A0A077YXA7_TRITR Loading...

Retinoid X receptor

AlphaFold DB , UniProt , Accession A0A077YXA7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 506 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	45.2	Very low	42.6	Very low	231 Å²	231	152.8 Å²	152.8	100%	1.138	75%	0.749	S	S	*	*				0	31.8	0	-59.8	-142.8	-73.1	0	0	112.4
2	R	44.2	Very low	41.9	Very low	222 Å²	222	152.3 Å²	152.3	84%	0.838	74%	0.744	S	S	*	*			trans	-114.5	3.6	-176	-74.7	-175.9	-163.3	176.5	5.9	113.6
3	D	48.5	Very low	41.2	Very low	153 Å²	153	157.1 Å²	157.1	82%	0.818	75%	0.749	S	S	*	*	S	Bend	trans	-107.4	-2.1	-171.7	-61.2	-51.3	0	0	0	114.4
4	E	47.1	Very low	40.5	Very low	178 Å²	178	161.8 Å²	161.8	83%	0.832	76%	0.756	S	S	*	*	S	Bend	trans	-98.4	-10.2	174.6	-83.4	177.3	120.6	0	0	114.2
5	Q	44.3	Very low	39.9	Very low	167 Å²	167	159.3 Å²	159.3	78%	0.78	75%	0.749	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.9	-5.1	-180	-74.5	-173.9	-26.3	0	0	114.3
6	H	41.2	Very low	39.2	Very low	157 Å²	157	154.8 Å²	154.8	73%	0.727	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.6	-5.9	-177.2	-125.8	-55.2	0	0	0	114.6
7	A	42.9	Very low	38.8	Very low	73 Å²	73	152.6 Å²	152.6	60%	0.603	75%	0.746	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.6	-28.4	179.4	0	0	0	0	0	113.7
8	D	40.8	Very low	38.4	Very low	109 Å²	109	150.2 Å²	150.2	58%	0.583	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.6	-27.7	178.5	-91.4	-35.1	0	0	0	113.9	K10 K11 Q12	D8-K10 VanDerWaalsContact C-N 3.25Å; D8-K10 PolarHBondContact O-N 3.22Å; D8-K11 PolarHBondContact O-N 3.34Å; D8-Q12 PolarHBondContact O-N 3.17Å
9	A	38.1	Very low	37.9	Very low	57 Å²	57	148.1 Å²	148.1	47%	0.471	74%	0.743	S	S	.	*	H	α-helix	trans	-70.1	-18.5	177.2	0	0	0	0	0	113.9
10	K	39.3	Very low	37.6	Very low	176 Å²	176	149.3 Å²	149.3	77%	0.765	75%	0.75	S	S	*	*	H	α-helix	trans	-91.6	-11.3	174.6	-111	176.3	179.2	176.3	0	113.5	D8	D8-K10 VanDerWaalsContact C-N 3.25Å; D8-K10 PolarHBondContact O-N 3.22Å
11	K	36.9	Very low	37.4	Very low	158 Å²	158	150.8 Å²	150.8	69%	0.687	76%	0.759	S	S	*	*	H	α-helix	trans	-97	-23.8	175.4	-146.2	168.6	-176.7	-179.1	0	112.4	D8	D8-K11 PolarHBondContact O-N 3.34Å
12	Q	34.7	Very low	36.6	Very low	146 Å²	146	144.1 Å²	144.1	68%	0.682	74%	0.741	S	S	*	*	H	α-helix	trans	-84.4	-18.8	173	-92.6	163.1	-23.1	0	0	115.4	D8 R14	D8-Q12 PolarHBondContact O-N 3.17Å; Q12-R14 VanDerWaalsContact C-N 3.35Å
13	R	32.3	Very low	35.9	Very low	215 Å²	215	137.8 Å²	137.8	81%	0.811	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.9	-3.4	173.5	-100.6	-177	167.3	-165.9	-3.3	115.1
14	R	31.5	Very low	35.3	Very low	223 Å²	223	136 Å²	136	84%	0.842	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.9	-2.3	171.1	-91.2	-179	167.9	177.4	-4.4	113.8	Q12	Q12-R14 VanDerWaalsContact C-N 3.35Å
15	N	31.1	Very low	34.8	Very low	124 Å²	124	132.7 Å²	132.7	66%	0.663	72%	0.715	S	S	*	*	S	Bend	trans	-118.8	15.7	178.2	-79.4	4.2	0	0	0	113.4
16	S	29.9	Very low	34.1	Very low	88 Å²	88	130.5 Å²	130.5	62%	0.615	71%	0.709	S	S	*	*	S	Bend	trans	-103	17.7	-180	57.7	0	0	0	0	114.3
17	S	31.9	Very low	33.7	Very low	118 Å²	118	129.8 Å²	129.8	83%	0.825	71%	0.707	S	S	*	*	S	Bend	trans	-110.8	12.2	173.4	-55.5	0	0	0	0	112.9
18	T	30.5	Very low	33.3	Very low	109 Å²	109	135.4 Å²	135.4	67%	0.669	71%	0.713	S	S	*	*	S	Bend	trans	-132.1	90.7	-179.6	42.7	0	0	0	0	109.1
19	S	29.7	Very low	32.9	Very low	109 Å²	109	136 Å²	136	76%	0.762	72%	0.715	S	S	*	*			trans	161.2	64.2	147.8	70.3	0	0	0	0	114.2
20	I	31.5	Very low	32.7	Very low	172 Å²	172	139.6 Å²	139.6	88%	0.882	73%	0.725	S	S	*	*	S	Bend	trans	-137.4	26.2	158.1	-47.8	175.2	0	0	0	111.8
21	L	33	Very low	32.5	Very low	181 Å²	181	136.6 Å²	136.6	95%	0.948	72%	0.721	S	S	*	*			trans	-128.9	12.3	172.9	-75.1	167.5	0	0	0	113.8	S23	L21-S23 PolarHBondContact O-N 3.02Å
22	A	29.3	Very low	32.4	Very low	92 Å²	92	132 Å²	132	76%	0.76	71%	0.713	S	S	*	*			trans	-88.7	77.7	167.5	0	0	0	0	0	109.5
23	S	29.6	Very low	32.3	Very low	89 Å²	89	131.2 Å²	131.2	62%	0.622	71%	0.713	S	S	*	*			trans	-149.5	104.1	163.2	-87.1	0	0	0	0	109.8	L21 N25	L21-S23 PolarHBondContact O-N 3.02Å; S23-N25 PolarHBondContact O-N 3.14Å
24	P	36.2	Very low	32.5	Very low	116 Å²	116	128.3 Å²	128.3	75%	0.753	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.9	7.4	-177	-7.1	18.7	0	0	0	114.8
25	N	35.2	Very low	32.6	Very low	107 Å²	107	124.9 Å²	124.9	57%	0.572	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.8	-1.9	-169	-74.6	-43.9	0	0	0	114.8	S23	S23-N25 PolarHBondContact O-N 3.14Å
26	L	31.6	Very low	32.6	Very low	122 Å²	122	123.9 Å²	123.9	64%	0.639	71%	0.71	S	S	*	*	S	Bend	trans	-85.8	-22.6	173.6	-152.5	73.4	0	0	0	112.3	R28 L29	L26-R28 PolarHBondContact O-N 2.95Å; L26-L29 PolarHBondContact O-N 3.32Å
27	M	31	Very low	32.8	Very low	142 Å²	142	128.2 Å²	128.2	70%	0.7	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.3	-12	174.1	-98.9	-147.9	-98.4	0	0	114.4
28	R	34.7	Very low	32.6	Very low	191 Å²	191	130 Å²	130	72%	0.721	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.9	-8.5	173.9	-81.7	-174	172.3	138.7	-4.5	114	L26	L26-R28 PolarHBondContact O-N 2.95Å
29	L	32.3	Very low	32.5	Very low	120 Å²	120	129.1 Å²	129.1	63%	0.628	72%	0.724	S	S	*	*	S	Bend	trans	-103.2	-8.1	-176.1	-83	158.4	0	0	0	114.2	L26	L26-L29 PolarHBondContact O-N 3.32Å
30	I	33.7	Very low	32.7	Very low	134 Å²	134	132.4 Å²	132.4	69%	0.687	73%	0.727	S	S	*	*	S	Bend	trans	-107.7	-15.1	-178.2	-59.9	175.4	0	0	0	111.7
31	V	36.7	Very low	32.7	Very low	112 Å²	112	129.6 Å²	129.6	68%	0.679	72%	0.722	S	S	*	*	S	Bend	trans	-96	-8.7	174.9	-178.7	0	0	0	0	112
32	A	34.7	Very low	32.5	Very low	61 Å²	61	127.5 Å²	127.5	50%	0.504	72%	0.717	S	S	.	*	T	Hydrogen-bonded Turn	trans	-90.6	-1.4	-177.3	0	0	0	0	0	115
33	D	32.6	Very low	32.5	Very low	131 Å²	131	129 Å²	129	70%	0.701	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.2	15.1	-176.2	-95.1	-20.1	0	0	0	114.2
34	L	36.9	Very low	32.4	Very low	154 Å²	154	130.2 Å²	130.2	81%	0.806	73%	0.727	S	S	*	*	S	Bend	trans	-115.1	1.8	176.5	-74.5	166.9	0	0	0	114.4
35	D	32.8	Very low	32.1	Very low	150 Å²	150	130 Å²	130	80%	0.802	73%	0.728	S	S	*	*	S	Bend	trans	-103.6	18.9	179.2	-82.5	-24	0	0	0	113.9
36	T	31.8	Very low	31.7	Very low	103 Å²	103	130.7 Å²	130.7	63%	0.632	74%	0.74	S	S	*	*			trans	-130.4	46.2	-176.1	41	0	0	0	0	113.9
37	L	32.6	Very low	31.7	Very low	180 Å²	180	131.6 Å²	131.6	94%	0.942	75%	0.751	S	S	*	*			trans	-140.6	60.6	160	-74.8	174.8	0	0	0	110.5
38	D	28.4	Very low	31.6	Very low	155 Å²	155	130.7 Å²	130.7	83%	0.829	75%	0.753	S	S	*	*			trans	-88.2	146.5	163.4	-133	-12.8	0	0	0	109.4
39	S	28.6	Very low	31.2	Very low	91 Å²	91	128.4 Å²	128.4	64%	0.636	76%	0.755	S	S	*	*			trans	85.3	95.5	179.2	76.4	0	0	0	0	117.8
40	H	33	Very low	31	Very low	177 Å²	177	127.6 Å²	127.6	82%	0.819	76%	0.759	S	S	*	*				172.2	121.6	105	-87.6	-69	0	0	0	112.7
41	S	32.6	Very low	30.9	Very low	113 Å²	113	126.5 Å²	126.5	79%	0.79	76%	0.764	S	S	*	*			trans	68.2	101.5	152.6	62.1	0	0	0	0	120.6
42	V	28	Very low	30.5	Very low	137 Å²	137	128.2 Å²	128.2	83%	0.83	77%	0.768	S	S	*	*			trans	-114.7	138.8	153.8	177.4	0	0	0	0	108.1
43	P	29.2	Very low	30.2	Very low	125 Å²	125	134.5 Å²	134.5	81%	0.812	79%	0.787	S	S	*	*			trans	-110.4	138.6	150.1	13.6	5.5	0	0	0	111.9
44	S	28.7	Very low	29.9	Very low	113 Å²	113	139.2 Å²	139.2	79%	0.79	80%	0.795	S	S	*	*			trans	-64.5	156.7	-169.1	-52	0	0	0	0	117.7
45	S	29	Very low	29.7	Very low	111 Å²	111	137.6 Å²	137.6	78%	0.776	80%	0.797	S	S	*	*			trans	132.3	114.1	147.6	64.8	0	0	0	0	109.1
46	C	27.5	Very low	29.5	Very low	122 Å²	122	138.1 Å²	138.1	82%	0.824	80%	0.8	S	S	*	*				-155.2	141.7	71.9	-66.2	0	0	0	0	111.6
47	V	31.1	Very low	29.5	Very low	141 Å²	141	141.3 Å²	141.3	86%	0.855	81%	0.813	S	S	*	*			trans	-71.3	137.3	-178.2	175.7	0	0	0	0	111
48	V	28.6	Very low	29.3	Very low	123 Å²	123	136.6 Å²	136.6	75%	0.745	81%	0.808	S	S	*	*			trans	-90.1	119.2	169.4	-170.8	0	0	0	0	107.5
49	D	27.5	Very low	29.4	Very low	143 Å²	143	132.9 Å²	132.9	77%	0.765	81%	0.806	S	S	*	*			trans	-88.7	109.6	170.5	-158.5	-14.5	0	0	0	109
50	S	27.7	Very low	29.3	Very low	103 Å²	103	133.8 Å²	133.8	72%	0.72	81%	0.812	S	S	*	*			trans	-96.7	95.8	173.8	-66.1	0	0	0	0	108.2
51	S	30.5	Very low	29	Very low	112 Å²	112	132.8 Å²	132.8	78%	0.783	81%	0.813	S	S	*	*			trans	-101.8	97.5	165.8	-71.2	0	0	0	0	109.6
52	L	28.1	Very low	28.7	Very low	148 Å²	148	136.7 Å²	136.7	78%	0.775	82%	0.815	S	S	*	*			trans	-77.1	117.4	171.2	-175.5	81.2	0	0	0	108.8
53	E	29.2	Very low	28.7	Very low	193 Å²	193	141.8 Å²	141.8	90%	0.902	82%	0.82	S	S	*	*			trans	-122.3	109.1	155.2	-76.2	-153.3	143.8	0	0	110
54	R	26.8	Very low	28.6	Very low	229 Å²	229	144.9 Å²	144.9	86%	0.864	82%	0.821	S	S	*	*			trans	-64.8	131	166.6	-82.2	175.2	170.1	-173.4	-3.6	109.3
55	S	31.4	Very low	28.5	Very low	120 Å²	120	146.6 Å²	146.6	84%	0.839	82%	0.821	S	S	*	*			trans	-135.6	115.9	143	33.6	0	0	0	0	108.6
56	N	29.2	Very low	28.4	Very low	162 Å²	162	146.5 Å²	146.5	87%	0.866	82%	0.82	S	S	*	*			trans	-63.1	128.9	166.4	-100.4	-10.1	0	0	0	108.3
57	D	32.3	Very low	28.3	Very low	169 Å²	169	145.3 Å²	145.3	90%	0.904	81%	0.808	S	S	*	*				-154.1	127.2	129.5	-119.5	-17.4	0	0	0	111
58	G	28.8	Very low	28.2	Very low	81 Å²	81	145.4 Å²	145.4	84%	0.835	80%	0.804	S	S	*	*			trans	-83.8	138.5	177.1	0	0	0	0	0	110.6
59	G	28.8	Very low	28.2	Very low	78 Å²	78	147.3 Å²	147.3	80%	0.804	80%	0.804	S	S	*	*			trans	-167.8	84.8	177.8	0	0	0	0	0	111.1
60	S	27.2	Very low	28.5	Very low	109 Å²	109	147.2 Å²	147.2	76%	0.762	81%	0.809	S	S	*	*			trans	-56	126.5	162.9	175.3	0	0	0	0	110.3
61	L	27.9	Very low	28.5	Very low	157 Å²	157	151.4 Å²	151.4	82%	0.822	82%	0.817	S	S	*	*				-175.4	141.8	123.8	-128.6	88.5	0	0	0	112.6
62	F	25.3	Very low	28.6	Very low	194 Å²	194	155.5 Å²	155.5	85%	0.851	82%	0.821	S	S	*	*			trans	-47.8	131.9	166.1	-72.6	-103.7	0	0	0	113.9
63	R	27.2	Very low	28.6	Very low	244 Å²	244	154.4 Å²	154.4	92%	0.921	82%	0.822	S	S	*	*			trans	-166.2	129.5	138.1	-126.9	176.5	174.4	149.1	-2.4	112.7
64	F	28.8	Very low	28.7	Very low	190 Å²	190	155.4 Å²	155.4	83%	0.833	82%	0.824	S	S	*	*			trans	-66.7	151.9	151.4	-98.4	-103.3	0	0	0	108.8
65	D	26.1	Very low	28.6	Very low	149 Å²	149	151.8 Å²	151.8	80%	0.797	82%	0.822	S	S	*	*			trans	97.8	124.6	174.4	-69.2	-41.3	0	0	0	120.6
66	C	26.7	Very low	28.6	Very low	110 Å²	110	152.4 Å²	152.4	74%	0.743	82%	0.82	S	S	*	*			trans	58.2	114.6	142.7	-83.7	0	0	0	0	121.8
67	T	25.9	Very low	28.7	Very low	96 Å²	96	150.7 Å²	150.7	59%	0.589	82%	0.816	S	S	*	*			trans	19.3	140.1	132.6	57.9	0	0	0	0	121.5
68	L	28.5	Very low	28.4	Very low	144 Å²	144	147 Å²	147	75%	0.754	81%	0.809	S	S	*	*			trans	79.6	131.8	165.4	-67.6	148.7	0	0	0	112.7
69	E	29	Very low	28.5	Very low	163 Å²	163	150.3 Å²	150.3	76%	0.762	81%	0.808	S	S	*	*			cis	-164.8	138.1	31.2	-117.6	150.1	-155.4	0	0	108.4
70	T	32.5	Very low	28.5	Very low	141 Å²	141	151.1 Å²	151.1	87%	0.865	80%	0.801	S	S	*	*			trans	-88.7	114.2	161.8	43.8	0	0	0	0	108.6
71	E	29.5	Very low	28.7	Very low	191 Å²	191	151.8 Å²	151.8	89%	0.893	81%	0.806	S	S	*	*			trans	-59.8	134.2	168.6	-63.1	-163.1	150.2	0	0	111.6
72	K	31.6	Very low	29	Very low	198 Å²	198	149.1 Å²	149.1	86%	0.861	80%	0.8	S	S	*	*			trans	-144	126.8	154.6	-112	-176.2	-177.7	-174.9	0	107.1
73	P	27.8	Very low	29.4	Very low	124 Å²	124	147.8 Å²	147.8	81%	0.805	80%	0.801	S	S	*	*			trans	-82.2	131.3	179.4	32.6	-30	0	0	0	109.2
74	F	31.8	Very low	29.5	Very low	215 Å²	215	141.5 Å²	141.5	94%	0.943	79%	0.793	S	S	*	*			trans	-154.7	121.6	154.8	-124.8	-88.5	0	0	0	110.1
75	N	24.9	Very low	29.6	Very low	153 Å²	153	138.3 Å²	138.3	82%	0.818	79%	0.792	S	S	*	*			trans	-51.8	145.5	173.9	-78.5	-30.7	0	0	0	112.5
76	V	31.5	Very low	29.9	Very low	132 Å²	132	139.2 Å²	139.2	80%	0.8	80%	0.795	S	S	*	*				176.8	108.8	129.8	164.8	0	0	0	0	109.7
77	T	29.8	Very low	29.9	Very low	126 Å²	126	139.1 Å²	139.1	77%	0.773	80%	0.795	S	S	*	*			trans	28.6	117.5	148.3	59.9	0	0	0	0	123
78	A	26.7	Very low	30.2	Very low	92 Å²	92	144.5 Å²	144.5	76%	0.76	81%	0.811	S	S	*	*				37.6	118.2	128.8	0	0	0	0	0	121.5
79	D	30.6	Very low	30.4	Very low	150 Å²	150	141.5 Å²	141.5	80%	0.802	81%	0.807	S	S	*	*				-169.5	110.9	108.2	-116.9	-26.3	0	0	0	114
80	S	28.6	Very low	30.6	Very low	95 Å²	95	142.8 Å²	142.8	66%	0.664	81%	0.813	S	S	*	*				42.1	132.2	127.7	-41.8	0	0	0	0	124.3
81	S	33.2	Very low	30.7	Very low	123 Å²	123	140.6 Å²	140.6	86%	0.86	81%	0.809	S	S	*	*			trans	78	128.8	154	67	0	0	0	0	117.8
82	S	33.9	Very low	30.8	Very low	102 Å²	102	136.9 Å²	136.9	71%	0.713	80%	0.804	S	S	*	*			cis	-164.3	125.7	34.1	49.4	0	0	0	0	110.5
83	L	32.4	Very low	31.2	Very low	166 Å²	166	132.9 Å²	132.9	87%	0.869	80%	0.799	S	S	*	*				57.6	130.4	106.7	-71	170.5	0	0	0	116
84	C	29.5	Very low	31.5	Very low	112 Å²	112	133 Å²	133	76%	0.757	80%	0.802	S	S	*	*			cis	-158.1	157.1	23	-73.5	0	0	0	0	111.8
85	P	31.3	Very low	31.6	Very low	123 Å²	123	126.9 Å²	126.9	80%	0.799	80%	0.8	S	S	*	*			trans	-109.6	163.2	164.8	37.7	-26.5	0	0	0	113.5
86	I	32.2	Very low	32.1	Very low	168 Å²	168	123.3 Å²	123.3	86%	0.862	80%	0.799	S	S	*	*			trans	-113.8	122.9	169.3	-63.2	176.3	0	0	0	108.5
87	S	26.5	Very low	32.1	Very low	107 Å²	107	125.7 Å²	125.7	75%	0.748	80%	0.802	S	S	*	*			trans	-95.2	151.4	170.9	-85.8	0	0	0	0	111.3
88	F	32.1	Very low	32.5	Very low	209 Å²	209	129 Å²	129	92%	0.917	81%	0.808	S	S	*	*			trans	-130.4	120.8	148.1	-110.2	-91.1	0	0	0	108.6
89	A	32.3	Very low	32.6	Very low	82 Å²	82	131.6 Å²	131.6	68%	0.678	81%	0.81	S	S	*	*			trans	-78.3	153	172.1	0	0	0	0	0	109.9
90	E	33.4	Very low	32.8	Very low	190 Å²	190	132.7 Å²	132.7	89%	0.888	81%	0.81	S	S	*	*				161.2	152.6	95.8	-85.2	176.8	147	0	0	104.6
91	A	34.8	Very low	32.8	Very low	95 Å²	95	132.9 Å²	132.9	79%	0.785	81%	0.811	S	S	*	*			cis	-163.2	143.1	-5.6	0	0	0	0	0	106.4
92	S	32.1	Very low	32.8	Very low	113 Å²	113	137.6 Å²	137.6	79%	0.79	81%	0.811	S	S	*	*			trans	-80.9	172	165.3	-47.8	0	0	0	0	110.2
93	P	40.5	Very low	32.5	Very low	114 Å²	114	140.4 Å²	140.4	74%	0.74	82%	0.817	S	S	*	*				-159	148.2	82.3	34.9	-11.1	0	0	0	119.2
94	S	33.2	Very low	32.6	Very low	126 Å²	126	143.5 Å²	143.5	88%	0.881	82%	0.819	S	S	*	*				67.3	129.3	126.4	-50.8	0	0	0	0	125.2
95	G	34.4	Very low	32.8	Very low	86 Å²	86	142.4 Å²	142.4	89%	0.887	82%	0.818	S	S	*	*			trans	136.1	123.6	146.4	0	0	0	0	0	112.5
96	G	34.6	Very low	32.7	Very low	79 Å²	79	142.1 Å²	142.1	81%	0.814	82%	0.819	S	S	*	*			cis	-169.1	172.8	3.4	0	0	0	0	0	111.7
97	Q	32.5	Very low	33.3	Very low	182 Å²	182	139.7 Å²	139.7	85%	0.85	81%	0.814	S	S	*	*			trans	-35.7	149	-175.8	-63.8	159	-33.8	0	0	119.7
98	Q	37.2	Very low	33.5	Very low	194 Å²	194	141.9 Å²	141.9	91%	0.907	82%	0.818	S	S	*	*				-174.3	144.2	105.8	-94.4	173.6	35.9	0	0	113.5
99	N	29.5	Very low	33.7	Very low	148 Å²	148	141.9 Å²	141.9	79%	0.791	82%	0.817	S	S	*	*			trans	-72.6	155.2	-172.2	-69.2	-36.7	0	0	0	114.5
100	H	35.4	Very low	33.8	Very low	173 Å²	173	144.8 Å²	144.8	80%	0.801	82%	0.822	S	S	*	*				-168	121.8	123.2	-103.8	-72.4	0	0	0	111.2
101	S	28.6	Very low	33.7	Very low	98 Å²	98	143.7 Å²	143.7	69%	0.685	82%	0.819	S	S	*	*			trans	-97	138.9	176.5	45.5	0	0	0	0	111.3
102	Y	32.2	Very low	33.6	Very low	222 Å²	222	144.7 Å²	144.7	87%	0.871	81%	0.814	S	S	*	*			trans	-140.2	125.8	155.1	-74.7	-74.3	0	0	0	109.8
103	L	28.8	Very low	33.4	Very low	161 Å²	161	144.9 Å²	144.9	84%	0.843	82%	0.816	S	S	*	*			trans	-96.1	140.4	175.7	-77.5	157.1	0	0	0	109.7
104	Y	32.8	Very low	33.1	Very low	232 Å²	232	146 Å²	146	91%	0.91	82%	0.821	S	S	*	*			trans	-159.5	98.4	153.5	-102.5	-83.4	0	0	0	105.9
105	A	34.8	Very low	33.4	Very low	89 Å²	89	145.1 Å²	145.1	74%	0.736	82%	0.815	S	S	*	*				65.7	100.2	87.3	0	0	0	0	0	114.1
106	S	27.8	Very low	33.4	Very low	117 Å²	117	146.4 Å²	146.4	82%	0.818	81%	0.81	S	S	*	*			trans	-76.9	161	164.8	-59.5	0	0	0	0	111.7
107	P	45.2	Very low	33.6	Very low	116 Å²	116	148 Å²	148	75%	0.753	81%	0.806	S	S	*	*			trans	-119	131.6	148.9	32	-18.7	0	0	0	112.1
108	D	31.4	Very low	33.6	Very low	154 Å²	154	144.8 Å²	144.8	82%	0.824	80%	0.804	S	S	*	*			trans	-63.9	147.9	166.7	-67.8	-56.2	0	0	0	111.8
109	F	37	Very low	33.7	Very low	208 Å²	208	141.6 Å²	141.6	91%	0.912	80%	0.803	S	S	*	*			trans	-127.5	120	158.6	-97.3	-80.2	0	0	0	109.6
110	D	33.4	Very low	34.1	Very low	144 Å²	144	139.8 Å²	139.8	77%	0.77	81%	0.809	S	S	*	*			trans	-90.7	156.9	-176.3	-107	-35.4	0	0	0	113.2
111	M	31.1	Very low	34.2	Very low	167 Å²	167	134.7 Å²	134.7	82%	0.823	80%	0.803	S	S	*	*			trans	64.3	137.1	157.2	-63.7	-159.3	84.5	0	0	117.9
112	V	33.3	Very low	34.7	Very low	115 Å²	115	137 Å²	137	70%	0.697	81%	0.813	S	S	*	*				-157.7	138.8	56.3	166.5	0	0	0	0	109.9
113	S	28.4	Very low	34.7	Very low	118 Å²	118	133.7 Å²	133.7	83%	0.825	81%	0.81	S	S	*	*			trans	-93.3	138.8	165.3	-62.6	0	0	0	0	110.5
114	T	34.3	Very low	35.3	Very low	137 Å²	137	135.5 Å²	135.5	84%	0.84	82%	0.815	S	S	*	*			trans	-134.8	130.5	160.7	30.5	0	0	0	0	110.8
115	S	38.7	Very low	35.3	Very low	107 Å²	107	132.2 Å²	132.2	75%	0.748	81%	0.812	S	S	*	*			trans	-72.7	148.8	-177.7	45.8	0	0	0	0	115.4
116	S	33.9	Very low	35.5	Very low	113 Å²	113	134.6 Å²	134.6	79%	0.79	82%	0.818	S	S	*	*			trans	25.4	167.2	133.5	-37.5	0	0	0	0	121.3
117	P	39.3	Very low	36	Very low	112 Å²	112	135.5 Å²	135.5	73%	0.727	81%	0.813	S	S	*	*			cis	-143	174	7	34.8	-10.9	0	0	0	117.4
118	S	32.3	Very low	35.4	Very low	116 Å²	116	137.7 Å²	137.7	81%	0.811	81%	0.813	S	S	*	*			trans	20.4	127.6	143.6	-39.1	0	0	0	0	122.7
119	S	39	Very low	35.7	Very low	127 Å²	127	137.5 Å²	137.5	89%	0.888	82%	0.818	S	S	*	*			trans	-142	125.9	155.7	-59.1	0	0	0	0	111.3
120	A	37.6	Very low	35.7	Very low	110 Å²	110	137.4 Å²	137.4	91%	0.909	81%	0.812	S	S	*	*			trans	-88.9	155.4	176.1	0	0	0	0	0	112.4
121	G	38.7	Very low	36.1	Very low	66 Å²	66	140.9 Å²	140.9	68%	0.68	82%	0.821	S	S	*	*			trans	-173.4	91.4	165.5	0	0	0	0	0	110.2
122	T	39.4	Very low	36.4	Very low	145 Å²	145	138 Å²	138	89%	0.89	82%	0.817	S	S	*	*				88.9	114.9	92.2	-52.8	0	0	0	0	114.1
123	N	31.3	Very low	36.7	Very low	153 Å²	153	136.8 Å²	136.8	82%	0.818	82%	0.818	S	S	*	*			trans	-56.6	149.6	173.4	-69.9	-39	0	0	0	114.8
124	Q	41	Very low	37.3	Very low	200 Å²	200	136.1 Å²	136.1	94%	0.935	81%	0.814	S	S	*	*			trans	-147.9	129	134.6	-68	-164.3	3	0	0	112
125	N	32.6	Very low	37.9	Very low	162 Å²	162	135.8 Å²	135.8	87%	0.866	81%	0.812	S	S	*	*			trans	-85.3	147	171.5	-99.4	-16.9	0	0	0	111
126	V	40.9	Very low	38.3	Very low	139 Å²	139	135.6 Å²	135.6	84%	0.842	81%	0.808	S	S	*	*			trans	-153.4	114.6	144.6	-165.5	0	0	0	0	112.7
127	N	36.3	Very low	38.7	Very low	137 Å²	137	137 Å²	137	73%	0.733	81%	0.805	S	S	*	*			trans	16.7	125.5	143.5	-72.7	1	0	0	0	122.2
128	E	33.7	Very low	38.8	Very low	161 Å²	161	136.1 Å²	136.1	75%	0.752	80%	0.802	S	S	*	*				74.7	122.2	86.4	-87.6	-162.8	145.4	0	0	116.9
129	T	38.1	Very low	39.2	Very low	151 Å²	151	138.9 Å²	138.9	93%	0.926	80%	0.802	S	S	*	*			trans	-166.4	134.3	130.7	6.5	0	0	0	0	113.2
130	R	37.1	Very low	39.2	Very low	206 Å²	206	138.3 Å²	138.3	78%	0.777	79%	0.793	S	S	*	*			trans	-75.2	160.8	177.6	-72.6	174.2	178.1	171.5	-0.6	113.4
131	F	41.9	Very low	39.5	Very low	217 Å²	217	140 Å²	140	95%	0.952	79%	0.787	S	S	*	*				-148	139.8	129.3	-92	-75.6	0	0	0	111.5
132	S	35.7	Very low	39.5	Very low	107 Å²	107	142.1 Å²	142.1	75%	0.748	79%	0.789	S	S	*	*			trans	-132.9	152.7	-178.6	-53.9	0	0	0	0	109.8
133	A	39.8	Very low	39.7	Very low	88 Å²	88	145.5 Å²	145.5	73%	0.727	79%	0.787	S	S	*	*			trans	176.9	108.2	152.5	0	0	0	0	0	109.3
134	S	41.2	Very low	40	Very low	105 Å²	105	142.6 Å²	142.6	73%	0.734	78%	0.778	S	S	*	*				67.9	134.2	88.1	60.8	0	0	0	0	113.7
135	T	48.2	Very low	39.9	Very low	130 Å²	130	140.6 Å²	140.6	80%	0.798	77%	0.773	S	S	*	*			cis	-178.3	-176.7	39.2	-6.8	0	0	0	0	109.8
136	P	47.1	Very low	40.2	Very low	102 Å²	102	138.4 Å²	138.4	66%	0.662	77%	0.771	S	S	*	*				-135.9	-162.3	-126.3	30.8	-2.2	0	0	0	117.3
137	I	40.9	Very low	40	Very low	143 Å²	143	137.8 Å²	137.8	73%	0.733	77%	0.77	S	S	*	*			trans	105.4	114	147	-56.2	158.8	0	0	0	119.3
138	S	41.1	Very low	40.2	Very low	93 Å²	93	136.4 Å²	136.4	65%	0.65	77%	0.77	S	S	*	*				166.8	114.3	118.2	-73.8	0	0	0	0	112
139	Q	42.1	Very low	40.3	Very low	174 Å²	174	133.8 Å²	133.8	81%	0.813	77%	0.77	S	S	*	*				72	137.8	106.8	-64.5	-179.2	6.6	0	0	115.3
140	T	39.3	Very low	40.1	Very low	116 Å²	116	132.8 Å²	132.8	71%	0.712	76%	0.764	S	S	*	*			cis	-176.9	139.3	-7	29.4	0	0	0	0	106.1
141	N	43	Very low	40.2	Very low	145 Å²	145	128 Å²	128	78%	0.775	76%	0.762	S	S	*	*			trans	157.7	122.1	137.6	-90.7	-3	0	0	0	112.6
142	P	38.9	Very low	39.6	Very low	111 Å²	111	125.2 Å²	125.2	72%	0.721	76%	0.757	S	S	*	*			trans	-131.7	130.7	152.7	34.2	-18.6	0	0	0	112.2
143	Y	42.6	Very low	39.6	Very low	216 Å²	216	125.8 Å²	125.8	85%	0.847	76%	0.761	S	S	*	*			trans	-145.4	95.3	161	-77.9	-72.6	0	0	0	110.9
144	S	37.9	Very low	39.4	Very low	92 Å²	92	130.5 Å²	130.5	64%	0.643	77%	0.768	S	S	*	*				38.8	134.1	122.2	58.4	0	0	0	0	123.8
145	L	39.5	Very low	39.3	Very low	157 Å²	157	134.3 Å²	134.3	82%	0.822	77%	0.774	S	S	*	*			trans	86.1	105.5	138.7	-72.6	147.8	0	0	0	120.3
146	S	39.6	Very low	38.9	Very low	117 Å²	117	134 Å²	134	82%	0.818	77%	0.771	S	S	*	*				177.4	130	112	30.4	0	0	0	0	111.5
147	P	36.7	Very low	38.5	Very low	126 Å²	126	136.7 Å²	136.7	82%	0.818	78%	0.779	S	S	*	*			trans	-109.7	129.7	168.5	34.7	-22.5	0	0	0	111.1
148	S	39.6	Very low	38.5	Very low	107 Å²	107	135.2 Å²	135.2	75%	0.748	78%	0.781	S	S	*	*			trans	-153.7	104.3	158.7	54.4	0	0	0	0	110.2
149	S	35.5	Very low	38.9	Very low	106 Å²	106	137.4 Å²	137.4	74%	0.741	79%	0.785	S	S	*	*			trans	11.2	129.7	143.8	50.1	0	0	0	0	117.7
150	T	35.3	Very low	39.6	Very low	130 Å²	130	133.6 Å²	133.6	80%	0.798	78%	0.776	S	S	*	*				173.2	143.9	89.1	-46.7	0	0	0	0	110.6
151	S	37.6	Very low	40.9	Very low	106 Å²	106	136.5 Å²	136.5	74%	0.741	78%	0.778	S	S	*	*			trans	101.8	94.6	157.8	78.8	0	0	0	0	119.8
152	N	29.7	Very low	42.8	Very low	158 Å²	158	132.5 Å²	132.5	85%	0.845	76%	0.755	S	S	*	*			trans	30	116.7	132.3	-71.3	-10.5	0	0	0	119.6
153	S	36.1	Very low	45.3	Very low	119 Å²	119	132.5 Å²	132.5	83%	0.832	75%	0.748	S	S	*	*				-173.5	126.2	125	-80.1	0	0	0	0	112.4
154	H	35.6	Very low	47.8	Very low	187 Å²	187	122.3 Å²	122.3	87%	0.866	71%	0.708	S	S	*	*			trans	-36.6	120.1	178.8	-60.9	-98	0	0	0	116.6	V156	H154-V156 PolarHBondContact O-N 2.93Å
155	H	39	Very low	50.4	Low	186 Å²	186	121.2 Å²	121.2	86%	0.861	70%	0.695	S	S	*	*			trans	-93.4	96.9	167	-151.6	-83.6	0	0	0	109.9
156	V	40.9	Very low	52.9	Low	123 Å²	123	113.9 Å²	113.9	75%	0.745	66%	0.657	S	S	*	*			trans	-63.9	129	172.6	178.6	0	0	0	0	109.4	H154 S158	H154-V156 PolarHBondContact O-N 2.93Å; V156-S158 PolarHBondContact O-N 2.66Å
157	L	38.7	Very low	55.6	Low	158 Å²	158	108.6 Å²	108.6	83%	0.827	62%	0.62	S	S	*	*			trans	-45.3	127.6	178.2	-73	148	0	0	0	112.8	L159	L157-L159 PolarHBondContact O-N 2.91Å; L157-L159 VanDerWaalsContact O-N 3.09Å
158	S	40.6	Very low	58.4	Low	112 Å²	112	105 Å²	105	78%	0.783	61%	0.605	S	S	*	*			trans	-68.5	97.7	178.2	53.5	0	0	0	0	111.8	V156	V156-S158 PolarHBondContact O-N 2.66Å
159	L	50	Low	61	Low	139 Å²	139	101.1 Å²	101.1	73%	0.728	58%	0.576	S	S	*	*			trans	-58	144.9	166.5	-121.2	71.6	0	0	0	110.5	L157 K161	L157-L159 PolarHBondContact O-N 2.91Å; L157-L159 VanDerWaalsContact O-N 3.09Å; L159-K161 PolarHBondContact O-N 3.13Å
160	P	56.6	Low	63.8	Low	95 Å²	95	104.8 Å²	104.8	62%	0.617	57%	0.574	S	S	*	*			trans	-50	130.3	173.6	-23	32.1	0	0	0	110.4	H162	P160-H162 VanDerWaalsContact C-N 3.3Å; P160-H162 PolarHBondContact O-CD2 2.86Å; P160-H162 PolarHBondContact O-N 3.33Å
161	K	65.8	Low	66.6	Low	177 Å²	177	99.2 Å²	99.2	77%	0.77	54%	0.541	S	S	*	.			trans	-68.5	86.8	-178.3	-73.5	174.7	-177.9	171	0	109.8	L159	L159-K161 PolarHBondContact O-N 3.13Å
162	H	83.7	Confident	69.2	Low	61 Å²	61	97.2 Å²	97.2	28%	0.282	53%	0.527	S	S	.	.			trans	-64	143	173	-65.8	-72.2	0	0	0	111	P160 A171 F199	P160-H162 VanDerWaalsContact C-N 3.3Å; P160-H162 PolarHBondContact O-CD2 2.86Å; P160-H162 PolarHBondContact O-N 3.33Å; H162-A171 HydrophobicContact CB-CB 3.98Å; H162-A171 WeakPolarHBondContact O-CB 3.43Å; H162-A171 PolarHBondContact O-N 3.29Å; H162-F199 HydrophobicContact CB-CB 4.2Å; H162-F199 HydrophobicContact CB-CD1 3.94Å; H162-F199 HydrophobicContact CB-CD2 3.92Å; H162-F199 HydrophobicContact CB-CE1 4.28Å; H162-F199 HydrophobicContact CB-CE2 4.25Å; H162-F199 HydrophobicContact CB-CG 3.76Å; H162-F199 HydrophobicContact CB-CZ 4.42Å; H162-F199 AromaticContact CD2-CE1 3.79Å; H162-F199 AromaticContact CD2-CZ 3.69Å; H162-F199 AromaticContact CE1-CE2 3.36Å; H162-F199 WeakPolarHBondContact CE1-CE2 2.83Å; H162-F199 AromaticContact CE1-CZ 3.31Å; H162-F199 WeakPolarHBondContact CE1-CZ 3.14Å; H162-F199 AromaticContact CG-CD1 3.97Å; H162-F199 AromaticContact CG-CD2 3.8Å; H162-F199 AromaticContact CG-CE1 3.79Å; H162-F199 AromaticContact CG-CE2 3.6Å; H162-F199 AromaticContact CG-CG 3.98Å; H162-F199 AromaticContact CG-CZ 3.6Å; H162-F199 AromaticContact ND1-CD2 3.52Å; H162-F199 AromaticContact ND1-CE2 3.06Å; H162-F199 WeakPolarHBondContact ND1-CE2 3.43Å; H162-F199 AromaticContact ND1-CZ 3.37Å; H162-F199 WeakPolarHBondContact ND1-CZ 3.4Å; H162-F199 AromaticContact NE2-CZ 3.52Å
163	I	91.7	Very high	72	Confident	111 Å²	111	90.6 Å²	90.6	57%	0.569	50%	0.496	S	S	*	.	B	Isolated β-bridge	trans	-106.3	142.5	179.4	-61	175.7	0	0	0	108.7	N165 G168	I163-N165 PolarHBondContact O-N 3.46Å; I163-N165 PolarHBondContact O-OD1 2.93Å; I163-G168 WeakPolarHBondContact CG2-O 3.48Å
164	C	94.6	Very high	74.5	Confident	2 Å²	2	89.3 Å²	89.3	1%	0.014	48%	0.475	C	S	.	.			trans	-68.2	115.9	177.1	176.4	0	0	0	0	110.5	I166 C167 G168 D169 F199 C201	C164-I166 PolarHBondContact O-N 3.48Å; C164-C167 PolarHBondContact O-N 2.9Å; C164-G168 WeakPolarHBondContact O-CA 3.4Å; C164-G168 PolarHBondContact O-N 2.9Å; C164-D169 WeakPolarHBondContact CB-O 3.39Å; C164-D169 PolarHBondContact N-O 2.83Å; C164-F199 WeakPolarHBondContact CA-O 3.45Å; C164-C201 HydrophobicContact CB-CB 3.87Å; C164-C201 PolarHBondContact SG-N 2.88Å
165	N	91.3	Very high	77.1	Confident	69 Å²	69	82 Å²	82	37%	0.369	44%	0.442	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-17.1	179.9	-64.4	74.7	0	0	0	113.5	I163 F199 M247	I163-N165 PolarHBondContact O-N 3.46Å; I163-N165 PolarHBondContact O-OD1 2.93Å; N165-F199 PolarHBondContact N-O 2.93Å; N165-F199 PolarHBondContact OD1-N 2.89Å; N165-F199 PolarHBondContact OD1-O 3.11Å; N165-F199 VanDerWaalsContact OD1-O 3.07Å; N165-M247 HydrophobicContact CB-CG 4.43Å; N165-M247 HydrophobicContact CB-SD 4.08Å
166	I	93.6	Very high	79.4	Confident	3 Å²	3	75.2 Å²	75.2	2%	0.015	41%	0.409	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-48.6	-179.2	-57.6	93.3	0	0	0	111.9	C164 C204 I228 K243 M247 M249	C164-I166 PolarHBondContact O-N 3.48Å; I166-C204 HydrophobicContact CB-CB 4.29Å; I166-C204 HydrophobicContact CD1-CB 4.26Å; I166-C204 HydrophobicContact CG1-CB 4.48Å; I166-C204 HydrophobicContact CG2-CB 4.43Å; I166-I228 HydrophobicContact CG2-CG2 4.09Å; I166-I228 WeakPolarHBondContact O-CG2 3.44Å; I166-K243 HydrophobicContact CG2-CB 4.42Å; I166-K243 HydrophobicContact CG2-CD 4.27Å; I166-K243 HydrophobicContact CG2-CG 4.24Å; I166-K243 VanDerWaalsContact O-CD 3.24Å; I166-K243 WeakPolarHBondContact O-CD 3.24Å; I166-K243 WeakPolarHBondContact O-CE 3.42Å; I166-K243 PolarHBondContact O-NZ 3.45Å; I166-M247 HydrophobicContact CG1-CB 4.32Å; I166-M247 HydrophobicContact CG1-CG 4.32Å; I166-M249 HydrophobicContact CD1-CE 3.62Å; I166-M249 HydrophobicContact CD1-SD 4.46Å
167	C	96.4	Very high	80.9	Confident	6 Å²	6	70.1 Å²	70.1	4%	0.041	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	-128.2	-0.6	-171.1	66.2	0	0	0	0	114.8	C164 D169 C204 I228 D229 K230 R233	C164-C167 PolarHBondContact O-N 2.9Å; C167-D169 PolarHBondContact O-N 3.26Å; C167-C204 VanDerWaalsContact SG-SG 3.69Å; C167-I228 HydrophobicContact CB-CG2 4.17Å; C167-D229 CarbonylContact O-C 3.41Å; C167-D229 WeakPolarHBondContact O-CA 3.22Å; C167-K230 PolarHBondContact O-N 2.84Å; C167-R233 HydrophobicContact CB-CB 4.14Å; C167-R233 PolarHBondContact SG-NH1 3.34Å
168	G	93.8	Very high	81.6	Confident	50 Å²	50	65.9 Å²	65.9	52%	0.515	36%	0.361	S	S	.	.	S	Bend	trans	75.6	4	-178.8	0	0	0	0	0	115.2	I163 C164	I163-G168 WeakPolarHBondContact CG2-O 3.48Å; C164-G168 WeakPolarHBondContact O-CA 3.4Å; C164-G168 PolarHBondContact O-N 2.9Å
169	D	95.5	Very high	82.2	Confident	26 Å²	26	67 Å²	67	14%	0.139	35%	0.354	C	S	.	.	S	Bend	trans	-73.4	168	173.7	-162.1	10.1	0	0	0	111.8	C164 C167 A171 C201 K230 R233	C164-D169 WeakPolarHBondContact CB-O 3.39Å; C164-D169 PolarHBondContact N-O 2.83Å; C167-D169 PolarHBondContact O-N 3.26Å; D169-A171 PolarHBondContact O-N 3.4Å; D169-C201 HydrophobicContact CB-CB 4.03Å; D169-K230 HydrophobicContact CB-CB 4.4Å; D169-K230 HydrophobicContact CB-CD 4.2Å; D169-K230 HydrophobicContact CB-CG 4.18Å; D169-K230 WeakPolarHBondContact OD1-CD 3.27Å; D169-K230 VanDerWaalsContact OD1-CE 3.24Å; D169-K230 WeakPolarHBondContact OD1-CE 3.19Å; D169-K230 IonicContact OD1-NZ 3.74Å; D169-K230 PolarHBondContact OD1-NZ 3.04Å; D169-R233 IonicContact OD2-CZ 2.95Å; D169-R233 IonicContact OD2-NH1 2.81Å; D169-R233 PolarHBondContact OD2-NH1 2.92Å; D169-R233 IonicContact OD2-NH2 2.85Å
