A0A061IPS0_CRIGR Loading...

Sorting nexin-7

AlphaFold DB , UniProt , Accession A0A061IPS0, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene n/a, Length 465 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	44.4	Very low	34	Very low	250 Å²	250	119.1 Å²	119.1	100%	1.232	85%	0.847	S	S	*	*				0	109.7	0	-73.5	162.8	169.1	0	0	106.5
2	G	37.4	Very low	33.8	Very low	78 Å²	78	117.1 Å²	117.1	80%	0.804	84%	0.842	S	S	*	*			trans	-83.9	162.3	-173	0	0	0	0	0	112.7
3	A	33.6	Very low	33.4	Very low	88 Å²	88	116.2 Å²	116.2	73%	0.727	85%	0.845	S	S	*	*			cis	118.8	120.1	8.4	0	0	0	0	0	112.2
4	Q	34.5	Very low	33.1	Very low	204 Å²	204	114 Å²	114	95%	0.953	85%	0.847	S	S	*	*			trans	66.8	151.8	157.9	-57.1	170.2	16.2	0	0	116.2
5	G	34	Very low	32.8	Very low	83 Å²	83	111.4 Å²	111.4	86%	0.856	84%	0.842	S	S	*	*			cis	167.3	167.6	1.1	0	0	0	0	0	107.3
6	G	32.9	Very low	32.7	Very low	70 Å²	70	110.6 Å²	110.6	72%	0.722	84%	0.84	S	S	*	*			cis	-152.7	167.1	-4.8	0	0	0	0	0	108.7
7	A	34.3	Very low	32.8	Very low	113 Å²	113	118.4 Å²	118.4	93%	0.934	85%	0.845	S	S	*	*				64	137.9	91.1	0	0	0	0	0	115.2
8	G	31.2	Very low	32.8	Very low	65 Å²	65	119.6 Å²	119.6	67%	0.67	85%	0.845	S	S	*	*			cis	-127	-178.5	5.6	0	0	0	0	0	113.9
9	L	30.2	Very low	32.9	Very low	179 Å²	179	118.6 Å²	118.6	94%	0.937	85%	0.845	S	S	*	*			cis	61.2	130.4	40.7	-73.8	156.2	0	0	0	112.2
10	A	32.8	Very low	32.7	Very low	81 Å²	81	116.4 Å²	116.4	67%	0.669	84%	0.841	S	S	*	*			cis	-143.1	163	13.3	0	0	0	0	0	111
11	A	29.3	Very low	32.6	Very low	99 Å²	99	118.8 Å²	118.8	82%	0.818	84%	0.84	S	S	*	*				48.4	143.3	83.5	0	0	0	0	0	114.9
12	A	30.6	Very low	32	Very low	95 Å²	95	114.2 Å²	114.2	79%	0.785	82%	0.821	S	S	*	*			cis	-157.7	164.8	4	0	0	0	0	0	112.9
13	A	29.4	Very low	31.6	Very low	106 Å²	106	113.5 Å²	113.5	88%	0.876	81%	0.814	S	S	*	*			trans	0.9	149.1	145.2	0	0	0	0	0	123.1
14	G	28.6	Very low	31.5	Very low	85 Å²	85	117.2 Å²	117.2	88%	0.876	82%	0.816	S	S	*	*			trans	111.6	136.3	161.2	0	0	0	0	0	113.8
15	G	29.3	Very low	31.3	Very low	75 Å²	75	117 Å²	117	77%	0.773	81%	0.807	S	S	*	*			cis	172.4	158.7	-6.1	0	0	0	0	0	112.6
16	A	30.3	Very low	31.1	Very low	98 Å²	98	120.3 Å²	120.3	81%	0.81	80%	0.804	S	S	*	*			trans	48.6	115.2	155.4	0	0	0	0	0	122.9
17	R	35.4	Very low	31	Very low	243 Å²	243	121.5 Å²	121.5	92%	0.917	81%	0.807	S	S	*	*				22.1	126.8	124.5	-66	176.8	169.9	-179	-4.1	120.6
18	T	33.1	Very low	30.9	Very low	140 Å²	140	122 Å²	122	86%	0.859	80%	0.804	S	S	*	*				-173.1	132.2	123.5	33.5	0	0	0	0	107.1
19	A	33.3	Very low	30.7	Very low	102 Å²	102	122 Å²	122	84%	0.843	80%	0.803	S	S	*	*				80.5	127.4	50.8	0	0	0	0	0	114.2
20	G	29.8	Very low	30.8	Very low	74 Å²	74	119.3 Å²	119.3	76%	0.763	80%	0.799	S	S	*	*			trans	117.8	100.9	-173	0	0	0	0	0	110.6
21	M	30.8	Very low	30.7	Very low	166 Å²	166	119.4 Å²	119.4	82%	0.818	80%	0.795	S	S	*	*			cis	73	135	48	-71.2	-177.6	63.3	0	0	115.6
22	D	30.4	Very low	30.8	Very low	154 Å²	154	122.2 Å²	122.2	82%	0.824	79%	0.791	S	S	*	*			trans	66.5	141.1	168.2	-46.6	-35.5	0	0	0	117.7
23	G	29	Very low	30.7	Very low	64 Å²	64	124.6 Å²	124.6	66%	0.66	79%	0.79	S	S	*	*			cis	166.2	158.1	-5.8	0	0	0	0	0	112.3
24	E	31.6	Very low	30.7	Very low	165 Å²	165	123.4 Å²	123.4	77%	0.771	78%	0.78	S	S	*	*			trans	63.5	155.1	160.5	-70.6	-160.2	107.5	0	0	120.2
25	R	30.8	Very low	30.8	Very low	201 Å²	201	126 Å²	126	76%	0.758	78%	0.778	S	S	*	*			cis	-174.9	179.6	-24.4	-166.5	162.5	-180	-165.4	2.2	109.8
26	L	30.1	Very low	30.7	Very low	152 Å²	152	125.6 Å²	125.6	80%	0.796	77%	0.774	S	S	*	*			trans	92.6	108.7	166.6	-55.3	168.3	0	0	0	114.1
27	A	31.8	Very low	30.6	Very low	95 Å²	95	130.6 Å²	130.6	79%	0.785	78%	0.781	S	S	*	*				81.8	142	67.3	0	0	0	0	0	111.7
28	S	30.3	Very low	30.3	Very low	124 Å²	124	124.3 Å²	124.3	87%	0.867	78%	0.775	S	S	*	*			cis	-154.1	171.6	18.6	48.3	0	0	0	0	110.2
29	G	27.3	Very low	31.2	Very low	63 Å²	63	122.6 Å²	122.6	65%	0.649	77%	0.765	S	S	*	*			cis	167.3	-178.3	-3.9	0	0	0	0	0	112.3
30	S	32.5	Very low	31	Very low	123 Å²	123	129.6 Å²	129.6	86%	0.86	77%	0.77	S	S	*	*			trans	63.9	144.3	162.2	-57.1	0	0	0	0	119
31	S	30.4	Very low	30.8	Very low	83 Å²	83	130 Å²	130	58%	0.58	78%	0.775	S	S	*	*			cis	-152.6	146.1	3.3	-115.1	0	0	0	0	111.7
32	E	32.6	Very low	30.6	Very low	158 Å²	158	126.3 Å²	126.3	74%	0.738	78%	0.778	S	S	*	*				52.9	147.4	128.1	-67.7	172.9	110.2	0	0	121.6
33	L	28.4	Very low	30.6	Very low	145 Å²	145	123.3 Å²	123.3	76%	0.759	78%	0.775	S	S	*	*			cis	-153.2	154.7	8.2	-113.5	150	0	0	0	111.4
34	A	29.3	Very low	31.1	Very low	82 Å²	82	126.5 Å²	126.5	68%	0.678	78%	0.784	S	S	*	*			trans	-9.7	162.3	154	0	0	0	0	0	120.4
35	V	29.7	Very low	31.1	Very low	138 Å²	138	126.2 Å²	126.2	84%	0.836	79%	0.786	S	S	*	*			cis	-153.9	140.4	41.3	-179.3	0	0	0	0	107.9
36	G	28.4	Very low	31.8	Very low	67 Å²	67	122.6 Å²	122.6	69%	0.691	79%	0.789	S	S	*	*				72	137.5	73.9	0	0	0	0	0	112.6
37	E	28.3	Very low	31.6	Very low	204 Å²	204	119.3 Å²	119.3	95%	0.953	79%	0.792	S	S	*	*			cis	-161.2	179.8	-3.9	-143	176.4	139.4	0	0	109.5
38	S	29.3	Very low	31.3	Very low	111 Å²	111	118.3 Å²	118.3	78%	0.776	79%	0.79	S	S	*	*			trans	-108.8	-159.2	-174.1	-137.6	0	0	0	0	111.6
39	P	50.8	Low	31.2	Very low	103 Å²	103	119 Å²	119	67%	0.669	80%	0.795	S	S	*	*			cis	-136.8	-164.3	-28.7	34.2	-12	0	0	0	114.2
40	R	28.8	Very low	31.1	Very low	250 Å²	250	119.3 Å²	119.3	94%	0.943	80%	0.798	S	S	*	*			trans	78.3	146.2	169.4	-58.4	176.4	167.6	-169.8	-3.8	116.5
41	G	26.8	Very low	31	Very low	83 Å²	83	119.6 Å²	119.6	86%	0.856	80%	0.8	S	S	*	*			cis	150.7	136.1	-6.3	0	0	0	0	0	112.3
42	G	26.9	Very low	30.8	Very low	87 Å²	87	121.6 Å²	121.6	90%	0.897	81%	0.813	S	S	*	*			trans	163.8	142.9	173.6	0	0	0	0	0	116.1
43	A	30.3	Very low	30.6	Very low	91 Å²	91	119.5 Å²	119.5	75%	0.752	82%	0.816	S	S	*	*			trans	-136	154.7	167.8	0	0	0	0	0	108.6
44	P	38.6	Very low	30.7	Very low	132 Å²	132	121 Å²	121	86%	0.857	82%	0.824	S	S	*	*				-148.6	-168.7	99.6	36.4	-16.2	0	0	0	116.2
45	I	31.3	Very low	30.8	Very low	158 Å²	158	125.4 Å²	125.4	81%	0.81	83%	0.832	S	S	*	*			trans	-134.6	158.5	-156.2	-78.6	166.2	0	0	0	108.7
46	P	47	Very low	30.8	Very low	126 Å²	126	128.2 Å²	128.2	82%	0.818	84%	0.836	S	S	*	*			cis	-139.3	-178.7	21.1	31.5	-7.4	0	0	0	118.8
47	G	25.4	Very low	30.8	Very low	83 Å²	83	129 Å²	129	86%	0.856	84%	0.836	S	S	*	*			trans	125.5	129.1	143	0	0	0	0	0	116.7
48	G	24.5	Very low	30.8	Very low	73 Å²	73	127 Å²	127	75%	0.753	83%	0.832	S	S	*	*			cis	176.1	159	-8.9	0	0	0	0	0	113
49	S	27.8	Very low	30.9	Very low	139 Å²	139	127.9 Å²	127.9	97%	0.972	83%	0.833	S	S	*	*			trans	73.3	134.3	172.1	-150.9	0	0	0	0	119.2
50	G	26.2	Very low	30.1	Very low	69 Å²	69	130.1 Å²	130.1	71%	0.711	84%	0.838	S	S	*	*			trans	132	80.3	153.3	0	0	0	0	0	120.1
51	S	29.6	Very low	30.3	Very low	129 Å²	129	125.3 Å²	125.3	90%	0.902	83%	0.831	S	S	*	*			trans	72.3	150.1	147.1	-147.8	0	0	0	0	123.4
52	C	27.2	Very low	30.7	Very low	125 Å²	125	128.8 Å²	128.8	85%	0.845	83%	0.829	S	S	*	*			trans	-45.3	153.4	-176.1	-119.3	0	0	0	0	119.4
53	S	27.9	Very low	31.1	Very low	114 Å²	114	131.8 Å²	131.8	80%	0.797	83%	0.825	S	S	*	*			trans	-88.1	144	169.6	-45.9	0	0	0	0	113.1
54	L	30.6	Very low	31.7	Very low	178 Å²	178	136 Å²	136	93%	0.932	83%	0.829	S	S	*	*			trans	-146.4	155.2	144	-95	175.8	0	0	0	108.7
55	M	32.3	Very low	31.8	Very low	173 Å²	173	136.8 Å²	136.8	85%	0.852	83%	0.826	S	S	*	*			trans	-106.6	168	-176.6	-72.8	-173.6	155.6	0	0	111.9
56	Q	27.8	Very low	32.5	Very low	197 Å²	197	137.1 Å²	137.1	92%	0.921	82%	0.824	S	S	*	*			trans	97.9	140.9	178.3	-64.8	177.8	-52.7	0	0	114.3
57	A	29.5	Very low	32.3	Very low	83 Å²	83	138.8 Å²	138.8	69%	0.686	83%	0.826	S	S	*	*			cis	-150.4	158	-12.6	0	0	0	0	0	109.3	V59	A57-V59 PolarHBondContact O-N 2.89Å
58	D	28	Very low	33.1	Very low	162 Å²	162	141.3 Å²	141.3	87%	0.866	82%	0.82	S	S	*	*			trans	-65.1	119.2	172.8	-69.7	-51.6	0	0	0	110	L60	D58-L60 PolarHBondContact O-N 3.18Å
59	V	32.4	Very low	33.9	Very low	130 Å²	130	144.5 Å²	144.5	79%	0.788	82%	0.819	S	S	*	*			trans	-74.2	116.6	169.4	-179.7	0	0	0	0	107.1	A57	A57-V59 PolarHBondContact O-N 2.89Å
60	L	32.8	Very low	34.6	Very low	151 Å²	151	147 Å²	147	79%	0.791	82%	0.815	S	S	*	*			trans	-87.2	110	165	-69.4	175.2	0	0	0	107.3	D58 L62	D58-L60 PolarHBondContact O-N 3.18Å; L60-L62 PolarHBondContact O-N 3.03Å
61	D	32.5	Very low	35.5	Very low	148 Å²	148	148.6 Å²	148.6	79%	0.791	81%	0.811	S	S	*	*			trans	-51.6	128.6	162.3	-74.7	-41.5	0	0	0	108.5
62	L	37	Very low	35.9	Very low	156 Å²	156	151.7 Å²	151.7	82%	0.817	81%	0.809	S	S	*	*			trans	-108.8	114.6	165	-70.7	175	0	0	0	105.7	L60 E64	L60-L62 PolarHBondContact O-N 3.03Å; L62-E64 PolarHBondContact O-N 3.05Å
63	D	34.4	Very low	36.5	Very low	151 Å²	151	151 Å²	151	81%	0.807	81%	0.806	S	S	*	*			trans	-54.9	126.9	-178.6	-60.9	-68.7	0	0	0	110.8	D65	D63-D65 PolarHBondContact O-N 3.36Å; D63-D65 VanDerWaalsContact O-N 3.16Å
64	E	43.2	Very low	36.8	Very low	178 Å²	178	154.8 Å²	154.8	83%	0.832	81%	0.808	S	S	*	*			trans	-79.9	91.5	177.8	-67.6	177.2	142	0	0	109.7	L62 E66	L62-E64 PolarHBondContact O-N 3.05Å; E64-E66 PolarHBondContact O-N 2.81Å
65	D	40.2	Very low	37	Very low	150 Å²	150	153.1 Å²	153.1	80%	0.802	80%	0.799	S	S	*	*			trans	-69	78.3	166.4	-73.5	-37.5	0	0	0	109.8	D63	D63-D65 PolarHBondContact O-N 3.36Å; D63-D65 VanDerWaalsContact O-N 3.16Å
66	E	45.7	Very low	36.9	Very low	165 Å²	165	150 Å²	150	77%	0.771	80%	0.801	S	S	*	*			trans	-83.9	-10.7	-176.4	-147.7	-179.8	-164.6	0	0	113.7	E64 D68	E64-E66 PolarHBondContact O-N 2.81Å; E66-D68 PolarHBondContact O-N 2.72Å
67	D	42.8	Very low	37	Very low	161 Å²	161	145.9 Å²	145.9	86%	0.861	79%	0.794	S	S	*	*	G	3₁₀ helix	trans	-79.3	-6	-165.6	-81.9	-36.1	0	0	0	116.8
68	D	42.1	Very low	37.2	Very low	135 Å²	135	150.4 Å²	150.4	72%	0.722	81%	0.806	S	S	*	*	G	3₁₀ helix	trans	-92.6	6	-166.3	-115.9	6.9	0	0	0	115.6	E66	E66-D68 PolarHBondContact O-N 2.72Å
69	L	43	Very low	37.6	Very low	141 Å²	141	150.8 Å²	150.8	74%	0.738	81%	0.805	S	S	*	*	G	3₁₀ helix	trans	-100.7	-3.6	-172	-72.8	175.9	0	0	0	116.8	V71	L69-V71 VanDerWaalsContact C-N 3.29Å; L69-V71 PolarHBondContact O-N 3.12Å; L69-V71 VanDerWaalsContact O-N 3.09Å
70	E	41.8	Very low	37.5	Very low	191 Å²	191	151.5 Å²	151.5	89%	0.893	80%	0.804	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82	31.2	-177.1	-67.5	-151.2	144.3	0	0	116.1
71	V	43.7	Very low	37.4	Very low	103 Å²	103	153.1 Å²	153.1	62%	0.624	81%	0.81	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.2	-6.4	-173.6	-178.3	0	0	0	0	114.7	L69	L69-V71 VanDerWaalsContact C-N 3.29Å; L69-V71 PolarHBondContact O-N 3.12Å; L69-V71 VanDerWaalsContact O-N 3.09Å
72	F	38.7	Very low	37.5	Very low	194 Å²	194	152.3 Å²	152.3	85%	0.851	81%	0.805	S	S	*	*	S	Bend	trans	-126.6	66	179.5	-74.9	-77.2	0	0	0	114.2
73	S	40.3	Very low	37.2	Very low	111 Å²	111	150.3 Å²	150.3	78%	0.776	80%	0.804	S	S	*	*			trans	-158.7	72	163	-88.4	0	0	0	0	114.9
74	K	34.2	Very low	37.1	Very low	193 Å²	193	152.1 Å²	152.1	84%	0.839	81%	0.806	S	S	*	*	S	Bend	trans	-164.2	147.1	142.3	-129.7	81.3	174.1	-170	0	113.6
75	D	33.9	Very low	36.6	Very low	142 Å²	142	148.5 Å²	148.5	76%	0.759	80%	0.8	S	S	*	*			trans	57.6	93.8	156	-60.1	-12.9	0	0	0	120.9
76	A	29.8	Very low	36.3	Very low	108 Å²	108	147.5 Å²	147.5	89%	0.893	80%	0.801	S	S	*	*			trans	-155.4	62.3	136.3	0	0	0	0	0	112.1
77	S	31.2	Very low	35.6	Very low	110 Å²	110	148.6 Å²	148.6	77%	0.769	81%	0.809	S	S	*	*			trans	-95.9	96.7	169.9	62.6	0	0	0	0	111.6
78	L	33.2	Very low	35.4	Very low	178 Å²	178	148.9 Å²	148.9	93%	0.932	81%	0.807	S	S	*	*			trans	-140.8	137.5	154.4	-83	-176.3	0	0	0	110.1
79	M	36.6	Very low	35.2	Very low	171 Å²	171	148.2 Å²	148.2	84%	0.842	81%	0.81	S	S	*	*			trans	-91.5	158.9	-167	-71.2	173.8	148.5	0	0	113.7
80	D	31.1	Very low	34.7	Very low	144 Å²	144	148.3 Å²	148.3	77%	0.77	82%	0.817	S	S	*	*			trans	44.2	115.3	145.5	-61.1	-17.3	0	0	0	120.1
81	M	30.5	Very low	34.2	Very low	186 Å²	186	144.7 Å²	144.7	92%	0.916	81%	0.812	S	S	*	*				-144	124.9	124	-114.4	-60.6	127.2	0	0	111.8
82	N	34	Very low	34.1	Very low	130 Å²	130	145.6 Å²	145.6	70%	0.695	82%	0.821	S	S	*	*			trans	-93.8	129.1	-176.8	-171.2	4.8	0	0	0	109.6
83	S	29.7	Very low	33.9	Very low	114 Å²	114	143.7 Å²	143.7	80%	0.797	82%	0.818	S	S	*	*			trans	-150.4	83	167.1	-156.6	0	0	0	0	112.2
84	F	32.4	Very low	33.7	Very low	190 Å²	190	144.2 Å²	144.2	83%	0.833	82%	0.822	S	S	*	*			trans	-70.7	134.8	157.8	-97.4	-97.9	0	0	0	109.9
85	S	33.4	Very low	34.3	Very low	102 Å²	102	143.4 Å²	143.4	71%	0.713	82%	0.823	S	S	*	*			trans	-148.4	120.7	157.7	-80.1	0	0	0	0	109.6
86	P	33.6	Very low	34.6	Very low	128 Å²	128	144 Å²	144	83%	0.831	83%	0.825	S	S	*	*			trans	-83	133.9	-177.7	32.5	-32.7	0	0	0	110.8
87	M	31.4	Very low	35	Very low	189 Å²	189	145.9 Å²	145.9	93%	0.931	82%	0.82	S	S	*	*			trans	-106.7	139.1	168.5	-75.4	-169.4	67	0	0	111.5
88	M	37.8	Very low	35.2	Very low	167 Å²	167	148.9 Å²	148.9	82%	0.823	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-73.4	155.9	-169.7	-69.2	-82.2	-79.4	0	0	112.9	T90	M88-T90 PolarHBondContact O-N 2.97Å
89	P	38.9	Very low	35.3	Very low	121 Å²	121	146.3 Å²	146.3	79%	0.786	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-70	127.2	177.5	29	-34.6	0	0	0	111.5
90	T	32.8	Very low	35.2	Very low	143 Å²	143	144.4 Å²	144.4	88%	0.877	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-93.5	136.2	172.6	44.4	0	0	0	0	111.4	M88	M88-T90 PolarHBondContact O-N 2.97Å
91	S	31	Very low	35.4	Very low	114 Å²	114	146 Å²	146	80%	0.797	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-72.3	152.7	-173.3	-60.5	0	0	0	0	113.8	L93	S91-L93 PolarHBondContact O-N 2.92Å
92	P	40.7	Very low	36.1	Very low	123 Å²	123	143.2 Å²	143.2	80%	0.799	78%	0.78	S	S	*	*			trans	-82.1	113.5	179.9	32.2	-32.6	0	0	0	111.3
93	L	36.5	Very low	36.5	Very low	153 Å²	153	144.5 Å²	144.5	80%	0.801	79%	0.787	S	S	*	*			trans	-177.4	97.2	150.2	-105	163.2	0	0	0	111.1	S91	S91-L93 PolarHBondContact O-N 2.92Å
94	S	35.1	Very low	36.9	Very low	122 Å²	122	145.7 Å²	145.7	85%	0.853	78%	0.78	S	S	*	*			trans	-159.9	89.9	152.7	-84.8	0	0	0	0	109.6	I96	S94-I96 PolarHBondContact O-N 2.9Å; S94-I96 VanDerWaalsContact O-N 3.15Å
95	M	46.6	Very low	37.4	Very low	177 Å²	177	140.7 Å²	140.7	87%	0.872	77%	0.766	S	S	*	*			trans	-73.5	97.4	167.4	-69.5	-169.4	-69.4	0	0	109.1
96	I	40.6	Very low	38.3	Very low	153 Å²	153	143 Å²	143	79%	0.785	77%	0.771	S	S	*	*			trans	-147.7	106.6	155.6	-143.1	73.3	0	0	0	111.2	S94 Q98	S94-I96 PolarHBondContact O-N 2.9Å; S94-I96 VanDerWaalsContact O-N 3.15Å; I96-Q98 PolarHBondContact O-N 3.26Å
97	N	38.8	Very low	39.6	Very low	149 Å²	149	143 Å²	143	80%	0.797	76%	0.763	S	S	*	*			trans	47.6	47.1	155.2	-132.2	35.2	0	0	0	119.6
98	Q	33.7	Very low	41.7	Very low	173 Å²	173	137.8 Å²	137.8	81%	0.808	74%	0.735	S	S	*	*			trans	-96.8	83.7	148	-74	-171.7	2.5	0	0	109.2	I96 K100	I96-Q98 PolarHBondContact O-N 3.26Å; Q98-K100 PolarHBondContact O-N 3.3Å
99	I	37.2	Very low	44.2	Very low	124 Å²	124	132.1 Å²	132.1	64%	0.636	71%	0.708	S	S	*	*			trans	-71.9	87.1	150.2	-59.6	174.8	0	0	0	104.8	F101	I99-F101 HydrophobicContact CG2-CD2 4.48Å; I99-F101 HydrophobicContact CG2-CE2 4.44Å; I99-F101 PolarHBondContact O-N 2.92Å
100	K	33.7	Very low	46.8	Very low	130 Å²	130	126.5 Å²	126.5	57%	0.565	67%	0.672	S	S	*	*			trans	-56.9	123.5	152	-84.1	170.6	133.8	-159.9	0	105.7	Q98 E102	Q98-K100 PolarHBondContact O-N 3.3Å; K100-E102 HydrophobicContact CB-CG 4.07Å; K100-E102 HydrophobicContact CD-CG 4.42Å; K100-E102 WeakPolarHBondContact CE-OE1 3.31Å; K100-E102 IonicContact NZ-OE1 3.28Å; K100-E102 PolarHBondContact NZ-OE1 2.99Å; K100-E102 IonicContact NZ-OE2 2.85Å; K100-E102 PolarHBondContact O-N 3.36Å
101	F	35.2	Very low	49.8	Very low	179 Å²	179	125.2 Å²	125.2	79%	0.785	65%	0.654	S	S	*	*			trans	-72.7	71.8	158.9	-72.8	-97	0	0	0	106.8	I99	I99-F101 HydrophobicContact CG2-CD2 4.48Å; I99-F101 HydrophobicContact CG2-CE2 4.44Å; I99-F101 PolarHBondContact O-N 2.92Å
102	E	44.3	Very low	53	Low	126 Å²	126	120 Å²	120	59%	0.589	62%	0.617	S	S	*	*			trans	-81.6	130.2	160.6	-84.4	167.6	167.6	0	0	106.5	K100	K100-E102 HydrophobicContact CB-CG 4.07Å; K100-E102 HydrophobicContact CD-CG 4.42Å; K100-E102 WeakPolarHBondContact CE-OE1 3.31Å; K100-E102 IonicContact NZ-OE1 3.28Å; K100-E102 PolarHBondContact NZ-OE1 2.99Å; K100-E102 IonicContact NZ-OE2 2.85Å; K100-E102 PolarHBondContact O-N 3.36Å
103	D	43.1	Very low	55.7	Low	157 Å²	157	117.2 Å²	117.2	84%	0.84	60%	0.598	S	S	*	*			trans	62.2	67.6	178.3	-48.6	-24.1	0	0	0	116.1	P105	D103-P105 WeakPolarHBondContact O-CD 3.39Å
104	E	38.7	Very low	58.7	Low	139 Å²	139	110 Å²	110	65%	0.65	56%	0.56	S	S	*	*			trans	-58.1	119.9	137.3	-88.1	-75.5	139.7	0	0	106.2
105	P	42.3	Very low	61.6	Low	85 Å²	85	106 Å²	106	55%	0.552	53%	0.529	S	S	*	.			trans	-62.2	150.2	175.1	27.3	-33	0	0	0	109	D103 L107	D103-P105 WeakPolarHBondContact O-CD 3.39Å; P105-L107 VanDerWaalsContact C-N 3.25Å; P105-L107 HydrophobicContact CG-CD2 4.16Å; P105-L107 HydrophobicContact CG-CG 4.25Å; P105-L107 PolarHBondContact O-N 2.68Å
106	D	53.2	Low	64	Low	151 Å²	151	99.3 Å²	99.3	81%	0.807	50%	0.502	S	S	*	.			trans	-59.4	90.4	169.4	-94.4	-43.6	0	0	0	109.4	K108	D106-K108 PolarHBondContact O-N 3.13Å
107	L	59.7	Low	66.6	Low	128 Å²	128	94.7 Å²	94.7	67%	0.67	48%	0.482	S	S	*	.			trans	-75	46.4	176.6	-70.3	175.4	0	0	0	110.6	P105 D109	P105-L107 VanDerWaalsContact C-N 3.25Å; P105-L107 HydrophobicContact CG-CD2 4.16Å; P105-L107 HydrophobicContact CG-CG 4.25Å; P105-L107 PolarHBondContact O-N 2.68Å; L107-D109 PolarHBondContact O-N 3.38Å
108	K	76.7	Confident	69.2	Low	79 Å²	79	91.4 Å²	91.4	34%	0.343	46%	0.462	S	S	.	.			trans	-65.3	104	166.3	-71.6	-158.9	176.1	-142.7	0	107.9	D106 F111 D208	D106-K108 PolarHBondContact O-N 3.13Å; K108-F111 HydrophobicContact CB-CE1 3.91Å; K108-F111 HydrophobicContact CB-CE2 4.48Å; K108-F111 HydrophobicContact CB-CZ 3.82Å; K108-F111 WeakPolarHBondContact O-CE2 3.49Å; K108-F111 WeakPolarHBondContact O-CZ 3.45Å; K108-D208 VanDerWaalsContact CE-OD1 3.32Å; K108-D208 WeakPolarHBondContact CE-OD1 3.25Å; K108-D208 IonicContact NZ-OD1 3.65Å; K108-D208 PolarHBondContact NZ-OD1 2.89Å; K108-D208 IonicContact NZ-OD2 2.76Å; K108-D208 PolarHBondContact NZ-OD2 2.98Å
109	D	89.4	Confident	71.9	Confident	48 Å²	48	86.6 Å²	86.6	26%	0.257	45%	0.447	S	S	.	.			trans	-99.3	-0	179.1	62	-1	0	0	0	112.3	L107 T136 S137 R138	L107-D109 PolarHBondContact O-N 3.38Å; D109-T136 WeakPolarHBondContact O-CA 3.39Å; D109-T136 VanDerWaalsContact O-CB 3.28Å; D109-T136 WeakPolarHBondContact O-CB 3.49Å; D109-T136 PolarHBondContact O-OG1 2.71Å; D109-S137 PolarHBondContact O-N 2.67Å; D109-R138 HydrophobicContact CB-CG 4.06Å; D109-R138 IonicContact OD1-CZ 3.38Å; D109-R138 IonicContact OD1-NE 3.18Å; D109-R138 PolarHBondContact OD1-NE 3.34Å; D109-R138 IonicContact OD1-NH2 2.66Å; D109-R138 PolarHBondContact OD1-NH2 3.16Å; D109-R138 VanDerWaalsContact OD2-CG 3.25Å; D109-R138 WeakPolarHBondContact OD2-CG 3.5Å; D109-R138 IonicContact OD2-CZ 2.63Å; D109-R138 IonicContact OD2-NE 3.91Å; D109-R138 PolarHBondContact OD2-NE 3.3Å; D109-R138 IonicContact OD2-NH2 3.63Å
110	L	94	Very high	74.3	Confident	4 Å²	4	84.6 Å²	84.6	2%	0.021	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	114	178.4	-170.7	64.6	0	0	0	109.8	I112 T134 F141 A207 F218 L222	L110-I112 HydrophobicContact CD2-CD1 4.11Å; L110-I112 HydrophobicContact CG-CD1 4.19Å; L110-I112 HydrophobicContact CG-CG1 4.14Å; L110-T134 HydrophobicContact CD1-CG2 3.43Å; L110-T134 VanDerWaalsContact CD1-CG2 3.43Å; L110-T134 HydrophobicContact CG-CG2 4.49Å; L110-F141 HydrophobicContact CD1-CZ 4.22Å; L110-A207 HydrophobicContact CD2-CB 3.9Å; L110-A207 HydrophobicContact CG-CB 4.35Å; L110-F218 HydrophobicContact CD2-CE1 3.8Å; L110-F218 HydrophobicContact CD2-CZ 4.33Å; L110-L222 HydrophobicContact CD1-CD1 4.38Å; L110-L222 HydrophobicContact CD2-CD1 4.08Å
111	F	95.9	Very high	76.8	Confident	116 Å²	116	83.9 Å²	83.9	51%	0.509	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	122.7	178.3	-60.2	-91.1	0	0	0	109.4	K108 T134 K135	K108-F111 HydrophobicContact CB-CE1 3.91Å; K108-F111 HydrophobicContact CB-CE2 4.48Å; K108-F111 HydrophobicContact CB-CZ 3.82Å; K108-F111 WeakPolarHBondContact O-CE2 3.49Å; K108-F111 WeakPolarHBondContact O-CZ 3.45Å; F111-T134 WeakPolarHBondContact O-CA 3.49Å; F111-K135 HydrophobicContact CB-CB 4.34Å; F111-K135 PolarHBondContact N-O 2.97Å; F111-K135 PolarHBondContact O-N 2.61Å
112	I	97.8	Very high	79	Confident	4 Å²	4	78.3 Å²	78.3	2%	0.021	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	115.4	-174.1	-53.5	174.9	0	0	0	110.5	L110 V114 I132 I133 T134 H200 L203 N204 A207 F218 L222	L110-I112 HydrophobicContact CD2-CD1 4.11Å; L110-I112 HydrophobicContact CG-CD1 4.19Å; L110-I112 HydrophobicContact CG-CG1 4.14Å; I112-V114 HydrophobicContact CG2-CG2 4.47Å; I112-I132 HydrophobicContact CG2-CG2 3.74Å; I112-I133 WeakPolarHBondContact CA-O 3.34Å; I112-T134 HydrophobicContact CG1-CG2 4.42Å; I112-H200 PolarHBondContact O-CE1 3.35Å; I112-H200 PolarHBondContact O-ND1 3.31Å; I112-L203 HydrophobicContact CD1-CB 4.16Å; I112-L203 HydrophobicContact CG2-CB 3.96Å; I112-L203 HydrophobicContact CG2-CD1 3.77Å; I112-N204 PolarHBondContact O-ND2 2.68Å; I112-A207 HydrophobicContact CD1-CB 3.9Å; I112-F218 HydrophobicContact CD1-CE2 4.32Å; I112-F218 HydrophobicContact CD1-CZ 3.65Å; I112-L222 HydrophobicContact CD1-CD1 3.75Å; I112-L222 HydrophobicContact CD1-CD2 3.94Å; I112-L222 HydrophobicContact CG1-CD1 4.45Å; I112-L222 HydrophobicContact CG2-CD2 4.35Å
113	T	98.1	Very high	80.7	Confident	65 Å²	65	79.2 Å²	79.2	40%	0.399	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	137.8	171.3	-54.9	0	0	0	0	109.7	D115 I132 I133	T113-D115 HydrophobicContact CG2-CB 4.26Å; T113-I132 WeakPolarHBondContact O-CA 3.29Å; T113-I133 PolarHBondContact N-O 2.69Å; T113-I133 PolarHBondContact O-N 2.59Å
114	V	98.2	Very high	82.4	Confident	0 Å²	0	79.3 Å²	79.3	0%	0	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	113.3	172.7	-176.3	0	0	0	0	108.3	I112 Y130 R131 I132 R196 L199 H200 L203	I112-V114 HydrophobicContact CG2-CG2 4.47Å; V114-Y130 HydrophobicContact CG1-CG 4.24Å; V114-R131 CarbonylContact C-O 3.56Å; V114-R131 VanDerWaalsContact CA-O 3.32Å; V114-R131 WeakPolarHBondContact CA-O 3.2Å; V114-I132 HydrophobicContact CG2-CG1 4.33Å; V114-R196 HydrophobicContact CG1-CG 4.37Å; V114-R196 WeakPolarHBondContact O-CD 3.36Å; V114-R196 WeakPolarHBondContact O-CG 3.31Å; V114-R196 PolarHBondContact O-NH1 2.98Å; V114-L199 HydrophobicContact CG1-CB 4.47Å; V114-H200 HydrophobicContact CB-CB 3.95Å; V114-H200 HydrophobicContact CG2-CB 4.21Å; V114-H200 PolarHBondContact N-ND1 3.27Å; V114-L203 HydrophobicContact CG2-CD1 3.59Å
115	D	97.4	Very high	84.4	Confident	39 Å²	39	76.6 Å²	76.6	21%	0.209	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	-168.8	-170	74	-11.8	0	0	0	113.1	T113 R131	T113-D115 HydrophobicContact CG2-CB 4.26Å; D115-R131 PolarHBondContact N-O 2.79Å; D115-R131 PolarHBondContact O-N 2.72Å; D115-R131 WeakPolarHBondContact OD1-CB 3.4Å; D115-R131 IonicContact OD1-CZ 3.52Å; D115-R131 IonicContact OD1-NE 3.43Å; D115-R131 PolarHBondContact OD1-NE 3.32Å; D115-R131 IonicContact OD1-NH2 3.38Å; D115-R131 PolarHBondContact OD1-NH2 2.81Å; D115-R131 IonicContact OD2-CZ 3.25Å; D115-R131 IonicContact OD2-NE 2.69Å; D115-R131 IonicContact OD2-NH2 3.54Å; D115-R131 PolarHBondContact OD2-NH2 2.79Å
116	A	96.1	Very high	86.4	Confident	37 Å²	37	74.4 Å²	74.4	31%	0.306	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	41.3	64.4	174.7	0	0	0	0	0	114.1	E118 R131 R149	A116-E118 PolarHBondContact O-N 3.49Å; A116-R131 HydrophobicContact CB-CB 4.14Å; A116-R149 PolarHBondContact O-NH2 3.25Å
117	P	95.1	Very high	88.1	Confident	55 Å²	55	69.3 Å²	69.3	36%	0.357	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.1	131.5	176	27.3	-34.2	0	0	0	110.9	I128 T129 Y130 I192	P117-I128 HydrophobicContact CB-CG2 4.17Å; P117-T129 WeakPolarHBondContact CA-O 3.3Å; P117-Y130 HydrophobicContact CB-CD1 4.01Å; P117-Y130 HydrophobicContact CB-CE1 3.94Å; P117-I192 HydrophobicContact CB-CG2 3.35Å; P117-I192 HydrophobicContact CG-CG2 3.61Å
118	E	93.5	Very high	89.6	Confident	80 Å²	80	64.1 Å²	64.1	37%	0.374	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	135.8	178.4	-73.4	168.3	-155.1	0	0	111	A116 H120 I128 T129 R149	A116-E118 PolarHBondContact O-N 3.49Å; E118-H120 PolarHBondContact O-CD2 3.23Å; E118-H120 VanDerWaalsContact O-CD2 3.32Å; E118-H120 IonicContact OE2-NE2 3.43Å; E118-H120 PolarHBondContact OE2-NE2 3.44Å; E118-H120 VanDerWaalsContact OE2-NE2 3.15Å; E118-I128 CarbonylContact O-C 3.59Å; E118-I128 VanDerWaalsContact O-CA 3.27Å; E118-I128 WeakPolarHBondContact O-CA 3.49Å; E118-T129 PolarHBondContact N-O 2.83Å; E118-T129 PolarHBondContact O-N 3.5Å; E118-R149 VanDerWaalsContact CD-NH2 3.27Å; E118-R149 IonicContact OE1-CZ 2.71Å; E118-R149 VanDerWaalsContact OE1-CZ 3.25Å; E118-R149 IonicContact OE1-NH1 3.95Å; E118-R149 PolarHBondContact OE1-NH1 3.46Å; E118-R149 IonicContact OE1-NH2 3.67Å; E118-R149 IonicContact OE2-CZ 3.61Å; E118-R149 IonicContact OE2-NE 3.74Å; E118-R149 PolarHBondContact OE2-NE 3.01Å; E118-R149 IonicContact OE2-NH1 2.67Å; E118-R149 PolarHBondContact OE2-NH1 2.88Å; E118-R149 IonicContact OE2-NH2 3.63Å
119	S	90.6	Very high	90.5	Very high	72 Å²	72	61 Å²	61	50%	0.503	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	124.4	173.7	-170.4	0	0	0	0	110.7
120	H	87.6	Confident	90.8	Very high	82 Å²	82	58.8 Å²	58.8	38%	0.38	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	122.5	177.1	-61.8	-91.4	0	0	0	109.7	E118 T126 F127 T129	E118-H120 PolarHBondContact O-CD2 3.23Å; E118-H120 VanDerWaalsContact O-CD2 3.32Å; E118-H120 IonicContact OE2-NE2 3.43Å; E118-H120 PolarHBondContact OE2-NE2 3.44Å; E118-H120 VanDerWaalsContact OE2-NE2 3.15Å; H120-T126 CarbonylContact O-C 3.54Å; H120-T126 VanDerWaalsContact O-CA 3.27Å; H120-T126 WeakPolarHBondContact O-CA 3.49Å; H120-T126 WeakPolarHBondContact O-CG2 3.28Å; H120-F127 HydrophobicContact CB-CD2 4.23Å; H120-F127 HydrophobicContact CB-CE1 4.35Å; H120-F127 HydrophobicContact CB-CE2 3.85Å; H120-F127 HydrophobicContact CB-CZ 3.91Å; H120-F127 PolarHBondContact N-O 3.13Å; H120-F127 PolarHBondContact O-N 3.03Å; H120-T129 VanDerWaalsContact CD2-CG2 3.49Å; H120-T129 WeakPolarHBondContact CD2-CG2 3.39Å; H120-T129 PolarHBondContact CD2-OG1 3.4Å
121	V	85.9	Confident	91	Very high	115 Å²	115	61.8 Å²	61.8	70%	0.697	34%	0.338	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.7	120.9	174.7	-176.1	0	0	0	0	108.8	T126	V121-T126 HydrophobicContact CG2-CG2 3.89Å
122	T	82.2	Confident	91.1	Very high	62 Å²	62	56.2 Å²	56.2	38%	0.38	31%	0.314	S	S	.	.			trans	-110	174.2	170.1	70.9	0	0	0	0	110.2	I124 E125 F127	T122-I124 PolarHBondContact O-N 3.08Å; T122-I124 VanDerWaalsContact O-N 3.16Å; T122-I124 PolarHBondContact OG1-N 3.24Å; T122-E125 WeakPolarHBondContact CB-O 3.34Å; T122-E125 PolarHBondContact N-O 3.46Å; T122-E125 PolarHBondContact OG1-N 3.36Å; T122-E125 PolarHBondContact OG1-O 3.02Å; T122-F127 HydrophobicContact CG2-CE1 3.77Å; T122-F127 HydrophobicContact CG2-CZ 4.48Å
123	T	79.3	Confident	91.1	Very high	146 Å²	146	57.4 Å²	57.4	90%	0.896	32%	0.319	S	S	*	.	S	Bend	trans	-64.9	-12.1	175.1	47.1	0	0	0	0	114.6
124	I	78.4	Confident	91.1	Very high	158 Å²	158	54.3 Å²	54.3	81%	0.81	30%	0.3	S	S	*	.	S	Bend	trans	-122.8	-35.9	-172.4	-60	171.4	0	0	0	111.6	T122	T122-I124 PolarHBondContact O-N 3.08Å; T122-I124 VanDerWaalsContact O-N 3.16Å; T122-I124 PolarHBondContact OG1-N 3.24Å
125	E	81.4	Confident	91	Very high	83 Å²	83	59 Å²	59	39%	0.388	32%	0.321	S	S	.	.			trans	-149.8	154.2	-177.5	55.6	167.5	173	0	0	113.2	T122 F127 R151	T122-E125 WeakPolarHBondContact CB-O 3.34Å; T122-E125 PolarHBondContact N-O 3.46Å; T122-E125 PolarHBondContact OG1-N 3.36Å; T122-E125 PolarHBondContact OG1-O 3.02Å; E125-F127 HydrophobicContact CG-CD1 4.03Å; E125-F127 HydrophobicContact CG-CE1 4.49Å; E125-R151 VanDerWaalsContact CD-NH2 3.34Å; E125-R151 IonicContact OE1-CZ 2.71Å; E125-R151 IonicContact OE1-NH1 2.68Å; E125-R151 PolarHBondContact OE1-NH1 2.69Å; E125-R151 IonicContact OE1-NH2 2.69Å; E125-R151 PolarHBondContact OE1-NH2 3.03Å; E125-R151 IonicContact OE2-CZ 2.68Å; E125-R151 IonicContact OE2-NH1 2.79Å; E125-R151 IonicContact OE2-NH2 3.15Å; E125-R151 PolarHBondContact OE2-NH2 3.09Å
