB 4.5Å; L569-A572 WeakPolarHBondContact O-CB 3.39Å; L569-A572 PolarHBondContact O-N 3.17Å; L569-A578 HydrophobicContact CD1-CB 3.68Å; L569-A578 WeakPolarHBondContact CD1-O 3.29Å; L569-L581 HydrophobicContact CD1-CB 4.5Å; L569-L582 HydrophobicContact CD1-CB 4.41Å; L569-L582 HydrophobicContact CD2-CB 4.15Å; L569-L582 HydrophobicContact CD2-CD1 3.91Å; L569-L582 HydrophobicContact CD2-CG 4.49Å; L569-L649 HydrophobicContact CB-CD1 4.33Å; L569-L649 HydrophobicContact CD2-CD1 4.4Å; L569-L649 HydrophobicContact CD2-CD2 3.94Å; L569-L649 HydrophobicContact CG-CD1 4.01Å; L569-L649 HydrophobicContact CG-CD2 4.43Å
570	G	95.8	Very high	97.1	Very high	12 Å²	12	46.3 Å²	46.3	12%	0.124	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-8.3	175.1	0	0	0	0	0	114.9	I567 A568 R646	I567-G570 PolarHBondContact O-N 3.49Å; I567-G570 VanDerWaalsContact O-N 3.09Å; A568-G570 PolarHBondContact O-N 3.25Å; G570-R646 WeakPolarHBondContact O-CG 2.95Å; G570-R646 PolarHBondContact O-NE 3.44Å
571	Y	96.5	Very high	97.1	Very high	144 Å²	144	47.7 Å²	47.7	57%	0.565	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-122.1	10.2	178.1	-60.3	-92	0	0	0	112.5	I567 A568 L569	I567-Y571 WeakPolarHBondContact O-CD2 3.46Å; A568-Y571 CarbonylContact O-C 3.43Å; A568-Y571 PolarHBondContact O-N 3.48Å; L569-Y571 PolarHBondContact O-N 2.98Å; L569-Y571 VanDerWaalsContact O-N 3.15Å
572	A	96.9	Very high	97.1	Very high	10 Å²	10	45.2 Å²	45.2	8%	0.083	23%	0.233	C	C	.	.			trans	-63.3	122.5	179.1	0	0	0	0	0	111.6	Y507 A568 L569 S574 A578 L581	Y507-A572 WeakPolarHBondContact OH-CB 3.41Å; Y507-A572 PolarHBondContact OH-O 3.46Å; A568-A572 PolarHBondContact O-N 2.97Å; L569-A572 HydrophobicContact CD1-CB 4.5Å; L569-A572 WeakPolarHBondContact O-CB 3.39Å; L569-A572 PolarHBondContact O-N 3.17Å; A572-S574 PolarHBondContact O-N 3.12Å; A572-A578 HydrophobicContact CB-CB 3.93Å; A572-L581 HydrophobicContact CB-CD1 4.03Å
573	P	94.7	Very high	97.2	Very high	106 Å²	106	46 Å²	46	69%	0.688	24%	0.238	S	C	*	.	S	Bend	trans	-78.9	-18.5	-171.9	30.1	-35.7	0	0	0	114.3	Y577	P573-Y577 HydrophobicContact CG-CD2 3.66Å; P573-Y577 HydrophobicContact CG-CE2 4.13Å; P573-Y577 HydrophobicContact CG-CG 4.12Å
574	S	95.8	Very high	97.2	Very high	29 Å²	29	49.3 Å²	49.3	20%	0.203	26%	0.255	C	S	.	.	S	Bend	trans	-145.2	167.7	173.9	82.2	0	0	0	0	111.6	Y507 A572 I576 Y577 A578	Y507-S574 VanDerWaalsContact CE1-C 3.49Å; A572-S574 PolarHBondContact O-N 3.12Å; S574-I576 PolarHBondContact O-N 3.13Å; S574-I576 PolarHBondContact OG-N 3.37Å; S574-Y577 PolarHBondContact O-N 2.77Å; S574-Y577 WeakPolarHBondContact OG-CD2 3.29Å; S574-A578 PolarHBondContact O-N 2.94Å
575	E	95.1	Very high	97.2	Very high	34 Å²	34	44.9 Å²	44.9	16%	0.159	23%	0.233	C	C	.	.	H	α-helix	trans	-60.5	-29.8	179	74.9	-78.3	-150.7	0	0	112.8	Y503 Y507 V509 R513 F517 T579	Y503-E575 HydrophobicContact CD1-CB 4.03Å; Y503-E575 HydrophobicContact CE1-CB 4.1Å; Y507-E575 HydrophobicContact CD2-CB 3.83Å; Y507-E575 HydrophobicContact CE2-CB 4.45Å; Y507-E575 HydrophobicContact CG-CB 3.92Å; V509-E575 HydrophobicContact CG2-CB 4.04Å; V509-E575 HydrophobicContact CG2-CG 4.03Å; R513-E575 IonicContact CZ-OE1 2.64Å; R513-E575 IonicContact NH1-OE1 2.72Å; R513-E575 PolarHBondContact NH1-OE1 3Å; R513-E575 IonicContact NH2-OE1 3.19Å; R513-E575 PolarHBondContact NH2-OE1 2.88Å; F517-E575 HydrophobicContact CD2-CG 4.17Å; F517-E575 HydrophobicContact CE1-CG 4.35Å; F517-E575 HydrophobicContact CE2-CB 4.15Å; F517-E575 HydrophobicContact CE2-CG 3.35Å; F517-E575 HydrophobicContact CZ-CB 4.49Å; F517-E575 HydrophobicContact CZ-CG 3.47Å; F517-E575 VanDerWaalsContact CZ-CG 3.47Å; E575-T579 WeakPolarHBondContact O-CB 3.42Å; E575-T579 PolarHBondContact O-N 3.19Å; E575-T579 PolarHBondContact O-OG1 3.49Å
576	I	96.4	Very high	97.1	Very high	92 Å²	92	43.2 Å²	43.2	47%	0.472	23%	0.225	S	C	.	.	H	α-helix	trans	-70.2	-46.8	175.9	-63.1	164.5	0	0	0	110.3	F517 S574 A578 T579 M580	F517-I576 HydrophobicContact CE1-CG1 4.2Å; F517-I576 HydrophobicContact CZ-CG1 4.33Å; S574-I576 PolarHBondContact O-N 3.13Å; S574-I576 PolarHBondContact OG-N 3.37Å; I576-A578 VanDerWaalsContact C-N 3.32Å; I576-A578 PolarHBondContact O-N 2.77Å; I576-T579 WeakPolarHBondContact O-CB 3.38Å; I576-T579 PolarHBondContact O-N 3.42Å; I576-T579 VanDerWaalsContact O-N 3.16Å; I576-M580 HydrophobicContact CG2-SD 4.36Å; I576-M580 WeakPolarHBondContact O-CG 3.32Å; I576-M580 PolarHBondContact O-N 2.89Å
577	Y	97	Very high	97.1	Very high	134 Å²	134	43.2 Å²	43.2	53%	0.525	23%	0.225	S	C	.	.	H	α-helix	trans	-64.1	-38.6	175.8	-72.9	-75.4	0	0	0	111.7	P573 S574 T579 M580 L581	P573-Y577 HydrophobicContact CG-CD2 3.66Å; P573-Y577 HydrophobicContact CG-CE2 4.13Å; P573-Y577 HydrophobicContact CG-CG 4.12Å; S574-Y577 PolarHBondContact O-N 2.77Å; S574-Y577 WeakPolarHBondContact OG-CD2 3.29Å; Y577-T579 VanDerWaalsContact C-N 3.31Å; Y577-T579 PolarHBondContact O-N 2.74Å; Y577-M580 PolarHBondContact O-N 2.74Å; Y577-L581 WeakPolarHBondContact O-CB 3.17Å; Y577-L581 VanDerWaalsContact O-CG 3.29Å; Y577-L581 WeakPolarHBondContact O-CG 3.11Å; Y577-L581 PolarHBondContact O-N 2.8Å
578	A	97.6	Very high	97	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-59.7	-42.8	172.7	0	0	0	0	0	111.5	F502 Y503 Y507 L569 A572 S574 I576 L581 L582	F502-A578 HydrophobicContact CE1-CB 4.24Å; Y503-A578 HydrophobicContact CE1-CB 4.28Å; Y503-A578 PolarHBondContact OH-O 3.1Å; Y507-A578 HydrophobicContact CE2-CB 3.79Å; L569-A578 HydrophobicContact CD1-CB 3.68Å; L569-A578 WeakPolarHBondContact CD1-O 3.29Å; A572-A578 HydrophobicContact CB-CB 3.93Å; S574-A578 PolarHBondContact O-N 2.94Å; I576-A578 VanDerWaalsContact C-N 3.32Å; I576-A578 PolarHBondContact O-N 2.77Å; A578-L581 PolarHBondContact O-N 3.08Å; A578-L582 WeakPolarHBondContact O-CB 3.42Å; A578-L582 PolarHBondContact O-N 2.82Å
579	T	97.5	Very high	96.9	Very high	10 Å²	10	40.6 Å²	40.6	6%	0.061	21%	0.205	C	C	.	.	H	α-helix	trans	-63.4	-45.1	178.1	-57.2	0	0	0	0	111.1	Y503 F517 F520 E575 I576 Y577 S583	Y503-T579 WeakPolarHBondContact OH-CA 3.28Å; Y503-T579 PolarHBondContact OH-N 3.47Å; Y503-T579 PolarHBondContact OH-OG1 2.95Å; F517-T579 HydrophobicContact CB-CG2 4.4Å; F517-T579 WeakPolarHBondContact CB-OG1 3.46Å; F517-T579 HydrophobicContact CD1-CG2 4.12Å; F517-T579 WeakPolarHBondContact CD1-OG1 3.44Å; F517-T579 WeakPolarHBondContact CG-OG1 3.27Å; F517-T579 WeakPolarHBondContact O-CG2 3.3Å; F520-T579 HydrophobicContact CB-CG2 3.86Å; F520-T579 HydrophobicContact CD2-CG2 4.18Å; F520-T579 HydrophobicContact CG-CG2 4.26Å; E575-T579 WeakPolarHBondContact O-CB 3.42Å; E575-T579 PolarHBondContact O-N 3.19Å; E575-T579 PolarHBondContact O-OG1 3.49Å; I576-T579 WeakPolarHBondContact O-CB 3.38Å; I576-T579 PolarHBondContact O-N 3.42Å; I576-T579 VanDerWaalsContact O-N 3.16Å; Y577-T579 VanDerWaalsContact C-N 3.31Å; Y577-T579 PolarHBondContact O-N 2.74Å; T579-S583 WeakPolarHBondContact O-CB 3.38Å; T579-S583 PolarHBondContact O-N 3.16Å; T579-S583 PolarHBondContact O-OG 2.91Å
580	M	98	Very high	96.8	Very high	109 Å²	109	40.6 Å²	40.6	54%	0.537	21%	0.205	S	C	.	.	H	α-helix	trans	-62.7	-47.6	178	-68.9	175.9	70.1	0	0	112	I576 Y577 S583 L584	I576-M580 HydrophobicContact CG2-SD 4.36Å; I576-M580 WeakPolarHBondContact O-CG 3.32Å; I576-M580 PolarHBondContact O-N 2.89Å; Y577-M580 PolarHBondContact O-N 2.74Å; M580-S583 PolarHBondContact O-N 3.07Å; M580-L584 WeakPolarHBondContact O-CG 3.3Å; M580-L584 PolarHBondContact O-N 3.31Å
581	L	98.2	Very high	96.7	Very high	36 Å²	36	41.5 Å²	41.5	19%	0.188	21%	0.207	C	C	.	.	H	α-helix	trans	-66.7	-43.7	-178.9	-69.4	166.8	0	0	0	112	F565 A568 L569 A572 Y577 A578 S583 L584 A585	F565-L581 HydrophobicContact CD1-CD2 3.83Å; F565-L581 HydrophobicContact CE1-CD2 4.35Å; A568-L581 HydrophobicContact CB-CD1 4.16Å; A568-L581 HydrophobicContact CB-CD2 3.96Å; L569-L581 HydrophobicContact CD1-CB 4.5Å; A572-L581 HydrophobicContact CB-CD1 4.03Å; Y577-L581 WeakPolarHBondContact O-CB 3.17Å; Y577-L581 VanDerWaalsContact O-CG 3.29Å; Y577-L581 WeakPolarHBondContact O-CG 3.11Å; Y577-L581 PolarHBondContact O-N 2.8Å; A578-L581 PolarHBondContact O-N 3.08Å; L581-S583 VanDerWaalsContact C-N 3.3Å; L581-S583 PolarHBondContact O-N 3.16Å; L581-L584 PolarHBondContact O-N 3.39Å; L581-A585 WeakPolarHBondContact O-CB 3.41Å; L581-A585 PolarHBondContact O-N 3.09Å
582	L	97.7	Very high	96.7	Very high	1 Å²	1	34.7 Å²	34.7	1%	0.005	18%	0.18	C	C	.	.	H	α-helix	trans	-64.6	-35.7	174.8	-175.6	60.8	0	0	0	111.6	M499 Y503 L518 P521 F566 L569 A578 A585 L586	M499-L582 HydrophobicContact CB-CD2 4.38Å; M499-L582 HydrophobicContact CG-CD2 3.84Å; M499-L582 HydrophobicContact SD-CD2 4.08Å; Y503-L582 HydrophobicContact CE2-CD2 4.45Å; L518-L582 HydrophobicContact CD2-CD2 3.96Å; P521-L582 HydrophobicContact CB-CD2 4.36Å; P521-L582 HydrophobicContact CB-CG 3.96Å; P521-L582 HydrophobicContact CG-CB 4.06Å; P521-L582 HydrophobicContact CG-CD2 3.76Å; P521-L582 HydrophobicContact CG-CG 3.65Å; F566-L582 HydrophobicContact CZ-CD1 4.46Å; L569-L582 HydrophobicContact CD1-CB 4.41Å; L569-L582 HydrophobicContact CD2-CB 4.15Å; L569-L582 HydrophobicContact CD2-CD1 3.91Å; L569-L582 HydrophobicContact CD2-CG 4.49Å; A578-L582 WeakPolarHBondContact O-CB 3.42Å; A578-L582 PolarHBondContact O-N 2.82Å; L582-A585 PolarHBondContact O-N 3.33Å; L582-L586 HydrophobicContact CD1-CD1 4.03Å; L582-L586 WeakPolarHBondContact O-CB 3.34Å; L582-L586 PolarHBondContact O-N 2.8Å
583	S	97.9	Very high	96.7	Very high	17 Å²	17	34.3 Å²	34.3	12%	0.119	18%	0.177	C	C	.	.	H	α-helix	trans	-68.8	-39.1	175.7	-59.9	0	0	0	0	112.9	P521 S524 T579 M580 L581 G587	P521-S583 WeakPolarHBondContact CD-OG 3.15Å; S524-S583 VanDerWaalsContact CB-O 3.29Å; S524-S583 WeakPolarHBondContact CB-O 3.42Å; S524-S583 PolarHBondContact OG-O 3.34Å; T579-S583 WeakPolarHBondContact O-CB 3.38Å; T579-S583 PolarHBondContact O-N 3.16Å; T579-S583 PolarHBondContact O-OG 2.91Å; M580-S583 PolarHBondContact O-N 3.07Å; L581-S583 VanDerWaalsContact C-N 3.3Å; L581-S583 PolarHBondContact O-N 3.16Å; S583-G587 PolarHBondContact O-N 3.45Å
584	L	98	Very high	96.7	Very high	69 Å²	69	29.3 Å²	29.3	36%	0.361	14%	0.144	S	C	.	.	H	α-helix	trans	-65.7	-45.2	172.4	-70.9	167.9	0	0	0	110.8	F565 M580 L581 L586 G587 F588	F565-L584 HydrophobicContact CD1-CB 4.15Å; F565-L584 HydrophobicContact CD1-CD1 4.38Å; F565-L584 HydrophobicContact CD2-CB 3.92Å; F565-L584 HydrophobicContact CE1-CB 4.09Å; F565-L584 HydrophobicContact CE1-CD1 3.8Å; F565-L584 HydrophobicContact CE2-CB 3.88Å; F565-L584 HydrophobicContact CG-CB 4.09Å; F565-L584 HydrophobicContact CZ-CB 3.96Å; F565-L584 HydrophobicContact CZ-CD1 4.02Å; F565-L584 HydrophobicContact CZ-CG 4.49Å; M580-L584 WeakPolarHBondContact O-CG 3.3Å; M580-L584 PolarHBondContact O-N 3.31Å; L581-L584 PolarHBondContact O-N 3.39Å; L584-L586 PolarHBondContact O-N 3.48Å; L584-G587 PolarHBondContact O-N 3.22Å; L584-F588 HydrophobicContact CD2-CE2 4.28Å; L584-F588 VanDerWaalsContact O-CD2 3.25Å; L584-F588 WeakPolarHBondContact O-CD2 3.48Å; L584-F588 PolarHBondContact O-N 2.89Å