170	R	94.6	Very high	82.2	Confident	182 Å²	182	67.7 Å²	67.7	69%	0.687	35%	0.347	S	S	*	.	B	Isolated β-bridge	trans	-60.9	123.9	176.4	-174.9	176.5	177.9	-176	-1.3	109.9	C201	R170-C201 WeakPolarHBondContact O-CB 3.3Å
171	A	93.2	Very high	81.7	Confident	14 Å²	14	67.4 Å²	67.4	12%	0.116	33%	0.334	C	S	.	.	P	Polyproline II helix	trans	-77	146.5	176.7	0	0	0	0	0	111.3	H162 D169 F199 S200	H162-A171 HydrophobicContact CB-CB 3.98Å; H162-A171 WeakPolarHBondContact O-CB 3.43Å; H162-A171 PolarHBondContact O-N 3.29Å; D169-A171 PolarHBondContact O-N 3.4Å; A171-F199 HydrophobicContact CB-CB 3.63Å; A171-F199 HydrophobicContact CB-CG 4.47Å; A171-S200 WeakPolarHBondContact CA-O 3.49Å
172	S	91.9	Very high	80.8	Confident	63 Å²	63	63.1 Å²	63.1	44%	0.441	33%	0.327	S	S	.	.			trans	-97.9	-14.3	172.5	54.1	0	0	0	0	112.7	H175 S200 E202	S172-H175 PolarHBondContact OG-NE2 2.99Å; S172-S200 PolarHBondContact N-O 3.35Å; S172-S200 PolarHBondContact OG-O 3.11Å; S172-E202 VanDerWaalsContact CB-OE1 3.26Å; S172-E202 WeakPolarHBondContact CB-OE1 3.49Å; S172-E202 PolarHBondContact OG-OE1 2.95Å
173	G	88.4	Confident	79.2	Confident	19 Å²	19	61.9 Å²	61.9	20%	0.196	33%	0.33	C	S	.	.	B	Isolated β-bridge	trans	152.7	-163.9	-179	0	0	0	0	0	112.1	H175 S200	G173-H175 PolarHBondContact O-CD2 3.18Å; G173-S200 PolarHBondContact O-N 2.9Å
174	K	88.9	Confident	77	Confident	92 Å²	92	62.3 Å²	62.3	40%	0.4	34%	0.34	S	S	.	.			trans	-85.2	132.6	174.3	-58	179.2	-177.5	175.5	0	108.6	V178 F199	K174-V178 HydrophobicContact CB-CG2 4.34Å; K174-V178 HydrophobicContact CD-CG2 3.77Å; K174-V178 HydrophobicContact CG-CG2 4.49Å; K174-F199 HydrophobicContact CG-CD1 4.11Å; K174-F199 HydrophobicContact CG-CE1 3.89Å
175	H	89.4	Confident	74.6	Confident	35 Å²	35	71.1 Å²	71.1	16%	0.162	38%	0.378	C	S	.	.			trans	-140.8	127.8	-179.2	-58.6	-71.8	0	0	0	110.5	S172 G173 G177 S200 E202 K205	S172-H175 PolarHBondContact OG-NE2 2.99Å; G173-H175 PolarHBondContact O-CD2 3.18Å; H175-G177 PolarHBondContact O-N 2.94Å; H175-S200 WeakPolarHBondContact CB-OG 3.35Å; H175-S200 PolarHBondContact CD2-OG 2.88Å; H175-E202 IonicContact CE1-OE1 3.62Å; H175-E202 IonicContact NE2-OE1 3.81Å; H175-K205 HydrophobicContact CB-CB 4.15Å; H175-K205 HydrophobicContact CB-CG 3.95Å; H175-K205 WeakPolarHBondContact ND1-CD 3.35Å; H175-K205 WeakPolarHBondContact ND1-CE 3.46Å
176	Y	88.7	Confident	72.3	Confident	43 Å²	43	75.8 Å²	75.8	17%	0.169	40%	0.4	C	S	.	.	S	Bend	trans	56.7	33	174.6	-44.7	-64	0	0	0	116.1	K205 F208 K209 M249 K250 A253 V254	Y176-K205 HydrophobicContact CE2-CB 4.25Å; Y176-K205 HydrophobicContact CE2-CG 3.57Å; Y176-K205 WeakPolarHBondContact CE2-O 3.46Å; Y176-F208 HydrophobicContact CD2-CB 4.46Å; Y176-F208 AromaticContact CD2-CD1 3.67Å; Y176-F208 HydrophobicContact CD2-CD1 3.67Å; Y176-F208 HydrophobicContact CD2-CE1 4.43Å; Y176-F208 HydrophobicContact CD2-CG 4.43Å; Y176-F208 HydrophobicContact CE2-CD1 4.37Å; Y176-F208 AromaticContact CG-CD1 3.93Å; Y176-F208 HydrophobicContact CG-CD1 3.93Å; Y176-F208 HydrophobicContact CG-CE1 4.26Å; Y176-K209 HydrophobicContact CE2-CB 4.21Å; Y176-K209 WeakPolarHBondContact OH-CB 3.36Å; Y176-K209 WeakPolarHBondContact OH-CD 3.29Å; Y176-K209 WeakPolarHBondContact OH-CG 3.44Å; Y176-M249 CarbonylContact O-C 3.42Å; Y176-M249 WeakPolarHBondContact O-CA 3.49Å; Y176-K250 WeakPolarHBondContact O-CB 3.4Å; Y176-K250 PolarHBondContact O-N 3.11Å; Y176-A253 HydrophobicContact CD1-CB 4.47Å; Y176-V254 HydrophobicContact CD1-CB 4.43Å; Y176-V254 HydrophobicContact CD1-CG2 3.62Å; Y176-V254 HydrophobicContact CE1-CG2 3.91Å; Y176-V254 HydrophobicContact CG-CG2 4Å
177	G	70.6	Confident	70	Confident	16 Å²	16	81.5 Å²	81.5	17%	0.165	44%	0.435	C	S	.	.			trans	164.5	119.6	173.2	0	0	0	0	0	113.9	H175	H175-G177 PolarHBondContact O-N 2.94Å
178	V	53.4	Low	67.8	Low	68 Å²	68	84 Å²	84	41%	0.412	46%	0.461	S	S	.	.			trans	-151.1	112.7	157.8	-169.2	0	0	0	0	106	K174	K174-V178 HydrophobicContact CB-CG2 4.34Å; K174-V178 HydrophobicContact CD-CG2 3.77Å; K174-V178 HydrophobicContact CG-CG2 4.49Å
179	H	53.8	Low	65.9	Low	135 Å²	135	90.7 Å²	90.7	63%	0.625	48%	0.484	S	S	*	.			trans	-124.6	139.5	147.9	-150.5	66	0	0	0	106.6	Y181	H179-Y181 PolarHBondContact O-N 3.35Å; H179-Y181 VanDerWaalsContact O-N 3.13Å
180	R	50.5	Low	63.4	Low	155 Å²	155	97.3 Å²	97.3	59%	0.585	51%	0.514	S	S	*	.			trans	-56.4	121.9	-175.3	-68.1	-177.5	-136.3	-160.9	3.3	108	S182	R180-S182 PolarHBondContact O-N 2.92Å
181	Y	46.8	Very low	61	Low	88 Å²	88	100.7 Å²	100.7	35%	0.345	53%	0.527	S	S	.	.			trans	-69.8	88.5	154.6	-152.7	-90.5	0	0	0	106.7	H179 G183 G422 L423	H179-Y181 PolarHBondContact O-N 3.35Å; H179-Y181 VanDerWaalsContact O-N 3.13Å; Y181-G183 PolarHBondContact O-N 3.5Å; Y181-G422 WeakPolarHBondContact OH-CA 3.4Å; Y181-G422 PolarHBondContact OH-N 3.26Å; Y181-L423 VanDerWaalsContact CE2-O 3.25Å; Y181-L423 WeakPolarHBondContact CE2-O 3.23Å; Y181-L423 PolarHBondContact OH-N 3.32Å; Y181-L423 PolarHBondContact OH-O 3.27Å
182	S	45.7	Very low	58.7	Low	88 Å²	88	107.7 Å²	107.7	62%	0.615	56%	0.557	S	S	*	*			trans	-86.3	55.5	167.9	46.1	0	0	0	0	109.2	R180	R180-S182 PolarHBondContact O-N 2.92Å
183	G	50.7	Low	56.5	Low	34 Å²	34	109.6 Å²	109.6	35%	0.351	56%	0.562	S	S	.	*			trans	-91.4	135.3	167.7	0	0	0	0	0	109.3	Y181 K185	Y181-G183 PolarHBondContact O-N 3.5Å; G183-K185 PolarHBondContact O-N 3.29Å
184	P	45.5	Very low	54.6	Low	120 Å²	120	116.4 Å²	116.4	78%	0.779	59%	0.586	S	S	*	*			trans	-68.3	107.7	176.6	27.1	-31.2	0	0	0	109.4
185	K	44.4	Very low	52.8	Low	188 Å²	188	114.7 Å²	114.7	82%	0.817	58%	0.584	S	S	*	*			trans	-88.6	108.5	152.1	-87.6	-170	173.2	-178.5	0	107.2	G183 V187	G183-K185 PolarHBondContact O-N 3.29Å; K185-V187 PolarHBondContact O-N 3.31Å
186	M	42.3	Very low	51.2	Low	166 Å²	166	117.5 Å²	117.5	82%	0.818	60%	0.599	S	S	*	*			trans	-65.6	115.1	166	-81.6	-163.1	61.1	0	0	108.9
187	V	45.8	Very low	49.9	Very low	124 Å²	124	119.6 Å²	119.6	75%	0.752	61%	0.611	S	S	*	*			trans	-130.9	93.1	161.2	-175.6	0	0	0	0	105.1	K185	K185-V187 PolarHBondContact O-N 3.31Å
188	G	50.3	Low	50.2	Low	57 Å²	57	121.6 Å²	121.6	59%	0.588	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	72.1	-172.2	-174.6	0	0	0	0	0	114.8	Q190	G188-Q190 PolarHBondContact O-N 3.34Å; G188-Q190 VanDerWaalsContact O-N 3.11Å
189	L	52.8	Low	51.9	Low	192 Å²	192	119.5 Å²	119.5	100%	1.005	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.5	7.9	-174.9	-129.8	82.4	0	0	0	114.3
190	Q	42.7	Very low	53.8	Low	165 Å²	165	113.1 Å²	113.1	77%	0.771	57%	0.57	S	S	*	*	S	Bend	trans	-124.2	117.2	-169.4	-143.3	161.9	-2.6	0	0	111.3	G188 Q192	G188-Q190 PolarHBondContact O-N 3.34Å; G188-Q190 VanDerWaalsContact O-N 3.11Å; Q190-Q192 PolarHBondContact O-N 3.06Å; Q190-Q192 VanDerWaalsContact O-N 3.1Å
191	R	45	Very low	55.9	Low	253 Å²	253	105.8 Å²	105.8	96%	0.955	54%	0.542	S	S	*	.			trans	-65.3	104.5	172.9	-105	178.6	169.9	179.9	-2.4	109
192	Q	44.3	Very low	58.3	Low	160 Å²	160	106.4 Å²	106.4	75%	0.748	55%	0.548	S	S	*	.			trans	-108.4	116.2	169.5	-142.6	169	8.5	0	0	109.6	Q190 F194	Q190-Q192 PolarHBondContact O-N 3.06Å; Q190-Q192 VanDerWaalsContact O-N 3.1Å; Q192-F194 PolarHBondContact O-N 2.69Å
193	L	46.2	Very low	60.7	Low	104 Å²	104	103.3 Å²	103.3	55%	0.545	53%	0.53	S	S	.	.			trans	-74.3	89.7	179	-164.5	77.2	0	0	0	109.3	T195	L193-T195 PolarHBondContact O-N 2.8Å; L193-T195 VanDerWaalsContact O-N 3.15Å
194	F	48.7	Very low	62.9	Low	161 Å²	161	101.7 Å²	101.7	71%	0.706	51%	0.513	S	S	*	.			trans	-76.4	101.8	172.7	-113.3	-93.3	0	0	0	109.5	Q192 L196	Q192-F194 PolarHBondContact O-N 2.69Å; F194-L196 PolarHBondContact O-N 3.19Å
195	T	50.4	Low	65.3	Low	56 Å²	56	98.4 Å²	98.4	34%	0.344	49%	0.487	S	S	.	.			trans	-70.7	101.9	167.4	-58.8	0	0	0	0	107.6	L193 Q197	L193-T195 PolarHBondContact O-N 2.8Å; L193-T195 VanDerWaalsContact O-N 3.15Å; T195-Q197 HydrophobicContact CG2-CG 4.21Å; T195-Q197 PolarHBondContact O-N 3.28Å
196	L	55.9	Low	67.8	Low	94 Å²	94	90.1 Å²	90.1	49%	0.492	46%	0.455	S	S	.	.			trans	-59.9	107.1	165.8	-83	163	0	0	0	107.7	F194 Y198	F194-L196 PolarHBondContact O-N 3.19Å; L196-Y198 HydrophobicContact CB-CE2 3.84Å; L196-Y198 WeakPolarHBondContact O-CD2 3.33Å; L196-Y198 WeakPolarHBondContact O-CE2 3.14Å
197	Q	62.6	Low	70.4	Confident	87 Å²	87	82.6 Å²	82.6	41%	0.407	42%	0.418	S	S	.	.			trans	-88.3	110.9	175.8	-66.2	-178.4	-17.3	0	0	108.1	T195 F199	T195-Q197 HydrophobicContact CG2-CG 4.21Å; T195-Q197 PolarHBondContact O-N 3.28Å; Q197-F199 HydrophobicContact CB-CD2 4.13Å; Q197-F199 HydrophobicContact CB-CE2 3.38Å; Q197-F199 HydrophobicContact CB-CZ 3.81Å; Q197-F199 HydrophobicContact CG-CE2 4.46Å; Q197-F199 WeakPolarHBondContact O-CD2 3.35Å
198	Y	75.6	Confident	72.8	Confident	59 Å²	59	76.7 Å²	76.7	23%	0.231	38%	0.382	C	S	.	.			trans	-86.3	119.5	177	-59.3	-86.2	0	0	0	109.6	L196 M247	L196-Y198 HydrophobicContact CB-CE2 3.84Å; L196-Y198 WeakPolarHBondContact O-CD2 3.33Å; L196-Y198 WeakPolarHBondContact O-CE2 3.14Å; Y198-M247 WeakPolarHBondContact CD1-O 3.48Å
199	F	89.7	Confident	74.9	Confident	23 Å²	23	78 Å²	78	10%	0.101	37%	0.371	C	S	.	.			trans	-112.7	144.1	-178.7	-69.6	-77	0	0	0	110.5	H162 C164 N165 A171 K174 Q197	H162-F199 HydrophobicContact CB-CB 4.2Å; H162-F199 HydrophobicContact CB-CD1 3.94Å; H162-F199 HydrophobicContact CB-CD2 3.92Å; H162-F199 HydrophobicContact CB-CE1 4.28Å; H162-F199 HydrophobicContact CB-CE2 4.25Å; H162-F199 HydrophobicContact CB-CG 3.76Å; H162-F199 HydrophobicContact CB-CZ 4.42Å; H162-F199 AromaticContact CD2-CE1 3.79Å; H162-F199 AromaticContact CD2-CZ 3.69Å; H162-F199 AromaticContact CE1-CE2 3.36Å; H162-F199 WeakPolarHBondContact CE1-CE2 2.83Å; H162-F199 AromaticContact CE1-CZ 3.31Å; H162-F199 WeakPolarHBondContact CE1-CZ 3.14Å; H162-F199 AromaticContact CG-CD1 3.97Å; H162-F199 AromaticContact CG-CD2 3.8Å; H162-F199 AromaticContact CG-CE1 3.79Å; H162-F199 AromaticContact CG-CE2 3.6Å; H162-F199 AromaticContact CG-CG 3.98Å; H162-F199 AromaticContact CG-CZ 3.6Å; H162-F199 AromaticContact ND1-CD2 3.52Å; H162-F199 AromaticContact ND1-CE2 3.06Å; H162-F199 WeakPolarHBondContact ND1-CE2 3.43Å; H162-F199 AromaticContact ND1-CZ 3.37Å; H162-F199 WeakPolarHBondContact ND1-CZ 3.4Å; H162-F199 AromaticContact NE2-CZ 3.52Å; C164-F199 WeakPolarHBondContact CA-O 3.45Å; N165-F199 PolarHBondContact N-O 2.93Å; N165-F199 PolarHBondContact OD1-N 2.89Å; N165-F199 PolarHBondContact OD1-O 3.11Å; N165-F199 VanDerWaalsContact OD1-O 3.07Å; A171-F199 HydrophobicContact CB-CB 3.63Å; A171-F199 HydrophobicContact CB-CG 4.47Å; K174-F199 HydrophobicContact CG-CD1 4.11Å; K174-F199 HydrophobicContact CG-CE1 3.89Å; Q197-F199 HydrophobicContact CB-CD2 4.13Å; Q197-F199 HydrophobicContact CB-CE2 3.38Å; Q197-F199 HydrophobicContact CB-CZ 3.81Å; Q197-F199 HydrophobicContact CG-CE2 4.46Å; Q197-F199 WeakPolarHBondContact O-CD2 3.35Å
200	S	93.3	Very high	77	Confident	1 Å²	1	75.2 Å²	75.2	1%	0.007	35%	0.348	C	S	.	.	B	Isolated β-bridge	trans	-136.6	155.2	173.9	68.1	0	0	0	0	112.8	A171 S172 G173 H175 M249	A171-S200 WeakPolarHBondContact CA-O 3.49Å; S172-S200 PolarHBondContact N-O 3.35Å; S172-S200 PolarHBondContact OG-O 3.11Å; G173-S200 PolarHBondContact O-N 2.9Å; H175-S200 WeakPolarHBondContact CB-OG 3.35Å; H175-S200 PolarHBondContact CD2-OG 2.88Å; S200-M249 WeakPolarHBondContact OG-CE 3.33Å
201	C	96.2	Very high	79.5	Confident	2 Å²	2	67.4 Å²	67.4	1%	0.014	31%	0.311	C	S	.	.			trans	-81.5	160.3	173	67.6	0	0	0	0	110.9	C164 D169 R170 G203 C204 K205 R233	C164-C201 HydrophobicContact CB-CB 3.87Å; C164-C201 PolarHBondContact SG-N 2.88Å; D169-C201 HydrophobicContact CB-CB 4.03Å; R170-C201 WeakPolarHBondContact O-CB 3.3Å; C201-G203 PolarHBondContact O-N 3.37Å; C201-G203 VanDerWaalsContact O-N 3.1Å; C201-C204 PolarHBondContact O-N 3.36Å; C201-C204 VanDerWaalsContact O-N 3.08Å; C201-C204 PolarHBondContact SG-N 3.39Å; C201-C204 VanDerWaalsContact SG-N 3.38Å; C201-K205 PolarHBondContact O-N 2.86Å; C201-R233 PolarHBondContact SG-NH1 3Å
202	E	95.6	Very high	81.8	Confident	100 Å²	100	56.1 Å²	56.1	47%	0.467	27%	0.27	S	S	.	.	H	α-helix	trans	-54.5	-32.1	175.7	-70.8	-57.5	123	0	0	113	S172 H175 K205 G206	S172-E202 VanDerWaalsContact CB-OE1 3.26Å; S172-E202 WeakPolarHBondContact CB-OE1 3.49Å; S172-E202 PolarHBondContact OG-OE1 2.95Å; H175-E202 IonicContact CE1-OE1 3.62Å; H175-E202 IonicContact NE2-OE1 3.81Å; E202-K205 IonicContact OE1-NZ 3.57Å; E202-K205 PolarHBondContact OE1-NZ 3.04Å; E202-K205 VanDerWaalsContact OE2-CD 3.28Å; E202-K205 WeakPolarHBondContact OE2-CD 3.29Å; E202-K205 IonicContact OE2-NZ 3.92Å; E202-K205 PolarHBondContact OE2-NZ 2.78Å; E202-G206 PolarHBondContact O-N 3.42Å
203	G	96.7	Very high	84	Confident	23 Å²	23	53.1 Å²	53.1	24%	0.237	25%	0.252	C	S	.	.	H	α-helix	trans	-64.5	-44.4	177.2	0	0	0	0	0	113.5	C201 F207 R240	C201-G203 PolarHBondContact O-N 3.37Å; C201-G203 VanDerWaalsContact O-N 3.1Å; G203-F207 VanDerWaalsContact O-CB 3.28Å; G203-F207 WeakPolarHBondContact O-CB 3.45Å; G203-F207 PolarHBondContact O-N 2.96Å; G203-F207 VanDerWaalsContact O-N 3.11Å; G203-R240 VanDerWaalsContact C-NH2 3.29Å; G203-R240 PolarHBondContact O-NH2 3.49Å
204	C	97.2	Very high	86.2	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-77.8	-37.6	178.8	-67.3	0	0	0	0	111.9	I166 C167 C201 F207 F208	I166-C204 HydrophobicContact CB-CB 4.29Å; I166-C204 HydrophobicContact CD1-CB 4.26Å; I166-C204 HydrophobicContact CG1-CB 4.48Å; I166-C204 HydrophobicContact CG2-CB 4.43Å; C167-C204 VanDerWaalsContact SG-SG 3.69Å; C201-C204 PolarHBondContact O-N 3.36Å; C201-C204 VanDerWaalsContact O-N 3.08Å; C201-C204 PolarHBondContact SG-N 3.39Å; C201-C204 VanDerWaalsContact SG-N 3.38Å; C204-F207 PolarHBondContact O-N 3.37Å; C204-F208 WeakPolarHBondContact O-CB 3.5Å; C204-F208 PolarHBondContact O-N 3Å
205	K	95.2	Very high	88.2	Confident	52 Å²	52	52.6 Å²	52.6	23%	0.226	25%	0.25	C	C	.	.	H	α-helix	trans	-53.7	-54.4	169.3	174.2	-159.6	-174.4	-177.4	0	111.2	H175 Y176 C201 E202 F207 F208 K209	H175-K205 HydrophobicContact CB-CB 4.15Å; H175-K205 HydrophobicContact CB-CG 3.95Å; H175-K205 WeakPolarHBondContact ND1-CD 3.35Å; H175-K205 WeakPolarHBondContact ND1-CE 3.46Å; Y176-K205 HydrophobicContact CE2-CB 4.25Å; Y176-K205 HydrophobicContact CE2-CG 3.57Å; Y176-K205 WeakPolarHBondContact CE2-O 3.46Å; C201-K205 PolarHBondContact O-N 2.86Å; E202-K205 IonicContact OE1-NZ 3.57Å; E202-K205 PolarHBondContact OE1-NZ 3.04Å; E202-K205 VanDerWaalsContact OE2-CD 3.28Å; E202-K205 WeakPolarHBondContact OE2-CD 3.29Å; E202-K205 IonicContact OE2-NZ 3.92Å; E202-K205 PolarHBondContact OE2-NZ 2.78Å; K205-F207 VanDerWaalsContact C-N 3.33Å; K205-F207 PolarHBondContact O-N 3.21Å; K205-F208 PolarHBondContact O-N 3.41Å; K205-K209 WeakPolarHBondContact O-CB 3.27Å; K205-K209 PolarHBondContact O-N 3.34Å
206	G	96.2	Very high	90.2	Very high	14 Å²	14	53 Å²	53	14%	0.144	25%	0.249	C	C	.	.	H	α-helix	trans	-65.1	-35.7	-179.4	0	0	0	0	0	113.2	E202 R210	E202-G206 PolarHBondContact O-N 3.42Å; G206-R210 WeakPolarHBondContact O-CG 3.45Å; G206-R210 VanDerWaalsContact O-CZ 3.24Å; G206-R210 PolarHBondContact O-N 3.42Å; G206-R210 PolarHBondContact O-NH1 3.05Å
207	F	97.8	Very high	91.8	Very high	7 Å²	7	52.5 Å²	52.5	3%	0.031	25%	0.251	C	S	.	.	H	α-helix	trans	-61.8	-57.6	174.3	170.6	-103.1	0	0	0	111.4	G203 C204 K205 K209 R210 T211 Y218 Q237 R240 Y241	G203-F207 VanDerWaalsContact O-CB 3.28Å; G203-F207 WeakPolarHBondContact O-CB 3.45Å; G203-F207 PolarHBondContact O-N 2.96Å; G203-F207 VanDerWaalsContact O-N 3.11Å; C204-F207 PolarHBondContact O-N 3.37Å; K205-F207 VanDerWaalsContact C-N 3.33Å; K205-F207 PolarHBondContact O-N 3.21Å; F207-K209 VanDerWaalsContact C-N 3.29Å; F207-K209 PolarHBondContact O-N 2.94Å; F207-R210 PolarHBondContact O-N 3.05Å; F207-R210 VanDerWaalsContact O-N 3.1Å; F207-T211 PolarHBondContact O-N 2.94Å; F207-T211 PolarHBondContact O-OG1 3.44Å; F207-T211 VanDerWaalsContact O-OG1 3.06Å; F207-Y218 AromaticContact CE2-CE2 3.84Å; F207-Y218 HydrophobicContact CE2-CE2 3.84Å; F207-Y218 HydrophobicContact CZ-CD2 4.3Å; F207-Y218 AromaticContact CZ-CE2 3.65Å; F207-Y218 HydrophobicContact CZ-CE2 3.65Å; F207-Q237 HydrophobicContact CE2-CB 4.13Å; F207-Q237 HydrophobicContact CE2-CG 4.18Å; F207-Q237 HydrophobicContact CZ-CB 4.27Å; F207-Q237 WeakPolarHBondContact CZ-O 3.38Å; F207-R240 VanDerWaalsContact CD1-CD 3.49Å; F207-R240 HydrophobicContact CD1-CG 3.9Å; F207-R240 HydrophobicContact CE1-CB 3.93Å; F207-R240 HydrophobicContact CE1-CG 3.66Å; F207-R240 HydrophobicContact CZ-CB 4.07Å; F207-R240 HydrophobicContact CZ-CG 4.19Å; F207-Y241 HydrophobicContact CE1-CD2 4.3Å
208	F	96.1	Very high	93.2	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-55	-46	179.2	-170.3	-97.2	0	0	0	111.8	Y176 C204 K205 R210 T211 V212 Y241 C244 L245 M249 K250 V254	Y176-F208 HydrophobicContact CD2-CB 4.46Å; Y176-F208 AromaticContact CD2-CD1 3.67Å; Y176-F208 HydrophobicContact CD2-CD1 3.67Å; Y176-F208 HydrophobicContact CD2-CE1 4.43Å; Y176-F208 HydrophobicContact CD2-CG 4.43Å; Y176-F208 HydrophobicContact CE2-CD1 4.37Å; Y176-F208 AromaticContact CG-CD1 3.93Å; Y176-F208 HydrophobicContact CG-CD1 3.93Å; Y176-F208 HydrophobicContact CG-CE1 4.26Å; C204-F208 WeakPolarHBondContact O-CB 3.5Å; C204-F208 PolarHBondContact O-N 3Å; K205-F208 PolarHBondContact O-N 3.41Å; F208-R210 VanDerWaalsContact C-N 3.33Å; F208-R210 PolarHBondContact O-N 3.46Å; F208-T211 PolarHBondContact O-N 2.99Å; F208-V212 HydrophobicContact CD1-CG2 4.12Å; F208-V212 HydrophobicContact CE1-CG2 3.78Å; F208-V212 HydrophobicContact CE2-CG2 4.46Å; F208-V212 HydrophobicContact CZ-CG2 3.97Å; F208-V212 WeakPolarHBondContact O-CG2 3.42Å; F208-V212 PolarHBondContact O-N 2.97Å; F208-Y241 AromaticContact CD2-CD2 4Å; F208-Y241 HydrophobicContact CD2-CD2 4Å; F208-Y241 AromaticContact CD2-CE2 3.69Å; F208-Y241 HydrophobicContact CD2-CE2 3.69Å; F208-Y241 HydrophobicContact CE2-CD2 4.26Å; F208-Y241 AromaticContact CE2-CE2 3.61Å; F208-Y241 HydrophobicContact CE2-CE2 3.61Å; F208-C244 HydrophobicContact CD2-CB 3.59Å; F208-C244 HydrophobicContact CE2-CB 4.1Å; F208-L245 HydrophobicContact CE2-CD2 3.7Å; F208-L245 HydrophobicContact CE2-CG 4.34Å; F208-L245 HydrophobicContact CZ-CD2 4.1Å; F208-M249 HydrophobicContact CB-SD 3.86Å; F208-M249 HydrophobicContact CD1-CB 4.26Å; F208-M249 HydrophobicContact CD1-SD 4.34Å; F208-M249 HydrophobicContact CD2-CB 3.84Å; F208-M249 HydrophobicContact CD2-CG 4.48Å; F208-M249 HydrophobicContact CD2-SD 3.83Å; F208-M249 HydrophobicContact CE1-CB 3.95Å; F208-M249 HydrophobicContact CE2-CB 3.49Å; F208-M249 VanDerWaalsContact CE2-CB 3.49Å; F208-M249 HydrophobicContact CE2-SD 4.47Å; F208-M249 HydrophobicContact CG-CB 4.2Å; F208-M249 HydrophobicContact CG-SD 3.75Å; F208-M249 HydrophobicContact CZ-CB 3.56Å; F208-K250 WeakPolarHBondContact CE1-O 3.28Å; F208-V254 HydrophobicContact CD1-CG2 3.8Å; F208-V254 HydrophobicContact CE1-CG2 3.68Å
209	K	95	Very high	93.9	Very high	85 Å²	85	50.9 Å²	50.9	37%	0.37	25%	0.253	S	S	.	.	H	α-helix	trans	-53.9	-44.8	177	-167.2	-179.5	92.2	168	0	113.6	Y176 K205 F207 R213 V254	Y176-K209 HydrophobicContact CE2-CB 4.21Å; Y176-K209 WeakPolarHBondContact OH-CB 3.36Å; Y176-K209 WeakPolarHBondContact OH-CD 3.29Å; Y176-K209 WeakPolarHBondContact OH-CG 3.44Å; K205-K209 WeakPolarHBondContact O-CB 3.27Å; K205-K209 PolarHBondContact O-N 3.34Å; F207-K209 VanDerWaalsContact C-N 3.29Å; F207-K209 PolarHBondContact O-N 2.94Å; K209-R213 VanDerWaalsContact CD-NH1 3.31Å; K209-R213 WeakPolarHBondContact O-CB 3.34Å; K209-R213 PolarHBondContact O-N 3.22Å; K209-R213 VanDerWaalsContact O-N 3.14Å; K209-V254 HydrophobicContact CG-CG1 4.25Å
210	R	96	Very high	94.1	Very high	134 Å²	134	50.9 Å²	50.9	51%	0.506	26%	0.255	S	S	.	.	H	α-helix	trans	-74.2	-40.1	-179.7	-74.7	-174.6	-60.3	-90.1	0.1	111.6	G206 F207 F208 V212 K214	G206-R210 WeakPolarHBondContact O-CG 3.45Å; G206-R210 VanDerWaalsContact O-CZ 3.24Å; G206-R210 PolarHBondContact O-N 3.42Å; G206-R210 PolarHBondContact O-NH1 3.05Å; F207-R210 PolarHBondContact O-N 3.05Å; F207-R210 VanDerWaalsContact O-N 3.1Å; F208-R210 VanDerWaalsContact C-N 3.33Å; F208-R210 PolarHBondContact O-N 3.46Å; R210-V212 VanDerWaalsContact C-N 3.33Å; R210-K214 WeakPolarHBondContact O-CB 3.42Å; R210-K214 PolarHBondContact O-N 2.82Å
211	T	95.6	Very high	94	Very high	0 Å²	0	62.9 Å²	62.9	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-59.1	-46.6	176.3	-54.9	0	0	0	0	110.7	F207 F208 D215 L216 Y218 Y241	F207-T211 PolarHBondContact O-N 2.94Å; F207-T211 PolarHBondContact O-OG1 3.44Å; F207-T211 VanDerWaalsContact O-OG1 3.06Å; F208-T211 PolarHBondContact O-N 2.99Å; T211-D215 CarbonylContact O-C 3.21Å; T211-D215 WeakPolarHBondContact O-CA 3.26Å; T211-D215 PolarHBondContact O-N 2.74Å; T211-L216 HydrophobicContact CG2-CB 4.29Å; T211-L216 WeakPolarHBondContact CG2-O 3.45Å; T211-L216 PolarHBondContact O-N 2.8Å; T211-Y218 HydrophobicContact CG2-CD2 4.33Å; T211-Y218 HydrophobicContact CG2-CE2 3.51Å; T211-Y218 WeakPolarHBondContact OG1-CE2 3.25Å; T211-Y218 PolarHBondContact OG1-OH 3.39Å; T211-Y241 HydrophobicContact CG2-CD1 4.11Å; T211-Y241 HydrophobicContact CG2-CD2 3.61Å; T211-Y241 HydrophobicContact CG2-CE1 3.99Å; T211-Y241 HydrophobicContact CG2-CE2 3.51Å; T211-Y241 HydrophobicContact CG2-CG 3.92Å
212	V	93.2	Very high	93.7	Very high	17 Å²	17	68.7 Å²	68.7	10%	0.103	33%	0.327	C	S	.	.	H	α-helix	trans	-69.4	-48.6	-179.9	172.8	0	0	0	0	112.7	F208 R210 K214 D215 R251 V254	F208-V212 HydrophobicContact CD1-CG2 4.12Å; F208-V212 HydrophobicContact CE1-CG2 3.78Å; F208-V212 HydrophobicContact CE2-CG2 4.46Å; F208-V212 HydrophobicContact CZ-CG2 3.97Å; F208-V212 WeakPolarHBondContact O-CG2 3.42Å; F208-V212 PolarHBondContact O-N 2.97Å; R210-V212 VanDerWaalsContact C-N 3.33Å; V212-K214 VanDerWaalsContact C-N 3.31Å; V212-K214 PolarHBondContact O-N 3.24Å; V212-D215 PolarHBondContact O-N 3.4Å; V212-R251 HydrophobicContact CB-CG 4.43Å; V212-R251 HydrophobicContact CG1-CG 3.62Å; V212-R251 HydrophobicContact CG2-CB 4.33Å; V212-R251 HydrophobicContact CG2-CG 3.99Å; V212-V254 HydrophobicContact CB-CB 4.13Å; V212-V254 HydrophobicContact CB-CG1 4.2Å; V212-V254 HydrophobicContact CB-CG2 3.96Å; V212-V254 HydrophobicContact CG1-CB 3.68Å; V212-V254 HydrophobicContact CG1-CG1 4Å; V212-V254 HydrophobicContact CG1-CG2 3.97Å; V212-V254 HydrophobicContact CG2-CG2 4.04Å
213	R	91.6	Very high	93.4	Very high	96 Å²	96	68 Å²	68	36%	0.362	33%	0.334	S	S	.	.	H	α-helix	trans	-64.5	-32.4	-176.5	-82.6	-167.9	174.6	70.3	-4.4	114.5	K209 V254 Q255	K209-R213 VanDerWaalsContact CD-NH1 3.31Å; K209-R213 WeakPolarHBondContact O-CB 3.34Å; K209-R213 PolarHBondContact O-N 3.22Å; K209-R213 VanDerWaalsContact O-N 3.14Å; R213-V254 HydrophobicContact CG-CG1 4.07Å; R213-Q255 PolarHBondContact NE-O 3.16Å; R213-Q255 PolarHBondContact NH2-O 3.15Å
214	K	92.4	Very high	93	Very high	153 Å²	153	72.7 Å²	72.7	67%	0.665	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.1	10.5	-179.5	-65.1	-172.8	174.3	-157.7	0	112.3	R210 V212 L216	R210-K214 WeakPolarHBondContact O-CB 3.42Å; R210-K214 PolarHBondContact O-N 2.82Å; V212-K214 VanDerWaalsContact C-N 3.31Å; V212-K214 PolarHBondContact O-N 3.24Å; K214-L216 HydrophobicContact CB-CD1 4.12Å; K214-L216 HydrophobicContact CB-CD2 3.89Å; K214-L216 HydrophobicContact CB-CG 3.68Å; K214-L216 HydrophobicContact CD-CD1 4.4Å; K214-L216 PolarHBondContact O-N 3.49Å
215	D	89.8	Confident	92.8	Very high	101 Å²	101	80.1 Å²	80.1	54%	0.54	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	36.7	48.7	-171.7	-156	33.8	0	0	0	115.2	T211 V212 T217 R251	T211-D215 CarbonylContact O-C 3.21Å; T211-D215 WeakPolarHBondContact O-CA 3.26Å; T211-D215 PolarHBondContact O-N 2.74Å; V212-D215 PolarHBondContact O-N 3.4Å; D215-T217 PolarHBondContact O-N 3.13Å; D215-R251 IonicContact OD1-CZ 3.04Å; D215-R251 VanDerWaalsContact OD1-CZ 3.26Å; D215-R251 IonicContact OD1-NH1 3.7Å; D215-R251 PolarHBondContact OD1-NH1 3.1Å; D215-R251 IonicContact OD1-NH2 2.85Å; D215-R251 PolarHBondContact OD1-NH2 3.31Å
216	L	93.4	Very high	92.7	Very high	64 Å²	64	78.5 Å²	78.5	34%	0.335	37%	0.374	S	S	.	.			trans	-75.9	130	-173.4	-60	173.7	0	0	0	110.7	T211 K214 Y218	T211-L216 HydrophobicContact CG2-CB 4.29Å; T211-L216 WeakPolarHBondContact CG2-O 3.45Å; T211-L216 PolarHBondContact O-N 2.8Å; K214-L216 HydrophobicContact CB-CD1 4.12Å; K214-L216 HydrophobicContact CB-CD2 3.89Å; K214-L216 HydrophobicContact CB-CG 3.68Å; K214-L216 HydrophobicContact CD-CD1 4.4Å; K214-L216 PolarHBondContact O-N 3.49Å; L216-Y218 HydrophobicContact CB-CE1 3.97Å; L216-Y218 HydrophobicContact CD1-CE1 4.37Å; L216-Y218 WeakPolarHBondContact CD1-OH 3.4Å
217	T	87.8	Confident	92.7	Very high	84 Å²	84	82.5 Å²	82.5	52%	0.515	40%	0.395	S	S	.	.			trans	-103.1	134.8	170.9	-61.8	0	0	0	0	110.1	D215 V278	D215-T217 PolarHBondContact O-N 3.13Å; T217-V278 HydrophobicContact CG2-CB 3.68Å; T217-V278 HydrophobicContact CG2-CG1 3.74Å; T217-V278 HydrophobicContact CG2-CG2 3.43Å; T217-V278 VanDerWaalsContact CG2-CG2 3.43Å
218	Y	93.3	Very high	92.6	Very high	32 Å²	32	82.6 Å²	82.6	13%	0.125	40%	0.396	C	S	.	.			trans	-119.4	147.7	-178.8	-55	-56.7	0	0	0	111.5	F207 T211 L216 Q237 H238	F207-Y218 AromaticContact CE2-CE2 3.84Å; F207-Y218 HydrophobicContact CE2-CE2 3.84Å; F207-Y218 HydrophobicContact CZ-CD2 4.3Å; F207-Y218 AromaticContact CZ-CE2 3.65Å; F207-Y218 HydrophobicContact CZ-CE2 3.65Å; T211-Y218 HydrophobicContact CG2-CD2 4.33Å; T211-Y218 HydrophobicContact CG2-CE2 3.51Å; T211-Y218 WeakPolarHBondContact OG1-CE2 3.25Å; T211-Y218 PolarHBondContact OG1-OH 3.39Å; L216-Y218 HydrophobicContact CB-CE1 3.97Å; L216-Y218 HydrophobicContact CD1-CE1 4.37Å; L216-Y218 WeakPolarHBondContact CD1-OH 3.4Å; Y218-Q237 HydrophobicContact CD1-CB 3.75Å; Y218-Q237 HydrophobicContact CD2-CB 3.81Å; Y218-Q237 HydrophobicContact CE1-CB 4.01Å; Y218-Q237 HydrophobicContact CE1-CG 4.48Å; Y218-Q237 HydrophobicContact CE2-CB 4.04Å; Y218-Q237 HydrophobicContact CG-CB 3.66Å; Y218-H238 PolarHBondContact O-ND1 3.03Å
219	S	89.2	Confident	92.6	Very high	80 Å²	80	85 Å²	85	56%	0.559	41%	0.409	S	S	*	.			trans	-114.9	136.4	172.5	-61.4	0	0	0	0	111.1
220	C	94	Very high	92.6	Very high	23 Å²	23	87 Å²	87	16%	0.155	42%	0.417	C	S	.	.			trans	-78.6	136.1	171.7	-172	0	0	0	0	109.9	E222 R224 C226 C236 H238 C239	C220-E222 VanDerWaalsContact C-N 3.33Å; C220-E222 PolarHBondContact SG-N 3.32Å; C220-E222 VanDerWaalsContact SG-N 3.36Å; C220-R224 HydrophobicContact CB-CG 3.9Å; C220-R224 PolarHBondContact SG-N 2.77Å; C220-C226 PolarHBondContact SG-SG 3.39Å; C220-C236 VanDerWaalsContact SG-SG 3.65Å; C220-H238 HydrophobicContact CB-CB 4.05Å; C220-C239 VanDerWaalsContact SG-SG 3.66Å
221	R	92.6	Very high	92.6	Very high	253 Å²	253	92 Å²	92	96%	0.955	44%	0.436	S	S	*	.	S	Bend	trans	-87.4	-5	175.8	-64.1	-177	177.3	176.1	-1.9	113.6
222	E	89.8	Confident	92.6	Very high	124 Å²	124	95.9 Å²	95.9	58%	0.579	46%	0.455	S	S	*	.	S	Bend	trans	-120	-148	-178.4	-61.3	169.9	-164	0	0	109	C220 R224 C226	C220-E222 VanDerWaalsContact C-N 3.33Å; C220-E222 PolarHBondContact SG-N 3.32Å; C220-E222 VanDerWaalsContact SG-N 3.36Å; E222-R224 VanDerWaalsContact C-N 3.34Å; E222-R224 PolarHBondContact O-N 3.44Å; E222-C226 PolarHBondContact OE2-SG 3.13Å
223	S	88.7	Confident	92.8	Very high	86 Å²	86	97.1 Å²	97.1	60%	0.601	46%	0.457	S	S	*	.	S	Bend	trans	-86.4	18.7	-174.8	58	0	0	0	0	115.3	H225	S223-H225 PolarHBondContact O-N 3.14Å; S223-H225 PolarHBondContact O-ND1 2.91Å
224	R	88.9	Confident	93.1	Very high	121 Å²	121	98.3 Å²	98.3	46%	0.457	47%	0.471	S	S	.	.	S	Bend	trans	59.8	17.2	-172.3	-57	-176.3	-174.8	178.6	2.4	115.6	C220 E222 C239 D325	C220-R224 HydrophobicContact CB-CG 3.9Å; C220-R224 PolarHBondContact SG-N 2.77Å; E222-R224 VanDerWaalsContact C-N 3.34Å; E222-R224 PolarHBondContact O-N 3.44Å; R224-C239 VanDerWaalsContact C-SG 3.6Å; R224-D325 IonicContact CZ-OD1 2.7Å; R224-D325 IonicContact NH1-OD1 3.76Å; R224-D325 PolarHBondContact NH1-OD1 3.17Å; R224-D325 IonicContact NH1-OD2 3.77Å
225	H	91.6	Very high	93.2	Very high	156 Å²	156	100.2 Å²	100.2	72%	0.722	47%	0.474	S	S	*	.			trans	-119.4	29.6	179.2	-66.4	83.1	0	0	0	113.3	S223 V227	S223-H225 PolarHBondContact O-N 3.14Å; S223-H225 PolarHBondContact O-ND1 2.91Å; H225-V227 PolarHBondContact O-N 3.02Å
226	C	94.8	Very high	93.6	Very high	18 Å²	18	96 Å²	96	12%	0.122	45%	0.452	C	S	.	.			trans	-64	135	-177.1	-51.4	0	0	0	0	111.8	C220 E222 I228 C236 C239	C220-C226 PolarHBondContact SG-SG 3.39Å; E222-C226 PolarHBondContact OE2-SG 3.13Å; C226-I228 PolarHBondContact O-N 3.13Å; C226-C236 HydrophobicContact CB-CB 3.8Å; C226-C236 VanDerWaalsContact SG-CB 3.6Å; C226-C239 HydrophobicContact CB-CB 3.78Å