126	T	84.3	Confident	90.9	Very high	39 Å²	39	57.9 Å²	57.9	24%	0.239	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	129.9	165.4	-49.5	0	0	0	0	109	H120 V121 F187	H120-T126 CarbonylContact O-C 3.54Å; H120-T126 VanDerWaalsContact O-CA 3.27Å; H120-T126 WeakPolarHBondContact O-CA 3.49Å; H120-T126 WeakPolarHBondContact O-CG2 3.28Å; V121-T126 HydrophobicContact CG2-CG2 3.89Å; T126-F187 HydrophobicContact CG2-CE1 3.71Å; T126-F187 HydrophobicContact CG2-CZ 3.48Å; T126-F187 VanDerWaalsContact CG2-CZ 3.48Å
127	F	87.8	Confident	90.7	Very high	43 Å²	43	60.8 Å²	60.8	19%	0.189	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	156.2	179.3	61.5	-93.9	0	0	0	111.9	H120 T122 E125 T129 R151	H120-F127 HydrophobicContact CB-CD2 4.23Å; H120-F127 HydrophobicContact CB-CE1 4.35Å; H120-F127 HydrophobicContact CB-CE2 3.85Å; H120-F127 HydrophobicContact CB-CZ 3.91Å; H120-F127 PolarHBondContact N-O 3.13Å; H120-F127 PolarHBondContact O-N 3.03Å; T122-F127 HydrophobicContact CG2-CE1 3.77Å; T122-F127 HydrophobicContact CG2-CZ 4.48Å; E125-F127 HydrophobicContact CG-CD1 4.03Å; E125-F127 HydrophobicContact CG-CE1 4.49Å; F127-T129 HydrophobicContact CD2-CG2 3.9Å; F127-T129 HydrophobicContact CE2-CG2 3.61Å; F127-R151 HydrophobicContact CD2-CB 3.94Å; F127-R151 HydrophobicContact CE2-CB 4.46Å
128	I	91.4	Very high	90.5	Very high	20 Å²	20	59.3 Å²	59.3	10%	0.103	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	136.8	177.2	-57.8	179	0	0	0	109.4	P117 E118 Y130 R151 F187 I192	P117-I128 HydrophobicContact CB-CG2 4.17Å; E118-I128 CarbonylContact O-C 3.59Å; E118-I128 VanDerWaalsContact O-CA 3.27Å; E118-I128 WeakPolarHBondContact O-CA 3.49Å; I128-Y130 HydrophobicContact CG2-CE1 4.25Å; I128-Y130 HydrophobicContact CG2-CE2 4.23Å; I128-R151 WeakPolarHBondContact O-CA 3.47Å; I128-R151 WeakPolarHBondContact O-CB 3Å; I128-F187 HydrophobicContact CD1-CD1 4.1Å; I128-F187 HydrophobicContact CG1-CD1 4.38Å; I128-F187 HydrophobicContact CG1-CE1 4.36Å; I128-I192 HydrophobicContact CD1-CD1 3.55Å; I128-I192 HydrophobicContact CD1-CG1 3.51Å
129	T	95.3	Very high	90.2	Very high	12 Å²	12	59.6 Å²	59.6	7%	0.074	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	147.9	165.9	70.9	0	0	0	0	110.4	P117 E118 H120 F127 R149 R150 R151	P117-T129 WeakPolarHBondContact CA-O 3.3Å; E118-T129 PolarHBondContact N-O 2.83Å; E118-T129 PolarHBondContact O-N 3.5Å; H120-T129 VanDerWaalsContact CD2-CG2 3.49Å; H120-T129 WeakPolarHBondContact CD2-CG2 3.39Å; H120-T129 PolarHBondContact CD2-OG1 3.4Å; F127-T129 HydrophobicContact CD2-CG2 3.9Å; F127-T129 HydrophobicContact CE2-CG2 3.61Å; T129-R149 PolarHBondContact O-NH2 3.08Å; T129-R149 VanDerWaalsContact O-NH2 3.08Å; T129-R149 PolarHBondContact OG1-NE 2.92Å; T129-R149 PolarHBondContact OG1-NH2 3.36Å; T129-R149 VanDerWaalsContact OG1-NH2 3.12Å; T129-R150 CarbonylContact C-O 3.55Å; T129-R150 VanDerWaalsContact CA-O 3.32Å; T129-R150 WeakPolarHBondContact CA-O 3.23Å; T129-R151 HydrophobicContact CG2-CB 4.19Å
130	Y	97.2	Very high	90.1	Very high	2 Å²	2	60.2 Å²	60.2	1%	0.008	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	141.5	171.9	-53.7	-87	0	0	0	107.9	V114 P117 I128 R149 R150 F155 I192 R195 R196 L199	V114-Y130 HydrophobicContact CG1-CG 4.24Å; P117-Y130 HydrophobicContact CB-CD1 4.01Å; P117-Y130 HydrophobicContact CB-CE1 3.94Å; I128-Y130 HydrophobicContact CG2-CE1 4.25Å; I128-Y130 HydrophobicContact CG2-CE2 4.23Å; Y130-R149 WeakPolarHBondContact O-CA 3.41Å; Y130-R150 PolarHBondContact N-O 3.16Å; Y130-R150 PolarHBondContact O-N 3.15Å; Y130-F155 HydrophobicContact CD2-CE2 4.41Å; Y130-I192 HydrophobicContact CE1-CG2 4.33Å; Y130-R195 WeakPolarHBondContact OH-CD 3.31Å; Y130-R195 WeakPolarHBondContact OH-CG 3.24Å; Y130-R196 HydrophobicContact CD1-CB 4.09Å; Y130-R196 HydrophobicContact CD1-CG 4.06Å; Y130-R196 HydrophobicContact CE1-CB 3.9Å; Y130-R196 HydrophobicContact CE1-CG 4.39Å; Y130-L199 HydrophobicContact CD2-CD1 3.6Å; Y130-L199 HydrophobicContact CE2-CD1 3.45Å; Y130-L199 VanDerWaalsContact CE2-CD1 3.45Å; Y130-L199 HydrophobicContact CG-CD1 4.26Å
131	R	97.9	Very high	90.2	Very high	67 Å²	67	57.3 Å²	57.3	25%	0.253	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	139.2	166.1	178.4	174	63.2	179.4	4.4	108.4	V114 D115 A116 I133 E147	V114-R131 CarbonylContact C-O 3.56Å; V114-R131 VanDerWaalsContact CA-O 3.32Å; V114-R131 WeakPolarHBondContact CA-O 3.2Å; D115-R131 PolarHBondContact N-O 2.79Å; D115-R131 PolarHBondContact O-N 2.72Å; D115-R131 WeakPolarHBondContact OD1-CB 3.4Å; D115-R131 IonicContact OD1-CZ 3.52Å; D115-R131 IonicContact OD1-NE 3.43Å; D115-R131 PolarHBondContact OD1-NE 3.32Å; D115-R131 IonicContact OD1-NH2 3.38Å; D115-R131 PolarHBondContact OD1-NH2 2.81Å; D115-R131 IonicContact OD2-CZ 3.25Å; D115-R131 IonicContact OD2-NE 2.69Å; D115-R131 IonicContact OD2-NH2 3.54Å; D115-R131 PolarHBondContact OD2-NH2 2.79Å; A116-R131 HydrophobicContact CB-CB 4.14Å; R131-I133 HydrophobicContact CG-CG1 4.13Å; R131-E147 VanDerWaalsContact CD-CD 3.47Å; R131-E147 WeakPolarHBondContact CD-OE1 3.3Å; R131-E147 HydrophobicContact CG-CG 3.86Å; R131-E147 IonicContact NH1-OE1 3.99Å
132	I	98.5	Very high	90.3	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	120.1	171.7	-52.4	-177.8	0	0	0	106.7	I112 T113 V114 E147 V148 R150 F155 L203 F221 L222	I112-I132 HydrophobicContact CG2-CG2 3.74Å; T113-I132 WeakPolarHBondContact O-CA 3.29Å; V114-I132 HydrophobicContact CG2-CG1 4.33Å; I132-E147 WeakPolarHBondContact O-CA 3.46Å; I132-V148 HydrophobicContact CB-CG2 3.91Å; I132-V148 PolarHBondContact N-O 3.32Å; I132-V148 PolarHBondContact O-N 3.05Å; I132-R150 HydrophobicContact CD1-CB 3.87Å; I132-R150 HydrophobicContact CD1-CG 3.37Å; I132-R150 HydrophobicContact CG1-CG 4.22Å; I132-F155 HydrophobicContact CD1-CE1 4.46Å; I132-F155 HydrophobicContact CD1-CZ 3.9Å; I132-L203 HydrophobicContact CD1-CD1 3.78Å; I132-L203 HydrophobicContact CG1-CD1 4.43Å; I132-L203 HydrophobicContact CG2-CD1 4.13Å; I132-F221 HydrophobicContact CD1-CD1 4.45Å; I132-F221 HydrophobicContact CD1-CE1 3.49Å; I132-F221 VanDerWaalsContact CD1-CE1 3.49Å; I132-F221 HydrophobicContact CD1-CZ 3.85Å; I132-L222 HydrophobicContact CG2-CD2 4.14Å
133	I	98.1	Very high	90.8	Very high	28 Å²	28	58.2 Å²	58.2	14%	0.144	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	122.1	170.9	-60	171.8	0	0	0	106.7	I112 T113 R131 K135 F146 E147	I112-I133 WeakPolarHBondContact CA-O 3.34Å; T113-I133 PolarHBondContact N-O 2.69Å; T113-I133 PolarHBondContact O-N 2.59Å; R131-I133 HydrophobicContact CG-CG1 4.13Å; I133-K135 HydrophobicContact CG2-CG 4.44Å; I133-F146 WeakPolarHBondContact CA-O 3.25Å; I133-E147 HydrophobicContact CG1-CG 4.47Å
134	T	97.7	Very high	91.4	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	122.8	178	-58.2	0	0	0	0	108.9	L110 F111 I112 E145 F146 L222	L110-T134 HydrophobicContact CD1-CG2 3.43Å; L110-T134 VanDerWaalsContact CD1-CG2 3.43Å; L110-T134 HydrophobicContact CG-CG2 4.49Å; F111-T134 WeakPolarHBondContact O-CA 3.49Å; I112-T134 HydrophobicContact CG1-CG2 4.42Å; T134-E145 CarbonylContact O-C 3.56Å; T134-E145 VanDerWaalsContact O-CA 3.3Å; T134-E145 WeakPolarHBondContact O-CA 3.5Å; T134-F146 PolarHBondContact N-O 3.27Å; T134-F146 PolarHBondContact O-N 2.71Å; T134-L222 HydrophobicContact CG2-CB 4.28Å; T134-L222 HydrophobicContact CG2-CD1 3.99Å
135	K	96.4	Very high	92.3	Very high	99 Å²	99	52.3 Å²	52.3	43%	0.43	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	135.2	174.3	-69.5	177.3	173.4	179.2	0	109.7	F111 I133 S144 E145	F111-K135 HydrophobicContact CB-CB 4.34Å; F111-K135 PolarHBondContact N-O 2.97Å; F111-K135 PolarHBondContact O-N 2.61Å; I133-K135 HydrophobicContact CG2-CG 4.44Å; K135-S144 WeakPolarHBondContact CA-O 3.42Å; K135-E145 WeakPolarHBondContact CE-OE1 3.42Å; K135-E145 WeakPolarHBondContact CE-OE2 3.4Å; K135-E145 HydrophobicContact CG-CB 4.38Å; K135-E145 HydrophobicContact CG-CG 4.06Å; K135-E145 IonicContact NZ-OE1 2.7Å; K135-E145 PolarHBondContact NZ-OE1 3.29Å; K135-E145 IonicContact NZ-OE2 3.89Å
136	T	94.5	Very high	93	Very high	15 Å²	15	49.4 Å²	49.4	9%	0.092	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	151.5	-176.2	-173	0	0	0	0	113.7	D109 R138 F141 S144 F146	D109-T136 WeakPolarHBondContact O-CA 3.39Å; D109-T136 VanDerWaalsContact O-CB 3.28Å; D109-T136 WeakPolarHBondContact O-CB 3.49Å; D109-T136 PolarHBondContact O-OG1 2.71Å; T136-R138 WeakPolarHBondContact OG1-CB 3.48Å; T136-R138 PolarHBondContact OG1-N 2.93Å; T136-R138 VanDerWaalsContact OG1-N 3.08Å; T136-F141 HydrophobicContact CG2-CB 3.82Å; T136-F141 HydrophobicContact CG2-CD1 4.08Å; T136-F141 HydrophobicContact CG2-CD2 3.84Å; T136-F141 HydrophobicContact CG2-CE2 4.43Å; T136-F141 HydrophobicContact CG2-CG 3.65Å; T136-S144 PolarHBondContact N-O 3.43Å; T136-F146 HydrophobicContact CG2-CE2 4.5Å
137	S	91.5	Very high	93.7	Very high	98 Å²	98	52.7 Å²	52.7	69%	0.685	30%	0.296	S	S	*	.			trans	-103.5	-0.5	169.6	54.1	0	0	0	0	113.1	D109 G139	D109-S137 PolarHBondContact O-N 2.67Å; S137-G139 PolarHBondContact O-N 3.44Å
138	R	91.3	Very high	94.1	Very high	25 Å²	25	50.8 Å²	50.8	9%	0.094	29%	0.288	C	S	.	.			trans	-73	124.8	-177.8	-66.1	-173.3	-174	163.8	12.4	111.8	D109 T136 E140 F141 T213	D109-R138 HydrophobicContact CB-CG 4.06Å; D109-R138 IonicContact OD1-CZ 3.38Å; D109-R138 IonicContact OD1-NE 3.18Å; D109-R138 PolarHBondContact OD1-NE 3.34Å; D109-R138 IonicContact OD1-NH2 2.66Å; D109-R138 PolarHBondContact OD1-NH2 3.16Å; D109-R138 VanDerWaalsContact OD2-CG 3.25Å; D109-R138 WeakPolarHBondContact OD2-CG 3.5Å; D109-R138 IonicContact OD2-CZ 2.63Å; D109-R138 IonicContact OD2-NE 3.91Å; D109-R138 PolarHBondContact OD2-NE 3.3Å; D109-R138 IonicContact OD2-NH2 3.63Å; T136-R138 WeakPolarHBondContact OG1-CB 3.48Å; T136-R138 PolarHBondContact OG1-N 2.93Å; T136-R138 VanDerWaalsContact OG1-N 3.08Å; R138-E140 HydrophobicContact CB-CG 4.03Å; R138-E140 WeakPolarHBondContact CD-OE1 3.35Å; R138-E140 IonicContact NH1-OE1 2.69Å; R138-E140 PolarHBondContact NH1-OE1 3.47Å; R138-E140 PolarHBondContact O-N 3.38Å; R138-F141 HydrophobicContact CB-CD2 3.85Å; R138-F141 HydrophobicContact CB-CE2 4.19Å; R138-F141 PolarHBondContact O-N 2.91Å; R138-F141 VanDerWaalsContact O-N 3.17Å; R138-T213 PolarHBondContact NH1-O 3.02Å; R138-T213 PolarHBondContact NH1-OG1 3.29Å; R138-T213 PolarHBondContact NH2-OG1 2.63Å
139	G	87.7	Confident	94.4	Very high	86 Å²	86	52.6 Å²	52.6	89%	0.887	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-2.1	178.4	0	0	0	0	0	116	S137 F141	S137-G139 PolarHBondContact O-N 3.44Å; G139-F141 VanDerWaalsContact C-N 3.33Å
140	E	88	Confident	94.4	Very high	85 Å²	85	52.1 Å²	52.1	40%	0.397	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-13.7	172	71.2	-162.3	-168.4	0	0	113.1	R138 K219	R138-E140 HydrophobicContact CB-CG 4.03Å; R138-E140 WeakPolarHBondContact CD-OE1 3.35Å; R138-E140 IonicContact NH1-OE1 2.69Å; R138-E140 PolarHBondContact NH1-OE1 3.47Å; R138-E140 PolarHBondContact O-N 3.38Å; E140-K219 VanDerWaalsContact O-CE 3.23Å; E140-K219 WeakPolarHBondContact O-CE 3.21Å; E140-K219 PolarHBondContact O-NZ 3.09Å
141	F	88.8	Confident	94.3	Very high	21 Å²	21	54.6 Å²	54.6	9%	0.092	30%	0.3	C	S	.	.	S	Bend	trans	-93.6	145	174.9	-69.4	-104.2	0	0	0	110.8	L110 T136 R138 G139 S143 F146 K219 T223	L110-F141 HydrophobicContact CD1-CZ 4.22Å; T136-F141 HydrophobicContact CG2-CB 3.82Å; T136-F141 HydrophobicContact CG2-CD1 4.08Å; T136-F141 HydrophobicContact CG2-CD2 3.84Å; T136-F141 HydrophobicContact CG2-CE2 4.43Å; T136-F141 HydrophobicContact CG2-CG 3.65Å; R138-F141 HydrophobicContact CB-CD2 3.85Å; R138-F141 HydrophobicContact CB-CE2 4.19Å; R138-F141 PolarHBondContact O-N 2.91Å; R138-F141 VanDerWaalsContact O-N 3.17Å; G139-F141 VanDerWaalsContact C-N 3.33Å; F141-S143 VanDerWaalsContact C-N 3.34Å; F141-F146 HydrophobicContact CB-CE2 3.93Å; F141-F146 HydrophobicContact CB-CZ 4.03Å; F141-F146 HydrophobicContact CD1-CD2 4.32Å; F141-F146 AromaticContact CD1-CE2 3.48Å; F141-F146 HydrophobicContact CD1-CE2 3.48Å; F141-F146 VanDerWaalsContact CD1-CE2 3.48Å; F141-F146 AromaticContact CD1-CZ 3.87Å; F141-F146 HydrophobicContact CD1-CZ 3.87Å; F141-F146 HydrophobicContact CE1-CE2 4.42Å; F141-F146 HydrophobicContact CG-CE2 4.12Å; F141-F146 HydrophobicContact CG-CZ 4.45Å; F141-K219 HydrophobicContact CE1-CG 3.96Å; F141-K219 HydrophobicContact CZ-CG 4.12Å; F141-T223 HydrophobicContact CD1-CG2 3.69Å; F141-T223 HydrophobicContact CE1-CG2 3.78Å
142	D	89	Confident	94.1	Very high	144 Å²	144	52.4 Å²	52.4	77%	0.77	29%	0.291	S	S	*	.	S	Bend	trans	-83.1	-9	-179.5	57.7	-39	0	0	0	114	F146	D142-F146 VanDerWaalsContact OD1-CE1 3.31Å; D142-F146 WeakPolarHBondContact OD1-CE1 3.47Å; D142-F146 VanDerWaalsContact OD1-CZ 3.24Å; D142-F146 WeakPolarHBondContact OD1-CZ 3.27Å
143	S	92.6	Very high	93.7	Very high	51 Å²	51	55.9 Å²	55.9	36%	0.357	31%	0.308	S	S	.	.			trans	-141.2	155.2	172.9	-179.4	0	0	0	0	110	F141 E145 F146	F141-S143 VanDerWaalsContact C-N 3.34Å; S143-E145 VanDerWaalsContact C-N 3.33Å; S143-E145 WeakPolarHBondContact CB-O 3.42Å; S143-E145 PolarHBondContact OG-N 2.92Å; S143-E145 PolarHBondContact OG-O 3.18Å; S143-F146 WeakPolarHBondContact O-CE2 3.42Å
144	S	92.4	Very high	93.6	Very high	86 Å²	86	55.6 Å²	55.6	60%	0.601	31%	0.306	S	S	*	.	S	Bend	trans	-80.4	-14.6	170.5	58.2	0	0	0	0	113.3	K135 T136	K135-S144 WeakPolarHBondContact CA-O 3.42Å; T136-S144 PolarHBondContact N-O 3.43Å
145	E	96.2	Very high	93.6	Very high	94 Å²	94	55.6 Å²	55.6	44%	0.439	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	136.9	179.7	-176.2	162.8	-164.3	0	0	111.2	T134 K135 S143	T134-E145 CarbonylContact O-C 3.56Å; T134-E145 VanDerWaalsContact O-CA 3.3Å; T134-E145 WeakPolarHBondContact O-CA 3.5Å; K135-E145 WeakPolarHBondContact CE-OE1 3.42Å; K135-E145 WeakPolarHBondContact CE-OE2 3.4Å; K135-E145 HydrophobicContact CG-CB 4.38Å; K135-E145 HydrophobicContact CG-CG 4.06Å; K135-E145 IonicContact NZ-OE1 2.7Å; K135-E145 PolarHBondContact NZ-OE1 3.29Å; K135-E145 IonicContact NZ-OE2 3.89Å; S143-E145 VanDerWaalsContact C-N 3.33Å; S143-E145 WeakPolarHBondContact CB-O 3.42Å; S143-E145 PolarHBondContact OG-N 2.92Å; S143-E145 PolarHBondContact OG-O 3.18Å
146	F	97	Very high	93.5	Very high	23 Å²	23	53.6 Å²	53.6	10%	0.101	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	139.1	175.3	-56.9	-95.5	0	0	0	110.1	I133 T134 T136 F141 D142 S143 T223	I133-F146 WeakPolarHBondContact CA-O 3.25Å; T134-F146 PolarHBondContact N-O 3.27Å; T134-F146 PolarHBondContact O-N 2.71Å; T136-F146 HydrophobicContact CG2-CE2 4.5Å; F141-F146 HydrophobicContact CB-CE2 3.93Å; F141-F146 HydrophobicContact CB-CZ 4.03Å; F141-F146 HydrophobicContact CD1-CD2 4.32Å; F141-F146 AromaticContact CD1-CE2 3.48Å; F141-F146 HydrophobicContact CD1-CE2 3.48Å; F141-F146 VanDerWaalsContact CD1-CE2 3.48Å; F141-F146 AromaticContact CD1-CZ 3.87Å; F141-F146 HydrophobicContact CD1-CZ 3.87Å; F141-F146 HydrophobicContact CE1-CE2 4.42Å; F141-F146 HydrophobicContact CG-CE2 4.12Å; F141-F146 HydrophobicContact CG-CZ 4.45Å; D142-F146 VanDerWaalsContact OD1-CE1 3.31Å; D142-F146 WeakPolarHBondContact OD1-CE1 3.47Å; D142-F146 VanDerWaalsContact OD1-CZ 3.24Å; D142-F146 WeakPolarHBondContact OD1-CZ 3.27Å; S143-F146 WeakPolarHBondContact O-CE2 3.42Å; F146-T223 HydrophobicContact CD1-CG2 3.71Å; F146-T223 HydrophobicContact CD2-CG2 4.01Å; F146-T223 HydrophobicContact CE1-CG2 3.54Å; F146-T223 HydrophobicContact CE2-CG2 3.88Å; F146-T223 HydrophobicContact CG-CG2 3.94Å; F146-T223 HydrophobicContact CZ-CG2 3.62Å
147	E	97.4	Very high	93.5	Very high	108 Å²	108	54.9 Å²	54.9	51%	0.505	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	121.5	167.5	-173.2	178.6	156.5	0	0	108.9	R131 I132 I133 Q225	R131-E147 VanDerWaalsContact CD-CD 3.47Å; R131-E147 WeakPolarHBondContact CD-OE1 3.3Å; R131-E147 HydrophobicContact CG-CG 3.86Å; R131-E147 IonicContact NH1-OE1 3.99Å; I132-E147 WeakPolarHBondContact O-CA 3.46Å; I133-E147 HydrophobicContact CG1-CG 4.47Å; E147-Q225 PolarHBondContact O-NE2 2.67Å
148	V	97.6	Very high	93.7	Very high	2 Å²	2	50.2 Å²	50.2	1%	0.012	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	153.7	177.1	-61.4	0	0	0	0	110.7	I132 R150 L222	I132-V148 HydrophobicContact CB-CG2 3.91Å; I132-V148 PolarHBondContact N-O 3.32Å; I132-V148 PolarHBondContact O-N 3.05Å; V148-R150 HydrophobicContact CG2-CG 4.47Å; V148-L222 WeakPolarHBondContact CG1-O 3.13Å; V148-L222 VanDerWaalsContact CG2-O 3.31Å; V148-L222 WeakPolarHBondContact CG2-O 3.48Å
149	R	96.6	Very high	93.9	Very high	59 Å²	59	50.9 Å²	50.9	22%	0.223	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	140.2	170.4	-57.9	-161	71.8	93	6.5	111	A116 E118 T129 Y130	A116-R149 PolarHBondContact O-NH2 3.25Å; E118-R149 VanDerWaalsContact CD-NH2 3.27Å; E118-R149 IonicContact OE1-CZ 2.71Å; E118-R149 VanDerWaalsContact OE1-CZ 3.25Å; E118-R149 IonicContact OE1-NH1 3.95Å; E118-R149 PolarHBondContact OE1-NH1 3.46Å; E118-R149 IonicContact OE1-NH2 3.67Å; E118-R149 IonicContact OE2-CZ 3.61Å; E118-R149 IonicContact OE2-NE 3.74Å; E118-R149 PolarHBondContact OE2-NE 3.01Å; E118-R149 IonicContact OE2-NH1 2.67Å; E118-R149 PolarHBondContact OE2-NH1 2.88Å; E118-R149 IonicContact OE2-NH2 3.63Å; T129-R149 PolarHBondContact O-NH2 3.08Å; T129-R149 VanDerWaalsContact O-NH2 3.08Å; T129-R149 PolarHBondContact OG1-NE 2.92Å; T129-R149 PolarHBondContact OG1-NH2 3.36Å; T129-R149 VanDerWaalsContact OG1-NH2 3.12Å; Y130-R149 WeakPolarHBondContact O-CA 3.41Å
150	R	96.9	Very high	94.3	Very high	1 Å²	1	47.5 Å²	47.5	0%	0.004	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	135.4	178.9	-60.8	-63.3	178.3	-116.4	4.4	111.4	T129 Y130 I132 V148 D154 F155 F221 A224	T129-R150 CarbonylContact C-O 3.55Å; T129-R150 VanDerWaalsContact CA-O 3.32Å; T129-R150 WeakPolarHBondContact CA-O 3.23Å; Y130-R150 PolarHBondContact N-O 3.16Å; Y130-R150 PolarHBondContact O-N 3.15Å; I132-R150 HydrophobicContact CD1-CB 3.87Å; I132-R150 HydrophobicContact CD1-CG 3.37Å; I132-R150 HydrophobicContact CG1-CG 4.22Å; V148-R150 HydrophobicContact CG2-CG 4.47Å; R150-D154 VanDerWaalsContact CA-OD2 3.28Å; R150-D154 WeakPolarHBondContact CA-OD2 3.49Å; R150-D154 HydrophobicContact CB-CB 4.18Å; R150-F155 HydrophobicContact CB-CD2 4.32Å; R150-F155 HydrophobicContact CB-CE2 3.67Å; R150-F155 HydrophobicContact CB-CZ 4.3Å; R150-F221 HydrophobicContact CB-CE2 4.29Å; R150-F221 HydrophobicContact CB-CZ 4.03Å; R150-F221 HydrophobicContact CG-CE1 4.18Å; R150-F221 HydrophobicContact CG-CE2 3.85Å; R150-F221 HydrophobicContact CG-CZ 3.64Å; R150-F221 PolarHBondContact NE-O 3.42Å; R150-F221 PolarHBondContact NH2-O 2.83Å; R150-A224 VanDerWaalsContact CZ-O 3.3Å; R150-A224 PolarHBondContact NH1-O 3.38Å; R150-A224 PolarHBondContact NH2-O 2.9Å
151	R	94.3	Very high	94.6	Very high	54 Å²	54	45.4 Å²	45.4	20%	0.204	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	159.5	167.7	61.5	-176	-65.2	-172.2	0.4	110.3	E125 F127 I128 T129 Q153 D154 F155	E125-R151 VanDerWaalsContact CD-NH2 3.34Å; E125-R151 IonicContact OE1-CZ 2.71Å; E125-R151 IonicContact OE1-NH1 2.68Å; E125-R151 PolarHBondContact OE1-NH1 2.69Å; E125-R151 IonicContact OE1-NH2 2.69Å; E125-R151 PolarHBondContact OE1-NH2 3.03Å; E125-R151 IonicContact OE2-CZ 2.68Å; E125-R151 IonicContact OE2-NH1 2.79Å; E125-R151 IonicContact OE2-NH2 3.15Å; E125-R151 PolarHBondContact OE2-NH2 3.09Å; F127-R151 HydrophobicContact CD2-CB 3.94Å; F127-R151 HydrophobicContact CE2-CB 4.46Å; I128-R151 WeakPolarHBondContact O-CA 3.47Å; I128-R151 WeakPolarHBondContact O-CB 3Å; T129-R151 HydrophobicContact CG2-CB 4.19Å; R151-Q153 HydrophobicContact CG-CB 4.36Å; R151-Q153 PolarHBondContact O-N 3.49Å; R151-D154 WeakPolarHBondContact CG-OD2 3.32Å; R151-D154 PolarHBondContact N-OD2 2.73Å; R151-D154 WeakPolarHBondContact O-CA 3.31Å; R151-D154 VanDerWaalsContact O-CB 3.25Å; R151-D154 WeakPolarHBondContact O-CB 3.46Å; R151-D154 PolarHBondContact O-N 3.18Å; R151-F155 WeakPolarHBondContact O-CD2 3.45Å
152	Y	92.9	Very high	94.9	Very high	21 Å²	21	44.4 Å²	44.4	8%	0.082	23%	0.225	C	C	.	.	H	α-helix	trans	-51.3	-32.5	179	176.9	-99.1	0	0	0	114.8	D154 F155 L156 P175 K177 L199	Y152-D154 VanDerWaalsContact C-N 3.25Å; Y152-D154 PolarHBondContact O-N 3.17Å; Y152-F155 PolarHBondContact O-N 2.79Å; Y152-L156 HydrophobicContact CD1-CD1 4.11Å; Y152-L156 HydrophobicContact CD1-CG 4.49Å; Y152-L156 HydrophobicContact CE1-CD1 3.58Å; Y152-L156 HydrophobicContact CE1-CD2 4.45Å; Y152-L156 HydrophobicContact CE1-CG 3.95Å; Y152-L156 PolarHBondContact O-N 3.42Å; Y152-P175 HydrophobicContact CE2-CG 4.24Å; Y152-P175 VanDerWaalsContact CE2-O 3.27Å; Y152-P175 WeakPolarHBondContact CE2-O 3.34Å; Y152-P175 VanDerWaalsContact CZ-O 3.3Å; Y152-P175 PolarHBondContact OH-O 2.72Å; Y152-K177 HydrophobicContact CE1-CB 3.9Å; Y152-K177 HydrophobicContact CE1-CG 4.05Å; Y152-K177 PolarHBondContact OH-N 2.95Å; Y152-L199 HydrophobicContact CD2-CD2 4.19Å
153	Q	91.4	Very high	95.1	Very high	74 Å²	74	39.5 Å²	39.5	35%	0.346	20%	0.197	S	C	.	.	H	α-helix	trans	-68.3	-19.2	174.5	-64.2	-60.6	-57.2	0	0	114	R151 W157	R151-Q153 HydrophobicContact CG-CB 4.36Å; R151-Q153 PolarHBondContact O-N 3.49Å; Q153-W157 PolarHBondContact O-N 3.01Å
154	D	95.4	Very high	95.1	Very high	21 Å²	21	41.6 Å²	41.6	11%	0.112	20%	0.204	C	C	.	.	H	α-helix	trans	-74.7	-38.5	172.6	-52.4	-31.3	0	0	0	111	R150 R151 Y152 W157 L158 F221 L229 K233	R150-D154 VanDerWaalsContact CA-OD2 3.28Å; R150-D154 WeakPolarHBondContact CA-OD2 3.49Å; R150-D154 HydrophobicContact CB-CB 4.18Å; R151-D154 WeakPolarHBondContact CG-OD2 3.32Å; R151-D154 PolarHBondContact N-OD2 2.73Å; R151-D154 WeakPolarHBondContact O-CA 3.31Å; R151-D154 VanDerWaalsContact O-CB 3.25Å; R151-D154 WeakPolarHBondContact O-CB 3.46Å; R151-D154 PolarHBondContact O-N 3.18Å; Y152-D154 VanDerWaalsContact C-N 3.25Å; Y152-D154 PolarHBondContact O-N 3.17Å; D154-W157 WeakPolarHBondContact O-CB 3.42Å; D154-W157 PolarHBondContact O-N 3.06Å; D154-L158 PolarHBondContact O-N 2.9Å; D154-F221 HydrophobicContact CB-CD2 4.49Å; D154-F221 HydrophobicContact CB-CE2 3.77Å; D154-L229 HydrophobicContact CB-CD2 4.24Å; D154-K233 IonicContact OD1-NZ 3.15Å; D154-K233 PolarHBondContact OD1-NZ 2.87Å
155	F	97	Very high	95	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-65.4	-42.4	175.1	-67.7	-100.7	0	0	0	111.4	Y130 I132 R150 R151 Y152 W157 L158 K159 L174 L199 F202 L203 F221	Y130-F155 HydrophobicContact CD2-CE2 4.41Å; I132-F155 HydrophobicContact CD1-CE1 4.46Å; I132-F155 HydrophobicContact CD1-CZ 3.9Å; R150-F155 HydrophobicContact CB-CD2 4.32Å; R150-F155 HydrophobicContact CB-CE2 3.67Å; R150-F155 HydrophobicContact CB-CZ 4.3Å; R151-F155 WeakPolarHBondContact O-CD2 3.45Å; Y152-F155 PolarHBondContact O-N 2.79Å; F155-W157 VanDerWaalsContact C-N 3.28Å; F155-W157 PolarHBondContact O-N 3.01Å; F155-L158 PolarHBondContact O-N 3.01Å; F155-L158 VanDerWaalsContact O-N 3.17Å; F155-K159 PolarHBondContact O-N 3.03Å; F155-L174 HydrophobicContact CB-CD1 3.97Å; F155-L174 HydrophobicContact CB-CD2 3.84Å; F155-L174 HydrophobicContact CD1-CD2 4.35Å; F155-L174 HydrophobicContact CG-CD2 4.5Å; F155-L174 WeakPolarHBondContact O-CD1 3.46Å; F155-L199 HydrophobicContact CB-CD2 4.15Å; F155-L199 HydrophobicContact CD1-CB 4.42Å; F155-L199 HydrophobicContact CD1-CD2 3.67Å; F155-L199 HydrophobicContact CD1-CG 4.46Å; F155-L199 HydrophobicContact CD2-CD1 4.19Å; F155-L199 HydrophobicContact CD2-CD2 4.17Å; F155-L199 HydrophobicContact CE1-CB 3.87Å; F155-L199 HydrophobicContact CE1-CD1 4.4Å; F155-L199 HydrophobicContact CE1-CD2 3.97Å; F155-L199 HydrophobicContact CE1-CG 4.29Å; F155-L199 HydrophobicContact CE2-CD1 3.91Å; F155-L199 HydrophobicContact CE2-CD2 4.48Å; F155-L199 HydrophobicContact CG-CD2 3.76Å; F155-L199 HydrophobicContact CZ-CB 4.07Å; F155-L199 HydrophobicContact CZ-CD1 4.01Å; F155-L199 HydrophobicContact CZ-CD2 4.38Å; F155-L199 HydrophobicContact CZ-CG 4.37Å; F155-F202 AromaticContact CD1-CD1 3.93Å; F155-F202 HydrophobicContact CD1-CD1 3.93Å; F155-F202 HydrophobicContact CD1-CE1 4.04Å; F155-L203 HydrophobicContact CD1-CD2 4.2Å; F155-L203 HydrophobicContact CD1-CG 4.49Å; F155-L203 HydrophobicContact CE1-CD1 3.8Å; F155-L203 HydrophobicContact CE1-CD2 3.99Å; F155-L203 HydrophobicContact CE1-CG 3.88Å; F155-L203 HydrophobicContact CZ-CD1 4.39Å; F155-F221 HydrophobicContact CD1-CE1 4.32Å; F155-F221 AromaticContact CD1-CZ 3.7Å; F155-F221 HydrophobicContact CD1-CZ 3.7Å; F155-F221 HydrophobicContact CD2-CE2 4.46Å; F155-F221 AromaticContact CD2-CZ 3.98Å; F155-F221 HydrophobicContact CD2-CZ 3.98Å; F155-F221 HydrophobicContact CE1-CE1 4.14Å; F155-F221 AromaticContact CE1-CZ 3.75Å; F155-F221 HydrophobicContact CE1-CZ 3.75Å; F155-F221 AromaticContact CE2-CZ 4Å; F155-F221 HydrophobicContact CE2-CZ 4Å; F155-F221 HydrophobicContact CG-CE2 4.36Å; F155-F221 AromaticContact CG-CZ 3.84Å; F155-F221 HydrophobicContact CG-CZ 3.84Å; F155-F221 HydrophobicContact CZ-CE1 4.45Å; F155-F221 AromaticContact CZ-CZ 3.9Å; F155-F221 HydrophobicContact CZ-CZ 3.9Å
156	L	94.1	Very high	94.9	Very high	58 Å²	58	37.6 Å²	37.6	30%	0.304	19%	0.185	S	C	.	.	H	α-helix	trans	-59.5	-37.9	172.9	-74.2	174	0	0	0	112.5	Y152 G160 L174	Y152-L156 HydrophobicContact CD1-CD1 4.11Å; Y152-L156 HydrophobicContact CD1-CG 4.49Å; Y152-L156 HydrophobicContact CE1-CD1 3.58Å; Y152-L156 HydrophobicContact CE1-CD2 4.45Å; Y152-L156 HydrophobicContact CE1-CG 3.95Å; Y152-L156 PolarHBondContact O-N 3.42Å; L156-G160 PolarHBondContact O-N 3.38Å; L156-L174 HydrophobicContact CD2-CD1 3.91Å; L156-L174 HydrophobicContact CG-CD1 4.31Å
157	W	94.5	Very high	94.7	Very high	41 Å²	41	38.7 Å²	38.7	16%	0.155	19%	0.194	C	C	.	.	H	α-helix	trans	-64	-46.6	173.5	166.5	81.4	0	0	0	111.4	Q153 D154 F155 G160 K161 D217 F221 L229 K233	Q153-W157 PolarHBondContact O-N 3.01Å; D154-W157 WeakPolarHBondContact O-CB 3.42Å; D154-W157 PolarHBondContact O-N 3.06Å; F155-W157 VanDerWaalsContact C-N 3.28Å; F155-W157 PolarHBondContact O-N 3.01Å; W157-G160 PolarHBondContact O-N 3.48Å; W157-K161 HydrophobicContact CD2-CG 4.32Å; W157-K161 HydrophobicContact CZ2-CG 3.89Å; W157-K161 WeakPolarHBondContact O-CG 3.25Å; W157-K161 PolarHBondContact O-N 2.9Å; W157-D217 HydrophobicContact CH2-CB 4.12Å; W157-D217 WeakPolarHBondContact CZ2-OD1 3.5Å; W157-F221 HydrophobicContact CE3-CD2 4.35Å; W157-F221 HydrophobicContact CZ3-CB 4.21Å; W157-F221 HydrophobicContact CZ3-CD2 4.24Å; W157-L229 HydrophobicContact CE3-CD1 4.19Å; W157-L229 HydrophobicContact CH2-CD1 3.89Å; W157-L229 HydrophobicContact CZ3-CD1 3.6Å; W157-K233 HydrophobicContact CD2-CD 4.49Å; W157-K233 HydrophobicContact CD2-CG 3.95Å; W157-K233 HydrophobicContact CG-CD 4.34Å; W157-K233 HydrophobicContact CG-CG 3.98Å; W157-K233 HydrophobicContact CZ2-CG 4.37Å
158	L	97.1	Very high	94.6	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-59.8	-49.7	176.7	171.5	61.8	0	0	0	111.5	D154 F155 G160 K161 L162 F202 L203 F218 F221	D154-L158 PolarHBondContact O-N 2.9Å; F155-L158 PolarHBondContact O-N 3.01Å; F155-L158 VanDerWaalsContact O-N 3.17Å; L158-G160 VanDerWaalsContact C-N 3.32Å; L158-G160 PolarHBondContact O-N 3.33Å; L158-K161 WeakPolarHBondContact O-CB 3.38Å; L158-K161 PolarHBondContact O-N 3.35Å; L158-L162 HydrophobicContact CD1-CD1 4.02Å; L158-L162 HydrophobicContact CD1-CD2 4.38Å; L158-L162 HydrophobicContact CD1-CG 3.98Å; L158-L162 HydrophobicContact CG-CD1 4.11Å; L158-L162 HydrophobicContact CG-CG 4.46Å; L158-L162 WeakPolarHBondContact O-CG 3.28Å; L158-L162 PolarHBondContact O-N 2.95Å; L158-F202 HydrophobicContact CD2-CE1 3.94Å; L158-F202 HydrophobicContact CD2-CZ 4.43Å; L158-L203 HydrophobicContact CD2-CD2 3.96Å; L158-F218 HydrophobicContact CD1-CB 4.05Å; L158-F218 HydrophobicContact CD1-CD2 4.32Å; L158-F218 HydrophobicContact CD2-CD2 3.84Å; L158-F218 HydrophobicContact CD2-CE2 4.45Å; L158-F221 HydrophobicContact CB-CD2 3.89Å; L158-F221 HydrophobicContact CB-CE2 4.28Å; L158-F221 HydrophobicContact CB-CG 4.24Å; L158-F221 HydrophobicContact CD1-CB 4.21Å; L158-F221 HydrophobicContact CD2-CB 4.04Å; L158-F221 HydrophobicContact CD2-CD1 3.58Å; L158-F221 HydrophobicContact CD2-CD2 4.01Å; L158-F221 HydrophobicContact CD2-CE1 3.98Å; L158-F221 HydrophobicContact CD2-CE2 4.36Å; L158-F221 HydrophobicContact CD2-CG 3.6Å; L158-F221 HydrophobicContact CD2-CZ 4.34Å; L158-F221 HydrophobicContact CG-CD2 4.48Å; L158-F221 HydrophobicContact CG-CG 4.34Å