585	A	98	Very high	96.6	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-55	-49.6	176	0	0	0	0	0	112.2	K562 F565 F566 L581 L582 S589	K562-A585 HydrophobicContact CG-CB 4.31Å; F565-A585 HydrophobicContact CB-CB 3.72Å; F566-A585 HydrophobicContact CD2-CB 3.82Å; F566-A585 HydrophobicContact CE2-CB 3.88Å; L581-A585 WeakPolarHBondContact O-CB 3.41Å; L581-A585 PolarHBondContact O-N 3.09Å; L582-A585 PolarHBondContact O-N 3.33Å; A585-S589 WeakPolarHBondContact O-CB 3.34Å; A585-S589 PolarHBondContact O-N 3.41Å
586	L	96.9	Very high	96.6	Very high	1 Å²	1	26.6 Å²	26.6	1%	0.005	13%	0.128	C	C	.	.	H	α-helix	trans	-72.2	-31.5	179.7	-102.2	67.4	0	0	0	113.1	S495 P521 F522 R525 L582 L584 S589 G590	S495-L586 WeakPolarHBondContact OG-CD1 3.19Å; P521-L586 HydrophobicContact CB-CB 4.26Å; P521-L586 HydrophobicContact CB-CD2 3.75Å; P521-L586 HydrophobicContact CB-CG 4.5Å; P521-L586 WeakPolarHBondContact O-CB 3.46Å; F522-L586 HydrophobicContact CD1-CD2 3.99Å; F522-L586 HydrophobicContact CE1-CD2 3.94Å; R525-L586 HydrophobicContact CB-CB 4.14Å; R525-L586 WeakPolarHBondContact CB-O 3.42Å; R525-L586 WeakPolarHBondContact CG-O 3.36Å; L582-L586 HydrophobicContact CD1-CD1 4.03Å; L582-L586 WeakPolarHBondContact O-CB 3.34Å; L582-L586 PolarHBondContact O-N 2.8Å; L584-L586 PolarHBondContact O-N 3.48Å; L586-S589 VanDerWaalsContact O-CB 3.28Å; L586-S589 WeakPolarHBondContact O-CB 3.4Å; L586-S589 PolarHBondContact O-N 2.86Å; L586-G590 PolarHBondContact O-N 3.12Å
587	G	97.3	Very high	96.6	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-62.7	-54.5	171.8	0	0	0	0	0	112.2	S524 F528 S583 L584 S589 G590 L591	S524-G587 WeakPolarHBondContact OG-CA 3.23Å; F528-G587 WeakPolarHBondContact CB-O 3.37Å; F528-G587 WeakPolarHBondContact CD1-O 3.37Å; F528-G587 WeakPolarHBondContact CG-O 3.25Å; S583-G587 PolarHBondContact O-N 3.45Å; L584-G587 PolarHBondContact O-N 3.22Å; G587-S589 PolarHBondContact O-N 3.46Å; G587-G590 WeakPolarHBondContact O-CA 3.38Å; G587-G590 PolarHBondContact O-N 3.17Å; G587-L591 PolarHBondContact O-N 3.43Å
588	F	96.4	Very high	96.5	Very high	48 Å²	48	15.9 Å²	15.9	21%	0.211	8%	0.081	C	C	.	.	H	α-helix	trans	-63.1	-31.4	175.9	-75.3	-70.3	0	0	0	112.5	G558 L561 F565 L584 G590 L591 A592	G558-F588 WeakPolarHBondContact CA-O 3.15Å; L561-F588 HydrophobicContact CB-CB 4.09Å; L561-F588 HydrophobicContact CB-CD1 4.31Å; L561-F588 HydrophobicContact CB-CD2 4.17Å; L561-F588 HydrophobicContact CB-CG 3.92Å; L561-F588 HydrophobicContact CD1-CD1 3.44Å; L561-F588 VanDerWaalsContact CD1-CD1 3.44Å; L561-F588 HydrophobicContact CD1-CD2 4.28Å; L561-F588 HydrophobicContact CD1-CE1 3.46Å; L561-F588 VanDerWaalsContact CD1-CE1 3.46Å; L561-F588 HydrophobicContact CD1-CE2 4.29Å; L561-F588 HydrophobicContact CD1-CG 3.89Å; L561-F588 HydrophobicContact CD1-CZ 3.91Å; F565-F588 HydrophobicContact CD2-CD2 4.12Å; F565-F588 AromaticContact CE2-CD2 3.54Å; F565-F588 HydrophobicContact CE2-CD2 3.54Å; F565-F588 AromaticContact CE2-CE2 3.7Å; F565-F588 HydrophobicContact CE2-CE2 3.7Å; F565-F588 HydrophobicContact CZ-CE2 4.29Å; L584-F588 HydrophobicContact CD2-CE2 4.28Å; L584-F588 VanDerWaalsContact O-CD2 3.25Å; L584-F588 WeakPolarHBondContact O-CD2 3.48Å; L584-F588 PolarHBondContact O-N 2.89Å; F588-G590 VanDerWaalsContact C-N 3.26Å; F588-G590 PolarHBondContact O-N 3.19Å; F588-L591 HydrophobicContact CD1-CD1 3.81Å; F588-L591 HydrophobicContact CE1-CD1 4.07Å; F588-L591 PolarHBondContact O-N 3.45Å; F588-A592 PolarHBondContact O-N 2.96Å; F588-A592 VanDerWaalsContact O-N 3.13Å
589	S	95.1	Very high	96.4	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-59.1	-36	167.3	-149.1	0	0	0	0	113.2	D488 R525 K562 A585 L586 G587 A592	D488-S589 PolarHBondContact OD1-OG 3.31Å; R525-S589 PolarHBondContact NH1-OG 3.38Å; K562-S589 VanDerWaalsContact CD-OG 3.27Å; K562-S589 WeakPolarHBondContact CD-OG 3.05Å; K562-S589 WeakPolarHBondContact CE-OG 3.47Å; K562-S589 PolarHBondContact NZ-OG 3.33Å; A585-S589 WeakPolarHBondContact O-CB 3.34Å; A585-S589 PolarHBondContact O-N 3.41Å; L586-S589 VanDerWaalsContact O-CB 3.28Å; L586-S589 WeakPolarHBondContact O-CB 3.4Å; L586-S589 PolarHBondContact O-N 2.86Å; G587-S589 PolarHBondContact O-N 3.46Å; S589-A592 WeakPolarHBondContact O-CB 3.47Å; S589-A592 PolarHBondContact O-N 3.07Å
590	G	95	Very high	96.3	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-64.5	-39.9	174.8	0	0	0	0	0	112.7	V529 L586 G587 F588 A592 V593	V529-G590 WeakPolarHBondContact CA-O 3.36Å; V529-G590 VanDerWaalsContact CG2-CA 3.42Å; L586-G590 PolarHBondContact O-N 3.12Å; G587-G590 WeakPolarHBondContact O-CA 3.38Å; G587-G590 PolarHBondContact O-N 3.17Å; F588-G590 VanDerWaalsContact C-N 3.26Å; F588-G590 PolarHBondContact O-N 3.19Å; G590-A592 VanDerWaalsContact C-N 3.3Å; G590-A592 PolarHBondContact O-N 3.24Å; G590-V593 WeakPolarHBondContact O-CB 3.19Å; G590-V593 PolarHBondContact O-N 3.16Å
591	L	95.1	Very high	96.2	Very high	32 Å²	32	10.2 Å²	10.2	17%	0.168	5%	0.053	C	C	.	.	H	α-helix	trans	-64.9	-33.3	173.3	-65.2	172.5	0	0	0	112.2	F528 I531 G532 F554 G587 F588 V593 A594	F528-L591 HydrophobicContact CB-CG 4.33Å; F528-L591 HydrophobicContact CD1-CD1 3.85Å; F528-L591 HydrophobicContact CD1-CD2 4.47Å; F528-L591 HydrophobicContact CD1-CG 3.88Å; F528-L591 HydrophobicContact CE1-CD1 4.33Å; F528-L591 WeakPolarHBondContact O-CD2 3.41Å; I531-L591 HydrophobicContact CG2-CD2 4.27Å; G532-L591 VanDerWaalsContact CA-CD2 3.5Å; F554-L591 HydrophobicContact CD1-CB 4.38Å; F554-L591 HydrophobicContact CE1-CD2 4.44Å; G587-L591 PolarHBondContact O-N 3.43Å; F588-L591 HydrophobicContact CD1-CD1 3.81Å; F588-L591 HydrophobicContact CE1-CD1 4.07Å; F588-L591 PolarHBondContact O-N 3.45Å; L591-V593 PolarHBondContact O-N 2.96Å; L591-A594 PolarHBondContact O-N 3.01Å
592	A	96.4	Very high	95.9	Very high	0 Å²	0	8.8 Å²	8.8	0%	0	5%	0.045	C	C	.	.	H	α-helix	trans	-58.8	-33.9	177.2	0	0	0	0	0	112.8	F559 F588 S589 G590 A594 G595 Y596	F559-A592 HydrophobicContact CD2-CB 4.2Å; F559-A592 HydrophobicContact CE2-CB 4.07Å; F559-A592 HydrophobicContact CZ-CB 4.47Å; F588-A592 PolarHBondContact O-N 2.96Å; F588-A592 VanDerWaalsContact O-N 3.13Å; S589-A592 WeakPolarHBondContact O-CB 3.47Å; S589-A592 PolarHBondContact O-N 3.07Å; G590-A592 VanDerWaalsContact C-N 3.3Å; G590-A592 PolarHBondContact O-N 3.24Å; A592-A594 PolarHBondContact O-N 2.84Å; A592-G595 WeakPolarHBondContact O-CA 3.45Å; A592-G595 PolarHBondContact O-N 3.05Å; A592-Y596 HydrophobicContact CB-CD1 4.06Å; A592-Y596 HydrophobicContact CB-CE1 4.04Å; A592-Y596 WeakPolarHBondContact O-CD1 3.21Å; A592-Y596 PolarHBondContact O-N 3.49Å
593	V	96.3	Very high	95.7	Very high	3 Å²	3	8.7 Å²	8.7	2%	0.018	5%	0.045	C	C	.	.	H	α-helix	trans	-55.6	-40.3	-179.1	-179.7	0	0	0	0	111.6	V387 V529 G590 L591 G595 Y596 A597	V387-V593 HydrophobicContact CG2-CG1 3.48Å; V387-V593 VanDerWaalsContact CG2-CG1 3.48Å; V529-V593 HydrophobicContact CG1-CB 4.4Å; V529-V593 HydrophobicContact CG1-CG1 4.2Å; V529-V593 HydrophobicContact CG2-CB 4.41Å; V529-V593 HydrophobicContact CG2-CG2 3.98Å; G590-V593 WeakPolarHBondContact O-CB 3.19Å; G590-V593 PolarHBondContact O-N 3.16Å; L591-V593 PolarHBondContact O-N 2.96Å; V593-G595 PolarHBondContact O-N 3.11Å; V593-G595 VanDerWaalsContact O-N 3.15Å; V593-Y596 HydrophobicContact CB-CE1 4.41Å; V593-Y596 HydrophobicContact CG2-CE1 4.11Å; V593-A597 HydrophobicContact CG1-CB 3.79Å; V593-A597 WeakPolarHBondContact O-CB 3.41Å; V593-A597 PolarHBondContact O-N 3.38Å; V593-A597 VanDerWaalsContact O-N 3.12Å
594	A	95.1	Very high	95.4	Very high	0 Å²	0	7.9 Å²	7.9	0%	0	4%	0.039	C	C	.	.	H	α-helix	trans	-64	-16.3	176.2	0	0	0	0	0	113.4	G532 A536 H551 F554 L591 A592 V598	G532-A594 WeakPolarHBondContact O-CB 3.37Å; A536-A594 HydrophobicContact CB-CB 4.2Å; H551-A594 PolarHBondContact CD2-O 3.18Å; F554-A594 HydrophobicContact CB-CB 4.49Å; F554-A594 HydrophobicContact CD1-CB 4.18Å; F554-A594 HydrophobicContact CG-CB 4.33Å; L591-A594 PolarHBondContact O-N 3.01Å; A592-A594 PolarHBondContact O-N 2.84Å; A594-V598 VanDerWaalsContact O-CG2 3.28Å; A594-V598 WeakPolarHBondContact O-CG2 3.49Å
595	G	94.2	Very high	95	Very high	0 Å²	0	5.1 Å²	5.1	0%	0	3%	0.025	C	C	.	.	H	α-helix	trans	-92.7	-65.5	170.5	0	0	0	0	0	113.3	H551 A592 V593 N599 Y663	H551-G595 WeakPolarHBondContact O-CA 3.31Å; A592-G595 WeakPolarHBondContact O-CA 3.45Å; A592-G595 PolarHBondContact O-N 3.05Å; V593-G595 PolarHBondContact O-N 3.11Å; V593-G595 VanDerWaalsContact O-N 3.15Å; G595-N599 WeakPolarHBondContact O-CB 3.47Å; G595-Y663 PolarHBondContact O-OH 3.11Å; G595-Y663 VanDerWaalsContact O-OH 3.08Å
596	Y	95.4	Very high	94.6	Very high	6 Å²	6	5.2 Å²	5.2	2%	0.024	3%	0.026	C	C	.	.	H	α-helix	trans	-81.6	-34.4	-166.4	77.6	-89.9	0	0	0	114.2	T484 Y485 D488 F559 A592 V593	T484-Y596 WeakPolarHBondContact OG1-CB 3.31Å; Y485-Y596 AromaticContact CD1-CE2 3.8Å; Y485-Y596 HydrophobicContact CD1-CE2 3.8Å; Y485-Y596 AromaticContact CD2-CD2 3.76Å; Y485-Y596 HydrophobicContact CD2-CD2 3.76Å; Y485-Y596 AromaticContact CD2-CE2 3.83Å; Y485-Y596 HydrophobicContact CD2-CE2 3.83Å; Y485-Y596 HydrophobicContact CE1-CD2 4.41Å; Y485-Y596 AromaticContact CE1-CE2 3.62Å; Y485-Y596 HydrophobicContact CE1-CE2 3.62Å; Y485-Y596 AromaticContact CE2-CD2 3.64Å; Y485-Y596 HydrophobicContact CE2-CD2 3.64Å; Y485-Y596 AromaticContact CE2-CE2 3.7Å; Y485-Y596 HydrophobicContact CE2-CE2 3.7Å; Y485-Y596 HydrophobicContact CG-CD2 4.24Å; Y485-Y596 AromaticContact CG-CE2 3.89Å; Y485-Y596 HydrophobicContact CG-CE2 3.89Å; Y485-Y596 AromaticContact CZ-CD2 3.99Å; Y485-Y596 AromaticContact CZ-CE2 3.59Å; D488-Y596 PolarHBondContact OD2-OH 3.1Å; F559-Y596 AromaticContact CE2-CD1 3.64Å; F559-Y596 HydrophobicContact CE2-CD1 3.64Å; F559-Y596 HydrophobicContact CE2-CE1 4.24Å; F559-Y596 HydrophobicContact CE2-CG 4.17Å; F559-Y596 AromaticContact CZ-CD1 3.78Å; F559-Y596 HydrophobicContact CZ-CD1 3.78Å; F559-Y596 AromaticContact CZ-CE1 3.97Å; F559-Y596 HydrophobicContact CZ-CE1 3.97Å; F559-Y596 HydrophobicContact CZ-CG 4.33Å; A592-Y596 HydrophobicContact CB-CD1 4.06Å; A592-Y596 HydrophobicContact CB-CE1 4.04Å; A592-Y596 WeakPolarHBondContact O-CD1 3.21Å; A592-Y596 PolarHBondContact O-N 3.49Å; V593-Y596 HydrophobicContact CB-CE1 4.41Å; V593-Y596 HydrophobicContact CG2-CE1 4.11Å
597	A	95.3	Very high	94.4	Very high	1 Å²	1	5.2 Å²	5.2	1%	0.008	3%	0.026	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-44.1	-177.4	0	0	0	0	0	111.2	F367 V383 Y485 V593 N599 V600	F367-A597 WeakPolarHBondContact CE1-O 3.32Å; F367-A597 HydrophobicContact CZ-CB 4.33Å; V383-A597 HydrophobicContact CG1-CB 4.35Å; Y485-A597 WeakPolarHBondContact OH-CB 3.47Å; V593-A597 HydrophobicContact CG1-CB 3.79Å; V593-A597 WeakPolarHBondContact O-CB 3.41Å; V593-A597 PolarHBondContact O-N 3.38Å; V593-A597 VanDerWaalsContact O-N 3.12Å; A597-N599 PolarHBondContact O-N 3.3Å; A597-V600 WeakPolarHBondContact O-CB 3.44Å; A597-V600 WeakPolarHBondContact O-CG2 3.3Å; A597-V600 PolarHBondContact O-N 3.44Å
598	V	95.3	Very high	94.3	Very high	1 Å²	1	5.2 Å²	5.2	1%	0.006	3%	0.026	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-37.5	176.1	-169.7	0	0	0	0	111.3	R379 V383 A594 V600 I601 D602	R379-V598 HydrophobicContact CB-CG1 4.5Å; R379-V598 HydrophobicContact CG-CG1 3.95Å; V383-V598 HydrophobicContact CB-CG2 4.25Å; V383-V598 HydrophobicContact CG1-CG2 4.21Å; A594-V598 VanDerWaalsContact O-CG2 3.28Å; A594-V598 WeakPolarHBondContact O-CG2 3.49Å; V598-V600 PolarHBondContact O-N 3.08Å; V598-V600 VanDerWaalsContact O-N 3.17Å; V598-I601 PolarHBondContact O-N 3.39Å; V598-I601 VanDerWaalsContact O-N 3.16Å; V598-D602 PolarHBondContact O-N 3.42Å