227	V	94.5	Very high	93.8	Very high	98 Å²	98	97.8 Å²	97.8	59%	0.594	46%	0.459	S	S	*	.			trans	-70.1	127	178.2	178.9	0	0	0	0	110.8	H225	H225-V227 PolarHBondContact O-N 3.02Å
228	I	96.1	Very high	94.2	Very high	9 Å²	9	94.5 Å²	94.5	5%	0.046	44%	0.437	C	S	.	.			trans	-108.8	101.3	178.5	-50.3	-57.9	0	0	0	109.6	I166 C167 C226 R233 C239 R240 K243	I166-I228 HydrophobicContact CG2-CG2 4.09Å; I166-I228 WeakPolarHBondContact O-CG2 3.44Å; C167-I228 HydrophobicContact CB-CG2 4.17Å; C226-I228 PolarHBondContact O-N 3.13Å; I228-R233 HydrophobicContact CG2-CB 3.93Å; I228-C239 HydrophobicContact CD1-CB 4.02Å; I228-R240 HydrophobicContact CD1-CB 3.99Å; I228-R240 HydrophobicContact CG2-CG 4.19Å; I228-K243 HydrophobicContact CB-CD 3.67Å; I228-K243 HydrophobicContact CG1-CB 4.46Å; I228-K243 HydrophobicContact CG1-CD 3.91Å; I228-K243 HydrophobicContact CG2-CD 4.16Å; I228-K243 PolarHBondContact O-NZ 3.09Å; I228-K243 VanDerWaalsContact O-NZ 3.11Å
229	D	96.2	Very high	94.3	Very high	50 Å²	50	93.4 Å²	93.4	27%	0.267	43%	0.434	S	S	.	.			trans	-126.1	178.4	175.5	69.1	41	0	0	0	111.6	C167 R231 Q232 R233	C167-D229 CarbonylContact O-C 3.41Å; C167-D229 WeakPolarHBondContact O-CA 3.22Å; D229-R231 VanDerWaalsContact C-N 3.28Å; D229-R231 PolarHBondContact O-N 3.04Å; D229-R231 WeakPolarHBondContact OD1-CA 3.24Å; D229-R231 PolarHBondContact OD1-N 3.04Å; D229-Q232 VanDerWaalsContact CG-CG 3.41Å; D229-Q232 WeakPolarHBondContact OD1-CG 3.46Å; D229-Q232 PolarHBondContact OD1-N 3.03Å; D229-Q232 WeakPolarHBondContact OD2-CG 3.43Å; D229-Q232 PolarHBondContact OD2-NE2 3.28Å; D229-R233 WeakPolarHBondContact O-CA 3.18Å; D229-R233 WeakPolarHBondContact O-CB 3.32Å; D229-R233 PolarHBondContact O-N 3.36Å
230	K	96	Very high	94.7	Very high	127 Å²	127	90 Å²	90	55%	0.552	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-35.6	-177.7	177.8	172.7	177.2	153.1	0	113.4	C167 D169	C167-K230 PolarHBondContact O-N 2.84Å; D169-K230 HydrophobicContact CB-CB 4.4Å; D169-K230 HydrophobicContact CB-CD 4.2Å; D169-K230 HydrophobicContact CB-CG 4.18Å; D169-K230 WeakPolarHBondContact OD1-CD 3.27Å; D169-K230 VanDerWaalsContact OD1-CE 3.24Å; D169-K230 WeakPolarHBondContact OD1-CE 3.19Å; D169-K230 IonicContact OD1-NZ 3.74Å; D169-K230 PolarHBondContact OD1-NZ 3.04Å
231	R	96.3	Very high	94.8	Very high	240 Å²	240	90 Å²	90	91%	0.906	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-39.6	-172.8	-65.6	-178.6	-179.5	-105.4	3.1	111.9	D229	D229-R231 VanDerWaalsContact C-N 3.28Å; D229-R231 PolarHBondContact O-N 3.04Å; D229-R231 WeakPolarHBondContact OD1-CA 3.24Å; D229-R231 PolarHBondContact OD1-N 3.04Å
232	Q	95.4	Very high	94.9	Very high	82 Å²	82	80.2 Å²	80.2	38%	0.383	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118	14.9	-173.2	53.1	173.7	-7.3	0	0	114.7	D229 N234 R235	D229-Q232 VanDerWaalsContact CG-CG 3.41Å; D229-Q232 WeakPolarHBondContact OD1-CG 3.46Å; D229-Q232 PolarHBondContact OD1-N 3.03Å; D229-Q232 WeakPolarHBondContact OD2-CG 3.43Å; D229-Q232 PolarHBondContact OD2-NE2 3.28Å; Q232-N234 PolarHBondContact O-N 3.4Å; Q232-R235 HydrophobicContact CB-CB 4.34Å; Q232-R235 VanDerWaalsContact O-CB 3.24Å; Q232-R235 WeakPolarHBondContact O-CB 3.38Å; Q232-R235 PolarHBondContact O-N 3.1Å
233	R	96.6	Very high	95	Very high	43 Å²	43	76.7 Å²	76.7	16%	0.162	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54	-18.3	172.2	61.4	-174.7	-168.9	-159	-4.1	114.9	C167 D169 C201 I228 D229 R240	C167-R233 HydrophobicContact CB-CB 4.14Å; C167-R233 PolarHBondContact SG-NH1 3.34Å; D169-R233 IonicContact OD2-CZ 2.95Å; D169-R233 IonicContact OD2-NH1 2.81Å; D169-R233 PolarHBondContact OD2-NH1 2.92Å; D169-R233 IonicContact OD2-NH2 2.85Å; C201-R233 PolarHBondContact SG-NH1 3Å; I228-R233 HydrophobicContact CG2-CB 3.93Å; D229-R233 WeakPolarHBondContact O-CA 3.18Å; D229-R233 WeakPolarHBondContact O-CB 3.32Å; D229-R233 PolarHBondContact O-N 3.36Å; R233-R240 VanDerWaalsContact O-CD 3.29Å; R233-R240 WeakPolarHBondContact O-CD 3.28Å; R233-R240 PolarHBondContact O-NH1 3.25Å
234	N	97.1	Very high	95.2	Very high	121 Å²	121	72.6 Å²	72.6	65%	0.647	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	-5.5	177.5	-64.5	-19.3	0	0	0	113.6	Q232 R240	Q232-N234 PolarHBondContact O-N 3.4Å; N234-R240 PolarHBondContact OD1-NH1 3.46Å
235	R	96.1	Very high	95.3	Very high	193 Å²	193	67.8 Å²	67.8	73%	0.728	31%	0.308	S	S	*	.	S	Bend	trans	-65.2	-43.3	-177.6	175.9	61.8	68.2	171.5	3.3	112.7	Q232	Q232-R235 HydrophobicContact CB-CB 4.34Å; Q232-R235 VanDerWaalsContact O-CB 3.24Å; Q232-R235 WeakPolarHBondContact O-CB 3.38Å; Q232-R235 PolarHBondContact O-N 3.1Å
236	C	97.4	Very high	95.2	Very high	11 Å²	11	63.6 Å²	63.6	7%	0.074	29%	0.29	C	S	.	.			trans	-134.9	109.9	-179.1	-177.3	0	0	0	0	110.6	C220 C226 C239 R240	C220-C236 VanDerWaalsContact SG-SG 3.65Å; C226-C236 HydrophobicContact CB-CB 3.8Å; C226-C236 VanDerWaalsContact SG-CB 3.6Å; C236-C239 HydrophobicContact CB-CB 4.29Å; C236-R240 WeakPolarHBondContact O-CB 3.38Å; C236-R240 PolarHBondContact O-N 3.47Å
237	Q	97.4	Very high	94.8	Very high	102 Å²	102	65 Å²	65	48%	0.477	30%	0.295	S	S	.	.	H	α-helix	trans	-69.3	-37.3	179.7	-66.2	174.4	-49.4	0	0	111.8	F207 Y218 R240 Y241	F207-Q237 HydrophobicContact CE2-CB 4.13Å; F207-Q237 HydrophobicContact CE2-CG 4.18Å; F207-Q237 HydrophobicContact CZ-CB 4.27Å; F207-Q237 WeakPolarHBondContact CZ-O 3.38Å; Y218-Q237 HydrophobicContact CD1-CB 3.75Å; Y218-Q237 HydrophobicContact CD2-CB 3.81Å; Y218-Q237 HydrophobicContact CE1-CB 4.01Å; Y218-Q237 HydrophobicContact CE1-CG 4.48Å; Y218-Q237 HydrophobicContact CE2-CB 4.04Å; Y218-Q237 HydrophobicContact CG-CB 3.66Å; Q237-R240 PolarHBondContact O-N 3.37Å; Q237-Y241 WeakPolarHBondContact O-CB 3.47Å; Q237-Y241 PolarHBondContact O-N 3.16Å
238	H	96.7	Very high	94.4	Very high	15 Å²	15	61.4 Å²	61.4	7%	0.069	28%	0.278	C	S	.	.	H	α-helix	trans	-56.8	-59.2	176.6	176.9	92.8	0	0	0	111.6	Y218 C220 R240 Y241 Q242	Y218-H238 PolarHBondContact O-ND1 3.03Å; C220-H238 HydrophobicContact CB-CB 4.05Å; H238-R240 VanDerWaalsContact C-N 3.25Å; H238-R240 PolarHBondContact O-N 2.95Å; H238-Y241 PolarHBondContact O-N 3.27Å; H238-Y241 VanDerWaalsContact O-N 3.11Å; H238-Q242 WeakPolarHBondContact O-CG 3.22Å; H238-Q242 PolarHBondContact O-N 2.98Å
239	C	95.9	Very high	94	Very high	9 Å²	9	61.3 Å²	61.3	6%	0.061	28%	0.278	C	S	.	.	H	α-helix	trans	-63.3	-32.6	-179.1	-62	0	0	0	0	112.1	C220 R224 C226 I228 C236 K243	C220-C239 VanDerWaalsContact SG-SG 3.66Å; R224-C239 VanDerWaalsContact C-SG 3.6Å; C226-C239 HydrophobicContact CB-CB 3.78Å; I228-C239 HydrophobicContact CD1-CB 4.02Å; C236-C239 HydrophobicContact CB-CB 4.29Å; C239-K243 VanDerWaalsContact O-CB 3.28Å; C239-K243 WeakPolarHBondContact O-CB 3.48Å; C239-K243 PolarHBondContact O-N 3.11Å
240	R	97.4	Very high	93.6	Very high	10 Å²	10	61.5 Å²	61.5	4%	0.038	28%	0.276	C	S	.	.	H	α-helix	trans	-65.1	-44.4	174.3	-170.8	-169.5	-171.7	161.3	-5.1	111.9	G203 F207 I228 R233 N234 C236 Q237 H238 K243 C244	G203-R240 VanDerWaalsContact C-NH2 3.29Å; G203-R240 PolarHBondContact O-NH2 3.49Å; F207-R240 VanDerWaalsContact CD1-CD 3.49Å; F207-R240 HydrophobicContact CD1-CG 3.9Å; F207-R240 HydrophobicContact CE1-CB 3.93Å; F207-R240 HydrophobicContact CE1-CG 3.66Å; F207-R240 HydrophobicContact CZ-CB 4.07Å; F207-R240 HydrophobicContact CZ-CG 4.19Å; I228-R240 HydrophobicContact CD1-CB 3.99Å; I228-R240 HydrophobicContact CG2-CG 4.19Å; R233-R240 VanDerWaalsContact O-CD 3.29Å; R233-R240 WeakPolarHBondContact O-CD 3.28Å; R233-R240 PolarHBondContact O-NH1 3.25Å; N234-R240 PolarHBondContact OD1-NH1 3.46Å; C236-R240 WeakPolarHBondContact O-CB 3.38Å; C236-R240 PolarHBondContact O-N 3.47Å; Q237-R240 PolarHBondContact O-N 3.37Å; H238-R240 VanDerWaalsContact C-N 3.25Å; H238-R240 PolarHBondContact O-N 2.95Å; R240-K243 PolarHBondContact O-N 3.02Å; R240-C244 PolarHBondContact O-N 2.98Å; R240-C244 PolarHBondContact O-SG 3.24Å
241	Y	96.1	Very high	93.4	Very high	21 Å²	21	59.8 Å²	59.8	8%	0.082	27%	0.266	C	S	.	.	H	α-helix	trans	-67.9	-46	179.4	-175.6	-123.6	0	0	0	111.5	F207 F208 T211 Q237 H238 K243 C244 L245 R251	F207-Y241 HydrophobicContact CE1-CD2 4.3Å; F208-Y241 AromaticContact CD2-CD2 4Å; F208-Y241 HydrophobicContact CD2-CD2 4Å; F208-Y241 AromaticContact CD2-CE2 3.69Å; F208-Y241 HydrophobicContact CD2-CE2 3.69Å; F208-Y241 HydrophobicContact CE2-CD2 4.26Å; F208-Y241 AromaticContact CE2-CE2 3.61Å; F208-Y241 HydrophobicContact CE2-CE2 3.61Å; T211-Y241 HydrophobicContact CG2-CD1 4.11Å; T211-Y241 HydrophobicContact CG2-CD2 3.61Å; T211-Y241 HydrophobicContact CG2-CE1 3.99Å; T211-Y241 HydrophobicContact CG2-CE2 3.51Å; T211-Y241 HydrophobicContact CG2-CG 3.92Å; Q237-Y241 WeakPolarHBondContact O-CB 3.47Å; Q237-Y241 PolarHBondContact O-N 3.16Å; H238-Y241 PolarHBondContact O-N 3.27Å; H238-Y241 VanDerWaalsContact O-N 3.11Å; Y241-K243 VanDerWaalsContact C-N 3.26Å; Y241-K243 PolarHBondContact O-N 3.12Å; Y241-C244 WeakPolarHBondContact O-CA 3.38Å; Y241-C244 VanDerWaalsContact O-CB 3.27Å; Y241-C244 WeakPolarHBondContact O-CB 3.43Å; Y241-C244 PolarHBondContact O-N 3.28Å; Y241-L245 HydrophobicContact CD1-CD1 3.99Å; Y241-L245 HydrophobicContact CE1-CD1 3.67Å; Y241-L245 HydrophobicContact CE1-CG 4.48Å; Y241-L245 HydrophobicContact CE2-CD1 4.41Å; Y241-L245 HydrophobicContact CE2-CD2 4.36Å; Y241-L245 HydrophobicContact CE2-CG 4.37Å; Y241-L245 PolarHBondContact O-N 3.47Å; Y241-R251 PolarHBondContact OH-NH2 3.42Å
242	Q	93.4	Very high	92.9	Very high	49 Å²	49	54.2 Å²	54.2	23%	0.229	25%	0.25	C	S	.	.	H	α-helix	trans	-55.9	-42.2	172.9	-68.2	-57.1	-23	0	0	111.7	H238 C244 L245 M246	H238-Q242 WeakPolarHBondContact O-CG 3.22Å; H238-Q242 PolarHBondContact O-N 2.98Å; Q242-C244 VanDerWaalsContact C-N 3.32Å; Q242-C244 PolarHBondContact O-N 2.86Å; Q242-L245 PolarHBondContact O-N 2.96Å; Q242-M246 WeakPolarHBondContact O-CB 3.46Å; Q242-M246 PolarHBondContact O-N 3.07Å
243	K	92.7	Very high	92.6	Very high	50 Å²	50	52.3 Å²	52.3	22%	0.217	25%	0.249	C	C	.	.	H	α-helix	trans	-65.5	-31.6	174.1	-166.7	173.4	-173.5	-176.4	0	113.4	I166 I228 C239 R240 Y241 M246 M247	I166-K243 HydrophobicContact CG2-CB 4.42Å; I166-K243 HydrophobicContact CG2-CD 4.27Å; I166-K243 HydrophobicContact CG2-CG 4.24Å; I166-K243 VanDerWaalsContact O-CD 3.24Å; I166-K243 WeakPolarHBondContact O-CD 3.24Å; I166-K243 WeakPolarHBondContact O-CE 3.42Å; I166-K243 PolarHBondContact O-NZ 3.45Å; I228-K243 HydrophobicContact CB-CD 3.67Å; I228-K243 HydrophobicContact CG1-CB 4.46Å; I228-K243 HydrophobicContact CG1-CD 3.91Å; I228-K243 HydrophobicContact CG2-CD 4.16Å; I228-K243 PolarHBondContact O-NZ 3.09Å; I228-K243 VanDerWaalsContact O-NZ 3.11Å; C239-K243 VanDerWaalsContact O-CB 3.28Å; C239-K243 WeakPolarHBondContact O-CB 3.48Å; C239-K243 PolarHBondContact O-N 3.11Å; R240-K243 PolarHBondContact O-N 3.02Å; Y241-K243 VanDerWaalsContact C-N 3.26Å; Y241-K243 PolarHBondContact O-N 3.12Å; K243-M246 HydrophobicContact CB-CE 4.41Å; K243-M246 HydrophobicContact CG-CE 3.97Å; K243-M247 HydrophobicContact CG-CE 4.48Å; K243-M247 HydrophobicContact CG-CG 4.29Å; K243-M247 WeakPolarHBondContact O-CB 3.31Å; K243-M247 WeakPolarHBondContact O-CG 3.02Å; K243-M247 PolarHBondContact O-N 3.08Å; K243-M247 VanDerWaalsContact O-N 3.08Å
244	C	93.3	Very high	92.3	Very high	0 Å²	0	51 Å²	51	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-64.3	-47.3	174.2	-65.7	0	0	0	0	110.8	F208 R240 Y241 Q242 M247 G248 M249	F208-C244 HydrophobicContact CD2-CB 3.59Å; F208-C244 HydrophobicContact CE2-CB 4.1Å; R240-C244 PolarHBondContact O-N 2.98Å; R240-C244 PolarHBondContact O-SG 3.24Å; Y241-C244 WeakPolarHBondContact O-CA 3.38Å; Y241-C244 VanDerWaalsContact O-CB 3.27Å; Y241-C244 WeakPolarHBondContact O-CB 3.43Å; Y241-C244 PolarHBondContact O-N 3.28Å; Q242-C244 VanDerWaalsContact C-N 3.32Å; Q242-C244 PolarHBondContact O-N 2.86Å; C244-M247 CarbonylContact O-C 2.99Å; C244-M247 PolarHBondContact O-N 3.17Å; C244-G248 PolarHBondContact O-N 2.77Å; C244-M249 HydrophobicContact CB-CB 4.3Å; C244-M249 HydrophobicContact CB-CG 4.31Å; C244-M249 HydrophobicContact CB-SD 3.61Å; C244-M249 WeakPolarHBondContact O-CB 3.38Å; C244-M249 PolarHBondContact O-N 3.33Å
245	L	91.2	Very high	91.7	Very high	19 Å²	19	52.6 Å²	52.6	10%	0.099	25%	0.249	C	C	.	.	H	α-helix	trans	-65.8	-44.8	179.5	-59.3	165.8	0	0	0	111.5	F208 Y241 Q242 M247 G248 M428	F208-L245 HydrophobicContact CE2-CD2 3.7Å; F208-L245 HydrophobicContact CE2-CG 4.34Å; F208-L245 HydrophobicContact CZ-CD2 4.1Å; Y241-L245 HydrophobicContact CD1-CD1 3.99Å; Y241-L245 HydrophobicContact CE1-CD1 3.67Å; Y241-L245 HydrophobicContact CE1-CG 4.48Å; Y241-L245 HydrophobicContact CE2-CD1 4.41Å; Y241-L245 HydrophobicContact CE2-CD2 4.36Å; Y241-L245 HydrophobicContact CE2-CG 4.37Å; Y241-L245 PolarHBondContact O-N 3.47Å; Q242-L245 PolarHBondContact O-N 2.96Å; L245-M247 PolarHBondContact O-N 3.13Å; L245-G248 WeakPolarHBondContact O-CA 3.24Å; L245-G248 PolarHBondContact O-N 2.87Å; L245-M428 HydrophobicContact CB-CG 3.92Å; L245-M428 HydrophobicContact CB-SD 3.21Å; L245-M428 WeakPolarHBondContact CB-SD 3.24Å; L245-M428 HydrophobicContact CD1-CE 4.01Å; L245-M428 HydrophobicContact CD1-SD 3.28Å; L245-M428 WeakPolarHBondContact CD1-SD 3.38Å; L245-M428 HydrophobicContact CD2-SD 4.36Å; L245-M428 HydrophobicContact CG-SD 3.75Å
246	M	87.9	Confident	90.8	Very high	69 Å²	69	51.7 Å²	51.7	34%	0.34	25%	0.253	S	S	.	.	H	α-helix	trans	-58.6	-30.3	174	171.8	169.1	68.8	0	0	112.9	Q242 K243 G248 P327 C425	Q242-M246 WeakPolarHBondContact O-CB 3.46Å; Q242-M246 PolarHBondContact O-N 3.07Å; K243-M246 HydrophobicContact CB-CE 4.41Å; K243-M246 HydrophobicContact CG-CE 3.97Å; M246-G248 PolarHBondContact O-N 3.39Å; M246-P327 HydrophobicContact SD-CG 4.34Å; M246-C425 WeakPolarHBondContact CG-SG 3.32Å
247	M	87.1	Confident	89.6	Confident	47 Å²	47	58.2 Å²	58.2	23%	0.232	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	11.9	175.6	-63.4	-69.1	144.3	0	0	112.8	N165 I166 Y198 K243 C244 L245	N165-M247 HydrophobicContact CB-CG 4.43Å; N165-M247 HydrophobicContact CB-SD 4.08Å; I166-M247 HydrophobicContact CG1-CB 4.32Å; I166-M247 HydrophobicContact CG1-CG 4.32Å; Y198-M247 WeakPolarHBondContact CD1-O 3.48Å; K243-M247 HydrophobicContact CG-CE 4.48Å; K243-M247 HydrophobicContact CG-CG 4.29Å; K243-M247 WeakPolarHBondContact O-CB 3.31Å; K243-M247 WeakPolarHBondContact O-CG 3.02Å; K243-M247 PolarHBondContact O-N 3.08Å; K243-M247 VanDerWaalsContact O-N 3.08Å; C244-M247 CarbonylContact O-C 2.99Å; C244-M247 PolarHBondContact O-N 3.17Å; L245-M247 PolarHBondContact O-N 3.13Å
248	G	85.5	Confident	88.5	Confident	22 Å²	22	63.8 Å²	63.8	23%	0.227	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	85.6	16.4	172.8	0	0	0	0	0	115.6	C244 L245 M246 K250	C244-G248 PolarHBondContact O-N 2.77Å; L245-G248 WeakPolarHBondContact O-CA 3.24Å; L245-G248 PolarHBondContact O-N 2.87Å; M246-G248 PolarHBondContact O-N 3.39Å; G248-K250 PolarHBondContact O-N 2.97Å
249	M	89.3	Confident	86.7	Confident	8 Å²	8	71.4 Å²	71.4	4%	0.039	33%	0.334	C	S	.	.			trans	-70.6	123.7	168.8	-67.1	-174.5	164.2	0	0	110	I166 Y176 S200 F208 C244	I166-M249 HydrophobicContact CD1-CE 3.62Å; I166-M249 HydrophobicContact CD1-SD 4.46Å; Y176-M249 CarbonylContact O-C 3.42Å; Y176-M249 WeakPolarHBondContact O-CA 3.49Å; S200-M249 WeakPolarHBondContact OG-CE 3.33Å; F208-M249 HydrophobicContact CB-SD 3.86Å; F208-M249 HydrophobicContact CD1-CB 4.26Å; F208-M249 HydrophobicContact CD1-SD 4.34Å; F208-M249 HydrophobicContact CD2-CB 3.84Å; F208-M249 HydrophobicContact CD2-CG 4.48Å; F208-M249 HydrophobicContact CD2-SD 3.83Å; F208-M249 HydrophobicContact CE1-CB 3.95Å; F208-M249 HydrophobicContact CE2-CB 3.49Å; F208-M249 VanDerWaalsContact CE2-CB 3.49Å; F208-M249 HydrophobicContact CE2-SD 4.47Å; F208-M249 HydrophobicContact CG-CB 4.2Å; F208-M249 HydrophobicContact CG-SD 3.75Å; F208-M249 HydrophobicContact CZ-CB 3.56Å; C244-M249 HydrophobicContact CB-CB 4.3Å; C244-M249 HydrophobicContact CB-CG 4.31Å; C244-M249 HydrophobicContact CB-SD 3.61Å; C244-M249 WeakPolarHBondContact O-CB 3.38Å; C244-M249 PolarHBondContact O-N 3.33Å
250	K	86.7	Confident	85	Confident	53 Å²	53	81.3 Å²	81.3	23%	0.23	37%	0.371	C	S	.	.			trans	-94.9	123.8	-176.6	-81.5	173.9	159.8	-89.4	0	110.6	Y176 F208 G248 E252 A253 T427	Y176-K250 WeakPolarHBondContact O-CB 3.4Å; Y176-K250 PolarHBondContact O-N 3.11Å; F208-K250 WeakPolarHBondContact CE1-O 3.28Å; G248-K250 PolarHBondContact O-N 2.97Å; K250-E252 VanDerWaalsContact C-N 3.31Å; K250-E252 WeakPolarHBondContact CA-OE2 3.45Å; K250-E252 VanDerWaalsContact CB-CD 3.46Å; K250-E252 HydrophobicContact CB-CG 4.45Å; K250-E252 VanDerWaalsContact CB-OE1 3.3Å; K250-E252 WeakPolarHBondContact CB-OE1 3.41Å; K250-E252 VanDerWaalsContact CB-OE2 3.27Å; K250-E252 WeakPolarHBondContact CB-OE2 3.27Å; K250-E252 WeakPolarHBondContact CD-OE1 2.84Å; K250-E252 WeakPolarHBondContact CG-OE1 2.78Å; K250-E252 IonicContact NZ-OE1 3.17Å; K250-E252 PolarHBondContact NZ-OE1 3.34Å; K250-E252 PolarHBondContact O-N 2.81Å; K250-A253 HydrophobicContact CB-CB 3.99Å; K250-A253 WeakPolarHBondContact O-CB 2.89Å; K250-A253 PolarHBondContact O-N 3.23Å; K250-T427 HydrophobicContact CG-CG2 4.3Å
251	R	91.1	Very high	82.9	Confident	91 Å²	91	89.6 Å²	89.6	34%	0.343	42%	0.415	S	S	.	.	G	3₁₀ helix	trans	-61.4	-43.5	179.2	173.7	-179.7	-81.2	-94.8	15.7	110.3	V212 D215 Y241 A253 V254	V212-R251 HydrophobicContact CB-CG 4.43Å; V212-R251 HydrophobicContact CG1-CG 3.62Å; V212-R251 HydrophobicContact CG2-CB 4.33Å; V212-R251 HydrophobicContact CG2-CG 3.99Å; D215-R251 IonicContact OD1-CZ 3.04Å; D215-R251 VanDerWaalsContact OD1-CZ 3.26Å; D215-R251 IonicContact OD1-NH1 3.7Å; D215-R251 PolarHBondContact OD1-NH1 3.1Å; D215-R251 IonicContact OD1-NH2 2.85Å; D215-R251 PolarHBondContact OD1-NH2 3.31Å; Y241-R251 PolarHBondContact OH-NH2 3.42Å; R251-A253 PolarHBondContact O-N 3.43Å; R251-V254 WeakPolarHBondContact O-CB 3.37Å; R251-V254 PolarHBondContact O-N 3.17Å
252	E	86.9	Confident	80.7	Confident	124 Å²	124	99.2 Å²	99.2	58%	0.579	45%	0.451	S	S	*	.	G	3₁₀ helix	trans	-63.6	-21.6	-179.4	72.7	-79.5	-171	0	0	113.6	K250 V254	K250-E252 VanDerWaalsContact C-N 3.31Å; K250-E252 WeakPolarHBondContact CA-OE2 3.45Å; K250-E252 VanDerWaalsContact CB-CD 3.46Å; K250-E252 HydrophobicContact CB-CG 4.45Å; K250-E252 VanDerWaalsContact CB-OE1 3.3Å; K250-E252 WeakPolarHBondContact CB-OE1 3.41Å; K250-E252 VanDerWaalsContact CB-OE2 3.27Å; K250-E252 WeakPolarHBondContact CB-OE2 3.27Å; K250-E252 WeakPolarHBondContact CD-OE1 2.84Å; K250-E252 WeakPolarHBondContact CG-OE1 2.78Å; K250-E252 IonicContact NZ-OE1 3.17Å; K250-E252 PolarHBondContact NZ-OE1 3.34Å; K250-E252 PolarHBondContact O-N 2.81Å; E252-V254 PolarHBondContact O-N 2.76Å
253	A	88.8	Confident	78.3	Confident	42 Å²	42	102.2 Å²	102.2	35%	0.347	48%	0.477	S	S	.	.	G	3₁₀ helix	trans	-75.2	-11	175.6	0	0	0	0	0	112.9	Y176 K250 R251 Q255	Y176-A253 HydrophobicContact CD1-CB 4.47Å; K250-A253 HydrophobicContact CB-CB 3.99Å; K250-A253 WeakPolarHBondContact O-CB 2.89Å; K250-A253 PolarHBondContact O-N 3.23Å; R251-A253 PolarHBondContact O-N 3.43Å; A253-Q255 PolarHBondContact O-N 3.27Å
254	V	90.1	Very high	75.8	Confident	15 Å²	15	107.4 Å²	107.4	9%	0.091	51%	0.508	C	S	.	.	S	Bend	trans	-85.5	101	175.5	-175.3	0	0	0	0	108.5	Y176 F208 K209 V212 R213 R251 E252	Y176-V254 HydrophobicContact CD1-CB 4.43Å; Y176-V254 HydrophobicContact CD1-CG2 3.62Å; Y176-V254 HydrophobicContact CE1-CG2 3.91Å; Y176-V254 HydrophobicContact CG-CG2 4Å; F208-V254 HydrophobicContact CD1-CG2 3.8Å; F208-V254 HydrophobicContact CE1-CG2 3.68Å; K209-V254 HydrophobicContact CG-CG1 4.25Å; V212-V254 HydrophobicContact CB-CB 4.13Å; V212-V254 HydrophobicContact CB-CG1 4.2Å; V212-V254 HydrophobicContact CB-CG2 3.96Å; V212-V254 HydrophobicContact CG1-CB 3.68Å; V212-V254 HydrophobicContact CG1-CG1 4Å; V212-V254 HydrophobicContact CG1-CG2 3.97Å; V212-V254 HydrophobicContact CG2-CG2 4.04Å; R213-V254 HydrophobicContact CG-CG1 4.07Å; R251-V254 WeakPolarHBondContact O-CB 3.37Å; R251-V254 PolarHBondContact O-N 3.17Å; E252-V254 PolarHBondContact O-N 2.76Å
255	Q	85.2	Confident	73.5	Confident	154 Å²	154	118.6 Å²	118.6	72%	0.72	55%	0.55	S	S	*	.	P	Polyproline II helix	trans	-55.8	144.8	172.7	-65.2	173.5	13.7	0	0	110.9	R213 A253	R213-Q255 PolarHBondContact NE-O 3.16Å; R213-Q255 PolarHBondContact NH2-O 3.15Å; A253-Q255 PolarHBondContact O-N 3.27Å
256	E	76.7	Confident	71.2	Confident	175 Å²	175	122.8 Å²	122.8	82%	0.818	58%	0.581	S	S	*	*	P	Polyproline II helix	trans	-59.7	160.7	172.4	-165.7	150.5	-154.3	0	0	111.2	R258	E256-R258 PolarHBondContact O-N 3.21Å
257	E	72.4	Confident	69.2	Low	147 Å²	147	126.6 Å²	126.6	69%	0.687	60%	0.602	S	S	*	*	P	Polyproline II helix	trans	-62.2	127.6	176.3	-175.9	156.2	-149.7	0	0	109.9	Q259	E257-Q259 VanDerWaalsContact C-N 3.25Å; E257-Q259 PolarHBondContact O-N 3.48Å
258	R	74	Confident	67.2	Low	219 Å²	219	129.4 Å²	129.4	83%	0.826	63%	0.627	S	S	*	*			trans	-65.8	93.8	171.2	-173.8	-178.8	-72.2	-175	-3.2	106.8	E256 R260	E256-R258 PolarHBondContact O-N 3.21Å; R258-R260 PolarHBondContact O-N 3.1Å
259	Q	59.9	Low	64.8	Low	175 Å²	175	131.7 Å²	131.7	82%	0.818	65%	0.65	S	S	*	*			trans	-55.7	107.8	170.8	-71.2	-175.1	4.6	0	0	107.1	E257 L261	E257-Q259 VanDerWaalsContact C-N 3.25Å; E257-Q259 PolarHBondContact O-N 3.48Å; Q259-L261 PolarHBondContact O-N 3.27Å
260	R	60.3	Low	62.5	Low	217 Å²	217	139.6 Å²	139.6	82%	0.819	69%	0.687	S	S	*	*			trans	-75.5	114.4	163.8	-68.4	-178.4	-179.6	-175.8	-1.3	104.4	R258 R262	R258-R260 PolarHBondContact O-N 3.1Å; R260-R262 VanDerWaalsContact C-N 3.27Å; R260-R262 PolarHBondContact O-N 3.11Å
261	L	52.8	Low	60.6	Low	184 Å²	184	142.1 Å²	142.1	96%	0.963	71%	0.708	S	S	*	*			trans	-44.3	95.5	167.6	-75.7	154.2	0	0	0	108.9	Q259	Q259-L261 PolarHBondContact O-N 3.27Å
262	R	49.3	Very low	57.9	Low	224 Å²	224	147.3 Å²	147.3	85%	0.845	74%	0.736	S	S	*	*			trans	-130.7	93.1	169	-82.8	-165.4	160.2	-156.6	-6.1	105.4	R260	R260-R262 VanDerWaalsContact C-N 3.27Å; R260-R262 PolarHBondContact O-N 3.11Å
263	S	44.1	Very low	55.5	Low	112 Å²	112	146 Å²	146	78%	0.783	74%	0.741	S	S	*	*			trans	12.3	122.3	148.8	59.2	0	0	0	0	116.6	R265	S263-R265 PolarHBondContact O-N 2.92Å
264	D	39.6	Very low	53.3	Low	159 Å²	159	150.1 Å²	150.1	85%	0.85	76%	0.762	S	S	*	*			trans	-14.6	121.2	154.4	-80.6	-46.9	0	0	0	115.2
265	R	44.1	Very low	50.8	Low	235 Å²	235	155.5 Å²	155.5	89%	0.887	80%	0.801	S	S	*	*			trans	-167.5	100.6	144	-103.7	160.8	-171.9	-140.4	0.2	108.9	S263	S263-R265 PolarHBondContact O-N 2.92Å
266	S	43.5	Very low	48.4	Very low	107 Å²	107	151.3 Å²	151.3	75%	0.748	79%	0.788	S	S	*	*				26.8	121.8	128.3	57.9	0	0	0	0	116.9
267	D	46.8	Very low	46.6	Very low	149 Å²	149	152 Å²	152	80%	0.797	79%	0.791	S	S	*	*				153.2	139.4	106.8	-165.2	18.2	0	0	0	111
268	S	44.1	Very low	45.5	Very low	106 Å²	106	147.1 Å²	147.1	74%	0.741	77%	0.771	S	S	*	*			trans	61.8	112.9	173	64	0	0	0	0	117
269	G	35.7	Very low	44.8	Very low	69 Å²	69	138.4 Å²	138.4	71%	0.711	74%	0.744	S	S	*	*			cis	90.1	64.7	36.4	0	0	0	0	0	110.1
270	E	40.5	Very low	45.5	Very low	175 Å²	175	137.4 Å²	137.4	82%	0.818	74%	0.739	S	S	*	*			trans	-135.9	120	167.4	-78.4	-64.1	142.1	0	0	108.5	E272	E270-E272 PolarHBondContact O-N 3.35Å
271	P	45.9	Very low	46.8	Very low	105 Å²	105	127.5 Å²	127.5	68%	0.682	70%	0.703	S	S	*	*			trans	-72	123.1	-179.8	28.7	-30.5	0	0	0	109.5	S273	P271-S273 PolarHBondContact O-N 2.94Å
272	E	34.9	Very low	48.7	Very low	200 Å²	200	120.1 Å²	120.1	94%	0.935	67%	0.666	S	S	*	*			trans	-60.5	98.3	169.4	-162.9	148.4	173.9	0	0	108.6	E270	E270-E272 PolarHBondContact O-N 3.35Å
273	S	36	Very low	50.8	Low	98 Å²	98	110.6 Å²	110.6	69%	0.685	63%	0.633	S	S	*	*			trans	-141.5	89.5	178.9	-78.9	0	0	0	0	109.1	P271	P271-S273 PolarHBondContact O-N 2.94Å
274	T	42.9	Very low	53.2	Low	127 Å²	127	111.2 Å²	111.2	78%	0.779	62%	0.624	S	S	*	*			trans	-145.8	83.9	147.2	-30.4	0	0	0	0	107.8	S276	T274-S276 VanDerWaalsContact C-N 3.32Å; T274-S276 PolarHBondContact O-N 2.88Å; T274-S276 PolarHBondContact O-OG 2.98Å
275	S	37.2	Very low	55.7	Low	129 Å²	129	109.9 Å²	109.9	90%	0.902	61%	0.607	S	S	*	*			trans	-52.9	99	162.5	44.9	0	0	0	0	108.3
276	S	35.3	Very low	58.2	Low	66 Å²	66	98.7 Å²	98.7	46%	0.462	57%	0.565	S	S	.	*			trans	-114.2	104.5	172.4	47.4	0	0	0	0	106.6	T274 V278	T274-S276 VanDerWaalsContact C-N 3.32Å; T274-S276 PolarHBondContact O-N 2.88Å; T274-S276 PolarHBondContact O-OG 2.98Å; S276-V278 WeakPolarHBondContact O-CG2 3.5Å; S276-V278 PolarHBondContact O-N 2.88Å
277	H	39.5	Very low	60.6	Low	189 Å²	189	96.3 Å²	96.3	88%	0.875	54%	0.543	S	S	*	.			trans	-61.7	73.5	-176	-148.2	-70.2	0	0	0	110.9	S279	H277-S279 PolarHBondContact O-N 3.17Å
278	V	49.8	Very low	62.9	Low	44 Å²	44	93.8 Å²	93.8	27%	0.267	53%	0.526	S	S	.	.			trans	-93.5	83.3	-179.4	-174.6	0	0	0	0	109.2	T217 S276 E280	T217-V278 HydrophobicContact CG2-CB 3.68Å; T217-V278 HydrophobicContact CG2-CG1 3.74Å; T217-V278 HydrophobicContact CG2-CG2 3.43Å; T217-V278 VanDerWaalsContact CG2-CG2 3.43Å; S276-V278 WeakPolarHBondContact O-CG2 3.5Å; S276-V278 PolarHBondContact O-N 2.88Å; V278-E280 PolarHBondContact O-N 2.62Å
279	S	58.8	Low	65.2	Low	37 Å²	37	88.7 Å²	88.7	26%	0.259	49%	0.491	S	S	.	.			trans	25.2	56.2	164.4	-163.7	0	0	0	0	114.2	H277 H322	H277-S279 PolarHBondContact O-N 3.17Å; S279-H322 PolarHBondContact O-CE1 2.99Å; S279-H322 PolarHBondContact O-NE2 3.42Å
280	E	75.6	Confident	67.9	Low	154 Å²	154	85.4 Å²	85.4	72%	0.72	46%	0.457	S	S	*	.			trans	-62.1	152.7	177.5	-168.4	166.3	-169.6	0	0	108.9	V278 S282	V278-E280 PolarHBondContact O-N 2.62Å; E280-S282 PolarHBondContact O-N 3.27Å
281	M	87.2	Confident	70.2	Confident	9 Å²	9	80.8 Å²	80.8	4%	0.044	44%	0.438	C	S	.	.			trans	-66.9	89.3	169.4	-171.3	78.1	73.4	0	0	107.2	I286 P321 F416 Y432 R435 A436 C439	M281-I286 HydrophobicContact SD-CD1 3.84Å; M281-I286 HydrophobicContact SD-CG1 4.47Å; M281-P321 HydrophobicContact SD-CB 4.29Å; M281-P321 HydrophobicContact SD-CG 4.24Å; M281-F416 HydrophobicContact CE-CD2 4.46Å; M281-F416 HydrophobicContact CE-CE2 4Å; M281-Y432 VanDerWaalsContact CE-O 3.32Å; M281-Y432 WeakPolarHBondContact CE-O 3.33Å; M281-R435 HydrophobicContact CB-CB 3.96Å; M281-R435 HydrophobicContact CE-CB 4.22Å; M281-A436 HydrophobicContact CE-CB 4.03Å; M281-C439 HydrophobicContact CB-CB 4.31Å; M281-C439 HydrophobicContact CG-CB 3.87Å; M281-C439 PolarHBondContact O-SG 3.48Å
282	S	91.4	Very high	72.2	Confident	28 Å²	28	77.2 Å²	77.2	20%	0.196	41%	0.414	C	S	.	.			trans	-100.6	139.4	-176.4	105.4	0	0	0	0	110.4	E280 E284 R285 I286	E280-S282 PolarHBondContact O-N 3.27Å; S282-E284 VanDerWaalsContact CB-OE2 3.27Å; S282-E284 WeakPolarHBondContact CB-OE2 3.45Å; S282-E284 PolarHBondContact O-N 3Å; S282-E284 PolarHBondContact OG-OE2 2.93Å; S282-R285 PolarHBondContact O-N 3.11Å; S282-R285 PolarHBondContact OG-N 2.88Å; S282-I286 WeakPolarHBondContact O-CG1 3.38Å; S282-I286 PolarHBondContact O-N 3.17Å
283	P	94.1	Very high	74.3	Confident	24 Å²	24	68.2 Å²	68.2	16%	0.156	37%	0.373	C	S	.	.	H	α-helix	trans	-60.9	-31.9	-179.5	22.5	-30.2	0	0	0	112.2	I286 L287 T405 Y443	P283-I286 PolarHBondContact O-N 2.91Å; P283-L287 WeakPolarHBondContact O-CB 3.43Å; P283-L287 PolarHBondContact O-N 2.71Å; P283-T405 HydrophobicContact CB-CG2 3.64Å; P283-Y443 HydrophobicContact CB-CD2 3.65Å; P283-Y443 HydrophobicContact CB-CE2 4.03Å; P283-Y443 HydrophobicContact CB-CG 4.43Å; P283-Y443 HydrophobicContact CG-CD2 4.05Å
284	E	93.8	Very high	75.8	Confident	125 Å²	125	64.9 Å²	64.9	58%	0.584	35%	0.348	S	S	*	.	H	α-helix	trans	-65.2	-42.5	179	-55.7	73.2	-158.1	0	0	111.9	S282 I286 L287 E288	S282-E284 VanDerWaalsContact CB-OE2 3.27Å; S282-E284 WeakPolarHBondContact CB-OE2 3.45Å; S282-E284 PolarHBondContact O-N 3Å; S282-E284 PolarHBondContact OG-OE2 2.93Å; E284-I286 VanDerWaalsContact C-N 3.32Å; E284-I286 PolarHBondContact O-N 2.97Å; E284-L287 PolarHBondContact O-N 3.29Å; E284-E288 WeakPolarHBondContact O-CB 3.34Å; E284-E288 PolarHBondContact O-N 3.38Å
285	R	93	Very high	76.8	Confident	132 Å²	132	64.9 Å²	64.9	50%	0.498	34%	0.339	S	S	.	.	H	α-helix	trans	-66.3	-37	177.5	-72.8	-69.8	-174.2	136.2	-3.4	111.8	S282 A289 P321	S282-R285 PolarHBondContact O-N 3.11Å; S282-R285 PolarHBondContact OG-N 2.88Å; R285-A289 WeakPolarHBondContact O-CB 3.45Å; R285-A289 PolarHBondContact O-N 2.94Å; R285-P321 HydrophobicContact CB-CG 3.95Å