159	K	95.7	Very high	94.5	Very high	39 Å²	39	34.2 Å²	34.2	17%	0.17	17%	0.174	C	C	.	.	H	α-helix	trans	-54.3	-48.7	176.7	179.1	173.9	-178.5	-69.5	0	111.2	F155 K161 L162 E163 I171 L174 F202 M358	F155-K159 PolarHBondContact O-N 3.03Å; K159-K161 VanDerWaalsContact C-N 3.3Å; K159-K161 PolarHBondContact O-N 3.04Å; K159-L162 PolarHBondContact O-N 3.12Å; K159-E163 IonicContact NZ-OE1 3.3Å; K159-E163 PolarHBondContact NZ-OE1 3.43Å; K159-E163 IonicContact NZ-OE2 2.73Å; K159-E163 WeakPolarHBondContact O-CG 3.24Å; K159-E163 PolarHBondContact O-N 3.09Å; K159-I171 HydrophobicContact CG-CG2 4.08Å; K159-L174 HydrophobicContact CB-CD1 3.75Å; K159-L174 HydrophobicContact CD-CB 4.45Å; K159-L174 HydrophobicContact CD-CD1 3.78Å; K159-L174 HydrophobicContact CD-CG 4Å; K159-L174 HydrophobicContact CG-CD1 4.41Å; K159-F202 HydrophobicContact CB-CE2 4.29Å; K159-F202 HydrophobicContact CB-CZ 4.11Å; K159-M358 VanDerWaalsContact CE-CE 3.42Å; K159-M358 VanDerWaalsContact NZ-CE 3.3Å
160	G	94.3	Very high	94.6	Very high	15 Å²	15	31.6 Å²	31.6	16%	0.155	16%	0.164	C	C	.	.	H	α-helix	trans	-63.5	-31.6	177.2	0	0	0	0	0	113.9	L156 W157 L158 D164	L156-G160 PolarHBondContact O-N 3.38Å; W157-G160 PolarHBondContact O-N 3.48Å; L158-G160 VanDerWaalsContact C-N 3.32Å; L158-G160 PolarHBondContact O-N 3.33Å; G160-D164 WeakPolarHBondContact O-CB 3.38Å; G160-D164 VanDerWaalsContact O-CG 3.23Å; G160-D164 PolarHBondContact O-N 2.69Å
161	K	94.6	Very high	94.6	Very high	41 Å²	41	31.5 Å²	31.5	18%	0.178	16%	0.164	C	C	.	.	H	α-helix	trans	-70.5	-41.1	173.1	-77.3	-52.1	-148.1	87.2	0	112.7	W157 L158 K159 D164 A165 D217	W157-K161 HydrophobicContact CD2-CG 4.32Å; W157-K161 HydrophobicContact CZ2-CG 3.89Å; W157-K161 WeakPolarHBondContact O-CG 3.25Å; W157-K161 PolarHBondContact O-N 2.9Å; L158-K161 WeakPolarHBondContact O-CB 3.38Å; L158-K161 PolarHBondContact O-N 3.35Å; K159-K161 VanDerWaalsContact C-N 3.3Å; K159-K161 PolarHBondContact O-N 3.04Å; K161-D164 PolarHBondContact O-N 2.75Å; K161-A165 VanDerWaalsContact O-CB 3.29Å; K161-A165 WeakPolarHBondContact O-CB 3.44Å; K161-A165 PolarHBondContact O-N 3.08Å; K161-D217 HydrophobicContact CB-CB 3.82Å; K161-D217 WeakPolarHBondContact CD-OD2 3.44Å; K161-D217 HydrophobicContact CG-CB 4.11Å; K161-D217 WeakPolarHBondContact CG-OD2 3.27Å; K161-D217 IonicContact NZ-OD1 3.9Å; K161-D217 PolarHBondContact NZ-OD1 2.75Å; K161-D217 IonicContact NZ-OD2 2.59Å; K161-D217 PolarHBondContact NZ-OD2 3.05Å
162	L	96.1	Very high	94.7	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-65.5	-39.4	175.1	-63.3	174.6	0	0	0	111.4	L158 K159 A165 H166 I171 I206 L212 N215	L158-L162 HydrophobicContact CD1-CD1 4.02Å; L158-L162 HydrophobicContact CD1-CD2 4.38Å; L158-L162 HydrophobicContact CD1-CG 3.98Å; L158-L162 HydrophobicContact CG-CD1 4.11Å; L158-L162 HydrophobicContact CG-CG 4.46Å; L158-L162 WeakPolarHBondContact O-CG 3.28Å; L158-L162 PolarHBondContact O-N 2.95Å; K159-L162 PolarHBondContact O-N 3.12Å; L162-A165 PolarHBondContact O-N 3.43Å; L162-H166 WeakPolarHBondContact O-CA 3.34Å; L162-H166 WeakPolarHBondContact O-CB 3.32Å; L162-H166 PolarHBondContact O-N 3.38Å; L162-I171 HydrophobicContact CB-CD1 3.87Å; L162-I171 HydrophobicContact CB-CG1 4.2Å; L162-I171 HydrophobicContact CB-CG2 4.15Å; L162-I171 HydrophobicContact CD1-CG2 4.23Å; L162-I206 HydrophobicContact CD1-CD1 3.6Å; L162-I206 HydrophobicContact CD1-CG1 4.11Å; L162-I206 HydrophobicContact CD1-CG2 4.26Å; L162-L212 HydrophobicContact CD2-CD2 4.33Å; L162-N215 HydrophobicContact CD2-CB 3.72Å; L162-N215 VanDerWaalsContact CD2-CG 3.46Å
163	E	93.8	Very high	94.8	Very high	41 Å²	41	28.9 Å²	28.9	19%	0.192	16%	0.156	C	C	.	.	H	α-helix	trans	-65.2	-41.2	173.4	-71.5	174	146.2	0	0	112.9	K159 P167 I171 M358 R365	K159-E163 IonicContact NZ-OE1 3.3Å; K159-E163 PolarHBondContact NZ-OE1 3.43Å; K159-E163 IonicContact NZ-OE2 2.73Å; K159-E163 WeakPolarHBondContact O-CG 3.24Å; K159-E163 PolarHBondContact O-N 3.09Å; E163-P167 WeakPolarHBondContact O-CA 3.25Å; E163-I171 HydrophobicContact CG-CB 4.4Å; E163-I171 HydrophobicContact CG-CG1 3.89Å; E163-M358 WeakPolarHBondContact OE1-CE 3.41Å; E163-R365 IonicContact OE1-NH1 3.84Å
164	D	90.9	Very high	94.9	Very high	95 Å²	95	26 Å²	26	51%	0.508	14%	0.143	S	C	.	.	H	α-helix	trans	-66.6	-38.7	176.3	-78.9	-15.6	0	0	0	111.6	G160 K161 R242	G160-D164 WeakPolarHBondContact O-CB 3.38Å; G160-D164 VanDerWaalsContact O-CG 3.23Å; G160-D164 PolarHBondContact O-N 2.69Å; K161-D164 PolarHBondContact O-N 2.75Å; D164-R242 IonicContact OD1-NH2 2.61Å; D164-R242 IonicContact OD2-CZ 2.59Å; D164-R242 IonicContact OD2-NE 3.57Å; D164-R242 IonicContact OD2-NH2 2.69Å; D164-R242 PolarHBondContact OD2-NH2 3.28Å
165	A	92.3	Very high	94.5	Very high	50 Å²	50	26.1 Å²	26.1	41%	0.413	15%	0.145	S	C	.	.	H	α-helix	trans	-79.9	-33.6	-178.9	0	0	0	0	0	113.5	K161 L162	K161-A165 VanDerWaalsContact O-CB 3.29Å; K161-A165 WeakPolarHBondContact O-CB 3.44Å; K161-A165 PolarHBondContact O-N 3.08Å; L162-A165 PolarHBondContact O-N 3.43Å
166	H	93.8	Very high	93.6	Very high	46 Å²	46	31.4 Å²	31.4	21%	0.213	17%	0.17	C	C	.	.			trans	-132.2	71.2	-174.2	-54.9	-68.5	0	0	0	110.8	L162 T168 L169 L212 N215	L162-H166 WeakPolarHBondContact O-CA 3.34Å; L162-H166 WeakPolarHBondContact O-CB 3.32Å; L162-H166 PolarHBondContact O-N 3.38Å; H166-T168 PolarHBondContact O-N 3.39Å; H166-L169 HydrophobicContact CB-CB 4.01Å; H166-L169 HydrophobicContact CB-CD1 3.71Å; H166-L169 HydrophobicContact CB-CG 3.91Å; H166-L169 PolarHBondContact O-N 2.84Å; H166-L169 VanDerWaalsContact O-N 3.15Å; H166-L212 HydrophobicContact CB-CD2 4.25Å; H166-N215 PolarHBondContact NE2-ND2 3.41Å; H166-N215 VanDerWaalsContact NE2-ND2 3.11Å
167	P	92.2	Very high	92.3	Very high	47 Å²	47	33.9 Å²	33.9	31%	0.305	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-17.7	-168.3	24.8	-35.8	0	0	0	114.9	E163 R365 I369	E163-P167 WeakPolarHBondContact O-CA 3.25Å; P167-R365 HydrophobicContact CB-CB 4.43Å; P167-R365 WeakPolarHBondContact O-CB 3.45Å; P167-R365 WeakPolarHBondContact O-CD 3.47Å; P167-R365 PolarHBondContact O-NE 2.96Å; P167-I369 HydrophobicContact CG-CD1 4.45Å
168	T	94.9	Very high	90.8	Very high	7 Å²	7	35.8 Å²	35.8	4%	0.043	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.7	12.2	179.1	60.6	0	0	0	0	114.9	H166 R366 I369 A404	H166-T168 PolarHBondContact O-N 3.39Å; T168-R366 HydrophobicContact CG2-CB 3.82Å; T168-I369 HydrophobicContact CG2-CD1 4.22Å; T168-A404 HydrophobicContact CG2-CB 3.88Å; T168-A404 WeakPolarHBondContact OG1-CA 3.48Å; T168-A404 PolarHBondContact OG1-O 2.67Å
169	L	96.7	Very high	88.5	Confident	8 Å²	8	41.8 Å²	41.8	4%	0.042	22%	0.218	C	C	.	.	S	Bend	trans	-89	150.7	165.6	-65.8	-176.6	0	0	0	111	H166 I171 T211 L212 V362 A407 D411	H166-L169 HydrophobicContact CB-CB 4.01Å; H166-L169 HydrophobicContact CB-CD1 3.71Å; H166-L169 HydrophobicContact CB-CG 3.91Å; H166-L169 PolarHBondContact O-N 2.84Å; H166-L169 VanDerWaalsContact O-N 3.15Å; L169-I171 HydrophobicContact CB-CD1 4.13Å; L169-I171 PolarHBondContact O-N 2.83Å; L169-I171 VanDerWaalsContact O-N 3.17Å; L169-T211 HydrophobicContact CD1-CG2 4.03Å; L169-L212 HydrophobicContact CB-CD2 4.46Å; L169-L212 HydrophobicContact CD1-CD2 3.7Å; L169-L212 HydrophobicContact CD1-CG 4.23Å; L169-V362 WeakPolarHBondContact O-CG2 3.47Å; L169-A407 HydrophobicContact CD2-CB 4.02Å; L169-D411 HydrophobicContact CD2-CB 3.82Å
170	I	97.5	Very high	85.9	Confident	4 Å²	4	46 Å²	46	2%	0.021	25%	0.247	C	C	.	.			trans	-87.8	84.1	-177.7	-56.6	166.4	0	0	0	107.8	Y355 M358 L359 V362 D411 W412 W415	I170-Y355 HydrophobicContact CG2-CD1 3.97Å; I170-Y355 HydrophobicContact CG2-CE1 4.03Å; I170-M358 HydrophobicContact CG2-CG 4.13Å; I170-L359 HydrophobicContact CB-CD2 4.5Å; I170-L359 HydrophobicContact CD1-CD2 3.58Å; I170-L359 HydrophobicContact CG1-CD2 3.82Å; I170-L359 HydrophobicContact CG2-CD2 3.83Å; I170-V362 HydrophobicContact CG1-CG2 4.43Å; I170-D411 WeakPolarHBondContact CA-OD2 3.43Å; I170-D411 WeakPolarHBondContact CB-OD2 3.29Å; I170-D411 PolarHBondContact N-OD2 3.49Å; I170-W412 HydrophobicContact CD1-CE3 4.24Å; I170-W415 HydrophobicContact CD1-CB 3.59Å; I170-W415 HydrophobicContact CD1-CG 3.97Å; I170-W415 HydrophobicContact CG2-CB 4.5Å; I170-W415 HydrophobicContact CG2-CG 4.17Å
171	I	97.3	Very high	83.3	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-66.5	128.8	178.7	-48.7	-50.2	0	0	0	109	K159 L162 E163 L169 L212 M358	K159-I171 HydrophobicContact CG-CG2 4.08Å; L162-I171 HydrophobicContact CB-CD1 3.87Å; L162-I171 HydrophobicContact CB-CG1 4.2Å; L162-I171 HydrophobicContact CB-CG2 4.15Å; L162-I171 HydrophobicContact CD1-CG2 4.23Å; E163-I171 HydrophobicContact CG-CB 4.4Å; E163-I171 HydrophobicContact CG-CG1 3.89Å; L169-I171 HydrophobicContact CB-CD1 4.13Å; L169-I171 PolarHBondContact O-N 2.83Å; L169-I171 VanDerWaalsContact O-N 3.17Å; I171-L212 HydrophobicContact CD1-CD1 3.67Å; I171-L212 HydrophobicContact CD1-CD2 3.58Å; I171-L212 HydrophobicContact CD1-CG 4.28Å; I171-M358 HydrophobicContact CB-CE 4.08Å; I171-M358 HydrophobicContact CB-SD 4.36Å; I171-M358 VanDerWaalsContact O-CE 3.28Å; I171-M358 WeakPolarHBondContact O-CE 3.33Å; I171-M358 WeakPolarHBondContact O-CG 3.43Å
172	P	96.6	Very high	80.9	Confident	4 Å²	4	54.4 Å²	54.4	3%	0.026	30%	0.296	C	S	.	.	P	Polyproline II helix	trans	-53.2	140.4	177.9	-28.3	36	0	0	0	112.1	F202 R205 I206	P172-F202 HydrophobicContact CB-CD2 3.93Å; P172-F202 WeakPolarHBondContact O-CD2 3.39Å; P172-F202 VanDerWaalsContact O-CE2 3.3Å; P172-F202 WeakPolarHBondContact O-CE2 3.16Å; P172-R205 HydrophobicContact CB-CB 4.05Å; P172-R205 HydrophobicContact CG-CB 3.5Å; P172-R205 VanDerWaalsContact CG-CB 3.5Å; P172-R205 HydrophobicContact CG-CG 4.45Å; P172-I206 HydrophobicContact CG-CG1 4.21Å
173	P	94.6	Very high	78.6	Confident	15 Å²	15	61.3 Å²	61.3	10%	0.097	33%	0.33	C	S	.	.	P	Polyproline II helix	trans	-66.7	157.1	177.3	28.3	-33.4	0	0	0	110.9	F202 E351 L354 Y355	P173-F202 WeakPolarHBondContact O-CD2 3.36Å; P173-E351 HydrophobicContact CG-CG 4.06Å; P173-L354 HydrophobicContact CB-CB 3.47Å; P173-L354 VanDerWaalsContact CB-CB 3.47Å; P173-L354 HydrophobicContact CB-CD1 4.4Å; P173-L354 HydrophobicContact CG-CB 3.89Å; P173-Y355 VanDerWaalsContact CD-CE1 3.44Å; P173-Y355 HydrophobicContact CG-CD1 4.44Å; P173-Y355 HydrophobicContact CG-CD2 3.85Å; P173-Y355 HydrophobicContact CG-CE1 4.49Å; P173-Y355 HydrophobicContact CG-CE2 3.9Å; P173-Y355 HydrophobicContact CG-CG 4.12Å
174	L	94.1	Very high	76.5	Confident	13 Å²	13	65.2 Å²	65.2	7%	0.068	36%	0.357	C	S	.	.	P	Polyproline II helix	trans	-102.5	145.7	167.2	-75.5	168.1	0	0	0	108.1	F155 L156 K159 L199 F202	F155-L174 HydrophobicContact CB-CD1 3.97Å; F155-L174 HydrophobicContact CB-CD2 3.84Å; F155-L174 HydrophobicContact CD1-CD2 4.35Å; F155-L174 HydrophobicContact CG-CD2 4.5Å; F155-L174 WeakPolarHBondContact O-CD1 3.46Å; L156-L174 HydrophobicContact CD2-CD1 3.91Å; L156-L174 HydrophobicContact CG-CD1 4.31Å; K159-L174 HydrophobicContact CB-CD1 3.75Å; K159-L174 HydrophobicContact CD-CB 4.45Å; K159-L174 HydrophobicContact CD-CD1 3.78Å; K159-L174 HydrophobicContact CD-CG 4Å; K159-L174 HydrophobicContact CG-CD1 4.41Å; L174-L199 HydrophobicContact CD2-CD2 3.58Å; L174-F202 HydrophobicContact CD1-CE2 4.34Å; L174-F202 HydrophobicContact CD1-CZ 4.34Å; L174-F202 HydrophobicContact CD2-CB 4.14Å; L174-F202 HydrophobicContact CD2-CD1 3.69Å; L174-F202 HydrophobicContact CD2-CD2 3.53Å; L174-F202 HydrophobicContact CD2-CE1 3.9Å; L174-F202 HydrophobicContact CD2-CE2 3.75Å; L174-F202 HydrophobicContact CD2-CG 3.51Å; L174-F202 HydrophobicContact CD2-CZ 3.92Å; L174-F202 HydrophobicContact CG-CD2 3.85Å; L174-F202 HydrophobicContact CG-CE2 3.74Å; L174-F202 HydrophobicContact CG-CG 4.34Å; L174-F202 HydrophobicContact CG-CZ 4.14Å
175	P	87.5	Confident	74.9	Confident	24 Å²	24	65.1 Å²	65.1	16%	0.156	35%	0.354	C	S	.	.	P	Polyproline II helix	trans	-57.6	147.2	173.6	28.6	-36.7	0	0	0	109.3	Y152 R195 A198 L199	Y152-P175 HydrophobicContact CE2-CG 4.24Å; Y152-P175 VanDerWaalsContact CE2-O 3.27Å; Y152-P175 WeakPolarHBondContact CE2-O 3.34Å; Y152-P175 VanDerWaalsContact CZ-O 3.3Å; Y152-P175 PolarHBondContact OH-O 2.72Å; P175-R195 HydrophobicContact CG-CG 4.09Å; P175-A198 HydrophobicContact CB-CB 3.85Å; P175-A198 HydrophobicContact CG-CB 3.72Å; P175-L199 HydrophobicContact CG-CD2 4.22Å; P175-L199 HydrophobicContact CG-CG 4.44Å
176	E	77.7	Confident	73.2	Confident	111 Å²	111	66.9 Å²	66.9	52%	0.519	35%	0.35	S	S	.	.	P	Polyproline II helix	trans	-55.4	149.3	-167.9	-66.4	-168.9	166.4	0	0	114.3	F178 R195 H350 L354	E176-F178 VanDerWaalsContact C-N 3.3Å; E176-F178 PolarHBondContact O-N 3.41Å; E176-R195 PolarHBondContact O-NH2 3.23Å; E176-H350 IonicContact OE1-CE1 3.27Å; E176-L354 HydrophobicContact CG-CD2 3.95Å
177	K	66.3	Low	71.6	Confident	111 Å²	111	68.1 Å²	68.1	48%	0.483	35%	0.354	S	S	.	.			trans	-76.8	89.2	168.1	-174.8	-178.8	173.6	-174.9	0	107.4	Y152 I179	Y152-K177 HydrophobicContact CE1-CB 3.9Å; Y152-K177 HydrophobicContact CE1-CG 4.05Å; Y152-K177 PolarHBondContact OH-N 2.95Å; K177-I179 HydrophobicContact CB-CD1 4.42Å; K177-I179 HydrophobicContact CD-CD1 4.09Å; K177-I179 HydrophobicContact CG-CD1 4.11Å; K177-I179 HydrophobicContact CG-CG1 4.34Å; K177-I179 WeakPolarHBondContact O-CD1 3.47Å; K177-I179 WeakPolarHBondContact O-CG1 3.42Å; K177-I179 PolarHBondContact O-N 2.95Å
178	F	63	Low	70.9	Confident	81 Å²	81	69.1 Å²	69.1	36%	0.355	36%	0.357	S	S	.	.			trans	-42.3	108.6	176.7	-146.5	-100.9	0	0	0	112.2	E176 E185 F191	E176-F178 VanDerWaalsContact C-N 3.3Å; E176-F178 PolarHBondContact O-N 3.41Å; F178-E185 HydrophobicContact CE1-CB 4.01Å; F178-E185 HydrophobicContact CZ-CB 4.2Å; F178-E185 WeakPolarHBondContact CZ-OE2 3.4Å; F178-F191 HydrophobicContact CB-CE2 4.15Å; F178-F191 HydrophobicContact CB-CZ 3.72Å; F178-F191 HydrophobicContact CD2-CD2 4.13Å; F178-F191 AromaticContact CD2-CE2 3.36Å; F178-F191 HydrophobicContact CD2-CE2 3.36Å; F178-F191 AromaticContact CD2-CZ 3.82Å; F178-F191 HydrophobicContact CD2-CZ 3.82Å; F178-F191 HydrophobicContact CE2-CD2 4.15Å; F178-F191 AromaticContact CE2-CE2 3.84Å; F178-F191 HydrophobicContact CE2-CE2 3.84Å; F178-F191 AromaticContact CG-CE2 3.88Å; F178-F191 HydrophobicContact CG-CE2 3.88Å; F178-F191 AromaticContact CG-CZ 3.83Å; F178-F191 HydrophobicContact CG-CZ 3.83Å
179	I	49.8	Very low	70.3	Confident	125 Å²	125	74.7 Å²	74.7	64%	0.641	39%	0.387	S	S	*	.			trans	-133.7	107.5	-179.5	-71.5	157.9	0	0	0	106	K177	K177-I179 HydrophobicContact CB-CD1 4.42Å; K177-I179 HydrophobicContact CD-CD1 4.09Å; K177-I179 HydrophobicContact CG-CD1 4.11Å; K177-I179 HydrophobicContact CG-CG1 4.34Å; K177-I179 WeakPolarHBondContact O-CD1 3.47Å; K177-I179 WeakPolarHBondContact O-CG1 3.42Å; K177-I179 PolarHBondContact O-N 2.95Å
180	V	40.8	Very low	69.5	Low	129 Å²	129	79.8 Å²	79.8	78%	0.782	41%	0.414	S	S	*	.	S	Bend	trans	75.2	107.8	-175.6	-168.1	0	0	0	0	113
181	K	39.2	Very low	68.8	Low	171 Å²	171	81.3 Å²	81.3	74%	0.743	42%	0.421	S	S	*	.	S	Bend		-151.1	94.4	72.5	-155.7	175.3	-173.2	-179.8	0	111.8
182	G	44.3	Very low	68.4	Low	60 Å²	60	82.1 Å²	82.1	62%	0.619	43%	0.425	S	S	*	.			trans	85.4	156.2	-179.8	0	0	0	0	0	114.9	V184	G182-V184 VanDerWaalsContact C-N 3.26Å; G182-V184 PolarHBondContact O-N 3.11Å
183	M	48.4	Very low	68	Low	145 Å²	145	85 Å²	85	71%	0.714	44%	0.438	S	S	*	.	S	Bend	trans	-78.2	-5.4	-178.7	-81	-164.2	174.7	0	0	114.5
184	V	48.8	Very low	67.7	Low	124 Å²	124	87.9 Å²	87.9	75%	0.752	46%	0.455	S	S	*	.	S	Bend	trans	-82.4	-44.5	-167.5	-172.8	0	0	0	0	111.6	G182 R186 F187	G182-V184 VanDerWaalsContact C-N 3.26Å; G182-V184 PolarHBondContact O-N 3.11Å; V184-R186 VanDerWaalsContact C-N 3.35Å; V184-R186 PolarHBondContact O-N 2.88Å; V184-F187 PolarHBondContact O-N 2.86Å
185	E	56.8	Low	67.5	Low	93 Å²	93	88.6 Å²	88.6	44%	0.435	46%	0.457	S	S	.	.	G	3₁₀ helix	trans	-70.5	-23	-173.8	-70.3	178.9	157	0	0	114.9	F178 F187 N188	F178-E185 HydrophobicContact CE1-CB 4.01Å; F178-E185 HydrophobicContact CZ-CB 4.2Å; F178-E185 WeakPolarHBondContact CZ-OE2 3.4Å; E185-F187 PolarHBondContact O-N 2.83Å; E185-N188 VanDerWaalsContact O-CB 3.31Å; E185-N188 WeakPolarHBondContact O-CB 3.29Å; E185-N188 PolarHBondContact O-N 3.33Å
186	R	56.3	Low	67.9	Low	87 Å²	87	89.6 Å²	89.6	33%	0.328	46%	0.458	S	S	.	.	G	3₁₀ helix	trans	-65.4	-11.5	178.1	77.2	-178.9	-178.8	165.2	1.8	113.8	V184 F191	V184-R186 VanDerWaalsContact C-N 3.35Å; V184-R186 PolarHBondContact O-N 2.88Å; R186-F191 HydrophobicContact CB-CE1 4.35Å
187	F	60.7	Low	68.6	Low	72 Å²	72	87.7 Å²	87.7	32%	0.316	45%	0.448	S	S	.	.	G	3₁₀ helix	trans	-116	10.2	174	-56.5	-64.2	0	0	0	112.5	T126 I128 V184 E185 D189	T126-F187 HydrophobicContact CG2-CE1 3.71Å; T126-F187 HydrophobicContact CG2-CZ 3.48Å; T126-F187 VanDerWaalsContact CG2-CZ 3.48Å; I128-F187 HydrophobicContact CD1-CD1 4.1Å; I128-F187 HydrophobicContact CG1-CD1 4.38Å; I128-F187 HydrophobicContact CG1-CE1 4.36Å; V184-F187 PolarHBondContact O-N 2.86Å; E185-F187 PolarHBondContact O-N 2.83Å; F187-D189 PolarHBondContact O-N 2.79Å
188	N	77.8	Confident	69.9	Low	68 Å²	68	84 Å²	84	36%	0.364	44%	0.437	S	S	.	.			trans	-67.3	129.5	168.6	-179.4	0.1	0	0	0	108.3	E185 D190 F191 I192	E185-N188 VanDerWaalsContact O-CB 3.31Å; E185-N188 WeakPolarHBondContact O-CB 3.29Å; E185-N188 PolarHBondContact O-N 3.33Å; N188-D190 VanDerWaalsContact C-N 3.26Å; N188-D190 PolarHBondContact ND2-OD2 3.17Å; N188-D190 PolarHBondContact O-N 3.03Å; N188-D190 PolarHBondContact OD1-N 3.37Å; N188-F191 HydrophobicContact CB-CB 4.22Å; N188-F191 WeakPolarHBondContact O-CB 3.37Å; N188-F191 PolarHBondContact O-N 3.24Å; N188-F191 VanDerWaalsContact O-N 3.08Å; N188-I192 VanDerWaalsContact O-CG1 3.31Å; N188-I192 WeakPolarHBondContact O-CG1 3.39Å; N188-I192 PolarHBondContact O-N 2.98Å
189	D	82.3	Confident	71.6	Confident	124 Å²	124	80.1 Å²	80.1	66%	0.663	42%	0.42	S	S	*	.	H	α-helix	trans	-58.6	-37.4	-179.2	-67.6	-38.9	0	0	0	111.9	F187 F191 I192 E193	F187-D189 PolarHBondContact O-N 2.79Å; D189-F191 VanDerWaalsContact C-N 3.29Å; D189-F191 PolarHBondContact O-N 3.25Å; D189-I192 PolarHBondContact O-N 3.04Å; D189-E193 WeakPolarHBondContact O-CB 3.27Å; D189-E193 PolarHBondContact O-N 3.35Å
190	D	80.3	Confident	73.8	Confident	114 Å²	114	77 Å²	77	61%	0.61	40%	0.403	S	S	*	.	H	α-helix	trans	-58.2	-42.4	175.2	-58.8	-30	0	0	0	111.8	N188 T194	N188-D190 VanDerWaalsContact C-N 3.26Å; N188-D190 PolarHBondContact ND2-OD2 3.17Å; N188-D190 PolarHBondContact O-N 3.03Å; N188-D190 PolarHBondContact OD1-N 3.37Å; D190-T194 VanDerWaalsContact O-CB 3.25Å; D190-T194 WeakPolarHBondContact O-CB 3.44Å; D190-T194 PolarHBondContact O-N 2.94Å; D190-T194 PolarHBondContact O-OG1 2.85Å
191	F	83	Confident	76.5	Confident	37 Å²	37	73.5 Å²	73.5	16%	0.162	38%	0.377	C	S	.	.	H	α-helix	trans	-72.4	-39.2	179.7	170.8	-101.1	0	0	0	111.6	F178 R186 N188 D189 E193 R195	F178-F191 HydrophobicContact CB-CE2 4.15Å; F178-F191 HydrophobicContact CB-CZ 3.72Å; F178-F191 HydrophobicContact CD2-CD2 4.13Å; F178-F191 AromaticContact CD2-CE2 3.36Å; F178-F191 HydrophobicContact CD2-CE2 3.36Å; F178-F191 AromaticContact CD2-CZ 3.82Å; F178-F191 HydrophobicContact CD2-CZ 3.82Å; F178-F191 HydrophobicContact CE2-CD2 4.15Å; F178-F191 AromaticContact CE2-CE2 3.84Å; F178-F191 HydrophobicContact CE2-CE2 3.84Å; F178-F191 AromaticContact CG-CE2 3.88Å; F178-F191 HydrophobicContact CG-CE2 3.88Å; F178-F191 AromaticContact CG-CZ 3.83Å; F178-F191 HydrophobicContact CG-CZ 3.83Å; R186-F191 HydrophobicContact CB-CE1 4.35Å; N188-F191 HydrophobicContact CB-CB 4.22Å; N188-F191 WeakPolarHBondContact O-CB 3.37Å; N188-F191 PolarHBondContact O-N 3.24Å; N188-F191 VanDerWaalsContact O-N 3.08Å; D189-F191 VanDerWaalsContact C-N 3.29Å; D189-F191 PolarHBondContact O-N 3.25Å; F191-E193 VanDerWaalsContact C-N 3.34Å; F191-R195 VanDerWaalsContact CE1-NH1 3.34Å; F191-R195 VanDerWaalsContact CZ-NH1 3.35Å; F191-R195 VanDerWaalsContact O-CB 3.27Å; F191-R195 WeakPolarHBondContact O-CB 3.47Å; F191-R195 PolarHBondContact O-N 3.34Å
192	I	88.3	Confident	79.2	Confident	17 Å²	17	65.5 Å²	65.5	9%	0.087	34%	0.343	C	S	.	.	H	α-helix	trans	-61.6	-45.4	175.2	-66.6	171.9	0	0	0	110.1	P117 I128 Y130 N188 D189 R196	P117-I192 HydrophobicContact CB-CG2 3.35Å; P117-I192 HydrophobicContact CG-CG2 3.61Å; I128-I192 HydrophobicContact CD1-CD1 3.55Å; I128-I192 HydrophobicContact CD1-CG1 3.51Å; Y130-I192 HydrophobicContact CE1-CG2 4.33Å; N188-I192 VanDerWaalsContact O-CG1 3.31Å; N188-I192 WeakPolarHBondContact O-CG1 3.39Å; N188-I192 PolarHBondContact O-N 2.98Å; D189-I192 PolarHBondContact O-N 3.04Å; I192-R196 WeakPolarHBondContact O-CB 3.47Å; I192-R196 PolarHBondContact O-N 3.39Å
193	E	89.1	Confident	81.8	Confident	65 Å²	65	62.7 Å²	62.7	30%	0.304	31%	0.313	S	S	.	.	H	α-helix	trans	-71	-44.6	-179.3	178.7	52	-152.1	0	0	112	D189 F191 R195 R196 K197	D189-E193 WeakPolarHBondContact O-CB 3.27Å; D189-E193 PolarHBondContact O-N 3.35Å; F191-E193 VanDerWaalsContact C-N 3.34Å; E193-R195 VanDerWaalsContact C-N 3.3Å; E193-R195 PolarHBondContact O-N 2.92Å; E193-R196 VanDerWaalsContact CD-NE 3.25Å; E193-R196 WeakPolarHBondContact O-CB 3.49Å; E193-R196 PolarHBondContact O-N 2.94Å; E193-R196 IonicContact OE1-CZ 3.35Å; E193-R196 VanDerWaalsContact OE1-CZ 3.27Å; E193-R196 IonicContact OE1-NE 3.05Å; E193-R196 PolarHBondContact OE1-NE 3.37Å; E193-R196 IonicContact OE1-NH2 2.67Å; E193-R196 PolarHBondContact OE1-NH2 2.73Å; E193-R196 VanDerWaalsContact OE2-CD 3.29Å; E193-R196 WeakPolarHBondContact OE2-CD 3.17Å; E193-R196 IonicContact OE2-CZ 2.75Å; E193-R196 IonicContact OE2-NE 3.59Å; E193-R196 PolarHBondContact OE2-NE 3.06Å; E193-R196 IonicContact OE2-NH2 3.99Å; E193-K197 HydrophobicContact CG-CD 4.49Å; E193-K197 WeakPolarHBondContact O-CG 3.33Å; E193-K197 PolarHBondContact O-N 3.3Å; E193-K197 VanDerWaalsContact OE1-CE 3.23Å; E193-K197 WeakPolarHBondContact OE1-CE 3.39Å; E193-K197 WeakPolarHBondContact OE1-CG 3.45Å
194	T	87	Confident	84.1	Confident	75 Å²	75	57.1 Å²	57.1	46%	0.46	29%	0.287	S	S	.	.	H	α-helix	trans	-56.3	-45.9	172.9	-60.8	0	0	0	0	110.9	D190 K197 A198	D190-T194 VanDerWaalsContact O-CB 3.25Å; D190-T194 WeakPolarHBondContact O-CB 3.44Å; D190-T194 PolarHBondContact O-N 2.94Å; D190-T194 PolarHBondContact O-OG1 2.85Å; T194-K197 PolarHBondContact O-N 3.16Å; T194-A198 PolarHBondContact O-N 3.27Å; T194-A198 VanDerWaalsContact O-N 3.08Å
195	R	91.1	Very high	86.4	Confident	28 Å²	28	52.6 Å²	52.6	11%	0.106	26%	0.256	C	S	.	.	H	α-helix	trans	-63.8	-42.1	173.9	177.2	173.1	-83.4	160.8	-5.4	111.7	Y130 P175 E176 F191 E193 A198 L199	Y130-R195 WeakPolarHBondContact OH-CD 3.31Å; Y130-R195 WeakPolarHBondContact OH-CG 3.24Å; P175-R195 HydrophobicContact CG-CG 4.09Å; E176-R195 PolarHBondContact O-NH2 3.23Å; F191-R195 VanDerWaalsContact CE1-NH1 3.34Å; F191-R195 VanDerWaalsContact CZ-NH1 3.35Å; F191-R195 VanDerWaalsContact O-CB 3.27Å; F191-R195 WeakPolarHBondContact O-CB 3.47Å; F191-R195 PolarHBondContact O-N 3.34Å; E193-R195 VanDerWaalsContact C-N 3.3Å; E193-R195 PolarHBondContact O-N 2.92Å; R195-A198 PolarHBondContact O-N 3.27Å; R195-L199 HydrophobicContact CG-CD1 3.8Å; R195-L199 HydrophobicContact CG-CG 4.04Å; R195-L199 WeakPolarHBondContact O-CB 3.38Å; R195-L199 WeakPolarHBondContact O-CG 3.19Å; R195-L199 PolarHBondContact O-N 3.22Å
196	R	94.9	Very high	88.3	Confident	45 Å²	45	48.2 Å²	48.2	17%	0.17	24%	0.235	C	C	.	.	H	α-helix	trans	-59.6	-47.2	177.4	-174.6	-147.8	65.2	77.1	-4.1	111.3	V114 Y130 I192 E193 A198 L199 H200	V114-R196 HydrophobicContact CG1-CG 4.37Å; V114-R196 WeakPolarHBondContact O-CD 3.36Å; V114-R196 WeakPolarHBondContact O-CG 3.31Å; V114-R196 PolarHBondContact O-NH1 2.98Å; Y130-R196 HydrophobicContact CD1-CB 4.09Å; Y130-R196 HydrophobicContact CD1-CG 4.06Å; Y130-R196 HydrophobicContact CE1-CB 3.9Å; Y130-R196 HydrophobicContact CE1-CG 4.39Å; I192-R196 WeakPolarHBondContact O-CB 3.47Å; I192-R196 PolarHBondContact O-N 3.39Å; E193-R196 VanDerWaalsContact CD-NE 3.25Å; E193-R196 WeakPolarHBondContact O-CB 3.49Å; E193-R196 PolarHBondContact O-N 2.94Å; E193-R196 IonicContact OE1-CZ 3.35Å; E193-R196 VanDerWaalsContact OE1-CZ 3.27Å; E193-R196 IonicContact OE1-NE 3.05Å; E193-R196 PolarHBondContact OE1-NE 3.37Å; E193-R196 IonicContact OE1-NH2 2.67Å; E193-R196 PolarHBondContact OE1-NH2 2.73Å; E193-R196 VanDerWaalsContact OE2-CD 3.29Å; E193-R196 WeakPolarHBondContact OE2-CD 3.17Å; E193-R196 IonicContact OE2-CZ 2.75Å; E193-R196 IonicContact OE2-NE 3.59Å; E193-R196 PolarHBondContact OE2-NE 3.06Å; E193-R196 IonicContact OE2-NH2 3.99Å; R196-A198 PolarHBondContact O-N 3.48Å; R196-L199 PolarHBondContact O-N 3.2Å; R196-H200 WeakPolarHBondContact O-CB 3.27Å; R196-H200 PolarHBondContact O-N 3.26Å
197	K	93.4	Very high	90.3	Very high	71 Å²	71	44.5 Å²	44.5	31%	0.309	22%	0.223	S	C	.	.	H	α-helix	trans	-55	-49.6	174.3	-72.1	173	176.2	176.9	0	111.2	E193 T194 H200 K201 E343	E193-K197 HydrophobicContact CG-CD 4.49Å; E193-K197 WeakPolarHBondContact O-CG 3.33Å; E193-K197 PolarHBondContact O-N 3.3Å; E193-K197 VanDerWaalsContact OE1-CE 3.23Å; E193-K197 WeakPolarHBondContact OE1-CE 3.39Å; E193-K197 WeakPolarHBondContact OE1-CG 3.45Å; T194-K197 PolarHBondContact O-N 3.16Å; K197-H200 WeakPolarHBondContact O-CB 3.49Å; K197-H200 PolarHBondContact O-N 3.06Å; K197-K201 PolarHBondContact O-N 3.29Å; K197-E343 IonicContact NZ-OE2 2.62Å; K197-E343 PolarHBondContact NZ-OE2 2.89Å
198	A	93.8	Very high	91.9	Very high	32 Å²	32	44.1 Å²	44.1	26%	0.264	23%	0.225	S	C	.	.	H	α-helix	trans	-66.2	-39.5	178.9	0	0	0	0	0	113.4	P175 T194 R195 R196 K201 F202	P175-A198 HydrophobicContact CB-CB 3.85Å; P175-A198 HydrophobicContact CG-CB 3.72Å; T194-A198 PolarHBondContact O-N 3.27Å; T194-A198 VanDerWaalsContact O-N 3.08Å; R195-A198 PolarHBondContact O-N 3.27Å; R196-A198 PolarHBondContact O-N 3.48Å; A198-K201 PolarHBondContact O-N 3.25Å; A198-F202 WeakPolarHBondContact O-CB 3.37Å; A198-F202 PolarHBondContact O-N 2.99Å
199	L	97.4	Very high	92.7	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-67.5	-35.5	175.2	-67.7	179.1	0	0	0	112.4	V114 Y130 Y152 F155 L174 P175 R195 R196 L203	V114-L199 HydrophobicContact CG1-CB 4.47Å; Y130-L199 HydrophobicContact CD2-CD1 3.6Å; Y130-L199 HydrophobicContact CE2-CD1 3.45Å; Y130-L199 VanDerWaalsContact CE2-CD1 3.45Å; Y130-L199 HydrophobicContact CG-CD1 4.26Å; Y152-L199 HydrophobicContact CD2-CD2 4.19Å; F155-L199 HydrophobicContact CB-CD2 4.15Å; F155-L199 HydrophobicContact CD1-CB 4.42Å; F155-L199 HydrophobicContact CD1-CD2 3.67Å; F155-L199 HydrophobicContact CD1-CG 4.46Å; F155-L199 HydrophobicContact CD2-CD1 4.19Å; F155-L199 HydrophobicContact CD2-CD2 4.17Å; F155-L199 HydrophobicContact CE1-CB 3.87Å; F155-L199 HydrophobicContact CE1-CD1 4.4Å; F155-L199 HydrophobicContact CE1-CD2 3.97Å; F155-L199 HydrophobicContact CE1-CG 4.29Å; F155-L199 HydrophobicContact CE2-CD1 3.91Å; F155-L199 HydrophobicContact CE2-CD2 4.48Å; F155-L199 HydrophobicContact CG-CD2 3.76Å; F155-L199 HydrophobicContact CZ-CB 4.07Å; F155-L199 HydrophobicContact CZ-CD1 4.01Å; F155-L199 HydrophobicContact CZ-CD2 4.38Å; F155-L199 HydrophobicContact CZ-CG 4.37Å; L174-L199 HydrophobicContact CD2-CD2 3.58Å; P175-L199 HydrophobicContact CG-CD2 4.22Å; P175-L199 HydrophobicContact CG-CG 4.44Å; R195-L199 HydrophobicContact CG-CD1 3.8Å; R195-L199 HydrophobicContact CG-CG 4.04Å; R195-L199 WeakPolarHBondContact O-CB 3.38Å; R195-L199 WeakPolarHBondContact O-CG 3.19Å; R195-L199 PolarHBondContact O-N 3.22Å; R196-L199 PolarHBondContact O-N 3.2Å; L199-L203 PolarHBondContact O-N 3.36Å