599	N	95.5	Very high	94.2	Very high	0 Å²	0	3 Å²	3	0%	0	2%	0.016	C	C	.	.	H	α-helix	trans	-61.8	-24.4	-177.7	-161.2	24.5	0	0	0	114.3	I481 G595 A597 I601 D602 L603 Y663 S668 S669	I481-N599 HydrophobicContact CD1-CB 4.46Å; G595-N599 WeakPolarHBondContact O-CB 3.47Å; A597-N599 PolarHBondContact O-N 3.3Å; N599-I601 VanDerWaalsContact C-N 3.28Å; N599-I601 PolarHBondContact O-N 2.82Å; N599-D602 PolarHBondContact O-N 3.43Å; N599-L603 WeakPolarHBondContact O-CB 3.49Å; N599-L603 PolarHBondContact O-N 3.05Å; N599-Y663 VanDerWaalsContact CB-OH 3.3Å; N599-Y663 WeakPolarHBondContact CB-OH 3.42Å; N599-Y663 PolarHBondContact ND2-OH 3.27Å; N599-S668 PolarHBondContact ND2-O 3.16Å; N599-S668 PolarHBondContact OD1-O 2.98Å; N599-S669 VanDerWaalsContact CG-OG 3.27Å; N599-S669 WeakPolarHBondContact OD1-CA 3.43Å; N599-S669 VanDerWaalsContact OD1-CB 3.24Å; N599-S669 WeakPolarHBondContact OD1-CB 3.37Å; N599-S669 PolarHBondContact OD1-OG 3.18Å
600	V	95.6	Very high	94.2	Very high	0 Å²	0	3 Å²	3	0%	0	2%	0.016	C	C	.	.	H	α-helix	trans	-58.7	-40.8	176	-176.8	0	0	0	0	111.6	F367 I481 Y485 A597 V598 S608 V611 M612	F367-V600 HydrophobicContact CD1-CB 4.1Å; F367-V600 HydrophobicContact CD1-CG1 4.12Å; F367-V600 HydrophobicContact CE1-CB 4.09Å; F367-V600 HydrophobicContact CE1-CG2 4.38Å; I481-V600 HydrophobicContact CD1-CG2 4.23Å; I481-V600 HydrophobicContact CG2-CG2 3.84Å; Y485-V600 HydrophobicContact CE2-CG2 3.96Å; A597-V600 WeakPolarHBondContact O-CB 3.44Å; A597-V600 WeakPolarHBondContact O-CG2 3.3Å; A597-V600 PolarHBondContact O-N 3.44Å; V598-V600 PolarHBondContact O-N 3.08Å; V598-V600 VanDerWaalsContact O-N 3.17Å; V600-S608 VanDerWaalsContact CG1-O 3.3Å; V600-S608 WeakPolarHBondContact CG1-O 3.41Å; V600-V611 HydrophobicContact CG1-CB 4.2Å; V600-V611 HydrophobicContact CG1-CG1 4.15Å; V600-M612 HydrophobicContact CG1-CB 4.27Å
601	I	94.6	Very high	94.3	Very high	0 Å²	0	3.1 Å²	3.1	0%	0	2%	0.017	C	C	.	.	H	α-helix	trans	-79.2	-35	-179.8	-56.8	-175.7	0	0	0	110.8	F367 L370 R371 V383 V598 N599 P605	F367-I601 HydrophobicContact CD1-CD1 4.07Å; F367-I601 HydrophobicContact CD1-CG1 3.84Å; F367-I601 HydrophobicContact CE1-CD1 4.47Å; F367-I601 HydrophobicContact CE1-CG1 4.32Å; L370-I601 HydrophobicContact CB-CD1 3.67Å; R371-I601 HydrophobicContact CB-CG2 4.35Å; V383-I601 HydrophobicContact CG2-CD1 3.65Å; V598-I601 PolarHBondContact O-N 3.39Å; V598-I601 VanDerWaalsContact O-N 3.16Å; N599-I601 VanDerWaalsContact C-N 3.28Å; N599-I601 PolarHBondContact O-N 2.82Å; I601-P605 WeakPolarHBondContact O-CA 3.35Å; I601-P605 WeakPolarHBondContact O-CD 3.47Å; I601-P605 VanDerWaalsContact O-CG 3.25Å; I601-P605 WeakPolarHBondContact O-CG 3.4Å
602	D	92.7	Very high	94.3	Very high	5 Å²	5	1.6 Å²	1.6	3%	0.027	1%	0.009	C	C	.	.	H	α-helix	trans	-70.1	-37.6	179.3	-95.9	15.8	0	0	0	113.5	R379 R547 H551 V598 N599	R379-D602 WeakPolarHBondContact CD-OD1 3.49Å; R379-D602 IonicContact CZ-OD1 3.41Å; R379-D602 IonicContact NE-OD1 3.72Å; R379-D602 IonicContact NH1-OD1 3.83Å; R379-D602 PolarHBondContact NH1-OD1 3.06Å; R547-D602 WeakPolarHBondContact CD-OD2 3.36Å; R547-D602 IonicContact CZ-OD2 3.69Å; R547-D602 IonicContact NE-OD2 3.19Å; R547-D602 IonicContact NH1-OD1 2.71Å; R547-D602 PolarHBondContact NH1-OD1 3.03Å; R547-D602 IonicContact NH1-OD2 3.23Å; R547-D602 PolarHBondContact NH1-OD2 3.17Å; H551-D602 IonicContact CE1-OD2 2.71Å; H551-D602 PolarHBondContact CE1-OD2 3.19Å; V598-D602 PolarHBondContact O-N 3.42Å; N599-D602 PolarHBondContact O-N 3.43Å
603	L	92.8	Very high	94.3	Very high	0 Å²	0	1.6 Å²	1.6	0%	0	1%	0.009	C	C	.	.	H	α-helix	trans	-71.9	-45.6	-177.3	-174.6	71	0	0	0	112.4	P477 V478 I481 N599 Q672	P477-L603 HydrophobicContact CB-CD1 3.46Å; P477-L603 VanDerWaalsContact CB-CD1 3.46Å; P477-L603 HydrophobicContact CB-CD2 3.74Å; P477-L603 HydrophobicContact CB-CG 4.27Å; P477-L603 HydrophobicContact CG-CD1 4.05Å; V478-L603 HydrophobicContact CG2-CD2 3.8Å; I481-L603 HydrophobicContact CD1-CD2 3.74Å; N599-L603 WeakPolarHBondContact O-CB 3.49Å; N599-L603 PolarHBondContact O-N 3.05Å; L603-Q672 HydrophobicContact CD1-CG 3.47Å; L603-Q672 VanDerWaalsContact CD1-CG 3.47Å; L603-Q672 HydrophobicContact CG-CG 3.76Å; L603-Q672 PolarHBondContact O-N 3.21Å
604	A	91.7	Very high	94.4	Very high	0 Å²	0	3.7 Å²	3.7	0%	0	2%	0.018	C	C	.	.			trans	-146.4	74.1	-174.7	0	0	0	0	0	112.5	N606 F607 S608 W674 A675	A604-N606 VanDerWaalsContact C-N 3.3Å; A604-N606 PolarHBondContact O-N 2.92Å; A604-N606 VanDerWaalsContact O-N 3.14Å; A604-F607 HydrophobicContact CB-CB 4.3Å; A604-F607 CarbonylContact O-C 3.39Å; A604-F607 PolarHBondContact O-N 3.25Å; A604-S608 PolarHBondContact O-N 2.85Å; A604-W674 HydrophobicContact CB-CE3 4.45Å; A604-W674 HydrophobicContact CB-CH2 3.76Å; A604-W674 HydrophobicContact CB-CZ3 3.5Å; A604-W674 VanDerWaalsContact CB-CZ3 3.5Å; A604-A675 HydrophobicContact CB-CB 4.39Å
605	P	90.3	Very high	94.4	Very high	10 Å²	10	3.7 Å²	3.7	7%	0.065	2%	0.018	C	C	.	.	G	3₁₀ helix	trans	-51.9	-40.8	-173.6	-26.5	30.4	0	0	0	115	R371 L458 I601 F607	R371-P605 VanDerWaalsContact CB-O 3.28Å; R371-P605 WeakPolarHBondContact CB-O 3.49Å; R371-P605 WeakPolarHBondContact CD-O 3.4Å; L458-P605 HydrophobicContact CD1-CB 4.15Å; L458-P605 HydrophobicContact CD2-CB 4.29Å; I601-P605 WeakPolarHBondContact O-CA 3.35Å; I601-P605 WeakPolarHBondContact O-CD 3.47Å; I601-P605 VanDerWaalsContact O-CG 3.25Å; I601-P605 WeakPolarHBondContact O-CG 3.4Å; P605-F607 VanDerWaalsContact C-N 3.32Å; P605-F607 PolarHBondContact O-N 2.95Å
606	N	89.8	Confident	94.5	Very high	3 Å²	3	3.9 Å²	3.9	2%	0.016	2%	0.019	C	C	.	.	G	3₁₀ helix	trans	-72.4	-26.6	-178.8	-159.4	40.3	0	0	0	112.9	R371 L458 N461 T465 A604 A675 Y676	R371-N606 PolarHBondContact NH1-O 2.78Å; L458-N606 VanDerWaalsContact CD1-CA 3.5Å; L458-N606 HydrophobicContact CD1-CB 3.91Å; N461-N606 PolarHBondContact ND2-ND2 3.42Å; N461-N606 VanDerWaalsContact ND2-ND2 3.14Å; N461-N606 PolarHBondContact ND2-OD1 2.87Å; T465-N606 VanDerWaalsContact CG2-ND2 3.3Å; T465-N606 WeakPolarHBondContact CG2-ND2 3.36Å; A604-N606 VanDerWaalsContact C-N 3.3Å; A604-N606 PolarHBondContact O-N 2.92Å; A604-N606 VanDerWaalsContact O-N 3.14Å; N606-A675 WeakPolarHBondContact CB-O 3.46Å; N606-Y676 HydrophobicContact CB-CD1 4.04Å; N606-Y676 HydrophobicContact CB-CE1 4.19Å
607	F	92.9	Very high	94.5	Very high	1 Å²	1	4.5 Å²	4.5	0%	0.004	2%	0.024	C	C	.	.	G	3₁₀ helix	trans	-112.6	18.1	-175.7	-56.7	-72.4	0	0	0	112.8	V309 T465 I467 P468 A604 P605 G609 L610 V611 W674	V309-F607 HydrophobicContact CG1-CD1 4.16Å; V309-F607 HydrophobicContact CG1-CE1 3.99Å; V309-F607 HydrophobicContact CG2-CD1 4.11Å; T465-F607 HydrophobicContact CG2-CE1 3.48Å; T465-F607 VanDerWaalsContact CG2-CE1 3.48Å; T465-F607 HydrophobicContact CG2-CZ 3.43Å; T465-F607 VanDerWaalsContact CG2-CZ 3.43Å; I467-F607 HydrophobicContact CB-CE1 4.47Å; I467-F607 HydrophobicContact CG1-CE1 4.03Å; P468-F607 HydrophobicContact CG-CE2 4.25Å; P468-F607 HydrophobicContact CG-CZ 4.33Å; A604-F607 HydrophobicContact CB-CB 4.3Å; A604-F607 CarbonylContact O-C 3.39Å; A604-F607 PolarHBondContact O-N 3.25Å; P605-F607 VanDerWaalsContact C-N 3.32Å; P605-F607 PolarHBondContact O-N 2.95Å; F607-G609 PolarHBondContact O-N 3.35Å; F607-L610 HydrophobicContact CB-CB 4.35Å; F607-L610 HydrophobicContact CB-CD2 4.47Å; F607-L610 HydrophobicContact CD1-CD2 4.12Å; F607-L610 WeakPolarHBondContact O-CB 3.4Å; F607-L610 PolarHBondContact O-N 2.95Å; F607-V611 PolarHBondContact O-N 3.37Å; F607-W674 HydrophobicContact CD2-CE3 4.25Å; F607-W674 HydrophobicContact CD2-CZ3 4.25Å; F607-W674 VanDerWaalsContact CE2-O 3.3Å; F607-W674 WeakPolarHBondContact CE2-O 3.26Å
608	S	94.3	Very high	94.6	Very high	0 Å²	0	7 Å²	7	0%	0	4%	0.039	C	C	.	.	H	α-helix	trans	-55.5	-48.4	-175	59.7	0	0	0	0	112.6	F367 R371 V600 A604 L610 M612	F367-S608 PolarHBondContact O-OG 2.91Å; R371-S608 WeakPolarHBondContact CD-OG 3.41Å; V600-S608 VanDerWaalsContact CG1-O 3.3Å; V600-S608 WeakPolarHBondContact CG1-O 3.41Å; A604-S608 PolarHBondContact O-N 2.85Å; S608-L610 PolarHBondContact O-N 3.46Å; S608-M612 WeakPolarHBondContact O-CB 3.42Å; S608-M612 PolarHBondContact O-N 3.44Å
609	G	94.5	Very high	94.7	Very high	0 Å²	0	7.2 Å²	7.2	0%	0	4%	0.04	C	C	.	.	H	α-helix	trans	-66.4	-33.5	176.9	0	0	0	0	0	113.2	G305 T308 P364 F607 G613	G305-G609 WeakPolarHBondContact CA-O 3.25Å; T308-G609 WeakPolarHBondContact OG1-CA 3.31Å; P364-G609 WeakPolarHBondContact O-CA 3.43Å; F607-G609 PolarHBondContact O-N 3.35Å; G609-G613 PolarHBondContact O-N 3.36Å
610	L	95.4	Very high	94.6	Very high	1 Å²	1	7.4 Å²	7.4	1%	0.005	4%	0.042	C	C	.	.	H	α-helix	trans	-66.2	-51.8	174.8	179.9	68.7	0	0	0	111.7	G305 V309 I467 W469 I472 F607 S608 M612 G613 F614	G305-L610 PolarHBondContact O-N 3.43Å; V309-L610 HydrophobicContact CG2-CB 3.88Å; V309-L610 HydrophobicContact CG2-CD2 4.31Å; I467-L610 HydrophobicContact CD1-CD2 4.2Å; I467-L610 HydrophobicContact CG2-CD2 3.61Å; W469-L610 HydrophobicContact CH2-CD1 4.1Å; W469-L610 HydrophobicContact CZ3-CD1 4.21Å; W469-L610 HydrophobicContact CZ3-CD2 4.43Å; I472-L610 HydrophobicContact CD1-CD2 3.89Å; F607-L610 HydrophobicContact CB-CB 4.35Å; F607-L610 HydrophobicContact CB-CD2 4.47Å; F607-L610 HydrophobicContact CD1-CD2 4.12Å; F607-L610 WeakPolarHBondContact O-CB 3.4Å; F607-L610 PolarHBondContact O-N 2.95Å; S608-L610 PolarHBondContact O-N 3.46Å; L610-M612 VanDerWaalsContact C-N 3.28Å; L610-M612 PolarHBondContact O-N 3.09Å; L610-G613 PolarHBondContact O-N 2.98Å; L610-G613 VanDerWaalsContact O-N 3.08Å; L610-F614 HydrophobicContact CD1-CD2 4.41Å; L610-F614 HydrophobicContact CD1-CE2 3.81Å; L610-F614 HydrophobicContact CG-CE2 4.28Å; L610-F614 WeakPolarHBondContact O-CD2 3.31Å; L610-F614 PolarHBondContact O-N 3.39Å
611	V	96.1	Very high	94.6	Very high	2 Å²	2	12.7 Å²	12.7	1%	0.012	7%	0.065	C	C	.	.	H	α-helix	trans	-61	-40.7	176.5	175.3	0	0	0	0	110.4	V478 V600 F607 G613 F614 A615	V478-V611 HydrophobicContact CG1-CG1 4.4Å; V600-V611 HydrophobicContact CG1-CB 4.2Å; V600-V611 HydrophobicContact CG1-CG1 4.15Å; F607-V611 PolarHBondContact O-N 3.37Å; V611-G613 VanDerWaalsContact C-N 3.33Å; V611-G613 PolarHBondContact O-N 3.21Å; V611-F614 PolarHBondContact O-N 2.84Å; V611-A615 WeakPolarHBondContact O-CB 3.29Å; V611-A615 PolarHBondContact O-N 2.85Å
612	M	96.3	Very high	94.6	Very high	1 Å²	1	13.6 Å²	13.6	1%	0.005	7%	0.07	C	C	.	.	H	α-helix	trans	-61.8	-38.6	173.1	-171.6	64.6	-128.2	0	0	112.3	I363 F367 Y485 V600 S608 L610 F614 A615 N616	I363-M612 HydrophobicContact CG2-CE 3.68Å; I363-M612 HydrophobicContact CG2-CG 3.97Å; I363-M612 HydrophobicContact CG2-SD 4.13Å; F367-M612 HydrophobicContact CB-CB 4.01Å; F367-M612 HydrophobicContact CB-CG 4.11Å; F367-M612 HydrophobicContact CD1-SD 4.44Å; F367-M612 HydrophobicContact CD2-CB 4.37Å; F367-M612 HydrophobicContact CD2-CG 3.59Å; F367-M612 HydrophobicContact CD2-SD 3.78Å; F367-M612 HydrophobicContact CE1-SD 4.38Å; F367-M612 HydrophobicContact CE2-CG 4.14Å; F367-M612 HydrophobicContact CE2-SD 3.69Å; F367-M612 HydrophobicContact CG-CB 4.1Å; F367-M612 HydrophobicContact CG-CG 3.82Å; F367-M612 HydrophobicContact CG-SD 4.16Å; F367-M612 HydrophobicContact CZ-SD 4.01Å; Y485-M612 HydrophobicContact CD1-CE 4.01Å; Y485-M612 HydrophobicContact CE1-CE 3.47Å; Y485-M612 VanDerWaalsContact CE1-CE 3.47Å; Y485-M612 HydrophobicContact CE1-SD 4.11Å; Y485-M612 HydrophobicContact CE2-CE 4.3Å; Y485-M612 HydrophobicContact CE2-SD 4.13Å; Y485-M612 PolarHBondContact OH-SD 3Å; Y485-M612 VanDerWaalsContact OH-SD 3.33Å; V600-M612 HydrophobicContact CG1-CB 4.27Å; S608-M612 WeakPolarHBondContact O-CB 3.42Å; S608-M612 PolarHBondContact O-N 3.44Å; L610-M612 VanDerWaalsContact C-N 3.28Å; L610-M612 PolarHBondContact O-N 3.09Å; M612-F614 PolarHBondContact O-N 3.5Å; M612-A615 HydrophobicContact CE-CB 4.33Å; M612-A615 PolarHBondContact O-N 3.39Å; M612-N616 HydrophobicContact CE-CB 3.81Å; M612-N616 WeakPolarHBondContact O-CB 3.48Å; M612-N616 PolarHBondContact O-N 2.85Å