286	I	95.6	Very high	77.8	Confident	0 Å²	0	62 Å²	62	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-66	-46.4	175.6	-60.7	-62.8	0	0	0	110.3	M281 S282 P283 E284 E288 A289 E290 L320 L409	M281-I286 HydrophobicContact SD-CD1 3.84Å; M281-I286 HydrophobicContact SD-CG1 4.47Å; S282-I286 WeakPolarHBondContact O-CG1 3.38Å; S282-I286 PolarHBondContact O-N 3.17Å; P283-I286 PolarHBondContact O-N 2.91Å; E284-I286 VanDerWaalsContact C-N 3.32Å; E284-I286 PolarHBondContact O-N 2.97Å; I286-E288 PolarHBondContact O-N 3.02Å; I286-A289 WeakPolarHBondContact O-CB 3.24Å; I286-A289 PolarHBondContact O-N 3.3Å; I286-E290 PolarHBondContact O-N 3.44Å; I286-L320 HydrophobicContact CD1-CD2 3.53Å; I286-L409 HydrophobicContact CG1-CD2 3.91Å; I286-L409 HydrophobicContact CG1-CG 4.39Å; I286-L409 HydrophobicContact CG2-CD2 4.49Å; I286-L409 HydrophobicContact CG2-CG 4.13Å
287	L	95.8	Very high	78.7	Confident	56 Å²	56	60.9 Å²	60.9	29%	0.293	30%	0.304	S	S	.	.	H	α-helix	trans	-61.8	-43.2	176.9	179	59.9	0	0	0	111.9	P283 E284 A289 E290 L291 R404	P283-L287 WeakPolarHBondContact O-CB 3.43Å; P283-L287 PolarHBondContact O-N 2.71Å; E284-L287 PolarHBondContact O-N 3.29Å; L287-A289 VanDerWaalsContact C-N 3.31Å; L287-A289 PolarHBondContact O-N 3.41Å; L287-E290 PolarHBondContact O-N 3.21Å; L287-L291 HydrophobicContact CD1-CD1 3.99Å; L287-L291 HydrophobicContact CD1-CG 4.1Å; L287-L291 HydrophobicContact CG-CD1 3.86Å; L287-L291 HydrophobicContact CG-CG 4.41Å; L287-L291 WeakPolarHBondContact O-CG 3.49Å; L287-L291 PolarHBondContact O-N 2.89Å; L287-R404 HydrophobicContact CD1-CB 3.91Å; L287-R404 HydrophobicContact CD1-CG 4.02Å
288	E	93.4	Very high	79	Confident	96 Å²	96	57.6 Å²	57.6	45%	0.449	30%	0.3	S	S	.	.	H	α-helix	trans	-58.4	-42.7	175.5	-174	-173.7	-179.1	0	0	111.6	E284 I286 T292 M319	E284-E288 WeakPolarHBondContact O-CB 3.34Å; E284-E288 PolarHBondContact O-N 3.38Å; I286-E288 PolarHBondContact O-N 3.02Å; E288-T292 VanDerWaalsContact O-CB 3.23Å; E288-T292 WeakPolarHBondContact O-CB 3.39Å; E288-T292 PolarHBondContact O-N 3.48Å; E288-T292 PolarHBondContact O-OG1 2.87Å; E288-M319 HydrophobicContact CG-CE 3.99Å
289	A	93.5	Very high	79.2	Confident	0 Å²	0	60 Å²	60	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-62.6	-45.6	176.6	0	0	0	0	0	112.2	R285 I286 L287 S293 M319 L320	R285-A289 WeakPolarHBondContact O-CB 3.45Å; R285-A289 PolarHBondContact O-N 2.94Å; I286-A289 WeakPolarHBondContact O-CB 3.24Å; I286-A289 PolarHBondContact O-N 3.3Å; L287-A289 VanDerWaalsContact C-N 3.31Å; L287-A289 PolarHBondContact O-N 3.41Å; A289-S293 PolarHBondContact O-N 3.44Å; A289-S293 VanDerWaalsContact O-N 3.17Å; A289-S293 PolarHBondContact O-OG 3.44Å; A289-M319 HydrophobicContact CB-CB 3.58Å; A289-L320 HydrophobicContact CB-CD2 4.06Å
290	E	92	Very high	78.9	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-61.6	-50.2	177	-72.2	-63.1	144.8	0	0	111.2	I286 L287 T292 S293 W316 R404 G408 R411	I286-E290 PolarHBondContact O-N 3.44Å; L287-E290 PolarHBondContact O-N 3.21Å; E290-T292 VanDerWaalsContact C-N 3.35Å; E290-T292 PolarHBondContact O-N 3.17Å; E290-S293 PolarHBondContact O-N 2.98Å; E290-S293 PolarHBondContact O-OG 2.58Å; E290-W316 PolarHBondContact OE1-NE1 3.15Å; E290-R404 HydrophobicContact CB-CG 4.02Å; E290-R404 PolarHBondContact O-NH2 3.11Å; E290-G408 VanDerWaalsContact OE1-CA 3.29Å; E290-G408 WeakPolarHBondContact OE1-CA 3.18Å; E290-R411 VanDerWaalsContact OE1-CD 3.28Å; E290-R411 WeakPolarHBondContact OE1-CD 3.49Å; E290-R411 IonicContact OE1-CZ 3.39Å; E290-R411 IonicContact OE1-NE 3.26Å; E290-R411 PolarHBondContact OE1-NE 3.47Å; E290-R411 IonicContact OE2-NE 2.66Å
291	L	89.6	Confident	77.6	Confident	77 Å²	77	56.5 Å²	56.5	40%	0.403	31%	0.305	S	S	.	.	H	α-helix	trans	-61.5	-42.8	-179.6	-69.9	168.2	0	0	0	111.9	L287 S293 D294	L287-L291 HydrophobicContact CD1-CD1 3.99Å; L287-L291 HydrophobicContact CD1-CG 4.1Å; L287-L291 HydrophobicContact CG-CD1 3.86Å; L287-L291 HydrophobicContact CG-CG 4.41Å; L287-L291 WeakPolarHBondContact O-CG 3.49Å; L287-L291 PolarHBondContact O-N 2.89Å; L291-S293 VanDerWaalsContact C-N 3.32Å; L291-S293 PolarHBondContact O-N 2.81Å; L291-D294 PolarHBondContact O-N 3.4Å
292	T	86.1	Confident	75.7	Confident	30 Å²	30	64.3 Å²	64.3	18%	0.184	34%	0.342	C	S	.	.	H	α-helix	trans	-72.9	-25.7	-175.2	-57.2	0	0	0	0	113	E288 E290 D294 H295 M319	E288-T292 VanDerWaalsContact O-CB 3.23Å; E288-T292 WeakPolarHBondContact O-CB 3.39Å; E288-T292 PolarHBondContact O-N 3.48Å; E288-T292 PolarHBondContact O-OG1 2.87Å; E290-T292 VanDerWaalsContact C-N 3.35Å; E290-T292 PolarHBondContact O-N 3.17Å; T292-D294 VanDerWaalsContact C-N 3.26Å; T292-D294 PolarHBondContact O-N 3.43Å; T292-H295 PolarHBondContact O-N 2.86Å; T292-M319 HydrophobicContact CG2-CE 3.91Å; T292-M319 HydrophobicContact CG2-SD 3.62Å
293	S	79.1	Confident	74	Confident	11 Å²	11	65.3 Å²	65.3	8%	0.077	34%	0.343	C	S	.	.	H	α-helix	trans	-72.8	-16.6	179.9	59.8	0	0	0	0	114.6	A289 E290 L291	A289-S293 PolarHBondContact O-N 3.44Å; A289-S293 VanDerWaalsContact O-N 3.17Å; A289-S293 PolarHBondContact O-OG 3.44Å; E290-S293 PolarHBondContact O-N 2.98Å; E290-S293 PolarHBondContact O-OG 2.58Å; L291-S293 VanDerWaalsContact C-N 3.32Å; L291-S293 PolarHBondContact O-N 2.81Å
294	D	69.4	Low	72.8	Confident	29 Å²	29	69.4 Å²	69.4	16%	0.155	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-25.6	177	-76.6	5.4	0	0	0	113.1	L291 T292 I296 W346 T367 R404	L291-D294 PolarHBondContact O-N 3.4Å; T292-D294 VanDerWaalsContact C-N 3.26Å; T292-D294 PolarHBondContact O-N 3.43Å; D294-I296 PolarHBondContact O-N 3.08Å; D294-W346 WeakPolarHBondContact OD1-CH2 3.42Å; D294-W346 WeakPolarHBondContact OD1-CZ2 3.28Å; D294-W346 WeakPolarHBondContact OD2-CH2 3.44Å; D294-T367 HydrophobicContact CB-CG2 4.25Å; D294-T367 WeakPolarHBondContact O-CG2 3.35Å; D294-R404 IonicContact OD1-NH2 2.91Å; D294-R404 PolarHBondContact OD1-NH2 2.91Å; D294-R404 IonicContact OD2-CZ 3.79Å; D294-R404 IonicContact OD2-NH1 2.71Å; D294-R404 PolarHBondContact OD2-NH1 3.16Å; D294-R404 VanDerWaalsContact OD2-NH1 3.13Å; D294-R404 IonicContact OD2-NH2 2.62Å; D294-R404 PolarHBondContact OD2-NH2 3.44Å
295	H	63.5	Low	71.6	Confident	127 Å²	127	64.4 Å²	64.4	59%	0.588	35%	0.345	S	S	*	.			trans	-71.1	106.2	-175.7	-63.4	-55.1	0	0	0	110.9	T292 S297	T292-H295 PolarHBondContact O-N 2.86Å; H295-S297 PolarHBondContact O-N 2.97Å
296	I	57.2	Low	70.7	Confident	68 Å²	68	60.1 Å²	60.1	35%	0.349	33%	0.334	S	S	.	.			trans	-73.4	117.1	168.8	-52.1	-178.3	0	0	0	107.5	D294 D300	D294-I296 PolarHBondContact O-N 3.08Å; I296-D300 HydrophobicContact CG2-CB 3.75Å
297	S	54.3	Low	69.7	Low	42 Å²	42	65.2 Å²	65.2	29%	0.294	36%	0.358	S	S	.	.			trans	-71.6	146.9	169.6	-63.1	0	0	0	0	108.8	H295 T299 D300	H295-S297 PolarHBondContact O-N 2.97Å; S297-T299 PolarHBondContact O-N 3.03Å; S297-D300 WeakPolarHBondContact CB-OD2 3.3Å; S297-D300 PolarHBondContact N-OD2 2.99Å; S297-D300 VanDerWaalsContact O-CB 3.25Å; S297-D300 WeakPolarHBondContact O-CB 3.46Å; S297-D300 PolarHBondContact O-N 2.86Å
298	P	46.4	Very low	68.8	Low	120 Å²	120	63.1 Å²	63.1	78%	0.779	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	-53.7	-26.2	178.4	-26.3	33.2	0	0	0	113.8	D300 C301	P298-D300 VanDerWaalsContact C-N 3.27Å; P298-D300 PolarHBondContact O-N 3.19Å; P298-C301 PolarHBondContact O-SG 2.91Å
299	T	52.6	Low	68.1	Low	96 Å²	96	59.1 Å²	59.1	59%	0.589	33%	0.327	S	S	*	.	G	3₁₀ helix	trans	-72.1	-14.2	175.4	50.1	0	0	0	0	114.8	S297	S297-T299 PolarHBondContact O-N 3.03Å
300	D	53.8	Low	67.6	Low	13 Å²	13	59.8 Å²	59.8	7%	0.07	33%	0.33	C	S	.	.	G	3₁₀ helix	trans	-85.3	-13.4	-177.9	-67.8	-32.8	0	0	0	112.4	I296 S297 P298 Q302 Q303 L308 R311	I296-D300 HydrophobicContact CG2-CB 3.75Å; S297-D300 WeakPolarHBondContact CB-OD2 3.3Å; S297-D300 PolarHBondContact N-OD2 2.99Å; S297-D300 VanDerWaalsContact O-CB 3.25Å; S297-D300 WeakPolarHBondContact O-CB 3.46Å; S297-D300 PolarHBondContact O-N 2.86Å; P298-D300 VanDerWaalsContact C-N 3.27Å; P298-D300 PolarHBondContact O-N 3.19Å; D300-Q302 PolarHBondContact O-N 3.03Å; D300-Q303 PolarHBondContact O-N 3.41Å; D300-L308 HydrophobicContact CB-CD1 3.69Å; D300-R311 IonicContact OD1-CZ 2.93Å; D300-R311 IonicContact OD1-NH1 2.78Å; D300-R311 PolarHBondContact OD1-NH1 3.44Å
301	C	47.5	Very low	67.2	Low	103 Å²	103	63 Å²	63	70%	0.696	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-15.1	-178.5	73.7	0	0	0	0	114.1	P298	P298-C301 PolarHBondContact O-SG 2.91Å
302	Q	47.3	Very low	67	Low	174 Å²	174	61 Å²	61	81%	0.813	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.6	5.4	-177.1	-62.9	-175.1	-42.8	0	0	113.6	D300	D300-Q302 PolarHBondContact O-N 3.03Å
303	Q	57.1	Low	67.1	Low	49 Å²	49	60 Å²	60	23%	0.229	32%	0.323	C	S	.	.	S	Bend	trans	-105.2	144.4	-172.3	-80	153.1	25.3	0	0	113	D300 G305 R311	D300-Q303 PolarHBondContact O-N 3.41Å; Q303-G305 PolarHBondContact O-N 3.23Å; Q303-R311 VanDerWaalsContact CD-CZ 3.46Å; Q303-R311 VanDerWaalsContact NE2-CZ 3.31Å
304	N	67.5	Low	67.6	Low	110 Å²	110	59.6 Å²	59.6	59%	0.588	32%	0.32	S	S	*	.			trans	-52.9	137.1	167.4	-176.8	-10.1	0	0	0	108.8	V306 E307 L308	N304-V306 PolarHBondContact O-N 2.57Å; N304-V306 PolarHBondContact OD1-N 2.68Å; N304-E307 PolarHBondContact O-N 3.2Å; N304-L308 PolarHBondContact O-N 3.34Å; N304-L308 VanDerWaalsContact O-N 3.14Å
305	G	69	Low	68.6	Low	19 Å²	19	61.3 Å²	61.3	20%	0.196	33%	0.325	C	S	.	.	H	α-helix	trans	-47.5	-41	-179.8	0	0	0	0	0	112.1	Q303 E307 L308 Y309 L370	Q303-G305 PolarHBondContact O-N 3.23Å; G305-E307 PolarHBondContact O-N 2.84Å; G305-L308 PolarHBondContact O-N 3.05Å; G305-Y309 PolarHBondContact O-N 3.15Å; G305-L370 VanDerWaalsContact O-CD1 3.22Å; G305-L370 WeakPolarHBondContact O-CD1 3.06Å; G305-L370 WeakPolarHBondContact O-CD2 3.28Å; G305-L370 VanDerWaalsContact O-CG 3.23Å; G305-L370 WeakPolarHBondContact O-CG 3.42Å
306	V	73.5	Confident	70	Confident	42 Å²	42	55.3 Å²	55.3	26%	0.255	30%	0.297	S	S	.	.	H	α-helix	trans	-55.3	-46.3	177.6	180	0	0	0	0	112.8	N304 Y309 Q310 P481	N304-V306 PolarHBondContact O-N 2.57Å; N304-V306 PolarHBondContact OD1-N 2.68Å; V306-Y309 VanDerWaalsContact CA-CD1 3.46Å; V306-Y309 VanDerWaalsContact CA-CE1 3.49Å; V306-Y309 HydrophobicContact CB-CD1 4.5Å; V306-Y309 HydrophobicContact CB-CE1 4.06Å; V306-Y309 HydrophobicContact CG1-CE1 3.69Å; V306-Y309 WeakPolarHBondContact O-CD1 3.44Å; V306-Y309 WeakPolarHBondContact O-CE1 3.35Å; V306-Q310 WeakPolarHBondContact O-CG 3.37Å; V306-Q310 PolarHBondContact O-N 2.71Å; V306-P481 HydrophobicContact CG1-CG 4.17Å; V306-P481 HydrophobicContact CG2-CG 4.15Å
307	E	75.1	Confident	71.9	Confident	108 Å²	108	52.1 Å²	52.1	51%	0.505	28%	0.28	S	S	.	.	H	α-helix	trans	-72.2	-36	-179.6	-65.1	-171.6	169.8	0	0	112	N304 G305 Y309 Q310 R311	N304-E307 PolarHBondContact O-N 3.2Å; G305-E307 PolarHBondContact O-N 2.84Å; E307-Y309 PolarHBondContact O-N 3.06Å; E307-Q310 PolarHBondContact O-N 3Å; E307-R311 WeakPolarHBondContact O-CB 3.41Å; E307-R311 PolarHBondContact O-N 3.25Å
308	L	76.9	Confident	73.7	Confident	11 Å²	11	52.7 Å²	52.7	6%	0.058	28%	0.276	C	S	.	.	H	α-helix	trans	-61.5	-44.1	179	179	59.5	0	0	0	111.2	D300 N304 G305 R311 R312 L370	D300-L308 HydrophobicContact CB-CD1 3.69Å; N304-L308 PolarHBondContact O-N 3.34Å; N304-L308 VanDerWaalsContact O-N 3.14Å; G305-L308 PolarHBondContact O-N 3.05Å; L308-R311 PolarHBondContact O-N 3.38Å; L308-R312 WeakPolarHBondContact O-CG 3.41Å; L308-R312 PolarHBondContact O-N 3.41Å; L308-L370 HydrophobicContact CB-CD1 3.85Å; L308-L370 HydrophobicContact CD2-CD1 3.99Å; L308-L370 HydrophobicContact CG-CD1 3.82Å
309	Y	79.2	Confident	75.9	Confident	13 Å²	13	49.6 Å²	49.6	5%	0.051	25%	0.252	C	S	.	.	H	α-helix	trans	-68.9	-40.9	-179.6	85.3	-102.1	0	0	0	110.6	G305 V306 E307 R311 R312 L313 I343 L370 P480 P481	G305-Y309 PolarHBondContact O-N 3.15Å; V306-Y309 VanDerWaalsContact CA-CD1 3.46Å; V306-Y309 VanDerWaalsContact CA-CE1 3.49Å; V306-Y309 HydrophobicContact CB-CD1 4.5Å; V306-Y309 HydrophobicContact CB-CE1 4.06Å; V306-Y309 HydrophobicContact CG1-CE1 3.69Å; V306-Y309 WeakPolarHBondContact O-CD1 3.44Å; V306-Y309 WeakPolarHBondContact O-CE1 3.35Å; E307-Y309 PolarHBondContact O-N 3.06Å; Y309-R311 PolarHBondContact O-N 3.05Å; Y309-R312 PolarHBondContact O-N 3.23Å; Y309-L313 VanDerWaalsContact O-CB 3.31Å; Y309-L313 WeakPolarHBondContact O-CB 3.3Å; Y309-L313 PolarHBondContact O-N 3.43Å; Y309-I343 HydrophobicContact CD2-CD1 3.97Å; Y309-I343 HydrophobicContact CE2-CD1 4.3Å; Y309-L370 HydrophobicContact CD1-CD2 3.76Å; Y309-L370 HydrophobicContact CG-CD2 4.17Å; Y309-P480 HydrophobicContact CD1-CB 3.55Å; Y309-P480 HydrophobicContact CD1-CG 3.79Å; Y309-P480 HydrophobicContact CE1-CB 3.21Å; Y309-P480 HydrophobicContact CE1-CG 4Å; Y309-P480 HydrophobicContact CG-CB 4.44Å; Y309-P480 HydrophobicContact CG-CG 4.41Å; Y309-P481 PolarHBondContact OH-O 3.19Å
310	Q	83.1	Confident	77.9	Confident	13 Å²	13	45.2 Å²	45.2	6%	0.061	23%	0.225	C	C	.	.	H	α-helix	trans	-59.5	-42.2	179	-72.4	-179.2	9.3	0	0	110.2	V306 E307 A314 P483 S487	V306-Q310 WeakPolarHBondContact O-CG 3.37Å; V306-Q310 PolarHBondContact O-N 2.71Å; E307-Q310 PolarHBondContact O-N 3Å; Q310-A314 VanDerWaalsContact O-CB 3.24Å; Q310-A314 WeakPolarHBondContact O-CB 3.18Å; Q310-A314 PolarHBondContact O-N 2.71Å; Q310-P483 HydrophobicContact CG-CB 4.13Å; Q310-S487 PolarHBondContact OE1-OG 3.21Å
311	R	83.3	Confident	79.7	Confident	67 Å²	67	44.9 Å²	44.9	25%	0.253	22%	0.224	S	C	.	.	H	α-helix	trans	-64	-45.8	175.9	-176.3	176.2	-60.9	159.1	12.1	112.5	D300 Q303 E307 L308 Y309 A314 R315	D300-R311 IonicContact OD1-CZ 2.93Å; D300-R311 IonicContact OD1-NH1 2.78Å; D300-R311 PolarHBondContact OD1-NH1 3.44Å; Q303-R311 VanDerWaalsContact CD-CZ 3.46Å; Q303-R311 VanDerWaalsContact NE2-CZ 3.31Å; E307-R311 WeakPolarHBondContact O-CB 3.41Å; E307-R311 PolarHBondContact O-N 3.25Å; L308-R311 PolarHBondContact O-N 3.38Å; Y309-R311 PolarHBondContact O-N 3.05Å; R311-A314 PolarHBondContact O-N 2.97Å; R311-R315 VanDerWaalsContact O-CB 3.24Å; R311-R315 WeakPolarHBondContact O-CB 3.36Å; R311-R315 PolarHBondContact O-N 2.89Å
312	R	84.3	Confident	81.8	Confident	35 Å²	35	40.6 Å²	40.6	13%	0.132	19%	0.193	C	C	.	.	H	α-helix	trans	-63.1	-44.8	178.7	-72.5	-170.2	-170.3	178.9	12.9	111.8	L308 Y309 A314 R315 W316 T367	L308-R312 WeakPolarHBondContact O-CG 3.41Å; L308-R312 PolarHBondContact O-N 3.41Å; Y309-R312 PolarHBondContact O-N 3.23Å; R312-A314 PolarHBondContact O-N 3.1Å; R312-R315 PolarHBondContact O-N 3.4Å; R312-R315 VanDerWaalsContact O-N 3.16Å; R312-W316 WeakPolarHBondContact O-CB 3.46Å; R312-W316 PolarHBondContact O-N 3.43Å; R312-T367 VanDerWaalsContact CZ-O 3.23Å; R312-T367 PolarHBondContact NH1-O 3.18Å; R312-T367 PolarHBondContact NH2-O 3.32Å
313	L	88.4	Confident	84.1	Confident	11 Å²	11	32.3 Å²	32.3	6%	0.058	15%	0.154	C	C	.	.	H	α-helix	trans	-61.4	-46.4	177.6	-167.2	70.4	0	0	0	111.3	Y309 R315 W316 A317 L335 L342	Y309-L313 VanDerWaalsContact O-CB 3.31Å; Y309-L313 WeakPolarHBondContact O-CB 3.3Å; Y309-L313 PolarHBondContact O-N 3.43Å; L313-R315 VanDerWaalsContact C-N 3.32Å; L313-R315 PolarHBondContact O-N 3.19Å; L313-W316 HydrophobicContact CD1-CE3 4.23Å; L313-A317 WeakPolarHBondContact O-CB 3.47Å; L313-A317 PolarHBondContact O-N 2.98Å; L313-L335 HydrophobicContact CD2-CD2 3.9Å; L313-L335 HydrophobicContact CG-CD2 3.76Å; L313-L342 HydrophobicContact CD1-CB 3.89Å; L313-L342 HydrophobicContact CD1-CD1 3.91Å; L313-L342 HydrophobicContact CD1-CG 4.49Å
314	A	91	Very high	85.8	Confident	1 Å²	1	34.7 Å²	34.7	1%	0.008	17%	0.168	C	C	.	.	H	α-helix	trans	-67	-31.1	175.4	0	0	0	0	0	112.6	Q310 R311 R312 R318 T491 L492	Q310-A314 VanDerWaalsContact O-CB 3.24Å; Q310-A314 WeakPolarHBondContact O-CB 3.18Å; Q310-A314 PolarHBondContact O-N 2.71Å; R311-A314 PolarHBondContact O-N 2.97Å; R312-A314 PolarHBondContact O-N 3.1Å; A314-R318 WeakPolarHBondContact O-CB 3.32Å; A314-R318 WeakPolarHBondContact O-CG 3.29Å; A314-R318 PolarHBondContact O-N 2.99Å; A314-R318 PolarHBondContact O-NE 3.37Å; A314-R318 VanDerWaalsContact O-NE 3.11Å; A314-T491 HydrophobicContact CB-CG2 3.67Å; A314-L492 HydrophobicContact CB-CD2 4.1Å
315	R	90.2	Very high	86.9	Confident	66 Å²	66	31.4 Å²	31.4	25%	0.249	15%	0.151	C	C	.	.	H	α-helix	trans	-68.5	-51	174.9	-179.5	-179.8	178.7	115.6	2.8	111.4	R311 R312 L313 R318 M319	R311-R315 VanDerWaalsContact O-CB 3.24Å; R311-R315 WeakPolarHBondContact O-CB 3.36Å; R311-R315 PolarHBondContact O-N 2.89Å; R312-R315 PolarHBondContact O-N 3.4Å; R312-R315 VanDerWaalsContact O-N 3.16Å; L313-R315 VanDerWaalsContact C-N 3.32Å; L313-R315 PolarHBondContact O-N 3.19Å; R315-R318 VanDerWaalsContact CA-NH2 3.35Å; R315-R318 PolarHBondContact O-N 3.43Å; R315-M319 WeakPolarHBondContact O-CG 3.29Å; R315-M319 PolarHBondContact O-N 2.91Å
316	W	93.4	Very high	88	Confident	1 Å²	1	30.9 Å²	30.9	0%	0.004	14%	0.143	C	C	.	.	H	α-helix	trans	-53.3	-53.9	174.2	169.7	78.5	0	0	0	111.3	E290 R312 L313 R318 M319 L320 L342 R411 L415	E290-W316 PolarHBondContact OE1-NE1 3.15Å; R312-W316 WeakPolarHBondContact O-CB 3.46Å; R312-W316 PolarHBondContact O-N 3.43Å; L313-W316 HydrophobicContact CD1-CE3 4.23Å; W316-R318 VanDerWaalsContact C-N 3.32Å; W316-R318 PolarHBondContact O-N 2.99Å; W316-M319 WeakPolarHBondContact O-CB 3.24Å; W316-M319 PolarHBondContact O-N 3.4Å; W316-L320 HydrophobicContact CD2-CD1 4.44Å; W316-L320 HydrophobicContact CE3-CD1 4.44Å; W316-L320 HydrophobicContact CH2-CD1 3.73Å; W316-L320 HydrophobicContact CZ2-CD1 3.73Å; W316-L320 HydrophobicContact CZ2-CD2 4.23Å; W316-L320 HydrophobicContact CZ2-CG 4.43Å; W316-L320 HydrophobicContact CZ3-CD1 4.1Å; W316-L342 HydrophobicContact CH2-CD2 3.66Å; W316-L342 HydrophobicContact CZ3-CD1 4.07Å; W316-L342 HydrophobicContact CZ3-CD2 3.85Å; W316-R411 HydrophobicContact CH2-CB 3.8Å; W316-R411 HydrophobicContact CZ2-CB 3.52Å; W316-L415 HydrophobicContact CH2-CB 4.13Å; W316-L415 HydrophobicContact CH2-CD2 4.01Å; W316-L415 HydrophobicContact CZ3-CB 4.34Å; W316-L415 HydrophobicContact CZ3-CD1 4.43Å; W316-L415 HydrophobicContact CZ3-CD2 3.79Å; W316-L415 HydrophobicContact CZ3-CG 4.42Å
317	A	95.4	Very high	88.9	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-61.2	-37.9	-175.8	0	0	0	0	0	113.1	L313 M319 L320 F323 L335 L415	L313-A317 WeakPolarHBondContact O-CB 3.47Å; L313-A317 PolarHBondContact O-N 2.98Å; A317-M319 PolarHBondContact O-N 3.19Å; A317-L320 WeakPolarHBondContact O-CB 3.01Å; A317-L320 PolarHBondContact O-N 2.97Å; A317-L320 VanDerWaalsContact O-N 3.15Å; A317-F323 VanDerWaalsContact C-CD1 3.5Å; A317-F323 HydrophobicContact CB-CD1 4.04Å; A317-F323 HydrophobicContact CB-CD2 4.29Å; A317-F323 HydrophobicContact CB-CE1 3.72Å; A317-F323 HydrophobicContact CB-CE2 4Å; A317-F323 HydrophobicContact CB-CG 4.3Å; A317-F323 HydrophobicContact CB-CZ 3.7Å; A317-F323 WeakPolarHBondContact O-CB 2.89Å; A317-F323 WeakPolarHBondContact O-CD1 3.18Å; A317-F323 WeakPolarHBondContact O-CG 2.84Å; A317-L335 HydrophobicContact CB-CD2 3.83Å; A317-L415 HydrophobicContact CB-CD2 4.14Å
318	R	92.9	Very high	89.8	Confident	54 Å²	54	26.6 Å²	26.6	20%	0.204	13%	0.125	C	C	.	.	H	α-helix	trans	-66.8	-19.2	177.1	-72	-178.2	-59.6	111.1	6	114.1	A314 R315 W316 F323 L324 L492	A314-R318 WeakPolarHBondContact O-CB 3.32Å; A314-R318 WeakPolarHBondContact O-CG 3.29Å; A314-R318 PolarHBondContact O-N 2.99Å; A314-R318 PolarHBondContact O-NE 3.37Å; A314-R318 VanDerWaalsContact O-NE 3.11Å; R315-R318 VanDerWaalsContact CA-NH2 3.35Å; R315-R318 PolarHBondContact O-N 3.43Å; W316-R318 VanDerWaalsContact C-N 3.32Å; W316-R318 PolarHBondContact O-N 2.99Å; R318-F323 HydrophobicContact CG-CE1 4.45Å; R318-L324 HydrophobicContact CB-CD2 4.09Å; R318-L324 HydrophobicContact CG-CD2 3.77Å; R318-L492 HydrophobicContact CG-CD2 3.89Å
319	M	92.2	Very high	90.7	Very high	55 Å²	55	29.4 Å²	29.4	27%	0.271	14%	0.138	S	C	.	.	H	α-helix	trans	-84.5	-17.5	176.1	-66.1	-174.9	65.5	0	0	112.6	E288 A289 T292 R315 W316 A317	E288-M319 HydrophobicContact CG-CE 3.99Å; A289-M319 HydrophobicContact CB-CB 3.58Å; T292-M319 HydrophobicContact CG2-CE 3.91Å; T292-M319 HydrophobicContact CG2-SD 3.62Å; R315-M319 WeakPolarHBondContact O-CG 3.29Å; R315-M319 PolarHBondContact O-N 2.91Å; W316-M319 WeakPolarHBondContact O-CB 3.24Å; W316-M319 PolarHBondContact O-N 3.4Å; A317-M319 PolarHBondContact O-N 3.19Å
320	L	94.7	Very high	91.5	Very high	5 Å²	5	28.8 Å²	28.8	3%	0.026	14%	0.135	C	C	.	.	S	Bend	trans	-68.3	140.2	179.1	-60.9	177	0	0	0	111.1	I286 A289 W316 A317 H322 F323 L415	I286-L320 HydrophobicContact CD1-CD2 3.53Å; A289-L320 HydrophobicContact CB-CD2 4.06Å; W316-L320 HydrophobicContact CD2-CD1 4.44Å; W316-L320 HydrophobicContact CE3-CD1 4.44Å; W316-L320 HydrophobicContact CH2-CD1 3.73Å; W316-L320 HydrophobicContact CZ2-CD1 3.73Å; W316-L320 HydrophobicContact CZ2-CD2 4.23Å; W316-L320 HydrophobicContact CZ2-CG 4.43Å; W316-L320 HydrophobicContact CZ3-CD1 4.1Å; A317-L320 WeakPolarHBondContact O-CB 3.01Å; A317-L320 PolarHBondContact O-N 2.97Å; A317-L320 VanDerWaalsContact O-N 3.15Å; L320-H322 PolarHBondContact O-N 3.42Å; L320-F323 HydrophobicContact CB-CB 4.25Å; L320-F323 PolarHBondContact O-N 2.83Å; L320-L415 HydrophobicContact CD1-CD2 3.44Å; L320-L415 VanDerWaalsContact CD1-CD2 3.44Å
321	P	92.4	Very high	92.1	Very high	6 Å²	6	28.6 Å²	28.6	4%	0.039	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.1	139	170.1	-25.8	35.2	0	0	0	111	M281 R285 F323	M281-P321 HydrophobicContact SD-CB 4.29Å; M281-P321 HydrophobicContact SD-CG 4.24Å; R285-P321 HydrophobicContact CB-CG 3.95Å; P321-F323 PolarHBondContact O-N 3.25Å
322	H	91.5	Very high	92.8	Very high	12 Å²	12	25.4 Å²	25.4	6%	0.056	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	66.4	-13	176	-49.5	-55	0	0	0	118.4	S279 L320 L324 D325 Y432 R435	S279-H322 PolarHBondContact O-CE1 2.99Å; S279-H322 PolarHBondContact O-NE2 3.42Å; L320-H322 PolarHBondContact O-N 3.42Å; H322-L324 VanDerWaalsContact C-N 3.25Å; H322-L324 PolarHBondContact O-N 3.13Å; H322-D325 IonicContact ND1-OD2 2.74Å; H322-D325 PolarHBondContact ND1-OD2 3.5Å; H322-D325 WeakPolarHBondContact O-CB 3.16Å; H322-D325 PolarHBondContact O-N 2.87Å; H322-Y432 HydrophobicContact CB-CD1 3.64Å; H322-Y432 HydrophobicContact CB-CD2 3.97Å; H322-Y432 HydrophobicContact CB-CE1 3.45Å; H322-Y432 VanDerWaalsContact CB-CE1 3.45Å; H322-Y432 HydrophobicContact CB-CE2 3.79Å; H322-Y432 HydrophobicContact CB-CG 3.89Å; H322-Y432 AromaticContact CD2-CD1 3.76Å; H322-Y432 AromaticContact CD2-CE1 3.96Å; H322-Y432 AromaticContact CG-CD1 3.72Å; H322-Y432 AromaticContact CG-CE1 3.52Å; H322-Y432 AromaticContact ND1-CE1 3.97Å; H322-R435 PolarHBondContact CE1-NH1 3.48Å; H322-R435 PolarHBondContact NE2-NH1 3.31Å
323	F	94.8	Very high	93.4	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.125	C	C	.	.	G	3₁₀ helix	trans	-58.5	-40.4	-179.1	-177	-99.6	0	0	0	112.3	A317 R318 L320 P321 D325 L326 Q331 L335 L415 F416 L492	A317-F323 VanDerWaalsContact C-CD1 3.5Å; A317-F323 HydrophobicContact CB-CD1 4.04Å; A317-F323 HydrophobicContact CB-CD2 4.29Å; A317-F323 HydrophobicContact CB-CE1 3.72Å; A317-F323 HydrophobicContact CB-CE2 4Å; A317-F323 HydrophobicContact CB-CG 4.3Å; A317-F323 HydrophobicContact CB-CZ 3.7Å; A317-F323 WeakPolarHBondContact O-CB 2.89Å; A317-F323 WeakPolarHBondContact O-CD1 3.18Å; A317-F323 WeakPolarHBondContact O-CG 2.84Å; R318-F323 HydrophobicContact CG-CE1 4.45Å; L320-F323 HydrophobicContact CB-CB 4.25Å; L320-F323 PolarHBondContact O-N 2.83Å; P321-F323 PolarHBondContact O-N 3.25Å; F323-D325 PolarHBondContact O-N 2.91Å; F323-L326 PolarHBondContact O-N 2.99Å; F323-Q331 HydrophobicContact CD1-CG 4.23Å; F323-Q331 HydrophobicContact CE1-CB 3.85Å; F323-Q331 HydrophobicContact CE1-CG 3.76Å; F323-Q331 HydrophobicContact CE2-CB 4.17Å; F323-Q331 HydrophobicContact CE2-CG 4.24Å; F323-Q331 HydrophobicContact CZ-CB 3.5Å; F323-Q331 HydrophobicContact CZ-CG 3.77Å; F323-Q331 PolarHBondContact O-NE2 2.93Å; F323-L335 HydrophobicContact CZ-CD1 4.02Å; F323-L335 HydrophobicContact CZ-CG 4.07Å; F323-L415 HydrophobicContact CD2-CD2 3.77Å; F323-L415 HydrophobicContact CE2-CD1 4.25Å; F323-L415 HydrophobicContact CE2-CD2 3.89Å; F323-L415 HydrophobicContact CE2-CG 4.35Å; F323-F416 HydrophobicContact CB-CE1 4.43Å; F323-F416 HydrophobicContact CB-CZ 4.26Å; F323-F416 HydrophobicContact CD2-CE1 4.12Å; F323-F416 HydrophobicContact CD2-CZ 4.5Å; F323-L492 HydrophobicContact CE1-CD2 3.93Å; F323-L492 HydrophobicContact CZ-CD2 4.48Å
324	L	93.1	Very high	93.8	Very high	99 Å²	99	25 Å²	25	52%	0.518	12%	0.123	S	C	.	.	G	3₁₀ helix	trans	-72.7	-10.7	177.4	-65	179.6	0	0	0	114.3	R318 H322 L326	R318-L324 HydrophobicContact CB-CD2 4.09Å; R318-L324 HydrophobicContact CG-CD2 3.77Å; H322-L324 VanDerWaalsContact C-N 3.25Å; H322-L324 PolarHBondContact O-N 3.13Å; L324-L326 VanDerWaalsContact C-N 3.27Å
325	D	91.2	Very high	94.1	Very high	42 Å²	42	24.9 Å²	24.9	23%	0.225	12%	0.122	C	C	.	.	G	3₁₀ helix	trans	-79.2	-15.3	175.6	-62.6	-29.6	0	0	0	111.5	R224 H322 F323 Y432	R224-D325 IonicContact CZ-OD1 2.7Å; R224-D325 IonicContact NH1-OD1 3.76Å; R224-D325 PolarHBondContact NH1-OD1 3.17Å; R224-D325 IonicContact NH1-OD2 3.77Å; H322-D325 IonicContact ND1-OD2 2.74Å; H322-D325 PolarHBondContact ND1-OD2 3.5Å; H322-D325 WeakPolarHBondContact O-CB 3.16Å; H322-D325 PolarHBondContact O-N 2.87Å; F323-D325 PolarHBondContact O-N 2.91Å; D325-Y432 WeakPolarHBondContact CB-OH 3.49Å
326	L	92.4	Very high	94.4	Very high	8 Å²	8	26 Å²	26	4%	0.042	13%	0.129	C	C	.	.	S	Bend	trans	-82.2	151.8	177	-62.7	171.9	0	0	0	111.7	F323 L324 D330 Q331 L334 F416 C425 M428 V429 Y432	F323-L326 PolarHBondContact O-N 2.99Å; L324-L326 VanDerWaalsContact C-N 3.27Å; L326-D330 HydrophobicContact CB-CB 4.47Å; L326-Q331 HydrophobicContact CB-CG 4.03Å; L326-Q331 PolarHBondContact O-NE2 3.39Å; L326-L334 HydrophobicContact CD1-CD1 3.53Å; L326-F416 HydrophobicContact CD1-CE1 4.26Å; L326-C425 HydrophobicContact CD2-CB 4.13Å; L326-M428 HydrophobicContact CD2-CB 4.15Å; L326-V429 HydrophobicContact CD1-CG2 3.97Å; L326-V429 HydrophobicContact CD2-CG2 3.85Å; L326-Y432 HydrophobicContact CD1-CD2 4.42Å; L326-Y432 HydrophobicContact CD1-CE2 4.42Å; L326-Y432 HydrophobicContact CD2-CD2 4.27Å; L326-Y432 HydrophobicContact CD2-CE2 3.72Å; L326-Y432 HydrophobicContact CG-CD2 4.41Å; L326-Y432 HydrophobicContact CG-CE2 3.93Å
327	P	92.4	Very high	94.5	Very high	27 Å²	27	28.4 Å²	28.4	18%	0.175	14%	0.142	C	C	.	.			trans	-56.7	145.4	169.4	-22.5	32.8	0	0	0	111.9	M246 E329 D330 Q331	M246-P327 HydrophobicContact SD-CG 4.34Å; P327-E329 PolarHBondContact O-N 3.39Å; P327-E329 VanDerWaalsContact O-N 3.17Å; P327-D330 HydrophobicContact CB-CB 4.43Å; P327-D330 WeakPolarHBondContact O-CA 3.22Å; P327-D330 WeakPolarHBondContact O-CB 3.23Å; P327-D330 PolarHBondContact O-N 3.05Å; P327-Q331 WeakPolarHBondContact O-CG 3.39Å; P327-Q331 PolarHBondContact O-N 3.26Å
328	V	94.1	Very high	94.5	Very high	32 Å²	32	28.4 Å²	28.4	19%	0.194	14%	0.142	C	C	.	.	H	α-helix	trans	-60.6	-30.4	-178.1	-179.3	0	0	0	0	112.1	Q331 A332 M489 L492	V328-Q331 PolarHBondContact O-N 3.35Å; V328-A332 WeakPolarHBondContact O-CB 3.49Å; V328-A332 PolarHBondContact O-N 3.49Å; V328-M489 HydrophobicContact CG1-CB 4.23Å; V328-M489 HydrophobicContact CG1-CG 4.15Å; V328-L492 HydrophobicContact CG1-CB 4.12Å; V328-L492 HydrophobicContact CG1-CD1 4.24Å
329	E	94.5	Very high	94.6	Very high	70 Å²	70	26.2 Å²	26.2	33%	0.327	13%	0.134	S	C	.	.	H	α-helix	trans	-65	-43.5	173.1	-59.8	77.4	-152.9	0	0	111.9	P327 A332 L333 K424 M489	P327-E329 PolarHBondContact O-N 3.39Å; P327-E329 VanDerWaalsContact O-N 3.17Å; E329-A332 PolarHBondContact O-N 3.19Å; E329-L333 WeakPolarHBondContact O-CB 3.49Å; E329-L333 VanDerWaalsContact O-CG 3.28Å; E329-L333 WeakPolarHBondContact O-CG 3.26Å; E329-L333 PolarHBondContact O-N 3.49Å; E329-K424 VanDerWaalsContact CD-NZ 3.35Å; E329-K424 IonicContact OE2-NZ 2.71Å; E329-K424 PolarHBondContact OE2-NZ 2.87Å; E329-M489 HydrophobicContact CG-CE 3.73Å; E329-M489 HydrophobicContact CG-SD 4.23Å; E329-M489 WeakPolarHBondContact OE1-CE 3.33Å
330	D	96.1	Very high	94.6	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-66.6	-42.4	177.3	-75.1	13.1	0	0	0	110	L326 P327 A332 L333 L334 L423 K424 C425	L326-D330 HydrophobicContact CB-CB 4.47Å; P327-D330 HydrophobicContact CB-CB 4.43Å; P327-D330 WeakPolarHBondContact O-CA 3.22Å; P327-D330 WeakPolarHBondContact O-CB 3.23Å; P327-D330 PolarHBondContact O-N 3.05Å; D330-A332 VanDerWaalsContact C-N 3.32Å; D330-A332 PolarHBondContact O-N 3.4Å; D330-L333 PolarHBondContact O-N 2.92Å; D330-L334 VanDerWaalsContact O-CG 3.27Å; D330-L334 WeakPolarHBondContact O-CG 3.48Å; D330-L334 PolarHBondContact O-N 3.44Å; D330-L423 HydrophobicContact CB-CD2 3.79Å; D330-K424 PolarHBondContact OD1-N 2.87Å; D330-K424 PolarHBondContact OD2-N 3.5Å; D330-C425 WeakPolarHBondContact OD2-CB 3.47Å; D330-C425 PolarHBondContact OD2-N 3.39Å