200	H	97.4	Very high	93.3	Very high	61 Å²	61	39.3 Å²	39.3	28%	0.282	20%	0.203	S	C	.	.	H	α-helix	trans	-62.4	-48.1	171.5	179.1	65.5	0	0	0	111.3	I112 V114 R196 K197 L203 N204	I112-H200 PolarHBondContact O-CE1 3.35Å; I112-H200 PolarHBondContact O-ND1 3.31Å; V114-H200 HydrophobicContact CB-CB 3.95Å; V114-H200 HydrophobicContact CG2-CB 4.21Å; V114-H200 PolarHBondContact N-ND1 3.27Å; R196-H200 WeakPolarHBondContact O-CB 3.27Å; R196-H200 PolarHBondContact O-N 3.26Å; K197-H200 WeakPolarHBondContact O-CB 3.49Å; K197-H200 PolarHBondContact O-N 3.06Å; H200-L203 PolarHBondContact O-N 3.15Å; H200-N204 PolarHBondContact CE1-ND2 2.88Å; H200-N204 VanDerWaalsContact CE1-ND2 3.27Å; H200-N204 PolarHBondContact ND1-ND2 2.82Å; H200-N204 PolarHBondContact O-N 3.43Å; H200-N204 VanDerWaalsContact O-N 3.13Å; H200-N204 PolarHBondContact O-ND2 2.9Å
201	K	95.7	Very high	94	Very high	54 Å²	54	37 Å²	37	24%	0.235	19%	0.194	C	C	.	.	H	α-helix	trans	-62.4	-43.4	177.6	-169.2	171	178	-177	0	111.7	K197 A198 L203 N204 R205 E351 D422	K197-K201 PolarHBondContact O-N 3.29Å; A198-K201 PolarHBondContact O-N 3.25Å; K201-L203 PolarHBondContact O-N 3.32Å; K201-N204 PolarHBondContact O-N 3.12Å; K201-R205 HydrophobicContact CG-CG 4.23Å; K201-R205 WeakPolarHBondContact O-CB 3.5Å; K201-R205 VanDerWaalsContact O-CG 3.25Å; K201-R205 WeakPolarHBondContact O-CG 3.4Å; K201-R205 PolarHBondContact O-N 3.36Å; K201-E351 VanDerWaalsContact CD-OE2 3.28Å; K201-E351 WeakPolarHBondContact CD-OE2 3.47Å; K201-E351 VanDerWaalsContact CE-OE1 3.31Å; K201-E351 WeakPolarHBondContact CE-OE1 3.39Å; K201-E351 WeakPolarHBondContact CE-OE2 3.38Å; K201-E351 IonicContact NZ-OE1 3.66Å; K201-E351 IonicContact NZ-OE2 3.02Å; K201-E351 PolarHBondContact NZ-OE2 3.31Å; K201-D422 WeakPolarHBondContact CE-OD2 3.19Å; K201-D422 IonicContact NZ-OD2 3.99Å; K201-D422 PolarHBondContact NZ-OD2 3.22Å
202	F	97.7	Very high	94.6	Very high	4 Å²	4	35.2 Å²	35.2	2%	0.018	19%	0.186	C	C	.	.	H	α-helix	trans	-53.4	-50.5	175.1	169	-94.3	0	0	0	112.8	F155 L158 K159 P172 P173 L174 A198 R205 I206	F155-F202 AromaticContact CD1-CD1 3.93Å; F155-F202 HydrophobicContact CD1-CD1 3.93Å; F155-F202 HydrophobicContact CD1-CE1 4.04Å; L158-F202 HydrophobicContact CD2-CE1 3.94Å; L158-F202 HydrophobicContact CD2-CZ 4.43Å; K159-F202 HydrophobicContact CB-CE2 4.29Å; K159-F202 HydrophobicContact CB-CZ 4.11Å; P172-F202 HydrophobicContact CB-CD2 3.93Å; P172-F202 WeakPolarHBondContact O-CD2 3.39Å; P172-F202 VanDerWaalsContact O-CE2 3.3Å; P172-F202 WeakPolarHBondContact O-CE2 3.16Å; P173-F202 WeakPolarHBondContact O-CD2 3.36Å; L174-F202 HydrophobicContact CD1-CE2 4.34Å; L174-F202 HydrophobicContact CD1-CZ 4.34Å; L174-F202 HydrophobicContact CD2-CB 4.14Å; L174-F202 HydrophobicContact CD2-CD1 3.69Å; L174-F202 HydrophobicContact CD2-CD2 3.53Å; L174-F202 HydrophobicContact CD2-CE1 3.9Å; L174-F202 HydrophobicContact CD2-CE2 3.75Å; L174-F202 HydrophobicContact CD2-CG 3.51Å; L174-F202 HydrophobicContact CD2-CZ 3.92Å; L174-F202 HydrophobicContact CG-CD2 3.85Å; L174-F202 HydrophobicContact CG-CE2 3.74Å; L174-F202 HydrophobicContact CG-CG 4.34Å; L174-F202 HydrophobicContact CG-CZ 4.14Å; A198-F202 WeakPolarHBondContact O-CB 3.37Å; A198-F202 PolarHBondContact O-N 2.99Å; F202-R205 PolarHBondContact O-N 3.07Å; F202-I206 HydrophobicContact CD1-CD1 3.93Å; F202-I206 HydrophobicContact CD2-CD1 4.2Å; F202-I206 HydrophobicContact CE1-CD1 3.48Å; F202-I206 VanDerWaalsContact CE1-CD1 3.48Å; F202-I206 HydrophobicContact CE2-CD1 3.77Å; F202-I206 HydrophobicContact CG-CD1 4.27Å; F202-I206 HydrophobicContact CZ-CD1 3.39Å; F202-I206 WeakPolarHBondContact O-CG1 2.78Å; F202-I206 PolarHBondContact O-N 2.91Å
203	L	98.3	Very high	95	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-68.6	-39.7	-179.6	-62.4	179.8	0	0	0	112.7	I112 V114 I132 F155 L158 L199 H200 K201 I206 A207 F218 F221 L222	I112-L203 HydrophobicContact CD1-CB 4.16Å; I112-L203 HydrophobicContact CG2-CB 3.96Å; I112-L203 HydrophobicContact CG2-CD1 3.77Å; V114-L203 HydrophobicContact CG2-CD1 3.59Å; I132-L203 HydrophobicContact CD1-CD1 3.78Å; I132-L203 HydrophobicContact CG1-CD1 4.43Å; I132-L203 HydrophobicContact CG2-CD1 4.13Å; F155-L203 HydrophobicContact CD1-CD2 4.2Å; F155-L203 HydrophobicContact CD1-CG 4.49Å; F155-L203 HydrophobicContact CE1-CD1 3.8Å; F155-L203 HydrophobicContact CE1-CD2 3.99Å; F155-L203 HydrophobicContact CE1-CG 3.88Å; F155-L203 HydrophobicContact CZ-CD1 4.39Å; L158-L203 HydrophobicContact CD2-CD2 3.96Å; L199-L203 PolarHBondContact O-N 3.36Å; H200-L203 PolarHBondContact O-N 3.15Å; K201-L203 PolarHBondContact O-N 3.32Å; L203-I206 PolarHBondContact O-N 2.89Å; L203-A207 PolarHBondContact O-N 3.44Å; L203-F218 HydrophobicContact CD2-CE2 4.05Å; L203-F221 HydrophobicContact CD1-CE1 3.99Å; L203-F221 HydrophobicContact CD2-CD1 4.07Å; L203-F221 HydrophobicContact CD2-CE1 3.53Å; L203-F221 HydrophobicContact CD2-CZ 4.36Å; L203-F221 HydrophobicContact CG-CE1 4.42Å; L203-L222 HydrophobicContact CD1-CD2 4.43Å
204	N	97.3	Very high	95.2	Very high	29 Å²	29	37 Å²	37	16%	0.155	19%	0.193	C	C	.	.	H	α-helix	trans	-67.4	-37	177.4	-76.4	-85.3	0	0	0	111.6	I112 H200 K201 I206 A207 D208	I112-N204 PolarHBondContact O-ND2 2.68Å; H200-N204 PolarHBondContact CE1-ND2 2.88Å; H200-N204 VanDerWaalsContact CE1-ND2 3.27Å; H200-N204 PolarHBondContact ND1-ND2 2.82Å; H200-N204 PolarHBondContact O-N 3.43Å; H200-N204 VanDerWaalsContact O-N 3.13Å; H200-N204 PolarHBondContact O-ND2 2.9Å; K201-N204 PolarHBondContact O-N 3.12Å; N204-I206 VanDerWaalsContact C-N 3.26Å; N204-I206 PolarHBondContact O-N 2.96Å; N204-A207 PolarHBondContact O-N 3.43Å; N204-D208 VanDerWaalsContact O-CB 3.29Å; N204-D208 WeakPolarHBondContact O-CB 3.28Å; N204-D208 PolarHBondContact O-N 3.47Å
205	R	96.4	Very high	95.6	Very high	29 Å²	29	34.3 Å²	34.3	11%	0.109	18%	0.175	C	C	.	.	H	α-helix	trans	-62.5	-29.5	173	-75	-68.6	-166	-161.1	2.6	113.8	P172 K201 F202 R414 N418 D422	P172-R205 HydrophobicContact CB-CB 4.05Å; P172-R205 HydrophobicContact CG-CB 3.5Å; P172-R205 VanDerWaalsContact CG-CB 3.5Å; P172-R205 HydrophobicContact CG-CG 4.45Å; K201-R205 HydrophobicContact CG-CG 4.23Å; K201-R205 WeakPolarHBondContact O-CB 3.5Å; K201-R205 VanDerWaalsContact O-CG 3.25Å; K201-R205 WeakPolarHBondContact O-CG 3.4Å; K201-R205 PolarHBondContact O-N 3.36Å; F202-R205 PolarHBondContact O-N 3.07Å; R205-R414 PolarHBondContact O-NH2 3.42Å; R205-N418 PolarHBondContact NH1-OD1 3.43Å; R205-D422 IonicContact CZ-OD1 2.61Å; R205-D422 IonicContact CZ-OD2 2.91Å; R205-D422 IonicContact NH2-OD1 3.46Å; R205-D422 PolarHBondContact NH2-OD1 2.85Å; R205-D422 IonicContact NH2-OD2 3.36Å; R205-D422 PolarHBondContact NH2-OD2 2.91Å
206	I	97.3	Very high	95.8	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-78	-43.7	173.3	-67.4	162.8	0	0	0	110.7	L162 P172 F202 L203 N204 D208 H209 L212 T213 F218	L162-I206 HydrophobicContact CD1-CD1 3.6Å; L162-I206 HydrophobicContact CD1-CG1 4.11Å; L162-I206 HydrophobicContact CD1-CG2 4.26Å; P172-I206 HydrophobicContact CG-CG1 4.21Å; F202-I206 HydrophobicContact CD1-CD1 3.93Å; F202-I206 HydrophobicContact CD2-CD1 4.2Å; F202-I206 HydrophobicContact CE1-CD1 3.48Å; F202-I206 VanDerWaalsContact CE1-CD1 3.48Å; F202-I206 HydrophobicContact CE2-CD1 3.77Å; F202-I206 HydrophobicContact CG-CD1 4.27Å; F202-I206 HydrophobicContact CZ-CD1 3.39Å; F202-I206 WeakPolarHBondContact O-CG1 2.78Å; F202-I206 PolarHBondContact O-N 2.91Å; L203-I206 PolarHBondContact O-N 2.89Å; N204-I206 VanDerWaalsContact C-N 3.26Å; N204-I206 PolarHBondContact O-N 2.96Å; I206-D208 VanDerWaalsContact C-N 3.28Å; I206-D208 PolarHBondContact O-N 3.39Å; I206-H209 WeakPolarHBondContact O-CB 3.49Å; I206-H209 PolarHBondContact O-N 3.37Å; I206-H209 VanDerWaalsContact O-N 3.08Å; I206-L212 HydrophobicContact CG2-CB 3.89Å; I206-T213 PolarHBondContact O-N 2.92Å; I206-F218 HydrophobicContact CB-CE2 4.01Å; I206-F218 HydrophobicContact CB-CZ 4.03Å; I206-F218 HydrophobicContact CG2-CD1 3.85Å; I206-F218 HydrophobicContact CG2-CD2 3.66Å; I206-F218 HydrophobicContact CG2-CE1 3.74Å; I206-F218 HydrophobicContact CG2-CE2 3.53Å; I206-F218 HydrophobicContact CG2-CG 3.8Å; I206-F218 HydrophobicContact CG2-CZ 3.56Å
207	A	96.4	Very high	95.8	Very high	9 Å²	9	38 Å²	38	7%	0.074	20%	0.197	C	C	.	.	H	α-helix	trans	-58.9	-40.1	174.6	0	0	0	0	0	112	L110 I112 L203 N204 H209 T213 F218	L110-A207 HydrophobicContact CD2-CB 3.9Å; L110-A207 HydrophobicContact CG-CB 4.35Å; I112-A207 HydrophobicContact CD1-CB 3.9Å; L203-A207 PolarHBondContact O-N 3.44Å; N204-A207 PolarHBondContact O-N 3.43Å; A207-H209 PolarHBondContact O-N 2.97Å; A207-T213 WeakPolarHBondContact CA-OG1 3.33Å; A207-T213 WeakPolarHBondContact O-CB 3.43Å; A207-T213 PolarHBondContact O-OG1 3.08Å; A207-F218 HydrophobicContact CB-CZ 4.33Å
208	D	94.9	Very high	96	Very high	65 Å²	65	34.7 Å²	34.7	35%	0.348	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82	10.5	177.1	-62.5	-11.9	0	0	0	113.3	K108 N204 I206 R414	K108-D208 VanDerWaalsContact CE-OD1 3.32Å; K108-D208 WeakPolarHBondContact CE-OD1 3.25Å; K108-D208 IonicContact NZ-OD1 3.65Å; K108-D208 PolarHBondContact NZ-OD1 2.89Å; K108-D208 IonicContact NZ-OD2 2.76Å; K108-D208 PolarHBondContact NZ-OD2 2.98Å; N204-D208 VanDerWaalsContact O-CB 3.29Å; N204-D208 WeakPolarHBondContact O-CB 3.28Å; N204-D208 PolarHBondContact O-N 3.47Å; I206-D208 VanDerWaalsContact C-N 3.28Å; I206-D208 PolarHBondContact O-N 3.39Å; D208-R414 VanDerWaalsContact C-NH2 3.34Å; D208-R414 PolarHBondContact O-NH2 3.38Å
209	H	95.8	Very high	96.1	Very high	4 Å²	4	35.5 Å²	35.5	2%	0.019	18%	0.18	C	C	.	.	S	Bend	trans	-103.4	122.5	176.5	-176.8	-49.3	0	0	0	110.5	I206 A207 T211 L212 T213 D411 R414	I206-H209 WeakPolarHBondContact O-CB 3.49Å; I206-H209 PolarHBondContact O-N 3.37Å; I206-H209 VanDerWaalsContact O-N 3.08Å; A207-H209 PolarHBondContact O-N 2.97Å; H209-T211 VanDerWaalsContact C-N 3.32Å; H209-T211 PolarHBondContact ND1-N 3.13Å; H209-T211 PolarHBondContact O-N 2.98Å; H209-T211 VanDerWaalsContact O-N 3.13Å; H209-L212 HydrophobicContact CB-CB 4Å; H209-L212 HydrophobicContact CB-CD1 4.09Å; H209-L212 HydrophobicContact CB-CG 4.13Å; H209-L212 VanDerWaalsContact CD2-CD1 3.46Å; H209-L212 WeakPolarHBondContact CD2-CD1 3.22Å; H209-L212 PolarHBondContact ND1-N 3.24Å; H209-L212 VanDerWaalsContact ND1-N 3.2Å; H209-L212 PolarHBondContact O-N 3.31Å; H209-T213 WeakPolarHBondContact O-CB 3.43Å; H209-T213 VanDerWaalsContact O-CG2 3.24Å; H209-T213 WeakPolarHBondContact O-CG2 3.44Å; H209-T213 PolarHBondContact O-N 3.3Å; H209-T213 VanDerWaalsContact O-N 3.08Å; H209-D411 IonicContact CD2-OD1 3.39Å; H209-D411 IonicContact CD2-OD2 3.63Å; H209-D411 IonicContact NE2-OD1 3.5Å; H209-D411 PolarHBondContact NE2-OD1 2.96Å; H209-D411 IonicContact NE2-OD2 2.72Å; H209-D411 PolarHBondContact NE2-OD2 2.65Å; H209-R414 PolarHBondContact CD2-NH1 3.36Å
210	P	94	Very high	96	Very high	86 Å²	86	36.1 Å²	36.1	56%	0.558	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-36.7	-172.5	22.2	-34.3	0	0	0	114.5	F214	P210-F214 WeakPolarHBondContact O-CD2 3.18Å; P210-F214 VanDerWaalsContact O-CE2 3.25Å; P210-F214 WeakPolarHBondContact O-CE2 3.32Å
211	T	94.4	Very high	96	Very high	66 Å²	66	33.2 Å²	33.2	41%	0.405	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-53.2	173.1	-37.8	0	0	0	0	114.4	L169 H209 T213 F214	L169-T211 HydrophobicContact CD1-CG2 4.03Å; H209-T211 VanDerWaalsContact C-N 3.32Å; H209-T211 PolarHBondContact ND1-N 3.13Å; H209-T211 PolarHBondContact O-N 2.98Å; H209-T211 VanDerWaalsContact O-N 3.13Å; T211-T213 VanDerWaalsContact C-N 3.25Å; T211-T213 PolarHBondContact O-N 2.93Å; T211-F214 PolarHBondContact O-N 3.47Å
212	L	96.3	Very high	96	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.159	C	C	.	.	G	3₁₀ helix	trans	-66.1	-26.3	-170.2	-52.6	174	0	0	0	113.3	L162 H166 L169 I171 I206 H209 F214 N215	L162-L212 HydrophobicContact CD2-CD2 4.33Å; H166-L212 HydrophobicContact CB-CD2 4.25Å; L169-L212 HydrophobicContact CB-CD2 4.46Å; L169-L212 HydrophobicContact CD1-CD2 3.7Å; L169-L212 HydrophobicContact CD1-CG 4.23Å; I171-L212 HydrophobicContact CD1-CD1 3.67Å; I171-L212 HydrophobicContact CD1-CD2 3.58Å; I171-L212 HydrophobicContact CD1-CG 4.28Å; I206-L212 HydrophobicContact CG2-CB 3.89Å; H209-L212 HydrophobicContact CB-CB 4Å; H209-L212 HydrophobicContact CB-CD1 4.09Å; H209-L212 HydrophobicContact CB-CG 4.13Å; H209-L212 VanDerWaalsContact CD2-CD1 3.46Å; H209-L212 WeakPolarHBondContact CD2-CD1 3.22Å; H209-L212 PolarHBondContact ND1-N 3.24Å; H209-L212 VanDerWaalsContact ND1-N 3.2Å; H209-L212 PolarHBondContact O-N 3.31Å; L212-F214 PolarHBondContact O-N 3.19Å; L212-N215 VanDerWaalsContact O-CB 3.25Å; L212-N215 WeakPolarHBondContact O-CB 3.14Å; L212-N215 PolarHBondContact O-N 2.83Å; L212-N215 VanDerWaalsContact O-N 3.09Å
213	T	95.6	Very high	95.9	Very high	9 Å²	9	31.8 Å²	31.8	6%	0.055	17%	0.167	C	C	.	.	G	3₁₀ helix	trans	-63.3	-20.7	179.9	-158.9	0	0	0	0	113.8	R138 I206 A207 H209 T211	R138-T213 PolarHBondContact NH1-O 3.02Å; R138-T213 PolarHBondContact NH1-OG1 3.29Å; R138-T213 PolarHBondContact NH2-OG1 2.63Å; I206-T213 PolarHBondContact O-N 2.92Å; A207-T213 WeakPolarHBondContact CA-OG1 3.33Å; A207-T213 WeakPolarHBondContact O-CB 3.43Å; A207-T213 PolarHBondContact O-OG1 3.08Å; H209-T213 WeakPolarHBondContact O-CB 3.43Å; H209-T213 VanDerWaalsContact O-CG2 3.24Å; H209-T213 WeakPolarHBondContact O-CG2 3.44Å; H209-T213 PolarHBondContact O-N 3.3Å; H209-T213 VanDerWaalsContact O-N 3.08Å; T211-T213 VanDerWaalsContact C-N 3.25Å; T211-T213 PolarHBondContact O-N 2.93Å
214	F	94	Very high	95.7	Very high	111 Å²	111	32.2 Å²	32.2	49%	0.487	17%	0.17	S	C	.	.	G	3₁₀ helix	trans	-102.5	11.8	177.1	-57.5	-71.2	0	0	0	113.1	P210 T211 L212	P210-F214 WeakPolarHBondContact O-CD2 3.18Å; P210-F214 VanDerWaalsContact O-CE2 3.25Å; P210-F214 WeakPolarHBondContact O-CE2 3.32Å; T211-F214 PolarHBondContact O-N 3.47Å; L212-F214 PolarHBondContact O-N 3.19Å
215	N	95.4	Very high	95.6	Very high	17 Å²	17	35.5 Å²	35.5	9%	0.091	19%	0.185	C	C	.	.			trans	-75.1	130.1	-179	-174.3	-76.2	0	0	0	111.6	L162 H166 L212 D217 F218 K219	L162-N215 HydrophobicContact CD2-CB 3.72Å; L162-N215 VanDerWaalsContact CD2-CG 3.46Å; H166-N215 PolarHBondContact NE2-ND2 3.41Å; H166-N215 VanDerWaalsContact NE2-ND2 3.11Å; L212-N215 VanDerWaalsContact O-CB 3.25Å; L212-N215 WeakPolarHBondContact O-CB 3.14Å; L212-N215 PolarHBondContact O-N 2.83Å; L212-N215 VanDerWaalsContact O-N 3.09Å; N215-D217 PolarHBondContact O-N 2.88Å; N215-D217 WeakPolarHBondContact OD1-CB 3.44Å; N215-D217 PolarHBondContact OD1-N 3.41Å; N215-F218 HydrophobicContact CB-CB 4.13Å; N215-F218 WeakPolarHBondContact O-CA 3.4Å; N215-F218 WeakPolarHBondContact O-CB 3.22Å; N215-F218 PolarHBondContact O-N 2.65Å; N215-F218 PolarHBondContact OD1-N 2.72Å; N215-K219 PolarHBondContact O-N 2.76Å
216	E	94.8	Very high	95.1	Very high	125 Å²	125	36.7 Å²	36.7	58%	0.584	20%	0.201	S	C	*	.	H	α-helix	trans	-63.3	-35.8	-177.7	-69.6	-64.8	161.3	0	0	113.8	F218 K219 V220	E216-F218 VanDerWaalsContact C-N 3.27Å; E216-F218 PolarHBondContact O-N 2.98Å; E216-K219 PolarHBondContact O-N 2.89Å; E216-V220 WeakPolarHBondContact O-CB 3.3Å; E216-V220 VanDerWaalsContact O-CG2 3.29Å; E216-V220 WeakPolarHBondContact O-CG2 3.44Å; E216-V220 PolarHBondContact O-N 3.21Å
217	D	95.6	Very high	94.6	Very high	27 Å²	27	41.2 Å²	41.2	14%	0.144	23%	0.23	C	C	.	.	H	α-helix	trans	-68	-29.3	174.4	-77.4	-63.3	0	0	0	111.3	W157 K161 N215 F221	W157-D217 HydrophobicContact CH2-CB 4.12Å; W157-D217 WeakPolarHBondContact CZ2-OD1 3.5Å; K161-D217 HydrophobicContact CB-CB 3.82Å; K161-D217 WeakPolarHBondContact CD-OD2 3.44Å; K161-D217 HydrophobicContact CG-CB 4.11Å; K161-D217 WeakPolarHBondContact CG-OD2 3.27Å; K161-D217 IonicContact NZ-OD1 3.9Å; K161-D217 PolarHBondContact NZ-OD1 2.75Å; K161-D217 IonicContact NZ-OD2 2.59Å; K161-D217 PolarHBondContact NZ-OD2 3.05Å; N215-D217 PolarHBondContact O-N 2.88Å; N215-D217 WeakPolarHBondContact OD1-CB 3.44Å; N215-D217 PolarHBondContact OD1-N 3.41Å; D217-F221 VanDerWaalsContact O-CB 3.24Å; D217-F221 WeakPolarHBondContact O-CB 3.41Å; D217-F221 PolarHBondContact O-N 3.4Å
218	F	97.1	Very high	94.2	Very high	1 Å²	1	45.9 Å²	45.9	0%	0.004	25%	0.25	C	C	.	.	H	α-helix	trans	-70.3	-46	171.7	179.5	-123.3	0	0	0	111.6	L110 I112 L158 L203 I206 A207 N215 E216 V220 F221 L222	L110-F218 HydrophobicContact CD2-CE1 3.8Å; L110-F218 HydrophobicContact CD2-CZ 4.33Å; I112-F218 HydrophobicContact CD1-CE2 4.32Å; I112-F218 HydrophobicContact CD1-CZ 3.65Å; L158-F218 HydrophobicContact CD1-CB 4.05Å; L158-F218 HydrophobicContact CD1-CD2 4.32Å; L158-F218 HydrophobicContact CD2-CD2 3.84Å; L158-F218 HydrophobicContact CD2-CE2 4.45Å; L203-F218 HydrophobicContact CD2-CE2 4.05Å; I206-F218 HydrophobicContact CB-CE2 4.01Å; I206-F218 HydrophobicContact CB-CZ 4.03Å; I206-F218 HydrophobicContact CG2-CD1 3.85Å; I206-F218 HydrophobicContact CG2-CD2 3.66Å; I206-F218 HydrophobicContact CG2-CE1 3.74Å; I206-F218 HydrophobicContact CG2-CE2 3.53Å; I206-F218 HydrophobicContact CG2-CG 3.8Å; I206-F218 HydrophobicContact CG2-CZ 3.56Å; A207-F218 HydrophobicContact CB-CZ 4.33Å; N215-F218 HydrophobicContact CB-CB 4.13Å; N215-F218 WeakPolarHBondContact O-CA 3.4Å; N215-F218 WeakPolarHBondContact O-CB 3.22Å; N215-F218 PolarHBondContact O-N 2.65Å; N215-F218 PolarHBondContact OD1-N 2.72Å; E216-F218 VanDerWaalsContact C-N 3.27Å; E216-F218 PolarHBondContact O-N 2.98Å; F218-V220 PolarHBondContact O-N 3.3Å; F218-F221 WeakPolarHBondContact O-CA 3.31Å; F218-F221 WeakPolarHBondContact O-CB 3.27Å; F218-F221 PolarHBondContact O-N 3.39Å; F218-F221 VanDerWaalsContact O-N 3.09Å; F218-L222 HydrophobicContact CD1-CD1 4.29Å; F218-L222 HydrophobicContact CD2-CD1 4.45Å; F218-L222 HydrophobicContact CD2-CG 4.42Å; F218-L222 HydrophobicContact CE1-CD1 3.85Å; F218-L222 HydrophobicContact CE2-CD1 4.03Å; F218-L222 HydrophobicContact CE2-CD2 4.22Å; F218-L222 HydrophobicContact CE2-CG 4.21Å; F218-L222 HydrophobicContact CZ-CD1 3.73Å; F218-L222 HydrophobicContact CZ-CG 4.4Å; F218-L222 WeakPolarHBondContact O-CG 3.34Å; F218-L222 PolarHBondContact O-N 3.24Å
219	K	95.7	Very high	94	Very high	49 Å²	49	42.9 Å²	42.9	21%	0.213	23%	0.234	C	C	.	.	H	α-helix	trans	-56.6	-51	173.9	-174	-178.5	-176.4	178.9	0	111.7	E140 F141 N215 E216 F221 L222 T223	E140-K219 VanDerWaalsContact O-CE 3.23Å; E140-K219 WeakPolarHBondContact O-CE 3.21Å; E140-K219 PolarHBondContact O-NZ 3.09Å; F141-K219 HydrophobicContact CE1-CG 3.96Å; F141-K219 HydrophobicContact CZ-CG 4.12Å; N215-K219 PolarHBondContact O-N 2.76Å; E216-K219 PolarHBondContact O-N 2.89Å; K219-F221 VanDerWaalsContact C-N 3.27Å; K219-F221 PolarHBondContact O-N 2.95Å; K219-L222 PolarHBondContact O-N 3.41Å; K219-T223 WeakPolarHBondContact O-CG2 3.37Å; K219-T223 PolarHBondContact O-N 2.96Å; K219-T223 PolarHBondContact O-OG1 2.91Å
220	V	95.5	Very high	93.6	Very high	13 Å²	13	45.5 Å²	45.5	8%	0.079	25%	0.253	C	S	.	.	H	α-helix	trans	-58.3	-38.7	174.2	169.4	0	0	0	0	111.4	E216 F218 L222 A224 L229 Y232	E216-V220 WeakPolarHBondContact O-CB 3.3Å; E216-V220 VanDerWaalsContact O-CG2 3.29Å; E216-V220 WeakPolarHBondContact O-CG2 3.44Å; E216-V220 PolarHBondContact O-N 3.21Å; F218-V220 PolarHBondContact O-N 3.3Å; V220-L222 VanDerWaalsContact C-N 3.3Å; V220-L222 PolarHBondContact O-N 3.08Å; V220-A224 HydrophobicContact CG1-CB 3.96Å; V220-A224 WeakPolarHBondContact O-CB 3.11Å; V220-A224 PolarHBondContact O-N 2.85Å; V220-L229 HydrophobicContact CG1-CD1 4.1Å; V220-Y232 HydrophobicContact CG1-CD1 4.15Å; V220-Y232 HydrophobicContact CG1-CD2 4Å; V220-Y232 HydrophobicContact CG1-CE1 4.47Å; V220-Y232 HydrophobicContact CG1-CE2 4.34Å; V220-Y232 HydrophobicContact CG1-CG 3.9Å; V220-Y232 HydrophobicContact CG2-CD1 4.38Å; V220-Y232 HydrophobicContact CG2-CE1 3.95Å; V220-Y232 HydrophobicContact CG2-CE2 4.42Å
221	F	97.3	Very high	93.2	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-63.9	-30.9	175.2	-179.3	-89.9	0	0	0	113.3	I132 R150 D154 F155 W157 L158 L203 D217 F218 K219	I132-F221 HydrophobicContact CD1-CD1 4.45Å; I132-F221 HydrophobicContact CD1-CE1 3.49Å; I132-F221 VanDerWaalsContact CD1-CE1 3.49Å; I132-F221 HydrophobicContact CD1-CZ 3.85Å; R150-F221 HydrophobicContact CB-CE2 4.29Å; R150-F221 HydrophobicContact CB-CZ 4.03Å; R150-F221 HydrophobicContact CG-CE1 4.18Å; R150-F221 HydrophobicContact CG-CE2 3.85Å; R150-F221 HydrophobicContact CG-CZ 3.64Å; R150-F221 PolarHBondContact NE-O 3.42Å; R150-F221 PolarHBondContact NH2-O 2.83Å; D154-F221 HydrophobicContact CB-CD2 4.49Å; D154-F221 HydrophobicContact CB-CE2 3.77Å; F155-F221 HydrophobicContact CD1-CE1 4.32Å; F155-F221 AromaticContact CD1-CZ 3.7Å; F155-F221 HydrophobicContact CD1-CZ 3.7Å; F155-F221 HydrophobicContact CD2-CE2 4.46Å; F155-F221 AromaticContact CD2-CZ 3.98Å; F155-F221 HydrophobicContact CD2-CZ 3.98Å; F155-F221 HydrophobicContact CE1-CE1 4.14Å; F155-F221 AromaticContact CE1-CZ 3.75Å; F155-F221 HydrophobicContact CE1-CZ 3.75Å; F155-F221 AromaticContact CE2-CZ 4Å; F155-F221 HydrophobicContact CE2-CZ 4Å; F155-F221 HydrophobicContact CG-CE2 4.36Å; F155-F221 AromaticContact CG-CZ 3.84Å; F155-F221 HydrophobicContact CG-CZ 3.84Å; F155-F221 HydrophobicContact CZ-CE1 4.45Å; F155-F221 AromaticContact CZ-CZ 3.9Å; F155-F221 HydrophobicContact CZ-CZ 3.9Å; W157-F221 HydrophobicContact CE3-CD2 4.35Å; W157-F221 HydrophobicContact CZ3-CB 4.21Å; W157-F221 HydrophobicContact CZ3-CD2 4.24Å; L158-F221 HydrophobicContact CB-CD2 3.89Å; L158-F221 HydrophobicContact CB-CE2 4.28Å; L158-F221 HydrophobicContact CB-CG 4.24Å; L158-F221 HydrophobicContact CD1-CB 4.21Å; L158-F221 HydrophobicContact CD2-CB 4.04Å; L158-F221 HydrophobicContact CD2-CD1 3.58Å; L158-F221 HydrophobicContact CD2-CD2 4.01Å; L158-F221 HydrophobicContact CD2-CE1 3.98Å; L158-F221 HydrophobicContact CD2-CE2 4.36Å; L158-F221 HydrophobicContact CD2-CG 3.6Å; L158-F221 HydrophobicContact CD2-CZ 4.34Å; L158-F221 HydrophobicContact CG-CD2 4.48Å; L158-F221 HydrophobicContact CG-CG 4.34Å; L203-F221 HydrophobicContact CD1-CE1 3.99Å; L203-F221 HydrophobicContact CD2-CD1 4.07Å; L203-F221 HydrophobicContact CD2-CE1 3.53Å; L203-F221 HydrophobicContact CD2-CZ 4.36Å; L203-F221 HydrophobicContact CG-CE1 4.42Å; D217-F221 VanDerWaalsContact O-CB 3.24Å; D217-F221 WeakPolarHBondContact O-CB 3.41Å; D217-F221 PolarHBondContact O-N 3.4Å; F218-F221 WeakPolarHBondContact O-CA 3.31Å; F218-F221 WeakPolarHBondContact O-CB 3.27Å; F218-F221 PolarHBondContact O-N 3.39Å; F218-F221 VanDerWaalsContact O-N 3.09Å; K219-F221 VanDerWaalsContact C-N 3.27Å; K219-F221 PolarHBondContact O-N 2.95Å
222	L	96.9	Very high	92.8	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-86	-30.3	178.4	-62	178	0	0	0	113.6	L110 I112 I132 T134 V148 L203 F218 K219 V220	L110-L222 HydrophobicContact CD1-CD1 4.38Å; L110-L222 HydrophobicContact CD2-CD1 4.08Å; I112-L222 HydrophobicContact CD1-CD1 3.75Å; I112-L222 HydrophobicContact CD1-CD2 3.94Å; I112-L222 HydrophobicContact CG1-CD1 4.45Å; I112-L222 HydrophobicContact CG2-CD2 4.35Å; I132-L222 HydrophobicContact CG2-CD2 4.14Å; T134-L222 HydrophobicContact CG2-CB 4.28Å; T134-L222 HydrophobicContact CG2-CD1 3.99Å; V148-L222 WeakPolarHBondContact CG1-O 3.13Å; V148-L222 VanDerWaalsContact CG2-O 3.31Å; V148-L222 WeakPolarHBondContact CG2-O 3.48Å; L203-L222 HydrophobicContact CD1-CD2 4.43Å; F218-L222 HydrophobicContact CD1-CD1 4.29Å; F218-L222 HydrophobicContact CD2-CD1 4.45Å; F218-L222 HydrophobicContact CD2-CG 4.42Å; F218-L222 HydrophobicContact CE1-CD1 3.85Å; F218-L222 HydrophobicContact CE2-CD1 4.03Å; F218-L222 HydrophobicContact CE2-CD2 4.22Å; F218-L222 HydrophobicContact CE2-CG 4.21Å; F218-L222 HydrophobicContact CZ-CD1 3.73Å; F218-L222 HydrophobicContact CZ-CG 4.4Å; F218-L222 WeakPolarHBondContact O-CG 3.34Å; F218-L222 PolarHBondContact O-N 3.24Å; K219-L222 PolarHBondContact O-N 3.41Å; V220-L222 VanDerWaalsContact C-N 3.3Å; V220-L222 PolarHBondContact O-N 3.08Å
223	T	95.5	Very high	92.3	Very high	28 Å²	28	49.4 Å²	49.4	17%	0.172	26%	0.261	C	S	.	.	H	α-helix	trans	-106.3	-36.1	-169.6	62.4	0	0	0	0	115	F141 F146 K219	F141-T223 HydrophobicContact CD1-CG2 3.69Å; F141-T223 HydrophobicContact CE1-CG2 3.78Å; F146-T223 HydrophobicContact CD1-CG2 3.71Å; F146-T223 HydrophobicContact CD2-CG2 4.01Å; F146-T223 HydrophobicContact CE1-CG2 3.54Å; F146-T223 HydrophobicContact CE2-CG2 3.88Å; F146-T223 HydrophobicContact CG-CG2 3.94Å; F146-T223 HydrophobicContact CZ-CG2 3.62Å; K219-T223 WeakPolarHBondContact O-CG2 3.37Å; K219-T223 PolarHBondContact O-N 2.96Å; K219-T223 PolarHBondContact O-OG1 2.91Å
224	A	94.4	Very high	91.6	Very high	9 Å²	9	57.2 Å²	57.2	7%	0.074	29%	0.294	C	S	.	.			trans	-71.7	141.9	-167.7	0	0	0	0	0	113.2	R150 V220 E228 L229	R150-A224 VanDerWaalsContact CZ-O 3.3Å; R150-A224 PolarHBondContact NH1-O 3.38Å; R150-A224 PolarHBondContact NH2-O 2.9Å; V220-A224 HydrophobicContact CG1-CB 3.96Å; V220-A224 WeakPolarHBondContact O-CB 3.11Å; V220-A224 PolarHBondContact O-N 2.85Å; A224-E228 HydrophobicContact CB-CB 4.16Å; A224-L229 HydrophobicContact CB-CB 4.47Å
225	Q	93.4	Very high	90.5	Very high	98 Å²	98	59 Å²	59	46%	0.458	30%	0.304	S	S	.	.			trans	-72.7	157	174.2	-66.4	-59.6	-30.5	0	0	111.2	E147 P227 E228 L229	E147-Q225 PolarHBondContact O-NE2 2.67Å; Q225-P227 VanDerWaalsContact C-CD 3.41Å; Q225-P227 VanDerWaalsContact C-N 3.33Å; Q225-P227 VanDerWaalsContact O-N 3.15Å; Q225-E228 PolarHBondContact N-OE2 3.13Å; Q225-E228 WeakPolarHBondContact O-CA 3.42Å; Q225-E228 WeakPolarHBondContact O-CB 3.31Å; Q225-E228 PolarHBondContact O-N 3.37Å; Q225-L229 PolarHBondContact O-N 3.49Å
226	A	87.6	Confident	89	Confident	54 Å²	54	59.6 Å²	59.6	45%	0.446	31%	0.314	S	S	.	.	H	α-helix	trans	-53.7	-37.2	-171.4	0	0	0	0	0	115.2	S230	A226-S230 WeakPolarHBondContact O-CB 3.28Å; A226-S230 PolarHBondContact O-N 2.92Å; A226-S230 VanDerWaalsContact O-N 3.12Å; A226-S230 PolarHBondContact O-OG 3.02Å
227	P	86.3	Confident	87.3	Confident	94 Å²	94	57.7 Å²	57.7	61%	0.61	31%	0.312	S	S	*	.	H	α-helix	trans	-67.6	-34.1	173.8	-20.6	34.4	0	0	0	113.8	Q225 S231	Q225-P227 VanDerWaalsContact C-CD 3.41Å; Q225-P227 VanDerWaalsContact C-N 3.33Å; Q225-P227 VanDerWaalsContact O-N 3.15Å; P227-S231 PolarHBondContact O-N 2.76Å; P227-S231 PolarHBondContact O-OG 3.32Å
228	E	87.9	Confident	85.6	Confident	107 Å²	107	58.6 Å²	58.6	50%	0.5	33%	0.328	S	S	.	.	H	α-helix	trans	-73.5	-47.9	-178.8	-60.5	169.2	158.6	0	0	110.2	A224 Q225 S230 S231 Y232	A224-E228 HydrophobicContact CB-CB 4.16Å; Q225-E228 PolarHBondContact N-OE2 3.13Å; Q225-E228 WeakPolarHBondContact O-CA 3.42Å; Q225-E228 WeakPolarHBondContact O-CB 3.31Å; Q225-E228 PolarHBondContact O-N 3.37Å; E228-S230 PolarHBondContact O-N 3.28Å; E228-S231 WeakPolarHBondContact O-CA 3.36Å; E228-S231 VanDerWaalsContact O-CB 3.31Å; E228-S231 WeakPolarHBondContact O-CB 3.4Å; E228-S231 PolarHBondContact O-N 3.4Å; E228-Y232 PolarHBondContact O-N 3.15Å
229	L	90	Very high	83.6	Confident	3 Å²	3	65 Å²	65	2%	0.016	36%	0.362	C	S	.	.	H	α-helix	trans	-55.4	-42.2	172.1	-175.6	70.9	0	0	0	111.4	D154 W157 V220 A224 Q225 S231 Y232 K233	D154-L229 HydrophobicContact CB-CD2 4.24Å; W157-L229 HydrophobicContact CE3-CD1 4.19Å; W157-L229 HydrophobicContact CH2-CD1 3.89Å; W157-L229 HydrophobicContact CZ3-CD1 3.6Å; V220-L229 HydrophobicContact CG1-CD1 4.1Å; A224-L229 HydrophobicContact CB-CB 4.47Å; Q225-L229 PolarHBondContact O-N 3.49Å; L229-S231 PolarHBondContact O-N 2.87Å; L229-Y232 PolarHBondContact O-N 3.02Å; L229-K233 HydrophobicContact CG-CD 4.46Å; L229-K233 WeakPolarHBondContact O-CB 3.47Å; L229-K233 VanDerWaalsContact O-CG 3.28Å; L229-K233 WeakPolarHBondContact O-CG 3.29Å; L229-K233 PolarHBondContact O-N 2.83Å
230	S	87.4	Confident	81.8	Confident	59 Å²	59	69.8 Å²	69.8	41%	0.413	39%	0.389	S	S	.	.	H	α-helix	trans	-64.7	-22.4	176.3	-61.6	0	0	0	0	113.4	A226 E228 K234	A226-S230 WeakPolarHBondContact O-CB 3.28Å; A226-S230 PolarHBondContact O-N 2.92Å; A226-S230 VanDerWaalsContact O-N 3.12Å; A226-S230 PolarHBondContact O-OG 3.02Å; E228-S230 PolarHBondContact O-N 3.28Å; S230-K234 WeakPolarHBondContact O-CG 3.39Å