613	G	96.7	Very high	94.6	Very high	0 Å²	0	13.4 Å²	13.4	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-58.9	-43.7	176.5	0	0	0	0	0	113.5	S301 G609 L610 V611 S617	S301-G613 CarbonylContact C-O 3.51Å; S301-G613 VanDerWaalsContact CB-O 3.3Å; S301-G613 WeakPolarHBondContact CB-O 3.41Å; S301-G613 WeakPolarHBondContact O-CA 3.35Å; G609-G613 PolarHBondContact O-N 3.36Å; L610-G613 PolarHBondContact O-N 2.98Å; L610-G613 VanDerWaalsContact O-N 3.08Å; V611-G613 VanDerWaalsContact C-N 3.33Å; V611-G613 PolarHBondContact O-N 3.21Å; G613-S617 VanDerWaalsContact O-CB 3.32Å; G613-S617 WeakPolarHBondContact O-CB 3.39Å; G613-S617 PolarHBondContact O-N 3.08Å; G613-S617 VanDerWaalsContact O-N 3.1Å
614	F	97	Very high	94.5	Very high	47 Å²	47	14.2 Å²	14.2	21%	0.206	7%	0.074	C	C	.	.	H	α-helix	trans	-70.2	-40.6	172.6	-72.5	-76.8	0	0	0	112.4	P302 W469 F473 L482 L610 V611 M612 N616 S617 V618	P302-F614 HydrophobicContact CB-CD1 4.05Å; P302-F614 HydrophobicContact CB-CE1 3.72Å; P302-F614 HydrophobicContact CB-CE2 4.3Å; P302-F614 HydrophobicContact CB-CG 4.48Å; P302-F614 HydrophobicContact CB-CZ 3.84Å; P302-F614 HydrophobicContact CG-CD1 4.12Å; P302-F614 HydrophobicContact CG-CE1 4.13Å; W469-F614 AromaticContact CZ3-CE2 3.89Å; W469-F614 HydrophobicContact CZ3-CE2 3.89Å; W469-F614 AromaticContact CZ3-CZ 3.96Å; W469-F614 HydrophobicContact CZ3-CZ 3.96Å; F473-F614 HydrophobicContact CE1-CD1 4.22Å; F473-F614 HydrophobicContact CE1-CE1 4.14Å; F473-F614 HydrophobicContact CE1-CG 4.45Å; F473-F614 HydrophobicContact CE1-CZ 4.31Å; F473-F614 HydrophobicContact CZ-CD1 4.31Å; F473-F614 AromaticContact CZ-CE1 3.78Å; F473-F614 HydrophobicContact CZ-CE1 3.78Å; F473-F614 HydrophobicContact CZ-CE2 4.06Å; F473-F614 AromaticContact CZ-CZ 3.65Å; F473-F614 HydrophobicContact CZ-CZ 3.65Å; L482-F614 HydrophobicContact CD2-CB 4.13Å; L610-F614 HydrophobicContact CD1-CD2 4.41Å; L610-F614 HydrophobicContact CD1-CE2 3.81Å; L610-F614 HydrophobicContact CG-CE2 4.28Å; L610-F614 WeakPolarHBondContact O-CD2 3.31Å; L610-F614 PolarHBondContact O-N 3.39Å; V611-F614 PolarHBondContact O-N 2.84Å; M612-F614 PolarHBondContact O-N 3.5Å; F614-N616 PolarHBondContact O-N 2.96Å; F614-S617 WeakPolarHBondContact O-CB 3.48Å; F614-S617 PolarHBondContact O-N 2.97Å; F614-V618 WeakPolarHBondContact O-CG2 3.35Å; F614-V618 PolarHBondContact O-N 3.32Å
615	A	96.8	Very high	94.6	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-61.6	-44	177.3	0	0	0	0	0	112.6	I481 L482 Y485 V611 M612 V618 S619	I481-A615 HydrophobicContact CG2-CB 4.28Å; L482-A615 VanDerWaalsContact CD2-CA 3.49Å; L482-A615 HydrophobicContact CD2-CB 3.98Å; Y485-A615 HydrophobicContact CD2-CB 3.69Å; Y485-A615 HydrophobicContact CE2-CB 4.22Å; Y485-A615 HydrophobicContact CG-CB 3.94Å; V611-A615 WeakPolarHBondContact O-CB 3.29Å; V611-A615 PolarHBondContact O-N 2.85Å; M612-A615 HydrophobicContact CE-CB 4.33Å; M612-A615 PolarHBondContact O-N 3.39Å; A615-V618 PolarHBondContact O-N 3.46Å; A615-S619 WeakPolarHBondContact O-CB 3.37Å; A615-S619 PolarHBondContact O-N 2.93Å
616	N	95.4	Very high	94.8	Very high	4 Å²	4	16.4 Å²	16.4	2%	0.021	9%	0.085	C	C	.	.	H	α-helix	trans	-65.9	-36.7	177	-165.2	45.3	0	0	0	112.2	Y297 S301 M612 F614 S619 T620	Y297-N616 WeakPolarHBondContact CE1-ND2 3.37Å; Y297-N616 WeakPolarHBondContact CE1-OD1 3.02Å; Y297-N616 VanDerWaalsContact OH-CG 3.32Å; Y297-N616 PolarHBondContact OH-ND2 3.13Å; Y297-N616 PolarHBondContact OH-OD1 2.93Å; S301-N616 PolarHBondContact OG-ND2 2.84Å; M612-N616 HydrophobicContact CE-CB 3.81Å; M612-N616 WeakPolarHBondContact O-CB 3.48Å; M612-N616 PolarHBondContact O-N 2.85Å; F614-N616 PolarHBondContact O-N 2.96Å; N616-S619 PolarHBondContact O-OG 3.34Å; N616-T620 WeakPolarHBondContact O-CB 3.16Å; N616-T620 PolarHBondContact O-N 2.89Å; N616-T620 PolarHBondContact O-OG1 2.71Å
617	S	96.4	Very high	94.9	Very high	19 Å²	19	16.5 Å²	16.5	13%	0.133	9%	0.086	C	C	.	.	H	α-helix	trans	-64.2	-52.9	173.5	-171	0	0	0	0	111.1	L298 G613 F614 S619 T620 F621	L298-S617 WeakPolarHBondContact CD1-O 3.42Å; L298-S617 WeakPolarHBondContact CD1-OG 3.45Å; L298-S617 PolarHBondContact O-OG 2.93Å; G613-S617 VanDerWaalsContact O-CB 3.32Å; G613-S617 WeakPolarHBondContact O-CB 3.39Å; G613-S617 PolarHBondContact O-N 3.08Å; G613-S617 VanDerWaalsContact O-N 3.1Å; F614-S617 WeakPolarHBondContact O-CB 3.48Å; F614-S617 PolarHBondContact O-N 2.97Å; S617-S619 VanDerWaalsContact C-N 3.33Å; S617-S619 PolarHBondContact O-N 2.92Å; S617-T620 PolarHBondContact O-N 3.16Å; S617-F621 PolarHBondContact O-N 2.7Å
618	V	96.8	Very high	94.8	Very high	54 Å²	54	20.8 Å²	20.8	33%	0.327	11%	0.105	S	C	.	.	H	α-helix	trans	-62.2	-40.4	177.7	177.5	0	0	0	0	111.3	L482 A486 F614 A615 F621 T622	L482-V618 HydrophobicContact CD2-CG2 4.34Å; A486-V618 HydrophobicContact CB-CG1 4.03Å; F614-V618 WeakPolarHBondContact O-CG2 3.35Å; F614-V618 PolarHBondContact O-N 3.32Å; A615-V618 PolarHBondContact O-N 3.46Å; V618-F621 PolarHBondContact O-N 2.99Å; V618-T622 PolarHBondContact O-N 3.25Å; V618-T622 VanDerWaalsContact O-N 3.11Å; V618-T622 PolarHBondContact O-OG1 3.13Å; V618-T622 VanDerWaalsContact O-OG1 3.05Å
619	S	95.9	Very high	94.7	Very high	4 Å²	4	23.1 Å²	23.1	3%	0.028	12%	0.116	C	C	.	.	H	α-helix	trans	-59.2	-51.1	176.6	98.3	0	0	0	0	111.1	D489 A615 N616 S617 F621 T622 G623	D489-S619 PolarHBondContact OD1-OG 3.34Å; A615-S619 WeakPolarHBondContact O-CB 3.37Å; A615-S619 PolarHBondContact O-N 2.93Å; N616-S619 PolarHBondContact O-OG 3.34Å; S617-S619 VanDerWaalsContact C-N 3.33Å; S617-S619 PolarHBondContact O-N 2.92Å; S619-F621 VanDerWaalsContact C-N 3.33Å; S619-F621 PolarHBondContact O-N 3.4Å; S619-T622 WeakPolarHBondContact CA-OG1 3.48Å; S619-T622 CarbonylContact O-C 3.5Å; S619-T622 WeakPolarHBondContact O-CA 3.44Å; S619-T622 PolarHBondContact O-N 3.08Å; S619-T622 PolarHBondContact O-OG1 3.04Å; S619-G623 PolarHBondContact O-N 3.22Å
620	T	94.2	Very high	94.6	Very high	5 Å²	5	23.2 Å²	23.2	3%	0.031	12%	0.117	C	C	.	.	H	α-helix	trans	-57	-44.1	178.7	-58.2	0	0	0	0	112.4	F294 Y297 L298 N616 S617 T622 G623 I624	F294-T620 HydrophobicContact CB-CG2 4.06Å; F294-T620 HydrophobicContact CD1-CG2 4.14Å; F294-T620 WeakPolarHBondContact O-CG2 3.47Å; Y297-T620 HydrophobicContact CD1-CG2 3.94Å; Y297-T620 WeakPolarHBondContact CD1-OG1 3.02Å; Y297-T620 WeakPolarHBondContact CE1-OG1 3.49Å; L298-T620 HydrophobicContact CB-CG2 4.15Å; N616-T620 WeakPolarHBondContact O-CB 3.16Å; N616-T620 PolarHBondContact O-N 2.89Å; N616-T620 PolarHBondContact O-OG1 2.71Å; S617-T620 PolarHBondContact O-N 3.16Å; T620-T622 VanDerWaalsContact C-N 3.32Å; T620-T622 PolarHBondContact O-N 2.88Å; T620-G623 PolarHBondContact O-N 3.47Å; T620-I624 HydrophobicContact CG2-CD1 4.29Å; T620-I624 WeakPolarHBondContact O-CG1 3.34Å; T620-I624 PolarHBondContact O-N 2.89Å
621	F	95.3	Very high	94.3	Very high	110 Å²	110	23.1 Å²	23.1	48%	0.482	12%	0.117	S	C	.	.	H	α-helix	trans	-58.1	-46.2	175	175.4	-106.1	0	0	0	111.3	L298 S617 V618 S619 L625	L298-F621 HydrophobicContact CD1-CB 3.81Å; S617-F621 PolarHBondContact O-N 2.7Å; V618-F621 PolarHBondContact O-N 2.99Å; S619-F621 VanDerWaalsContact C-N 3.33Å; S619-F621 PolarHBondContact O-N 3.4Å; F621-L625 HydrophobicContact CE1-CD2 3.96Å; F621-L625 HydrophobicContact CZ-CD2 4.21Å; F621-L625 WeakPolarHBondContact O-CB 3.25Å; F621-L625 PolarHBondContact O-N 3.3Å
622	T	95.5	Very high	94.1	Very high	19 Å²	19	24.5 Å²	24.5	12%	0.117	13%	0.125	C	C	.	.	H	α-helix	trans	-70.2	-27.6	177.1	45.6	0	0	0	0	114.5	A486 W490 V618 S619 T620 S626	A486-T622 VanDerWaalsContact CA-OG1 3.31Å; A486-T622 WeakPolarHBondContact CA-OG1 3.04Å; A486-T622 HydrophobicContact CB-CG2 4.03Å; A486-T622 PolarHBondContact O-OG1 3.49Å; A486-T622 VanDerWaalsContact O-OG1 3.11Å; W490-T622 HydrophobicContact CE3-CG2 4.34Å; V618-T622 PolarHBondContact O-N 3.25Å; V618-T622 VanDerWaalsContact O-N 3.11Å; V618-T622 PolarHBondContact O-OG1 3.13Å; V618-T622 VanDerWaalsContact O-OG1 3.05Å; S619-T622 WeakPolarHBondContact CA-OG1 3.48Å; S619-T622 CarbonylContact O-C 3.5Å; S619-T622 WeakPolarHBondContact O-CA 3.44Å; S619-T622 PolarHBondContact O-N 3.08Å; S619-T622 PolarHBondContact O-OG1 3.04Å; T620-T622 VanDerWaalsContact C-N 3.32Å; T620-T622 PolarHBondContact O-N 2.88Å; T622-S626 VanDerWaalsContact O-CB 3.27Å; T622-S626 WeakPolarHBondContact O-CB 3.44Å; T622-S626 PolarHBondContact O-N 3.36Å
623	G	92.9	Very high	94	Very high	2 Å²	2	24.6 Å²	24.6	2%	0.021	13%	0.126	C	C	.	.	H	α-helix	trans	-68.5	-46.2	172	0	0	0	0	0	112.8	D489 Q493 S619 T620 L625 S626 T627	D489-G623 WeakPolarHBondContact OD2-CA 3.4Å; Q493-G623 WeakPolarHBondContact CG-O 3.41Å; S619-G623 PolarHBondContact O-N 3.22Å; T620-G623 PolarHBondContact O-N 3.47Å; G623-L625 VanDerWaalsContact C-N 3.35Å; G623-S626 PolarHBondContact O-N 3.29Å; G623-S626 PolarHBondContact O-OG 3.23Å; G623-S626 VanDerWaalsContact O-OG 3.09Å; G623-T627 PolarHBondContact O-N 3.5Å
624	I	91.1	Very high	93.7	Very high	17 Å²	17	24.9 Å²	24.9	9%	0.087	13%	0.128	C	C	.	.	H	α-helix	trans	-57.8	-51.9	171.8	-60.8	166	0	0	0	109.2	W280 F294 F295 T620 S626 T627 F628	W280-I624 HydrophobicContact CZ2-CG2 4.1Å; F294-I624 HydrophobicContact CB-CD1 3.78Å; F294-I624 HydrophobicContact CB-CG1 3.85Å; F295-I624 HydrophobicContact CD1-CD1 4.14Å; F295-I624 HydrophobicContact CE1-CD1 4.13Å; T620-I624 HydrophobicContact CG2-CD1 4.29Å; T620-I624 WeakPolarHBondContact O-CG1 3.34Å; T620-I624 PolarHBondContact O-N 2.89Å; I624-S626 VanDerWaalsContact C-N 3.33Å; I624-S626 PolarHBondContact O-N 2.86Å; I624-T627 PolarHBondContact O-N 3.07Å; I624-T627 PolarHBondContact O-OG1 2.92Å; I624-F628 PolarHBondContact O-N 3.14Å
625	L	93.5	Very high	93.2	Very high	55 Å²	55	26.6 Å²	26.6	29%	0.288	14%	0.136	S	C	.	.	H	α-helix	trans	-62	-35.7	-176.3	-175.5	61.1	0	0	0	112.9	W490 F621 G623 F628 I629	W490-L625 HydrophobicContact CZ3-CD2 4.26Å; W490-L625 HydrophobicContact CZ3-CG 4.36Å; F621-L625 HydrophobicContact CE1-CD2 3.96Å; F621-L625 HydrophobicContact CZ-CD2 4.21Å; F621-L625 WeakPolarHBondContact O-CB 3.25Å; F621-L625 PolarHBondContact O-N 3.3Å; G623-L625 VanDerWaalsContact C-N 3.35Å; L625-F628 PolarHBondContact O-N 2.9Å; L625-I629 HydrophobicContact CD1-CD1 3.78Å; L625-I629 HydrophobicContact CD1-CG1 4.09Å; L625-I629 HydrophobicContact CD2-CD1 4.38Å; L625-I629 HydrophobicContact CG-CD1 3.73Å; L625-I629 HydrophobicContact CG-CG1 4.38Å; L625-I629 WeakPolarHBondContact O-CB 3.41Å; L625-I629 WeakPolarHBondContact O-CG1 3.15Å; L625-I629 PolarHBondContact O-N 3.35Å