331	Q	96.9	Very high	94.6	Very high	9 Å²	9	24.2 Å²	24.2	4%	0.042	12%	0.123	C	C	.	.	H	α-helix	trans	-54.5	-47.3	173.6	-67.9	176.2	27.1	0	0	111.8	F323 L326 P327 V328 L335 L492	F323-Q331 HydrophobicContact CD1-CG 4.23Å; F323-Q331 HydrophobicContact CE1-CB 3.85Å; F323-Q331 HydrophobicContact CE1-CG 3.76Å; F323-Q331 HydrophobicContact CE2-CB 4.17Å; F323-Q331 HydrophobicContact CE2-CG 4.24Å; F323-Q331 HydrophobicContact CZ-CB 3.5Å; F323-Q331 HydrophobicContact CZ-CG 3.77Å; F323-Q331 PolarHBondContact O-NE2 2.93Å; L326-Q331 HydrophobicContact CB-CG 4.03Å; L326-Q331 PolarHBondContact O-NE2 3.39Å; P327-Q331 WeakPolarHBondContact O-CG 3.39Å; P327-Q331 PolarHBondContact O-N 3.26Å; V328-Q331 PolarHBondContact O-N 3.35Å; Q331-L335 WeakPolarHBondContact O-CB 3.49Å; Q331-L335 WeakPolarHBondContact O-CG 3.39Å; Q331-L335 PolarHBondContact O-N 3.42Å; Q331-L335 VanDerWaalsContact O-N 3.1Å; Q331-L492 HydrophobicContact CB-CD1 3.68Å
332	A	96.5	Very high	94.7	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-68.6	-36.6	178.8	0	0	0	0	0	112.6	V328 E329 D330 K336 V485 L488 M489 L492	V328-A332 WeakPolarHBondContact O-CB 3.49Å; V328-A332 PolarHBondContact O-N 3.49Å; E329-A332 PolarHBondContact O-N 3.19Å; D330-A332 VanDerWaalsContact C-N 3.32Å; D330-A332 PolarHBondContact O-N 3.4Å; A332-K336 VanDerWaalsContact O-CB 3.29Å; A332-K336 WeakPolarHBondContact O-CB 3.28Å; A332-K336 PolarHBondContact O-N 3.07Å; A332-V485 HydrophobicContact CB-CG1 3.82Å; A332-L488 HydrophobicContact CB-CB 3.86Å; A332-L488 WeakPolarHBondContact O-CD1 3.48Å; A332-M489 HydrophobicContact CB-CG 3.52Å; A332-L492 HydrophobicContact CB-CD1 4.25Å
333	L	97.2	Very high	94.6	Very high	36 Å²	36	24.1 Å²	24.1	19%	0.188	12%	0.123	C	C	.	.	H	α-helix	trans	-65.1	-44.6	174.8	-74.5	173.3	0	0	0	112	E329 D330 K336 N337 T420 L423 V485	E329-L333 WeakPolarHBondContact O-CB 3.49Å; E329-L333 VanDerWaalsContact O-CG 3.28Å; E329-L333 WeakPolarHBondContact O-CG 3.26Å; E329-L333 PolarHBondContact O-N 3.49Å; D330-L333 PolarHBondContact O-N 2.92Å; L333-K336 PolarHBondContact O-N 3.09Å; L333-N337 WeakPolarHBondContact O-CB 3.38Å; L333-N337 PolarHBondContact O-N 3.34Å; L333-T420 HydrophobicContact CB-CG2 4.11Å; L333-L423 HydrophobicContact CB-CD2 4.34Å; L333-V485 HydrophobicContact CD2-CG2 4.18Å
334	L	97.9	Very high	94.4	Very high	1 Å²	1	24.1 Å²	24.1	1%	0.005	12%	0.123	C	C	.	.	H	α-helix	trans	-60.8	-47	177.2	-68.5	174.7	0	0	0	111.4	L326 D330 N337 G338 L415 F416 N417 L423 V429	L326-L334 HydrophobicContact CD1-CD1 3.53Å; D330-L334 VanDerWaalsContact O-CG 3.27Å; D330-L334 WeakPolarHBondContact O-CG 3.48Å; D330-L334 PolarHBondContact O-N 3.44Å; L334-N337 PolarHBondContact O-N 2.74Å; L334-G338 PolarHBondContact O-N 3.13Å; L334-L415 HydrophobicContact CB-CD1 4.14Å; L334-L415 WeakPolarHBondContact CD2-O 3.4Å; L334-F416 HydrophobicContact CD1-CD1 4.42Å; L334-N417 WeakPolarHBondContact CD2-O 3.42Å; L334-L423 HydrophobicContact CD2-CD1 4.04Å; L334-L423 HydrophobicContact CD2-CD2 3.94Å; L334-L423 HydrophobicContact CG-CD2 4.04Å; L334-V429 HydrophobicContact CD1-CG1 4.36Å; L334-V429 HydrophobicContact CD1-CG2 4.09Å; L334-V429 HydrophobicContact CD2-CG1 3.91Å; L334-V429 HydrophobicContact CD2-CG2 4.48Å
335	L	96.9	Very high	94.4	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-60.5	-47	175.5	-75.9	175.2	0	0	0	111.9	L313 A317 F323 Q331 N337 W339 L415 L488 L492	L313-L335 HydrophobicContact CD2-CD2 3.9Å; L313-L335 HydrophobicContact CG-CD2 3.76Å; A317-L335 HydrophobicContact CB-CD2 3.83Å; F323-L335 HydrophobicContact CZ-CD1 4.02Å; F323-L335 HydrophobicContact CZ-CG 4.07Å; Q331-L335 WeakPolarHBondContact O-CB 3.49Å; Q331-L335 WeakPolarHBondContact O-CG 3.39Å; Q331-L335 PolarHBondContact O-N 3.42Å; Q331-L335 VanDerWaalsContact O-N 3.1Å; L335-N337 VanDerWaalsContact C-N 3.29Å; L335-N337 PolarHBondContact O-N 3.31Å; L335-W339 WeakPolarHBondContact O-CA 3.39Å; L335-W339 VanDerWaalsContact O-CB 3.29Å; L335-W339 WeakPolarHBondContact O-CB 3.4Å; L335-W339 PolarHBondContact O-N 3.47Å; L335-L415 HydrophobicContact CD2-CD1 3.79Å; L335-L415 HydrophobicContact CG-CD1 4.26Å; L335-L488 HydrophobicContact CB-CD1 3.89Å; L335-L488 HydrophobicContact CB-CD2 4.3Å; L335-L488 HydrophobicContact CD1-CD2 4.25Å; L335-L492 HydrophobicContact CD1-CD1 4.09Å; L335-L492 HydrophobicContact CD1-CD2 4.13Å; L335-L492 HydrophobicContact CD1-CG 4.37Å
336	K	95.7	Very high	94.4	Very high	88 Å²	88	19.1 Å²	19.1	38%	0.383	10%	0.095	S	C	.	.	H	α-helix	trans	-62.2	-35.4	176	175.9	-177.3	169.9	-161.8	0	112.1	A332 L333 V482 V485 L488	A332-K336 VanDerWaalsContact O-CB 3.29Å; A332-K336 WeakPolarHBondContact O-CB 3.28Å; A332-K336 PolarHBondContact O-N 3.07Å; L333-K336 PolarHBondContact O-N 3.09Å; K336-V482 HydrophobicContact CG-CG1 4.16Å; K336-V485 HydrophobicContact CD-CG2 3.41Å; K336-V485 VanDerWaalsContact CD-CG2 3.41Å; K336-L488 HydrophobicContact CB-CD1 3.92Å
337	N	96.1	Very high	94.1	Very high	52 Å²	52	19 Å²	19	28%	0.278	9%	0.094	S	C	.	.	H	α-helix	trans	-75	-38.9	-177.1	-172.7	81.3	0	0	0	112.2	L333 L334 L335 N417 T420	L333-N337 WeakPolarHBondContact O-CB 3.38Å; L333-N337 PolarHBondContact O-N 3.34Å; L334-N337 PolarHBondContact O-N 2.74Å; L335-N337 VanDerWaalsContact C-N 3.29Å; L335-N337 PolarHBondContact O-N 3.31Å; N337-N417 PolarHBondContact ND2-ND2 2.75Å; N337-N417 VanDerWaalsContact ND2-ND2 3.17Å; N337-T420 HydrophobicContact CB-CG2 3.68Å
338	G	95.7	Very high	94	Very high	1 Å²	1	17.7 Å²	17.7	1%	0.01	9%	0.086	C	C	.	.	H	α-helix	trans	-96	-0.2	-177.8	0	0	0	0	0	115.3	L334 N340 E341 L342	L334-G338 PolarHBondContact O-N 3.13Å; G338-N340 VanDerWaalsContact C-N 3.32Å; G338-N340 PolarHBondContact O-N 2.94Å; G338-N340 VanDerWaalsContact O-N 3.15Å; G338-E341 PolarHBondContact O-N 2.94Å; G338-L342 WeakPolarHBondContact O-CB 3.37Å; G338-L342 WeakPolarHBondContact O-CG 3.48Å; G338-L342 PolarHBondContact O-N 3.26Å
339	W	93.6	Very high	93.8	Very high	7 Å²	7	18.5 Å²	18.5	3%	0.027	9%	0.085	C	C	.	.	H	α-helix	trans	-49.4	-46.2	-166.7	73.6	-69.9	0	0	0	114.7	L335 I343 Y473 I479 P480 V482 P483	L335-W339 WeakPolarHBondContact O-CA 3.39Å; L335-W339 VanDerWaalsContact O-CB 3.29Å; L335-W339 WeakPolarHBondContact O-CB 3.4Å; L335-W339 PolarHBondContact O-N 3.47Å; W339-I343 HydrophobicContact CE3-CD1 3.9Å; W339-I343 HydrophobicContact CZ3-CD1 4.22Å; W339-I343 WeakPolarHBondContact O-CB 3.48Å; W339-I343 WeakPolarHBondContact O-CD1 3.48Å; W339-I343 VanDerWaalsContact O-CG1 3.24Å; W339-I343 WeakPolarHBondContact O-CG1 3.45Å; W339-I343 PolarHBondContact O-N 2.67Å; W339-Y473 PolarHBondContact NE1-OH 3.11Å; W339-I479 HydrophobicContact CH2-CB 4.48Å; W339-I479 HydrophobicContact CH2-CD1 4.37Å; W339-I479 HydrophobicContact CH2-CG1 4.24Å; W339-I479 HydrophobicContact CH2-CG2 3.58Å; W339-I479 HydrophobicContact CZ3-CB 4.48Å; W339-I479 HydrophobicContact CZ3-CD1 4Å; W339-I479 HydrophobicContact CZ3-CG1 3.81Å; W339-I479 HydrophobicContact CZ3-CG2 4.04Å; W339-P480 WeakPolarHBondContact CH2-O 3.21Å; W339-P480 WeakPolarHBondContact CZ3-O 3.24Å; W339-V482 HydrophobicContact CH2-CG2 4.37Å; W339-V482 HydrophobicContact CZ2-CB 4.17Å; W339-V482 HydrophobicContact CZ2-CG2 3.45Å; W339-V482 VanDerWaalsContact CZ2-CG2 3.45Å; W339-P483 HydrophobicContact CB-CG 3.92Å; W339-P483 HydrophobicContact CG-CG 4.22Å
340	N	92	Very high	93.4	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-71	-48.3	-178.6	54.6	-20.6	0	0	0	111.4	G338 L342 I343 L344 G469 I479	G338-N340 VanDerWaalsContact C-N 3.32Å; G338-N340 PolarHBondContact O-N 2.94Å; G338-N340 VanDerWaalsContact O-N 3.15Å; N340-L342 VanDerWaalsContact C-N 3.3Å; N340-L342 PolarHBondContact O-N 2.93Å; N340-I343 PolarHBondContact O-N 3.21Å; N340-I343 VanDerWaalsContact O-N 3.16Å; N340-L344 WeakPolarHBondContact O-CB 3.47Å; N340-L344 VanDerWaalsContact O-CG 3.24Å; N340-L344 WeakPolarHBondContact O-CG 3.43Å; N340-L344 PolarHBondContact O-N 2.85Å; N340-G469 VanDerWaalsContact ND2-C 3.26Å; N340-G469 PolarHBondContact ND2-O 2.95Å; N340-I479 HydrophobicContact CB-CD1 3.91Å
341	E	95.8	Very high	92.9	Very high	18 Å²	18	16.9 Å²	16.9	8%	0.084	8%	0.084	C	C	.	.	H	α-helix	trans	-64.2	-37.3	179	-66.9	178.7	-134.1	0	0	111.6	G338 S345 V414 L465 R466	G338-E341 PolarHBondContact O-N 2.94Å; E341-S345 VanDerWaalsContact O-CB 3.3Å; E341-S345 WeakPolarHBondContact O-CB 3.45Å; E341-S345 PolarHBondContact O-N 3.28Å; E341-S345 PolarHBondContact O-OG 2.81Å; E341-V414 HydrophobicContact CB-CG1 3.71Å; E341-L465 HydrophobicContact CB-CD1 4.45Å; E341-L465 HydrophobicContact CB-CD2 4.15Å; E341-L465 HydrophobicContact CB-CG 4.05Å; E341-L465 HydrophobicContact CG-CG 4.25Å; E341-R466 WeakPolarHBondContact OE1-CD 3.33Å; E341-R466 IonicContact OE1-CZ 3.95Å; E341-R466 IonicContact OE1-NE 3.57Å; E341-R466 IonicContact OE1-NH1 2.72Å; E341-R466 PolarHBondContact OE1-NH1 2.96Å
342	L	94.7	Very high	92.3	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-63.7	-44.7	172.3	-67.3	170.3	0	0	0	110.6	L313 W316 G338 N340 S345 W346 R411 V414 L415	L313-L342 HydrophobicContact CD1-CB 3.89Å; L313-L342 HydrophobicContact CD1-CD1 3.91Å; L313-L342 HydrophobicContact CD1-CG 4.49Å; W316-L342 HydrophobicContact CH2-CD2 3.66Å; W316-L342 HydrophobicContact CZ3-CD1 4.07Å; W316-L342 HydrophobicContact CZ3-CD2 3.85Å; G338-L342 WeakPolarHBondContact O-CB 3.37Å; G338-L342 WeakPolarHBondContact O-CG 3.48Å; G338-L342 PolarHBondContact O-N 3.26Å; N340-L342 VanDerWaalsContact C-N 3.3Å; N340-L342 PolarHBondContact O-N 2.93Å; L342-S345 PolarHBondContact O-OG 3.23Å; L342-W346 PolarHBondContact O-N 3.26Å; L342-R411 HydrophobicContact CD2-CB 3.95Å; L342-R411 HydrophobicContact CD2-CG 4.4Å; L342-R411 WeakPolarHBondContact CD2-O 3.3Å; L342-R411 PolarHBondContact O-NH1 2.86Å; L342-V414 HydrophobicContact CD2-CB 4.23Å; L342-V414 HydrophobicContact CD2-CG1 4.04Å; L342-V414 HydrophobicContact CG-CG1 4.13Å; L342-L415 HydrophobicContact CD1-CD1 4.01Å; L342-L415 HydrophobicContact CD2-CB 4.41Å
343	I	89.3	Confident	91.2	Very high	17 Å²	17	24.9 Å²	24.9	9%	0.087	13%	0.127	C	C	.	.	H	α-helix	trans	-64.9	-52	176.6	-74.8	168.3	0	0	0	111.1	Y309 W339 N340 S345 W346 L347 M371 I479	Y309-I343 HydrophobicContact CD2-CD1 3.97Å; Y309-I343 HydrophobicContact CE2-CD1 4.3Å; W339-I343 HydrophobicContact CE3-CD1 3.9Å; W339-I343 HydrophobicContact CZ3-CD1 4.22Å; W339-I343 WeakPolarHBondContact O-CB 3.48Å; W339-I343 WeakPolarHBondContact O-CD1 3.48Å; W339-I343 VanDerWaalsContact O-CG1 3.24Å; W339-I343 WeakPolarHBondContact O-CG1 3.45Å; W339-I343 PolarHBondContact O-N 2.67Å; N340-I343 PolarHBondContact O-N 3.21Å; N340-I343 VanDerWaalsContact O-N 3.16Å; I343-S345 VanDerWaalsContact C-N 3.35Å; I343-S345 PolarHBondContact O-N 3.13Å; I343-W346 WeakPolarHBondContact O-CB 3.19Å; I343-W346 PolarHBondContact O-N 3.41Å; I343-W346 VanDerWaalsContact O-N 3.08Å; I343-L347 HydrophobicContact CG2-CD1 3.67Å; I343-L347 HydrophobicContact CG2-CG 4.12Å; I343-L347 WeakPolarHBondContact O-CG 3.47Å; I343-L347 PolarHBondContact O-N 3.33Å; I343-M371 HydrophobicContact CG2-CE 3.26Å; I343-M371 HydrophobicContact CG2-SD 4.24Å; I343-I479 HydrophobicContact CB-CD1 3.93Å; I343-I479 HydrophobicContact CB-CG1 4.48Å; I343-I479 HydrophobicContact CD1-CD1 4.4Å; I343-I479 HydrophobicContact CD1-CG1 4.33Å; I343-I479 HydrophobicContact CG2-CD1 3.64Å; I343-I479 HydrophobicContact CG2-CG1 3.86Å
344	L	91.2	Very high	89.9	Confident	0 Å²	0	24.5 Å²	24.5	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-57.9	-43.5	-177.1	-73.5	166.9	0	0	0	112.9	N340 W346 L347 A348 M389 L465 I468 G469 F478 I479	N340-L344 WeakPolarHBondContact O-CB 3.47Å; N340-L344 VanDerWaalsContact O-CG 3.24Å; N340-L344 WeakPolarHBondContact O-CG 3.43Å; N340-L344 PolarHBondContact O-N 2.85Å; L344-W346 VanDerWaalsContact C-N 3.29Å; L344-W346 PolarHBondContact O-N 2.72Å; L344-L347 PolarHBondContact O-N 2.65Å; L344-A348 VanDerWaalsContact O-CB 3.24Å; L344-A348 WeakPolarHBondContact O-CB 3.43Å; L344-A348 PolarHBondContact O-N 3.07Å; L344-M389 HydrophobicContact CD2-SD 4.12Å; L344-L465 HydrophobicContact CB-CD1 3.74Å; L344-I468 HydrophobicContact CD1-CG2 4.07Å; L344-I468 HydrophobicContact CD2-CG2 4.32Å; L344-G469 VanDerWaalsContact CD1-CA 3.47Å; L344-F478 HydrophobicContact CD2-CE1 3.84Å; L344-I479 HydrophobicContact CD2-CD1 4.49Å; L344-I479 HydrophobicContact CG-CD1 4.12Å
345	S	92.8	Very high	87.9	Confident	4 Å²	4	30.3 Å²	30.3	3%	0.028	16%	0.156	C	C	.	.	H	α-helix	trans	-61.3	-39	177.5	53.8	0	0	0	0	112.2	E341 L342 I343 Y349 R411	E341-S345 VanDerWaalsContact O-CB 3.3Å; E341-S345 WeakPolarHBondContact O-CB 3.45Å; E341-S345 PolarHBondContact O-N 3.28Å; E341-S345 PolarHBondContact O-OG 2.81Å; L342-S345 PolarHBondContact O-OG 3.23Å; I343-S345 VanDerWaalsContact C-N 3.35Å; I343-S345 PolarHBondContact O-N 3.13Å; S345-Y349 WeakPolarHBondContact O-CB 3.38Å; S345-Y349 PolarHBondContact O-N 2.84Å; S345-Y349 VanDerWaalsContact O-N 3.17Å; S345-R411 WeakPolarHBondContact OG-CG 3.33Å; S345-R411 PolarHBondContact OG-NH1 3.39Å
346	W	90.7	Very high	85.7	Confident	32 Å²	32	33.6 Å²	33.6	12%	0.121	18%	0.177	C	C	.	.	H	α-helix	trans	-66.5	-49.2	174.5	176	-103.3	0	0	0	112.1	D294 L342 I343 L344 A348 Y349 A350 L407	D294-W346 WeakPolarHBondContact OD1-CH2 3.42Å; D294-W346 WeakPolarHBondContact OD1-CZ2 3.28Å; D294-W346 WeakPolarHBondContact OD2-CH2 3.44Å; L342-W346 PolarHBondContact O-N 3.26Å; I343-W346 WeakPolarHBondContact O-CB 3.19Å; I343-W346 PolarHBondContact O-N 3.41Å; I343-W346 VanDerWaalsContact O-N 3.08Å; L344-W346 VanDerWaalsContact C-N 3.29Å; L344-W346 PolarHBondContact O-N 2.72Å; W346-A348 VanDerWaalsContact C-N 3.3Å; W346-A348 PolarHBondContact O-N 2.73Å; W346-Y349 HydrophobicContact CZ3-CD1 4.45Å; W346-Y349 PolarHBondContact O-N 2.87Å; W346-A350 WeakPolarHBondContact O-CB 3.28Å; W346-A350 PolarHBondContact O-N 2.99Å; W346-L407 HydrophobicContact CE3-CD2 3.75Å; W346-L407 HydrophobicContact CZ3-CD2 3.92Å
347	L	85.4	Confident	83.3	Confident	4 Å²	4	38.2 Å²	38.2	2%	0.021	20%	0.203	C	C	.	.	H	α-helix	trans	-60.1	-42.8	179.9	-59	168.6	0	0	0	111.3	I343 L344 Y349 A350 S351 M363 T368 M371 L373 M389	I343-L347 HydrophobicContact CG2-CD1 3.67Å; I343-L347 HydrophobicContact CG2-CG 4.12Å; I343-L347 WeakPolarHBondContact O-CG 3.47Å; I343-L347 PolarHBondContact O-N 3.33Å; L344-L347 PolarHBondContact O-N 2.65Å; L347-Y349 VanDerWaalsContact C-N 3.34Å; L347-Y349 PolarHBondContact O-N 3.13Å; L347-A350 PolarHBondContact O-N 2.89Å; L347-S351 WeakPolarHBondContact O-CB 3.44Å; L347-S351 PolarHBondContact O-N 3.1Å; L347-S351 PolarHBondContact O-OG 2.92Å; L347-M363 HydrophobicContact CB-CE 3.78Å; L347-M363 HydrophobicContact CD2-CE 3.16Å; L347-M363 HydrophobicContact CG-CE 4.01Å; L347-T368 HydrophobicContact CD2-CG2 4.07Å; L347-M371 HydrophobicContact CD1-CE 4.06Å; L347-M371 HydrophobicContact CD1-SD 3.28Å; L347-M371 WeakPolarHBondContact CD1-SD 3.29Å; L347-M371 HydrophobicContact CD2-CE 4.34Å; L347-M371 HydrophobicContact CD2-SD 3.53Å; L347-M371 VanDerWaalsContact CD2-SD 3.53Å; L347-M371 HydrophobicContact CG-SD 4Å; L347-L373 HydrophobicContact CD1-CD1 4.5Å; L347-M389 HydrophobicContact CB-SD 4.21Å
348	A	90.5	Very high	81	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-62.4	-41.7	179.3	0	0	0	0	0	111.9	L344 W346 M389 L393 T394 M397	L344-A348 VanDerWaalsContact O-CB 3.24Å; L344-A348 WeakPolarHBondContact O-CB 3.43Å; L344-A348 PolarHBondContact O-N 3.07Å; W346-A348 VanDerWaalsContact C-N 3.3Å; W346-A348 PolarHBondContact O-N 2.73Å; A348-M389 HydrophobicContact CB-CG 4.24Å; A348-L393 HydrophobicContact CB-CB 3.74Å; A348-L393 HydrophobicContact CB-CD1 4.3Å; A348-T394 VanDerWaalsContact CA-OG1 3.29Å; A348-T394 WeakPolarHBondContact CA-OG1 3.39Å; A348-T394 WeakPolarHBondContact O-CG2 3.33Å; A348-T394 PolarHBondContact O-OG1 3.26Å; A348-M397 HydrophobicContact CB-CE 4.39Å; A348-M397 HydrophobicContact CB-SD 3.99Å
349	Y	91.3	Very high	78.7	Confident	49 Å²	49	39.8 Å²	39.8	19%	0.192	21%	0.211	C	C	.	.	H	α-helix	trans	-68.5	-47.3	176	177	-89	0	0	0	112.3	S345 W346 L347 S351 M352 M402 R404 L407	S345-Y349 WeakPolarHBondContact O-CB 3.38Å; S345-Y349 PolarHBondContact O-N 2.84Å; S345-Y349 VanDerWaalsContact O-N 3.17Å; W346-Y349 HydrophobicContact CZ3-CD1 4.45Å; W346-Y349 PolarHBondContact O-N 2.87Å; L347-Y349 VanDerWaalsContact C-N 3.34Å; L347-Y349 PolarHBondContact O-N 3.13Å; Y349-S351 PolarHBondContact O-N 2.84Å; Y349-S351 VanDerWaalsContact O-N 3.13Å; Y349-M352 HydrophobicContact CD2-SD 3.46Å; Y349-M352 WeakPolarHBondContact CD2-SD 3.41Å; Y349-M352 HydrophobicContact CE2-SD 3.92Å; Y349-M352 HydrophobicContact CG-SD 4.04Å; Y349-M352 VanDerWaalsContact O-CB 3.24Å; Y349-M352 WeakPolarHBondContact O-CB 3.41Å; Y349-M352 VanDerWaalsContact O-CG 3.22Å; Y349-M352 WeakPolarHBondContact O-CG 3.02Å; Y349-M352 PolarHBondContact O-N 2.65Å; Y349-M402 WeakPolarHBondContact CE2-O 3.39Å; Y349-R404 WeakPolarHBondContact OH-CB 3.47Å; Y349-R404 PolarHBondContact OH-N 3.46Å; Y349-L407 HydrophobicContact CD1-CD2 3.52Å; Y349-L407 HydrophobicContact CD2-CB 4.03Å; Y349-L407 HydrophobicContact CD2-CD1 4.32Å; Y349-L407 HydrophobicContact CD2-CD2 3.79Å; Y349-L407 HydrophobicContact CD2-CG 4.23Å; Y349-L407 HydrophobicContact CE1-CD2 4.1Å; Y349-L407 HydrophobicContact CE2-CB 4.28Å; Y349-L407 HydrophobicContact CE2-CD2 4.31Å; Y349-L407 HydrophobicContact CG-CB 4.47Å; Y349-L407 HydrophobicContact CG-CD1 4.22Å; Y349-L407 HydrophobicContact CG-CD2 3.37Å; Y349-L407 HydrophobicContact CG-CG 4.19Å
350	A	85.9	Confident	76.2	Confident	37 Å²	37	41.1 Å²	41.1	31%	0.306	23%	0.227	S	C	.	.	H	α-helix	trans	-59.8	-26.5	178.4	0	0	0	0	0	112.4	W346 L347 M352	W346-A350 WeakPolarHBondContact O-CB 3.28Å; W346-A350 PolarHBondContact O-N 2.99Å; L347-A350 PolarHBondContact O-N 2.89Å; A350-M352 VanDerWaalsContact C-N 3.33Å
351	S	84.6	Confident	73.6	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.4	5	177.4	-52.3	0	0	0	0	114.2	L347 Y349 T354 V359 T394 R398	L347-S351 WeakPolarHBondContact O-CB 3.44Å; L347-S351 PolarHBondContact O-N 3.1Å; L347-S351 PolarHBondContact O-OG 2.92Å; Y349-S351 PolarHBondContact O-N 2.84Å; Y349-S351 VanDerWaalsContact O-N 3.13Å; S351-T354 VanDerWaalsContact CA-OG1 3.32Å; S351-T354 WeakPolarHBondContact CA-OG1 3.45Å; S351-T354 PolarHBondContact O-OG1 2.97Å; S351-T354 VanDerWaalsContact O-OG1 3.08Å; S351-V359 WeakPolarHBondContact OG-CG1 3.25Å; S351-T394 VanDerWaalsContact O-CG2 3.25Å; S351-T394 WeakPolarHBondContact O-CG2 3.5Å; S351-R398 PolarHBondContact O-NH2 3.45Å
352	M	85.3	Confident	70.7	Confident	17 Å²	17	46.2 Å²	46.2	8%	0.084	26%	0.259	C	S	.	.	S	Bend	trans	-66	-39.2	-179.2	-76.1	170.5	53	0	0	112.3	Y349 A350 M397 R398 M402	Y349-M352 HydrophobicContact CD2-SD 3.46Å; Y349-M352 WeakPolarHBondContact CD2-SD 3.41Å; Y349-M352 HydrophobicContact CE2-SD 3.92Å; Y349-M352 HydrophobicContact CG-SD 4.04Å; Y349-M352 VanDerWaalsContact O-CB 3.24Å; Y349-M352 WeakPolarHBondContact O-CB 3.41Å; Y349-M352 VanDerWaalsContact O-CG 3.22Å; Y349-M352 WeakPolarHBondContact O-CG 3.02Å; Y349-M352 PolarHBondContact O-N 2.65Å; A350-M352 VanDerWaalsContact C-N 3.33Å; M352-M397 HydrophobicContact CE-CB 4.28Å; M352-M397 VanDerWaalsContact CE-O 3.32Å; M352-M397 WeakPolarHBondContact CE-O 3.19Å; M352-M397 HydrophobicContact CG-CB 3.97Å; M352-M397 HydrophobicContact SD-CB 3.47Å; M352-M397 WeakPolarHBondContact SD-CB 3.19Å; M352-R398 HydrophobicContact CG-CB 4.49Å; M352-R398 PolarHBondContact O-NE 3.42Å; M352-R398 PolarHBondContact O-NH2 2.85Å; M352-M402 HydrophobicContact CE-CB 4.36Å
353	D	73.4	Confident	67.9	Low	160 Å²	160	46.5 Å²	46.5	86%	0.856	26%	0.261	S	S	*	.	S	Bend	trans	-90	-6.1	-176.5	-65.2	-36.4	0	0	0	113.5
354	T	68.9	Low	65.5	Low	28 Å²	28	47.5 Å²	47.5	17%	0.172	27%	0.271	C	S	.	.	S	Bend	trans	-90	139.7	176.6	55.8	0	0	0	0	110.1	S351 T362 R398	S351-T354 VanDerWaalsContact CA-OG1 3.32Å; S351-T354 WeakPolarHBondContact CA-OG1 3.45Å; S351-T354 PolarHBondContact O-OG1 2.97Å; S351-T354 VanDerWaalsContact O-OG1 3.08Å; T354-T362 HydrophobicContact CG2-CG2 4.15Å; T354-T362 VanDerWaalsContact CG2-OG1 3.31Å; T354-T362 WeakPolarHBondContact CG2-OG1 3.08Å; T354-R398 PolarHBondContact O-NH2 2.93Å
355	I	56	Low	63.1	Low	123 Å²	123	53.7 Å²	53.7	63%	0.631	30%	0.304	S	S	*	.			trans	-63.9	136.3	175.9	-58.8	173.6	0	0	0	107	M357 D358	I355-M357 PolarHBondContact O-N 3.26Å; I355-D358 PolarHBondContact O-N 3.05Å
356	P	50.8	Low	60.5	Low	68 Å²	68	57.5 Å²	57.5	44%	0.442	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.5	-26.4	-174.4	-29.5	34.4	0	0	0	115.8
357	M	45.4	Very low	58.2	Low	186 Å²	186	58.3 Å²	58.3	92%	0.916	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-15.2	176.9	-77.4	-163.6	172.4	0	0	115	I355	I355-M357 PolarHBondContact O-N 3.26Å
358	D	48.8	Very low	56.3	Low	84 Å²	84	58.6 Å²	58.6	45%	0.449	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.7	0.3	-177.8	-119.3	-8.2	0	0	0	113.3	I355 G360 V361 T362	I355-D358 PolarHBondContact O-N 3.05Å; D358-G360 PolarHBondContact O-N 3.37Å; D358-V361 PolarHBondContact O-N 3.34Å; D358-V361 VanDerWaalsContact O-N 3.1Å; D358-T362 PolarHBondContact O-N 2.93Å; D358-T362 VanDerWaalsContact O-N 3.13Å; D358-T362 PolarHBondContact O-OG1 2.91Å
359	V	45.8	Very low	53.8	Low	1 Å²	1	65.3 Å²	65.3	1%	0.006	37%	0.373	C	S	.	.	H	α-helix	trans	-64	-25.7	-176.8	-176.6	0	0	0	0	112	S351 V361 M363 F386 I390	S351-V359 WeakPolarHBondContact OG-CG1 3.25Å; V359-V361 VanDerWaalsContact C-N 3.33Å; V359-V361 PolarHBondContact O-N 3.35Å; V359-M363 VanDerWaalsContact O-CG 3.26Å; V359-M363 WeakPolarHBondContact O-CG 3.33Å; V359-F386 HydrophobicContact CB-CZ 3.9Å; V359-F386 HydrophobicContact CG1-CE2 4.04Å; V359-F386 HydrophobicContact CG1-CZ 3.78Å; V359-I390 HydrophobicContact CB-CD1 4.24Å; V359-I390 HydrophobicContact CG1-CD1 3.71Å; V359-I390 HydrophobicContact CG2-CD1 4.15Å
360	G	41.1	Very low	51.5	Low	36 Å²	36	64.6 Å²	64.6	37%	0.371	37%	0.372	S	S	.	.	H	α-helix	trans	-73.5	-18.8	175.7	0	0	0	0	0	114.9	D358	D358-G360 PolarHBondContact O-N 3.37Å
361	V	37.5	Very low	49.5	Very low	71 Å²	71	63.5 Å²	63.5	43%	0.43	36%	0.361	S	S	.	.	H	α-helix	trans	-112	-40	-170	-178.6	0	0	0	0	111.8	D358 V359 M363 A364	D358-V361 PolarHBondContact O-N 3.34Å; D358-V361 VanDerWaalsContact O-N 3.1Å; V359-V361 VanDerWaalsContact C-N 3.33Å; V359-V361 PolarHBondContact O-N 3.35Å; V361-M363 PolarHBondContact O-N 3.38Å; V361-A364 PolarHBondContact O-N 3.37Å
362	T	34.7	Very low	47.5	Very low	54 Å²	54	68 Å²	68	33%	0.331	39%	0.392	S	S	.	.	H	α-helix	trans	-69.3	-15	-178.2	35.5	0	0	0	0	114.9	T354 D358 A364	T354-T362 HydrophobicContact CG2-CG2 4.15Å; T354-T362 VanDerWaalsContact CG2-OG1 3.31Å; T354-T362 WeakPolarHBondContact CG2-OG1 3.08Å; D358-T362 PolarHBondContact O-N 2.93Å; D358-T362 VanDerWaalsContact O-N 3.13Å; D358-T362 PolarHBondContact O-OG1 2.91Å; T362-A364 VanDerWaalsContact C-N 3.27Å; T362-A364 PolarHBondContact O-N 2.99Å
363	M	37.3	Very low	45.7	Very low	6 Å²	6	67.4 Å²	67.4	3%	0.03	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-20.7	174.6	-59.5	-66.3	-85.7	0	0	111.8	L347 V359 V361 T368 L373	L347-M363 HydrophobicContact CB-CE 3.78Å; L347-M363 HydrophobicContact CD2-CE 3.16Å; L347-M363 HydrophobicContact CG-CE 4.01Å; V359-M363 VanDerWaalsContact O-CG 3.26Å; V359-M363 WeakPolarHBondContact O-CG 3.33Å; V361-M363 PolarHBondContact O-N 3.38Å; M363-T368 WeakPolarHBondContact CA-OG1 3.27Å; M363-T368 HydrophobicContact CE-CG2 4.1Å; M363-T368 CarbonylContact O-C 3.6Å; M363-T368 WeakPolarHBondContact O-CA 3.49Å; M363-T368 WeakPolarHBondContact O-CB 3.31Å; M363-T368 PolarHBondContact O-OG1 3.47Å; M363-L373 HydrophobicContact CE-CD1 4.29Å; M363-L373 HydrophobicContact CG-CD1 4.46Å
364	A	38.8	Very low	44.5	Very low	38 Å²	38	66.5 Å²	66.5	31%	0.314	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-31.6	-178.8	0	0	0	0	0	114.1	V361 T362 H369	V361-A364 PolarHBondContact O-N 3.37Å; T362-A364 VanDerWaalsContact C-N 3.27Å; T362-A364 PolarHBondContact O-N 2.99Å; A364-H369 PolarHBondContact O-CE1 3.49Å; A364-H369 PolarHBondContact O-ND1 3.18Å
365	D	40.5	Very low	43.6	Very low	129 Å²	129	66.9 Å²	66.9	69%	0.69	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.5	-9.1	-158.9	-71.2	-5.9	0	0	0	115.1
366	S	37.5	Very low	43.5	Very low	85 Å²	85	63.9 Å²	63.9	59%	0.594	37%	0.374	S	S	*	.	S	Bend	trans	-143.9	111	179.5	-66.3	0	0	0	0	108.2	T368	S366-T368 PolarHBondContact O-N 3.06Å; S366-T368 PolarHBondContact O-OG1 3.01Å
367	T	42.1	Very low	43.7	Very low	49 Å²	49	69.7 Å²	69.7	30%	0.301	40%	0.395	S	S	.	.	S	Bend	trans	58.5	-6.7	178.5	54	0	0	0	0	118.6	D294 R312	D294-T367 HydrophobicContact CB-CG2 4.25Å; D294-T367 WeakPolarHBondContact O-CG2 3.35Å; R312-T367 VanDerWaalsContact CZ-O 3.23Å; R312-T367 PolarHBondContact NH1-O 3.18Å; R312-T367 PolarHBondContact NH2-O 3.32Å
368	T	45.4	Very low	44.5	Very low	10 Å²	10	64.6 Å²	64.6	6%	0.061	39%	0.391	C	S	.	.			trans	-122.4	41.8	-174.9	22.6	0	0	0	0	114.9	L347 M363 S366 L370 M371	L347-T368 HydrophobicContact CD2-CG2 4.07Å; M363-T368 WeakPolarHBondContact CA-OG1 3.27Å; M363-T368 HydrophobicContact CE-CG2 4.1Å; M363-T368 CarbonylContact O-C 3.6Å; M363-T368 WeakPolarHBondContact O-CA 3.49Å; M363-T368 WeakPolarHBondContact O-CB 3.31Å; M363-T368 PolarHBondContact O-OG1 3.47Å; S366-T368 PolarHBondContact O-N 3.06Å; S366-T368 PolarHBondContact O-OG1 3.01Å; T368-L370 PolarHBondContact O-N 3.3Å; T368-M371 PolarHBondContact O-N 3.02Å
369	H	39.8	Very low	45.6	Very low	140 Å²	140	62.2 Å²	62.2	65%	0.648	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	17.1	165.3	-91.1	-58.8	0	0	0	115.7	A364	A364-H369 PolarHBondContact O-CE1 3.49Å; A364-H369 PolarHBondContact O-ND1 3.18Å
370	L	41.6	Very low	47.3	Very low	34 Å²	34	66.2 Å²	66.2	18%	0.178	41%	0.406	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.2	-11.2	-177.8	-123.6	140.9	0	0	0	113.1	G305 L308 Y309 T368 P480	G305-L370 VanDerWaalsContact O-CD1 3.22Å; G305-L370 WeakPolarHBondContact O-CD1 3.06Å; G305-L370 WeakPolarHBondContact O-CD2 3.28Å; G305-L370 VanDerWaalsContact O-CG 3.23Å; G305-L370 WeakPolarHBondContact O-CG 3.42Å; L308-L370 HydrophobicContact CB-CD1 3.85Å; L308-L370 HydrophobicContact CD2-CD1 3.99Å; L308-L370 HydrophobicContact CG-CD1 3.82Å; Y309-L370 HydrophobicContact CD1-CD2 3.76Å; Y309-L370 HydrophobicContact CG-CD2 4.17Å; T368-L370 PolarHBondContact O-N 3.3Å; L370-P480 HydrophobicContact CD2-CG 3.63Å
371	M	44.6	Very low	49.3	Very low	15 Å²	15	68.3 Å²	68.3	7%	0.074	41%	0.409	C	S	.	.			trans	-145.4	95.5	-176.2	-57.2	-170.2	-175.9	0	0	110.4	I343 L347 T368 L373 I479 P480	I343-M371 HydrophobicContact CG2-CE 3.26Å; I343-M371 HydrophobicContact CG2-SD 4.24Å; L347-M371 HydrophobicContact CD1-CE 4.06Å; L347-M371 HydrophobicContact CD1-SD 3.28Å; L347-M371 WeakPolarHBondContact CD1-SD 3.29Å; L347-M371 HydrophobicContact CD2-CE 4.34Å; L347-M371 HydrophobicContact CD2-SD 3.53Å; L347-M371 VanDerWaalsContact CD2-SD 3.53Å; L347-M371 HydrophobicContact CG-SD 4Å; T368-M371 PolarHBondContact O-N 3.02Å; M371-L373 HydrophobicContact CB-CD2 4.18Å; M371-L373 HydrophobicContact CB-CG 3.92Å; M371-L373 PolarHBondContact O-N 3.25Å; M371-L373 HydrophobicContact SD-CD2 4.04Å; M371-I479 HydrophobicContact CE-CG1 4.29Å; M371-P480 HydrophobicContact CE-CG 3.73Å
372	S	41.7	Very low	51.4	Low	94 Å²	94	65 Å²	65	66%	0.657	39%	0.389	S	S	*	.			trans	-67.2	89.9	139.8	174.1	0	0	0	0	105.7	K374	S372-K374 PolarHBondContact O-N 3.07Å; S372-K374 VanDerWaalsContact OG-CB 3.24Å; S372-K374 WeakPolarHBondContact OG-CB 3.36Å
373	L	48.9	Very low	53.7	Low	4 Å²	4	65.9 Å²	65.9	2%	0.021	39%	0.392	C	S	.	.			trans	-65.2	5.1	166.4	-73.3	176.2	0	0	0	111.5	L347 M363 M371 P375 F386 M389 F478	L347-L373 HydrophobicContact CD1-CD1 4.5Å; M363-L373 HydrophobicContact CE-CD1 4.29Å; M363-L373 HydrophobicContact CG-CD1 4.46Å; M371-L373 HydrophobicContact CB-CD2 4.18Å; M371-L373 HydrophobicContact CB-CG 3.92Å; M371-L373 PolarHBondContact O-N 3.25Å; M371-L373 HydrophobicContact SD-CD2 4.04Å; L373-P375 WeakPolarHBondContact O-CD 3.24Å; L373-F386 HydrophobicContact CB-CD2 4.41Å; L373-F386 HydrophobicContact CB-CE2 4.28Å; L373-F386 HydrophobicContact CD1-CD2 4.35Å; L373-F386 HydrophobicContact CD1-CE2 4.06Å; L373-M389 HydrophobicContact CD1-CE 4.16Å; L373-F478 HydrophobicContact CD2-CD2 4.24Å; L373-F478 HydrophobicContact CD2-CE1 4.33Å; L373-F478 HydrophobicContact CD2-CE2 3.83Å; L373-F478 HydrophobicContact CD2-CZ 3.89Å; L373-F478 WeakPolarHBondContact CD2-O 3.48Å
374	K	48.4	Very low	56.2	Low	142 Å²	142	67.9 Å²	67.9	62%	0.617	41%	0.409	S	S	*	.			trans	-57.8	114.1	168.9	-156.3	178	-178.3	-171.7	0	106.8	S372 A376	S372-K374 PolarHBondContact O-N 3.07Å; S372-K374 VanDerWaalsContact OG-CB 3.24Å; S372-K374 WeakPolarHBondContact OG-CB 3.36Å; K374-A376 PolarHBondContact O-N 2.78Å
375	P	49.4	Very low	58.5	Low	36 Å²	36	66.4 Å²	66.4	23%	0.234	40%	0.396	C	S	.	.			trans	-50.9	133.4	173.2	-8.2	14.3	0	0	0	107.1	L373 E377 A382 D383	L373-P375 WeakPolarHBondContact O-CD 3.24Å; P375-E377 PolarHBondContact O-N 2.89Å; P375-A382 HydrophobicContact CB-CB 4.03Å; P375-D383 WeakPolarHBondContact CB-OD1 3.31Å; P375-D383 WeakPolarHBondContact CG-OD1 3.21Å