231	S	87	Confident	80.1	Confident	62 Å²	62	72.2 Å²	72.2	43%	0.434	41%	0.406	S	S	.	.	H	α-helix	trans	-84.9	-44.8	175.4	-57.7	0	0	0	0	111.2	P227 E228 L229 K233 K234	P227-S231 PolarHBondContact O-N 2.76Å; P227-S231 PolarHBondContact O-OG 3.32Å; E228-S231 WeakPolarHBondContact O-CA 3.36Å; E228-S231 VanDerWaalsContact O-CB 3.31Å; E228-S231 WeakPolarHBondContact O-CB 3.4Å; E228-S231 PolarHBondContact O-N 3.4Å; L229-S231 PolarHBondContact O-N 2.87Å; S231-K233 VanDerWaalsContact C-N 3.3Å; S231-K233 PolarHBondContact O-N 2.93Å; S231-K234 WeakPolarHBondContact O-CB 3.22Å; S231-K234 PolarHBondContact O-N 3.34Å
232	Y	84.9	Confident	78.2	Confident	110 Å²	110	77.6 Å²	77.6	43%	0.431	43%	0.427	S	S	.	.	H	α-helix	trans	-53.9	-44.8	171.2	-96.5	-90	0	0	0	112.3	V220 E228 L229 K234 Q235	V220-Y232 HydrophobicContact CG1-CD1 4.15Å; V220-Y232 HydrophobicContact CG1-CD2 4Å; V220-Y232 HydrophobicContact CG1-CE1 4.47Å; V220-Y232 HydrophobicContact CG1-CE2 4.34Å; V220-Y232 HydrophobicContact CG1-CG 3.9Å; V220-Y232 HydrophobicContact CG2-CD1 4.38Å; V220-Y232 HydrophobicContact CG2-CE1 3.95Å; V220-Y232 HydrophobicContact CG2-CE2 4.42Å; E228-Y232 PolarHBondContact O-N 3.15Å; L229-Y232 PolarHBondContact O-N 3.02Å; Y232-K234 PolarHBondContact O-N 2.87Å; Y232-K234 VanDerWaalsContact O-N 3.13Å; Y232-Q235 PolarHBondContact O-N 2.99Å
233	K	85.5	Confident	76.2	Confident	62 Å²	62	82.9 Å²	82.9	27%	0.27	45%	0.453	S	S	.	.	G	3₁₀ helix	trans	-54.9	-30.3	175.9	-77.7	174.7	169.3	-160.9	0	114.3	D154 W157 L229 S231	D154-K233 IonicContact OD1-NZ 3.15Å; D154-K233 PolarHBondContact OD1-NZ 2.87Å; W157-K233 HydrophobicContact CD2-CD 4.49Å; W157-K233 HydrophobicContact CD2-CG 3.95Å; W157-K233 HydrophobicContact CG-CD 4.34Å; W157-K233 HydrophobicContact CG-CG 3.98Å; W157-K233 HydrophobicContact CZ2-CG 4.37Å; L229-K233 HydrophobicContact CG-CD 4.46Å; L229-K233 WeakPolarHBondContact O-CB 3.47Å; L229-K233 VanDerWaalsContact O-CG 3.28Å; L229-K233 WeakPolarHBondContact O-CG 3.29Å; L229-K233 PolarHBondContact O-N 2.83Å; S231-K233 VanDerWaalsContact C-N 3.3Å; S231-K233 PolarHBondContact O-N 2.93Å
234	K	81.3	Confident	74.5	Confident	173 Å²	173	83.6 Å²	83.6	75%	0.752	47%	0.466	S	S	*	.	G	3₁₀ helix	trans	-83.9	-13.6	-179.7	-66.7	171	-175.3	174.5	0	113.7	S230 S231 Y232	S230-K234 WeakPolarHBondContact O-CG 3.39Å; S231-K234 WeakPolarHBondContact O-CB 3.22Å; S231-K234 PolarHBondContact O-N 3.34Å; Y232-K234 PolarHBondContact O-N 2.87Å; Y232-K234 VanDerWaalsContact O-N 3.13Å
235	Q	71.9	Confident	73	Confident	149 Å²	149	88.8 Å²	88.8	70%	0.696	49%	0.489	S	S	*	.	G	3₁₀ helix	trans	-85.6	-9	179.2	-63.6	177.9	4.7	0	0	113.1	Y232	Y232-Q235 PolarHBondContact O-N 2.99Å
236	G	62.5	Low	71.5	Confident	28 Å²	28	88.2 Å²	88.2	29%	0.289	49%	0.492	S	S	.	.	S	Bend	trans	-70.7	165.9	177.2	0	0	0	0	0	114	G238	G236-G238 PolarHBondContact O-N 3.18Å
237	P	59.5	Low	70.3	Confident	85 Å²	85	90.5 Å²	90.5	55%	0.552	50%	0.5	S	S	*	.	P	Polyproline II helix	trans	-55.2	126.5	178.2	-24.4	33.9	0	0	0	112.1
238	G	59.4	Low	69.2	Low	47 Å²	47	94.6 Å²	94.6	49%	0.485	50%	0.503	S	S	.	.	P	Polyproline II helix	trans	-60.7	154.3	-177.8	0	0	0	0	0	113.2	G236 L240 S241	G236-G238 PolarHBondContact O-N 3.18Å; G238-L240 PolarHBondContact O-N 2.64Å; G238-S241 VanDerWaalsContact O-CB 3.3Å; G238-S241 WeakPolarHBondContact O-CB 3.42Å; G238-S241 PolarHBondContact O-N 3.18Å
239	L	55.8	Low	68	Low	135 Å²	135	90.9 Å²	90.9	71%	0.707	49%	0.491	S	S	*	.	H	α-helix	trans	-52.5	-31.8	-173	-174.1	139.5	0	0	0	114.4	S241 R242 M243	L239-S241 PolarHBondContact O-N 2.99Å; L239-R242 PolarHBondContact O-N 3.43Å; L239-M243 HydrophobicContact CD2-CE 4.11Å; L239-M243 PolarHBondContact O-N 3.41Å; L239-M243 VanDerWaalsContact O-N 3.08Å
240	L	57.3	Low	66.7	Low	149 Å²	149	94.9 Å²	94.9	78%	0.78	52%	0.516	S	S	*	.	H	α-helix	trans	-65.1	-34.4	175.2	-62.5	175	0	0	0	113.3	G238 G244	G238-L240 PolarHBondContact O-N 2.64Å; L240-G244 PolarHBondContact O-N 3.28Å
241	S	59.7	Low	65.5	Low	64 Å²	64	94.9 Å²	94.9	45%	0.448	52%	0.519	S	S	.	.	H	α-helix	trans	-68	-47.8	177	-179.2	0	0	0	0	110.8	G238 L239 M243 G244 Q245	G238-S241 VanDerWaalsContact O-CB 3.3Å; G238-S241 WeakPolarHBondContact O-CB 3.42Å; G238-S241 PolarHBondContact O-N 3.18Å; L239-S241 PolarHBondContact O-N 2.99Å; S241-M243 PolarHBondContact O-N 3.39Å; S241-G244 PolarHBondContact O-N 3.22Å; S241-Q245 PolarHBondContact O-N 3.17Å; S241-Q245 VanDerWaalsContact O-N 3.13Å
242	R	58.2	Low	64.1	Low	113 Å²	113	93.9 Å²	93.9	43%	0.426	51%	0.512	S	S	.	.	H	α-helix	trans	-59.1	-44.1	175.7	-80.6	-177.7	161.1	-171.9	-6.1	112.2	D164 L239 G244 Q245 T246	D164-R242 IonicContact OD1-NH2 2.61Å; D164-R242 IonicContact OD2-CZ 2.59Å; D164-R242 IonicContact OD2-NE 3.57Å; D164-R242 IonicContact OD2-NH2 2.69Å; D164-R242 PolarHBondContact OD2-NH2 3.28Å; L239-R242 PolarHBondContact O-N 3.43Å; R242-G244 VanDerWaalsContact C-N 3.32Å; R242-G244 PolarHBondContact O-N 3.44Å; R242-Q245 WeakPolarHBondContact O-CB 3.45Å; R242-Q245 PolarHBondContact O-N 3.2Å; R242-Q245 VanDerWaalsContact O-N 3.08Å; R242-T246 PolarHBondContact O-N 3.02Å; R242-T246 PolarHBondContact O-OG1 3.37Å; R242-T246 VanDerWaalsContact O-OG1 3.05Å
243	M	55.6	Low	63	Low	111 Å²	111	90.9 Å²	90.9	55%	0.547	51%	0.507	S	S	.	.	H	α-helix	trans	-62.5	-37.5	178.8	-165.1	125.3	66.6	0	0	112.7	L239 S241 Q245 T246 V247	L239-M243 HydrophobicContact CD2-CE 4.11Å; L239-M243 PolarHBondContact O-N 3.41Å; L239-M243 VanDerWaalsContact O-N 3.08Å; S241-M243 PolarHBondContact O-N 3.39Å; M243-Q245 VanDerWaalsContact C-N 3.34Å; M243-T246 PolarHBondContact O-N 3.01Å; M243-V247 PolarHBondContact O-N 3.1Å; M243-V247 VanDerWaalsContact O-N 3.16Å
244	G	59.5	Low	61.6	Low	44 Å²	44	95.7 Å²	95.7	45%	0.454	53%	0.533	S	S	.	.	H	α-helix	trans	-64.9	-34.7	172.8	0	0	0	0	0	113.6	L240 S241 R242 R248	L240-G244 PolarHBondContact O-N 3.28Å; S241-G244 PolarHBondContact O-N 3.22Å; R242-G244 VanDerWaalsContact C-N 3.32Å; R242-G244 PolarHBondContact O-N 3.44Å; G244-R248 PolarHBondContact O-N 3.19Å
245	Q	62.9	Low	60.7	Low	117 Å²	117	96 Å²	96	55%	0.547	53%	0.529	S	S	.	.	H	α-helix	trans	-68.9	-41.4	172.3	-67.1	171.3	-55.5	0	0	111.6	S241 R242 M243 V247 R248 A249	S241-Q245 PolarHBondContact O-N 3.17Å; S241-Q245 VanDerWaalsContact O-N 3.13Å; R242-Q245 WeakPolarHBondContact O-CB 3.45Å; R242-Q245 PolarHBondContact O-N 3.2Å; R242-Q245 VanDerWaalsContact O-N 3.08Å; M243-Q245 VanDerWaalsContact C-N 3.34Å; Q245-V247 PolarHBondContact O-N 3.4Å; Q245-R248 PolarHBondContact O-N 3Å; Q245-A249 WeakPolarHBondContact O-CB 3.02Å; Q245-A249 PolarHBondContact O-N 3.32Å
246	T	62	Low	60.2	Low	86 Å²	86	90.9 Å²	90.9	53%	0.528	52%	0.517	S	S	.	.	H	α-helix	trans	-58.3	-47.3	177.2	-50.3	0	0	0	0	112.1	R242 M243 R248 A249 V250	R242-T246 PolarHBondContact O-N 3.02Å; R242-T246 PolarHBondContact O-OG1 3.37Å; R242-T246 VanDerWaalsContact O-OG1 3.05Å; M243-T246 PolarHBondContact O-N 3.01Å; T246-R248 VanDerWaalsContact C-N 3.33Å; T246-R248 PolarHBondContact O-N 3.4Å; T246-A249 PolarHBondContact O-N 2.89Å; T246-V250 WeakPolarHBondContact O-CG2 3.24Å; T246-V250 PolarHBondContact O-N 3.18Å
247	V	60.9	Low	60.7	Low	102 Å²	102	91.2 Å²	91.2	62%	0.618	51%	0.513	S	S	*	.	H	α-helix	trans	-61	-42.2	178.3	174.4	0	0	0	0	111.4	M243 Q245 V250 A251	M243-V247 PolarHBondContact O-N 3.1Å; M243-V247 VanDerWaalsContact O-N 3.16Å; Q245-V247 PolarHBondContact O-N 3.4Å; V247-V250 PolarHBondContact O-N 2.7Å; V247-A251 PolarHBondContact O-N 3.03Å; V247-A251 VanDerWaalsContact O-N 3.09Å
248	R	64.3	Low	61.2	Low	180 Å²	180	93.7 Å²	93.7	68%	0.679	52%	0.515	S	S	*	.	H	α-helix	trans	-63.6	-44.7	176	-170.4	-177.8	-63.2	-179.4	0.5	111.7	G244 Q245 T246 V250 A251 S252	G244-R248 PolarHBondContact O-N 3.19Å; Q245-R248 PolarHBondContact O-N 3Å; T246-R248 VanDerWaalsContact C-N 3.33Å; T246-R248 PolarHBondContact O-N 3.4Å; R248-V250 PolarHBondContact O-N 3.43Å; R248-A251 PolarHBondContact O-N 2.79Å; R248-S252 PolarHBondContact O-N 2.99Å; R248-S252 PolarHBondContact O-OG 3.27Å
249	A	61.3	Low	61.9	Low	30 Å²	30	97.1 Å²	97.1	25%	0.248	52%	0.522	C	S	.	.	H	α-helix	trans	-63	-39.9	179.4	0	0	0	0	0	112.5	Q245 T246 S253	Q245-A249 WeakPolarHBondContact O-CB 3.02Å; Q245-A249 PolarHBondContact O-N 3.32Å; T246-A249 PolarHBondContact O-N 2.89Å; A249-S253 WeakPolarHBondContact O-CB 3.45Å; A249-S253 PolarHBondContact O-N 3.22Å; A249-S253 PolarHBondContact O-OG 2.89Å
250	V	63.2	Low	63.2	Low	87 Å²	87	93.9 Å²	93.9	53%	0.527	50%	0.501	S	S	.	.	H	α-helix	trans	-64.2	-47.4	174.4	173	0	0	0	0	110.8	T246 V247 R248 S252 S253 M254	T246-V250 WeakPolarHBondContact O-CG2 3.24Å; T246-V250 PolarHBondContact O-N 3.18Å; V247-V250 PolarHBondContact O-N 2.7Å; R248-V250 PolarHBondContact O-N 3.43Å; V250-S252 VanDerWaalsContact C-N 3.34Å; V250-S252 PolarHBondContact O-N 2.87Å; V250-S253 WeakPolarHBondContact O-CB 3.17Å; V250-S253 PolarHBondContact O-N 3.14Å; V250-S253 VanDerWaalsContact O-N 3.13Å; V250-M254 PolarHBondContact O-N 2.62Å
251	A	62.9	Low	64.7	Low	58 Å²	58	89 Å²	89	48%	0.479	48%	0.478	S	S	.	.	H	α-helix	trans	-61.4	-38.5	179	0	0	0	0	0	113.2	V247 R248	V247-A251 PolarHBondContact O-N 3.03Å; V247-A251 VanDerWaalsContact O-N 3.09Å; R248-A251 PolarHBondContact O-N 2.79Å
252	S	58.2	Low	66.2	Low	42 Å²	42	91.7 Å²	91.7	29%	0.294	49%	0.487	S	S	.	.	H	α-helix	trans	-69.6	-37.4	173.2	-62.5	0	0	0	0	112.5	R248 V250 M254 R255	R248-S252 PolarHBondContact O-N 2.99Å; R248-S252 PolarHBondContact O-OG 3.27Å; V250-S252 VanDerWaalsContact C-N 3.34Å; V250-S252 PolarHBondContact O-N 2.87Å; S252-M254 PolarHBondContact O-N 3.19Å; S252-R255 PolarHBondContact O-N 3.01Å; S252-R255 VanDerWaalsContact O-N 3.14Å
253	S	60.2	Low	67.9	Low	46 Å²	46	90.4 Å²	90.4	32%	0.322	49%	0.486	S	S	.	.	H	α-helix	trans	-61.4	-26	-179.5	-59.1	0	0	0	0	113.2	A249 V250 R255 K364 Q368	A249-S253 WeakPolarHBondContact O-CB 3.45Å; A249-S253 PolarHBondContact O-N 3.22Å; A249-S253 PolarHBondContact O-OG 2.89Å; V250-S253 WeakPolarHBondContact O-CB 3.17Å; V250-S253 PolarHBondContact O-N 3.14Å; V250-S253 VanDerWaalsContact O-N 3.13Å; S253-R255 VanDerWaalsContact C-N 3.3Å; S253-R255 PolarHBondContact O-N 3.41Å; S253-K364 VanDerWaalsContact OG-CE 3.29Å; S253-K364 WeakPolarHBondContact OG-CE 3.48Å; S253-Q368 PolarHBondContact OG-NE2 3.28Å
254	M	56.1	Low	69.7	Low	164 Å²	164	85.1 Å²	85.1	81%	0.808	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.2	-9.9	178.9	-63.6	-174.9	78.7	0	0	114.5	V250 S252	V250-M254 PolarHBondContact O-N 2.62Å; S252-M254 PolarHBondContact O-N 3.19Å
255	R	63.3	Low	71.3	Confident	178 Å²	178	87.9 Å²	87.9	67%	0.672	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	-19.1	-179.2	-68.3	-171.2	-179.5	-171.3	0.6	114.3	S252 S253	S252-R255 PolarHBondContact O-N 3.01Å; S252-R255 VanDerWaalsContact O-N 3.14Å; S253-R255 VanDerWaalsContact C-N 3.3Å; S253-R255 PolarHBondContact O-N 3.41Å
256	G	62.5	Low	72.8	Confident	43 Å²	43	89.1 Å²	89.1	44%	0.443	47%	0.468	S	S	.	.			trans	65.8	162.9	-171.6	0	0	0	0	0	113.2
257	V	71.9	Confident	74.5	Confident	34 Å²	34	85.7 Å²	85.7	21%	0.206	45%	0.446	C	S	.	.			trans	-85.8	121.5	167.7	175	0	0	0	0	108.2	R260 D367 Q370	V257-R260 HydrophobicContact CG1-CB 3.88Å; V257-D367 HydrophobicContact CG2-CB 3.45Å; V257-D367 VanDerWaalsContact CG2-CB 3.45Å; V257-Q370 HydrophobicContact CG1-CG 4.08Å
258	K	70.7	Confident	76.1	Confident	137 Å²	137	82.1 Å²	82.1	60%	0.596	42%	0.424	S	S	*	.	S	Bend	trans	-73.2	-39.6	179.3	-65.2	178.9	-175.7	173.3	0	112.1	E378	K258-E378 IonicContact NZ-OE1 3.41Å; K258-E378 PolarHBondContact NZ-OE1 2.89Å; K258-E378 IonicContact NZ-OE2 3.89Å
259	N	73.1	Confident	77.6	Confident	120 Å²	120	76.7 Å²	76.7	64%	0.642	41%	0.414	S	S	*	.	S	Bend	trans	-126.1	71.8	-173.2	-60.8	-29.3	0	0	0	110.2
260	R	83.9	Confident	79.3	Confident	66 Å²	66	79.1 Å²	79.1	25%	0.249	42%	0.419	C	S	.	.			trans	-79.9	125.3	173.2	-171.4	-170.4	-78.5	165.4	-16.4	108	V257 F264 N268 D367	V257-R260 HydrophobicContact CG1-CB 3.88Å; R260-F264 HydrophobicContact CG-CB 3.7Å; R260-N268 VanDerWaalsContact NH1-CB 3.27Å; R260-N268 PolarHBondContact NH1-ND2 2.86Å; R260-N268 PolarHBondContact NH1-OD1 3.32Å; R260-N268 PolarHBondContact NH2-OD1 2.9Å; R260-D367 IonicContact CZ-OD2 2.65Å; R260-D367 VanDerWaalsContact CZ-OD2 3.28Å; R260-D367 IonicContact NE-OD1 3.77Å; R260-D367 IonicContact NE-OD2 2.76Å; R260-D367 PolarHBondContact NE-OD2 3.31Å; R260-D367 IonicContact NH2-OD2 2.7Å; R260-D367 PolarHBondContact NH2-OD2 3.11Å
261	P	88.9	Confident	81	Confident	47 Å²	47	75.1 Å²	75.1	31%	0.305	39%	0.394	S	S	.	.			trans	-63.5	148.9	177.4	-17	28.8	0	0	0	111.5	E263 F264 M265	P261-E263 VanDerWaalsContact C-N 3.32Å; P261-E263 HydrophobicContact CB-CG 4.38Å; P261-E263 PolarHBondContact O-N 3.34Å; P261-F264 HydrophobicContact CB-CD2 4.05Å; P261-F264 HydrophobicContact CG-CD2 3.96Å; P261-F264 WeakPolarHBondContact O-CA 3.41Å; P261-F264 WeakPolarHBondContact O-CB 3.29Å; P261-F264 PolarHBondContact O-N 3.36Å; P261-M265 PolarHBondContact O-N 2.71Å; P261-M265 VanDerWaalsContact O-N 3.12Å
262	D	91.3	Very high	82.6	Confident	120 Å²	120	77.2 Å²	77.2	64%	0.642	39%	0.394	S	S	*	.	H	α-helix	trans	-54.2	-43.5	-170	-58.3	-27.1	0	0	0	113.1	F264 M265 E266	D262-F264 VanDerWaalsContact C-N 3.26Å; D262-F264 PolarHBondContact O-N 3.13Å; D262-M265 CarbonylContact O-C 3.6Å; D262-M265 WeakPolarHBondContact O-CA 3.21Å; D262-M265 VanDerWaalsContact O-CB 3.25Å; D262-M265 WeakPolarHBondContact O-CB 3.25Å; D262-M265 PolarHBondContact O-N 3.4Å; D262-E266 PolarHBondContact O-N 2.84Å
263	E	92.3	Very high	84.5	Confident	87 Å²	87	78.4 Å²	78.4	41%	0.407	40%	0.4	S	S	.	.	H	α-helix	trans	-55.8	-35.4	175.3	65.5	-171.4	170.6	0	0	113.8	P261 M267 K409	P261-E263 VanDerWaalsContact C-N 3.32Å; P261-E263 HydrophobicContact CB-CG 4.38Å; P261-E263 PolarHBondContact O-N 3.34Å; E263-M267 WeakPolarHBondContact O-CB 3.36Å; E263-M267 PolarHBondContact O-N 3.36Å; E263-M267 VanDerWaalsContact O-N 3.1Å; E263-K409 WeakPolarHBondContact OE1-CE 3.3Å; E263-K409 IonicContact OE1-NZ 2.79Å; E263-K409 PolarHBondContact OE1-NZ 2.9Å; E263-K409 WeakPolarHBondContact OE2-CE 3.29Å; E263-K409 IonicContact OE2-NZ 3.65Å; E263-K409 PolarHBondContact OE2-NZ 3.35Å
264	F	94.2	Very high	86.3	Confident	0 Å²	0	77.3 Å²	77.3	0%	0	39%	0.389	C	S	.	.	H	α-helix	trans	-81.5	-24	176.1	-68.9	-79.1	0	0	0	111.3	R260 P261 D262 M267 N268 M363 R366 N405 L408 K409	R260-F264 HydrophobicContact CG-CB 3.7Å; P261-F264 HydrophobicContact CB-CD2 4.05Å; P261-F264 HydrophobicContact CG-CD2 3.96Å; P261-F264 WeakPolarHBondContact O-CA 3.41Å; P261-F264 WeakPolarHBondContact O-CB 3.29Å; P261-F264 PolarHBondContact O-N 3.36Å; D262-F264 VanDerWaalsContact C-N 3.26Å; D262-F264 PolarHBondContact O-N 3.13Å; F264-M267 HydrophobicContact CD1-CE 3.27Å; F264-M267 HydrophobicContact CE1-CE 3.56Å; F264-M267 HydrophobicContact CG-CE 4.22Å; F264-N268 VanDerWaalsContact O-CB 3.29Å; F264-N268 WeakPolarHBondContact O-CB 3.38Å; F264-N268 PolarHBondContact O-N 2.81Å; F264-M363 HydrophobicContact CB-CE 4.18Å; F264-M363 HydrophobicContact CD1-CE 4.26Å; F264-M363 WeakPolarHBondContact O-CE 3.42Å; F264-R366 HydrophobicContact CD1-CG 4.43Å; F264-R366 HydrophobicContact CE1-CG 4.26Å; F264-N405 HydrophobicContact CE2-CB 4.16Å; F264-N405 WeakPolarHBondContact CE2-OD1 3.23Å; F264-N405 HydrophobicContact CZ-CB 3.64Å; F264-N405 WeakPolarHBondContact CZ-OD1 3.49Å; F264-L408 HydrophobicContact CD1-CD2 4.34Å; F264-L408 HydrophobicContact CE1-CD2 3.94Å; F264-L408 HydrophobicContact CE1-CG 4.37Å; F264-K409 HydrophobicContact CZ-CG 4.47Å
265	M	93.2	Very high	88.3	Confident	102 Å²	102	70.4 Å²	70.4	50%	0.502	36%	0.357	S	S	.	.	H	α-helix	trans	-71.3	-45	171.9	-164.5	-174.8	-52.8	0	0	110.9	P261 D262 N268 S269	P261-M265 PolarHBondContact O-N 2.71Å; P261-M265 VanDerWaalsContact O-N 3.12Å; D262-M265 CarbonylContact O-C 3.6Å; D262-M265 WeakPolarHBondContact O-CA 3.21Å; D262-M265 VanDerWaalsContact O-CB 3.25Å; D262-M265 WeakPolarHBondContact O-CB 3.25Å; D262-M265 PolarHBondContact O-N 3.4Å; M265-N268 PolarHBondContact O-N 2.85Å; M265-S269 WeakPolarHBondContact O-CB 3.44Å; M265-S269 PolarHBondContact O-N 3.25Å
266	E	95.3	Very high	89.9	Confident	143 Å²	143	68.2 Å²	68.2	67%	0.668	36%	0.355	S	S	*	.	H	α-helix	trans	-59.5	-48.6	172.9	-70.3	178.8	-177.9	0	0	111.4	D262 N268 S269 F270	D262-E266 PolarHBondContact O-N 2.84Å; E266-N268 VanDerWaalsContact C-N 3.34Å; E266-N268 PolarHBondContact O-N 3.02Å; E266-S269 PolarHBondContact O-N 2.74Å; E266-F270 PolarHBondContact O-N 2.98Å
267	M	96.6	Very high	91.6	Very high	13 Å²	13	71.2 Å²	71.2	6%	0.064	36%	0.355	C	S	.	.	H	α-helix	trans	-60.5	-40.1	175.9	175.5	163.7	42.6	0	0	112.4	E263 F264 F270 I271 M363 L408 W412	E263-M267 WeakPolarHBondContact O-CB 3.36Å; E263-M267 PolarHBondContact O-N 3.36Å; E263-M267 VanDerWaalsContact O-N 3.1Å; F264-M267 HydrophobicContact CD1-CE 3.27Å; F264-M267 HydrophobicContact CE1-CE 3.56Å; F264-M267 HydrophobicContact CG-CE 4.22Å; M267-F270 PolarHBondContact O-N 3.35Å; M267-I271 HydrophobicContact CG-CD1 3.85Å; M267-I271 WeakPolarHBondContact O-CD1 3.46Å; M267-I271 VanDerWaalsContact O-CG1 3.22Å; M267-I271 WeakPolarHBondContact O-CG1 3.44Å; M267-I271 PolarHBondContact O-N 3.45Å; M267-M363 HydrophobicContact CE-CE 4.38Å; M267-M363 HydrophobicContact CE-SD 3.75Å; M267-M363 HydrophobicContact CG-SD 3.94Å; M267-M363 HydrophobicContact SD-SD 4.01Å; M267-L408 HydrophobicContact CE-CD2 3.96Å; M267-L408 HydrophobicContact CE-CG 3.99Å; M267-L408 HydrophobicContact SD-CD1 4.31Å; M267-L408 HydrophobicContact SD-CD2 4.49Å; M267-L408 HydrophobicContact SD-CG 4.23Å; M267-W412 HydrophobicContact CB-CZ2 4.36Å; M267-W412 HydrophobicContact CG-CD2 3.98Å; M267-W412 HydrophobicContact CG-CE3 4.05Å; M267-W412 HydrophobicContact CG-CH2 3.8Å; M267-W412 HydrophobicContact CG-CZ2 3.71Å; M267-W412 HydrophobicContact CG-CZ3 3.95Å; M267-W412 HydrophobicContact SD-CB 4.25Å; M267-W412 HydrophobicContact SD-CD2 3.4Å; M267-W412 HydrophobicContact SD-CE3 3.58Å; M267-W412 VanDerWaalsContact SD-CE3 3.58Å; M267-W412 HydrophobicContact SD-CG 3.7Å; M267-W412 HydrophobicContact SD-CH2 4.42Å; M267-W412 HydrophobicContact SD-CZ2 4.28Å; M267-W412 HydrophobicContact SD-CZ3 4.08Å
268	N	94.8	Very high	92.8	Very high	28 Å²	28	69.8 Å²	69.8	15%	0.15	35%	0.347	C	S	.	.	H	α-helix	trans	-64	-44.7	175.2	-172.9	100.6	0	0	0	112.1	R260 F264 M265 E266 F270 I271 E272 M363	R260-N268 VanDerWaalsContact NH1-CB 3.27Å; R260-N268 PolarHBondContact NH1-ND2 2.86Å; R260-N268 PolarHBondContact NH1-OD1 3.32Å; R260-N268 PolarHBondContact NH2-OD1 2.9Å; F264-N268 VanDerWaalsContact O-CB 3.29Å; F264-N268 WeakPolarHBondContact O-CB 3.38Å; F264-N268 PolarHBondContact O-N 2.81Å; M265-N268 PolarHBondContact O-N 2.85Å; E266-N268 VanDerWaalsContact C-N 3.34Å; E266-N268 PolarHBondContact O-N 3.02Å; N268-F270 VanDerWaalsContact C-N 3.32Å; N268-F270 PolarHBondContact O-N 3.41Å; N268-I271 PolarHBondContact O-N 3.23Å; N268-I271 VanDerWaalsContact O-N 3.13Å; N268-E272 VanDerWaalsContact ND2-CD 3.28Å; N268-E272 PolarHBondContact ND2-OE1 3.13Å; N268-E272 WeakPolarHBondContact O-CG 3.39Å; N268-E272 PolarHBondContact O-N 3.22Å; N268-M363 HydrophobicContact CB-CE 4.11Å
269	S	96	Very high	94.1	Very high	66 Å²	66	66.1 Å²	66.1	46%	0.462	33%	0.334	S	S	.	.	H	α-helix	trans	-60.9	-40.6	176.2	179.7	0	0	0	0	112	M265 E266 T273	M265-S269 WeakPolarHBondContact O-CB 3.44Å; M265-S269 PolarHBondContact O-N 3.25Å; E266-S269 PolarHBondContact O-N 2.74Å; S269-T273 WeakPolarHBondContact O-CB 3.4Å; S269-T273 PolarHBondContact O-N 3.08Å; S269-T273 PolarHBondContact O-OG1 3.21Å
270	F	97.8	Very high	95.3	Very high	81 Å²	81	64 Å²	64	36%	0.355	32%	0.322	S	S	.	.	H	α-helix	trans	-60.4	-47.5	170.9	-179.7	-76.5	0	0	0	111.2	E266 M267 N268 E272 T273 F274 W412 W415 M419	E266-F270 PolarHBondContact O-N 2.98Å; M267-F270 PolarHBondContact O-N 3.35Å; N268-F270 VanDerWaalsContact C-N 3.32Å; N268-F270 PolarHBondContact O-N 3.41Å; F270-E272 PolarHBondContact O-N 3.43Å; F270-T273 PolarHBondContact O-N 3.31Å; F270-F274 HydrophobicContact CD1-CB 4.02Å; F270-F274 HydrophobicContact CE1-CB 3.77Å; F270-F274 HydrophobicContact CE1-CD2 4.32Å; F270-F274 HydrophobicContact CE1-CG 4.04Å; F270-F274 HydrophobicContact CZ-CB 4.47Å; F270-F274 WeakPolarHBondContact O-CB 3.38Å; F270-F274 PolarHBondContact O-N 3.23Å; F270-W412 HydrophobicContact CB-CZ2 4.34Å; F270-W412 AromaticContact CD1-CH2 3.46Å; F270-W412 HydrophobicContact CD1-CH2 3.46Å; F270-W412 VanDerWaalsContact CD1-CH2 3.46Å; F270-W412 AromaticContact CD1-CZ2 3.69Å; F270-W412 HydrophobicContact CD1-CZ2 3.69Å; F270-W412 AromaticContact CE1-CH2 3.9Å; F270-W412 HydrophobicContact CE1-CH2 3.9Å; F270-W412 HydrophobicContact CE1-CZ2 4.16Å; F270-W412 HydrophobicContact CG-CH2 4.22Å; F270-W412 HydrophobicContact CG-CZ2 4.03Å; F270-W415 HydrophobicContact CE1-CH2 4.02Å; F270-W415 AromaticContact CE1-CZ3 3.9Å; F270-W415 HydrophobicContact CE1-CZ3 3.9Å; F270-M419 HydrophobicContact CZ-CE 4.49Å
271	I	97.3	Very high	95.9	Very high	3 Å²	3	63.9 Å²	63.9	2%	0.015	33%	0.325	C	S	.	.	H	α-helix	trans	-62.9	-41.3	-177.5	-70.6	161.4	0	0	0	111.5	M267 N268 S275 L359 M360 M363 W412	M267-I271 HydrophobicContact CG-CD1 3.85Å; M267-I271 WeakPolarHBondContact O-CD1 3.46Å; M267-I271 VanDerWaalsContact O-CG1 3.22Å; M267-I271 WeakPolarHBondContact O-CG1 3.44Å; M267-I271 PolarHBondContact O-N 3.45Å; N268-I271 PolarHBondContact O-N 3.23Å; N268-I271 VanDerWaalsContact O-N 3.13Å; I271-S275 WeakPolarHBondContact O-CB 3.44Å; I271-S275 PolarHBondContact O-N 3.42Å; I271-L359 HydrophobicContact CD1-CB 3.89Å; I271-L359 HydrophobicContact CG1-CB 3.93Å; I271-L359 HydrophobicContact CG1-CD1 4.31Å; I271-L359 HydrophobicContact CG2-CB 3.98Å; I271-M360 HydrophobicContact CG2-CG 3.61Å; I271-M363 HydrophobicContact CD1-CG 3.34Å; I271-M363 HydrophobicContact CD1-SD 4.18Å; I271-W412 HydrophobicContact CD1-CH2 4.07Å; I271-W412 HydrophobicContact CD1-CZ3 3.89Å; I271-W412 HydrophobicContact CG1-CH2 3.68Å; I271-W412 HydrophobicContact CG1-CZ3 3.85Å
272	E	96.8	Very high	96.2	Very high	101 Å²	101	62.7 Å²	62.7	47%	0.472	32%	0.317	S	S	.	.	H	α-helix	trans	-62	-49.2	175.5	-72.8	168.7	-176.2	0	0	111.2	N268 F270 S275 Q276	N268-E272 VanDerWaalsContact ND2-CD 3.28Å; N268-E272 PolarHBondContact ND2-OE1 3.13Å; N268-E272 WeakPolarHBondContact O-CG 3.39Å; N268-E272 PolarHBondContact O-N 3.22Å; F270-E272 PolarHBondContact O-N 3.43Å; E272-S275 PolarHBondContact O-N 2.97Å; E272-Q276 WeakPolarHBondContact O-CG 3.35Å; E272-Q276 PolarHBondContact O-N 3.24Å; E272-Q276 VanDerWaalsContact O-N 3.13Å
273	T	98.1	Very high	96.4	Very high	68 Å²	68	64 Å²	64	42%	0.417	32%	0.316	S	S	.	.	H	α-helix	trans	-63.2	-45.8	177.6	-55.7	0	0	0	0	111.7	S269 F270 Q276 K277	S269-T273 WeakPolarHBondContact O-CB 3.4Å; S269-T273 PolarHBondContact O-N 3.08Å; S269-T273 PolarHBondContact O-OG1 3.21Å; F270-T273 PolarHBondContact O-N 3.31Å; T273-Q276 PolarHBondContact O-N 2.85Å; T273-K277 HydrophobicContact CG2-CG 4.4Å; T273-K277 WeakPolarHBondContact O-CG 3.42Å; T273-K277 PolarHBondContact O-N 3.46Å
274	F	98.1	Very high	96.6	Very high	22 Å²	22	63.3 Å²	63.3	10%	0.096	32%	0.315	C	S	.	.	H	α-helix	trans	-60.7	-47	178.5	173.4	-106	0	0	0	111	F270 Q276 K277 I278 Y352 L359 W415 M419	F270-F274 HydrophobicContact CD1-CB 4.02Å; F270-F274 HydrophobicContact CE1-CB 3.77Å; F270-F274 HydrophobicContact CE1-CD2 4.32Å; F270-F274 HydrophobicContact CE1-CG 4.04Å; F270-F274 HydrophobicContact CZ-CB 4.47Å; F270-F274 WeakPolarHBondContact O-CB 3.38Å; F270-F274 PolarHBondContact O-N 3.23Å; F274-Q276 PolarHBondContact O-N 2.84Å; F274-K277 PolarHBondContact O-N 3.2Å; F274-I278 HydrophobicContact CE1-CG2 4.24Å; F274-I278 HydrophobicContact CE2-CB 4.27Å; F274-I278 HydrophobicContact CZ-CB 4.27Å; F274-I278 HydrophobicContact CZ-CG1 4.38Å; F274-I278 HydrophobicContact CZ-CG2 4.32Å; F274-I278 WeakPolarHBondContact O-CB 3.4Å; F274-I278 VanDerWaalsContact O-CG2 3.29Å; F274-I278 WeakPolarHBondContact O-CG2 3.49Å; F274-I278 PolarHBondContact O-N 3.31Å; F274-Y352 HydrophobicContact CZ-CD1 4.21Å; F274-L359 HydrophobicContact CD1-CD1 4.3Å; F274-L359 HydrophobicContact CE1-CD1 4.3Å; F274-W415 HydrophobicContact CD1-CH2 4.18Å; F274-W415 AromaticContact CE1-CH2 3.92Å; F274-W415 HydrophobicContact CE1-CH2 3.92Å; F274-W415 AromaticContact CE1-CZ2 3.82Å; F274-W415 HydrophobicContact CE1-CZ2 3.82Å; F274-W415 HydrophobicContact CE2-CH2 4.33Å; F274-W415 HydrophobicContact CG-CH2 4.49Å; F274-W415 AromaticContact CZ-CH2 3.99Å; F274-W415 HydrophobicContact CZ-CH2 3.99Å; F274-W415 AromaticContact CZ-CZ2 3.82Å; F274-W415 HydrophobicContact CZ-CZ2 3.82Å; F274-M419 HydrophobicContact CD2-SD 4.03Å; F274-M419 HydrophobicContact CE2-CG 4.4Å; F274-M419 HydrophobicContact CE2-SD 3.35Å; F274-M419 WeakPolarHBondContact CE2-SD 3.33Å; F274-M419 HydrophobicContact CZ-SD 3.8Å
275	S	97.9	Very high	96.6	Very high	20 Å²	20	63.9 Å²	63.9	14%	0.14	32%	0.319	C	S	.	.	H	α-helix	trans	-57.1	-47.4	177.2	-171.4	0	0	0	0	111.6	I271 E272 N279 S356	I271-S275 WeakPolarHBondContact O-CB 3.44Å; I271-S275 PolarHBondContact O-N 3.42Å; E272-S275 PolarHBondContact O-N 2.97Å; S275-N279 WeakPolarHBondContact O-CB 3.4Å; S275-N279 PolarHBondContact O-N 3.06Å; S275-N279 PolarHBondContact O-ND2 3.34Å; S275-S356 PolarHBondContact OG-OG 3.13Å
276	Q	97.8	Very high	96.5	Very high	132 Å²	132	63 Å²	63	62%	0.617	31%	0.313	S	S	*	.	H	α-helix	trans	-60.1	-48.5	175.8	-68.9	169.8	2.2	0	0	112	E272 T273 F274 L280	E272-Q276 WeakPolarHBondContact O-CG 3.35Å; E272-Q276 PolarHBondContact O-N 3.24Å; E272-Q276 VanDerWaalsContact O-N 3.13Å; T273-Q276 PolarHBondContact O-N 2.85Å; F274-Q276 PolarHBondContact O-N 2.84Å; Q276-L280 PolarHBondContact O-N 2.85Å; Q276-L280 VanDerWaalsContact O-N 3.11Å
277	K	98.1	Very high	96.5	Very high	105 Å²	105	63.1 Å²	63.1	46%	0.457	31%	0.308	S	S	.	.	H	α-helix	trans	-71	-40	-175.4	-64.1	-61.7	174.4	-174.4	0	113	T273 F274 L280 I281	T273-K277 HydrophobicContact CG2-CG 4.4Å; T273-K277 WeakPolarHBondContact O-CG 3.42Å; T273-K277 PolarHBondContact O-N 3.46Å; F274-K277 PolarHBondContact O-N 3.2Å; K277-L280 PolarHBondContact O-N 2.9Å; K277-I281 VanDerWaalsContact O-CG1 3.26Å; K277-I281 WeakPolarHBondContact O-CG1 3.27Å; K277-I281 PolarHBondContact O-N 3.31Å
278	I	97.8	Very high	96.4	Very high	5 Å²	5	66 Å²	66	3%	0.026	32%	0.322	C	S	.	.	H	α-helix	trans	-69.7	-36.9	179.1	-163	64.6	0	0	0	112	F274 L280 I281 D282 V349 V353	F274-I278 HydrophobicContact CE1-CG2 4.24Å; F274-I278 HydrophobicContact CE2-CB 4.27Å; F274-I278 HydrophobicContact CZ-CB 4.27Å; F274-I278 HydrophobicContact CZ-CG1 4.38Å; F274-I278 HydrophobicContact CZ-CG2 4.32Å; F274-I278 WeakPolarHBondContact O-CB 3.4Å; F274-I278 VanDerWaalsContact O-CG2 3.29Å; F274-I278 WeakPolarHBondContact O-CG2 3.49Å; F274-I278 PolarHBondContact O-N 3.31Å; I278-L280 VanDerWaalsContact C-N 3.34Å; I278-L280 PolarHBondContact O-N 2.87Å; I278-I281 PolarHBondContact O-N 3.32Å; I278-D282 PolarHBondContact O-N 3.48Å; I278-V349 HydrophobicContact CD1-CG1 4.21Å; I278-V353 HydrophobicContact CG1-CG2 4.07Å; I278-V353 HydrophobicContact CG2-CG2 4.2Å
279	N	96.7	Very high	96.3	Very high	60 Å²	60	66.2 Å²	66.2	32%	0.321	32%	0.321	S	S	.	.	H	α-helix	trans	-64.5	-37.9	172.7	-83.9	-88.8	0	0	0	112.1	S275 D282 K283	S275-N279 WeakPolarHBondContact O-CB 3.4Å; S275-N279 PolarHBondContact O-N 3.06Å; S275-N279 PolarHBondContact O-ND2 3.34Å; N279-D282 PolarHBondContact O-N 2.85Å; N279-K283 WeakPolarHBondContact O-CG 3.26Å; N279-K283 PolarHBondContact O-N 3.37Å
280	L	97.8	Very high	96.1	Very high	74 Å²	74	69.2 Å²	69.2	39%	0.387	33%	0.326	S	S	.	.	H	α-helix	trans	-65.7	-43.1	174.1	-178.9	60.9	0	0	0	111.6	Q276 K277 I278 D282 K283 I284	Q276-L280 PolarHBondContact O-N 2.85Å; Q276-L280 VanDerWaalsContact O-N 3.11Å; K277-L280 PolarHBondContact O-N 2.9Å; I278-L280 VanDerWaalsContact C-N 3.34Å; I278-L280 PolarHBondContact O-N 2.87Å; L280-D282 VanDerWaalsContact C-N 3.35Å; L280-D282 PolarHBondContact O-N 3.08Å; L280-K283 PolarHBondContact O-N 3.35Å; L280-I284 HydrophobicContact CD1-CD1 3.88Å; L280-I284 HydrophobicContact CD1-CG1 4.26Å; L280-I284 HydrophobicContact CG-CD1 3.82Å; L280-I284 WeakPolarHBondContact O-CB 3.4Å; L280-I284 VanDerWaalsContact O-CG1 3.28Å; L280-I284 WeakPolarHBondContact O-CG1 3.43Å; L280-I284 PolarHBondContact O-N 3.14Å