626	S	94.1	Very high	92.7	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-66.4	-40.9	179.3	78.3	0	0	0	0	112.3	W490 T622 G623 I624 A630	W490-S626 VanDerWaalsContact CD2-CB 3.44Å; W490-S626 VanDerWaalsContact CG-CB 3.43Å; W490-S626 WeakPolarHBondContact O-CB 3.36Å; W490-S626 PolarHBondContact O-OG 3.43Å; T622-S626 VanDerWaalsContact O-CB 3.27Å; T622-S626 WeakPolarHBondContact O-CB 3.44Å; T622-S626 PolarHBondContact O-N 3.36Å; G623-S626 PolarHBondContact O-N 3.29Å; G623-S626 PolarHBondContact O-OG 3.23Å; G623-S626 VanDerWaalsContact O-OG 3.09Å; I624-S626 VanDerWaalsContact C-N 3.33Å; I624-S626 PolarHBondContact O-N 2.86Å; S626-A630 VanDerWaalsContact O-CB 3.25Å; S626-A630 WeakPolarHBondContact O-CB 3.38Å; S626-A630 PolarHBondContact O-N 3.28Å
627	T	91.1	Very high	92.2	Very high	5 Å²	5	39.1 Å²	39.1	3%	0.031	19%	0.19	C	C	.	.	H	α-helix	trans	-67.6	-38.8	176.1	68	0	0	0	0	112.3	W280 Q493 V497 G623 I624 S631	W280-T627 PolarHBondContact NE1-OG1 3.19Å; W280-T627 VanDerWaalsContact NE1-OG1 3.13Å; Q493-T627 HydrophobicContact CB-CG2 4.49Å; Q493-T627 HydrophobicContact CG-CG2 3.62Å; V497-T627 HydrophobicContact CB-CG2 4.22Å; V497-T627 HydrophobicContact CG2-CG2 4.49Å; G623-T627 PolarHBondContact O-N 3.5Å; I624-T627 PolarHBondContact O-N 3.07Å; I624-T627 PolarHBondContact O-OG1 2.92Å; T627-S631 WeakPolarHBondContact O-CB 3.48Å; T627-S631 PolarHBondContact O-N 2.98Å
628	F	90.7	Very high	91.6	Very high	92 Å²	92	42 Å²	42	40%	0.404	22%	0.223	S	C	.	.	H	α-helix	trans	-65	-49.9	176.4	178.9	-98.6	0	0	0	111.2	W280 I624 L625 A630 S631 V632	W280-F628 HydrophobicContact CB-CD2 4.2Å; W280-F628 HydrophobicContact CD2-CD2 4.05Å; W280-F628 AromaticContact CG-CD2 3.91Å; W280-F628 HydrophobicContact CG-CD2 3.91Å; I624-F628 PolarHBondContact O-N 3.14Å; L625-F628 PolarHBondContact O-N 2.9Å; F628-A630 PolarHBondContact O-N 2.98Å; F628-S631 PolarHBondContact O-N 3.39Å; F628-V632 HydrophobicContact CD1-CG2 4.31Å; F628-V632 HydrophobicContact CE1-CG2 3.91Å; F628-V632 HydrophobicContact CE2-CG2 4.24Å; F628-V632 HydrophobicContact CZ-CG2 3.88Å; F628-V632 WeakPolarHBondContact O-CG2 3.25Å; F628-V632 PolarHBondContact O-N 2.72Å
629	I	93.5	Very high	91.2	Very high	48 Å²	48	42.9 Å²	42.9	25%	0.246	23%	0.226	C	C	.	.	H	α-helix	trans	-62.1	-43	177.4	-72	173.4	0	0	0	110.8	W490 L625 S631 V632 V633 L651	W490-I629 HydrophobicContact CH2-CD1 3.65Å; W490-I629 HydrophobicContact CZ2-CD1 4.36Å; W490-I629 HydrophobicContact CZ3-CD1 4.41Å; L625-I629 HydrophobicContact CD1-CD1 3.78Å; L625-I629 HydrophobicContact CD1-CG1 4.09Å; L625-I629 HydrophobicContact CD2-CD1 4.38Å; L625-I629 HydrophobicContact CG-CD1 3.73Å; L625-I629 HydrophobicContact CG-CG1 4.38Å; L625-I629 WeakPolarHBondContact O-CB 3.41Å; L625-I629 WeakPolarHBondContact O-CG1 3.15Å; L625-I629 PolarHBondContact O-N 3.35Å; I629-S631 VanDerWaalsContact C-N 3.35Å; I629-S631 PolarHBondContact O-N 3.28Å; I629-V632 PolarHBondContact O-N 2.95Å; I629-V633 HydrophobicContact CG2-CG2 4Å; I629-V633 VanDerWaalsContact O-CB 3.28Å; I629-V633 WeakPolarHBondContact O-CB 3.43Å; I629-V633 WeakPolarHBondContact O-CG2 3.3Å; I629-V633 PolarHBondContact O-N 3.12Å; I629-L651 HydrophobicContact CG2-CD1 4.11Å
630	A	92.7	Very high	91	Very high	2 Å²	2	49.3 Å²	49.3	2%	0.017	26%	0.256	C	S	.	.	H	α-helix	trans	-58.3	-44.8	175.4	0	0	0	0	0	112.1	M278 S626 F628 V633 V634 A648	M278-A630 HydrophobicContact CE-CB 4.05Å; S626-A630 VanDerWaalsContact O-CB 3.25Å; S626-A630 WeakPolarHBondContact O-CB 3.38Å; S626-A630 PolarHBondContact O-N 3.28Å; F628-A630 PolarHBondContact O-N 2.98Å; A630-V633 PolarHBondContact O-N 3.37Å; A630-V634 VanDerWaalsContact O-CB 3.32Å; A630-V634 WeakPolarHBondContact O-CB 3.42Å; A630-V634 WeakPolarHBondContact O-CG2 3.21Å; A630-V634 PolarHBondContact O-N 3.03Å; A630-A648 HydrophobicContact CB-CB 4.28Å
631	S	88.9	Confident	90.9	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-63	-46.5	177	-173.3	0	0	0	0	112.7	P279 T627 F628 I629 V633 V634 H635	P279-S631 VanDerWaalsContact O-CB 3.22Å; P279-S631 WeakPolarHBondContact O-CB 3.47Å; P279-S631 PolarHBondContact O-OG 3.35Å; T627-S631 WeakPolarHBondContact O-CB 3.48Å; T627-S631 PolarHBondContact O-N 2.98Å; F628-S631 PolarHBondContact O-N 3.39Å; I629-S631 VanDerWaalsContact C-N 3.35Å; I629-S631 PolarHBondContact O-N 3.28Å; S631-V633 PolarHBondContact O-N 3.09Å; S631-V634 PolarHBondContact O-N 3.24Å; S631-H635 WeakPolarHBondContact O-CB 3.41Å; S631-H635 PolarHBondContact O-N 2.91Å
632	V	91	Very high	90.8	Very high	30 Å²	30	53.1 Å²	53.1	18%	0.182	27%	0.274	C	S	.	.	H	α-helix	trans	-61.4	-44.1	176.1	173.2	0	0	0	0	111.4	F628 I629 K636 F637	F628-V632 HydrophobicContact CD1-CG2 4.31Å; F628-V632 HydrophobicContact CE1-CG2 3.91Å; F628-V632 HydrophobicContact CE2-CG2 4.24Å; F628-V632 HydrophobicContact CZ-CG2 3.88Å; F628-V632 WeakPolarHBondContact O-CG2 3.25Å; F628-V632 PolarHBondContact O-N 2.72Å; I629-V632 PolarHBondContact O-N 2.95Å; V632-K636 HydrophobicContact CG1-CB 4.33Å; V632-K636 HydrophobicContact CG2-CD 4.44Å; V632-K636 WeakPolarHBondContact O-CA 3.37Å; V632-K636 WeakPolarHBondContact O-CB 3.24Å; V632-K636 PolarHBondContact O-N 2.71Å; V632-F637 HydrophobicContact CG1-CE2 4.44Å; V632-F637 HydrophobicContact CG1-CZ 4.27Å; V632-F637 PolarHBondContact O-N 3.19Å
633	V	93.5	Very high	90.8	Very high	4 Å²	4	54.6 Å²	54.6	2%	0.024	28%	0.281	C	S	.	.	H	α-helix	trans	-67.5	-42.2	-179.1	169.8	0	0	0	0	112.2	I629 A630 S631 F637 G644 V647 A648 L651	I629-V633 HydrophobicContact CG2-CG2 4Å; I629-V633 VanDerWaalsContact O-CB 3.28Å; I629-V633 WeakPolarHBondContact O-CB 3.43Å; I629-V633 WeakPolarHBondContact O-CG2 3.3Å; I629-V633 PolarHBondContact O-N 3.12Å; A630-V633 PolarHBondContact O-N 3.37Å; S631-V633 PolarHBondContact O-N 3.09Å; V633-F637 HydrophobicContact CB-CD2 4.28Å; V633-F637 HydrophobicContact CG2-CD2 3.95Å; V633-F637 HydrophobicContact CG2-CE2 3.77Å; V633-G644 WeakPolarHBondContact CG1-O 3.19Å; V633-V647 HydrophobicContact CG1-CB 3.76Å; V633-V647 HydrophobicContact CG1-CG1 3.67Å; V633-A648 HydrophobicContact CG1-CB 4.18Å; V633-L651 HydrophobicContact CG2-CD1 4.13Å
634	V	91.5	Very high	90.9	Very high	6 Å²	6	54.5 Å²	54.5	4%	0.036	28%	0.28	C	S	.	.	H	α-helix	trans	-74.9	-37.8	-178	172.5	0	0	0	0	112.1	M278 A630 S631 L641 W645 A648	M278-V634 HydrophobicContact CE-CB 4.47Å; M278-V634 HydrophobicContact CE-CG2 4.39Å; M278-V634 HydrophobicContact SD-CB 4.42Å; M278-V634 HydrophobicContact SD-CG1 4.35Å; A630-V634 VanDerWaalsContact O-CB 3.32Å; A630-V634 WeakPolarHBondContact O-CB 3.42Å; A630-V634 WeakPolarHBondContact O-CG2 3.21Å; A630-V634 PolarHBondContact O-N 3.03Å; S631-V634 PolarHBondContact O-N 3.24Å; V634-L641 HydrophobicContact CG1-CD1 3.94Å; V634-W645 HydrophobicContact CG1-CD2 4.46Å; V634-W645 HydrophobicContact CG1-CZ2 4.28Å; V634-W645 HydrophobicContact CG2-CD2 3.65Å; V634-W645 HydrophobicContact CG2-CE3 4.04Å; V634-W645 HydrophobicContact CG2-CG 3.93Å; V634-W645 HydrophobicContact CG2-CZ2 4.21Å; V634-W645 HydrophobicContact CG2-CZ3 4.46Å; V634-A648 HydrophobicContact CG2-CB 4.39Å
635	H	87.1	Confident	91.1	Very high	82 Å²	82	53.8 Å²	53.8	38%	0.38	28%	0.277	S	S	.	.	H	α-helix	trans	-114.7	-18.8	-169.5	-68	-55.8	0	0	0	116.3	M278 Q505 S631	M278-H635 PolarHBondContact SD-NE2 3.15Å; Q505-H635 PolarHBondContact NE2-CE1 2.94Å; Q505-H635 VanDerWaalsContact NE2-CE1 3.32Å; Q505-H635 PolarHBondContact NE2-NE2 2.87Å; Q505-H635 VanDerWaalsContact NE2-NE2 3.16Å; S631-H635 WeakPolarHBondContact O-CB 3.41Å; S631-H635 PolarHBondContact O-N 2.91Å
636	K	85.1	Confident	91.2	Very high	131 Å²	131	54.8 Å²	54.8	57%	0.57	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.7	-18.8	-172.9	-60.2	-174.1	-178	174.1	0	115.3	V632 G638	V632-K636 HydrophobicContact CG1-CB 4.33Å; V632-K636 HydrophobicContact CG2-CD 4.44Å; V632-K636 WeakPolarHBondContact O-CA 3.37Å; V632-K636 WeakPolarHBondContact O-CB 3.24Å; V632-K636 PolarHBondContact O-N 2.71Å; K636-G638 VanDerWaalsContact C-N 3.29Å; K636-G638 PolarHBondContact O-N 2.63Å
637	F	85.6	Confident	91.4	Very high	136 Å²	136	57.8 Å²	57.8	60%	0.596	30%	0.295	S	S	*	.	S	Bend	trans	-82.4	5.8	176	-74.8	-35.9	0	0	0	115.2	V632 V633 L639	V632-F637 HydrophobicContact CG1-CE2 4.44Å; V632-F637 HydrophobicContact CG1-CZ 4.27Å; V632-F637 PolarHBondContact O-N 3.19Å; V633-F637 HydrophobicContact CB-CD2 4.28Å; V633-F637 HydrophobicContact CG2-CD2 3.95Å; V633-F637 HydrophobicContact CG2-CE2 3.77Å; F637-L639 HydrophobicContact CB-CD1 4.32Å; F637-L639 HydrophobicContact CB-CG 4.21Å; F637-L639 PolarHBondContact O-N 2.97Å; F637-L639 VanDerWaalsContact O-N 3.1Å
638	G	82.6	Confident	91.6	Very high	80 Å²	80	57.8 Å²	57.8	83%	0.825	30%	0.296	S	S	*	.			trans	65.8	12.5	176.3	0	0	0	0	0	115.1	K636	K636-G638 VanDerWaalsContact C-N 3.29Å; K636-G638 PolarHBondContact O-N 2.63Å
639	L	88.8	Confident	91.9	Very high	72 Å²	72	53.5 Å²	53.5	38%	0.377	28%	0.277	S	S	.	.			trans	-69.8	151.7	175.7	-63.5	172.6	0	0	0	110.7	F637 L641 V647	F637-L639 HydrophobicContact CB-CD1 4.32Å; F637-L639 HydrophobicContact CB-CG 4.21Å; F637-L639 PolarHBondContact O-N 2.97Å; F637-L639 VanDerWaalsContact O-N 3.1Å; L639-L641 PolarHBondContact O-N 2.98Å; L639-V647 HydrophobicContact CD1-CG2 4.19Å
640	E	92.5	Very high	92.1	Very high	140 Å²	140	53.5 Å²	53.5	65%	0.654	28%	0.28	S	S	*	.			trans	-53.8	137.9	162.2	-64.1	-173	141.9	0	0	109.8	K642 N643 G644	E640-K642 VanDerWaalsContact C-N 3.27Å; E640-K642 PolarHBondContact O-N 2.93Å; E640-K642 VanDerWaalsContact O-N 3.09Å; E640-N643 HydrophobicContact CB-CB 4.4Å; E640-N643 CarbonylContact O-C 3.57Å; E640-N643 WeakPolarHBondContact O-CA 3.47Å; E640-N643 PolarHBondContact O-N 3.01Å; E640-N643 PolarHBondContact OE2-ND2 2.96Å; E640-G644 PolarHBondContact O-N 2.98Å
641	L	92	Very high	92.3	Very high	69 Å²	69	56.7 Å²	56.7	36%	0.361	30%	0.297	S	S	.	.	H	α-helix	trans	-47.5	-45.2	-175.1	-173.4	61.4	0	0	0	113.7	Q505 I506 V634 L639 N643 G644 W645	Q505-L641 HydrophobicContact CB-CD1 4.41Å; Q505-L641 HydrophobicContact CB-CD2 4.15Å; Q505-L641 WeakPolarHBondContact O-CD2 3.15Å; I506-L641 HydrophobicContact CD1-CG 4.06Å; V634-L641 HydrophobicContact CG1-CD1 3.94Å; L639-L641 PolarHBondContact O-N 2.98Å; L641-N643 VanDerWaalsContact C-N 3.34Å; L641-N643 PolarHBondContact O-N 3.08Å; L641-G644 PolarHBondContact O-N 3.32Å; L641-W645 VanDerWaalsContact O-CD1 3.27Å; L641-W645 PolarHBondContact O-N 2.72Å; L641-W645 VanDerWaalsContact O-N 3.13Å
642	K	93.1	Very high	92.7	Very high	126 Å²	126	56.7 Å²	56.7	55%	0.548	30%	0.297	S	S	.	.	H	α-helix	trans	-63.3	-36.1	176.5	-73.4	179.3	178.7	-177.8	0	113	I506 E640 R646	I506-K642 HydrophobicContact CD1-CG 3.92Å; E640-K642 VanDerWaalsContact C-N 3.27Å; E640-K642 PolarHBondContact O-N 2.93Å; E640-K642 VanDerWaalsContact O-N 3.09Å; K642-R646 WeakPolarHBondContact O-CD 3.21Å; K642-R646 VanDerWaalsContact O-CG 3.26Å; K642-R646 WeakPolarHBondContact O-CG 3.2Å; K642-R646 PolarHBondContact O-N 3.37Å; K642-R646 VanDerWaalsContact O-N 3.13Å
643	N	94.6	Very high	93	Very high	49 Å²	49	55.3 Å²	55.3	26%	0.262	29%	0.289	S	S	.	.	H	α-helix	trans	-81.3	-33.8	-179.7	-61.5	-31.3	0	0	0	111.9	E640 L641 R646 V647	E640-N643 HydrophobicContact CB-CB 4.4Å; E640-N643 CarbonylContact O-C 3.57Å; E640-N643 WeakPolarHBondContact O-CA 3.47Å; E640-N643 PolarHBondContact O-N 3.01Å; E640-N643 PolarHBondContact OE2-ND2 2.96Å; L641-N643 VanDerWaalsContact C-N 3.34Å; L641-N643 PolarHBondContact O-N 3.08Å; N643-R646 PolarHBondContact O-N 2.63Å; N643-R646 PolarHBondContact OD1-NH1 3.33Å; N643-V647 WeakPolarHBondContact O-CG2 3.01Å; N643-V647 PolarHBondContact O-N 2.93Å