376	A	52.7	Low	60.7	Low	60 Å²	60	61.8 Å²	61.8	50%	0.496	37%	0.369	S	S	.	.			trans	-52.8	129.5	164.8	0	0	0	0	0	106.7	K374 G378 D379	K374-A376 PolarHBondContact O-N 2.78Å; A376-G378 PolarHBondContact O-N 2.92Å; A376-D379 PolarHBondContact O-N 3.14Å
377	E	55.1	Low	63.1	Low	189 Å²	189	62.1 Å²	62.1	88%	0.883	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.2	112.8	-178.2	-70.2	-177.2	172	0	0	109	P375	P375-E377 PolarHBondContact O-N 2.89Å
378	G	63.8	Low	65.6	Low	79 Å²	79	63.4 Å²	63.4	81%	0.814	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	106.6	-5.3	-178.2	0	0	0	0	0	117.1	A376 S380	A376-G378 PolarHBondContact O-N 2.92Å; G378-S380 PolarHBondContact O-N 2.87Å; G378-S380 VanDerWaalsContact O-N 3.14Å
379	D	72	Confident	67.8	Low	34 Å²	34	62.9 Å²	62.9	18%	0.182	36%	0.361	C	S	.	.			trans	-86	79.4	173.5	-167	-7.3	0	0	0	111.8	A376 N381 A382 D383 S475 S477	A376-D379 PolarHBondContact O-N 3.14Å; D379-N381 PolarHBondContact O-N 3.49Å; D379-N381 WeakPolarHBondContact OD1-CB 3.45Å; D379-N381 PolarHBondContact OD1-N 3.02Å; D379-A382 HydrophobicContact CB-CB 3.95Å; D379-A382 WeakPolarHBondContact O-CB 3.26Å; D379-A382 PolarHBondContact O-N 3.48Å; D379-A382 PolarHBondContact OD1-N 2.8Å; D379-D383 PolarHBondContact O-N 2.94Å; D379-S475 PolarHBondContact OD2-OG 3.18Å; D379-S477 PolarHBondContact OD2-OG 2.95Å
380	S	79.7	Confident	70.1	Confident	86 Å²	86	56.9 Å²	56.9	60%	0.601	33%	0.334	S	S	*	.	H	α-helix	trans	-53.8	-23.8	176.8	59.9	0	0	0	0	114.4	G378 A384	G378-S380 PolarHBondContact O-N 2.87Å; G378-S380 VanDerWaalsContact O-N 3.14Å; S380-A384 PolarHBondContact O-N 3.34Å
381	N	83.4	Confident	72.5	Confident	80 Å²	80	60 Å²	60	43%	0.428	35%	0.351	S	S	.	.	H	α-helix	trans	-75.5	-39.9	176.2	-67.3	-32.7	0	0	0	111.1	D379 D383 A384 I385	D379-N381 PolarHBondContact O-N 3.49Å; D379-N381 WeakPolarHBondContact OD1-CB 3.45Å; D379-N381 PolarHBondContact OD1-N 3.02Å; N381-D383 VanDerWaalsContact C-N 3.33Å; N381-D383 PolarHBondContact O-N 3.34Å; N381-A384 PolarHBondContact O-N 3.22Å; N381-I385 WeakPolarHBondContact O-CB 3.32Å; N381-I385 WeakPolarHBondContact O-CD1 3.42Å; N381-I385 WeakPolarHBondContact O-CG1 3.21Å; N381-I385 PolarHBondContact O-N 3.29Å
382	A	82.6	Confident	74.8	Confident	1 Å²	1	61.9 Å²	61.9	1%	0.008	36%	0.359	C	S	.	.	H	α-helix	trans	-60.9	-43.7	176.4	0	0	0	0	0	111.2	P375 D379 I385 F386 S475 F478	P375-A382 HydrophobicContact CB-CB 4.03Å; D379-A382 HydrophobicContact CB-CB 3.95Å; D379-A382 WeakPolarHBondContact O-CB 3.26Å; D379-A382 PolarHBondContact O-N 3.48Å; D379-A382 PolarHBondContact OD1-N 2.8Å; A382-I385 PolarHBondContact O-N 3.36Å; A382-F386 WeakPolarHBondContact O-CB 3.38Å; A382-F386 PolarHBondContact O-N 3.11Å; A382-S475 WeakPolarHBondContact CB-OG 3.37Å; A382-F478 HydrophobicContact CB-CB 4.38Å; A382-F478 HydrophobicContact CB-CD2 4.16Å
383	D	82.3	Confident	77.3	Confident	73 Å²	73	57.4 Å²	57.4	39%	0.39	33%	0.328	S	S	.	.	H	α-helix	trans	-57.3	-51.5	174.1	-76.1	-40.6	0	0	0	111.7	P375 D379 N381 I385 F386 D387	P375-D383 WeakPolarHBondContact CB-OD1 3.31Å; P375-D383 WeakPolarHBondContact CG-OD1 3.21Å; D379-D383 PolarHBondContact O-N 2.94Å; N381-D383 VanDerWaalsContact C-N 3.33Å; N381-D383 PolarHBondContact O-N 3.34Å; D383-I385 VanDerWaalsContact C-N 3.3Å; D383-I385 PolarHBondContact O-N 3.48Å; D383-F386 WeakPolarHBondContact O-CB 3.36Å; D383-F386 PolarHBondContact O-N 3.39Å; D383-D387 PolarHBondContact O-N 3.11Å
384	A	89.2	Confident	79.4	Confident	48 Å²	48	57.3 Å²	57.3	40%	0.397	33%	0.327	S	S	.	.	H	α-helix	trans	-61.9	-38.1	179.7	0	0	0	0	0	112.3	S380 N381 R388	S380-A384 PolarHBondContact O-N 3.34Å; N381-A384 PolarHBondContact O-N 3.22Å; A384-R388 WeakPolarHBondContact O-CB 3.4Å; A384-R388 WeakPolarHBondContact O-CG 3.37Å; A384-R388 PolarHBondContact O-N 3.33Å; A384-R388 VanDerWaalsContact O-N 3.11Å
385	I	88.9	Confident	81.4	Confident	7 Å²	7	51.7 Å²	51.7	4%	0.036	31%	0.306	C	S	.	.	H	α-helix	trans	-67	-43.2	176.3	-67.7	162.2	0	0	0	110.4	N381 A382 D383 R388 M389 I468 A471 F478	N381-I385 WeakPolarHBondContact O-CB 3.32Å; N381-I385 WeakPolarHBondContact O-CD1 3.42Å; N381-I385 WeakPolarHBondContact O-CG1 3.21Å; N381-I385 PolarHBondContact O-N 3.29Å; A382-I385 PolarHBondContact O-N 3.36Å; D383-I385 VanDerWaalsContact C-N 3.3Å; D383-I385 PolarHBondContact O-N 3.48Å; I385-R388 PolarHBondContact O-N 2.91Å; I385-M389 PolarHBondContact O-N 3.39Å; I385-I468 HydrophobicContact CG2-CG2 4.05Å; I385-A471 HydrophobicContact CD1-CB 4.24Å; I385-A471 WeakPolarHBondContact CD1-O 3.28Å; I385-A471 HydrophobicContact CG1-CB 3.9Å; I385-F478 HydrophobicContact CB-CD1 4.48Å; I385-F478 HydrophobicContact CB-CE1 4.48Å; I385-F478 HydrophobicContact CG2-CD1 3.57Å; I385-F478 HydrophobicContact CG2-CD2 4.41Å; I385-F478 HydrophobicContact CG2-CE1 3.4Å; I385-F478 HydrophobicContact CG2-CE2 4.27Å; I385-F478 HydrophobicContact CG2-CG 4.09Å; I385-F478 HydrophobicContact CG2-CZ 3.78Å
386	F	86.3	Confident	83.6	Confident	31 Å²	31	54.3 Å²	54.3	14%	0.136	31%	0.313	C	S	.	.	H	α-helix	trans	-59.5	-52.3	176.5	-174.2	-100.6	0	0	0	111.4	V359 L373 A382 D383 R388 M389 I390 F478	V359-F386 HydrophobicContact CB-CZ 3.9Å; V359-F386 HydrophobicContact CG1-CE2 4.04Å; V359-F386 HydrophobicContact CG1-CZ 3.78Å; L373-F386 HydrophobicContact CB-CD2 4.41Å; L373-F386 HydrophobicContact CB-CE2 4.28Å; L373-F386 HydrophobicContact CD1-CD2 4.35Å; L373-F386 HydrophobicContact CD1-CE2 4.06Å; A382-F386 WeakPolarHBondContact O-CB 3.38Å; A382-F386 PolarHBondContact O-N 3.11Å; D383-F386 WeakPolarHBondContact O-CB 3.36Å; D383-F386 PolarHBondContact O-N 3.39Å; F386-R388 VanDerWaalsContact C-N 3.27Å; F386-R388 PolarHBondContact O-N 3.36Å; F386-M389 HydrophobicContact CD2-CE 4.07Å; F386-M389 HydrophobicContact CE2-CE 4.06Å; F386-M389 WeakPolarHBondContact O-CA 3.43Å; F386-M389 WeakPolarHBondContact O-CB 3.49Å; F386-M389 PolarHBondContact O-N 3.16Å; F386-I390 HydrophobicContact CD1-CG1 4.11Å; F386-I390 HydrophobicContact CE1-CD1 4.32Å; F386-I390 HydrophobicContact CE1-CG1 3.79Å; F386-I390 HydrophobicContact CE2-CD1 4.33Å; F386-I390 HydrophobicContact CE2-CG1 4.48Å; F386-I390 HydrophobicContact CZ-CD1 4.02Å; F386-I390 HydrophobicContact CZ-CG1 4.01Å; F386-I390 WeakPolarHBondContact O-CG1 3.27Å; F386-I390 PolarHBondContact O-N 2.93Å; F386-F478 HydrophobicContact CB-CE2 3.79Å; F386-F478 HydrophobicContact CB-CZ 4.32Å; F386-F478 HydrophobicContact CD2-CE2 4.06Å; F386-F478 HydrophobicContact CD2-CZ 4.35Å; F386-F478 HydrophobicContact CG-CE2 4.44Å
387	D	88	Confident	85.6	Confident	93 Å²	93	51.6 Å²	51.6	50%	0.497	29%	0.291	S	S	.	.	H	α-helix	trans	-58	-40.8	179.2	-80.5	-20.1	0	0	0	111.9	D383 I390 N391	D383-D387 PolarHBondContact O-N 3.11Å; D387-I390 PolarHBondContact O-N 3.08Å; D387-N391 VanDerWaalsContact O-CB 3.27Å; D387-N391 WeakPolarHBondContact O-CB 3.43Å; D387-N391 VanDerWaalsContact O-CG 3.29Å; D387-N391 PolarHBondContact O-N 3.22Å; D387-N391 PolarHBondContact O-ND2 3.04Å
388	R	92.9	Very high	87.4	Confident	75 Å²	75	46.4 Å²	46.4	28%	0.283	26%	0.263	S	S	.	.	H	α-helix	trans	-65.5	-42.2	174.8	-72.3	-179.7	67.7	-156.4	-4	112.2	A384 I385 F386 I390 N391 E392 S467 I468	A384-R388 WeakPolarHBondContact O-CB 3.4Å; A384-R388 WeakPolarHBondContact O-CG 3.37Å; A384-R388 PolarHBondContact O-N 3.33Å; A384-R388 VanDerWaalsContact O-N 3.11Å; I385-R388 PolarHBondContact O-N 2.91Å; F386-R388 VanDerWaalsContact C-N 3.27Å; F386-R388 PolarHBondContact O-N 3.36Å; R388-I390 PolarHBondContact O-N 2.69Å; R388-N391 PolarHBondContact O-N 3.28Å; R388-E392 IonicContact CZ-OE1 2.65Å; R388-E392 IonicContact NE-OE1 3.13Å; R388-E392 PolarHBondContact NE-OE1 2.94Å; R388-E392 IonicContact NH2-OE1 3.28Å; R388-E392 PolarHBondContact NH2-OE1 3.24Å; R388-E392 IonicContact NH2-OE2 3.35Å; R388-E392 WeakPolarHBondContact O-CB 3.17Å; R388-E392 WeakPolarHBondContact O-CG 3.3Å; R388-E392 PolarHBondContact O-N 3.42Å; R388-S467 PolarHBondContact NH2-OG 3Å; R388-I468 HydrophobicContact CB-CD1 4.21Å; R388-I468 HydrophobicContact CB-CG1 4.08Å
389	M	91.7	Very high	88.8	Confident	0 Å²	0	48 Å²	48	0%	0	25%	0.253	C	S	.	.	I	π-helix	trans	-57.6	-48.6	174.7	-175.6	-172.4	75	0	0	111.1	L344 L347 A348 L373 I385 F386 L393 T394 F478	L344-M389 HydrophobicContact CD2-SD 4.12Å; L347-M389 HydrophobicContact CB-SD 4.21Å; A348-M389 HydrophobicContact CB-CG 4.24Å; L373-M389 HydrophobicContact CD1-CE 4.16Å; I385-M389 PolarHBondContact O-N 3.39Å; F386-M389 HydrophobicContact CD2-CE 4.07Å; F386-M389 HydrophobicContact CE2-CE 4.06Å; F386-M389 WeakPolarHBondContact O-CA 3.43Å; F386-M389 WeakPolarHBondContact O-CB 3.49Å; F386-M389 PolarHBondContact O-N 3.16Å; M389-L393 HydrophobicContact CG-CD1 4.29Å; M389-L393 WeakPolarHBondContact O-CA 3.26Å; M389-L393 VanDerWaalsContact O-CB 3.27Å; M389-L393 WeakPolarHBondContact O-CB 3.32Å; M389-L393 PolarHBondContact O-N 3.35Å; M389-T394 PolarHBondContact O-N 3.14Å; M389-F478 HydrophobicContact SD-CZ 4.47Å
390	I	89.2	Confident	89.9	Confident	14 Å²	14	47.8 Å²	47.8	7%	0.072	25%	0.251	C	S	.	.	I	π-helix	trans	-63.2	-49	179.8	-60.6	-54.5	0	0	0	111.3	V359 F386 D387 R388 T394 S395	V359-I390 HydrophobicContact CB-CD1 4.24Å; V359-I390 HydrophobicContact CG1-CD1 3.71Å; V359-I390 HydrophobicContact CG2-CD1 4.15Å; F386-I390 HydrophobicContact CD1-CG1 4.11Å; F386-I390 HydrophobicContact CE1-CD1 4.32Å; F386-I390 HydrophobicContact CE1-CG1 3.79Å; F386-I390 HydrophobicContact CE2-CD1 4.33Å; F386-I390 HydrophobicContact CE2-CG1 4.48Å; F386-I390 HydrophobicContact CZ-CD1 4.02Å; F386-I390 HydrophobicContact CZ-CG1 4.01Å; F386-I390 WeakPolarHBondContact O-CG1 3.27Å; F386-I390 PolarHBondContact O-N 2.93Å; D387-I390 PolarHBondContact O-N 3.08Å; R388-I390 PolarHBondContact O-N 2.69Å; I390-T394 PolarHBondContact O-N 3.15Å; I390-S395 WeakPolarHBondContact O-CB 3.18Å; I390-S395 PolarHBondContact O-N 3.27Å
391	N	91	Very high	90.6	Very high	100 Å²	100	51.9 Å²	51.9	54%	0.535	26%	0.258	S	S	.	.	I	π-helix	trans	-77.7	-39.1	-172	-70.2	-45.6	0	0	0	113.2	D387 R388 S395	D387-N391 VanDerWaalsContact O-CB 3.27Å; D387-N391 WeakPolarHBondContact O-CB 3.43Å; D387-N391 VanDerWaalsContact O-CG 3.29Å; D387-N391 PolarHBondContact O-N 3.22Å; D387-N391 PolarHBondContact O-ND2 3.04Å; R388-N391 PolarHBondContact O-N 3.28Å; N391-S395 PolarHBondContact O-OG 3.17Å
392	E	94.6	Very high	91.1	Very high	54 Å²	54	48.3 Å²	48.3	25%	0.252	24%	0.239	S	C	.	.	I	π-helix	trans	-92.3	-28.6	-174.9	-57.1	-176.6	-135.2	0	0	113.3	R388 K396 R461 S464 I468	R388-E392 IonicContact CZ-OE1 2.65Å; R388-E392 IonicContact NE-OE1 3.13Å; R388-E392 PolarHBondContact NE-OE1 2.94Å; R388-E392 IonicContact NH2-OE1 3.28Å; R388-E392 PolarHBondContact NH2-OE1 3.24Å; R388-E392 IonicContact NH2-OE2 3.35Å; R388-E392 WeakPolarHBondContact O-CB 3.17Å; R388-E392 WeakPolarHBondContact O-CG 3.3Å; R388-E392 PolarHBondContact O-N 3.42Å; E392-K396 WeakPolarHBondContact O-CG 3.12Å; E392-R461 PolarHBondContact O-NH1 3.23Å; E392-S464 PolarHBondContact OE2-OG 3.48Å; E392-S464 VanDerWaalsContact OE2-OG 3.13Å; E392-I468 HydrophobicContact CB-CD1 4.14Å
393	L	93.7	Very high	91.8	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	25%	0.249	C	C	.	.	I	π-helix	trans	-108.4	-68.7	-177.9	-54.1	176.7	0	0	0	111.5	A348 M389 S395 K396 M397 L465 I468	A348-L393 HydrophobicContact CB-CB 3.74Å; A348-L393 HydrophobicContact CB-CD1 4.3Å; M389-L393 HydrophobicContact CG-CD1 4.29Å; M389-L393 WeakPolarHBondContact O-CA 3.26Å; M389-L393 VanDerWaalsContact O-CB 3.27Å; M389-L393 WeakPolarHBondContact O-CB 3.32Å; M389-L393 PolarHBondContact O-N 3.35Å; L393-S395 PolarHBondContact O-N 2.97Å; L393-K396 PolarHBondContact O-N 3.49Å; L393-K396 VanDerWaalsContact O-N 3.11Å; L393-M397 VanDerWaalsContact O-CG 3.29Å; L393-M397 WeakPolarHBondContact O-CG 3.48Å; L393-M397 PolarHBondContact O-N 3.18Å; L393-L465 HydrophobicContact CD1-CD1 3.84Å; L393-L465 HydrophobicContact CD2-CB 4.19Å; L393-I468 HydrophobicContact CD1-CD1 3.75Å; L393-I468 HydrophobicContact CD2-CD1 4.43Å; L393-I468 HydrophobicContact CG-CD1 3.77Å
394	T	91.7	Very high	92.4	Very high	1 Å²	1	49 Å²	49	1%	0.006	24%	0.239	C	C	.	.	I	π-helix	trans	-58.8	-47.7	-171.1	-60.4	0	0	0	0	112.5	A348 S351 M389 I390 K396 M397 R398	A348-T394 VanDerWaalsContact CA-OG1 3.29Å; A348-T394 WeakPolarHBondContact CA-OG1 3.39Å; A348-T394 WeakPolarHBondContact O-CG2 3.33Å; A348-T394 PolarHBondContact O-OG1 3.26Å; S351-T394 VanDerWaalsContact O-CG2 3.25Å; S351-T394 WeakPolarHBondContact O-CG2 3.5Å; M389-T394 PolarHBondContact O-N 3.14Å; I390-T394 PolarHBondContact O-N 3.15Å; T394-K396 VanDerWaalsContact C-N 3.29Å; T394-K396 PolarHBondContact O-N 3.42Å; T394-M397 PolarHBondContact O-N 3.26Å; T394-R398 WeakPolarHBondContact O-CB 3.45Å; T394-R398 PolarHBondContact O-N 3Å
395	S	91.6	Very high	92.7	Very high	24 Å²	24	47.1 Å²	47.1	17%	0.168	22%	0.222	C	C	.	.	H	α-helix	trans	-59.4	-41.5	178.6	82.8	0	0	0	0	111.5	I390 N391 L393 R398 D399	I390-S395 WeakPolarHBondContact O-CB 3.18Å; I390-S395 PolarHBondContact O-N 3.27Å; N391-S395 PolarHBondContact O-OG 3.17Å; L393-S395 PolarHBondContact O-N 2.97Å; S395-R398 WeakPolarHBondContact O-CB 3.42Å; S395-R398 PolarHBondContact O-N 2.9Å; S395-D399 WeakPolarHBondContact O-CB 3.45Å; S395-D399 PolarHBondContact O-N 3.49Å
396	K	94.8	Very high	93.2	Very high	91 Å²	91	46.8 Å²	46.8	40%	0.396	22%	0.221	S	C	.	.	H	α-helix	trans	-73.3	-38.5	-177.3	-59	-56.8	174.5	-161.1	0	112.3	E392 L393 T394 R398 D399 M400	E392-K396 WeakPolarHBondContact O-CG 3.12Å; L393-K396 PolarHBondContact O-N 3.49Å; L393-K396 VanDerWaalsContact O-N 3.11Å; T394-K396 VanDerWaalsContact C-N 3.29Å; T394-K396 PolarHBondContact O-N 3.42Å; K396-R398 VanDerWaalsContact C-N 3.34Å; K396-D399 IonicContact NZ-OD2 3.91Å; K396-M400 WeakPolarHBondContact O-CG 3.4Å; K396-M400 PolarHBondContact O-N 3.05Å; K396-M400 VanDerWaalsContact O-N 3.16Å
397	M	94.5	Very high	93.7	Very high	4 Å²	4	45.3 Å²	45.3	2%	0.02	21%	0.214	C	C	.	.	H	α-helix	trans	-63.6	-40.4	172.6	-66.1	174.7	171.1	0	0	111.2	A348 M352 L393 T394 M400 K401 M402	A348-M397 HydrophobicContact CB-CE 4.39Å; A348-M397 HydrophobicContact CB-SD 3.99Å; M352-M397 HydrophobicContact CE-CB 4.28Å; M352-M397 VanDerWaalsContact CE-O 3.32Å; M352-M397 WeakPolarHBondContact CE-O 3.19Å; M352-M397 HydrophobicContact CG-CB 3.97Å; M352-M397 HydrophobicContact SD-CB 3.47Å; M352-M397 WeakPolarHBondContact SD-CB 3.19Å; L393-M397 VanDerWaalsContact O-CG 3.29Å; L393-M397 WeakPolarHBondContact O-CG 3.48Å; L393-M397 PolarHBondContact O-N 3.18Å; T394-M397 PolarHBondContact O-N 3.26Å; M397-M400 WeakPolarHBondContact O-CG 3.45Å; M397-K401 PolarHBondContact O-N 3.46Å; M397-K401 VanDerWaalsContact O-N 3.11Å; M397-M402 HydrophobicContact CB-CB 4.19Å; M397-M402 HydrophobicContact CB-SD 4.41Å; M397-M402 HydrophobicContact CE-CE 4.26Å; M397-M402 HydrophobicContact CE-SD 4.12Å; M397-M402 HydrophobicContact CG-CE 3.8Å; M397-M402 HydrophobicContact CG-SD 3.86Å; M397-M402 PolarHBondContact O-N 3.41Å; M397-M402 HydrophobicContact SD-SD 4.14Å
398	R	94	Very high	94.1	Very high	79 Å²	79	40.9 Å²	40.9	30%	0.298	19%	0.191	S	C	.	.	H	α-helix	trans	-62.3	-52	173.7	-173.5	-169.8	-64	143.8	0.6	112.2	S351 M352 T354 T394 S395 K396 M400 K401	S351-R398 PolarHBondContact O-NH2 3.45Å; M352-R398 HydrophobicContact CG-CB 4.49Å; M352-R398 PolarHBondContact O-NE 3.42Å; M352-R398 PolarHBondContact O-NH2 2.85Å; T354-R398 PolarHBondContact O-NH2 2.93Å; T394-R398 WeakPolarHBondContact O-CB 3.45Å; T394-R398 PolarHBondContact O-N 3Å; S395-R398 WeakPolarHBondContact O-CB 3.42Å; S395-R398 PolarHBondContact O-N 2.9Å; K396-R398 VanDerWaalsContact C-N 3.34Å; R398-M400 VanDerWaalsContact C-N 3.25Å; R398-M400 PolarHBondContact O-N 3.49Å; R398-K401 PolarHBondContact O-N 3.38Å
399	D	93.5	Very high	94.3	Very high	113 Å²	113	37.3 Å²	37.3	60%	0.604	18%	0.177	S	C	*	.	H	α-helix	trans	-57	-40.7	-178.5	-69.7	-16.5	0	0	0	111.8	S395 K396 K401	S395-D399 WeakPolarHBondContact O-CB 3.45Å; S395-D399 PolarHBondContact O-N 3.49Å; K396-D399 IonicContact NZ-OD2 3.91Å; D399-K401 VanDerWaalsContact C-N 3.34Å
400	M	93.3	Very high	94.6	Very high	30 Å²	30	37.8 Å²	37.8	15%	0.148	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-3.6	-179.7	73.9	-169	-65.1	0	0	114.4	K396 M397 R398 M402 R454 K457 L458	K396-M400 WeakPolarHBondContact O-CG 3.4Å; K396-M400 PolarHBondContact O-N 3.05Å; K396-M400 VanDerWaalsContact O-N 3.16Å; M397-M400 WeakPolarHBondContact O-CG 3.45Å; R398-M400 VanDerWaalsContact C-N 3.25Å; R398-M400 PolarHBondContact O-N 3.49Å; M400-M402 HydrophobicContact CG-CB 4.17Å; M400-M402 PolarHBondContact O-N 2.91Å; M400-M402 HydrophobicContact SD-CE 4.03Å; M400-R454 PolarHBondContact O-NH1 2.86Å; M400-K457 HydrophobicContact CE-CB 4.11Å; M400-L458 HydrophobicContact CE-CB 4.4Å; M400-L458 HydrophobicContact CE-CD2 3.23Å; M400-L458 HydrophobicContact CE-CG 3.55Å; M400-L458 HydrophobicContact SD-CD2 4.15Å
401	K	94.6	Very high	95.1	Very high	171 Å²	171	37.7 Å²	37.7	74%	0.743	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	trans	48	59	-172.8	-56.6	179.6	-178.1	-178.6	0	110.3	M397 R398 D399 D403 R454	M397-K401 PolarHBondContact O-N 3.46Å; M397-K401 VanDerWaalsContact O-N 3.11Å; R398-K401 PolarHBondContact O-N 3.38Å; D399-K401 VanDerWaalsContact C-N 3.34Å; K401-D403 PolarHBondContact O-N 3.2Å; K401-R454 PolarHBondContact O-NH2 3.37Å
402	M	95.7	Very high	95.4	Very high	6 Å²	6	32.9 Å²	32.9	3%	0.03	15%	0.153	C	C	.	.			trans	-59.6	130.3	175	-177	179	-75.7	0	0	108.7	Y349 M352 M397 M400 E406 L407 L410 L458 R461	Y349-M402 WeakPolarHBondContact CE2-O 3.39Å; M352-M402 HydrophobicContact CE-CB 4.36Å; M397-M402 HydrophobicContact CB-CB 4.19Å; M397-M402 HydrophobicContact CB-SD 4.41Å; M397-M402 HydrophobicContact CE-CE 4.26Å; M397-M402 HydrophobicContact CE-SD 4.12Å; M397-M402 HydrophobicContact CG-CE 3.8Å; M397-M402 HydrophobicContact CG-SD 3.86Å; M397-M402 PolarHBondContact O-N 3.41Å; M397-M402 HydrophobicContact SD-SD 4.14Å; M400-M402 HydrophobicContact CG-CB 4.17Å; M400-M402 PolarHBondContact O-N 2.91Å; M400-M402 HydrophobicContact SD-CE 4.03Å; M402-E406 WeakPolarHBondContact CA-OE2 3.38Å; M402-E406 HydrophobicContact CG-CB 3.98Å; M402-L407 HydrophobicContact SD-CB 4.37Å; M402-L410 HydrophobicContact CE-CD1 3.5Å; M402-L410 VanDerWaalsContact CE-CD1 3.5Å; M402-L410 HydrophobicContact SD-CD1 4.13Å; M402-L458 HydrophobicContact CE-CD2 3.4Å; M402-L458 HydrophobicContact CG-CD2 4.17Å; M402-L458 HydrophobicContact SD-CD2 4.49Å; M402-R461 HydrophobicContact CE-CG 4.17Å
403	D	95.5	Very high	95.6	Very high	41 Å²	41	30.5 Å²	30.5	22%	0.219	14%	0.141	C	C	.	.			trans	-91.1	171.1	175	70.8	52.2	0	0	0	111.8	K401 T405 E406 L407 Y443	K401-D403 PolarHBondContact O-N 3.2Å; D403-T405 VanDerWaalsContact C-N 3.3Å; D403-T405 PolarHBondContact O-N 3.5Å; D403-T405 WeakPolarHBondContact OD1-CA 3.13Å; D403-T405 VanDerWaalsContact OD1-CB 3.28Å; D403-T405 WeakPolarHBondContact OD1-CB 3.44Å; D403-T405 PolarHBondContact OD1-N 3.24Å; D403-E406 PolarHBondContact N-OE2 2.98Å; D403-E406 PolarHBondContact O-N 3.03Å; D403-E406 WeakPolarHBondContact OD1-CG 3.43Å; D403-E406 PolarHBondContact OD1-N 3.41Å; D403-L407 PolarHBondContact O-N 2.96Å; D403-L407 VanDerWaalsContact O-N 3.09Å; D403-Y443 WeakPolarHBondContact OD2-CE1 3.19Å; D403-Y443 PolarHBondContact OD2-OH 2.96Å
404	R	94.7	Very high	95.8	Very high	47 Å²	47	31 Å²	31	18%	0.177	15%	0.145	C	C	.	.	H	α-helix	trans	-68.5	-29.4	-176	-164.2	170.2	-179.4	142.1	6.7	113.1	L287 E290 D294 Y349 G408	L287-R404 HydrophobicContact CD1-CB 3.91Å; L287-R404 HydrophobicContact CD1-CG 4.02Å; E290-R404 HydrophobicContact CB-CG 4.02Å; E290-R404 PolarHBondContact O-NH2 3.11Å; D294-R404 IonicContact OD1-NH2 2.91Å; D294-R404 PolarHBondContact OD1-NH2 2.91Å; D294-R404 IonicContact OD2-CZ 3.79Å; D294-R404 IonicContact OD2-NH1 2.71Å; D294-R404 PolarHBondContact OD2-NH1 3.16Å; D294-R404 VanDerWaalsContact OD2-NH1 3.13Å; D294-R404 IonicContact OD2-NH2 2.62Å; D294-R404 PolarHBondContact OD2-NH2 3.44Å; Y349-R404 WeakPolarHBondContact OH-CB 3.47Å; Y349-R404 PolarHBondContact OH-N 3.46Å; R404-G408 PolarHBondContact O-N 2.8Å; R404-G408 VanDerWaalsContact O-N 3.07Å
405	T	97.3	Very high	96.1	Very high	8 Å²	8	31 Å²	31	5%	0.049	15%	0.145	C	C	.	.	H	α-helix	trans	-71.2	-44.2	178.2	-51.7	0	0	0	0	110.1	P283 D403 L407 G408 L409 Y443	P283-T405 HydrophobicContact CB-CG2 3.64Å; D403-T405 VanDerWaalsContact C-N 3.3Å; D403-T405 PolarHBondContact O-N 3.5Å; D403-T405 WeakPolarHBondContact OD1-CA 3.13Å; D403-T405 VanDerWaalsContact OD1-CB 3.28Å; D403-T405 WeakPolarHBondContact OD1-CB 3.44Å; D403-T405 PolarHBondContact OD1-N 3.24Å; T405-L407 VanDerWaalsContact C-N 3.34Å; T405-L407 PolarHBondContact O-N 2.85Å; T405-G408 PolarHBondContact O-N 3.42Å; T405-L409 HydrophobicContact CG2-CD1 4.17Å; T405-L409 PolarHBondContact O-N 3.17Å; T405-Y443 HydrophobicContact CG2-CD1 4.37Å; T405-Y443 HydrophobicContact CG2-CD2 4.18Å; T405-Y443 HydrophobicContact CG2-CE1 4.02Å; T405-Y443 HydrophobicContact CG2-CE2 3.81Å; T405-Y443 HydrophobicContact CG2-CG 4.44Å; T405-Y443 PolarHBondContact OG1-OH 3.17Å
406	E	97.9	Very high	96.4	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-60.4	-43.9	175	-68.8	170.1	160.6	0	0	111.8	M402 D403 G408 L409 L410 L440 Y443 R454 L458	M402-E406 WeakPolarHBondContact CA-OE2 3.38Å; M402-E406 HydrophobicContact CG-CB 3.98Å; D403-E406 PolarHBondContact N-OE2 2.98Å; D403-E406 PolarHBondContact O-N 3.03Å; D403-E406 WeakPolarHBondContact OD1-CG 3.43Å; D403-E406 PolarHBondContact OD1-N 3.41Å; E406-G408 VanDerWaalsContact C-N 3.35Å; E406-G408 PolarHBondContact O-N 2.72Å; E406-L409 PolarHBondContact O-N 3Å; E406-L410 WeakPolarHBondContact O-CG 3.49Å; E406-L410 PolarHBondContact O-N 2.96Å; E406-L440 HydrophobicContact CB-CD1 4.42Å; E406-L440 HydrophobicContact CG-CD1 4.19Å; E406-Y443 HydrophobicContact CG-CD1 4.11Å; E406-Y443 HydrophobicContact CG-CE1 3.94Å; E406-R454 IonicContact OE1-CZ 2.86Å; E406-R454 IonicContact OE1-NE 3.73Å; E406-R454 PolarHBondContact OE1-NE 3Å; E406-R454 IonicContact OE1-NH2 3.75Å; E406-R454 PolarHBondContact OE1-NH2 3.37Å; E406-R454 IonicContact OE2-CZ 3.33Å; E406-R454 IonicContact OE2-NE 3.63Å; E406-R454 IonicContact OE2-NH2 2.77Å; E406-R454 PolarHBondContact OE2-NH2 3.21Å; E406-L458 HydrophobicContact CB-CD1 4.29Å; E406-L458 HydrophobicContact CB-CD2 4.16Å; E406-L458 HydrophobicContact CG-CD1 3.95Å; E406-L458 HydrophobicContact CG-CD2 4.49Å
407	L	96.7	Very high	96.5	Very high	1 Å²	1	27 Å²	27	1%	0.005	13%	0.126	C	C	.	.	H	α-helix	trans	-55.8	-50.9	172.5	175.6	69.4	0	0	0	110.9	W346 Y349 M402 D403 T405 L409 L410 R411	W346-L407 HydrophobicContact CE3-CD2 3.75Å; W346-L407 HydrophobicContact CZ3-CD2 3.92Å; Y349-L407 HydrophobicContact CD1-CD2 3.52Å; Y349-L407 HydrophobicContact CD2-CB 4.03Å; Y349-L407 HydrophobicContact CD2-CD1 4.32Å; Y349-L407 HydrophobicContact CD2-CD2 3.79Å; Y349-L407 HydrophobicContact CD2-CG 4.23Å; Y349-L407 HydrophobicContact CE1-CD2 4.1Å; Y349-L407 HydrophobicContact CE2-CB 4.28Å; Y349-L407 HydrophobicContact CE2-CD2 4.31Å; Y349-L407 HydrophobicContact CG-CB 4.47Å; Y349-L407 HydrophobicContact CG-CD1 4.22Å; Y349-L407 HydrophobicContact CG-CD2 3.37Å; Y349-L407 HydrophobicContact CG-CG 4.19Å; M402-L407 HydrophobicContact SD-CB 4.37Å; D403-L407 PolarHBondContact O-N 2.96Å; D403-L407 VanDerWaalsContact O-N 3.09Å; T405-L407 VanDerWaalsContact C-N 3.34Å; T405-L407 PolarHBondContact O-N 2.85Å; L407-L409 VanDerWaalsContact C-N 3.3Å; L407-L409 PolarHBondContact O-N 2.66Å; L407-L410 PolarHBondContact O-N 2.82Å; L407-R411 HydrophobicContact CD1-CG 4.31Å; L407-R411 HydrophobicContact CG-CG 4.43Å; L407-R411 WeakPolarHBondContact O-CB 3.24Å; L407-R411 WeakPolarHBondContact O-CD 3.23Å; L407-R411 VanDerWaalsContact O-CG 3.24Å; L407-R411 WeakPolarHBondContact O-CG 3.41Å; L407-R411 PolarHBondContact O-N 3.01Å
408	G	97.2	Very high	96.6	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-61.6	-37.8	-178.8	0	0	0	0	0	113.1	E290 R404 T405 E406 R411 A412	E290-G408 VanDerWaalsContact OE1-CA 3.29Å; E290-G408 WeakPolarHBondContact OE1-CA 3.18Å; R404-G408 PolarHBondContact O-N 2.8Å; R404-G408 VanDerWaalsContact O-N 3.07Å; T405-G408 PolarHBondContact O-N 3.42Å; E406-G408 VanDerWaalsContact C-N 3.35Å; E406-G408 PolarHBondContact O-N 2.72Å; G408-R411 PolarHBondContact O-N 3.35Å; G408-A412 WeakPolarHBondContact O-CB 3.5Å; G408-A412 PolarHBondContact O-N 3.17Å
409	L	98.1	Very high	96.7	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-69.8	-41.1	176.1	-76.4	165.9	0	0	0	112.1	I286 T405 E406 L407 R411 A412 I413 C439 L440	I286-L409 HydrophobicContact CG1-CD2 3.91Å; I286-L409 HydrophobicContact CG1-CG 4.39Å; I286-L409 HydrophobicContact CG2-CD2 4.49Å; I286-L409 HydrophobicContact CG2-CG 4.13Å; T405-L409 HydrophobicContact CG2-CD1 4.17Å; T405-L409 PolarHBondContact O-N 3.17Å; E406-L409 PolarHBondContact O-N 3Å; L407-L409 VanDerWaalsContact C-N 3.3Å; L407-L409 PolarHBondContact O-N 2.66Å; L409-R411 VanDerWaalsContact C-N 3.33Å; L409-R411 PolarHBondContact O-N 3.47Å; L409-A412 PolarHBondContact O-N 2.84Å; L409-I413 WeakPolarHBondContact O-CD1 3.28Å; L409-I413 VanDerWaalsContact O-CG1 3.3Å; L409-I413 WeakPolarHBondContact O-CG1 3.48Å; L409-I413 PolarHBondContact O-N 3.26Å; L409-C439 HydrophobicContact CD2-CB 3.98Å; L409-L440 HydrophobicContact CB-CB 4.17Å; L409-L440 HydrophobicContact CB-CD1 3.9Å; L409-L440 HydrophobicContact CB-CD2 4.48Å; L409-L440 HydrophobicContact CB-CG 4.4Å; L409-L440 HydrophobicContact CD1-CB 4Å; L409-L440 HydrophobicContact CD1-CD1 3.71Å; L409-L440 HydrophobicContact CD1-CG 4.48Å; L409-L440 HydrophobicContact CG-CD1 4.45Å
410	L	98.1	Very high	96.7	Very high	9 Å²	9	25.1 Å²	25.1	5%	0.047	12%	0.123	C	C	.	.	H	α-helix	trans	-61.1	-42.3	172	-72.9	177.7	0	0	0	111.5	M402 E406 L407 I413 V414 L440 L458 M459 L462	M402-L410 HydrophobicContact CE-CD1 3.5Å; M402-L410 VanDerWaalsContact CE-CD1 3.5Å; M402-L410 HydrophobicContact SD-CD1 4.13Å; E406-L410 WeakPolarHBondContact O-CG 3.49Å; E406-L410 PolarHBondContact O-N 2.96Å; L407-L410 PolarHBondContact O-N 2.82Å; L410-I413 HydrophobicContact CD2-CD1 4.46Å; L410-I413 WeakPolarHBondContact O-CB 3.25Å; L410-I413 PolarHBondContact O-N 3.45Å; L410-V414 WeakPolarHBondContact O-CG2 3.43Å; L410-V414 PolarHBondContact O-N 3.17Å; L410-L440 HydrophobicContact CD2-CD2 4Å; L410-L440 HydrophobicContact CG-CD2 4.43Å; L410-L458 HydrophobicContact CD1-CB 4.42Å; L410-L458 HydrophobicContact CD1-CD2 4.29Å; L410-L458 HydrophobicContact CD2-CB 4.4Å; L410-M459 HydrophobicContact CD2-SD 4.34Å; L410-L462 HydrophobicContact CD2-CD1 4.48Å; L410-L462 HydrophobicContact CD2-CD2 4.17Å; L410-L462 HydrophobicContact CD2-CG 4.28Å
411	R	97.7	Very high	96.8	Very high	12 Å²	12	27.7 Å²	27.7	5%	0.045	15%	0.149	C	C	.	.	H	α-helix	trans	-64.5	-39.1	175.2	-70.2	162.1	59.8	77.4	-0.8	112	E290 W316 L342 S345 L407 G408 L409 I413 V414 L415	E290-R411 VanDerWaalsContact OE1-CD 3.28Å; E290-R411 WeakPolarHBondContact OE1-CD 3.49Å; E290-R411 IonicContact OE1-CZ 3.39Å; E290-R411 IonicContact OE1-NE 3.26Å; E290-R411 PolarHBondContact OE1-NE 3.47Å; E290-R411 IonicContact OE2-NE 2.66Å; W316-R411 HydrophobicContact CH2-CB 3.8Å; W316-R411 HydrophobicContact CZ2-CB 3.52Å; L342-R411 HydrophobicContact CD2-CB 3.95Å; L342-R411 HydrophobicContact CD2-CG 4.4Å; L342-R411 WeakPolarHBondContact CD2-O 3.3Å; L342-R411 PolarHBondContact O-NH1 2.86Å; S345-R411 WeakPolarHBondContact OG-CG 3.33Å; S345-R411 PolarHBondContact OG-NH1 3.39Å; L407-R411 HydrophobicContact CD1-CG 4.31Å; L407-R411 HydrophobicContact CG-CG 4.43Å; L407-R411 WeakPolarHBondContact O-CB 3.24Å; L407-R411 WeakPolarHBondContact O-CD 3.23Å; L407-R411 VanDerWaalsContact O-CG 3.24Å; L407-R411 WeakPolarHBondContact O-CG 3.41Å; L407-R411 PolarHBondContact O-N 3.01Å; G408-R411 PolarHBondContact O-N 3.35Å; L409-R411 VanDerWaalsContact C-N 3.33Å; L409-R411 PolarHBondContact O-N 3.47Å; R411-I413 VanDerWaalsContact C-N 3.35Å; R411-V414 PolarHBondContact O-N 3.36Å; R411-L415 WeakPolarHBondContact O-CB 3.27Å; R411-L415 PolarHBondContact O-N 2.79Å
412	A	98	Very high	96.7	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-62.8	-40.7	174.2	0	0	0	0	0	111.8	G408 L409 L415 F416 A436	G408-A412 WeakPolarHBondContact O-CB 3.5Å; G408-A412 PolarHBondContact O-N 3.17Å; L409-A412 PolarHBondContact O-N 2.84Å; A412-L415 PolarHBondContact O-N 2.9Å; A412-F416 HydrophobicContact CB-CD2 4.41Å; A412-F416 HydrophobicContact CB-CE2 4.39Å; A412-F416 WeakPolarHBondContact O-CD2 3.49Å; A412-F416 PolarHBondContact O-N 3.47Å; A412-A436 HydrophobicContact CB-CB 4.47Å