281	I	97.4	Very high	95.9	Very high	64 Å²	64	70.6 Å²	70.6	33%	0.328	33%	0.334	S	S	.	.	H	α-helix	trans	-63.1	-40.1	176.5	-67.2	164.5	0	0	0	111.1	K277 I278 I284 S285 V349 F427	K277-I281 VanDerWaalsContact O-CG1 3.26Å; K277-I281 WeakPolarHBondContact O-CG1 3.27Å; K277-I281 PolarHBondContact O-N 3.31Å; I278-I281 PolarHBondContact O-N 3.32Å; I281-I284 PolarHBondContact O-N 2.95Å; I281-S285 VanDerWaalsContact O-CB 3.27Å; I281-S285 WeakPolarHBondContact O-CB 3.38Å; I281-S285 PolarHBondContact O-N 3.47Å; I281-S285 PolarHBondContact O-OG 3.37Å; I281-V349 HydrophobicContact CB-CG1 4.44Å; I281-V349 HydrophobicContact CG2-CG1 3.86Å; I281-V349 HydrophobicContact CG2-CG2 4.15Å; I281-F427 HydrophobicContact CG2-CZ 4.29Å
282	D	94.8	Very high	95.7	Very high	23 Å²	23	72.7 Å²	72.7	12%	0.123	34%	0.343	C	S	.	.	H	α-helix	trans	-61.2	-53.6	174.8	-168.4	48.5	0	0	0	110.9	I278 N279 L280 I284 S285 Q286 V349 H350 V353	I278-D282 PolarHBondContact O-N 3.48Å; N279-D282 PolarHBondContact O-N 2.85Å; L280-D282 VanDerWaalsContact C-N 3.35Å; L280-D282 PolarHBondContact O-N 3.08Å; D282-I284 VanDerWaalsContact C-N 3.31Å; D282-I284 PolarHBondContact O-N 3.46Å; D282-S285 PolarHBondContact O-N 2.89Å; D282-S285 VanDerWaalsContact O-N 3.12Å; D282-Q286 VanDerWaalsContact O-CG 3.25Å; D282-Q286 WeakPolarHBondContact O-CG 3.36Å; D282-Q286 PolarHBondContact O-N 3.35Å; D282-V349 HydrophobicContact CB-CG1 3.76Å; D282-H350 IonicContact OD2-ND1 3.75Å; D282-V353 HydrophobicContact CB-CG2 3.73Å
283	K	95.4	Very high	95.5	Very high	147 Å²	147	73.1 Å²	73.1	64%	0.639	34%	0.341	S	S	*	.	H	α-helix	trans	-53.1	-45.5	175.9	-73.9	179.1	178.1	-171.3	0	112.9	N279 L280 R287	N279-K283 WeakPolarHBondContact O-CG 3.26Å; N279-K283 PolarHBondContact O-N 3.37Å; L280-K283 PolarHBondContact O-N 3.35Å; K283-R287 WeakPolarHBondContact O-CB 3.38Å; K283-R287 PolarHBondContact O-N 2.97Å
284	I	96.8	Very high	95.2	Very high	73 Å²	73	73.8 Å²	73.8	37%	0.374	34%	0.342	S	S	.	.	H	α-helix	trans	-66.9	-43	179.7	-71.5	170	0	0	0	110.6	L280 I281 D282 R287 I288	L280-I284 HydrophobicContact CD1-CD1 3.88Å; L280-I284 HydrophobicContact CD1-CG1 4.26Å; L280-I284 HydrophobicContact CG-CD1 3.82Å; L280-I284 WeakPolarHBondContact O-CB 3.4Å; L280-I284 VanDerWaalsContact O-CG1 3.28Å; L280-I284 WeakPolarHBondContact O-CG1 3.43Å; L280-I284 PolarHBondContact O-N 3.14Å; I281-I284 PolarHBondContact O-N 2.95Å; D282-I284 VanDerWaalsContact C-N 3.31Å; D282-I284 PolarHBondContact O-N 3.46Å; I284-R287 PolarHBondContact O-N 3.28Å; I284-I288 HydrophobicContact CG2-CD1 3.88Å; I284-I288 HydrophobicContact CG2-CG1 4.46Å; I284-I288 WeakPolarHBondContact O-CG1 3.28Å; I284-I288 PolarHBondContact O-N 3.18Å
285	S	94.7	Very high	95	Very high	11 Å²	11	77.9 Å²	77.9	8%	0.077	36%	0.357	C	S	.	.	H	α-helix	trans	-66.8	-39.6	-179.2	-56	0	0	0	0	111.8	I281 D282 Y289 L346	I281-S285 VanDerWaalsContact O-CB 3.27Å; I281-S285 WeakPolarHBondContact O-CB 3.38Å; I281-S285 PolarHBondContact O-N 3.47Å; I281-S285 PolarHBondContact O-OG 3.37Å; D282-S285 PolarHBondContact O-N 2.89Å; D282-S285 VanDerWaalsContact O-N 3.12Å; S285-Y289 WeakPolarHBondContact O-CB 3.49Å; S285-Y289 PolarHBondContact O-N 3.32Å; S285-L346 VanDerWaalsContact CB-CD2 3.48Å
286	Q	91.4	Very high	94.9	Very high	83 Å²	83	77.5 Å²	77.5	39%	0.388	35%	0.353	S	S	.	.	H	α-helix	trans	-65.3	-39.3	172.7	-63.1	-67.9	-15.4	0	0	111.9	D282 Y289 K290	D282-Q286 VanDerWaalsContact O-CG 3.25Å; D282-Q286 WeakPolarHBondContact O-CG 3.36Å; D282-Q286 PolarHBondContact O-N 3.35Å; Q286-Y289 PolarHBondContact O-N 3.21Å; Q286-K290 PolarHBondContact O-N 3.33Å
287	R	94.6	Very high	94.7	Very high	146 Å²	146	75 Å²	75	55%	0.551	34%	0.344	S	S	*	.	H	α-helix	trans	-61.9	-52.8	174.8	-177	-175.3	-66.4	-165	-1.2	111.1	K283 I284 Y289 K290 E291	K283-R287 WeakPolarHBondContact O-CB 3.38Å; K283-R287 PolarHBondContact O-N 2.97Å; I284-R287 PolarHBondContact O-N 3.28Å; R287-Y289 VanDerWaalsContact C-N 3.29Å; R287-Y289 PolarHBondContact O-N 2.97Å; R287-K290 WeakPolarHBondContact O-CB 3.4Å; R287-K290 PolarHBondContact O-N 3.08Å; R287-K290 VanDerWaalsContact O-N 3.09Å; R287-E291 VanDerWaalsContact CD-OE1 3.27Å; R287-E291 WeakPolarHBondContact CD-OE1 3.35Å; R287-E291 HydrophobicContact CG-CG 4.38Å; R287-E291 WeakPolarHBondContact CG-OE1 3.19Å; R287-E291 WeakPolarHBondContact O-CG 3.41Å; R287-E291 PolarHBondContact O-N 3.17Å
288	I	93.8	Very high	94.5	Very high	73 Å²	73	75 Å²	75	37%	0.374	35%	0.345	S	S	.	.	H	α-helix	trans	-55.3	-46.4	176.9	-69.7	168.9	0	0	0	110.6	I284 K290 E291 E292 L341	I284-I288 HydrophobicContact CG2-CD1 3.88Å; I284-I288 HydrophobicContact CG2-CG1 4.46Å; I284-I288 WeakPolarHBondContact O-CG1 3.28Å; I284-I288 PolarHBondContact O-N 3.18Å; I288-K290 VanDerWaalsContact C-N 3.29Å; I288-K290 PolarHBondContact O-N 2.97Å; I288-E291 PolarHBondContact O-N 2.95Å; I288-E292 HydrophobicContact CG2-CG 4.16Å; I288-E292 VanDerWaalsContact O-CB 3.29Å; I288-E292 WeakPolarHBondContact O-CB 3.29Å; I288-E292 VanDerWaalsContact O-CG 3.3Å; I288-E292 WeakPolarHBondContact O-CG 3.41Å; I288-E292 PolarHBondContact O-N 3.04Å; I288-L341 HydrophobicContact CG2-CD2 4.29Å
289	Y	92.9	Very high	94.3	Very high	33 Å²	33	75.8 Å²	75.8	13%	0.129	35%	0.349	C	S	.	.	H	α-helix	trans	-61.4	-37.1	179.3	-175.2	-99.9	0	0	0	113.2	S285 Q286 R287 R293 M338 L341 S342 L346	S285-Y289 WeakPolarHBondContact O-CB 3.49Å; S285-Y289 PolarHBondContact O-N 3.32Å; Q286-Y289 PolarHBondContact O-N 3.21Å; R287-Y289 VanDerWaalsContact C-N 3.29Å; R287-Y289 PolarHBondContact O-N 2.97Å; Y289-R293 WeakPolarHBondContact O-CB 3.37Å; Y289-R293 PolarHBondContact O-N 3.21Å; Y289-R293 VanDerWaalsContact O-N 3.15Å; Y289-R293 PolarHBondContact OH-NH2 3.41Å; Y289-M338 HydrophobicContact CE2-CB 4.31Å; Y289-M338 WeakPolarHBondContact CE2-O 3.31Å; Y289-L341 HydrophobicContact CD2-CB 3.87Å; Y289-L341 HydrophobicContact CD2-CD2 4.42Å; Y289-L341 HydrophobicContact CE2-CB 4.3Å; Y289-S342 WeakPolarHBondContact OH-CB 3.37Å; Y289-S342 PolarHBondContact OH-OG 2.89Å; Y289-L346 HydrophobicContact CD1-CD1 4.13Å; Y289-L346 HydrophobicContact CD2-CD1 4.13Å; Y289-L346 HydrophobicContact CG-CD1 3.81Å
290	K	91.8	Very high	94.2	Very high	130 Å²	130	76.8 Å²	76.8	57%	0.565	35%	0.351	S	S	*	.	H	α-helix	trans	-69.4	-49.9	175.6	-170.1	-158.2	167.7	-146.9	0	111.3	Q286 R287 I288 E292 R293 D294	Q286-K290 PolarHBondContact O-N 3.33Å; R287-K290 WeakPolarHBondContact O-CB 3.4Å; R287-K290 PolarHBondContact O-N 3.08Å; R287-K290 VanDerWaalsContact O-N 3.09Å; I288-K290 VanDerWaalsContact C-N 3.29Å; I288-K290 PolarHBondContact O-N 2.97Å; K290-E292 VanDerWaalsContact C-N 3.33Å; K290-E292 PolarHBondContact O-N 2.87Å; K290-R293 WeakPolarHBondContact O-CA 3.42Å; K290-R293 WeakPolarHBondContact O-CB 3.4Å; K290-R293 PolarHBondContact O-N 2.87Å; K290-D294 VanDerWaalsContact CE-OD2 3.32Å; K290-D294 WeakPolarHBondContact CE-OD2 3.29Å; K290-D294 IonicContact NZ-OD2 2.65Å; K290-D294 VanDerWaalsContact O-CG 3.29Å; K290-D294 PolarHBondContact O-N 2.82Å
291	E	94.5	Very high	94.1	Very high	110 Å²	110	79 Å²	79	51%	0.514	36%	0.359	S	S	.	.	H	α-helix	trans	-60.4	-41.7	180	-71.2	168.4	-175.2	0	0	111.7	R287 I288 R293 D294 Y295	R287-E291 VanDerWaalsContact CD-OE1 3.27Å; R287-E291 WeakPolarHBondContact CD-OE1 3.35Å; R287-E291 HydrophobicContact CG-CG 4.38Å; R287-E291 WeakPolarHBondContact CG-OE1 3.19Å; R287-E291 WeakPolarHBondContact O-CG 3.41Å; R287-E291 PolarHBondContact O-N 3.17Å; I288-E291 PolarHBondContact O-N 2.95Å; E291-R293 VanDerWaalsContact C-N 3.32Å; E291-R293 PolarHBondContact O-N 3.28Å; E291-D294 PolarHBondContact O-N 3.42Å; E291-Y295 WeakPolarHBondContact O-CB 3.11Å; E291-Y295 PolarHBondContact O-N 3.47Å
292	E	92	Very high	94	Very high	46 Å²	46	80.6 Å²	80.6	22%	0.215	36%	0.362	C	S	.	.	H	α-helix	trans	-65.2	-32.2	173.9	-74.8	-79.8	-168.3	0	0	112.7	I288 K290 F296 R337	I288-E292 HydrophobicContact CG2-CG 4.16Å; I288-E292 VanDerWaalsContact O-CB 3.29Å; I288-E292 WeakPolarHBondContact O-CB 3.29Å; I288-E292 VanDerWaalsContact O-CG 3.3Å; I288-E292 WeakPolarHBondContact O-CG 3.41Å; I288-E292 PolarHBondContact O-N 3.04Å; K290-E292 VanDerWaalsContact C-N 3.33Å; K290-E292 PolarHBondContact O-N 2.87Å; E292-F296 VanDerWaalsContact O-CB 3.23Å; E292-F296 WeakPolarHBondContact O-CB 3.29Å; E292-F296 PolarHBondContact O-N 2.92Å; E292-R337 IonicContact OE1-CZ 3.28Å; E292-R337 IonicContact OE1-NH1 3.06Å; E292-R337 PolarHBondContact OE1-NH1 3.47Å; E292-R337 IonicContact OE1-NH2 2.69Å; E292-R337 PolarHBondContact OE1-NH2 3.19Å; E292-R337 IonicContact OE2-CZ 2.69Å; E292-R337 IonicContact OE2-NH1 3.41Å; E292-R337 IonicContact OE2-NH2 3.49Å; E292-R337 PolarHBondContact OE2-NH2 2.9Å
293	R	92.4	Very high	94.1	Very high	111 Å²	111	79.6 Å²	79.6	42%	0.419	36%	0.357	S	S	.	.	H	α-helix	trans	-70.7	-48	173.2	-179.1	174.8	-71.3	-168.8	-7.3	111.9	Y289 K290 E291 Y295 F296 D297 M338	Y289-R293 WeakPolarHBondContact O-CB 3.37Å; Y289-R293 PolarHBondContact O-N 3.21Å; Y289-R293 VanDerWaalsContact O-N 3.15Å; Y289-R293 PolarHBondContact OH-NH2 3.41Å; K290-R293 WeakPolarHBondContact O-CA 3.42Å; K290-R293 WeakPolarHBondContact O-CB 3.4Å; K290-R293 PolarHBondContact O-N 2.87Å; E291-R293 VanDerWaalsContact C-N 3.32Å; E291-R293 PolarHBondContact O-N 3.28Å; R293-Y295 VanDerWaalsContact C-N 3.25Å; R293-Y295 PolarHBondContact O-N 3.08Å; R293-F296 WeakPolarHBondContact O-CB 3.25Å; R293-F296 PolarHBondContact O-N 3.09Å; R293-F296 VanDerWaalsContact O-N 3.14Å; R293-D297 PolarHBondContact O-N 2.99Å; R293-M338 VanDerWaalsContact CA-CE 3.43Å; R293-M338 HydrophobicContact CB-CE 3.47Å; R293-M338 VanDerWaalsContact CB-CE 3.47Å; R293-M338 HydrophobicContact CG-CE 3.88Å
294	D	93.6	Very high	94.2	Very high	81 Å²	81	76.1 Å²	76.1	43%	0.433	35%	0.349	S	S	.	.	H	α-helix	trans	-60.4	-40.1	179.3	-63.5	-16.9	0	0	0	109.5	K290 E291 E298	K290-D294 VanDerWaalsContact CE-OD2 3.32Å; K290-D294 WeakPolarHBondContact CE-OD2 3.29Å; K290-D294 IonicContact NZ-OD2 2.65Å; K290-D294 VanDerWaalsContact O-CG 3.29Å; K290-D294 PolarHBondContact O-N 2.82Å; E291-D294 PolarHBondContact O-N 3.42Å; D294-E298 PolarHBondContact O-N 3.43Å
295	Y	92.9	Very high	94.2	Very high	108 Å²	108	76.8 Å²	76.8	42%	0.424	35%	0.353	S	S	.	.	H	α-helix	trans	-65.3	-42.6	171.9	175.9	-109.2	0	0	0	113.8	E291 R293 E298 M299	E291-Y295 WeakPolarHBondContact O-CB 3.11Å; E291-Y295 PolarHBondContact O-N 3.47Å; R293-Y295 VanDerWaalsContact C-N 3.25Å; R293-Y295 PolarHBondContact O-N 3.08Å; Y295-E298 PolarHBondContact O-N 2.93Å; Y295-M299 HydrophobicContact CE1-SD 4.27Å; Y295-M299 WeakPolarHBondContact O-CB 3.32Å; Y295-M299 PolarHBondContact O-N 3.27Å
296	F	94.9	Very high	94.4	Very high	12 Å²	12	77.8 Å²	77.8	5%	0.053	36%	0.356	C	S	.	.	H	α-helix	trans	-63.1	-39.9	177.9	167.8	-117.8	0	0	0	112.9	E292 R293 M299 K300 C331 T334 E335 M338	E292-F296 VanDerWaalsContact O-CB 3.23Å; E292-F296 WeakPolarHBondContact O-CB 3.29Å; E292-F296 PolarHBondContact O-N 2.92Å; R293-F296 WeakPolarHBondContact O-CB 3.25Å; R293-F296 PolarHBondContact O-N 3.09Å; R293-F296 VanDerWaalsContact O-N 3.14Å; F296-M299 PolarHBondContact O-N 3.45Å; F296-K300 HydrophobicContact CE1-CD 4.16Å; F296-K300 HydrophobicContact CE2-CD 4.17Å; F296-K300 HydrophobicContact CE2-CG 4.28Å; F296-K300 HydrophobicContact CZ-CD 3.97Å; F296-K300 PolarHBondContact O-N 2.9Å; F296-K300 VanDerWaalsContact O-N 3.13Å; F296-C331 HydrophobicContact CE2-CB 4.12Å; F296-C331 VanDerWaalsContact CE2-O 3.3Å; F296-C331 WeakPolarHBondContact CE2-O 3.45Å; F296-T334 HydrophobicContact CB-CG2 3.86Å; F296-T334 HydrophobicContact CD2-CG2 3.74Å; F296-T334 HydrophobicContact CG-CG2 4.08Å; F296-E335 HydrophobicContact CE1-CG 4.44Å; F296-E335 HydrophobicContact CE2-CB 3.92Å; F296-E335 HydrophobicContact CZ-CB 3.65Å; F296-E335 HydrophobicContact CZ-CG 3.85Å; F296-M338 HydrophobicContact CB-SD 3.7Å; F296-M338 HydrophobicContact CD1-CE 4.29Å; F296-M338 HydrophobicContact CD1-SD 3.83Å; F296-M338 HydrophobicContact CG-SD 3.8Å
297	D	94	Very high	94.7	Very high	81 Å²	81	77.9 Å²	77.9	43%	0.433	36%	0.358	S	S	.	.	H	α-helix	trans	-68	-35.6	177.3	-72.9	-24.4	0	0	0	111.2	R293	R293-D297 PolarHBondContact O-N 2.99Å
298	E	94.3	Very high	94.8	Very high	103 Å²	103	77.1 Å²	77.1	48%	0.481	37%	0.365	S	S	.	.	H	α-helix	trans	-65.1	-45.1	168.1	-168.8	-167.9	139.6	0	0	111.8	D294 Y295 K300 E301 Y302	D294-E298 PolarHBondContact O-N 3.43Å; Y295-E298 PolarHBondContact O-N 2.93Å; E298-K300 PolarHBondContact O-N 3.46Å; E298-E301 PolarHBondContact O-N 3.27Å; E298-Y302 HydrophobicContact CG-CE2 4.16Å; E298-Y302 PolarHBondContact OE1-OH 2.82Å
299	M	93.4	Very high	95	Very high	22 Å²	22	79.6 Å²	79.6	11%	0.108	37%	0.37	C	S	.	.	H	α-helix	trans	-57.8	-36.2	-176.1	-163.2	-175.1	-149	0	0	112.4	Y295 F296 E301 Y302 I327 C330	Y295-M299 HydrophobicContact CE1-SD 4.27Å; Y295-M299 WeakPolarHBondContact O-CB 3.32Å; Y295-M299 PolarHBondContact O-N 3.27Å; F296-M299 PolarHBondContact O-N 3.45Å; M299-E301 VanDerWaalsContact C-N 3.28Å; M299-E301 PolarHBondContact O-N 2.88Å; M299-Y302 PolarHBondContact O-N 3.06Å; M299-I327 HydrophobicContact CG-CG2 4.49Å; M299-I327 WeakPolarHBondContact O-CG2 3.43Å; M299-C330 HydrophobicContact CE-CB 3.79Å; M299-C330 HydrophobicContact SD-CB 4.43Å
300	K	95.3	Very high	95.2	Very high	81 Å²	81	78.4 Å²	78.4	35%	0.352	37%	0.366	S	S	.	.	H	α-helix	trans	-61.5	-29.1	177.9	-85.8	172.9	156.9	166.5	0	114.2	F296 E298 P304 E335	F296-K300 HydrophobicContact CE1-CD 4.16Å; F296-K300 HydrophobicContact CE2-CD 4.17Å; F296-K300 HydrophobicContact CE2-CG 4.28Å; F296-K300 HydrophobicContact CZ-CD 3.97Å; F296-K300 PolarHBondContact O-N 2.9Å; F296-K300 VanDerWaalsContact O-N 3.13Å; E298-K300 PolarHBondContact O-N 3.46Å; K300-P304 WeakPolarHBondContact O-CD 3.23Å; K300-E335 IonicContact NZ-OE1 4Å
301	E	96	Very high	95.4	Very high	121 Å²	121	76.1 Å²	76.1	57%	0.565	37%	0.371	S	S	*	.	H	α-helix	trans	-75.3	-26.3	-179.7	-64.1	-60.4	135.4	0	0	112.2	E298 M299 G303 P304 I305	E298-E301 PolarHBondContact O-N 3.27Å; M299-E301 VanDerWaalsContact C-N 3.28Å; M299-E301 PolarHBondContact O-N 2.88Å; E301-G303 PolarHBondContact O-N 3.01Å; E301-P304 WeakPolarHBondContact O-CD 3.4Å; E301-I305 HydrophobicContact CB-CD1 4.46Å; E301-I305 WeakPolarHBondContact O-CD1 3.49Å; E301-I305 VanDerWaalsContact O-CG1 3.24Å; E301-I305 WeakPolarHBondContact O-CG1 3.37Å; E301-I305 PolarHBondContact O-N 2.69Å
302	Y	95.7	Very high	95.5	Very high	98 Å²	98	75.6 Å²	75.6	38%	0.384	38%	0.38	S	S	.	.	H	α-helix	trans	-65.8	-34.3	-178	-67.5	-59.9	0	0	0	113.6	E298 M299 I305 H306	E298-Y302 HydrophobicContact CG-CE2 4.16Å; E298-Y302 PolarHBondContact OE1-OH 2.82Å; M299-Y302 PolarHBondContact O-N 3.06Å; Y302-I305 HydrophobicContact CD1-CD1 4.44Å; Y302-I305 PolarHBondContact O-N 2.68Å; Y302-H306 PolarHBondContact O-N 2.85Å; Y302-H306 PolarHBondContact O-ND1 2.7Å
303	G	96	Very high	95.6	Very high	2 Å²	2	76.8 Å²	76.8	2%	0.021	39%	0.385	C	S	.	.	H	α-helix	trans	-57.7	-59.4	176.7	0	0	0	0	0	112.2	E301 I305 H306 I307 A324	E301-G303 PolarHBondContact O-N 3.01Å; G303-I305 VanDerWaalsContact C-N 3.3Å; G303-I305 PolarHBondContact O-N 2.71Å; G303-H306 PolarHBondContact O-N 2.69Å; G303-I307 WeakPolarHBondContact O-CG1 3.48Å; G303-I307 PolarHBondContact O-N 3.15Å; G303-I307 VanDerWaalsContact O-N 3.08Å; G303-A324 WeakPolarHBondContact O-CB 3.19Å
304	P	97.2	Very high	95.6	Very high	73 Å²	73	80.1 Å²	80.1	47%	0.474	41%	0.406	S	S	.	.	H	α-helix	trans	-53.3	-38.8	172.9	-29.2	36	0	0	0	114.7	K300 E301 I307 L308	K300-P304 WeakPolarHBondContact O-CD 3.23Å; E301-P304 WeakPolarHBondContact O-CD 3.4Å; P304-I307 PolarHBondContact O-N 2.59Å; P304-L308 WeakPolarHBondContact O-CB 3.32Å; P304-L308 PolarHBondContact O-N 2.76Å
305	I	97.3	Very high	95.5	Very high	88 Å²	88	83.8 Å²	83.8	45%	0.451	43%	0.425	S	S	.	.	H	α-helix	trans	-61.9	-45.9	177.4	-69.4	167.6	0	0	0	111.1	E301 Y302 G303 L308 W309	E301-I305 HydrophobicContact CB-CD1 4.46Å; E301-I305 WeakPolarHBondContact O-CD1 3.49Å; E301-I305 VanDerWaalsContact O-CG1 3.24Å; E301-I305 WeakPolarHBondContact O-CG1 3.37Å; E301-I305 PolarHBondContact O-N 2.69Å; Y302-I305 HydrophobicContact CD1-CD1 4.44Å; Y302-I305 PolarHBondContact O-N 2.68Å; G303-I305 VanDerWaalsContact C-N 3.3Å; G303-I305 PolarHBondContact O-N 2.71Å; I305-L308 PolarHBondContact O-N 3.4Å; I305-W309 WeakPolarHBondContact O-CB 3.31Å; I305-W309 PolarHBondContact O-N 3.44Å
306	H	97.6	Very high	95.5	Very high	32 Å²	32	82.5 Å²	82.5	15%	0.148	43%	0.425	C	S	.	.	H	α-helix	trans	-67.7	-35.1	178	-72.3	85.2	0	0	0	112.4	Y302 G303 W309 S310 I323 A324	Y302-H306 PolarHBondContact O-N 2.85Å; Y302-H306 PolarHBondContact O-ND1 2.7Å; G303-H306 PolarHBondContact O-N 2.69Å; H306-W309 PolarHBondContact O-N 3.4Å; H306-S310 WeakPolarHBondContact O-CB 3.12Å; H306-S310 PolarHBondContact O-N 3.11Å; H306-I323 VanDerWaalsContact CD2-CG2 3.49Å; H306-I323 WeakPolarHBondContact CD2-CG2 3.31Å; H306-A324 HydrophobicContact CB-CB 3.95Å
307	I	97.6	Very high	95.5	Very high	84 Å²	84	83.4 Å²	83.4	43%	0.431	43%	0.432	S	S	.	.	H	α-helix	trans	-62.8	-45.1	171.6	-64.6	-61.6	0	0	0	111.2	G303 P304 S310 A311 K321 A324	G303-I307 WeakPolarHBondContact O-CG1 3.48Å; G303-I307 PolarHBondContact O-N 3.15Å; G303-I307 VanDerWaalsContact O-N 3.08Å; P304-I307 PolarHBondContact O-N 2.59Å; I307-S310 PolarHBondContact O-N 2.81Å; I307-S310 PolarHBondContact O-OG 2.77Å; I307-A311 PolarHBondContact O-N 3.39Å; I307-K321 HydrophobicContact CD1-CB 4.31Å; I307-K321 HydrophobicContact CD1-CG 3.95Å; I307-A324 HydrophobicContact CD1-CB 3.59Å; I307-A324 HydrophobicContact CG1-CB 3.71Å
308	L	97.5	Very high	95.5	Very high	131 Å²	131	85.2 Å²	85.2	69%	0.686	44%	0.441	S	S	*	.	H	α-helix	trans	-65.3	-40.9	178.5	-178.4	61.2	0	0	0	111.8	P304 I305 S310 A311	P304-L308 WeakPolarHBondContact O-CB 3.32Å; P304-L308 PolarHBondContact O-N 2.76Å; I305-L308 PolarHBondContact O-N 3.4Å; L308-S310 VanDerWaalsContact C-N 3.34Å; L308-A311 WeakPolarHBondContact O-CB 3.28Å; L308-A311 PolarHBondContact O-N 3.11Å
309	W	97.6	Very high	95.6	Very high	125 Å²	125	82.1 Å²	82.1	47%	0.473	43%	0.43	S	S	.	.	H	α-helix	trans	-60.9	-43	173.6	-172.7	2.5	0	0	0	111.1	I305 H306 A311 S312 E313 L320	I305-W309 WeakPolarHBondContact O-CB 3.31Å; I305-W309 PolarHBondContact O-N 3.44Å; H306-W309 PolarHBondContact O-N 3.4Å; W309-A311 PolarHBondContact O-N 3.48Å; W309-S312 PolarHBondContact O-N 2.98Å; W309-E313 PolarHBondContact NE1-OE1 3.47Å; W309-L320 HydrophobicContact CB-CD1 4.35Å; W309-L320 HydrophobicContact CD2-CD1 4.06Å; W309-L320 HydrophobicContact CD2-CD2 3.97Å; W309-L320 HydrophobicContact CE3-CD2 3.78Å; W309-L320 HydrophobicContact CG-CD1 3.89Å; W309-L320 HydrophobicContact CG-CD2 4.47Å; W309-L320 HydrophobicContact CZ3-CD2 4.11Å
310	S	97.4	Very high	95.8	Very high	7 Å²	7	81.5 Å²	81.5	5%	0.049	43%	0.427	C	S	.	.	H	α-helix	trans	-58.1	-18.6	177.6	82.1	0	0	0	0	114.6	H306 I307 L308 S312	H306-S310 WeakPolarHBondContact O-CB 3.12Å; H306-S310 PolarHBondContact O-N 3.11Å; I307-S310 PolarHBondContact O-N 2.81Å; I307-S310 PolarHBondContact O-OG 2.77Å; L308-S310 VanDerWaalsContact C-N 3.34Å; S310-S312 VanDerWaalsContact C-N 3.33Å
311	A	96.1	Very high	95.8	Very high	83 Å²	83	81.9 Å²	81.9	69%	0.686	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.6	-6.2	175.3	0	0	0	0	0	114.1	I307 L308 W309	I307-A311 PolarHBondContact O-N 3.39Å; L308-A311 WeakPolarHBondContact O-CB 3.28Å; L308-A311 PolarHBondContact O-N 3.11Å; W309-A311 PolarHBondContact O-N 3.48Å
312	S	95.8	Very high	95.9	Very high	98 Å²	98	76.9 Å²	76.9	69%	0.685	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.2	-4.5	179.7	-52.3	0	0	0	0	113.6	W309 S310	W309-S312 PolarHBondContact O-N 2.98Å; S310-S312 VanDerWaalsContact C-N 3.33Å
313	E	95.6	Very high	96	Very high	72 Å²	72	74 Å²	74	34%	0.336	40%	0.4	S	S	.	.			trans	-107.4	157.8	179.4	-61.1	-64.1	161	0	0	110.3	W309 L316 V317 L320	W309-E313 PolarHBondContact NE1-OE1 3.47Å; E313-L316 HydrophobicContact CB-CB 4.19Å; E313-L316 HydrophobicContact CG-CB 4.35Å; E313-V317 WeakPolarHBondContact O-CG2 3.48Å; E313-L320 HydrophobicContact CB-CD1 4.36Å; E313-L320 HydrophobicContact CG-CD1 3.73Å
314	E	91.3	Very high	96.1	Very high	180 Å²	180	74 Å²	74	84%	0.841	40%	0.4	S	S	*	.	S	Bend	trans	-105.5	-50.7	173.6	-64.7	-173.3	176.5	0	0	111.2	V317	E314-V317 VanDerWaalsContact O-CG2 3.31Å; E314-V317 WeakPolarHBondContact O-CG2 3.25Å
315	D	91.5	Very high	96.1	Very high	158 Å²	158	73.1 Å²	73.1	85%	0.845	40%	0.396	S	S	*	.	S	Bend	trans	-83.9	-30.8	-175.8	-55.5	-44.1	0	0	0	113.7
316	L	93.9	Very high	96.1	Very high	81 Å²	81	69.2 Å²	69.2	42%	0.424	38%	0.376	S	S	.	.	S	Bend	trans	-94.1	5.2	-171.8	-61.6	178.6	0	0	0	114.2	E313 D318 T319 L320	E313-L316 HydrophobicContact CB-CB 4.19Å; E313-L316 HydrophobicContact CG-CB 4.35Å; L316-D318 PolarHBondContact O-N 3.48Å; L316-T319 PolarHBondContact O-N 2.73Å; L316-L320 HydrophobicContact CB-CD1 4.1Å; L316-L320 HydrophobicContact CB-CG 4.33Å; L316-L320 WeakPolarHBondContact O-CB 3.1Å; L316-L320 WeakPolarHBondContact O-CG 3.37Å; L316-L320 PolarHBondContact O-N 3.25Å
317	V	95.2	Very high	96.1	Very high	31 Å²	31	68.3 Å²	68.3	19%	0.188	37%	0.372	C	S	.	.	H	α-helix	trans	-53.9	-51.8	-170.9	176.5	0	0	0	0	112.2	E313 E314 K321	E313-V317 WeakPolarHBondContact O-CG2 3.48Å; E314-V317 VanDerWaalsContact O-CG2 3.31Å; E314-V317 WeakPolarHBondContact O-CG2 3.25Å; V317-K321 HydrophobicContact CG1-CD 4.29Å; V317-K321 VanDerWaalsContact CG1-CE 3.44Å; V317-K321 VanDerWaalsContact O-CG 3.31Å; V317-K321 WeakPolarHBondContact O-CG 3.25Å; V317-K321 PolarHBondContact O-N 2.92Å; V317-K321 VanDerWaalsContact O-N 3.12Å
318	D	93.8	Very high	96.1	Very high	119 Å²	119	67.8 Å²	67.8	64%	0.636	37%	0.37	S	S	*	.	H	α-helix	trans	-81.3	-28.3	-174.1	-68.6	-23.9	0	0	0	112.3	L316 K321 G322	L316-D318 PolarHBondContact O-N 3.48Å; D318-K321 IonicContact OD1-NZ 3.73Å; D318-K321 PolarHBondContact OD1-NZ 2.65Å; D318-G322 PolarHBondContact O-N 3.09Å
319	T	96	Very high	96.1	Very high	39 Å²	39	65.1 Å²	65.1	24%	0.239	35%	0.354	C	S	.	.	H	α-helix	trans	-61.3	-48.5	168.3	-56.2	0	0	0	0	111.2	L316 G322 I323 F448 Q452	L316-T319 PolarHBondContact O-N 2.73Å; T319-G322 WeakPolarHBondContact O-CA 3.31Å; T319-G322 PolarHBondContact O-N 3.46Å; T319-G322 VanDerWaalsContact O-N 3.13Å; T319-I323 HydrophobicContact CG2-CD1 4.35Å; T319-I323 WeakPolarHBondContact O-CG1 3.36Å; T319-I323 PolarHBondContact O-N 3Å; T319-F448 HydrophobicContact CG2-CZ 4.06Å; T319-Q452 PolarHBondContact OG1-OE1 3.19Å
320	L	96.9	Very high	96.1	Very high	9 Å²	9	59.2 Å²	59.2	5%	0.047	33%	0.332	C	S	.	.	H	α-helix	trans	-65.5	-38.8	179.3	-74	169.6	0	0	0	112.4	W309 E313 L316 G322 I323 A324	W309-L320 HydrophobicContact CB-CD1 4.35Å; W309-L320 HydrophobicContact CD2-CD1 4.06Å; W309-L320 HydrophobicContact CD2-CD2 3.97Å; W309-L320 HydrophobicContact CE3-CD2 3.78Å; W309-L320 HydrophobicContact CG-CD1 3.89Å; W309-L320 HydrophobicContact CG-CD2 4.47Å; W309-L320 HydrophobicContact CZ3-CD2 4.11Å; E313-L320 HydrophobicContact CB-CD1 4.36Å; E313-L320 HydrophobicContact CG-CD1 3.73Å; L316-L320 HydrophobicContact CB-CD1 4.1Å; L316-L320 HydrophobicContact CB-CG 4.33Å; L316-L320 WeakPolarHBondContact O-CB 3.1Å; L316-L320 WeakPolarHBondContact O-CG 3.37Å; L316-L320 PolarHBondContact O-N 3.25Å; L320-G322 VanDerWaalsContact C-N 3.33Å; L320-I323 HydrophobicContact CD2-CD1 4.49Å; L320-I323 PolarHBondContact O-N 3.14Å; L320-A324 PolarHBondContact O-N 3.37Å
321	K	96.7	Very high	96	Very high	88 Å²	88	59.3 Å²	59.3	38%	0.383	33%	0.333	S	S	.	.	H	α-helix	trans	-65.3	-35.9	170.7	-69.6	169.2	-168.1	162.6	0	112.5	I307 V317 D318 A324 S325	I307-K321 HydrophobicContact CD1-CB 4.31Å; I307-K321 HydrophobicContact CD1-CG 3.95Å; V317-K321 HydrophobicContact CG1-CD 4.29Å; V317-K321 VanDerWaalsContact CG1-CE 3.44Å; V317-K321 VanDerWaalsContact O-CG 3.31Å; V317-K321 WeakPolarHBondContact O-CG 3.25Å; V317-K321 PolarHBondContact O-N 2.92Å; V317-K321 VanDerWaalsContact O-N 3.12Å; D318-K321 IonicContact OD1-NZ 3.73Å; D318-K321 PolarHBondContact OD1-NZ 2.65Å; K321-A324 PolarHBondContact O-N 2.67Å; K321-S325 WeakPolarHBondContact O-CB 3.16Å; K321-S325 PolarHBondContact O-N 2.98Å
322	G	97.1	Very high	96	Very high	17 Å²	17	61.2 Å²	61.2	18%	0.175	33%	0.326	C	S	.	.	H	α-helix	trans	-62.1	-45.9	173.2	0	0	0	0	0	112	D318 T319 L320 A324 S325 C326	D318-G322 PolarHBondContact O-N 3.09Å; T319-G322 WeakPolarHBondContact O-CA 3.31Å; T319-G322 PolarHBondContact O-N 3.46Å; T319-G322 VanDerWaalsContact O-N 3.13Å; L320-G322 VanDerWaalsContact C-N 3.33Å; G322-A324 PolarHBondContact O-N 3.18Å; G322-S325 WeakPolarHBondContact O-CB 3.48Å; G322-S325 PolarHBondContact O-N 3.11Å; G322-C326 PolarHBondContact O-N 3.31Å; G322-C326 PolarHBondContact O-SG 3.33Å
323	I	97.6	Very high	96	Very high	37 Å²	37	56.7 Å²	56.7	19%	0.19	29%	0.294	C	S	.	.	H	α-helix	trans	-58.7	-47.5	173.4	-67.5	167.6	0	0	0	110.8	H306 T319 L320 S325 C326 I327 W445 F448	H306-I323 VanDerWaalsContact CD2-CG2 3.49Å; H306-I323 WeakPolarHBondContact CD2-CG2 3.31Å; T319-I323 HydrophobicContact CG2-CD1 4.35Å; T319-I323 WeakPolarHBondContact O-CG1 3.36Å; T319-I323 PolarHBondContact O-N 3Å; L320-I323 HydrophobicContact CD2-CD1 4.49Å; L320-I323 PolarHBondContact O-N 3.14Å; I323-S325 VanDerWaalsContact C-N 3.33Å; I323-S325 PolarHBondContact O-N 3.41Å; I323-C326 WeakPolarHBondContact O-CB 3.39Å; I323-C326 PolarHBondContact O-N 2.89Å; I323-C326 VanDerWaalsContact O-N 3.1Å; I323-I327 HydrophobicContact CG2-CD1 3.78Å; I323-I327 WeakPolarHBondContact O-CG1 3.27Å; I323-I327 PolarHBondContact O-N 3.4Å; I323-W445 HydrophobicContact CG2-CH2 4.23Å; I323-F448 HydrophobicContact CD1-CZ 4.41Å; I323-F448 HydrophobicContact CG1-CE1 3.69Å; I323-F448 HydrophobicContact CG1-CZ 3.6Å
324	A	97.8	Very high	96	Very high	2 Å²	2	53.3 Å²	53.3	2%	0.017	28%	0.278	C	S	.	.	H	α-helix	trans	-57.4	-44.3	176.2	0	0	0	0	0	112.3	G303 H306 I307 L320 K321 G322 C326 I327 D328	G303-A324 WeakPolarHBondContact O-CB 3.19Å; H306-A324 HydrophobicContact CB-CB 3.95Å; I307-A324 HydrophobicContact CD1-CB 3.59Å; I307-A324 HydrophobicContact CG1-CB 3.71Å; L320-A324 PolarHBondContact O-N 3.37Å; K321-A324 PolarHBondContact O-N 2.67Å; G322-A324 PolarHBondContact O-N 3.18Å; A324-C326 VanDerWaalsContact C-N 3.31Å; A324-C326 PolarHBondContact O-N 3.03Å; A324-I327 PolarHBondContact O-N 3.48Å; A324-D328 PolarHBondContact O-N 2.72Å
325	S	97.6	Very high	96.2	Very high	55 Å²	55	49.1 Å²	49.1	39%	0.385	26%	0.259	S	S	.	.	H	α-helix	trans	-63	-34.5	175.5	-179	0	0	0	0	113.1	K321 G322 I323 Q329	K321-S325 WeakPolarHBondContact O-CB 3.16Å; K321-S325 PolarHBondContact O-N 2.98Å; G322-S325 WeakPolarHBondContact O-CB 3.48Å; G322-S325 PolarHBondContact O-N 3.11Å; I323-S325 VanDerWaalsContact C-N 3.33Å; I323-S325 PolarHBondContact O-N 3.41Å; S325-Q329 VanDerWaalsContact O-CG 3.29Å; S325-Q329 WeakPolarHBondContact O-CG 3.47Å; S325-Q329 PolarHBondContact O-N 3.25Å; S325-Q329 VanDerWaalsContact O-N 3.12Å; S325-Q329 PolarHBondContact O-NE2 2.7Å; S325-Q329 PolarHBondContact OG-NE2 3.2Å
326	C	98.1	Very high	96.3	Very high	5 Å²	5	46.4 Å²	46.4	3%	0.034	24%	0.239	C	C	.	.	H	α-helix	trans	-67.6	-45.2	174.6	-64.6	0	0	0	0	111.4	G322 I323 A324 D328 Q329 C330 T444 W445 F448	G322-C326 PolarHBondContact O-N 3.31Å; G322-C326 PolarHBondContact O-SG 3.33Å; I323-C326 WeakPolarHBondContact O-CB 3.39Å; I323-C326 PolarHBondContact O-N 2.89Å; I323-C326 VanDerWaalsContact O-N 3.1Å; A324-C326 VanDerWaalsContact C-N 3.31Å; A324-C326 PolarHBondContact O-N 3.03Å; C326-D328 PolarHBondContact O-N 3.4Å; C326-Q329 PolarHBondContact O-N 2.96Å; C326-Q329 VanDerWaalsContact O-N 3.16Å; C326-C330 PolarHBondContact O-N 3Å; C326-C330 PolarHBondContact O-SG 3.2Å; C326-C330 VanDerWaalsContact O-SG 3.37Å; C326-T444 HydrophobicContact CB-CG2 3.77Å; C326-W445 HydrophobicContact CB-CD2 4.13Å; C326-W445 HydrophobicContact CB-CE3 3.89Å; C326-W445 HydrophobicContact CB-CH2 3.67Å; C326-W445 HydrophobicContact CB-CZ2 3.9Å; C326-W445 HydrophobicContact CB-CZ3 3.66Å; C326-F448 WeakPolarHBondContact SG-CB 3.42Å