644	G	95.3	Very high	93.2	Very high	0 Å²	0	61.7 Å²	61.7	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-56.7	-50.1	168	0	0	0	0	0	111.9	V633 E640 L641 R646 V647 A648	V633-G644 WeakPolarHBondContact CG1-O 3.19Å; E640-G644 PolarHBondContact O-N 2.98Å; L641-G644 PolarHBondContact O-N 3.32Å; G644-R646 PolarHBondContact O-N 3.01Å; G644-V647 PolarHBondContact O-N 3.35Å; G644-A648 PolarHBondContact O-N 3.43Å
645	W	95.5	Very high	93.5	Very high	3 Å²	3	62.4 Å²	62.4	1%	0.011	32%	0.321	C	S	.	.	H	α-helix	trans	-63.2	-37.9	176	-81	107.3	0	0	0	113.6	M278 C498 M499 F502 I506 V634 L641 A648 L649	M278-W645 HydrophobicContact CE-CH2 3.58Å; M278-W645 HydrophobicContact CE-CZ2 3.91Å; M278-W645 HydrophobicContact CE-CZ3 4.35Å; M278-W645 HydrophobicContact SD-CH2 4.14Å; M278-W645 HydrophobicContact SD-CZ2 3.9Å; C498-W645 HydrophobicContact CB-CH2 3.89Å; C498-W645 HydrophobicContact CB-CZ3 3.98Å; C498-W645 VanDerWaalsContact O-CH2 3.22Å; C498-W645 WeakPolarHBondContact O-CH2 3.48Å; M499-W645 HydrophobicContact CE-CE3 4.42Å; M499-W645 HydrophobicContact CE-CZ3 4.03Å; F502-W645 HydrophobicContact CB-CD2 4.24Å; F502-W645 HydrophobicContact CB-CE3 4.11Å; F502-W645 HydrophobicContact CB-CH2 3.95Å; F502-W645 HydrophobicContact CB-CZ2 4.06Å; F502-W645 HydrophobicContact CB-CZ3 3.97Å; F502-W645 HydrophobicContact CD2-CB 4.02Å; F502-W645 AromaticContact CD2-CD2 3.59Å; F502-W645 HydrophobicContact CD2-CD2 3.59Å; F502-W645 AromaticContact CD2-CE3 3.78Å; F502-W645 HydrophobicContact CD2-CE3 3.78Å; F502-W645 AromaticContact CD2-CG 3.7Å; F502-W645 HydrophobicContact CD2-CG 3.7Å; F502-W645 HydrophobicContact CD2-CZ3 4.48Å; F502-W645 HydrophobicContact CE2-CB 4.04Å; F502-W645 HydrophobicContact CE2-CD2 4.47Å; F502-W645 HydrophobicContact CE2-CG 4.22Å; F502-W645 HydrophobicContact CG-CD2 4.37Å; F502-W645 HydrophobicContact CG-CE3 4.31Å; I506-W645 HydrophobicContact CD1-CG 4.38Å; I506-W645 HydrophobicContact CG1-CG 4.38Å; V634-W645 HydrophobicContact CG1-CD2 4.46Å; V634-W645 HydrophobicContact CG1-CZ2 4.28Å; V634-W645 HydrophobicContact CG2-CD2 3.65Å; V634-W645 HydrophobicContact CG2-CE3 4.04Å; V634-W645 HydrophobicContact CG2-CG 3.93Å; V634-W645 HydrophobicContact CG2-CZ2 4.21Å; V634-W645 HydrophobicContact CG2-CZ3 4.46Å; L641-W645 VanDerWaalsContact O-CD1 3.27Å; L641-W645 PolarHBondContact O-N 2.72Å; L641-W645 VanDerWaalsContact O-N 3.13Å; W645-A648 PolarHBondContact O-N 3.34Å; W645-L649 WeakPolarHBondContact O-CB 3.26Å; W645-L649 WeakPolarHBondContact O-CG 3.45Å; W645-L649 PolarHBondContact O-N 2.91Å
646	R	96.6	Very high	94	Very high	75 Å²	75	58.5 Å²	58.5	28%	0.283	30%	0.303	S	S	.	.	H	α-helix	trans	-59.3	-46.8	171.9	-77.1	162.5	176.9	170.9	-7.3	112.3	G570 K642 N643 G644 L649 C650	G570-R646 WeakPolarHBondContact O-CG 2.95Å; G570-R646 PolarHBondContact O-NE 3.44Å; K642-R646 WeakPolarHBondContact O-CD 3.21Å; K642-R646 VanDerWaalsContact O-CG 3.26Å; K642-R646 WeakPolarHBondContact O-CG 3.2Å; K642-R646 PolarHBondContact O-N 3.37Å; K642-R646 VanDerWaalsContact O-N 3.13Å; N643-R646 PolarHBondContact O-N 2.63Å; N643-R646 PolarHBondContact OD1-NH1 3.33Å; G644-R646 PolarHBondContact O-N 3.01Å; R646-L649 PolarHBondContact O-N 2.98Å; R646-C650 WeakPolarHBondContact O-CB 3.41Å; R646-C650 PolarHBondContact O-N 3.45Å; R646-C650 PolarHBondContact O-SG 3.29Å; R646-C650 VanDerWaalsContact O-SG 3.32Å
647	V	96.6	Very high	94.6	Very high	63 Å²	63	54.9 Å²	54.9	38%	0.382	29%	0.288	S	S	.	.	H	α-helix	trans	-63.6	-43.8	178.7	174.6	0	0	0	0	110.7	V633 L639 N643 G644 L649 C650 L651	V633-V647 HydrophobicContact CG1-CB 3.76Å; V633-V647 HydrophobicContact CG1-CG1 3.67Å; L639-V647 HydrophobicContact CD1-CG2 4.19Å; N643-V647 WeakPolarHBondContact O-CG2 3.01Å; N643-V647 PolarHBondContact O-N 2.93Å; G644-V647 PolarHBondContact O-N 3.35Å; V647-L649 PolarHBondContact O-N 2.72Å; V647-C650 PolarHBondContact O-N 3.1Å; V647-L651 HydrophobicContact CG1-CD1 4.08Å; V647-L651 HydrophobicContact CG1-CG 4.46Å; V647-L651 VanDerWaalsContact O-CG 3.32Å; V647-L651 WeakPolarHBondContact O-CG 3.26Å; V647-L651 PolarHBondContact O-N 3.34Å
648	A	96.5	Very high	95.1	Very high	6 Å²	6	51 Å²	51	5%	0.05	28%	0.275	C	S	.	.	H	α-helix	trans	-60.7	-42.1	176.5	0	0	0	0	0	112.7	A630 V633 V634 G644 W645 A652	A630-A648 HydrophobicContact CB-CB 4.28Å; V633-A648 HydrophobicContact CG1-CB 4.18Å; V634-A648 HydrophobicContact CG2-CB 4.39Å; G644-A648 PolarHBondContact O-N 3.43Å; W645-A648 PolarHBondContact O-N 3.34Å; A648-A652 WeakPolarHBondContact O-CB 3.38Å; A648-A652 PolarHBondContact O-N 3.37Å; A648-A652 VanDerWaalsContact O-N 3.11Å
649	L	97.1	Very high	95.8	Very high	1 Å²	1	47.3 Å²	47.3	1%	0.005	24%	0.237	C	C	.	.	H	α-helix	trans	-70	-38.2	176.5	-73.4	170.4	0	0	0	112.9	M499 F502 F566 L569 W645 R646 V647 A652 A653	M499-L649 HydrophobicContact CE-CD2 3.93Å; F502-L649 HydrophobicContact CE2-CD1 4.26Å; F502-L649 HydrophobicContact CZ-CD1 4.39Å; F566-L649 HydrophobicContact CD1-CD2 3.66Å; F566-L649 HydrophobicContact CE1-CD2 4Å; L569-L649 HydrophobicContact CB-CD1 4.33Å; L569-L649 HydrophobicContact CD2-CD1 4.4Å; L569-L649 HydrophobicContact CD2-CD2 3.94Å; L569-L649 HydrophobicContact CG-CD1 4.01Å; L569-L649 HydrophobicContact CG-CD2 4.43Å; W645-L649 WeakPolarHBondContact O-CB 3.26Å; W645-L649 WeakPolarHBondContact O-CG 3.45Å; W645-L649 PolarHBondContact O-N 2.91Å; R646-L649 PolarHBondContact O-N 2.98Å; V647-L649 PolarHBondContact O-N 2.72Å; L649-A652 PolarHBondContact O-N 3Å; L649-A653 PolarHBondContact O-N 2.88Å
650	C	97.1	Very high	96.2	Very high	48 Å²	48	45.7 Å²	45.7	32%	0.324	23%	0.228	S	C	.	.	H	α-helix	trans	-67.4	-36.6	174.8	-74.2	0	0	0	0	112.6	R646 V647 A652 A653 F654	R646-C650 WeakPolarHBondContact O-CB 3.41Å; R646-C650 PolarHBondContact O-N 3.45Å; R646-C650 PolarHBondContact O-SG 3.29Å; R646-C650 VanDerWaalsContact O-SG 3.32Å; V647-C650 PolarHBondContact O-N 3.1Å; C650-A652 VanDerWaalsContact C-N 3.34Å; C650-A653 PolarHBondContact O-N 2.84Å; C650-F654 WeakPolarHBondContact O-CB 3.24Å; C650-F654 PolarHBondContact O-N 3.14Å
651	L	96.9	Very high	96.5	Very high	70 Å²	70	43.3 Å²	43.3	37%	0.366	22%	0.219	S	C	.	.	H	α-helix	trans	-63	-41.5	170.8	-73	168.3	0	0	0	111.4	I629 V633 V647 F654 S655	I629-L651 HydrophobicContact CG2-CD1 4.11Å; V633-L651 HydrophobicContact CG2-CD1 4.13Å; V647-L651 HydrophobicContact CG1-CD1 4.08Å; V647-L651 HydrophobicContact CG1-CG 4.46Å; V647-L651 VanDerWaalsContact O-CG 3.32Å; V647-L651 WeakPolarHBondContact O-CG 3.26Å; V647-L651 PolarHBondContact O-N 3.34Å; L651-F654 PolarHBondContact O-N 3.38Å; L651-S655 PolarHBondContact O-N 3.02Å
652	A	96.9	Very high	96.7	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-67	-34.7	175.9	0	0	0	0	0	112.8	T491 I494 F566 A648 L649 C650 S655 Q656	T491-A652 HydrophobicContact CG2-CB 3.83Å; T491-A652 WeakPolarHBondContact CG2-O 3.32Å; I494-A652 HydrophobicContact CD1-CB 3.82Å; F566-A652 HydrophobicContact CD1-CB 3.88Å; F566-A652 HydrophobicContact CE1-CB 4.12Å; A648-A652 WeakPolarHBondContact O-CB 3.38Å; A648-A652 PolarHBondContact O-N 3.37Å; A648-A652 VanDerWaalsContact O-N 3.11Å; L649-A652 PolarHBondContact O-N 3Å; C650-A652 VanDerWaalsContact C-N 3.34Å; A652-S655 PolarHBondContact O-OG 3.26Å; A652-Q656 WeakPolarHBondContact O-CG 3.41Å; A652-Q656 PolarHBondContact O-NE2 3.3Å
653	A	97.9	Very high	96.9	Very high	1 Å²	1	35.1 Å²	35.1	1%	0.008	18%	0.182	C	C	.	.	H	α-helix	trans	-68.7	-42.7	171.9	0	0	0	0	0	112.6	G563 F566 I567 L649 C650 S655 Q656 F657	G563-A653 VanDerWaalsContact O-CB 3.28Å; G563-A653 WeakPolarHBondContact O-CB 3.08Å; F566-A653 HydrophobicContact CB-CB 3.93Å; I567-A653 HydrophobicContact CD1-CB 4.16Å; I567-A653 HydrophobicContact CG1-CB 3.56Å; L649-A653 PolarHBondContact O-N 2.88Å; C650-A653 PolarHBondContact O-N 2.84Å; A653-S655 VanDerWaalsContact C-N 3.3Å; A653-S655 PolarHBondContact O-N 3.34Å; A653-Q656 WeakPolarHBondContact O-CB 3.46Å; A653-Q656 PolarHBondContact O-N 2.97Å; A653-F657 HydrophobicContact CB-CE2 4.27Å; A653-F657 WeakPolarHBondContact O-CD2 3.48Å; A653-F657 PolarHBondContact O-N 2.93Å; A653-F657 VanDerWaalsContact O-N 3.16Å
654	F	97.8	Very high	97	Very high	137 Å²	137	36.3 Å²	36.3	60%	0.601	19%	0.188	S	C	*	.	H	α-helix	trans	-56.2	-43.1	177.6	175.7	-103.9	0	0	0	111.8	C650 L651 Q656 F657 V658	C650-F654 WeakPolarHBondContact O-CB 3.24Å; C650-F654 PolarHBondContact O-N 3.14Å; L651-F654 PolarHBondContact O-N 3.38Å; F654-Q656 VanDerWaalsContact C-N 3.27Å; F654-Q656 PolarHBondContact O-N 3.48Å; F654-F657 PolarHBondContact O-N 3.26Å; F654-V658 HydrophobicContact CD1-CG2 4.24Å; F654-V658 HydrophobicContact CD2-CG2 4.38Å; F654-V658 HydrophobicContact CE1-CG2 3.79Å; F654-V658 HydrophobicContact CE2-CG2 3.95Å; F654-V658 HydrophobicContact CZ-CG2 3.64Å; F654-V658 WeakPolarHBondContact O-CG2 3.44Å; F654-V658 PolarHBondContact O-N 3.13Å
655	S	96.9	Very high	97	Very high	21 Å²	21	41.7 Å²	41.7	15%	0.147	22%	0.216	C	C	.	.	H	α-helix	trans	-62.7	-31.7	175.9	67.9	0	0	0	0	113	A487 L651 A652 A653 A659	A487-S655 WeakPolarHBondContact CB-O 3.44Å; L651-S655 PolarHBondContact O-N 3.02Å; A652-S655 PolarHBondContact O-OG 3.26Å; A653-S655 VanDerWaalsContact C-N 3.3Å; A653-S655 PolarHBondContact O-N 3.34Å; S655-A659 WeakPolarHBondContact O-CB 3.48Å; S655-A659 PolarHBondContact O-N 3.04Å
656	Q	97.8	Very high	97	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-68.6	-42.2	174.9	-49.8	-43.7	-82.2	0	0	111.6	A487 T491 F559 K562 A652 A653 F654 A659 M660	A487-Q656 PolarHBondContact O-NE2 3.22Å; A487-Q656 PolarHBondContact O-OE1 2.72Å; T491-Q656 HydrophobicContact CG2-CG 4.06Å; T491-Q656 PolarHBondContact OG1-NE2 3.43Å; T491-Q656 PolarHBondContact OG1-OE1 3.39Å; F559-Q656 HydrophobicContact CD1-CB 4.48Å; F559-Q656 WeakPolarHBondContact O-CB 3.23Å; K562-Q656 HydrophobicContact CD-CG 4.2Å; K562-Q656 VanDerWaalsContact CD-OE1 3.3Å; K562-Q656 VanDerWaalsContact CE-OE1 3.26Å; K562-Q656 HydrophobicContact CG-CG 4.24Å; A652-Q656 WeakPolarHBondContact O-CG 3.41Å; A652-Q656 PolarHBondContact O-NE2 3.3Å; A653-Q656 WeakPolarHBondContact O-CB 3.46Å; A653-Q656 PolarHBondContact O-N 2.97Å; F654-Q656 VanDerWaalsContact C-N 3.27Å; F654-Q656 PolarHBondContact O-N 3.48Å; Q656-A659 PolarHBondContact O-N 3.41Å; Q656-M660 VanDerWaalsContact O-CB 3.31Å; Q656-M660 WeakPolarHBondContact O-CB 3.26Å; Q656-M660 PolarHBondContact O-N 3.17Å
657	F	98.1	Very high	96.8	Very high	55 Å²	55	43 Å²	43	24%	0.241	23%	0.225	C	C	.	.	H	α-helix	trans	-67.2	-38.8	177.5	-64.2	-60.7	0	0	0	112.2	G560 I564 I567 A653 F654 M660 I661	G560-F657 WeakPolarHBondContact O-CE1 3.44Å; I564-F657 HydrophobicContact CG1-CE1 4.18Å; I564-F657 HydrophobicContact CG1-CZ 3.91Å; I567-F657 HydrophobicContact CD1-CE2 3.95Å; A653-F657 HydrophobicContact CB-CE2 4.27Å; A653-F657 WeakPolarHBondContact O-CD2 3.48Å; A653-F657 PolarHBondContact O-N 2.93Å; A653-F657 VanDerWaalsContact O-N 3.16Å; F654-F657 PolarHBondContact O-N 3.26Å; F657-M660 HydrophobicContact CD1-CE 4.29Å; F657-M660 PolarHBondContact O-N 2.96Å; F657-I661 VanDerWaalsContact O-CG1 3.29Å; F657-I661 WeakPolarHBondContact O-CG1 3.33Å; F657-I661 PolarHBondContact O-N 2.99Å