413	I	98.3	Very high	96.5	Very high	3 Å²	3	21.4 Å²	21.4	2%	0.015	13%	0.134	C	C	.	.	H	α-helix	trans	-60.9	-44	174.4	-70.9	160.7	0	0	0	111.3	L409 L410 R411 R433 A436 Y437 L440 M459 L462	L409-I413 WeakPolarHBondContact O-CD1 3.28Å; L409-I413 VanDerWaalsContact O-CG1 3.3Å; L409-I413 WeakPolarHBondContact O-CG1 3.48Å; L409-I413 PolarHBondContact O-N 3.26Å; L410-I413 HydrophobicContact CD2-CD1 4.46Å; L410-I413 WeakPolarHBondContact O-CB 3.25Å; L410-I413 PolarHBondContact O-N 3.45Å; R411-I413 VanDerWaalsContact C-N 3.35Å; I413-R433 PolarHBondContact O-NE 3.43Å; I413-R433 VanDerWaalsContact O-NE 3.11Å; I413-R433 PolarHBondContact O-NH2 3.42Å; I413-A436 HydrophobicContact CG1-CB 3.75Å; I413-Y437 HydrophobicContact CB-CE1 4.24Å; I413-Y437 HydrophobicContact CD1-CD1 3.56Å; I413-Y437 HydrophobicContact CD1-CE1 3.69Å; I413-Y437 HydrophobicContact CG1-CD1 3.84Å; I413-Y437 HydrophobicContact CG1-CE1 3.73Å; I413-Y437 HydrophobicContact CG2-CD1 4.41Å; I413-Y437 HydrophobicContact CG2-CE1 3.46Å; I413-Y437 VanDerWaalsContact CG2-CE1 3.46Å; I413-L440 HydrophobicContact CD1-CD2 4.04Å; I413-M459 HydrophobicContact CD1-SD 4.06Å; I413-L462 HydrophobicContact CG2-CD1 3.76Å
414	V	98.1	Very high	96.4	Very high	12 Å²	12	25 Å²	25	7%	0.073	15%	0.148	C	C	.	.	H	α-helix	trans	-62	-45	174.9	170.8	0	0	0	0	110.6	E341 L342 L410 R411 L462 L465	E341-V414 HydrophobicContact CB-CG1 3.71Å; L342-V414 HydrophobicContact CD2-CB 4.23Å; L342-V414 HydrophobicContact CD2-CG1 4.04Å; L342-V414 HydrophobicContact CG-CG1 4.13Å; L410-V414 WeakPolarHBondContact O-CG2 3.43Å; L410-V414 PolarHBondContact O-N 3.17Å; R411-V414 PolarHBondContact O-N 3.36Å; V414-L462 HydrophobicContact CG2-CD2 3.69Å; V414-L465 HydrophobicContact CG2-CD2 4.03Å
415	L	98.1	Very high	96.2	Very high	0 Å²	0	23 Å²	23	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-64	-48.9	-178.7	178.8	67.6	0	0	0	112.5	W316 A317 L320 F323 L334 L335 L342 R411 A412 N417	W316-L415 HydrophobicContact CH2-CB 4.13Å; W316-L415 HydrophobicContact CH2-CD2 4.01Å; W316-L415 HydrophobicContact CZ3-CB 4.34Å; W316-L415 HydrophobicContact CZ3-CD1 4.43Å; W316-L415 HydrophobicContact CZ3-CD2 3.79Å; W316-L415 HydrophobicContact CZ3-CG 4.42Å; A317-L415 HydrophobicContact CB-CD2 4.14Å; L320-L415 HydrophobicContact CD1-CD2 3.44Å; L320-L415 VanDerWaalsContact CD1-CD2 3.44Å; F323-L415 HydrophobicContact CD2-CD2 3.77Å; F323-L415 HydrophobicContact CE2-CD1 4.25Å; F323-L415 HydrophobicContact CE2-CD2 3.89Å; F323-L415 HydrophobicContact CE2-CG 4.35Å; L334-L415 HydrophobicContact CB-CD1 4.14Å; L334-L415 WeakPolarHBondContact CD2-O 3.4Å; L335-L415 HydrophobicContact CD2-CD1 3.79Å; L335-L415 HydrophobicContact CG-CD1 4.26Å; L342-L415 HydrophobicContact CD1-CD1 4.01Å; L342-L415 HydrophobicContact CD2-CB 4.41Å; R411-L415 WeakPolarHBondContact O-CB 3.27Å; R411-L415 PolarHBondContact O-N 2.79Å; A412-L415 PolarHBondContact O-N 2.9Å; L415-N417 PolarHBondContact O-N 3.28Å
416	F	97.9	Very high	96	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	15%	0.153	C	C	.	.			trans	-78.4	58.3	-176.1	-67.8	-59.6	0	0	0	112	M281 F323 L326 L334 A412 S418 V429 Y432 R433	M281-F416 HydrophobicContact CE-CD2 4.46Å; M281-F416 HydrophobicContact CE-CE2 4Å; F323-F416 HydrophobicContact CB-CE1 4.43Å; F323-F416 HydrophobicContact CB-CZ 4.26Å; F323-F416 HydrophobicContact CD2-CE1 4.12Å; F323-F416 HydrophobicContact CD2-CZ 4.5Å; L326-F416 HydrophobicContact CD1-CE1 4.26Å; L334-F416 HydrophobicContact CD1-CD1 4.42Å; A412-F416 HydrophobicContact CB-CD2 4.41Å; A412-F416 HydrophobicContact CB-CE2 4.39Å; A412-F416 WeakPolarHBondContact O-CD2 3.49Å; A412-F416 PolarHBondContact O-N 3.47Å; F416-S418 PolarHBondContact O-N 3.38Å; F416-V429 HydrophobicContact CB-CG1 4.07Å; F416-V429 WeakPolarHBondContact O-CG1 2.95Å; F416-Y432 HydrophobicContact CD1-CD2 4.37Å; F416-Y432 HydrophobicContact CE1-CD2 4.2Å; F416-R433 HydrophobicContact CB-CB 3.94Å; F416-R433 WeakPolarHBondContact O-CB 3.31Å; F416-R433 PolarHBondContact O-NE 3.46Å; F416-R433 PolarHBondContact O-NH2 2.95Å
417	N	97.1	Very high	95.7	Very high	31 Å²	31	26.4 Å²	26.4	17%	0.166	16%	0.163	C	C	.	.			trans	-85.4	98.2	179.8	-165.7	19	0	0	0	114	L334 N337 L415 D419 T420 L423 R433	L334-N417 WeakPolarHBondContact CD2-O 3.42Å; N337-N417 PolarHBondContact ND2-ND2 2.75Å; N337-N417 VanDerWaalsContact ND2-ND2 3.17Å; L415-N417 PolarHBondContact O-N 3.28Å; N417-D419 PolarHBondContact O-N 3.21Å; N417-D419 PolarHBondContact OD1-N 2.82Å; N417-T420 VanDerWaalsContact O-CB 3.28Å; N417-T420 WeakPolarHBondContact O-CB 3.35Å; N417-T420 PolarHBondContact O-N 3.35Å; N417-T420 VanDerWaalsContact O-N 3.07Å; N417-T420 PolarHBondContact O-OG1 2.74Å; N417-L423 WeakPolarHBondContact O-CD1 3.35Å; N417-R433 VanDerWaalsContact CA-CZ 3.47Å; N417-R433 VanDerWaalsContact CB-NH2 3.25Å; N417-R433 PolarHBondContact OD1-NH1 3.03Å; N417-R433 PolarHBondContact OD1-NH2 3.05Å; N417-R433 VanDerWaalsContact OD1-NH2 3.15Å
418	S	96.5	Very high	95.5	Very high	12 Å²	12	27 Å²	27	8%	0.084	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-23.8	177.8	50.1	0	0	0	0	113.9	F416 T420 S426	F416-S418 PolarHBondContact O-N 3.38Å; S418-T420 PolarHBondContact O-N 2.93Å; S418-S426 PolarHBondContact O-OG 3.06Å
419	D	95.9	Very high	95.4	Very high	135 Å²	135	27 Å²	27	72%	0.722	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.7	-1.7	178.3	-57.2	-39	0	0	0	113.3	N417 A421	N417-D419 PolarHBondContact O-N 3.21Å; N417-D419 PolarHBondContact OD1-N 2.82Å; D419-A421 PolarHBondContact O-N 3.24Å
420	T	95.2	Very high	95.3	Very high	9 Å²	9	31.1 Å²	31.1	6%	0.055	19%	0.185	C	C	.	.			trans	-61.3	122.4	177.9	-56.8	0	0	0	0	110	L333 N337 N417 S418 G422 L423	L333-T420 HydrophobicContact CB-CG2 4.11Å; N337-T420 HydrophobicContact CB-CG2 3.68Å; N417-T420 VanDerWaalsContact O-CB 3.28Å; N417-T420 WeakPolarHBondContact O-CB 3.35Å; N417-T420 PolarHBondContact O-N 3.35Å; N417-T420 VanDerWaalsContact O-N 3.07Å; N417-T420 PolarHBondContact O-OG1 2.74Å; S418-T420 PolarHBondContact O-N 2.93Å; T420-G422 PolarHBondContact O-N 3.33Å; T420-L423 HydrophobicContact CG2-CG 4.34Å; T420-L423 VanDerWaalsContact O-CG 3.3Å; T420-L423 WeakPolarHBondContact O-CG 3.28Å
421	A	94.3	Very high	95.1	Very high	85 Å²	85	32.6 Å²	32.6	70%	0.702	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.8	134.8	178.8	0	0	0	0	0	111.3	D419	D419-A421 PolarHBondContact O-N 3.24Å
422	G	92.3	Very high	95	Very high	43 Å²	43	32.2 Å²	32.2	44%	0.443	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	94.8	-3.8	176.5	0	0	0	0	0	115.3	Y181 T420 K424	Y181-G422 WeakPolarHBondContact OH-CA 3.4Å; Y181-G422 PolarHBondContact OH-N 3.26Å; T420-G422 PolarHBondContact O-N 3.33Å; G422-K424 PolarHBondContact O-N 3.01Å
423	L	92.7	Very high	95	Very high	2 Å²	2	33.9 Å²	33.9	1%	0.01	20%	0.202	C	C	.	.			trans	-61.2	135.5	176.9	-69.9	176.7	0	0	0	112	Y181 D330 L333 L334 N417 T420 V429	Y181-L423 VanDerWaalsContact CE2-O 3.25Å; Y181-L423 WeakPolarHBondContact CE2-O 3.23Å; Y181-L423 PolarHBondContact OH-N 3.32Å; Y181-L423 PolarHBondContact OH-O 3.27Å; D330-L423 HydrophobicContact CB-CD2 3.79Å; L333-L423 HydrophobicContact CB-CD2 4.34Å; L334-L423 HydrophobicContact CD2-CD1 4.04Å; L334-L423 HydrophobicContact CD2-CD2 3.94Å; L334-L423 HydrophobicContact CG-CD2 4.04Å; N417-L423 WeakPolarHBondContact O-CD1 3.35Å; T420-L423 HydrophobicContact CG2-CG 4.34Å; T420-L423 VanDerWaalsContact O-CG 3.3Å; T420-L423 WeakPolarHBondContact O-CG 3.28Å; L423-V429 HydrophobicContact CD1-CB 4.46Å; L423-V429 HydrophobicContact CD1-CG1 4.47Å; L423-V429 HydrophobicContact CD1-CG2 4.19Å
424	K	91.8	Very high	94.9	Very high	117 Å²	117	38.6 Å²	38.6	51%	0.509	22%	0.223	S	C	.	.	S	Bend	trans	-82.7	-35.5	171.8	-60.8	171.5	-173.8	172.8	0	111.1	E329 D330 G422	E329-K424 VanDerWaalsContact CD-NZ 3.35Å; E329-K424 IonicContact OE2-NZ 2.71Å; E329-K424 PolarHBondContact OE2-NZ 2.87Å; D330-K424 PolarHBondContact OD1-N 2.87Å; D330-K424 PolarHBondContact OD2-N 3.5Å; G422-K424 PolarHBondContact O-N 3.01Å
425	C	91.3	Very high	94.7	Very high	5 Å²	5	42.7 Å²	42.7	3%	0.034	24%	0.238	C	C	.	.			trans	-114.3	42.9	-173	-60.3	0	0	0	0	113.2	M246 L326 D330 T427 M428 V429	M246-C425 WeakPolarHBondContact CG-SG 3.32Å; L326-C425 HydrophobicContact CD2-CB 4.13Å; D330-C425 WeakPolarHBondContact OD2-CB 3.47Å; D330-C425 PolarHBondContact OD2-N 3.39Å; C425-T427 VanDerWaalsContact C-N 3.28Å; C425-T427 PolarHBondContact O-N 2.76Å; C425-M428 HydrophobicContact CB-CB 4.07Å; C425-M428 HydrophobicContact CB-CG 4.2Å; C425-M428 WeakPolarHBondContact O-CB 3.33Å; C425-M428 PolarHBondContact O-N 3.05Å; C425-V429 PolarHBondContact O-N 3.43Å; C425-V429 VanDerWaalsContact O-N 3.14Å
426	S	92.9	Very high	94.7	Very high	43 Å²	43	42.7 Å²	42.7	30%	0.301	24%	0.238	S	C	.	.	H	α-helix	trans	-53.7	-39.3	-175	174.6	0	0	0	0	113.7	S418 M428 V429 E430	S418-S426 PolarHBondContact O-OG 3.06Å; S426-M428 VanDerWaalsContact C-N 3.33Å; S426-M428 PolarHBondContact O-N 3.43Å; S426-V429 PolarHBondContact O-N 2.97Å; S426-E430 PolarHBondContact O-N 3.24Å
427	T	91.7	Very high	94.7	Very high	36 Å²	36	46 Å²	46	22%	0.221	25%	0.251	C	S	.	.	H	α-helix	trans	-65.3	-32.2	176.8	51.6	0	0	0	0	113.8	K250 C425 S431	K250-T427 HydrophobicContact CG-CG2 4.3Å; C425-T427 VanDerWaalsContact C-N 3.28Å; C425-T427 PolarHBondContact O-N 2.76Å; T427-S431 PolarHBondContact O-N 2.96Å; T427-S431 VanDerWaalsContact O-N 3.16Å
428	M	92.4	Very high	94.7	Very high	13 Å²	13	49.5 Å²	49.5	6%	0.064	27%	0.269	C	S	.	.	H	α-helix	trans	-70.6	-43.9	174.3	-69.7	-65.5	-64.1	0	0	110.8	L245 L326 C425 S426 E430 S431 Y432	L245-M428 HydrophobicContact CB-CG 3.92Å; L245-M428 HydrophobicContact CB-SD 3.21Å; L245-M428 WeakPolarHBondContact CB-SD 3.24Å; L245-M428 HydrophobicContact CD1-CE 4.01Å; L245-M428 HydrophobicContact CD1-SD 3.28Å; L245-M428 WeakPolarHBondContact CD1-SD 3.38Å; L245-M428 HydrophobicContact CD2-SD 4.36Å; L245-M428 HydrophobicContact CG-SD 3.75Å; L326-M428 HydrophobicContact CD2-CB 4.15Å; C425-M428 HydrophobicContact CB-CB 4.07Å; C425-M428 HydrophobicContact CB-CG 4.2Å; C425-M428 WeakPolarHBondContact O-CB 3.33Å; C425-M428 PolarHBondContact O-N 3.05Å; S426-M428 VanDerWaalsContact C-N 3.33Å; S426-M428 PolarHBondContact O-N 3.43Å; M428-E430 VanDerWaalsContact C-N 3.31Å; M428-E430 PolarHBondContact O-N 2.88Å; M428-S431 PolarHBondContact O-N 3.07Å; M428-Y432 HydrophobicContact CB-CE2 4.17Å; M428-Y432 HydrophobicContact CE-CE1 3.88Å; M428-Y432 HydrophobicContact CE-CE2 4.16Å; M428-Y432 WeakPolarHBondContact CE-OH 3.37Å; M428-Y432 VanDerWaalsContact O-CD2 3.26Å; M428-Y432 WeakPolarHBondContact O-CD2 3.21Å; M428-Y432 PolarHBondContact O-N 2.95Å
429	V	95.1	Very high	94.7	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-60.4	-44	178	177.1	0	0	0	0	110.5	L326 L334 F416 L423 C425 S426 Y432 R433	L326-V429 HydrophobicContact CD1-CG2 3.97Å; L326-V429 HydrophobicContact CD2-CG2 3.85Å; L334-V429 HydrophobicContact CD1-CG1 4.36Å; L334-V429 HydrophobicContact CD1-CG2 4.09Å; L334-V429 HydrophobicContact CD2-CG1 3.91Å; L334-V429 HydrophobicContact CD2-CG2 4.48Å; F416-V429 HydrophobicContact CB-CG1 4.07Å; F416-V429 WeakPolarHBondContact O-CG1 2.95Å; L423-V429 HydrophobicContact CD1-CB 4.46Å; L423-V429 HydrophobicContact CD1-CG1 4.47Å; L423-V429 HydrophobicContact CD1-CG2 4.19Å; C425-V429 PolarHBondContact O-N 3.43Å; C425-V429 VanDerWaalsContact O-N 3.14Å; S426-V429 PolarHBondContact O-N 2.97Å; V429-Y432 PolarHBondContact O-N 3.47Å; V429-R433 PolarHBondContact O-N 2.9Å
430	E	95.7	Very high	94.7	Very high	86 Å²	86	43.1 Å²	43.1	40%	0.402	24%	0.235	S	C	.	.	H	α-helix	trans	-57.2	-49.1	173.8	-174.2	172.6	-150.7	0	0	111.5	S426 M428 Y432 R433 E434	S426-E430 PolarHBondContact O-N 3.24Å; M428-E430 VanDerWaalsContact C-N 3.31Å; M428-E430 PolarHBondContact O-N 2.88Å; E430-Y432 VanDerWaalsContact C-N 3.3Å; E430-Y432 PolarHBondContact O-N 3.23Å; E430-R433 WeakPolarHBondContact O-CB 3.4Å; E430-R433 PolarHBondContact O-N 3.29Å; E430-R433 VanDerWaalsContact O-N 3.13Å; E430-E434 WeakPolarHBondContact O-CG 3.07Å; E430-E434 PolarHBondContact O-N 3.07Å
431	S	94.6	Very high	94.8	Very high	40 Å²	40	46 Å²	46	28%	0.28	25%	0.248	S	C	.	.	H	α-helix	trans	-61	-36.3	176.7	-174.8	0	0	0	0	113.1	T427 M428 R435	T427-S431 PolarHBondContact O-N 2.96Å; T427-S431 VanDerWaalsContact O-N 3.16Å; M428-S431 PolarHBondContact O-N 3.07Å; S431-R435 VanDerWaalsContact O-CG 3.32Å; S431-R435 WeakPolarHBondContact O-CG 3.44Å; S431-R435 PolarHBondContact O-N 3.08Å; S431-R435 VanDerWaalsContact O-N 3.11Å
432	Y	95.5	Very high	94.9	Very high	5 Å²	5	46.2 Å²	46.2	2%	0.02	23%	0.234	C	C	.	.	H	α-helix	trans	-70.3	-36.3	176	-59.9	-30.7	0	0	0	112.4	M281 H322 D325 L326 F416 M428 V429 E430 R435 A436	M281-Y432 VanDerWaalsContact CE-O 3.32Å; M281-Y432 WeakPolarHBondContact CE-O 3.33Å; H322-Y432 HydrophobicContact CB-CD1 3.64Å; H322-Y432 HydrophobicContact CB-CD2 3.97Å; H322-Y432 HydrophobicContact CB-CE1 3.45Å; H322-Y432 VanDerWaalsContact CB-CE1 3.45Å; H322-Y432 HydrophobicContact CB-CE2 3.79Å; H322-Y432 HydrophobicContact CB-CG 3.89Å; H322-Y432 AromaticContact CD2-CD1 3.76Å; H322-Y432 AromaticContact CD2-CE1 3.96Å; H322-Y432 AromaticContact CG-CD1 3.72Å; H322-Y432 AromaticContact CG-CE1 3.52Å; H322-Y432 AromaticContact ND1-CE1 3.97Å; D325-Y432 WeakPolarHBondContact CB-OH 3.49Å; L326-Y432 HydrophobicContact CD1-CD2 4.42Å; L326-Y432 HydrophobicContact CD1-CE2 4.42Å; L326-Y432 HydrophobicContact CD2-CD2 4.27Å; L326-Y432 HydrophobicContact CD2-CE2 3.72Å; L326-Y432 HydrophobicContact CG-CD2 4.41Å; L326-Y432 HydrophobicContact CG-CE2 3.93Å; F416-Y432 HydrophobicContact CD1-CD2 4.37Å; F416-Y432 HydrophobicContact CE1-CD2 4.2Å; M428-Y432 HydrophobicContact CB-CE2 4.17Å; M428-Y432 HydrophobicContact CE-CE1 3.88Å; M428-Y432 HydrophobicContact CE-CE2 4.16Å; M428-Y432 WeakPolarHBondContact CE-OH 3.37Å; M428-Y432 VanDerWaalsContact O-CD2 3.26Å; M428-Y432 WeakPolarHBondContact O-CD2 3.21Å; M428-Y432 PolarHBondContact O-N 2.95Å; V429-Y432 PolarHBondContact O-N 3.47Å; E430-Y432 VanDerWaalsContact C-N 3.3Å; E430-Y432 PolarHBondContact O-N 3.23Å; Y432-R435 PolarHBondContact O-N 2.75Å; Y432-A436 PolarHBondContact O-N 3.44Å; Y432-A436 VanDerWaalsContact O-N 3.11Å
433	R	97	Very high	95.1	Very high	35 Å²	35	46 Å²	46	13%	0.132	22%	0.221	C	C	.	.	H	α-helix	trans	-64	-43.9	172.1	173.4	179.2	-88.9	177.4	-7.5	111.7	I413 F416 N417 V429 E430 R435 A436 Y437	I413-R433 PolarHBondContact O-NE 3.43Å; I413-R433 VanDerWaalsContact O-NE 3.11Å; I413-R433 PolarHBondContact O-NH2 3.42Å; F416-R433 HydrophobicContact CB-CB 3.94Å; F416-R433 WeakPolarHBondContact O-CB 3.31Å; F416-R433 PolarHBondContact O-NE 3.46Å; F416-R433 PolarHBondContact O-NH2 2.95Å; N417-R433 VanDerWaalsContact CA-CZ 3.47Å; N417-R433 VanDerWaalsContact CB-NH2 3.25Å; N417-R433 PolarHBondContact OD1-NH1 3.03Å; N417-R433 PolarHBondContact OD1-NH2 3.05Å; N417-R433 VanDerWaalsContact OD1-NH2 3.15Å; V429-R433 PolarHBondContact O-N 2.9Å; E430-R433 WeakPolarHBondContact O-CB 3.4Å; E430-R433 PolarHBondContact O-N 3.29Å; E430-R433 VanDerWaalsContact O-N 3.13Å; R433-R435 VanDerWaalsContact C-N 3.3Å; R433-R435 PolarHBondContact O-N 3.32Å; R433-A436 WeakPolarHBondContact O-CA 3.36Å; R433-A436 WeakPolarHBondContact O-CB 3.43Å; R433-A436 PolarHBondContact O-N 3.25Å; R433-Y437 WeakPolarHBondContact CD-OH 3.42Å; R433-Y437 HydrophobicContact CG-CD2 4.28Å; R433-Y437 HydrophobicContact CG-CE1 4.45Å; R433-Y437 HydrophobicContact CG-CE2 3.58Å; R433-Y437 PolarHBondContact O-N 3.09Å
434	E	96	Very high	95.3	Very high	101 Å²	101	46.3 Å²	46.3	47%	0.472	22%	0.222	S	C	.	.	H	α-helix	trans	-58.7	-41.5	174.5	-71.7	176.6	170	0	0	112.3	E430 A436 Y437 N438	E430-E434 WeakPolarHBondContact O-CG 3.07Å; E430-E434 PolarHBondContact O-N 3.07Å; E434-A436 VanDerWaalsContact C-N 3.28Å; E434-A436 PolarHBondContact O-N 2.99Å; E434-Y437 WeakPolarHBondContact O-CB 3.06Å; E434-Y437 PolarHBondContact O-N 3.2Å; E434-N438 PolarHBondContact O-N 3.35Å
435	R	95.7	Very high	95.5	Very high	99 Å²	99	46 Å²	46	37%	0.374	22%	0.221	S	C	.	.	H	α-helix	trans	-61.4	-37	173.7	-69.4	171.3	-170.6	-140.8	-11.5	112.2	M281 H322 S431 Y432 R433 C439	M281-R435 HydrophobicContact CB-CB 3.96Å; M281-R435 HydrophobicContact CE-CB 4.22Å; H322-R435 PolarHBondContact CE1-NH1 3.48Å; H322-R435 PolarHBondContact NE2-NH1 3.31Å; S431-R435 VanDerWaalsContact O-CG 3.32Å; S431-R435 WeakPolarHBondContact O-CG 3.44Å; S431-R435 PolarHBondContact O-N 3.08Å; S431-R435 VanDerWaalsContact O-N 3.11Å; Y432-R435 PolarHBondContact O-N 2.75Å; R433-R435 VanDerWaalsContact C-N 3.3Å; R433-R435 PolarHBondContact O-N 3.32Å; R435-C439 WeakPolarHBondContact O-CB 3.35Å; R435-C439 PolarHBondContact O-N 2.81Å
436	A	97.3	Very high	95.7	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-66.6	-38.8	174.5	0	0	0	0	0	112.1	M281 A412 I413 Y432 R433 E434 L440	M281-A436 HydrophobicContact CE-CB 4.03Å; A412-A436 HydrophobicContact CB-CB 4.47Å; I413-A436 HydrophobicContact CG1-CB 3.75Å; Y432-A436 PolarHBondContact O-N 3.44Å; Y432-A436 VanDerWaalsContact O-N 3.11Å; R433-A436 WeakPolarHBondContact O-CA 3.36Å; R433-A436 WeakPolarHBondContact O-CB 3.43Å; R433-A436 PolarHBondContact O-N 3.25Å; E434-A436 VanDerWaalsContact C-N 3.28Å; E434-A436 PolarHBondContact O-N 2.99Å; A436-L440 WeakPolarHBondContact O-CB 3.45Å; A436-L440 PolarHBondContact O-N 2.93Å
437	Y	97.4	Very high	95.8	Very high	70 Å²	70	52.7 Å²	52.7	28%	0.275	25%	0.251	S	S	.	.	H	α-helix	trans	-59.8	-51.7	172.8	-65.4	-41.3	0	0	0	111.8	I413 R433 E434 C439 L440 E441 M459	I413-Y437 HydrophobicContact CB-CE1 4.24Å; I413-Y437 HydrophobicContact CD1-CD1 3.56Å; I413-Y437 HydrophobicContact CD1-CE1 3.69Å; I413-Y437 HydrophobicContact CG1-CD1 3.84Å; I413-Y437 HydrophobicContact CG1-CE1 3.73Å; I413-Y437 HydrophobicContact CG2-CD1 4.41Å; I413-Y437 HydrophobicContact CG2-CE1 3.46Å; I413-Y437 VanDerWaalsContact CG2-CE1 3.46Å; R433-Y437 WeakPolarHBondContact CD-OH 3.42Å; R433-Y437 HydrophobicContact CG-CD2 4.28Å; R433-Y437 HydrophobicContact CG-CE1 4.45Å; R433-Y437 HydrophobicContact CG-CE2 3.58Å; R433-Y437 PolarHBondContact O-N 3.09Å; E434-Y437 WeakPolarHBondContact O-CB 3.06Å; E434-Y437 PolarHBondContact O-N 3.2Å; Y437-C439 VanDerWaalsContact C-N 3.33Å; Y437-C439 PolarHBondContact O-N 2.8Å; Y437-L440 PolarHBondContact O-N 3.49Å; Y437-E441 WeakPolarHBondContact O-CB 3.39Å; Y437-E441 PolarHBondContact O-N 3.02Å; Y437-M459 HydrophobicContact CD1-CE 4.01Å; Y437-M459 HydrophobicContact CD1-SD 4.18Å; Y437-M459 HydrophobicContact CE1-CE 3.44Å; Y437-M459 VanDerWaalsContact CE1-CE 3.44Å; Y437-M459 HydrophobicContact CE1-SD 4.11Å
438	N	96.6	Very high	95.8	Very high	103 Å²	103	52.1 Å²	52.1	55%	0.551	25%	0.248	S	C	*	.	H	α-helix	trans	-62.3	-42.2	-179.2	-65.3	-17.7	0	0	0	111.6	E434 L440 E441 E442	E434-N438 PolarHBondContact O-N 3.35Å; N438-L440 PolarHBondContact O-N 3.43Å; N438-E441 PolarHBondContact O-N 2.74Å; N438-E442 VanDerWaalsContact O-CB 3.31Å; N438-E442 WeakPolarHBondContact O-CB 3.19Å; N438-E442 PolarHBondContact O-N 3.18Å
439	C	96.8	Very high	95.9	Very high	14 Å²	14	56.2 Å²	56.2	10%	0.095	28%	0.276	C	S	.	.	H	α-helix	trans	-60.4	-45.3	176.5	-175.4	0	0	0	0	111.6	M281 L409 R435 Y437 Y443	M281-C439 HydrophobicContact CB-CB 4.31Å; M281-C439 HydrophobicContact CG-CB 3.87Å; M281-C439 PolarHBondContact O-SG 3.48Å; L409-C439 HydrophobicContact CD2-CB 3.98Å; R435-C439 WeakPolarHBondContact O-CB 3.35Å; R435-C439 PolarHBondContact O-N 2.81Å; Y437-C439 VanDerWaalsContact C-N 3.33Å; Y437-C439 PolarHBondContact O-N 2.8Å; C439-Y443 WeakPolarHBondContact O-CB 3.45Å; C439-Y443 PolarHBondContact O-N 2.93Å
440	L	97.5	Very high	95.9	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-67.1	-41.7	178.4	-176.9	60.1	0	0	0	112.8	E406 L409 L410 I413 A436 Y437 N438 Y443 C444 F455 L458 M459	E406-L440 HydrophobicContact CB-CD1 4.42Å; E406-L440 HydrophobicContact CG-CD1 4.19Å; L409-L440 HydrophobicContact CB-CB 4.17Å; L409-L440 HydrophobicContact CB-CD1 3.9Å; L409-L440 HydrophobicContact CB-CD2 4.48Å; L409-L440 HydrophobicContact CB-CG 4.4Å; L409-L440 HydrophobicContact CD1-CB 4Å; L409-L440 HydrophobicContact CD1-CD1 3.71Å; L409-L440 HydrophobicContact CD1-CG 4.48Å; L409-L440 HydrophobicContact CG-CD1 4.45Å; L410-L440 HydrophobicContact CD2-CD2 4Å; L410-L440 HydrophobicContact CG-CD2 4.43Å; I413-L440 HydrophobicContact CD1-CD2 4.04Å; A436-L440 WeakPolarHBondContact O-CB 3.45Å; A436-L440 PolarHBondContact O-N 2.93Å; Y437-L440 PolarHBondContact O-N 3.49Å; N438-L440 PolarHBondContact O-N 3.43Å; L440-Y443 PolarHBondContact O-N 2.78Å; L440-C444 WeakPolarHBondContact O-CB 3.45Å; L440-C444 PolarHBondContact O-N 3.1Å; L440-C444 PolarHBondContact O-SG 3.19Å; L440-F455 HydrophobicContact CB-CD2 4.29Å; L440-F455 HydrophobicContact CB-CE2 4.09Å; L440-F455 HydrophobicContact CD2-CD2 4.17Å; L440-F455 HydrophobicContact CD2-CE2 4.08Å; L440-F455 HydrophobicContact CG-CD2 3.91Å; L440-F455 HydrophobicContact CG-CE2 4.07Å; L440-L458 HydrophobicContact CD1-CD1 4.03Å; L440-L458 HydrophobicContact CG-CD1 4.48Å; L440-M459 HydrophobicContact CD2-SD 4.44Å
441	E	97	Very high	95.8	Very high	69 Å²	69	60.9 Å²	60.9	32%	0.322	31%	0.309	S	S	.	.	H	α-helix	trans	-62	-47.1	177.6	-167.8	-171.1	162.8	0	0	111	Y437 N438 C444 K445 F455	Y437-E441 WeakPolarHBondContact O-CB 3.39Å; Y437-E441 PolarHBondContact O-N 3.02Å; N438-E441 PolarHBondContact O-N 2.74Å; E441-C444 PolarHBondContact O-N 2.91Å; E441-K445 WeakPolarHBondContact O-CG 3.36Å; E441-K445 PolarHBondContact O-N 3.34Å; E441-K445 VanDerWaalsContact O-N 3.1Å; E441-K445 VanDerWaalsContact OE1-CE 3.26Å; E441-K445 WeakPolarHBondContact OE1-CE 3.37Å; E441-K445 IonicContact OE1-NZ 3.6Å; E441-K445 PolarHBondContact OE1-NZ 3.28Å; E441-F455 HydrophobicContact CB-CD2 3.79Å; E441-F455 HydrophobicContact CB-CE2 3.9Å; E441-F455 HydrophobicContact CB-CG 4.14Å; E441-F455 HydrophobicContact CB-CZ 4.34Å; E441-F455 HydrophobicContact CG-CB 4.5Å; E441-F455 HydrophobicContact CG-CD1 4.3Å; E441-F455 HydrophobicContact CG-CD2 4.27Å; E441-F455 HydrophobicContact CG-CG 4.1Å
442	E	95.8	Very high	95.7	Very high	90 Å²	90	65 Å²	65	42%	0.421	34%	0.335	S	S	.	.	H	α-helix	trans	-66.5	-42.3	179	-172.4	55	-149.2	0	0	111.7	N438 C444 K445 Q446	N438-E442 VanDerWaalsContact O-CB 3.31Å; N438-E442 WeakPolarHBondContact O-CB 3.19Å; N438-E442 PolarHBondContact O-N 3.18Å; E442-C444 VanDerWaalsContact C-N 3.34Å; E442-C444 PolarHBondContact O-N 3.32Å; E442-K445 WeakPolarHBondContact O-CB 3.39Å; E442-K445 PolarHBondContact O-N 2.89Å; E442-Q446 WeakPolarHBondContact O-CG 3.36Å; E442-Q446 PolarHBondContact O-N 3.2Å; E442-Q446 PolarHBondContact OE1-NE2 3.04Å
443	Y	97	Very high	95.6	Very high	39 Å²	39	66.5 Å²	66.5	15%	0.153	35%	0.351	C	S	.	.	H	α-helix	trans	-56.6	-47.3	174	-176.1	-102.4	0	0	0	111.6	P283 D403 T405 E406 C439 L440 K445 Q446 T447	P283-Y443 HydrophobicContact CB-CD2 3.65Å; P283-Y443 HydrophobicContact CB-CE2 4.03Å; P283-Y443 HydrophobicContact CB-CG 4.43Å; P283-Y443 HydrophobicContact CG-CD2 4.05Å; D403-Y443 WeakPolarHBondContact OD2-CE1 3.19Å; D403-Y443 PolarHBondContact OD2-OH 2.96Å; T405-Y443 HydrophobicContact CG2-CD1 4.37Å; T405-Y443 HydrophobicContact CG2-CD2 4.18Å; T405-Y443 HydrophobicContact CG2-CE1 4.02Å; T405-Y443 HydrophobicContact CG2-CE2 3.81Å; T405-Y443 HydrophobicContact CG2-CG 4.44Å; T405-Y443 PolarHBondContact OG1-OH 3.17Å; E406-Y443 HydrophobicContact CG-CD1 4.11Å; E406-Y443 HydrophobicContact CG-CE1 3.94Å; C439-Y443 WeakPolarHBondContact O-CB 3.45Å; C439-Y443 PolarHBondContact O-N 2.93Å; L440-Y443 PolarHBondContact O-N 2.78Å; Y443-K445 VanDerWaalsContact C-N 3.34Å; Y443-K445 PolarHBondContact O-N 2.81Å; Y443-Q446 PolarHBondContact O-N 3.45Å; Y443-T447 HydrophobicContact CD1-CG2 4.29Å; Y443-T447 HydrophobicContact CD2-CG2 3.91Å; Y443-T447 HydrophobicContact CE1-CG2 3.91Å; Y443-T447 HydrophobicContact CE2-CG2 3.49Å; Y443-T447 VanDerWaalsContact CE2-CG2 3.49Å; Y443-T447 HydrophobicContact CG-CG2 4.3Å; Y443-T447 PolarHBondContact O-N 2.85Å; Y443-T447 PolarHBondContact O-OG1 3.2Å
444	C	96.9	Very high	95.6	Very high	7 Å²	7	65.3 Å²	65.3	5%	0.047	35%	0.347	C	S	.	.	H	α-helix	trans	-59.4	-43.5	177.5	-69.9	0	0	0	0	112.3	L440 E441 E442 Q446 T448 F455 L458	L440-C444 WeakPolarHBondContact O-CB 3.45Å; L440-C444 PolarHBondContact O-N 3.1Å; L440-C444 PolarHBondContact O-SG 3.19Å; E441-C444 PolarHBondContact O-N 2.91Å; E442-C444 VanDerWaalsContact C-N 3.34Å; E442-C444 PolarHBondContact O-N 3.32Å; C444-Q446 VanDerWaalsContact C-N 3.28Å; C444-Q446 PolarHBondContact O-N 3.14Å; C444-T448 CarbonylContact O-C 3.59Å; C444-T448 WeakPolarHBondContact O-CA 3.28Å; C444-T448 PolarHBondContact O-N 2.95Å; C444-T448 PolarHBondContact O-OG1 3Å; C444-F455 HydrophobicContact CB-CB 4.44Å; C444-L458 VanDerWaalsContact SG-CD1 3.53Å
445	K	95.4	Very high	95.6	Very high	111 Å²	111	62.9 Å²	62.9	48%	0.483	34%	0.335	S	S	.	.	H	α-helix	trans	-61.3	-38	178.1	-73.2	171.2	-175.9	164.4	0	111.7	E441 E442 Y443	E441-K445 WeakPolarHBondContact O-CG 3.36Å; E441-K445 PolarHBondContact O-N 3.34Å; E441-K445 VanDerWaalsContact O-N 3.1Å; E441-K445 VanDerWaalsContact OE1-CE 3.26Å; E441-K445 WeakPolarHBondContact OE1-CE 3.37Å; E441-K445 IonicContact OE1-NZ 3.6Å; E441-K445 PolarHBondContact OE1-NZ 3.28Å; E442-K445 WeakPolarHBondContact O-CB 3.39Å; E442-K445 PolarHBondContact O-N 2.89Å; Y443-K445 VanDerWaalsContact C-N 3.34Å; Y443-K445 PolarHBondContact O-N 2.81Å
446	Q	95	Very high	95.7	Very high	126 Å²	126	60.8 Å²	60.8	59%	0.589	34%	0.338	S	S	*	.	H	α-helix	trans	-78.8	-45.6	-178.6	-67.9	178.3	18.2	0	0	113.1	E442 Y443 C444	E442-Q446 WeakPolarHBondContact O-CG 3.36Å; E442-Q446 PolarHBondContact O-N 3.2Å; E442-Q446 PolarHBondContact OE1-NE2 3.04Å; Y443-Q446 PolarHBondContact O-N 3.45Å; C444-Q446 VanDerWaalsContact C-N 3.28Å; C444-Q446 PolarHBondContact O-N 3.14Å
447	T	95.5	Very high	95.7	Very high	62 Å²	62	66.4 Å²	66.4	38%	0.38	36%	0.363	S	S	.	.	H	α-helix	trans	-85.6	-28.7	-173.4	60.2	0	0	0	0	113.7	Y443 P449	Y443-T447 HydrophobicContact CD1-CG2 4.29Å; Y443-T447 HydrophobicContact CD2-CG2 3.91Å; Y443-T447 HydrophobicContact CE1-CG2 3.91Å; Y443-T447 HydrophobicContact CE2-CG2 3.49Å; Y443-T447 VanDerWaalsContact CE2-CG2 3.49Å; Y443-T447 HydrophobicContact CG-CG2 4.3Å; Y443-T447 PolarHBondContact O-N 2.85Å; Y443-T447 PolarHBondContact O-OG1 3.2Å; T447-P449 VanDerWaalsContact C-CD 3.49Å
448	T	92.8	Very high	95.7	Very high	25 Å²	25	63 Å²	63	15%	0.153	35%	0.35	C	S	.	.			trans	-136.4	56	-175.3	58.9	0	0	0	0	112.8	C444 S450 Q451 R454	C444-T448 CarbonylContact O-C 3.59Å; C444-T448 WeakPolarHBondContact O-CA 3.28Å; C444-T448 PolarHBondContact O-N 2.95Å; C444-T448 PolarHBondContact O-OG1 3Å; T448-S450 PolarHBondContact O-N 3.3Å; T448-Q451 PolarHBondContact O-N 3.44Å; T448-R454 WeakPolarHBondContact OG1-CD 3.43Å
449	P	93.4	Very high	95.7	Very high	99 Å²	99	60.2 Å²	60.2	64%	0.643	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-20.8	-177.3	24.3	-35	0	0	0	113.8	T447 Q451	T447-P449 VanDerWaalsContact C-CD 3.49Å; P449-Q451 PolarHBondContact O-N 3.49Å
450	S	95	Very high	95.8	Very high	103 Å²	103	64.7 Å²	64.7	72%	0.72	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-13	175.6	59.9	0	0	0	0	114.3	T448 P452	T448-S450 PolarHBondContact O-N 3.3Å; S450-P452 WeakPolarHBondContact O-CD 3.36Å
451	Q	93.4	Very high	95.7	Very high	80 Å²	80	66.9 Å²	66.9	37%	0.374	36%	0.364	S	S	.	.			trans	-123.1	76.7	-176.8	-62.1	-173	19	0	0	111.2	T448 P449 G453 R454	T448-Q451 PolarHBondContact O-N 3.44Å; P449-Q451 PolarHBondContact O-N 3.49Å; Q451-G453 PolarHBondContact O-N 2.58Å; Q451-R454 HydrophobicContact CB-CB 4.03Å; Q451-R454 VanDerWaalsContact O-CB 3.27Å; Q451-R454 WeakPolarHBondContact O-CB 3.42Å; Q451-R454 PolarHBondContact O-N 2.92Å
452	P	92.1	Very high	95.7	Very high	128 Å²	128	65 Å²	65	83%	0.831	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-24.6	-176.5	23.5	-34.4	0	0	0	113.7	S450	S450-P452 WeakPolarHBondContact O-CD 3.36Å
453	G	94.5	Very high	95.8	Very high	35 Å²	35	64.5 Å²	64.5	36%	0.361	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	6.1	175.7	0	0	0	0	0	115.4	Q451 A456 K457	Q451-G453 PolarHBondContact O-N 2.58Å; G453-A456 PolarHBondContact O-N 3.1Å; G453-K457 WeakPolarHBondContact O-CG 3.42Å; G453-K457 PolarHBondContact O-N 3.08Å