327	I	97.4	Very high	96.3	Very high	14 Å²	14	43 Å²	43	7%	0.072	22%	0.221	C	C	.	.	H	α-helix	trans	-60.1	-46.5	176.3	-66.4	162.9	0	0	0	110.4	M299 I323 A324 Q329 C330 C331 W445	M299-I327 HydrophobicContact CG-CG2 4.49Å; M299-I327 WeakPolarHBondContact O-CG2 3.43Å; I323-I327 HydrophobicContact CG2-CD1 3.78Å; I323-I327 WeakPolarHBondContact O-CG1 3.27Å; I323-I327 PolarHBondContact O-N 3.4Å; A324-I327 PolarHBondContact O-N 3.48Å; I327-Q329 VanDerWaalsContact C-N 3.26Å; I327-Q329 PolarHBondContact O-N 3.06Å; I327-C330 PolarHBondContact O-N 2.66Å; I327-C331 WeakPolarHBondContact O-CB 3.48Å; I327-C331 PolarHBondContact O-N 2.83Å; I327-C331 PolarHBondContact O-SG 3.23Å; I327-W445 HydrophobicContact CG1-CH2 4.14Å; I327-W445 HydrophobicContact CG1-CZ2 4.19Å
328	D	97	Very high	96.1	Very high	72 Å²	72	42 Å²	42	39%	0.385	22%	0.215	S	C	.	.	H	α-helix	trans	-58.9	-34.7	175.6	-86.6	6.9	0	0	0	113.1	A324 C326 K332	A324-D328 PolarHBondContact O-N 2.72Å; C326-D328 PolarHBondContact O-N 3.4Å; D328-K332 WeakPolarHBondContact O-CD 3.43Å; D328-K332 VanDerWaalsContact O-CG 3.31Å; D328-K332 WeakPolarHBondContact O-CG 3.38Å; D328-K332 PolarHBondContact O-N 3.05Å
329	Q	97	Very high	96	Very high	75 Å²	75	39.4 Å²	39.4	35%	0.35	20%	0.203	S	C	.	.	H	α-helix	trans	-74.8	-41.3	176.4	-75.5	175	55.8	0	0	111.9	S325 C326 I327 K332 A333 T444	S325-Q329 VanDerWaalsContact O-CG 3.29Å; S325-Q329 WeakPolarHBondContact O-CG 3.47Å; S325-Q329 PolarHBondContact O-N 3.25Å; S325-Q329 VanDerWaalsContact O-N 3.12Å; S325-Q329 PolarHBondContact O-NE2 2.7Å; S325-Q329 PolarHBondContact OG-NE2 3.2Å; C326-Q329 PolarHBondContact O-N 2.96Å; C326-Q329 VanDerWaalsContact O-N 3.16Å; I327-Q329 VanDerWaalsContact C-N 3.26Å; I327-Q329 PolarHBondContact O-N 3.06Å; Q329-K332 PolarHBondContact O-N 3.34Å; Q329-A333 PolarHBondContact O-N 3.41Å; Q329-A333 VanDerWaalsContact O-N 3.09Å; Q329-T444 HydrophobicContact CB-CG2 3.83Å; Q329-T444 PolarHBondContact OE1-OG1 2.69Å
330	C	97.6	Very high	95.6	Very high	2 Å²	2	38.7 Å²	38.7	1%	0.014	20%	0.203	C	C	.	.	H	α-helix	trans	-61.7	-43.3	172	-68.7	0	0	0	0	111.4	M299 C326 I327 K332 A333 T334 C441 W445	M299-C330 HydrophobicContact CE-CB 3.79Å; M299-C330 HydrophobicContact SD-CB 4.43Å; C326-C330 PolarHBondContact O-N 3Å; C326-C330 PolarHBondContact O-SG 3.2Å; C326-C330 VanDerWaalsContact O-SG 3.37Å; I327-C330 PolarHBondContact O-N 2.66Å; C330-K332 VanDerWaalsContact C-N 3.32Å; C330-K332 PolarHBondContact O-N 2.94Å; C330-A333 CarbonylContact O-C 3.6Å; C330-A333 WeakPolarHBondContact O-CA 3.41Å; C330-A333 WeakPolarHBondContact O-CB 3.34Å; C330-A333 PolarHBondContact O-N 3.45Å; C330-T334 PolarHBondContact O-N 3Å; C330-T334 PolarHBondContact O-OG1 2.65Å; C330-T334 VanDerWaalsContact O-OG1 3.11Å; C330-C441 VanDerWaalsContact SG-SG 3.68Å; C330-W445 PolarHBondContact SG-NE1 3.37Å; C330-W445 VanDerWaalsContact SG-NE1 3.42Å
331	C	96.7	Very high	95.3	Very high	9 Å²	9	39.1 Å²	39.1	6%	0.061	21%	0.206	C	C	.	.	H	α-helix	trans	-56.2	-44.5	174.7	-70.1	0	0	0	0	111.8	F296 I327 A333 T334 E335	F296-C331 HydrophobicContact CE2-CB 4.12Å; F296-C331 VanDerWaalsContact CE2-O 3.3Å; F296-C331 WeakPolarHBondContact CE2-O 3.45Å; I327-C331 WeakPolarHBondContact O-CB 3.48Å; I327-C331 PolarHBondContact O-N 2.83Å; I327-C331 PolarHBondContact O-SG 3.23Å; C331-A333 VanDerWaalsContact C-N 3.32Å; C331-A333 PolarHBondContact O-N 3.44Å; C331-T334 WeakPolarHBondContact O-CB 3.41Å; C331-T334 PolarHBondContact O-N 2.93Å; C331-E335 WeakPolarHBondContact O-CB 3.45Å; C331-E335 PolarHBondContact O-N 3.33Å
332	K	95.8	Very high	95	Very high	123 Å²	123	36.7 Å²	36.7	54%	0.535	20%	0.199	S	C	.	.	H	α-helix	trans	-63.9	-35.6	176.2	-70.6	160.5	-170.6	154.7	0	112.6	D328 Q329 C330 K336	D328-K332 WeakPolarHBondContact O-CD 3.43Å; D328-K332 VanDerWaalsContact O-CG 3.31Å; D328-K332 WeakPolarHBondContact O-CG 3.38Å; D328-K332 PolarHBondContact O-N 3.05Å; Q329-K332 PolarHBondContact O-N 3.34Å; C330-K332 VanDerWaalsContact C-N 3.32Å; C330-K332 PolarHBondContact O-N 2.94Å; K332-K336 WeakPolarHBondContact O-CB 3.35Å; K332-K336 PolarHBondContact O-N 3.37Å; K332-K336 VanDerWaalsContact O-N 3.16Å
333	A	96.3	Very high	94.5	Very high	3 Å²	3	41.1 Å²	41.1	3%	0.025	22%	0.216	C	C	.	.	H	α-helix	trans	-67.9	-42.6	173.5	0	0	0	0	0	111.3	Q329 C330 C331 K336 R337 Y437 Q440	Q329-A333 PolarHBondContact O-N 3.41Å; Q329-A333 VanDerWaalsContact O-N 3.09Å; C330-A333 CarbonylContact O-C 3.6Å; C330-A333 WeakPolarHBondContact O-CA 3.41Å; C330-A333 WeakPolarHBondContact O-CB 3.34Å; C330-A333 PolarHBondContact O-N 3.45Å; C331-A333 VanDerWaalsContact C-N 3.32Å; C331-A333 PolarHBondContact O-N 3.44Å; A333-K336 PolarHBondContact O-N 2.87Å; A333-R337 WeakPolarHBondContact O-CB 3.47Å; A333-R337 PolarHBondContact O-N 3.5Å; A333-Y437 HydrophobicContact CB-CD2 3.75Å; A333-Y437 HydrophobicContact CB-CE2 4.07Å; A333-Q440 HydrophobicContact CB-CG 4.23Å
334	T	95.7	Very high	94.1	Very high	0 Å²	0	41 Å²	41	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-60.1	-48.4	175	-58.2	0	0	0	0	111.3	F296 C330 C331 K336 R337 M338 Y437	F296-T334 HydrophobicContact CB-CG2 3.86Å; F296-T334 HydrophobicContact CD2-CG2 3.74Å; F296-T334 HydrophobicContact CG-CG2 4.08Å; C330-T334 PolarHBondContact O-N 3Å; C330-T334 PolarHBondContact O-OG1 2.65Å; C330-T334 VanDerWaalsContact O-OG1 3.11Å; C331-T334 WeakPolarHBondContact O-CB 3.41Å; C331-T334 PolarHBondContact O-N 2.93Å; T334-K336 VanDerWaalsContact C-N 3.34Å; T334-K336 PolarHBondContact O-N 3.01Å; T334-R337 PolarHBondContact O-N 3.4Å; T334-M338 HydrophobicContact CG2-CG 4.33Å; T334-M338 HydrophobicContact CG2-SD 3.97Å; T334-M338 WeakPolarHBondContact O-CB 3.39Å; T334-M338 VanDerWaalsContact O-CG 3.3Å; T334-M338 WeakPolarHBondContact O-CG 3.39Å; T334-M338 PolarHBondContact O-N 2.7Å; T334-Y437 WeakPolarHBondContact OG1-CE2 3.39Å
335	E	94.4	Very high	93.8	Very high	92 Å²	92	41.4 Å²	41.4	43%	0.43	22%	0.222	S	C	.	.	H	α-helix	trans	-57.6	-45.7	178.3	-168.4	166.4	-122.1	0	0	111.4	F296 K300 C331 M338 T339	F296-E335 HydrophobicContact CE1-CG 4.44Å; F296-E335 HydrophobicContact CE2-CB 3.92Å; F296-E335 HydrophobicContact CZ-CB 3.65Å; F296-E335 HydrophobicContact CZ-CG 3.85Å; K300-E335 IonicContact NZ-OE1 4Å; C331-E335 WeakPolarHBondContact O-CB 3.45Å; C331-E335 PolarHBondContact O-N 3.33Å; E335-M338 PolarHBondContact O-N 3.07Å; E335-T339 PolarHBondContact O-N 3.02Å; E335-T339 PolarHBondContact O-OG1 3Å
336	K	93.8	Very high	93.6	Very high	101 Å²	101	39.5 Å²	39.5	44%	0.439	21%	0.207	S	C	.	.	H	α-helix	trans	-62	-45.8	175.7	-177.9	175.3	176.1	-92.6	0	112.6	K332 A333 T334 T339 G340 E433	K332-K336 WeakPolarHBondContact O-CB 3.35Å; K332-K336 PolarHBondContact O-N 3.37Å; K332-K336 VanDerWaalsContact O-N 3.16Å; A333-K336 PolarHBondContact O-N 2.87Å; T334-K336 VanDerWaalsContact C-N 3.34Å; T334-K336 PolarHBondContact O-N 3.01Å; K336-T339 WeakPolarHBondContact O-CB 3.3Å; K336-T339 PolarHBondContact O-N 3.21Å; K336-G340 PolarHBondContact O-N 3.07Å; K336-G340 VanDerWaalsContact O-N 3.14Å; K336-E433 IonicContact NZ-OE1 3.88Å; K336-E433 PolarHBondContact NZ-OE1 2.93Å; K336-E433 IonicContact NZ-OE2 3.68Å; K336-E433 PolarHBondContact NZ-OE2 3.16Å
337	R	93.7	Very high	93.3	Very high	10 Å²	10	41.6 Å²	41.6	4%	0.038	22%	0.221	C	C	.	.	H	α-helix	trans	-59.3	-47.4	175.6	177.1	178.1	57	135.1	5.5	110.8	E292 A333 T334 T339 G340 L341 N434 Y437	E292-R337 IonicContact OE1-CZ 3.28Å; E292-R337 IonicContact OE1-NH1 3.06Å; E292-R337 PolarHBondContact OE1-NH1 3.47Å; E292-R337 IonicContact OE1-NH2 2.69Å; E292-R337 PolarHBondContact OE1-NH2 3.19Å; E292-R337 IonicContact OE2-CZ 2.69Å; E292-R337 IonicContact OE2-NH1 3.41Å; E292-R337 IonicContact OE2-NH2 3.49Å; E292-R337 PolarHBondContact OE2-NH2 2.9Å; A333-R337 WeakPolarHBondContact O-CB 3.47Å; A333-R337 PolarHBondContact O-N 3.5Å; T334-R337 PolarHBondContact O-N 3.4Å; R337-T339 PolarHBondContact O-N 3.33Å; R337-G340 WeakPolarHBondContact O-CA 3.23Å; R337-G340 PolarHBondContact O-N 3.07Å; R337-G340 VanDerWaalsContact O-N 3.11Å; R337-L341 HydrophobicContact CG-CD1 4Å; R337-L341 WeakPolarHBondContact O-CD1 3.47Å; R337-L341 PolarHBondContact O-N 3.42Å; R337-L341 VanDerWaalsContact O-N 3.07Å; R337-N434 VanDerWaalsContact CD-OD1 3.27Å; R337-N434 WeakPolarHBondContact CD-OD1 3.43Å; R337-Y437 HydrophobicContact CB-CD2 4.28Å; R337-Y437 HydrophobicContact CB-CG 4.4Å
338	M	92.3	Very high	93.1	Very high	11 Å²	11	42 Å²	42	5%	0.054	22%	0.224	C	C	.	.	H	α-helix	trans	-59.4	-44.8	176.7	-72.5	175.1	67.3	0	0	112	Y289 R293 F296 T334 E335 G340 L341 S342	Y289-M338 HydrophobicContact CE2-CB 4.31Å; Y289-M338 WeakPolarHBondContact CE2-O 3.31Å; R293-M338 VanDerWaalsContact CA-CE 3.43Å; R293-M338 HydrophobicContact CB-CE 3.47Å; R293-M338 VanDerWaalsContact CB-CE 3.47Å; R293-M338 HydrophobicContact CG-CE 3.88Å; F296-M338 HydrophobicContact CB-SD 3.7Å; F296-M338 HydrophobicContact CD1-CE 4.29Å; F296-M338 HydrophobicContact CD1-SD 3.83Å; F296-M338 HydrophobicContact CG-SD 3.8Å; T334-M338 HydrophobicContact CG2-CG 4.33Å; T334-M338 HydrophobicContact CG2-SD 3.97Å; T334-M338 WeakPolarHBondContact O-CB 3.39Å; T334-M338 VanDerWaalsContact O-CG 3.3Å; T334-M338 WeakPolarHBondContact O-CG 3.39Å; T334-M338 PolarHBondContact O-N 2.7Å; E335-M338 PolarHBondContact O-N 3.07Å; M338-G340 PolarHBondContact O-N 2.95Å; M338-L341 PolarHBondContact O-N 3.39Å; M338-L341 VanDerWaalsContact O-N 3.1Å; M338-S342 PolarHBondContact O-N 2.99Å; M338-S342 PolarHBondContact O-OG 3.25Å
339	T	90.7	Very high	93.1	Very high	63 Å²	63	38.6 Å²	38.6	39%	0.387	21%	0.206	S	C	.	.	H	α-helix	trans	-53.8	-44.8	174	-57	0	0	0	0	110.8	E335 K336 R337 L341 S342 E343	E335-T339 PolarHBondContact O-N 3.02Å; E335-T339 PolarHBondContact O-OG1 3Å; K336-T339 WeakPolarHBondContact O-CB 3.3Å; K336-T339 PolarHBondContact O-N 3.21Å; R337-T339 PolarHBondContact O-N 3.33Å; T339-L341 PolarHBondContact O-N 3.48Å; T339-S342 WeakPolarHBondContact CA-OG 3.31Å; T339-S342 PolarHBondContact O-N 2.81Å; T339-S342 PolarHBondContact O-OG 3.04Å; T339-S342 VanDerWaalsContact O-OG 3.07Å; T339-E343 HydrophobicContact CG2-CG 4.2Å; T339-E343 WeakPolarHBondContact CG2-OE1 3.13Å; T339-E343 WeakPolarHBondContact O-CB 3.48Å; T339-E343 PolarHBondContact O-N 3.22Å
340	G	88.6	Confident	93	Very high	24 Å²	24	37.7 Å²	37.7	25%	0.247	20%	0.202	C	C	.	.	H	α-helix	trans	-56	-48	174	0	0	0	0	0	113.6	K336 R337 M338 S342 A344	K336-G340 PolarHBondContact O-N 3.07Å; K336-G340 VanDerWaalsContact O-N 3.14Å; R337-G340 WeakPolarHBondContact O-CA 3.23Å; R337-G340 PolarHBondContact O-N 3.07Å; R337-G340 VanDerWaalsContact O-N 3.11Å; M338-G340 PolarHBondContact O-N 2.95Å; G340-S342 PolarHBondContact O-N 3.41Å; G340-A344 VanDerWaalsContact O-CB 3.31Å; G340-A344 WeakPolarHBondContact O-CB 3.22Å; G340-A344 PolarHBondContact O-N 2.91Å
341	L	89.6	Confident	92.8	Very high	19 Å²	19	39.1 Å²	39.1	10%	0.099	21%	0.208	C	C	.	.	I	π-helix	trans	-59.1	-48.5	175.6	-85.3	76.8	0	0	0	111.6	I288 Y289 R337 M338 T339 L345 L346	I288-L341 HydrophobicContact CG2-CD2 4.29Å; Y289-L341 HydrophobicContact CD2-CB 3.87Å; Y289-L341 HydrophobicContact CD2-CD2 4.42Å; Y289-L341 HydrophobicContact CE2-CB 4.3Å; R337-L341 HydrophobicContact CG-CD1 4Å; R337-L341 WeakPolarHBondContact O-CD1 3.47Å; R337-L341 PolarHBondContact O-N 3.42Å; R337-L341 VanDerWaalsContact O-N 3.07Å; M338-L341 PolarHBondContact O-N 3.39Å; M338-L341 VanDerWaalsContact O-N 3.1Å; T339-L341 PolarHBondContact O-N 3.48Å; L341-L345 PolarHBondContact O-N 3.21Å; L341-L346 WeakPolarHBondContact O-CG 3.24Å; L341-L346 PolarHBondContact O-N 3.1Å
342	S	89.5	Confident	92.9	Very high	36 Å²	36	38.7 Å²	38.7	25%	0.252	21%	0.205	S	C	.	.	I	π-helix	trans	-71.4	-30.4	-176.9	43.9	0	0	0	0	114.8	Y289 M338 T339 G340 P347	Y289-S342 WeakPolarHBondContact OH-CB 3.37Å; Y289-S342 PolarHBondContact OH-OG 2.89Å; M338-S342 PolarHBondContact O-N 2.99Å; M338-S342 PolarHBondContact O-OG 3.25Å; T339-S342 WeakPolarHBondContact CA-OG 3.31Å; T339-S342 PolarHBondContact O-N 2.81Å; T339-S342 PolarHBondContact O-OG 3.04Å; T339-S342 VanDerWaalsContact O-OG 3.07Å; G340-S342 PolarHBondContact O-N 3.41Å; S342-P347 VanDerWaalsContact O-CD 3.31Å; S342-P347 WeakPolarHBondContact O-CD 3.49Å; S342-P347 VanDerWaalsContact O-CG 3.3Å; S342-P347 WeakPolarHBondContact O-CG 3.29Å
343	E	87.8	Confident	92.9	Very high	110 Å²	110	33.4 Å²	33.4	51%	0.514	18%	0.183	S	C	.	.	I	π-helix	trans	-96.8	-26.8	-176.5	-70	-158.5	-141.6	0	0	114.3	K197 T339	K197-E343 IonicContact NZ-OE2 2.62Å; K197-E343 PolarHBondContact NZ-OE2 2.89Å; T339-E343 HydrophobicContact CG2-CG 4.2Å; T339-E343 WeakPolarHBondContact CG2-OE1 3.13Å; T339-E343 WeakPolarHBondContact O-CB 3.48Å; T339-E343 PolarHBondContact O-N 3.22Å
344	A	88	Confident	92.8	Very high	34 Å²	34	34 Å²	34	28%	0.281	19%	0.186	S	C	.	.	I	π-helix	trans	-108.3	-55.1	-178.5	0	0	0	0	0	112.8	G340 V348	G340-A344 VanDerWaalsContact O-CB 3.31Å; G340-A344 WeakPolarHBondContact O-CB 3.22Å; G340-A344 PolarHBondContact O-N 2.91Å; A344-V348 VanDerWaalsContact O-CG2 3.23Å; A344-V348 WeakPolarHBondContact O-CG2 3.25Å
345	L	92.2	Very high	92.9	Very high	12 Å²	12	34.4 Å²	34.4	6%	0.063	19%	0.187	C	C	.	.	I	π-helix	trans	-76.7	-58.2	-171.1	-175.7	64	0	0	0	112.9	L341 V348 V349 A426 F427 T430	L341-L345 PolarHBondContact O-N 3.21Å; L345-V348 PolarHBondContact O-N 2.85Å; L345-V349 HydrophobicContact CD1-CG2 3.92Å; L345-V349 HydrophobicContact CG-CG2 4.26Å; L345-V349 WeakPolarHBondContact O-CG2 3.39Å; L345-V349 PolarHBondContact O-N 2.9Å; L345-A426 HydrophobicContact CD1-CB 4.17Å; L345-F427 HydrophobicContact CD1-CD1 3.91Å; L345-F427 HydrophobicContact CD1-CE1 3.77Å; L345-F427 HydrophobicContact CD1-CZ 4.35Å; L345-T430 HydrophobicContact CD2-CG2 4.25Å
346	L	92.8	Very high	93	Very high	14 Å²	14	30.1 Å²	30.1	7%	0.073	17%	0.167	C	C	.	.	H	α-helix	trans	-56.4	-44.6	-175	-60.8	-177.8	0	0	0	113	S285 Y289 L341 V348 V349 H350	S285-L346 VanDerWaalsContact CB-CD2 3.48Å; Y289-L346 HydrophobicContact CD1-CD1 4.13Å; Y289-L346 HydrophobicContact CD2-CD1 4.13Å; Y289-L346 HydrophobicContact CG-CD1 3.81Å; L341-L346 WeakPolarHBondContact O-CG 3.24Å; L341-L346 PolarHBondContact O-N 3.1Å; L346-V348 VanDerWaalsContact C-N 3.33Å; L346-V348 PolarHBondContact O-N 3.12Å; L346-V349 PolarHBondContact O-N 3.31Å; L346-H350 VanDerWaalsContact O-CB 3.31Å; L346-H350 WeakPolarHBondContact O-CB 3.37Å; L346-H350 PolarHBondContact O-N 3.5Å
347	P	91.6	Very high	93	Very high	49 Å²	49	31.1 Å²	31.1	32%	0.318	17%	0.174	S	C	.	.	H	α-helix	trans	-66	-34.5	-179.3	-22.4	36.2	0	0	0	113.1	S342 E351	S342-P347 VanDerWaalsContact O-CD 3.31Å; S342-P347 WeakPolarHBondContact O-CD 3.49Å; S342-P347 VanDerWaalsContact O-CG 3.3Å; S342-P347 WeakPolarHBondContact O-CG 3.29Å; P347-E351 WeakPolarHBondContact O-CB 3.25Å; P347-E351 PolarHBondContact O-N 2.91Å
348	V	94.8	Very high	93.1	Very high	24 Å²	24	31.1 Å²	31.1	15%	0.145	17%	0.174	C	C	.	.	H	α-helix	trans	-72.6	-45.7	178.7	173.8	0	0	0	0	110.8	A344 L345 L346 H350 E351 Y352 D422 L423 A426	A344-V348 VanDerWaalsContact O-CG2 3.23Å; A344-V348 WeakPolarHBondContact O-CG2 3.25Å; L345-V348 PolarHBondContact O-N 2.85Å; L346-V348 VanDerWaalsContact C-N 3.33Å; L346-V348 PolarHBondContact O-N 3.12Å; V348-H350 PolarHBondContact O-N 3.49Å; V348-E351 PolarHBondContact O-N 3.04Å; V348-Y352 HydrophobicContact CG1-CD2 4.13Å; V348-Y352 HydrophobicContact CG1-CE2 4.11Å; V348-Y352 VanDerWaalsContact O-CD2 3.24Å; V348-Y352 WeakPolarHBondContact O-CD2 3.22Å; V348-Y352 PolarHBondContact O-N 3.19Å; V348-D422 HydrophobicContact CG1-CB 4.2Å; V348-L423 HydrophobicContact CG1-CD2 4.18Å; V348-A426 HydrophobicContact CB-CB 4.1Å; V348-A426 HydrophobicContact CG1-CB 4.01Å; V348-A426 HydrophobicContact CG2-CB 4.29Å
349	V	95.9	Very high	93.3	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-59.4	-48.4	176.6	172.4	0	0	0	0	110.6	I278 I281 D282 L345 L346 E351 Y352 V353	I278-V349 HydrophobicContact CD1-CG1 4.21Å; I281-V349 HydrophobicContact CB-CG1 4.44Å; I281-V349 HydrophobicContact CG2-CG1 3.86Å; I281-V349 HydrophobicContact CG2-CG2 4.15Å; D282-V349 HydrophobicContact CB-CG1 3.76Å; L345-V349 HydrophobicContact CD1-CG2 3.92Å; L345-V349 HydrophobicContact CG-CG2 4.26Å; L345-V349 WeakPolarHBondContact O-CG2 3.39Å; L345-V349 PolarHBondContact O-N 2.9Å; L346-V349 PolarHBondContact O-N 3.31Å; V349-E351 PolarHBondContact O-N 3.36Å; V349-Y352 PolarHBondContact O-N 3.23Å; V349-V353 PolarHBondContact O-N 3.45Å; V349-V353 VanDerWaalsContact O-N 3.07Å
350	H	94.4	Very high	93.5	Very high	56 Å²	56	31.9 Å²	31.9	26%	0.259	17%	0.174	S	C	.	.	H	α-helix	trans	-65.8	-35.2	179.2	-174.7	75.3	0	0	0	112.9	E176 D282 L346 V348 Y352 V353 L354	E176-H350 IonicContact OE1-CE1 3.27Å; D282-H350 IonicContact OD2-ND1 3.75Å; L346-H350 VanDerWaalsContact O-CB 3.31Å; L346-H350 WeakPolarHBondContact O-CB 3.37Å; L346-H350 PolarHBondContact O-N 3.5Å; V348-H350 PolarHBondContact O-N 3.49Å; H350-Y352 PolarHBondContact O-N 2.8Å; H350-V353 WeakPolarHBondContact O-CB 3.47Å; H350-V353 PolarHBondContact O-N 3.43Å; H350-L354 WeakPolarHBondContact O-CG 3.49Å; H350-L354 PolarHBondContact O-N 3.31Å; H350-L354 VanDerWaalsContact O-N 3.09Å
351	E	94.8	Very high	93.7	Very high	31 Å²	31	31.7 Å²	31.7	15%	0.145	17%	0.172	C	C	.	.	H	α-helix	trans	-57.3	-38.7	170.5	-177	-176.7	169.6	0	0	111.6	P173 K201 P347 V348 V349 L354 Y355	P173-E351 HydrophobicContact CG-CG 4.06Å; K201-E351 VanDerWaalsContact CD-OE2 3.28Å; K201-E351 WeakPolarHBondContact CD-OE2 3.47Å; K201-E351 VanDerWaalsContact CE-OE1 3.31Å; K201-E351 WeakPolarHBondContact CE-OE1 3.39Å; K201-E351 WeakPolarHBondContact CE-OE2 3.38Å; K201-E351 IonicContact NZ-OE1 3.66Å; K201-E351 IonicContact NZ-OE2 3.02Å; K201-E351 PolarHBondContact NZ-OE2 3.31Å; P347-E351 WeakPolarHBondContact O-CB 3.25Å; P347-E351 PolarHBondContact O-N 2.91Å; V348-E351 PolarHBondContact O-N 3.04Å; V349-E351 PolarHBondContact O-N 3.36Å; E351-L354 PolarHBondContact O-N 3.13Å; E351-Y355 HydrophobicContact CG-CD2 4.03Å; E351-Y355 HydrophobicContact CG-CE2 3.79Å; E351-Y355 VanDerWaalsContact O-CD2 3.31Å; E351-Y355 WeakPolarHBondContact O-CD2 3.37Å; E351-Y355 PolarHBondContact O-N 2.83Å; E351-Y355 WeakPolarHBondContact OE1-CE2 3.29Å
352	Y	97.4	Very high	94	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-77.2	-23.2	178	-78.3	-66.9	0	0	0	114.4	F274 V348 V349 H350 Y355 S356 W415 M419 D422 L423	F274-Y352 HydrophobicContact CZ-CD1 4.21Å; V348-Y352 HydrophobicContact CG1-CD2 4.13Å; V348-Y352 HydrophobicContact CG1-CE2 4.11Å; V348-Y352 VanDerWaalsContact O-CD2 3.24Å; V348-Y352 WeakPolarHBondContact O-CD2 3.22Å; V348-Y352 PolarHBondContact O-N 3.19Å; V349-Y352 PolarHBondContact O-N 3.23Å; H350-Y352 PolarHBondContact O-N 2.8Å; Y352-Y355 AromaticContact CD1-CD2 3.58Å; Y352-Y355 HydrophobicContact CD1-CD2 3.58Å; Y352-Y355 HydrophobicContact CD1-CE2 4.33Å; Y352-Y355 HydrophobicContact CD1-CG 4.13Å; Y352-Y355 AromaticContact CE1-CD2 3.53Å; Y352-Y355 HydrophobicContact CE1-CD2 3.53Å; Y352-Y355 AromaticContact CE1-CE2 3.85Å; Y352-Y355 HydrophobicContact CE1-CE2 3.85Å; Y352-Y355 HydrophobicContact CE1-CG 4.23Å; Y352-Y355 HydrophobicContact CG-CD2 4.32Å; Y352-Y355 PolarHBondContact O-N 3.06Å; Y352-S356 PolarHBondContact O-N 3.45Å; Y352-S356 VanDerWaalsContact O-N 3.14Å; Y352-W415 HydrophobicContact CD1-CZ2 4.29Å; Y352-W415 HydrophobicContact CE1-CZ2 4.45Å; Y352-W415 AromaticContact CE1-NE1 3.95Å; Y352-M419 HydrophobicContact CD1-CB 4.19Å; Y352-M419 HydrophobicContact CD1-CG 3.77Å; Y352-M419 HydrophobicContact CE1-CB 3.58Å; Y352-M419 HydrophobicContact CE1-CG 3.67Å; Y352-M419 HydrophobicContact CG-CG 4.37Å; Y352-M419 WeakPolarHBondContact OH-CA 3.37Å; Y352-D422 HydrophobicContact CE2-CB 3.65Å; Y352-D422 PolarHBondContact OH-OD2 3.48Å; Y352-L423 HydrophobicContact CD2-CD2 3.97Å; Y352-L423 HydrophobicContact CD2-CG 4.11Å; Y352-L423 HydrophobicContact CE2-CG 4.43Å
353	V	96.6	Very high	94.2	Very high	12 Å²	12	29.3 Å²	29.3	7%	0.073	16%	0.157	C	C	.	.	H	α-helix	trans	-60.1	-49.3	161.7	177.2	0	0	0	0	109.9	I278 D282 V349 H350 Y355 S356	I278-V353 HydrophobicContact CG1-CG2 4.07Å; I278-V353 HydrophobicContact CG2-CG2 4.2Å; D282-V353 HydrophobicContact CB-CG2 3.73Å; V349-V353 PolarHBondContact O-N 3.45Å; V349-V353 VanDerWaalsContact O-N 3.07Å; H350-V353 WeakPolarHBondContact O-CB 3.47Å; H350-V353 PolarHBondContact O-N 3.43Å; V353-Y355 VanDerWaalsContact C-N 3.32Å; V353-Y355 PolarHBondContact O-N 2.74Å; V353-S356 WeakPolarHBondContact O-CB 3.42Å; V353-S356 PolarHBondContact O-N 2.97Å; V353-S356 PolarHBondContact O-OG 2.87Å
354	L	95.5	Very high	94.4	Very high	16 Å²	16	29.5 Å²	29.5	8%	0.084	16%	0.156	C	C	.	.	H	α-helix	trans	-66.9	-30.1	179.1	-59	172.7	0	0	0	113	P173 E176 H350 E351 S356 M358	P173-L354 HydrophobicContact CB-CB 3.47Å; P173-L354 VanDerWaalsContact CB-CB 3.47Å; P173-L354 HydrophobicContact CB-CD1 4.4Å; P173-L354 HydrophobicContact CG-CB 3.89Å; E176-L354 HydrophobicContact CG-CD2 3.95Å; H350-L354 WeakPolarHBondContact O-CG 3.49Å; H350-L354 PolarHBondContact O-N 3.31Å; H350-L354 VanDerWaalsContact O-N 3.09Å; E351-L354 PolarHBondContact O-N 3.13Å; L354-S356 VanDerWaalsContact C-N 3.34Å; L354-M358 PolarHBondContact O-N 3.33Å
355	Y	97.3	Very high	94.6	Very high	9 Å²	9	30.5 Å²	30.5	4%	0.035	15%	0.153	C	C	.	.	H	α-helix	trans	-64.2	-36.3	168.5	-87	-73.7	0	0	0	112	I170 P173 E351 Y352 V353 E357 M358 L359 W415	I170-Y355 HydrophobicContact CG2-CD1 3.97Å; I170-Y355 HydrophobicContact CG2-CE1 4.03Å; P173-Y355 VanDerWaalsContact CD-CE1 3.44Å; P173-Y355 HydrophobicContact CG-CD1 4.44Å; P173-Y355 HydrophobicContact CG-CD2 3.85Å; P173-Y355 HydrophobicContact CG-CE1 4.49Å; P173-Y355 HydrophobicContact CG-CE2 3.9Å; P173-Y355 HydrophobicContact CG-CG 4.12Å; E351-Y355 HydrophobicContact CG-CD2 4.03Å; E351-Y355 HydrophobicContact CG-CE2 3.79Å; E351-Y355 VanDerWaalsContact O-CD2 3.31Å; E351-Y355 WeakPolarHBondContact O-CD2 3.37Å; E351-Y355 PolarHBondContact O-N 2.83Å; E351-Y355 WeakPolarHBondContact OE1-CE2 3.29Å; Y352-Y355 AromaticContact CD1-CD2 3.58Å; Y352-Y355 HydrophobicContact CD1-CD2 3.58Å; Y352-Y355 HydrophobicContact CD1-CE2 4.33Å; Y352-Y355 HydrophobicContact CD1-CG 4.13Å; Y352-Y355 AromaticContact CE1-CD2 3.53Å; Y352-Y355 HydrophobicContact CE1-CD2 3.53Å; Y352-Y355 AromaticContact CE1-CE2 3.85Å; Y352-Y355 HydrophobicContact CE1-CE2 3.85Å; Y352-Y355 HydrophobicContact CE1-CG 4.23Å; Y352-Y355 HydrophobicContact CG-CD2 4.32Å; Y352-Y355 PolarHBondContact O-N 3.06Å; V353-Y355 VanDerWaalsContact C-N 3.32Å; V353-Y355 PolarHBondContact O-N 2.74Å; Y355-E357 VanDerWaalsContact C-N 3.27Å; Y355-E357 PolarHBondContact O-N 3.47Å; Y355-M358 WeakPolarHBondContact O-CB 3.02Å; Y355-M358 PolarHBondContact O-N 3.16Å; Y355-M358 VanDerWaalsContact O-N 3.08Å; Y355-L359 VanDerWaalsContact O-CG 3.27Å; Y355-L359 WeakPolarHBondContact O-CG 3.48Å; Y355-L359 PolarHBondContact O-N 2.8Å; Y355-W415 AromaticContact CD1-CD1 3.62Å; Y355-W415 AromaticContact CD1-NE1 3.26Å; Y355-W415 VanDerWaalsContact CD1-NE1 3.26Å; Y355-W415 AromaticContact CE1-CD1 3.67Å; Y355-W415 AromaticContact CE1-NE1 3.74Å; Y355-W415 AromaticContact CG-NE1 3.49Å
356	S	96.4	Very high	94.6	Very high	1 Å²	1	30.1 Å²	30.1	1%	0.007	15%	0.15	C	C	.	.	H	α-helix	trans	-60.5	-39.4	-179.7	92.1	0	0	0	0	111.5	S275 Y352 V353 L354 L359 M360	S275-S356 PolarHBondContact OG-OG 3.13Å; Y352-S356 PolarHBondContact O-N 3.45Å; Y352-S356 VanDerWaalsContact O-N 3.14Å; V353-S356 WeakPolarHBondContact O-CB 3.42Å; V353-S356 PolarHBondContact O-N 2.97Å; V353-S356 PolarHBondContact O-OG 2.87Å; L354-S356 VanDerWaalsContact C-N 3.34Å; S356-L359 PolarHBondContact O-N 3.43Å; S356-M360 WeakPolarHBondContact O-CG 3.31Å; S356-M360 PolarHBondContact O-N 2.94Å; S356-M360 VanDerWaalsContact O-N 3.11Å
357	E	93.3	Very high	94.5	Very high	123 Å²	123	30.2 Å²	30.2	58%	0.575	15%	0.151	S	C	*	.	H	α-helix	trans	-62.8	-44.4	172.1	-58.9	-162.6	149.8	0	0	112.8	Y355 L359 M360 G361	Y355-E357 VanDerWaalsContact C-N 3.27Å; Y355-E357 PolarHBondContact O-N 3.47Å; E357-L359 VanDerWaalsContact C-N 3.35Å; E357-L359 PolarHBondContact O-N 2.95Å; E357-M360 PolarHBondContact O-N 3.3Å; E357-G361 PolarHBondContact O-N 3.46Å
358	M	95.4	Very high	94.5	Very high	10 Å²	10	30.2 Å²	30.2	5%	0.049	15%	0.147	C	C	.	.	H	α-helix	trans	-58.9	-45.9	176.2	175	58.4	60.1	0	0	111.4	K159 E163 I170 I171 L354 Y355 G361 V362	K159-M358 VanDerWaalsContact CE-CE 3.42Å; K159-M358 VanDerWaalsContact NZ-CE 3.3Å; E163-M358 WeakPolarHBondContact OE1-CE 3.41Å; I170-M358 HydrophobicContact CG2-CG 4.13Å; I171-M358 HydrophobicContact CB-CE 4.08Å; I171-M358 HydrophobicContact CB-SD 4.36Å; I171-M358 VanDerWaalsContact O-CE 3.28Å; I171-M358 WeakPolarHBondContact O-CE 3.33Å; I171-M358 WeakPolarHBondContact O-CG 3.43Å; L354-M358 PolarHBondContact O-N 3.33Å; Y355-M358 WeakPolarHBondContact O-CB 3.02Å; Y355-M358 PolarHBondContact O-N 3.16Å; Y355-M358 VanDerWaalsContact O-N 3.08Å; M358-G361 CarbonylContact O-C 3.5Å; M358-G361 WeakPolarHBondContact O-CA 3.1Å; M358-G361 PolarHBondContact O-N 3.41Å; M358-G361 VanDerWaalsContact O-N 3.09Å; M358-V362 HydrophobicContact CG-CG2 4.28Å; M358-V362 WeakPolarHBondContact O-CG2 3.44Å; M358-V362 PolarHBondContact O-N 3.31Å; M358-V362 HydrophobicContact SD-CG2 3.94Å
359	L	96.9	Very high	94.3	Very high	1 Å²	1	29.7 Å²	29.7	1%	0.005	14%	0.143	C	C	.	.	H	α-helix	trans	-64	-42.6	-178.7	-64.4	169.1	0	0	0	111.7	I170 I271 F274 Y355 S356 E357 G361 V362 M363 W412 W415	I170-L359 HydrophobicContact CB-CD2 4.5Å; I170-L359 HydrophobicContact CD1-CD2 3.58Å; I170-L359 HydrophobicContact CG1-CD2 3.82Å; I170-L359 HydrophobicContact CG2-CD2 3.83Å; I271-L359 HydrophobicContact CD1-CB 3.89Å; I271-L359 HydrophobicContact CG1-CB 3.93Å; I271-L359 HydrophobicContact CG1-CD1 4.31Å; I271-L359 HydrophobicContact CG2-CB 3.98Å; F274-L359 HydrophobicContact CD1-CD1 4.3Å; F274-L359 HydrophobicContact CE1-CD1 4.3Å; Y355-L359 VanDerWaalsContact O-CG 3.27Å; Y355-L359 WeakPolarHBondContact O-CG 3.48Å; Y355-L359 PolarHBondContact O-N 2.8Å; S356-L359 PolarHBondContact O-N 3.43Å; E357-L359 VanDerWaalsContact C-N 3.35Å; E357-L359 PolarHBondContact O-N 2.95Å; L359-G361 VanDerWaalsContact C-N 3.28Å; L359-G361 PolarHBondContact O-N 2.97Å; L359-V362 PolarHBondContact O-N 3.3Å; L359-M363 WeakPolarHBondContact O-CG 3.49Å; L359-M363 PolarHBondContact O-N 3.45Å; L359-W412 HydrophobicContact CD1-CZ3 4.14Å; L359-W412 HydrophobicContact CD2-CE3 4.19Å; L359-W412 HydrophobicContact CD2-CZ3 3.84Å; L359-W412 HydrophobicContact CG-CZ3 4.48Å; L359-W415 HydrophobicContact CD1-CD2 4.26Å; L359-W415 HydrophobicContact CD1-CE3 4.23Å; L359-W415 HydrophobicContact CD1-CH2 3.53Å; L359-W415 HydrophobicContact CD1-CZ2 3.53Å; L359-W415 HydrophobicContact CD1-CZ3 3.88Å; L359-W415 HydrophobicContact CD2-CD2 4.17Å; L359-W415 HydrophobicContact CD2-CE3 4.35Å
360	M	94.4	Very high	94.1	Very high	88 Å²	88	30.8 Å²	30.8	43%	0.433	15%	0.148	S	C	.	.	H	α-helix	trans	-58.8	-41.3	171.3	-70.4	-172.6	-70.5	0	0	111.5	I271 S356 E357 K364	I271-M360 HydrophobicContact CG2-CG 3.61Å; S356-M360 WeakPolarHBondContact O-CG 3.31Å; S356-M360 PolarHBondContact O-N 2.94Å; S356-M360 VanDerWaalsContact O-N 3.11Å; E357-M360 PolarHBondContact O-N 3.3Å; M360-K364 VanDerWaalsContact O-CB 3.29Å; M360-K364 WeakPolarHBondContact O-CB 3.49Å; M360-K364 PolarHBondContact O-N 3.49Å
361	G	93.1	Very high	93.9	Very high	20 Å²	20	29 Å²	29	21%	0.206	14%	0.141	C	C	.	.	H	α-helix	trans	-62.7	-44.2	174.5	0	0	0	0	0	113.7	E357 M358 L359 K364 R365	E357-G361 PolarHBondContact O-N 3.46Å; M358-G361 CarbonylContact O-C 3.5Å; M358-G361 WeakPolarHBondContact O-CA 3.1Å; M358-G361 PolarHBondContact O-N 3.41Å; M358-G361 VanDerWaalsContact O-N 3.09Å; L359-G361 VanDerWaalsContact C-N 3.28Å; L359-G361 PolarHBondContact O-N 2.97Å; G361-K364 PolarHBondContact O-N 3.03Å; G361-R365 WeakPolarHBondContact O-CG 3.39Å; G361-R365 PolarHBondContact O-N 3Å