658	V	97.1	Very high	96.7	Very high	55 Å²	55	41 Å²	41	33%	0.333	21%	0.213	S	C	.	.	H	α-helix	trans	-62.6	-43.8	173.6	171.9	0	0	0	0	111.3	F654 T662	F654-V658 HydrophobicContact CD1-CG2 4.24Å; F654-V658 HydrophobicContact CD2-CG2 4.38Å; F654-V658 HydrophobicContact CE1-CG2 3.79Å; F654-V658 HydrophobicContact CE2-CG2 3.95Å; F654-V658 HydrophobicContact CZ-CG2 3.64Å; F654-V658 WeakPolarHBondContact O-CG2 3.44Å; F654-V658 PolarHBondContact O-N 3.13Å; V658-T662 VanDerWaalsContact O-CB 3.23Å; V658-T662 WeakPolarHBondContact O-CB 3.08Å; V658-T662 PolarHBondContact O-N 2.78Å; V658-T662 PolarHBondContact O-OG1 3.25Å
659	A	97.1	Very high	96.4	Very high	2 Å²	2	40.7 Å²	40.7	2%	0.017	21%	0.211	C	C	.	.	H	α-helix	trans	-65.4	-43	175.2	0	0	0	0	0	112.5	T484 A487 F559 S655 Q656 I661 T662 Y663	T484-A659 HydrophobicContact CG2-CB 4.25Å; A487-A659 HydrophobicContact CB-CB 3.38Å; F559-A659 HydrophobicContact CD1-CB 4.45Å; S655-A659 WeakPolarHBondContact O-CB 3.48Å; S655-A659 PolarHBondContact O-N 3.04Å; Q656-A659 PolarHBondContact O-N 3.41Å; A659-I661 PolarHBondContact O-N 3.29Å; A659-T662 PolarHBondContact O-N 3.29Å; A659-Y663 VanDerWaalsContact O-CB 3.25Å; A659-Y663 WeakPolarHBondContact O-CB 3.42Å; A659-Y663 PolarHBondContact O-N 3.22Å
660	M	97.5	Very high	96.1	Very high	39 Å²	39	46.6 Å²	46.6	19%	0.192	24%	0.239	C	C	.	.	H	α-helix	trans	-55.5	-52.8	175.1	-176.5	-165.3	70.6	0	0	111.2	F559 G560 Q656 F657 Y663 L664	F559-M660 HydrophobicContact CB-CB 3.91Å; G560-M660 WeakPolarHBondContact CA-SD 3.46Å; Q656-M660 VanDerWaalsContact O-CB 3.31Å; Q656-M660 WeakPolarHBondContact O-CB 3.26Å; Q656-M660 PolarHBondContact O-N 3.17Å; F657-M660 HydrophobicContact CD1-CE 4.29Å; F657-M660 PolarHBondContact O-N 2.96Å; M660-Y663 PolarHBondContact O-N 3.44Å; M660-L664 HydrophobicContact CG-CD1 3.99Å; M660-L664 WeakPolarHBondContact O-CB 3.49Å; M660-L664 VanDerWaalsContact O-CG 3.26Å; M660-L664 WeakPolarHBondContact O-CG 3.47Å; M660-L664 PolarHBondContact O-N 3Å
661	I	97.5	Very high	95.7	Very high	90 Å²	90	49 Å²	49	46%	0.462	25%	0.245	S	C	.	.	H	α-helix	trans	-63.1	-49.2	-179.1	-67.4	164.7	0	0	0	110.4	F657 A659 Y663 L664 L665	F657-I661 VanDerWaalsContact O-CG1 3.29Å; F657-I661 WeakPolarHBondContact O-CG1 3.33Å; F657-I661 PolarHBondContact O-N 2.99Å; A659-I661 PolarHBondContact O-N 3.29Å; I661-Y663 VanDerWaalsContact C-N 3.3Å; I661-Y663 PolarHBondContact O-N 3Å; I661-L664 PolarHBondContact O-N 3.28Å; I661-L665 HydrophobicContact CG2-CD1 3.82Å; I661-L665 HydrophobicContact CG2-CG 4.44Å; I661-L665 WeakPolarHBondContact O-CB 3.44Å; I661-L665 WeakPolarHBondContact O-CG 3.3Å; I661-L665 PolarHBondContact O-N 3.07Å
662	T	96.3	Very high	95.4	Very high	23 Å²	23	47.5 Å²	47.5	14%	0.141	24%	0.236	C	C	.	.	H	α-helix	trans	-56.9	-42.8	178	-58.9	0	0	0	0	111.6	F483 V658 A659 F666	F483-T662 HydrophobicContact CB-CG2 4.1Å; F483-T662 HydrophobicContact CD2-CG2 3.72Å; F483-T662 HydrophobicContact CG-CG2 4.15Å; V658-T662 VanDerWaalsContact O-CB 3.23Å; V658-T662 WeakPolarHBondContact O-CB 3.08Å; V658-T662 PolarHBondContact O-N 2.78Å; V658-T662 PolarHBondContact O-OG1 3.25Å; A659-T662 PolarHBondContact O-N 3.29Å; T662-F666 HydrophobicContact CG2-CD2 3.99Å; T662-F666 WeakPolarHBondContact O-CB 3.3Å; T662-F666 WeakPolarHBondContact O-CD2 3.29Å; T662-F666 PolarHBondContact O-N 3.49Å
663	Y	96.7	Very high	94.9	Very high	0 Å²	0	53 Å²	53	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-71.5	-43.3	-179.9	-163.1	-94.7	0	0	0	112.7	A480 T484 K552 A555 G595 N599 A659 M660 I661 L665 S667	A480-Y663 HydrophobicContact CB-CD2 4.15Å; T484-Y663 HydrophobicContact CG2-CD2 3.44Å; T484-Y663 VanDerWaalsContact CG2-CD2 3.44Å; T484-Y663 HydrophobicContact CG2-CE2 4.31Å; T484-Y663 HydrophobicContact CG2-CG 3.79Å; K552-Y663 HydrophobicContact CG-CD1 4.38Å; K552-Y663 HydrophobicContact CG-CE1 4.32Å; A555-Y663 HydrophobicContact CB-CD1 3.5Å; A555-Y663 VanDerWaalsContact CB-CD1 3.5Å; A555-Y663 HydrophobicContact CB-CE1 3.51Å; A555-Y663 HydrophobicContact CB-CG 4.26Å; G595-Y663 PolarHBondContact O-OH 3.11Å; G595-Y663 VanDerWaalsContact O-OH 3.08Å; N599-Y663 VanDerWaalsContact CB-OH 3.3Å; N599-Y663 WeakPolarHBondContact CB-OH 3.42Å; N599-Y663 PolarHBondContact ND2-OH 3.27Å; A659-Y663 VanDerWaalsContact O-CB 3.25Å; A659-Y663 WeakPolarHBondContact O-CB 3.42Å; A659-Y663 PolarHBondContact O-N 3.22Å; M660-Y663 PolarHBondContact O-N 3.44Å; I661-Y663 VanDerWaalsContact C-N 3.3Å; I661-Y663 PolarHBondContact O-N 3Å; Y663-L665 VanDerWaalsContact C-N 3.31Å; Y663-L665 PolarHBondContact O-N 3.23Å; Y663-S667 WeakPolarHBondContact CD1-OG 3.06Å; Y663-S667 VanDerWaalsContact CE1-OG 3.31Å; Y663-S667 WeakPolarHBondContact CE1-OG 3.36Å; Y663-S667 VanDerWaalsContact O-CB 3.26Å; Y663-S667 WeakPolarHBondContact O-CB 3.43Å; Y663-S667 PolarHBondContact O-N 3.17Å; Y663-S667 VanDerWaalsContact O-N 3.1Å; Y663-S667 PolarHBondContact O-OG 2.98Å
664	L	96.9	Very high	94.4	Very high	73 Å²	73	53.8 Å²	53.8	38%	0.382	28%	0.278	S	S	.	.	H	α-helix	trans	-62.4	-38	177.3	-72	175.8	0	0	0	112	K552 M660 I661	K552-L664 HydrophobicContact CB-CD2 3.92Å; K552-L664 WeakPolarHBondContact CD-O 3.44Å; K552-L664 WeakPolarHBondContact CE-O 3.32Å; K552-L664 HydrophobicContact CG-CD2 4.36Å; K552-L664 PolarHBondContact NZ-O 3.35Å; K552-L664 WeakPolarHBondContact O-CD2 3.23Å; M660-L664 HydrophobicContact CG-CD1 3.99Å; M660-L664 WeakPolarHBondContact O-CB 3.49Å; M660-L664 VanDerWaalsContact O-CG 3.26Å; M660-L664 WeakPolarHBondContact O-CG 3.47Å; M660-L664 PolarHBondContact O-N 3Å; I661-L664 PolarHBondContact O-N 3.28Å
665	L	96.2	Very high	93.9	Very high	114 Å²	114	47.2 Å²	47.2	60%	0.597	25%	0.249	S	C	*	.	H	α-helix	trans	-74	-57.6	175.9	-65.8	174.7	0	0	0	112.1	K552 I661 Y663	K552-L665 PolarHBondContact NZ-O 3.22Å; I661-L665 HydrophobicContact CG2-CD1 3.82Å; I661-L665 HydrophobicContact CG2-CG 4.44Å; I661-L665 WeakPolarHBondContact O-CB 3.44Å; I661-L665 WeakPolarHBondContact O-CG 3.3Å; I661-L665 PolarHBondContact O-N 3.07Å; Y663-L665 VanDerWaalsContact C-N 3.31Å; Y663-L665 PolarHBondContact O-N 3.23Å
666	F	95	Very high	93.1	Very high	99 Å²	99	47.3 Å²	47.3	43%	0.434	25%	0.246	S	C	.	.	H	α-helix	trans	-103.2	-11.2	-160.5	-57.5	-60.4	0	0	0	116.4	R476 A480 T662	R476-F666 HydrophobicContact CB-CB 4.29Å; A480-F666 HydrophobicContact CB-CB 4.2Å; T662-F666 HydrophobicContact CG2-CD2 3.99Å; T662-F666 WeakPolarHBondContact O-CB 3.3Å; T662-F666 WeakPolarHBondContact O-CD2 3.29Å; T662-F666 PolarHBondContact O-N 3.49Å
667	S	93	Very high	91.8	Very high	5 Å²	5	49 Å²	49	4%	0.035	26%	0.258	C	S	.	.			trans	-71.9	145.9	176.7	68.5	0	0	0	0	112.2	K552 Y663	K552-S667 WeakPolarHBondContact CE-O 3.43Å; K552-S667 WeakPolarHBondContact CE-OG 3.35Å; K552-S667 WeakPolarHBondContact CG-OG 3.42Å; K552-S667 PolarHBondContact NZ-O 3.36Å; Y663-S667 WeakPolarHBondContact CD1-OG 3.06Å; Y663-S667 VanDerWaalsContact CE1-OG 3.31Å; Y663-S667 WeakPolarHBondContact CE1-OG 3.36Å; Y663-S667 VanDerWaalsContact O-CB 3.26Å; Y663-S667 WeakPolarHBondContact O-CB 3.43Å; Y663-S667 PolarHBondContact O-N 3.17Å; Y663-S667 VanDerWaalsContact O-N 3.1Å; Y663-S667 PolarHBondContact O-OG 2.98Å
668	S	93.4	Very high	90	Very high	21 Å²	21	50.8 Å²	50.8	15%	0.147	28%	0.275	C	S	.	.			trans	-134.9	155.4	160.7	-174.2	0	0	0	0	108.2	N599 E670	N599-S668 PolarHBondContact ND2-O 3.16Å; N599-S668 PolarHBondContact OD1-O 2.98Å; S668-E670 PolarHBondContact OG-N 3.23Å
669	S	90.9	Very high	88.4	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	27%	0.273	C	S	.	.			trans	-116.3	19.4	170.4	-54	0	0	0	0	111.8	R547 T548 H551 N599	R547-S669 VanDerWaalsContact CZ-O 3.28Å; R547-S669 PolarHBondContact NH1-O 2.99Å; R547-S669 VanDerWaalsContact NH1-O 3.15Å; R547-S669 PolarHBondContact NH2-O 3.42Å; T548-S669 PolarHBondContact OG1-N 3.4Å; H551-S669 PolarHBondContact ND1-OG 3.13Å; N599-S669 VanDerWaalsContact CG-OG 3.27Å; N599-S669 WeakPolarHBondContact OD1-CA 3.43Å; N599-S669 VanDerWaalsContact OD1-CB 3.24Å; N599-S669 WeakPolarHBondContact OD1-CB 3.37Å; N599-S669 PolarHBondContact OD1-OG 3.18Å
670	E	90.8	Very high	86.2	Confident	125 Å²	125	57.3 Å²	57.3	58%	0.584	31%	0.309	S	S	*	.	S	Bend	trans	-85.5	132.4	166.6	-66.5	171.4	168.8	0	0	109	S668 Q672	S668-E670 PolarHBondContact OG-N 3.23Å; E670-Q672 PolarHBondContact O-N 3.13Å; E670-Q672 PolarHBondContact O-NE2 3.32Å
671	Q	89.7	Confident	84	Confident	99 Å²	99	62.3 Å²	62.3	46%	0.463	33%	0.332	S	S	.	.	P	Polyproline II helix	trans	-56.8	126.8	-179.8	-178.1	-166	-68.2	0	0	109.6	A675 Y676	Q671-A675 HydrophobicContact CG-CB 3.57Å; Q671-Y676 HydrophobicContact CG-CE2 4.48Å
672	Q	89.7	Confident	81.9	Confident	38 Å²	38	60.9 Å²	60.9	18%	0.178	33%	0.325	C	S	.	.	P	Polyproline II helix	trans	-68.4	151.3	177.9	-56.8	-66.6	-91	0	0	110.9	S475 L603 E670 W674 A675	S475-Q672 PolarHBondContact OG-OE1 3.4Å; L603-Q672 HydrophobicContact CD1-CG 3.47Å; L603-Q672 VanDerWaalsContact CD1-CG 3.47Å; L603-Q672 HydrophobicContact CG-CG 3.76Å; L603-Q672 PolarHBondContact O-N 3.21Å; E670-Q672 PolarHBondContact O-N 3.13Å; E670-Q672 PolarHBondContact O-NE2 3.32Å; Q672-W674 HydrophobicContact CB-CD2 3.87Å; Q672-W674 HydrophobicContact CB-CG 4.11Å; Q672-W674 HydrophobicContact CB-CZ2 3.94Å; Q672-W674 HydrophobicContact CG-CH2 4.35Å; Q672-W674 HydrophobicContact CG-CZ2 3.67Å; Q672-W674 PolarHBondContact O-N 3.06Å; Q672-A675 HydrophobicContact CB-CB 4.48Å; Q672-A675 WeakPolarHBondContact O-CB 3.33Å; Q672-A675 PolarHBondContact O-N 2.82Å
673	S	86.6	Confident	79.9	Confident	116 Å²	116	62.8 Å²	62.8	81%	0.811	34%	0.336	S	S	*	.	G	3₁₀ helix	trans	-55.3	-40.7	175.7	48.9	0	0	0	0	112.1	A675	S673-A675 PolarHBondContact O-N 3.27Å
674	W	88	Confident	77.5	Confident	17 Å²	17	67.5 Å²	67.5	6%	0.064	36%	0.362	C	S	.	.	G	3₁₀ helix	trans	-76.4	3	177.9	57.7	-102.6	0	0	0	115	P468 Q471 I472 V478 A604 F607 Q672 Y676	P468-W674 HydrophobicContact CB-CB 4.22Å; P468-W674 HydrophobicContact CG-CB 3.89Å; P468-W674 HydrophobicContact CG-CE3 4.18Å; P468-W674 HydrophobicContact CG-CG 4.48Å; Q471-W674 HydrophobicContact CB-CB 4.1Å; Q471-W674 HydrophobicContact CB-CG 3.86Å; Q471-W674 VanDerWaalsContact OE1-CB 3.29Å; I472-W674 HydrophobicContact CB-CH2 4.49Å; I472-W674 HydrophobicContact CD1-CZ3 4.36Å; I472-W674 HydrophobicContact CG1-CD2 4.32Å; I472-W674 HydrophobicContact CG1-CE3 3.78Å; I472-W674 HydrophobicContact CG1-CH2 3.9Å; I472-W674 HydrophobicContact CG1-CZ2 4.38Å; I472-W674 HydrophobicContact CG1-CZ3 3.57Å; V478-W674 HydrophobicContact CG2-CH2 3.91Å; V478-W674 HydrophobicContact CG2-CZ2 3.89Å; A604-W674 HydrophobicContact CB-CE3 4.45Å; A604-W674 HydrophobicContact CB-CH2 3.76Å; A604-W674 HydrophobicContact CB-CZ3 3.5Å; A604-W674 VanDerWaalsContact CB-CZ3 3.5Å; F607-W674 HydrophobicContact CD2-CE3 4.25Å; F607-W674 HydrophobicContact CD2-CZ3 4.25Å; F607-W674 VanDerWaalsContact CE2-O 3.3Å; F607-W674 WeakPolarHBondContact CE2-O 3.26Å; Q672-W674 HydrophobicContact CB-CD2 3.87Å; Q672-W674 HydrophobicContact CB-CG 4.11Å; Q672-W674 HydrophobicContact CB-CZ2 3.94Å; Q672-W674 HydrophobicContact CG-CH2 4.35Å; Q672-W674 HydrophobicContact CG-CZ2 3.67Å; Q672-W674 PolarHBondContact O-N 3.06Å; W674-Y676 PolarHBondContact O-N 2.72Å