454	R	96.8	Very high	95.8	Very high	10 Å²	10	63.8 Å²	63.8	4%	0.038	36%	0.362	C	S	.	.	H	α-helix	trans	-63	-45.4	-173.6	-171.7	177.9	-178.7	81.4	-1.6	112.6	M400 K401 E406 T448 Q451 A456 K457 L458	M400-R454 PolarHBondContact O-NH1 2.86Å; K401-R454 PolarHBondContact O-NH2 3.37Å; E406-R454 IonicContact OE1-CZ 2.86Å; E406-R454 IonicContact OE1-NE 3.73Å; E406-R454 PolarHBondContact OE1-NE 3Å; E406-R454 IonicContact OE1-NH2 3.75Å; E406-R454 PolarHBondContact OE1-NH2 3.37Å; E406-R454 IonicContact OE2-CZ 3.33Å; E406-R454 IonicContact OE2-NE 3.63Å; E406-R454 IonicContact OE2-NH2 2.77Å; E406-R454 PolarHBondContact OE2-NH2 3.21Å; T448-R454 WeakPolarHBondContact OG1-CD 3.43Å; Q451-R454 HydrophobicContact CB-CB 4.03Å; Q451-R454 VanDerWaalsContact O-CB 3.27Å; Q451-R454 WeakPolarHBondContact O-CB 3.42Å; Q451-R454 PolarHBondContact O-N 2.92Å; R454-A456 VanDerWaalsContact C-N 3.33Å; R454-A456 PolarHBondContact O-N 3.45Å; R454-K457 WeakPolarHBondContact O-CB 3.18Å; R454-K457 PolarHBondContact O-N 2.93Å; R454-K457 VanDerWaalsContact O-N 3.1Å; R454-L458 HydrophobicContact CG-CD1 4.16Å; R454-L458 HydrophobicContact CG-CG 4.44Å; R454-L458 WeakPolarHBondContact O-CG 3.33Å; R454-L458 PolarHBondContact O-N 3.41Å
455	F	97.1	Very high	95.8	Very high	51 Å²	51	63.8 Å²	63.8	22%	0.224	36%	0.361	C	S	.	.	H	α-helix	trans	-53.2	-50.5	175.6	174.8	-104.2	0	0	0	111.6	L440 E441 C444 K457 L458 M459	L440-F455 HydrophobicContact CB-CD2 4.29Å; L440-F455 HydrophobicContact CB-CE2 4.09Å; L440-F455 HydrophobicContact CD2-CD2 4.17Å; L440-F455 HydrophobicContact CD2-CE2 4.08Å; L440-F455 HydrophobicContact CG-CD2 3.91Å; L440-F455 HydrophobicContact CG-CE2 4.07Å; E441-F455 HydrophobicContact CB-CD2 3.79Å; E441-F455 HydrophobicContact CB-CE2 3.9Å; E441-F455 HydrophobicContact CB-CG 4.14Å; E441-F455 HydrophobicContact CB-CZ 4.34Å; E441-F455 HydrophobicContact CG-CB 4.5Å; E441-F455 HydrophobicContact CG-CD1 4.3Å; E441-F455 HydrophobicContact CG-CD2 4.27Å; E441-F455 HydrophobicContact CG-CG 4.1Å; C444-F455 HydrophobicContact CB-CB 4.44Å; F455-K457 PolarHBondContact O-N 3.02Å; F455-L458 WeakPolarHBondContact O-CB 3.26Å; F455-L458 PolarHBondContact O-N 2.95Å; F455-M459 HydrophobicContact CD1-CG 4.44Å; F455-M459 HydrophobicContact CD2-CG 4.48Å; F455-M459 HydrophobicContact CE1-CG 4.04Å; F455-M459 HydrophobicContact CE2-CG 4.09Å; F455-M459 HydrophobicContact CE2-SD 4.34Å; F455-M459 HydrophobicContact CZ-CG 3.86Å; F455-M459 HydrophobicContact CZ-SD 4.28Å; F455-M459 WeakPolarHBondContact O-CG 3.45Å; F455-M459 PolarHBondContact O-N 2.92Å
456	A	97.3	Very high	95.9	Very high	54 Å²	54	63.6 Å²	63.6	45%	0.446	36%	0.357	S	S	.	.	H	α-helix	trans	-61.4	-40.9	177.7	0	0	0	0	0	112.5	G453 R454 L458 M459 L460	G453-A456 PolarHBondContact O-N 3.1Å; R454-A456 VanDerWaalsContact C-N 3.33Å; R454-A456 PolarHBondContact O-N 3.45Å; A456-L458 PolarHBondContact O-N 3.13Å; A456-M459 PolarHBondContact O-N 2.7Å; A456-L460 VanDerWaalsContact O-CG 3.3Å; A456-L460 WeakPolarHBondContact O-CG 3.35Å; A456-L460 PolarHBondContact O-N 3.4Å
457	K	96.4	Very high	96	Very high	118 Å²	118	60.1 Å²	60.1	51%	0.513	35%	0.347	S	S	.	.	H	α-helix	trans	-61.9	-40.9	176.6	-72.8	176	-179.1	-178.6	0	112.6	M400 G453 R454 F455 L460	M400-K457 HydrophobicContact CE-CB 4.11Å; G453-K457 WeakPolarHBondContact O-CG 3.42Å; G453-K457 PolarHBondContact O-N 3.08Å; R454-K457 WeakPolarHBondContact O-CB 3.18Å; R454-K457 PolarHBondContact O-N 2.93Å; R454-K457 VanDerWaalsContact O-N 3.1Å; F455-K457 PolarHBondContact O-N 3.02Å; K457-L460 PolarHBondContact O-N 3.3Å
458	L	97.5	Very high	96	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-63.6	-47.5	175.5	-70.2	166.9	0	0	0	110.7	M400 M402 E406 L410 L440 C444 R454 F455 A456 L460 R461	M400-L458 HydrophobicContact CE-CB 4.4Å; M400-L458 HydrophobicContact CE-CD2 3.23Å; M400-L458 HydrophobicContact CE-CG 3.55Å; M400-L458 HydrophobicContact SD-CD2 4.15Å; M402-L458 HydrophobicContact CE-CD2 3.4Å; M402-L458 HydrophobicContact CG-CD2 4.17Å; M402-L458 HydrophobicContact SD-CD2 4.49Å; E406-L458 HydrophobicContact CB-CD1 4.29Å; E406-L458 HydrophobicContact CB-CD2 4.16Å; E406-L458 HydrophobicContact CG-CD1 3.95Å; E406-L458 HydrophobicContact CG-CD2 4.49Å; L410-L458 HydrophobicContact CD1-CB 4.42Å; L410-L458 HydrophobicContact CD1-CD2 4.29Å; L410-L458 HydrophobicContact CD2-CB 4.4Å; L440-L458 HydrophobicContact CD1-CD1 4.03Å; L440-L458 HydrophobicContact CG-CD1 4.48Å; C444-L458 VanDerWaalsContact SG-CD1 3.53Å; R454-L458 HydrophobicContact CG-CD1 4.16Å; R454-L458 HydrophobicContact CG-CG 4.44Å; R454-L458 WeakPolarHBondContact O-CG 3.33Å; R454-L458 PolarHBondContact O-N 3.41Å; F455-L458 WeakPolarHBondContact O-CB 3.26Å; F455-L458 PolarHBondContact O-N 2.95Å; A456-L458 PolarHBondContact O-N 3.13Å; L458-L460 VanDerWaalsContact C-N 3.26Å; L458-L460 PolarHBondContact O-N 3.49Å; L458-R461 VanDerWaalsContact O-CB 3.28Å; L458-R461 WeakPolarHBondContact O-CB 3.27Å; L458-R461 WeakPolarHBondContact O-CG 3.44Å; L458-R461 PolarHBondContact O-N 3.31Å
459	M	97.8	Very high	96.1	Very high	44 Å²	44	56 Å²	56	22%	0.217	32%	0.322	C	S	.	.	H	α-helix	trans	-59.4	-35.6	178.1	-71.8	-55	-63.7	0	0	113	L410 I413 Y437 L440 F455 A456 R461 L462 P463	L410-M459 HydrophobicContact CD2-SD 4.34Å; I413-M459 HydrophobicContact CD1-SD 4.06Å; Y437-M459 HydrophobicContact CD1-CE 4.01Å; Y437-M459 HydrophobicContact CD1-SD 4.18Å; Y437-M459 HydrophobicContact CE1-CE 3.44Å; Y437-M459 VanDerWaalsContact CE1-CE 3.44Å; Y437-M459 HydrophobicContact CE1-SD 4.11Å; L440-M459 HydrophobicContact CD2-SD 4.44Å; F455-M459 HydrophobicContact CD1-CG 4.44Å; F455-M459 HydrophobicContact CD2-CG 4.48Å; F455-M459 HydrophobicContact CE1-CG 4.04Å; F455-M459 HydrophobicContact CE2-CG 4.09Å; F455-M459 HydrophobicContact CE2-SD 4.34Å; F455-M459 HydrophobicContact CZ-CG 3.86Å; F455-M459 HydrophobicContact CZ-SD 4.28Å; F455-M459 WeakPolarHBondContact O-CG 3.45Å; F455-M459 PolarHBondContact O-N 2.92Å; A456-M459 PolarHBondContact O-N 2.7Å; M459-R461 PolarHBondContact O-N 3.03Å; M459-R461 VanDerWaalsContact O-N 3.09Å; M459-L462 HydrophobicContact CE-CD1 3.63Å; M459-L462 WeakPolarHBondContact O-CB 3.4Å; M459-L462 PolarHBondContact O-N 2.89Å; M459-L462 VanDerWaalsContact O-N 3.12Å; M459-L462 HydrophobicContact SD-CD1 4.13Å; M459-P463 WeakPolarHBondContact O-CD 3.37Å
460	L	97.1	Very high	96.1	Very high	107 Å²	107	55.5 Å²	55.5	56%	0.56	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-1.6	175.5	-71.5	171.9	0	0	0	114.3	A456 K457 L458	A456-L460 VanDerWaalsContact O-CG 3.3Å; A456-L460 WeakPolarHBondContact O-CG 3.35Å; A456-L460 PolarHBondContact O-N 3.4Å; K457-L460 PolarHBondContact O-N 3.3Å; L458-L460 VanDerWaalsContact C-N 3.26Å; L458-L460 PolarHBondContact O-N 3.49Å
461	R	96.7	Very high	96	Very high	47 Å²	47	51.8 Å²	51.8	18%	0.177	29%	0.289	C	S	.	.	H	α-helix	trans	-80.7	-28	169.6	-57.6	-57.1	83.3	-144.7	-4.5	112.3	E392 M402 L458 M459 S464 L465	E392-R461 PolarHBondContact O-NH1 3.23Å; M402-R461 HydrophobicContact CE-CG 4.17Å; L458-R461 VanDerWaalsContact O-CB 3.28Å; L458-R461 WeakPolarHBondContact O-CB 3.27Å; L458-R461 WeakPolarHBondContact O-CG 3.44Å; L458-R461 PolarHBondContact O-N 3.31Å; M459-R461 PolarHBondContact O-N 3.03Å; M459-R461 VanDerWaalsContact O-N 3.09Å; R461-S464 PolarHBondContact O-N 2.75Å; R461-L465 WeakPolarHBondContact O-CB 3.42Å; R461-L465 PolarHBondContact O-N 2.93Å
462	L	97.3	Very high	95.8	Very high	29 Å²	29	48.2 Å²	48.2	15%	0.152	27%	0.273	C	S	.	.	H	α-helix	trans	-62.3	-39.2	-177.2	-59.7	178.6	0	0	0	113.8	L410 I413 V414 M459 L465 R466	L410-L462 HydrophobicContact CD2-CD1 4.48Å; L410-L462 HydrophobicContact CD2-CD2 4.17Å; L410-L462 HydrophobicContact CD2-CG 4.28Å; I413-L462 HydrophobicContact CG2-CD1 3.76Å; V414-L462 HydrophobicContact CG2-CD2 3.69Å; M459-L462 HydrophobicContact CE-CD1 3.63Å; M459-L462 WeakPolarHBondContact O-CB 3.4Å; M459-L462 PolarHBondContact O-N 2.89Å; M459-L462 VanDerWaalsContact O-N 3.12Å; M459-L462 HydrophobicContact SD-CD1 4.13Å; L462-L465 HydrophobicContact CD2-CD2 4.36Å; L462-L465 PolarHBondContact O-N 2.87Å; L462-R466 WeakPolarHBondContact O-CB 3.12Å; L462-R466 PolarHBondContact O-N 3.05Å
463	P	97.5	Very high	95.6	Very high	80 Å²	80	48 Å²	48	52%	0.519	26%	0.256	S	S	.	.	H	α-helix	trans	-63.3	-44.6	176.6	-25	35.8	0	0	0	113.8	M459 L465 R466 S467	M459-P463 WeakPolarHBondContact O-CD 3.37Å; P463-L465 VanDerWaalsContact C-N 3.35Å; P463-R466 PolarHBondContact O-N 3.31Å; P463-S467 WeakPolarHBondContact O-CB 3.24Å; P463-S467 PolarHBondContact O-N 3.27Å
464	S	96.9	Very high	95.2	Very high	24 Å²	24	49.5 Å²	49.5	17%	0.168	27%	0.265	C	S	.	.	H	α-helix	trans	-62.9	-43.5	174.3	-74.6	0	0	0	0	110.9	E392 R461 R466 S467 I468	E392-S464 PolarHBondContact OE2-OG 3.48Å; E392-S464 VanDerWaalsContact OE2-OG 3.13Å; R461-S464 PolarHBondContact O-N 2.75Å; S464-R466 VanDerWaalsContact C-N 3.33Å; S464-R466 PolarHBondContact O-N 2.82Å; S464-S467 PolarHBondContact O-N 3.11Å; S464-I468 WeakPolarHBondContact O-CG1 3.47Å; S464-I468 PolarHBondContact O-N 2.84Å
465	L	97.4	Very high	94.5	Very high	7 Å²	7	49 Å²	49	4%	0.037	26%	0.263	C	S	.	.	H	α-helix	trans	-58.4	-45.6	176.6	-179.9	63.2	0	0	0	111.5	E341 L344 L393 V414 R461 L462 P463 I468 G469	E341-L465 HydrophobicContact CB-CD1 4.45Å; E341-L465 HydrophobicContact CB-CD2 4.15Å; E341-L465 HydrophobicContact CB-CG 4.05Å; E341-L465 HydrophobicContact CG-CG 4.25Å; L344-L465 HydrophobicContact CB-CD1 3.74Å; L393-L465 HydrophobicContact CD1-CD1 3.84Å; L393-L465 HydrophobicContact CD2-CB 4.19Å; V414-L465 HydrophobicContact CG2-CD2 4.03Å; R461-L465 WeakPolarHBondContact O-CB 3.42Å; R461-L465 PolarHBondContact O-N 2.93Å; L462-L465 HydrophobicContact CD2-CD2 4.36Å; L462-L465 PolarHBondContact O-N 2.87Å; P463-L465 VanDerWaalsContact C-N 3.35Å; L465-I468 PolarHBondContact O-N 3.24Å; L465-G469 PolarHBondContact O-N 3.46Å
466	R	97.2	Very high	93.4	Very high	106 Å²	106	51.5 Å²	51.5	40%	0.4	29%	0.285	S	S	.	.	H	α-helix	trans	-61.5	-45.2	176.5	-179.8	59.3	177.5	161.1	1.9	111.8	E341 L462 P463 S464 G469 L470	E341-R466 WeakPolarHBondContact OE1-CD 3.33Å; E341-R466 IonicContact OE1-CZ 3.95Å; E341-R466 IonicContact OE1-NE 3.57Å; E341-R466 IonicContact OE1-NH1 2.72Å; E341-R466 PolarHBondContact OE1-NH1 2.96Å; L462-R466 WeakPolarHBondContact O-CB 3.12Å; L462-R466 PolarHBondContact O-N 3.05Å; P463-R466 PolarHBondContact O-N 3.31Å; S464-R466 VanDerWaalsContact C-N 3.33Å; S464-R466 PolarHBondContact O-N 2.82Å; R466-G469 PolarHBondContact O-N 3.05Å; R466-L470 HydrophobicContact CG-CD1 4.39Å; R466-L470 WeakPolarHBondContact O-CG 3.39Å; R466-L470 PolarHBondContact O-N 2.87Å
467	S	96.9	Very high	92.4	Very high	54 Å²	54	52.1 Å²	52.1	38%	0.378	29%	0.286	S	S	.	.	H	α-helix	trans	-61.9	-43.8	179.2	-175.2	0	0	0	0	112.3	R388 P463 S464 A471	R388-S467 PolarHBondContact NH2-OG 3Å; P463-S467 WeakPolarHBondContact O-CB 3.24Å; P463-S467 PolarHBondContact O-N 3.27Å; S464-S467 PolarHBondContact O-N 3.11Å; S467-A471 PolarHBondContact O-N 3.49Å
468	I	94.6	Very high	91.5	Very high	0 Å²	0	47 Å²	47	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-70.6	-42.4	177.4	-64.3	161.3	0	0	0	110.4	L344 I385 R388 E392 L393 S464 L465 L470 A471 C472	L344-I468 HydrophobicContact CD1-CG2 4.07Å; L344-I468 HydrophobicContact CD2-CG2 4.32Å; I385-I468 HydrophobicContact CG2-CG2 4.05Å; R388-I468 HydrophobicContact CB-CD1 4.21Å; R388-I468 HydrophobicContact CB-CG1 4.08Å; E392-I468 HydrophobicContact CB-CD1 4.14Å; L393-I468 HydrophobicContact CD1-CD1 3.75Å; L393-I468 HydrophobicContact CD2-CD1 4.43Å; L393-I468 HydrophobicContact CG-CD1 3.77Å; S464-I468 WeakPolarHBondContact O-CG1 3.47Å; S464-I468 PolarHBondContact O-N 2.84Å; L465-I468 PolarHBondContact O-N 3.24Å; I468-L470 VanDerWaalsContact C-N 3.29Å; I468-L470 PolarHBondContact O-N 3.24Å; I468-A471 WeakPolarHBondContact O-CA 3.4Å; I468-A471 WeakPolarHBondContact O-CB 3.4Å; I468-A471 PolarHBondContact O-N 2.88Å; I468-C472 PolarHBondContact O-N 3.05Å; I468-C472 VanDerWaalsContact O-N 3.14Å; I468-C472 PolarHBondContact O-SG 3.38Å
469	G	94.3	Very high	90.6	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-57.7	-39.9	176.3	0	0	0	0	0	113.1	N340 L344 L465 R466 C472	N340-G469 VanDerWaalsContact ND2-C 3.26Å; N340-G469 PolarHBondContact ND2-O 2.95Å; L344-G469 VanDerWaalsContact CD1-CA 3.47Å; L465-G469 PolarHBondContact O-N 3.46Å; R466-G469 PolarHBondContact O-N 3.05Å; G469-C472 WeakPolarHBondContact O-CB 3.42Å; G469-C472 PolarHBondContact O-N 2.74Å
470	L	94	Very high	89.8	Confident	88 Å²	88	46 Å²	46	46%	0.461	26%	0.26	S	S	.	.	H	α-helix	trans	-65.7	-36.8	173.3	-73	173.5	0	0	0	112.5	R466 I468 C472 Y473	R466-L470 HydrophobicContact CG-CD1 4.39Å; R466-L470 WeakPolarHBondContact O-CG 3.39Å; R466-L470 PolarHBondContact O-N 2.87Å; I468-L470 VanDerWaalsContact C-N 3.29Å; I468-L470 PolarHBondContact O-N 3.24Å; L470-C472 VanDerWaalsContact C-N 3.27Å; L470-C472 PolarHBondContact O-N 3.11Å; L470-Y473 PolarHBondContact O-N 3.33Å
471	A	92.3	Very high	89.2	Confident	26 Å²	26	44.5 Å²	44.5	22%	0.215	26%	0.256	C	S	.	.	H	α-helix	trans	-65.2	-30	177.2	0	0	0	0	0	112.6	I385 S467 I468 Y473 A474	I385-A471 HydrophobicContact CD1-CB 4.24Å; I385-A471 WeakPolarHBondContact CD1-O 3.28Å; I385-A471 HydrophobicContact CG1-CB 3.9Å; S467-A471 PolarHBondContact O-N 3.49Å; I468-A471 WeakPolarHBondContact O-CA 3.4Å; I468-A471 WeakPolarHBondContact O-CB 3.4Å; I468-A471 PolarHBondContact O-N 2.88Å; A471-Y473 PolarHBondContact O-N 3.06Å; A471-Y473 VanDerWaalsContact O-N 3.11Å; A471-A474 WeakPolarHBondContact O-CB 3.29Å; A471-A474 PolarHBondContact O-N 2.8Å
472	C	89.2	Confident	88.9	Confident	4 Å²	4	45 Å²	45	3%	0.027	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-59.5	-22.1	176.5	-64.6	0	0	0	0	114.4	I468 G469 L470 A474 S475 I479	I468-C472 PolarHBondContact O-N 3.05Å; I468-C472 VanDerWaalsContact O-N 3.14Å; I468-C472 PolarHBondContact O-SG 3.38Å; G469-C472 WeakPolarHBondContact O-CB 3.42Å; G469-C472 PolarHBondContact O-N 2.74Å; L470-C472 VanDerWaalsContact C-N 3.27Å; L470-C472 PolarHBondContact O-N 3.11Å; C472-A474 PolarHBondContact O-N 2.89Å; C472-S475 CarbonylContact O-C 3.51Å; C472-S475 PolarHBondContact O-N 3.27Å; C472-I479 HydrophobicContact CB-CG2 3.78Å
473	Y	88.9	Confident	88.6	Confident	124 Å²	124	43.7 Å²	43.7	49%	0.486	26%	0.258	S	S	.	.	G	3₁₀ helix	trans	-66.5	-23.2	173.6	-74.4	-84.9	0	0	0	112.9	W339 L470 A471 V482	W339-Y473 PolarHBondContact NE1-OH 3.11Å; L470-Y473 PolarHBondContact O-N 3.33Å; A471-Y473 PolarHBondContact O-N 3.06Å; A471-Y473 VanDerWaalsContact O-N 3.11Å; Y473-V482 HydrophobicContact CE1-CG2 3.94Å
474	A	86	Confident	88.4	Confident	66 Å²	66	45.6 Å²	45.6	55%	0.545	26%	0.263	S	S	.	.	G	3₁₀ helix	trans	-85.9	-11.8	178.5	0	0	0	0	0	113.7	A471 C472	A471-A474 WeakPolarHBondContact O-CB 3.29Å; A471-A474 PolarHBondContact O-N 2.8Å; C472-A474 PolarHBondContact O-N 2.89Å
475	S	82.1	Confident	88.2	Confident	1 Å²	1	46.2 Å²	46.2	1%	0.007	27%	0.266	C	S	.	.			trans	-135.4	84.1	175.9	178	0	0	0	0	109.8	D379 A382 C472 S477 F478	D379-S475 PolarHBondContact OD2-OG 3.18Å; A382-S475 WeakPolarHBondContact CB-OG 3.37Å; C472-S475 CarbonylContact O-C 3.51Å; C472-S475 PolarHBondContact O-N 3.27Å; S475-S477 PolarHBondContact O-N 3.35Å; S475-S477 VanDerWaalsContact O-N 3.13Å; S475-S477 PolarHBondContact OG-OG 2.81Å; S475-S477 VanDerWaalsContact OG-OG 3.06Å; S475-F478 WeakPolarHBondContact O-CB 3.28Å; S475-F478 PolarHBondContact O-N 3.21Å; S475-F478 VanDerWaalsContact O-N 3.13Å
476	P	75.1	Confident	87.9	Confident	103 Å²	103	50.2 Å²	50.2	67%	0.669	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-12.2	179.8	-21.8	33.7	0	0	0	114.4
477	S	74.6	Confident	87.6	Confident	67 Å²	67	46.6 Å²	46.6	47%	0.469	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-27.6	175.7	59.6	0	0	0	0	112.1	D379 S475	D379-S477 PolarHBondContact OD2-OG 2.95Å; S475-S477 PolarHBondContact O-N 3.35Å; S475-S477 VanDerWaalsContact O-N 3.13Å; S475-S477 PolarHBondContact OG-OG 2.81Å; S475-S477 VanDerWaalsContact OG-OG 3.06Å
478	F	77.3	Confident	87.4	Confident	11 Å²	11	44 Å²	44	5%	0.048	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-32.9	-172.7	-175.8	-101.2	0	0	0	113.6	L344 L373 A382 I385 F386 M389 S475	L344-F478 HydrophobicContact CD2-CE1 3.84Å; L373-F478 HydrophobicContact CD2-CD2 4.24Å; L373-F478 HydrophobicContact CD2-CE1 4.33Å; L373-F478 HydrophobicContact CD2-CE2 3.83Å; L373-F478 HydrophobicContact CD2-CZ 3.89Å; L373-F478 WeakPolarHBondContact CD2-O 3.48Å; A382-F478 HydrophobicContact CB-CB 4.38Å; A382-F478 HydrophobicContact CB-CD2 4.16Å; I385-F478 HydrophobicContact CB-CD1 4.48Å; I385-F478 HydrophobicContact CB-CE1 4.48Å; I385-F478 HydrophobicContact CG2-CD1 3.57Å; I385-F478 HydrophobicContact CG2-CD2 4.41Å; I385-F478 HydrophobicContact CG2-CE1 3.4Å; I385-F478 HydrophobicContact CG2-CE2 4.27Å; I385-F478 HydrophobicContact CG2-CG 4.09Å; I385-F478 HydrophobicContact CG2-CZ 3.78Å; F386-F478 HydrophobicContact CB-CE2 3.79Å; F386-F478 HydrophobicContact CB-CZ 4.32Å; F386-F478 HydrophobicContact CD2-CE2 4.06Å; F386-F478 HydrophobicContact CD2-CZ 4.35Å; F386-F478 HydrophobicContact CG-CE2 4.44Å; M389-F478 HydrophobicContact SD-CZ 4.47Å; S475-F478 WeakPolarHBondContact O-CB 3.28Å; S475-F478 PolarHBondContact O-N 3.21Å; S475-F478 VanDerWaalsContact O-N 3.13Å
479	I	79.5	Confident	87.3	Confident	7 Å²	7	45.9 Å²	45.9	4%	0.036	27%	0.273	C	S	.	.	S	Bend	trans	-138.1	151.7	-175.1	-164.5	168.8	0	0	0	108.5	W339 N340 I343 L344 M371 C472	W339-I479 HydrophobicContact CH2-CB 4.48Å; W339-I479 HydrophobicContact CH2-CD1 4.37Å; W339-I479 HydrophobicContact CH2-CG1 4.24Å; W339-I479 HydrophobicContact CH2-CG2 3.58Å; W339-I479 HydrophobicContact CZ3-CB 4.48Å; W339-I479 HydrophobicContact CZ3-CD1 4Å; W339-I479 HydrophobicContact CZ3-CG1 3.81Å; W339-I479 HydrophobicContact CZ3-CG2 4.04Å; N340-I479 HydrophobicContact CB-CD1 3.91Å; I343-I479 HydrophobicContact CB-CD1 3.93Å; I343-I479 HydrophobicContact CB-CG1 4.48Å; I343-I479 HydrophobicContact CD1-CD1 4.4Å; I343-I479 HydrophobicContact CD1-CG1 4.33Å; I343-I479 HydrophobicContact CG2-CD1 3.64Å; I343-I479 HydrophobicContact CG2-CG1 3.86Å; L344-I479 HydrophobicContact CD2-CD1 4.49Å; L344-I479 HydrophobicContact CG-CD1 4.12Å; M371-I479 HydrophobicContact CE-CG1 4.29Å; C472-I479 HydrophobicContact CB-CG2 3.78Å
480	P	81.9	Confident	87.1	Confident	15 Å²	15	51.7 Å²	51.7	10%	0.097	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-52.6	158.2	178	-29.5	35.2	0	0	0	112.8	Y309 W339 L370 M371	Y309-P480 HydrophobicContact CD1-CB 3.55Å; Y309-P480 HydrophobicContact CD1-CG 3.79Å; Y309-P480 HydrophobicContact CE1-CB 3.21Å; Y309-P480 HydrophobicContact CE1-CG 4Å; Y309-P480 HydrophobicContact CG-CB 4.44Å; Y309-P480 HydrophobicContact CG-CG 4.41Å; W339-P480 WeakPolarHBondContact CH2-O 3.21Å; W339-P480 WeakPolarHBondContact CZ3-O 3.24Å; L370-P480 HydrophobicContact CD2-CG 3.63Å; M371-P480 HydrophobicContact CE-CG 3.73Å
481	P	84.5	Confident	86.8	Confident	76 Å²	76	48.8 Å²	48.8	49%	0.494	29%	0.286	S	S	.	.	P	Polyproline II helix	trans	-65.2	153.7	178.9	27	-35	0	0	0	111.8	V306 Y309	V306-P481 HydrophobicContact CG1-CG 4.17Å; V306-P481 HydrophobicContact CG2-CG 4.15Å; Y309-P481 PolarHBondContact OH-O 3.19Å
482	V	90	Very high	86.6	Confident	57 Å²	57	48.3 Å²	48.3	35%	0.345	28%	0.28	S	S	.	.	P	Polyproline II helix	trans	-52.5	127.5	175.6	-174.2	0	0	0	0	109.9	K336 W339 Y473	K336-V482 HydrophobicContact CG-CG1 4.16Å; W339-V482 HydrophobicContact CH2-CG2 4.37Å; W339-V482 HydrophobicContact CZ2-CB 4.17Å; W339-V482 HydrophobicContact CZ2-CG2 3.45Å; W339-V482 VanDerWaalsContact CZ2-CG2 3.45Å; Y473-V482 HydrophobicContact CE1-CG2 3.94Å
483	P	90.6	Very high	86.4	Confident	2 Å²	2	53.8 Å²	53.8	1%	0.013	30%	0.304	C	S	.	.	P	Polyproline II helix	trans	-69.7	138.7	179.9	28.5	-35.5	0	0	0	111.9	Q310 W339 L488	Q310-P483 HydrophobicContact CG-CB 4.13Å; W339-P483 HydrophobicContact CB-CG 3.92Å; W339-P483 HydrophobicContact CG-CG 4.22Å; P483-L488 HydrophobicContact CB-CD1 3.85Å; P483-L488 HydrophobicContact CB-CD2 4.05Å; P483-L488 HydrophobicContact CB-CG 3.88Å; P483-L488 HydrophobicContact CG-CD1 3.82Å; P483-L488 HydrophobicContact CG-CD2 4.41Å; P483-L488 HydrophobicContact CG-CG 4.34Å
484	L	92.4	Very high	85.6	Confident	119 Å²	119	56 Å²	56	62%	0.623	31%	0.312	S	S	*	.	P	Polyproline II helix	trans	-70.7	137.6	171.8	-63.4	176.9	0	0	0	110.2	T486 S487 L488	L484-T486 PolarHBondContact O-N 3.4Å; L484-S487 WeakPolarHBondContact O-CB 3.38Å; L484-S487 PolarHBondContact O-N 2.77Å; L484-L488 PolarHBondContact O-N 2.72Å
485	V	92.7	Very high	84.1	Confident	38 Å²	38	64.2 Å²	64.2	23%	0.23	33%	0.329	C	S	.	.	H	α-helix	trans	-55.4	-41.8	177.3	-178.9	0	0	0	0	110.8	A332 L333 K336 S487 L488 M489	A332-V485 HydrophobicContact CB-CG1 3.82Å; L333-V485 HydrophobicContact CD2-CG2 4.18Å; K336-V485 HydrophobicContact CD-CG2 3.41Å; K336-V485 VanDerWaalsContact CD-CG2 3.41Å; V485-S487 PolarHBondContact O-N 3.44Å; V485-L488 PolarHBondContact O-N 2.94Å; V485-M489 HydrophobicContact CG1-CG 4.28Å; V485-M489 HydrophobicContact CG1-SD 4.01Å; V485-M489 VanDerWaalsContact O-CG 3.26Å; V485-M489 WeakPolarHBondContact O-CG 3.48Å; V485-M489 PolarHBondContact O-N 3.33Å
486	T	92.6	Very high	82.7	Confident	90 Å²	90	66.6 Å²	66.6	55%	0.552	34%	0.343	S	S	*	.	H	α-helix	trans	-61.2	-42.3	177.7	48.5	0	0	0	0	112.4	L484 M489 Q490	L484-T486 PolarHBondContact O-N 3.4Å; T486-M489 PolarHBondContact O-N 3.14Å; T486-Q490 VanDerWaalsContact O-CG 3.28Å; T486-Q490 WeakPolarHBondContact O-CG 3.02Å; T486-Q490 PolarHBondContact O-N 3.43Å
487	S	91.3	Very high	80.8	Confident	31 Å²	31	66.8 Å²	66.8	22%	0.217	35%	0.347	C	S	.	.	H	α-helix	trans	-64.2	-43.7	175.9	-173.2	0	0	0	0	111.7	Q310 L484 V485 Q490 T491	Q310-S487 PolarHBondContact OE1-OG 3.21Å; L484-S487 WeakPolarHBondContact O-CB 3.38Å; L484-S487 PolarHBondContact O-N 2.77Å; V485-S487 PolarHBondContact O-N 3.44Å; S487-Q490 PolarHBondContact O-N 3.31Å; S487-T491 WeakPolarHBondContact O-CB 3.14Å; S487-T491 PolarHBondContact O-N 3.45Å; S487-T491 PolarHBondContact O-OG1 2.72Å
488	L	92.1	Very high	79	Confident	0 Å²	0	68.9 Å²	68.9	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-63.4	-45.1	177	-71.5	170	0	0	0	111.6	A332 L335 K336 P483 L484 V485 Q490 T491 L492	A332-L488 HydrophobicContact CB-CB 3.86Å; A332-L488 WeakPolarHBondContact O-CD1 3.48Å; L335-L488 HydrophobicContact CB-CD1 3.89Å; L335-L488 HydrophobicContact CB-CD2 4.3Å; L335-L488 HydrophobicContact CD1-CD2 4.25Å; K336-L488 HydrophobicContact CB-CD1 3.92Å; P483-L488 HydrophobicContact CB-CD1 3.85Å; P483-L488 HydrophobicContact CB-CD2 4.05Å; P483-L488 HydrophobicContact CB-CG 3.88Å; P483-L488 HydrophobicContact CG-CD1 3.82Å; P483-L488 HydrophobicContact CG-CD2 4.41Å; P483-L488 HydrophobicContact CG-CG 4.34Å; L484-L488 PolarHBondContact O-N 2.72Å; V485-L488 PolarHBondContact O-N 2.94Å; L488-Q490 VanDerWaalsContact C-N 3.34Å; L488-Q490 PolarHBondContact O-N 2.85Å; L488-T491 PolarHBondContact O-N 2.93Å; L488-L492 WeakPolarHBondContact O-CB 3.47Å; L488-L492 VanDerWaalsContact O-CG 3.23Å; L488-L492 WeakPolarHBondContact O-CG 3.24Å; L488-L492 PolarHBondContact O-N 3.38Å
489	M	91.8	Very high	76.7	Confident	39 Å²	39	72.5 Å²	72.5	19%	0.192	38%	0.382	C	S	.	.	H	α-helix	trans	-60.5	-43.5	176.5	-69.7	177.8	68.9	0	0	111.7	V328 E329 A332 V485 T486 T491 L492 H493	V328-M489 HydrophobicContact CG1-CB 4.23Å; V328-M489 HydrophobicContact CG1-CG 4.15Å; E329-M489 HydrophobicContact CG-CE 3.73Å; E329-M489 HydrophobicContact CG-SD 4.23Å; E329-M489 WeakPolarHBondContact OE1-CE 3.33Å; A332-M489 HydrophobicContact CB-CG 3.52Å; V485-M489 HydrophobicContact CG1-CG 4.28Å; V485-M489 HydrophobicContact CG1-SD 4.01Å; V485-M489 VanDerWaalsContact O-CG 3.26Å; V485-M489 WeakPolarHBondContact O-CG 3.48Å; V485-M489 PolarHBondContact O-N 3.33Å; T486-M489 PolarHBondContact O-N 3.14Å; M489-T491 VanDerWaalsContact C-N 3.32Å; M489-T491 PolarHBondContact O-N 3.34Å; M489-L492 PolarHBondContact O-N 2.92Å; M489-H493 WeakPolarHBondContact O-CB 3.21Å; M489-H493 PolarHBondContact O-N 2.89Å
490	Q	90.2	Very high	74.4	Confident	121 Å²	121	76.1 Å²	76.1	57%	0.565	41%	0.413	S	S	*	.	H	α-helix	trans	-60.5	-43.1	174.6	-73.5	173	0.3	0	0	111.6	T486 S487 L488 H493 R494	T486-Q490 VanDerWaalsContact O-CG 3.28Å; T486-Q490 WeakPolarHBondContact O-CG 3.02Å; T486-Q490 PolarHBondContact O-N 3.43Å; S487-Q490 PolarHBondContact O-N 3.31Å; L488-Q490 VanDerWaalsContact C-N 3.34Å; L488-Q490 PolarHBondContact O-N 2.85Å; Q490-H493 PolarHBondContact O-N 3.49Å; Q490-R494 WeakPolarHBondContact O-CG 3.13Å; Q490-R494 PolarHBondContact O-N 3.48Å
491	T	88.3	Confident	72	Confident	28 Å²	28	78.8 Å²	78.8	17%	0.172	43%	0.433	C	S	.	.	H	α-helix	trans	-65.7	-40	178.1	-56.8	0	0	0	0	111.9	A314 S487 L488 M489 R494	A314-T491 HydrophobicContact CB-CG2 3.67Å; S487-T491 WeakPolarHBondContact O-CB 3.14Å; S487-T491 PolarHBondContact O-N 3.45Å; S487-T491 PolarHBondContact O-OG1 2.72Å; L488-T491 PolarHBondContact O-N 2.93Å; M489-T491 VanDerWaalsContact C-N 3.32Å; M489-T491 PolarHBondContact O-N 3.34Å; T491-R494 PolarHBondContact O-N 2.91Å
492	L	88.7	Confident	69.6	Low	16 Å²	16	79.1 Å²	79.1	8%	0.084	44%	0.441	C	S	.	.	H	α-helix	trans	-69.8	-34.8	177.4	-72	167.3	0	0	0	112.6	A314 R318 F323 V328 Q331 A332 L335 L488 M489	A314-L492 HydrophobicContact CB-CD2 4.1Å; R318-L492 HydrophobicContact CG-CD2 3.89Å; F323-L492 HydrophobicContact CE1-CD2 3.93Å; F323-L492 HydrophobicContact CZ-CD2 4.48Å; V328-L492 HydrophobicContact CG1-CB 4.12Å; V328-L492 HydrophobicContact CG1-CD1 4.24Å; Q331-L492 HydrophobicContact CB-CD1 3.68Å; A332-L492 HydrophobicContact CB-CD1 4.25Å; L335-L492 HydrophobicContact CD1-CD1 4.09Å; L335-L492 HydrophobicContact CD1-CD2 4.13Å; L335-L492 HydrophobicContact CD1-CG 4.37Å; L488-L492 WeakPolarHBondContact O-CB 3.47Å; L488-L492 VanDerWaalsContact O-CG 3.23Å; L488-L492 WeakPolarHBondContact O-CG 3.24Å; L488-L492 PolarHBondContact O-N 3.38Å; M489-L492 PolarHBondContact O-N 2.92Å
493	H	84	Confident	66.9	Low	118 Å²	118	84.1 Å²	84.1	55%	0.546	47%	0.465	S	S	.	.	H	α-helix	trans	-71.3	-28.5	176.1	-78.1	167.6	0	0	0	113.8	M489 Q490 R495	M489-H493 WeakPolarHBondContact O-CB 3.21Å; M489-H493 PolarHBondContact O-N 2.89Å; Q490-H493 PolarHBondContact O-N 3.49Å; H493-R495 PolarHBondContact O-N 3.31Å
494	R	72.5	Confident	64.2	Low	170 Å²	170	92.3 Å²	92.3	64%	0.642	50%	0.503	S	S	*	.	S	Bend	trans	-62.9	102	175.5	-75.7	-179.9	-172.8	-163.4	5.4	108.2	Q490 T491 V496	Q490-R494 WeakPolarHBondContact O-CG 3.13Å; Q490-R494 PolarHBondContact O-N 3.48Å; T491-R494 PolarHBondContact O-N 2.91Å; R494-V496 PolarHBondContact O-N 3.36Å
495	R	55	Low	61.2	Low	239 Å²	239	94.9 Å²	94.9	90%	0.902	51%	0.512	S	S	*	.			trans	-52.7	116.6	171	-71.7	-175.1	-179.8	179.2	0.8	107.1	H493 S497	H493-R495 PolarHBondContact O-N 3.31Å; R495-S497 VanDerWaalsContact C-N 3.35Å; R495-S497 PolarHBondContact O-N 2.92Å
496	V	52.7	Low	58.2	Low	52 Å²	52	107.1 Å²	107.1	32%	0.315	56%	0.556	S	S	.	*			trans	-63.9	108.1	165.4	169.7	0	0	0	0	106	R494 V498	R494-V496 PolarHBondContact O-N 3.36Å; V496-V498 HydrophobicContact CG1-CG2 3.93Å; V496-V498 PolarHBondContact O-N 2.83Å
497	S	34.9	Very low	56.5	Low	106 Å²	106	108 Å²	108	74%	0.741	56%	0.556	S	S	*	*			trans	-54.6	91.6	154	168.9	0	0	0	0	105.9	R495 C499	R495-S497 VanDerWaalsContact C-N 3.35Å; R495-S497 PolarHBondContact O-N 2.92Å; S497-C499 PolarHBondContact O-N 3.27Å; S497-C499 VanDerWaalsContact O-N 3.14Å
498	V	37	Very low	54.7	Low	112 Å²	112	112 Å²	112	68%	0.679	57%	0.574	S	S	*	*			trans	-70.3	106.3	164.1	-177.4	0	0	0	0	103.5	V496 A500	V496-V498 HydrophobicContact CG1-CG2 3.93Å; V496-V498 PolarHBondContact O-N 2.83Å; V498-A500 PolarHBondContact O-N 2.79Å
499	C	27.9	Very low	52.6	Low	86 Å²	86	118.2 Å²	118.2	58%	0.581	61%	0.606	S	S	*	*			trans	-60.6	106.5	165.7	-128.5	0	0	0	0	106	S497 S501	S497-C499 PolarHBondContact O-N 3.27Å; S497-C499 VanDerWaalsContact O-N 3.14Å; C499-S501 WeakPolarHBondContact CB-OG 3.43Å; C499-S501 PolarHBondContact O-N 3.11Å; C499-S501 PolarHBondContact SG-OG 2.83Å
500	A	31.7	Very low	50.3	Low	83 Å²	83	122.9 Å²	122.9	69%	0.686	63%	0.631	S	S	*	*	G	3₁₀ helix	trans	-62.7	2.2	177.3	0	0	0	0	0	113.1	V498	V498-A500 PolarHBondContact O-N 2.79Å
501	S	30.8	Very low	47.8	Very low	72 Å²	72	123 Å²	123	50%	0.503	64%	0.635	S	S	.	*	G	3₁₀ helix	trans	-79.8	-12.6	179.5	45.9	0	0	0	0	114.8	C499	C499-S501 WeakPolarHBondContact CB-OG 3.43Å; C499-S501 PolarHBondContact O-N 3.11Å; C499-S501 PolarHBondContact SG-OG 2.83Å
502	A	33.7	Very low	45.1	Very low	82 Å²	82	129.3 Å²	129.3	68%	0.678	67%	0.666	S	S	*	*	G	3₁₀ helix	trans	-86.2	-7.3	-178	0	0	0	0	0	115
503	L	33.4	Very low	42	Very low	162 Å²	162	137.4 Å²	137.4	85%	0.848	71%	0.707	S	S	*	*	G	3₁₀ helix	trans	-102.8	11.1	-179.9	-79.9	164.7	0	0	0	113.9
504	Q	33.6	Very low	38.7	Very low	174 Å²	174	138.9 Å²	138.9	81%	0.813	72%	0.719	S	S	*	*	S	Bend	trans	-112.9	10.8	177.8	-95.8	177.4	-26	0	0	114
505	Q	29.6	Very low	35.9	Very low	173 Å²	173	136.3 Å²	136.3	81%	0.808	73%	0.726	S	S	*	*			trans	-120.8	15	-178.6	-82.7	-171	-27.8	0	0	115.3
506	Y	30.8	Very low	34.2	Very low	295 Å²	295	127 Å²	127	100%	1.157	71%	0.71	S	S	*	*			trans	-131.1	0	168	-94.4	-84.2	0	0	0	111.7

Retrieved 506 of 506 residues in 139.5 ms (Link to these results)

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