675	A	85.8	Confident	75.3	Confident	0 Å²	0	68.8 Å²	68.8	0%	0	37%	0.369	C	S	.	.	G	3₁₀ helix	trans	-69.8	-10.3	-173.3	0	0	0	0	0	115.2	A604 N606 Q671 Q672 S673	A604-A675 HydrophobicContact CB-CB 4.39Å; N606-A675 WeakPolarHBondContact CB-O 3.46Å; Q671-A675 HydrophobicContact CG-CB 3.57Å; Q672-A675 HydrophobicContact CB-CB 4.48Å; Q672-A675 WeakPolarHBondContact O-CB 3.33Å; Q672-A675 PolarHBondContact O-N 2.82Å; S673-A675 PolarHBondContact O-N 3.27Å
676	Y	82	Confident	73.1	Confident	23 Å²	23	68.6 Å²	68.6	9%	0.09	37%	0.368	C	S	.	.	S	Bend	trans	-133.2	160.5	169.9	-66	-81.2	0	0	0	109	S455 R457 L458 N606 Q671 W674	S455-Y676 VanDerWaalsContact CB-OH 3.29Å; S455-Y676 WeakPolarHBondContact CB-OH 3.42Å; R457-Y676 HydrophobicContact CB-CD1 3.8Å; R457-Y676 HydrophobicContact CB-CE1 4.01Å; R457-Y676 HydrophobicContact CB-CG 4.22Å; L458-Y676 HydrophobicContact CB-CE1 3.84Å; L458-Y676 HydrophobicContact CD1-CE1 3.85Å; L458-Y676 HydrophobicContact CG-CE1 4.47Å; N606-Y676 HydrophobicContact CB-CD1 4.04Å; N606-Y676 HydrophobicContact CB-CE1 4.19Å; Q671-Y676 HydrophobicContact CG-CE2 4.48Å; W674-Y676 PolarHBondContact O-N 2.72Å
677	S	69.4	Low	71.1	Confident	34 Å²	34	68.6 Å²	68.6	24%	0.238	37%	0.373	C	S	.	.	P	Polyproline II helix	trans	-70.4	148.7	163.2	-65.6	0	0	0	0	109.9	T465 T679	T465-S677 WeakPolarHBondContact CG2-OG 3.33Å; S677-T679 PolarHBondContact O-N 2.92Å
678	P	60.5	Low	68.9	Low	94 Å²	94	74 Å²	74	61%	0.61	40%	0.398	S	S	*	.	P	Polyproline II helix	trans	-54.4	134.6	172.4	-25.1	34.5	0	0	0	111.3	D682 V683	P678-D682 WeakPolarHBondContact CA-OD2 3.46Å; P678-D682 HydrophobicContact CB-CB 3.98Å; P678-V683 HydrophobicContact CB-CG2 4.04Å
679	T	62.5	Low	66.9	Low	47 Å²	47	77.8 Å²	77.8	29%	0.288	42%	0.416	S	S	.	.	P	Polyproline II helix	trans	-75.9	164	160.9	43.3	0	0	0	0	109.6	R457 S677 E681 D682 V683	R457-T679 HydrophobicContact CG-CG2 4.49Å; S677-T679 PolarHBondContact O-N 2.92Å; T679-E681 PolarHBondContact O-N 3.26Å; T679-D682 PolarHBondContact N-OD2 2.99Å; T679-D682 WeakPolarHBondContact O-CB 3.38Å; T679-D682 PolarHBondContact O-N 3.13Å; T679-D682 PolarHBondContact OG1-OD2 3.38Å; T679-D682 VanDerWaalsContact OG1-OD2 3.06Å; T679-V683 PolarHBondContact O-N 3.32Å
680	L	52.3	Low	64.8	Low	147 Å²	147	82.4 Å²	82.4	77%	0.77	44%	0.441	S	S	*	.	H	α-helix	trans	-56.3	-39.3	176.2	-66.5	169.6	0	0	0	111.1	D682 V683 D684	L680-D682 VanDerWaalsContact C-N 3.3Å; L680-D682 PolarHBondContact O-N 3.25Å; L680-V683 WeakPolarHBondContact O-CA 3.46Å; L680-V683 WeakPolarHBondContact O-CB 3.5Å; L680-V683 PolarHBondContact O-N 3.03Å; L680-D684 PolarHBondContact O-N 3.12Å
681	E	51.2	Low	62.8	Low	143 Å²	143	82.9 Å²	82.9	67%	0.668	44%	0.443	S	S	*	.	H	α-helix	trans	-58.6	-33	171.8	-59.9	172	156.9	0	0	113.9	T679 V683 N685	T679-E681 PolarHBondContact O-N 3.26Å; E681-V683 VanDerWaalsContact C-N 3.34Å; E681-N685 PolarHBondContact O-ND2 2.72Å
682	D	54.1	Low	60.7	Low	60 Å²	60	82.3 Å²	82.3	32%	0.321	44%	0.443	S	S	.	.	H	α-helix	trans	-71.1	-33.2	175	-61.3	-44.4	0	0	0	110.2	R457 P678 T679 L680 D686	R457-D682 IonicContact CZ-OD2 3.99Å; R457-D682 IonicContact NH1-OD1 2.82Å; R457-D682 PolarHBondContact NH1-OD1 2.92Å; R457-D682 IonicContact NH1-OD2 2.72Å; R457-D682 PolarHBondContact NH1-OD2 2.95Å; P678-D682 WeakPolarHBondContact CA-OD2 3.46Å; P678-D682 HydrophobicContact CB-CB 3.98Å; T679-D682 PolarHBondContact N-OD2 2.99Å; T679-D682 WeakPolarHBondContact O-CB 3.38Å; T679-D682 PolarHBondContact O-N 3.13Å; T679-D682 PolarHBondContact OG1-OD2 3.38Å; T679-D682 VanDerWaalsContact OG1-OD2 3.06Å; L680-D682 VanDerWaalsContact C-N 3.3Å; L680-D682 PolarHBondContact O-N 3.25Å; D682-D686 PolarHBondContact O-N 2.74Å
683	V	53.7	Low	58.5	Low	63 Å²	63	84.6 Å²	84.6	38%	0.382	46%	0.457	S	S	.	.	H	α-helix	trans	-75.5	-44.6	-179.4	-179	0	0	0	0	112.1	P678 T679 L680 E681 N685 D686 D687	P678-V683 HydrophobicContact CB-CG2 4.04Å; T679-V683 PolarHBondContact O-N 3.32Å; L680-V683 WeakPolarHBondContact O-CA 3.46Å; L680-V683 WeakPolarHBondContact O-CB 3.5Å; L680-V683 PolarHBondContact O-N 3.03Å; E681-V683 VanDerWaalsContact C-N 3.34Å; V683-N685 PolarHBondContact O-N 3.38Å; V683-N685 VanDerWaalsContact O-N 3.15Å; V683-D686 PolarHBondContact O-N 3.47Å; V683-D686 VanDerWaalsContact O-N 3.12Å; V683-D687 PolarHBondContact O-N 3.48Å
684	D	46.5	Very low	56.5	Low	99 Å²	99	83 Å²	83	53%	0.529	44%	0.442	S	S	.	.	H	α-helix	trans	-60.1	-26.4	179.4	-69.1	-37.8	0	0	0	112.4	L680 Q688	L680-D684 PolarHBondContact O-N 3.12Å; D684-Q688 WeakPolarHBondContact O-CG 3.4Å; D684-Q688 PolarHBondContact O-N 3.15Å
685	N	50.3	Low	54.2	Low	101 Å²	101	87.8 Å²	87.8	54%	0.54	47%	0.469	S	S	.	.	H	α-helix	trans	-79.6	-43.9	174.1	-77.2	-73.7	0	0	0	112.5	E681 V683 D687 Q688 D689	E681-N685 PolarHBondContact O-ND2 2.72Å; V683-N685 PolarHBondContact O-N 3.38Å; V683-N685 VanDerWaalsContact O-N 3.15Å; N685-D687 VanDerWaalsContact C-N 3.29Å; N685-D687 PolarHBondContact O-N 3.19Å; N685-Q688 PolarHBondContact O-N 2.78Å; N685-D689 PolarHBondContact O-N 2.97Å
686	D	50.2	Low	52.2	Low	109 Å²	109	95.5 Å²	95.5	58%	0.583	50%	0.502	S	S	*	.	H	α-helix	trans	-59.1	-39.4	175.8	-94.4	-13.8	0	0	0	111.4	D682 V683 D689 N690	D682-D686 PolarHBondContact O-N 2.74Å; V683-D686 PolarHBondContact O-N 3.47Å; V683-D686 VanDerWaalsContact O-N 3.12Å; D686-D689 PolarHBondContact O-N 3.45Å; D686-N690 WeakPolarHBondContact O-CB 3.46Å; D686-N690 PolarHBondContact O-N 3.03Å; D686-N690 PolarHBondContact O-ND2 3.25Å
687	D	51.8	Low	50	Low	99 Å²	99	101.1 Å²	101.1	53%	0.529	53%	0.534	S	S	.	.	H	α-helix	trans	-69	-34.7	177	-83.3	-25.5	0	0	0	112.7	V683 N685 H691	V683-D687 PolarHBondContact O-N 3.48Å; N685-D687 VanDerWaalsContact C-N 3.29Å; N685-D687 PolarHBondContact O-N 3.19Å; D687-H691 PolarHBondContact O-N 3.02Å
688	Q	48.6	Very low	48.2	Very low	120 Å²	120	109.2 Å²	109.2	56%	0.561	56%	0.559	S	S	*	*	H	α-helix	trans	-67	-42.7	173.5	-76.3	-176.6	38.7	0	0	112.4	D684 N685 H691 N692	D684-Q688 WeakPolarHBondContact O-CG 3.4Å; D684-Q688 PolarHBondContact O-N 3.15Å; N685-Q688 PolarHBondContact O-N 2.78Å; Q688-H691 PolarHBondContact O-N 3.18Å; Q688-N692 PolarHBondContact O-N 2.86Å; Q688-N692 PolarHBondContact O-ND2 3.02Å
689	D	50.1	Low	46.8	Very low	100 Å²	100	109.9 Å²	109.9	54%	0.535	56%	0.564	S	S	.	*	H	α-helix	trans	-70.6	-30.6	177.8	-97.7	-10.7	0	0	0	112.7	N685 D686 N692 N693	N685-D689 PolarHBondContact O-N 2.97Å; D686-D689 PolarHBondContact O-N 3.45Å; D689-N692 PolarHBondContact O-N 3Å; D689-N693 WeakPolarHBondContact O-CB 3.43Å; D689-N693 PolarHBondContact O-N 3.42Å; D689-N693 PolarHBondContact O-ND2 3.44Å
690	N	47.8	Very low	45.2	Very low	97 Å²	97	116.6 Å²	116.6	52%	0.519	59%	0.594	S	S	.	*	H	α-helix	trans	-66.8	-39.5	169.2	-79.7	-63.4	0	0	0	112.2	D686 T694	D686-N690 WeakPolarHBondContact O-CB 3.46Å; D686-N690 PolarHBondContact O-N 3.03Å; D686-N690 PolarHBondContact O-ND2 3.25Å; N690-T694 WeakPolarHBondContact O-CG2 3.46Å; N690-T694 PolarHBondContact O-N 2.9Å; N690-T694 PolarHBondContact O-OG1 3.45Å
691	H	48.7	Very low	44.3	Very low	134 Å²	134	118 Å²	118	62%	0.62	60%	0.597	S	S	*	*	H	α-helix	trans	-66.3	-37.5	172.9	-103.2	-49	0	0	0	113.2	D687 Q688 T694 N695	D687-H691 PolarHBondContact O-N 3.02Å; Q688-H691 PolarHBondContact O-N 3.18Å; H691-T694 WeakPolarHBondContact CA-OG1 3.41Å; H691-T694 PolarHBondContact O-OG1 2.84Å; H691-T694 VanDerWaalsContact O-OG1 3.12Å; H691-N695 PolarHBondContact O-N 3.03Å; H691-N695 PolarHBondContact O-ND2 3.32Å
692	N	44.2	Very low	43.3	Very low	87 Å²	87	119.4 Å²	119.4	47%	0.465	60%	0.603	S	S	.	*	H	α-helix	trans	-69.7	-35.2	176.8	-76.5	-41.1	0	0	0	113.1	Q688 D689	Q688-N692 PolarHBondContact O-N 2.86Å; Q688-N692 PolarHBondContact O-ND2 3.02Å; D689-N692 PolarHBondContact O-N 3Å
693	N	44	Very low	42.2	Very low	87 Å²	87	124.7 Å²	124.7	47%	0.465	63%	0.63	S	S	.	*	H	α-helix	trans	-77.6	-36.2	177.5	-77.2	-59.7	0	0	0	113.2	D689 N695 K696	D689-N693 WeakPolarHBondContact O-CB 3.43Å; D689-N693 PolarHBondContact O-N 3.42Å; D689-N693 PolarHBondContact O-ND2 3.44Å; N693-N695 PolarHBondContact O-N 3.12Å; N693-K696 PolarHBondContact O-N 3.15Å; N693-K696 VanDerWaalsContact O-N 3.15Å
694	T	45.1	Very low	41.3	Very low	83 Å²	83	128.2 Å²	128.2	51%	0.509	65%	0.646	S	S	.	*	H	α-helix	trans	-64.9	-26.7	176.3	45.3	0	0	0	0	113.4	N690 H691	N690-T694 WeakPolarHBondContact O-CG2 3.46Å; N690-T694 PolarHBondContact O-N 2.9Å; N690-T694 PolarHBondContact O-OG1 3.45Å; H691-T694 WeakPolarHBondContact CA-OG1 3.41Å; H691-T694 PolarHBondContact O-OG1 2.84Å; H691-T694 VanDerWaalsContact O-OG1 3.12Å
695	N	40.7	Very low	40.5	Very low	116 Å²	116	132.1 Å²	132.1	62%	0.62	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79	-14.7	174.4	-80	-30.8	0	0	0	114.8	H691 N693	H691-N695 PolarHBondContact O-N 3.03Å; H691-N695 PolarHBondContact O-ND2 3.32Å; N693-N695 PolarHBondContact O-N 3.12Å
696	K	42.8	Very low	39.6	Very low	163 Å²	163	132.9 Å²	132.9	71%	0.709	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.5	-17.4	179	-76.7	177	179.2	168.2	0	114.6	N693	N693-K696 PolarHBondContact O-N 3.15Å; N693-K696 VanDerWaalsContact O-N 3.15Å
697	N	36.7	Very low	38.7	Very low	141 Å²	141	136 Å²	136	75%	0.754	69%	0.688	S	S	*	*	S	Bend	trans	-110.6	14.4	-171.2	-73.7	-15.2	0	0	0	114.8
698	R	29.9	Very low	38.2	Very low	203 Å²	203	143.2 Å²	143.2	77%	0.766	72%	0.724	S	S	*	*			trans	-83.8	126.5	166.3	-67.9	-167.9	-172.2	-165.4	3.9	110.1
699	P	31.5	Very low	37.7	Very low	108 Å²	108	144.4 Å²	144.4	70%	0.701	73%	0.732	S	S	*	*			trans	-60.2	151	161.3	-18.5	32.1	0	0	0	110.6	E701	P699-E701 PolarHBondContact O-N 2.92Å
700	M	30.2	Very low	37	Very low	188 Å²	188	146.7 Å²	146.7	93%	0.926	74%	0.742	S	S	*	*			trans	-73	75.3	166.9	-83.1	-91.8	-71.4	0	0	109.9	Q702	M700-Q702 PolarHBondContact O-N 3.48Å
701	E	32.2	Very low	36.4	Very low	177 Å²	177	149.5 Å²	149.5	83%	0.827	76%	0.755	S	S	*	*			trans	-68	128.4	163.3	-72.9	-164	132.3	0	0	109.5	P699 I703	P699-E701 PolarHBondContact O-N 2.92Å; E701-I703 PolarHBondContact O-N 2.89Å
702	Q	29.7	Very low	35.7	Very low	173 Å²	173	150.4 Å²	150.4	81%	0.808	76%	0.762	S	S	*	*			trans	-73.6	110	-172.7	-66.4	172.5	-45	0	0	110.3	M700 N704	M700-Q702 PolarHBondContact O-N 3.48Å; Q702-N704 VanDerWaalsContact C-N 3.26Å; Q702-N704 PolarHBondContact O-N 3.2Å
703	I	31.5	Very low	35.2	Very low	170 Å²	170	154.4 Å²	154.4	87%	0.872	78%	0.781	S	S	*	*			trans	-69.2	90	164.4	-58.6	177.6	0	0	0	107.5	E701	E701-I703 PolarHBondContact O-N 2.89Å
704	N	34.5	Very low	34.6	Very low	137 Å²	137	158.9 Å²	158.9	73%	0.733	80%	0.802	S	S	*	*			trans	-74.6	138.4	174	-115	-22.5	0	0	0	109.9	Q702	Q702-N704 VanDerWaalsContact C-N 3.26Å; Q702-N704 PolarHBondContact O-N 3.2Å
705	H	31.1	Very low	33.8	Very low	182 Å²	182	164.3 Å²	164.3	84%	0.843	82%	0.823	S	S	*	*			trans	-64.9	139.7	-174.3	-88.5	-111.9	0	0	0	113.6
706	S	30.1	Very low	33.3	Very low	117 Å²	117	168 Å²	168	82%	0.818	84%	0.839	S	S	*	*			trans	-153.7	46.3	164.1	55.8	0	0	0	0	114.1
707	M	31.8	Very low	32.5	Very low	174 Å²	174	168.4 Å²	168.4	86%	0.857	85%	0.849	S	S	*	*			trans	-142.1	98.4	158.6	-81.5	-163.5	177.3	0	0	111.3
708	I	40.6	Very low	32.1	Very low	251 Å²	251	170.9 Å²	170.9	100%	1.287	86%	0.858	S	S	*	*			trans	178.8	0	145.7	-93.8	159	0	0	0	106.7

Retrieved 708 of 708 residues in 1538.7 ms (Link to these results)

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