362	V	95.4	Very high	93.6	Very high	1 Å²	1	31 Å²	31	1%	0.006	15%	0.15	C	C	.	.	H	α-helix	trans	-62.5	-49.4	176.9	166.1	0	0	0	0	111.2	L169 I170 M358 L359 K364 R365 R366 L408	L169-V362 WeakPolarHBondContact O-CG2 3.47Å; I170-V362 HydrophobicContact CG1-CG2 4.43Å; M358-V362 HydrophobicContact CG-CG2 4.28Å; M358-V362 WeakPolarHBondContact O-CG2 3.44Å; M358-V362 PolarHBondContact O-N 3.31Å; M358-V362 HydrophobicContact SD-CG2 3.94Å; L359-V362 PolarHBondContact O-N 3.3Å; V362-K364 VanDerWaalsContact C-N 3.34Å; V362-K364 PolarHBondContact O-N 3.48Å; V362-R365 VanDerWaalsContact CG2-NH2 3.25Å; V362-R365 PolarHBondContact O-N 2.99Å; V362-R366 PolarHBondContact O-N 2.93Å; V362-L408 HydrophobicContact CG1-CD1 3.42Å; V362-L408 VanDerWaalsContact CG1-CD1 3.42Å; V362-L408 HydrophobicContact CG1-CD2 3.96Å; V362-L408 HydrophobicContact CG1-CG 4.31Å
363	M	93.7	Very high	93.3	Very high	4 Å²	4	31.7 Å²	31.7	2%	0.02	15%	0.154	C	C	.	.	H	α-helix	trans	-59	-45.2	176.5	-74.9	-58	-65.8	0	0	111.8	F264 M267 N268 I271 L359 R365 R366 D367 L408	F264-M363 HydrophobicContact CB-CE 4.18Å; F264-M363 HydrophobicContact CD1-CE 4.26Å; F264-M363 WeakPolarHBondContact O-CE 3.42Å; M267-M363 HydrophobicContact CE-CE 4.38Å; M267-M363 HydrophobicContact CE-SD 3.75Å; M267-M363 HydrophobicContact CG-SD 3.94Å; M267-M363 HydrophobicContact SD-SD 4.01Å; N268-M363 HydrophobicContact CB-CE 4.11Å; I271-M363 HydrophobicContact CD1-CG 3.34Å; I271-M363 HydrophobicContact CD1-SD 4.18Å; L359-M363 WeakPolarHBondContact O-CG 3.49Å; L359-M363 PolarHBondContact O-N 3.45Å; M363-R365 VanDerWaalsContact C-N 3.32Å; M363-R365 PolarHBondContact O-N 3.44Å; M363-R366 PolarHBondContact O-N 3.02Å; M363-D367 WeakPolarHBondContact O-CB 3.44Å; M363-D367 PolarHBondContact O-N 2.92Å; M363-L408 HydrophobicContact SD-CD2 3.88Å
364	K	91.9	Very high	93	Very high	115 Å²	115	32.6 Å²	32.6	50%	0.5	16%	0.159	S	C	.	.	H	α-helix	trans	-61.2	-38.6	176.8	-175.5	173.5	-177.7	173.5	0	112.5	S253 M360 G361 V362 Q368	S253-K364 VanDerWaalsContact OG-CE 3.29Å; S253-K364 WeakPolarHBondContact OG-CE 3.48Å; M360-K364 VanDerWaalsContact O-CB 3.29Å; M360-K364 WeakPolarHBondContact O-CB 3.49Å; M360-K364 PolarHBondContact O-N 3.49Å; G361-K364 PolarHBondContact O-N 3.03Å; V362-K364 VanDerWaalsContact C-N 3.34Å; V362-K364 PolarHBondContact O-N 3.48Å; K364-Q368 VanDerWaalsContact O-CG 3.22Å; K364-Q368 WeakPolarHBondContact O-CG 3.38Å; K364-Q368 PolarHBondContact O-N 3.14Å
365	R	92	Very high	92.6	Very high	55 Å²	55	34.3 Å²	34.3	21%	0.208	17%	0.172	C	C	.	.	H	α-helix	trans	-67.9	-44	175.4	-73.9	-177.3	-61.6	-111.4	6.9	111.6	E163 P167 G361 V362 M363 D367 Q368 I369	E163-R365 IonicContact OE1-NH1 3.84Å; P167-R365 HydrophobicContact CB-CB 4.43Å; P167-R365 WeakPolarHBondContact O-CB 3.45Å; P167-R365 WeakPolarHBondContact O-CD 3.47Å; P167-R365 PolarHBondContact O-NE 2.96Å; G361-R365 WeakPolarHBondContact O-CG 3.39Å; G361-R365 PolarHBondContact O-N 3Å; V362-R365 VanDerWaalsContact CG2-NH2 3.25Å; V362-R365 PolarHBondContact O-N 2.99Å; M363-R365 VanDerWaalsContact C-N 3.32Å; M363-R365 PolarHBondContact O-N 3.44Å; R365-D367 VanDerWaalsContact C-N 3.33Å; R365-D367 PolarHBondContact O-N 2.92Å; R365-Q368 PolarHBondContact O-N 2.76Å; R365-I369 WeakPolarHBondContact O-CG1 3.35Å; R365-I369 PolarHBondContact O-N 3.49Å
366	R	93.3	Very high	92.3	Very high	3 Å²	3	36.6 Å²	36.6	1%	0.011	18%	0.182	C	C	.	.	H	α-helix	trans	-56.4	-47	173.3	179	-95.4	169.7	-135.1	-14.2	111.6	T168 F264 V362 M363 Q368 I369 Q370 N405 L408	T168-R366 HydrophobicContact CG2-CB 3.82Å; F264-R366 HydrophobicContact CD1-CG 4.43Å; F264-R366 HydrophobicContact CE1-CG 4.26Å; V362-R366 PolarHBondContact O-N 2.93Å; M363-R366 PolarHBondContact O-N 3.02Å; R366-Q368 VanDerWaalsContact C-N 3.35Å; R366-Q368 PolarHBondContact O-N 3.36Å; R366-I369 PolarHBondContact O-N 3.47Å; R366-Q370 PolarHBondContact O-N 3.21Å; R366-Q370 VanDerWaalsContact O-N 3.1Å; R366-N405 PolarHBondContact NE-OD1 3.06Å; R366-N405 PolarHBondContact NH2-OD1 3.36Å; R366-L408 HydrophobicContact CB-CD2 4.08Å; R366-L408 HydrophobicContact CG-CD2 4.1Å
367	D	91.5	Very high	91.9	Very high	16 Å²	16	39.5 Å²	39.5	9%	0.086	20%	0.199	C	C	.	.	H	α-helix	trans	-68.7	-31.4	-178.9	-83	-8.4	0	0	0	113.1	V257 R260 M363 R365 Q370 T371	V257-D367 HydrophobicContact CG2-CB 3.45Å; V257-D367 VanDerWaalsContact CG2-CB 3.45Å; R260-D367 IonicContact CZ-OD2 2.65Å; R260-D367 VanDerWaalsContact CZ-OD2 3.28Å; R260-D367 IonicContact NE-OD1 3.77Å; R260-D367 IonicContact NE-OD2 2.76Å; R260-D367 PolarHBondContact NE-OD2 3.31Å; R260-D367 IonicContact NH2-OD2 2.7Å; R260-D367 PolarHBondContact NH2-OD2 3.11Å; M363-D367 WeakPolarHBondContact O-CB 3.44Å; M363-D367 PolarHBondContact O-N 2.92Å; R365-D367 VanDerWaalsContact C-N 3.33Å; R365-D367 PolarHBondContact O-N 2.92Å; D367-Q370 PolarHBondContact O-N 2.94Å; D367-T371 WeakPolarHBondContact O-CB 3.27Å; D367-T371 PolarHBondContact O-N 3Å; D367-T371 PolarHBondContact O-OG1 3.4Å
368	Q	90.1	Very high	91.7	Very high	50 Å²	50	37.2 Å²	37.2	23%	0.234	19%	0.188	C	C	.	.	H	α-helix	trans	-64.2	-37.4	170.6	-76.5	167	1.4	0	0	112.5	S253 K364 R365 R366 T371 E372	S253-Q368 PolarHBondContact OG-NE2 3.28Å; K364-Q368 VanDerWaalsContact O-CG 3.22Å; K364-Q368 WeakPolarHBondContact O-CG 3.38Å; K364-Q368 PolarHBondContact O-N 3.14Å; R365-Q368 PolarHBondContact O-N 2.76Å; R366-Q368 VanDerWaalsContact C-N 3.35Å; R366-Q368 PolarHBondContact O-N 3.36Å; Q368-T371 PolarHBondContact O-N 3.07Å; Q368-E372 WeakPolarHBondContact O-CB 3.39Å; Q368-E372 PolarHBondContact O-N 2.87Å
369	I	90.9	Very high	91.4	Very high	13 Å²	13	37.8 Å²	37.8	7%	0.067	20%	0.195	C	C	.	.	H	α-helix	trans	-67.5	-43.6	175.4	-57.6	167.3	0	0	0	110.2	P167 T168 R365 R366 T371 E372 L373 K400 V401 A404	P167-I369 HydrophobicContact CG-CD1 4.45Å; T168-I369 HydrophobicContact CG2-CD1 4.22Å; R365-I369 WeakPolarHBondContact O-CG1 3.35Å; R365-I369 PolarHBondContact O-N 3.49Å; R366-I369 PolarHBondContact O-N 3.47Å; I369-T371 VanDerWaalsContact C-N 3.33Å; I369-T371 PolarHBondContact O-N 3.33Å; I369-E372 WeakPolarHBondContact O-CB 3.42Å; I369-E372 PolarHBondContact O-N 2.99Å; I369-L373 PolarHBondContact O-N 3.1Å; I369-K400 HydrophobicContact CG2-CD 3.86Å; I369-K400 HydrophobicContact CG2-CG 3.84Å; I369-V401 HydrophobicContact CG2-CG2 3.7Å; I369-A404 HydrophobicContact CD1-CB 3.85Å
370	Q	91.4	Very high	90.9	Very high	23 Å²	23	40.2 Å²	40.2	11%	0.107	21%	0.207	C	C	.	.	H	α-helix	trans	-58.4	-44.7	172.6	-175.4	70.4	63.8	0	0	111.6	V257 R366 D367 E372 L373 D374	V257-Q370 HydrophobicContact CG1-CG 4.08Å; R366-Q370 PolarHBondContact O-N 3.21Å; R366-Q370 VanDerWaalsContact O-N 3.1Å; D367-Q370 PolarHBondContact O-N 2.94Å; Q370-E372 VanDerWaalsContact C-N 3.28Å; Q370-E372 PolarHBondContact O-N 3.14Å; Q370-L373 WeakPolarHBondContact O-CB 3.49Å; Q370-L373 PolarHBondContact O-N 3.38Å; Q370-D374 PolarHBondContact NE2-OD1 3.49Å; Q370-D374 VanDerWaalsContact O-CG 3.24Å; Q370-D374 PolarHBondContact O-N 2.95Å
371	T	90	Very high	90.5	Very high	18 Å²	18	40.6 Å²	40.6	11%	0.11	22%	0.215	C	C	.	.	H	α-helix	trans	-66.2	-32.2	-178.8	-53.4	0	0	0	0	111.9	D367 Q368 I369 S375	D367-T371 WeakPolarHBondContact O-CB 3.27Å; D367-T371 PolarHBondContact O-N 3Å; D367-T371 PolarHBondContact O-OG1 3.4Å; Q368-T371 PolarHBondContact O-N 3.07Å; I369-T371 VanDerWaalsContact C-N 3.33Å; I369-T371 PolarHBondContact O-N 3.33Å; T371-S375 VanDerWaalsContact O-CB 3.27Å; T371-S375 WeakPolarHBondContact O-CB 3.48Å; T371-S375 PolarHBondContact O-N 2.69Å
372	E	89.6	Confident	90.1	Very high	73 Å²	73	49 Å²	49	34%	0.341	24%	0.242	S	C	.	.	H	α-helix	trans	-65.1	-44	173.9	-172.2	172.1	-141.4	0	0	111.3	Q368 I369 Q370 K376 L397 K400	Q368-E372 WeakPolarHBondContact O-CB 3.39Å; Q368-E372 PolarHBondContact O-N 2.87Å; I369-E372 WeakPolarHBondContact O-CB 3.42Å; I369-E372 PolarHBondContact O-N 2.99Å; Q370-E372 VanDerWaalsContact C-N 3.28Å; Q370-E372 PolarHBondContact O-N 3.14Å; E372-K376 VanDerWaalsContact O-CG 3.31Å; E372-K376 WeakPolarHBondContact O-CG 3.26Å; E372-K376 PolarHBondContact O-N 3.15Å; E372-L397 HydrophobicContact CB-CD2 4.43Å; E372-L397 HydrophobicContact CG-CD1 4.01Å; E372-L397 HydrophobicContact CG-CD2 3.81Å; E372-L397 WeakPolarHBondContact OE2-CD2 3.18Å; E372-K400 IonicContact OE2-NZ 3.88Å; E372-K400 PolarHBondContact OE2-NZ 2.84Å
373	L	90.9	Very high	89.1	Confident	15 Å²	15	55.6 Å²	55.6	8%	0.079	27%	0.27	C	S	.	.	H	α-helix	trans	-62.7	-55	173	175.2	59.4	0	0	0	111.6	I369 Q370 S375 K376 V377 I394 L397 E398 V401	I369-L373 PolarHBondContact O-N 3.1Å; Q370-L373 WeakPolarHBondContact O-CB 3.49Å; Q370-L373 PolarHBondContact O-N 3.38Å; L373-S375 PolarHBondContact O-N 3.45Å; L373-K376 WeakPolarHBondContact O-CA 3.38Å; L373-K376 PolarHBondContact O-N 3.34Å; L373-V377 HydrophobicContact CD1-CG2 3.97Å; L373-V377 HydrophobicContact CG-CG2 4.41Å; L373-V377 PolarHBondContact O-N 3.42Å; L373-I394 HydrophobicContact CD1-CG2 4Å; L373-L397 HydrophobicContact CB-CB 4.12Å; L373-L397 HydrophobicContact CD1-CB 3.86Å; L373-E398 HydrophobicContact CD1-CG 3.71Å; L373-E398 HydrophobicContact CD2-CG 3.96Å; L373-V401 HydrophobicContact CB-CG2 4.13Å; L373-V401 HydrophobicContact CD2-CB 4.32Å; L373-V401 HydrophobicContact CD2-CG2 3.86Å
374	D	89.6	Confident	87.9	Confident	31 Å²	31	64.9 Å²	64.9	17%	0.166	31%	0.311	C	S	.	.	H	α-helix	trans	-54.2	-43.1	-178.6	-66.5	0.9	0	0	0	110.9	Q370 K376 V377 E378	Q370-D374 PolarHBondContact NE2-OD1 3.49Å; Q370-D374 VanDerWaalsContact O-CG 3.24Å; Q370-D374 PolarHBondContact O-N 2.95Å; D374-K376 VanDerWaalsContact C-N 3.3Å; D374-K376 PolarHBondContact O-N 2.91Å; D374-V377 PolarHBondContact O-N 3.35Å; D374-E378 WeakPolarHBondContact O-CB 3.37Å; D374-E378 WeakPolarHBondContact O-CG 3.48Å; D374-E378 PolarHBondContact O-N 3.34Å
375	S	88.3	Confident	86.6	Confident	51 Å²	51	62.8 Å²	62.8	36%	0.357	32%	0.315	S	S	.	.	H	α-helix	trans	-67.5	-25.1	178.1	-174.9	0	0	0	0	114	T371 L373 A379	T371-S375 VanDerWaalsContact O-CB 3.27Å; T371-S375 WeakPolarHBondContact O-CB 3.48Å; T371-S375 PolarHBondContact O-N 2.69Å; L373-S375 PolarHBondContact O-N 3.45Å; S375-A379 WeakPolarHBondContact O-CB 3.33Å; S375-A379 PolarHBondContact O-N 3.06Å; S375-A379 VanDerWaalsContact O-N 3.15Å
376	K	89.5	Confident	86.1	Confident	58 Å²	58	65.7 Å²	65.7	25%	0.252	33%	0.334	S	S	.	.	H	α-helix	trans	-83.5	-39.1	176.5	-71.6	-80.6	-173.9	166.6	0	111.1	E372 L373 D374 A379 L380 L390 E393 I394 L397	E372-K376 VanDerWaalsContact O-CG 3.31Å; E372-K376 WeakPolarHBondContact O-CG 3.26Å; E372-K376 PolarHBondContact O-N 3.15Å; L373-K376 WeakPolarHBondContact O-CA 3.38Å; L373-K376 PolarHBondContact O-N 3.34Å; D374-K376 VanDerWaalsContact C-N 3.3Å; D374-K376 PolarHBondContact O-N 2.91Å; K376-A379 WeakPolarHBondContact O-CB 3.44Å; K376-A379 PolarHBondContact O-N 2.9Å; K376-A379 VanDerWaalsContact O-N 3.12Å; K376-L380 PolarHBondContact O-N 3.12Å; K376-L390 HydrophobicContact CD-CD2 4.15Å; K376-E393 VanDerWaalsContact NZ-CD 3.31Å; K376-E393 IonicContact NZ-OE1 2.65Å; K376-E393 PolarHBondContact NZ-OE1 3.37Å; K376-E393 IonicContact NZ-OE2 2.67Å; K376-E393 PolarHBondContact NZ-OE2 3.03Å; K376-I394 HydrophobicContact CB-CD1 4.49Å; K376-I394 HydrophobicContact CB-CG1 3.81Å; K376-L397 HydrophobicContact CB-CD1 4.21Å; K376-L397 HydrophobicContact CG-CD1 3.7Å
377	V	89.3	Confident	85.6	Confident	61 Å²	61	67 Å²	67	37%	0.37	35%	0.346	S	S	.	.	H	α-helix	trans	-61.2	-45.8	170.9	175.9	0	0	0	0	110.9	L373 D374 A379 L380 T381 I394	L373-V377 HydrophobicContact CD1-CG2 3.97Å; L373-V377 HydrophobicContact CG-CG2 4.41Å; L373-V377 PolarHBondContact O-N 3.42Å; D374-V377 PolarHBondContact O-N 3.35Å; V377-A379 VanDerWaalsContact C-N 3.33Å; V377-A379 PolarHBondContact O-N 3Å; V377-L380 PolarHBondContact O-N 2.88Å; V377-T381 WeakPolarHBondContact O-CG2 3.44Å; V377-T381 PolarHBondContact O-N 3.09Å; V377-T381 VanDerWaalsContact O-N 3.07Å; V377-T381 PolarHBondContact O-OG1 3.03Å; V377-I394 HydrophobicContact CG2-CD1 4.12Å; V377-I394 HydrophobicContact CG2-CG1 4.17Å; V377-I394 HydrophobicContact CG2-CG2 4.15Å
378	E	88.7	Confident	85.4	Confident	75 Å²	75	73 Å²	73	35%	0.35	38%	0.378	S	S	.	.	H	α-helix	trans	-57.8	-43.9	170.1	-76.2	-176.3	-177.8	0	0	111.4	K258 D374 L380 T381 Y382	K258-E378 IonicContact NZ-OE1 3.41Å; K258-E378 PolarHBondContact NZ-OE1 2.89Å; K258-E378 IonicContact NZ-OE2 3.89Å; D374-E378 WeakPolarHBondContact O-CB 3.37Å; D374-E378 WeakPolarHBondContact O-CG 3.48Å; D374-E378 PolarHBondContact O-N 3.34Å; E378-L380 PolarHBondContact O-N 3.27Å; E378-T381 PolarHBondContact O-N 2.95Å; E378-T381 PolarHBondContact O-OG1 3.48Å; E378-Y382 WeakPolarHBondContact O-CD2 3.28Å; E378-Y382 PolarHBondContact O-N 2.99Å
379	A	88.3	Confident	85.2	Confident	22 Å²	22	75.7 Å²	75.7	18%	0.182	39%	0.393	C	S	.	.	H	α-helix	trans	-61.3	-43.3	177.9	0	0	0	0	0	112.9	S375 K376 V377 Y382 K383 L390	S375-A379 WeakPolarHBondContact O-CB 3.33Å; S375-A379 PolarHBondContact O-N 3.06Å; S375-A379 VanDerWaalsContact O-N 3.15Å; K376-A379 WeakPolarHBondContact O-CB 3.44Å; K376-A379 PolarHBondContact O-N 2.9Å; K376-A379 VanDerWaalsContact O-N 3.12Å; V377-A379 VanDerWaalsContact C-N 3.33Å; V377-A379 PolarHBondContact O-N 3Å; A379-Y382 PolarHBondContact O-N 3.24Å; A379-K383 VanDerWaalsContact O-CB 3.25Å; A379-K383 WeakPolarHBondContact O-CB 3.32Å; A379-K383 PolarHBondContact O-N 2.89Å; A379-L390 HydrophobicContact CB-CD2 4.48Å
380	L	87.9	Confident	85.1	Confident	52 Å²	52	76 Å²	76	27%	0.272	40%	0.395	S	S	.	.	H	α-helix	trans	-63.8	-40.8	177.8	179	64	0	0	0	112.2	K376 V377 E378 Y382 A387 L390 I394	K376-L380 PolarHBondContact O-N 3.12Å; V377-L380 PolarHBondContact O-N 2.88Å; E378-L380 PolarHBondContact O-N 3.27Å; L380-Y382 VanDerWaalsContact C-N 3.34Å; L380-Y382 PolarHBondContact O-N 3.46Å; L380-A387 HydrophobicContact CD1-CB 3.86Å; L380-L390 HydrophobicContact CB-CB 4.36Å; L380-L390 HydrophobicContact CB-CD1 4.46Å; L380-L390 HydrophobicContact CD1-CB 4.04Å; L380-L390 HydrophobicContact CD1-CD1 4.45Å; L380-I394 HydrophobicContact CB-CD1 3.83Å; L380-I394 HydrophobicContact CD2-CD1 3.61Å; L380-I394 HydrophobicContact CG-CD1 4.34Å
381	T	85.6	Confident	85	Confident	97 Å²	97	78.4 Å²	78.4	60%	0.595	41%	0.412	S	S	*	.	H	α-helix	trans	-66.1	-33.3	179.1	55.4	0	0	0	0	113.3	V377 E378	V377-T381 WeakPolarHBondContact O-CG2 3.44Å; V377-T381 PolarHBondContact O-N 3.09Å; V377-T381 VanDerWaalsContact O-N 3.07Å; V377-T381 PolarHBondContact O-OG1 3.03Å; E378-T381 PolarHBondContact O-N 2.95Å; E378-T381 PolarHBondContact O-OG1 3.48Å
382	Y	83.9	Confident	85.1	Confident	197 Å²	197	82.8 Å²	82.8	77%	0.773	43%	0.431	S	S	*	.	H	α-helix	trans	-97.1	-21.6	-179.3	-65.9	-65.4	0	0	0	115	E378 A379 L380	E378-Y382 WeakPolarHBondContact O-CD2 3.28Å; E378-Y382 PolarHBondContact O-N 2.99Å; A379-Y382 PolarHBondContact O-N 3.24Å; L380-Y382 VanDerWaalsContact C-N 3.34Å; L380-Y382 PolarHBondContact O-N 3.46Å
383	K	75.6	Confident	85.3	Confident	138 Å²	138	83.2 Å²	83.2	60%	0.6	43%	0.433	S	S	*	.			trans	-117.3	110.9	-178.4	-60.2	-179.9	178.7	179.2	0	110.9	A379	A379-K383 VanDerWaalsContact O-CB 3.25Å; A379-K383 WeakPolarHBondContact O-CB 3.32Å; A379-K383 PolarHBondContact O-N 2.89Å
384	K	67.9	Low	85.4	Confident	200 Å²	200	83 Å²	83	87%	0.87	43%	0.432	S	S	*	.			trans	-81.8	-13.6	175.1	-67.4	-171.7	176.3	-175.2	0	114.5
385	A	64.2	Low	85.6	Confident	70 Å²	70	82.7 Å²	82.7	58%	0.579	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	142.7	168.5	0	0	0	0	0	109	A387	A385-A387 PolarHBondContact O-N 3.41Å
386	D	80.8	Confident	85.9	Confident	116 Å²	116	85.8 Å²	85.8	62%	0.62	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	60	25.7	179.1	-46.2	-37.2	0	0	0	114.9	D388 L389 L390	D386-D388 VanDerWaalsContact C-N 3.32Å; D386-D388 PolarHBondContact O-N 2.95Å; D386-L389 HydrophobicContact CB-CB 4.48Å; D386-L389 HydrophobicContact CB-CD1 4.42Å; D386-L389 PolarHBondContact O-N 3.32Å; D386-L390 WeakPolarHBondContact O-CG 3.1Å; D386-L390 PolarHBondContact O-N 2.89Å
387	A	83.8	Confident	86.1	Confident	31 Å²	31	83.8 Å²	83.8	26%	0.256	44%	0.435	S	S	.	.	H	α-helix	trans	-56.5	-40	-176.9	0	0	0	0	0	113.8	L380 A385 L390 T391	L380-A387 HydrophobicContact CD1-CB 3.86Å; A385-A387 PolarHBondContact O-N 3.41Å; A387-L390 PolarHBondContact O-N 2.87Å; A387-T391 WeakPolarHBondContact O-CB 3.41Å; A387-T391 PolarHBondContact O-N 2.89Å; A387-T391 PolarHBondContact O-OG1 3.49Å
388	D	86.1	Confident	86.4	Confident	143 Å²	143	85.8 Å²	85.8	77%	0.765	44%	0.44	S	S	*	.	H	α-helix	trans	-66.2	-43.3	178.7	-59.3	-27	0	0	0	111.5	D386 T391 E392	D386-D388 VanDerWaalsContact C-N 3.32Å; D386-D388 PolarHBondContact O-N 2.95Å; D388-T391 PolarHBondContact O-N 3.11Å; D388-E392 PolarHBondContact O-N 3.33Å
389	L	87.7	Confident	86.7	Confident	105 Å²	105	87.2 Å²	87.2	55%	0.55	45%	0.45	S	S	.	.	H	α-helix	trans	-65.5	-43.3	176.2	-71.7	172.5	0	0	0	111.6	D386 T391 E392 E393	D386-L389 HydrophobicContact CB-CB 4.48Å; D386-L389 HydrophobicContact CB-CD1 4.42Å; D386-L389 PolarHBondContact O-N 3.32Å; L389-T391 VanDerWaalsContact C-N 3.28Å; L389-T391 PolarHBondContact O-N 2.97Å; L389-E392 PolarHBondContact O-N 2.91Å; L389-E393 WeakPolarHBondContact O-CG 3.49Å; L389-E393 PolarHBondContact O-N 2.61Å
390	L	87.9	Confident	87	Confident	19 Å²	19	90.4 Å²	90.4	10%	0.099	46%	0.46	C	S	.	.	H	α-helix	trans	-62.5	-36.4	175.3	-74.8	172.6	0	0	0	111.6	K376 A379 L380 D386 A387 E393 I394	K376-L390 HydrophobicContact CD-CD2 4.15Å; A379-L390 HydrophobicContact CB-CD2 4.48Å; L380-L390 HydrophobicContact CB-CB 4.36Å; L380-L390 HydrophobicContact CB-CD1 4.46Å; L380-L390 HydrophobicContact CD1-CB 4.04Å; L380-L390 HydrophobicContact CD1-CD1 4.45Å; D386-L390 WeakPolarHBondContact O-CG 3.1Å; D386-L390 PolarHBondContact O-N 2.89Å; A387-L390 PolarHBondContact O-N 2.87Å; L390-E393 PolarHBondContact O-N 3.05Å; L390-I394 WeakPolarHBondContact O-CB 3.41Å; L390-I394 WeakPolarHBondContact O-CD1 3.46Å; L390-I394 WeakPolarHBondContact O-CG1 3.27Å; L390-I394 PolarHBondContact O-N 2.78Å
391	T	90.1	Very high	87.3	Confident	75 Å²	75	88.5 Å²	88.5	46%	0.46	45%	0.45	S	S	.	.	H	α-helix	trans	-67.2	-41.9	176.3	-55.5	0	0	0	0	111.3	A387 D388 L389 I394 G395	A387-T391 WeakPolarHBondContact O-CB 3.41Å; A387-T391 PolarHBondContact O-N 2.89Å; A387-T391 PolarHBondContact O-OG1 3.49Å; D388-T391 PolarHBondContact O-N 3.11Å; L389-T391 VanDerWaalsContact C-N 3.28Å; L389-T391 PolarHBondContact O-N 2.97Å; T391-I394 PolarHBondContact O-N 2.9Å; T391-G395 PolarHBondContact O-N 3.15Å
392	E	92.1	Very high	87.7	Confident	110 Å²	110	89.5 Å²	89.5	51%	0.514	45%	0.448	S	S	.	.	H	α-helix	trans	-65.2	-38.9	174.4	-164.3	-165.2	151	0	0	112.3	D388 L389 K396	D388-E392 PolarHBondContact O-N 3.33Å; L389-E392 PolarHBondContact O-N 2.91Å; E392-K396 WeakPolarHBondContact O-CG 3.3Å; E392-K396 PolarHBondContact O-N 3.36Å; E392-K396 WeakPolarHBondContact OE1-CE 3.48Å; E392-K396 IonicContact OE1-NZ 3.31Å; E392-K396 PolarHBondContact OE1-NZ 3.09Å
393	E	92.1	Very high	88.2	Confident	81 Å²	81	84.3 Å²	84.3	38%	0.379	44%	0.44	S	S	.	.	H	α-helix	trans	-67.3	-37.6	174	-74	-175.4	144.5	0	0	112.7	K376 L389 L390 L397	K376-E393 VanDerWaalsContact NZ-CD 3.31Å; K376-E393 IonicContact NZ-OE1 2.65Å; K376-E393 PolarHBondContact NZ-OE1 3.37Å; K376-E393 IonicContact NZ-OE2 2.67Å; K376-E393 PolarHBondContact NZ-OE2 3.03Å; L389-E393 WeakPolarHBondContact O-CG 3.49Å; L389-E393 PolarHBondContact O-N 2.61Å; L390-E393 PolarHBondContact O-N 3.05Å; E393-L397 WeakPolarHBondContact O-CG 3.35Å; E393-L397 PolarHBondContact O-N 3.35Å; E393-L397 VanDerWaalsContact O-N 3.16Å
394	I	93.3	Very high	89.1	Confident	12 Å²	12	78.1 Å²	78.1	6%	0.062	41%	0.414	C	S	.	.	H	α-helix	trans	-63	-50.6	176	-76.6	161.8	0	0	0	110.2	L373 K376 V377 L380 L390 T391 K396 L397 E398	L373-I394 HydrophobicContact CD1-CG2 4Å; K376-I394 HydrophobicContact CB-CD1 4.49Å; K376-I394 HydrophobicContact CB-CG1 3.81Å; V377-I394 HydrophobicContact CG2-CD1 4.12Å; V377-I394 HydrophobicContact CG2-CG1 4.17Å; V377-I394 HydrophobicContact CG2-CG2 4.15Å; L380-I394 HydrophobicContact CB-CD1 3.83Å; L380-I394 HydrophobicContact CD2-CD1 3.61Å; L380-I394 HydrophobicContact CG-CD1 4.34Å; L390-I394 WeakPolarHBondContact O-CB 3.41Å; L390-I394 WeakPolarHBondContact O-CD1 3.46Å; L390-I394 WeakPolarHBondContact O-CG1 3.27Å; L390-I394 PolarHBondContact O-N 2.78Å; T391-I394 PolarHBondContact O-N 2.9Å; I394-K396 VanDerWaalsContact C-N 3.3Å; I394-K396 PolarHBondContact O-N 3.43Å; I394-L397 CarbonylContact O-C 3.55Å; I394-L397 WeakPolarHBondContact O-CA 3.3Å; I394-L397 WeakPolarHBondContact O-CB 3.47Å; I394-L397 PolarHBondContact O-N 3.3Å; I394-E398 HydrophobicContact CG2-CG 4.15Å; I394-E398 WeakPolarHBondContact O-CG 3.43Å; I394-E398 PolarHBondContact O-N 2.99Å
395	G	94.5	Very high	90.4	Very high	24 Å²	24	69.7 Å²	69.7	25%	0.247	38%	0.379	C	S	.	.	H	α-helix	trans	-56.5	-42.6	179.4	0	0	0	0	0	112.9	T391 L397 E398 D399	T391-G395 PolarHBondContact O-N 3.15Å; G395-L397 VanDerWaalsContact C-N 3.25Å; G395-L397 PolarHBondContact O-N 3.26Å; G395-E398 PolarHBondContact O-N 3.48Å; G395-D399 PolarHBondContact O-N 2.64Å
396	K	94.9	Very high	91.8	Very high	116 Å²	116	70.3 Å²	70.3	50%	0.504	37%	0.372	S	S	.	.	H	α-helix	trans	-63.7	-29	174.5	-69.1	169.3	-172.5	166.7	0	113.5	E392 I394 K400	E392-K396 WeakPolarHBondContact O-CG 3.3Å; E392-K396 PolarHBondContact O-N 3.36Å; E392-K396 WeakPolarHBondContact OE1-CE 3.48Å; E392-K396 IonicContact OE1-NZ 3.31Å; E392-K396 PolarHBondContact OE1-NZ 3.09Å; I394-K396 VanDerWaalsContact C-N 3.3Å; I394-K396 PolarHBondContact O-N 3.43Å; K396-K400 VanDerWaalsContact O-CB 3.27Å; K396-K400 WeakPolarHBondContact O-CB 3.31Å; K396-K400 PolarHBondContact O-N 3.06Å
397	L	93.4	Very high	92.5	Very high	16 Å²	16	66.3 Å²	66.3	8%	0.084	36%	0.356	C	S	.	.	H	α-helix	trans	-82.6	-32.2	176	-72.6	169.8	0	0	0	112	E372 L373 K376 E393 I394 G395 K400 V401	E372-L397 HydrophobicContact CB-CD2 4.43Å; E372-L397 HydrophobicContact CG-CD1 4.01Å; E372-L397 HydrophobicContact CG-CD2 3.81Å; E372-L397 WeakPolarHBondContact OE2-CD2 3.18Å; L373-L397 HydrophobicContact CB-CB 4.12Å; L373-L397 HydrophobicContact CD1-CB 3.86Å; K376-L397 HydrophobicContact CB-CD1 4.21Å; K376-L397 HydrophobicContact CG-CD1 3.7Å; E393-L397 WeakPolarHBondContact O-CG 3.35Å; E393-L397 PolarHBondContact O-N 3.35Å; E393-L397 VanDerWaalsContact O-N 3.16Å; I394-L397 CarbonylContact O-C 3.55Å; I394-L397 WeakPolarHBondContact O-CA 3.3Å; I394-L397 WeakPolarHBondContact O-CB 3.47Å; I394-L397 PolarHBondContact O-N 3.3Å; G395-L397 VanDerWaalsContact C-N 3.25Å; G395-L397 PolarHBondContact O-N 3.26Å; L397-K400 HydrophobicContact CD2-CD 3.97Å; L397-K400 PolarHBondContact O-N 3.41Å; L397-V401 WeakPolarHBondContact O-CB 3.33Å; L397-V401 VanDerWaalsContact O-CG2 3.28Å; L397-V401 WeakPolarHBondContact O-CG2 3.48Å; L397-V401 PolarHBondContact O-N 3.21Å
398	E	95	Very high	93.1	Very high	103 Å²	103	64.9 Å²	64.9	48%	0.481	34%	0.344	S	S	.	.	H	α-helix	trans	-61.5	-52.7	170.7	-69	174.3	145.7	0	0	110.1	L373 I394 G395 K400 V401 E402	L373-E398 HydrophobicContact CD1-CG 3.71Å; L373-E398 HydrophobicContact CD2-CG 3.96Å; I394-E398 HydrophobicContact CG2-CG 4.15Å; I394-E398 WeakPolarHBondContact O-CG 3.43Å; I394-E398 PolarHBondContact O-N 2.99Å; G395-E398 PolarHBondContact O-N 3.48Å; E398-K400 VanDerWaalsContact C-N 3.28Å; E398-K400 PolarHBondContact O-N 3.16Å; E398-V401 PolarHBondContact O-N 2.84Å; E398-V401 VanDerWaalsContact O-N 3.13Å; E398-E402 PolarHBondContact O-N 2.86Å
399	D	96.1	Very high	93.5	Very high	105 Å²	105	61.5 Å²	61.5	56%	0.561	32%	0.322	S	S	*	.	H	α-helix	trans	-53	-45.7	173.5	-68.8	-22.4	0	0	0	111.6	G395 E402 C403	G395-D399 PolarHBondContact O-N 2.64Å; D399-E402 PolarHBondContact O-N 3.23Å; D399-C403 WeakPolarHBondContact O-CB 3.12Å; D399-C403 PolarHBondContact O-N 3.4Å; D399-C403 PolarHBondContact O-SG 2.67Å; D399-C403 VanDerWaalsContact O-SG 3.38Å
400	K	94.1	Very high	93.8	Very high	89 Å²	89	59.8 Å²	59.8	39%	0.387	32%	0.323	S	S	.	.	H	α-helix	trans	-66.3	-39.8	180	-175.9	-169.9	173.8	-170.1	0	112.2	I369 E372 K396 L397 E398 A404	I369-K400 HydrophobicContact CG2-CD 3.86Å; I369-K400 HydrophobicContact CG2-CG 3.84Å; E372-K400 IonicContact OE2-NZ 3.88Å; E372-K400 PolarHBondContact OE2-NZ 2.84Å; K396-K400 VanDerWaalsContact O-CB 3.27Å; K396-K400 WeakPolarHBondContact O-CB 3.31Å; K396-K400 PolarHBondContact O-N 3.06Å; L397-K400 HydrophobicContact CD2-CD 3.97Å; L397-K400 PolarHBondContact O-N 3.41Å; E398-K400 VanDerWaalsContact C-N 3.28Å; E398-K400 PolarHBondContact O-N 3.16Å; K400-A404 WeakPolarHBondContact O-CB 3.31Å; K400-A404 PolarHBondContact O-N 2.97Å
401	V	93.4	Very high	94.2	Very high	12 Å²	12	59.1 Å²	59.1	7%	0.073	32%	0.319	C	S	.	.	H	α-helix	trans	-65.8	-44	174.3	166.2	0	0	0	0	110.1	I369 L373 L397 E398 A404 N405	I369-V401 HydrophobicContact CG2-CG2 3.7Å; L373-V401 HydrophobicContact CB-CG2 4.13Å; L373-V401 HydrophobicContact CD2-CB 4.32Å; L373-V401 HydrophobicContact CD2-CG2 3.86Å; L397-V401 WeakPolarHBondContact O-CB 3.33Å; L397-V401 VanDerWaalsContact O-CG2 3.28Å; L397-V401 WeakPolarHBondContact O-CG2 3.48Å; L397-V401 PolarHBondContact O-N 3.21Å; E398-V401 PolarHBondContact O-N 2.84Å; E398-V401 VanDerWaalsContact O-N 3.13Å; V401-A404 PolarHBondContact O-N 2.96Å; V401-N405 WeakPolarHBondContact CG1-ND2 3.48Å; V401-N405 VanDerWaalsContact O-CB 3.29Å; V401-N405 WeakPolarHBondContact O-CB 3.14Å; V401-N405 PolarHBondContact O-N 3.19Å; V401-N405 PolarHBondContact O-ND2 3.39Å
402	E	94.8	Very high	94.5	Very high	118 Å²	118	56.5 Å²	56.5	55%	0.551	30%	0.301	S	S	*	.	H	α-helix	trans	-62.1	-51.5	178	-176	175.2	173.4	0	0	111.5	E398 D399 A404 N405 N406	E398-E402 PolarHBondContact O-N 2.86Å; D399-E402 PolarHBondContact O-N 3.23Å; E402-A404 VanDerWaalsContact C-N 3.31Å; E402-A404 PolarHBondContact O-N 3.2Å; E402-N405 PolarHBondContact O-N 2.98Å; E402-N406 WeakPolarHBondContact O-CB 3.44Å; E402-N406 VanDerWaalsContact O-CG 3.31Å; E402-N406 PolarHBondContact O-N 3.19Å; E402-N406 PolarHBondContact O-ND2 3.26Å
403	C	94.6	Very high	94.7	Very high	88 Å²	88	56.5 Å²	56.5	60%	0.595	30%	0.301	S	S	*	.	H	α-helix	trans	-56.7	-44.4	174.7	-72.6	0	0	0	0	112.1	D399 N406 A407	D399-C403 WeakPolarHBondContact O-CB 3.12Å; D399-C403 PolarHBondContact O-N 3.4Å; D399-C403 PolarHBondContact O-SG 2.67Å; D399-C403 VanDerWaalsContact O-SG 3.38Å; C403-N406 PolarHBondContact O-N 3.13Å; C403-A407 VanDerWaalsContact O-CB 3.26Å; C403-A407 WeakPolarHBondContact O-CB 3.24Å; C403-A407 PolarHBondContact O-N 2.86Å
404	A	93.6	Very high	94.8	Very high	8 Å²	8	55.4 Å²	55.4	7%	0.066	29%	0.294	C	S	.	.	H	α-helix	trans	-64.2	-41.9	179.9	0	0	0	0	0	112.6	T168 I369 K400 V401 E402 L408	T168-A404 HydrophobicContact CG2-CB 3.88Å; T168-A404 WeakPolarHBondContact OG1-CA 3.48Å; T168-A404 PolarHBondContact OG1-O 2.67Å; I369-A404 HydrophobicContact CD1-CB 3.85Å; K400-A404 WeakPolarHBondContact O-CB 3.31Å; K400-A404 PolarHBondContact O-N 2.97Å; V401-A404 PolarHBondContact O-N 2.96Å; E402-A404 VanDerWaalsContact C-N 3.31Å; E402-A404 PolarHBondContact O-N 3.2Å; A404-L408 WeakPolarHBondContact O-CB 3.38Å; A404-L408 PolarHBondContact O-N 3.33Å; A404-L408 VanDerWaalsContact O-N 3.14Å
405	N	95	Very high	95	Very high	22 Å²	22	55.1 Å²	55.1	12%	0.118	29%	0.292	C	S	.	.	H	α-helix	trans	-65.4	-48.2	176.2	-72.7	-23.7	0	0	0	111.1	F264 R366 V401 E402 L408 K409	F264-N405 HydrophobicContact CE2-CB 4.16Å; F264-N405 WeakPolarHBondContact CE2-OD1 3.23Å; F264-N405 HydrophobicContact CZ-CB 3.64Å; F264-N405 WeakPolarHBondContact CZ-OD1 3.49Å; R366-N405 PolarHBondContact NE-OD1 3.06Å; R366-N405 PolarHBondContact NH2-OD1 3.36Å; V401-N405 WeakPolarHBondContact CG1-ND2 3.48Å; V401-N405 VanDerWaalsContact O-CB 3.29Å; V401-N405 WeakPolarHBondContact O-CB 3.14Å; V401-N405 PolarHBondContact O-N 3.19Å; V401-N405 PolarHBondContact O-ND2 3.39Å; E402-N405 PolarHBondContact O-N 2.98Å; N405-L408 PolarHBondContact O-N 3.25Å; N405-K409 VanDerWaalsContact O-CG 3.31Å; N405-K409 WeakPolarHBondContact O-CG 3.37Å; N405-K409 PolarHBondContact O-N 2.96Å
406	N	94.9	Very high	95.1	Very high	83 Å²	83	56 Å²	56	44%	0.444	29%	0.289	S	S	.	.	H	α-helix	trans	-65.6	-41.5	-178.3	-71	-18.5	0	0	0	111.9	E402 C403 K409 A410	E402-N406 WeakPolarHBondContact O-CB 3.44Å; E402-N406 VanDerWaalsContact O-CG 3.31Å; E402-N406 PolarHBondContact O-N 3.19Å; E402-N406 PolarHBondContact O-ND2 3.26Å; C403-N406 PolarHBondContact O-N 3.13Å; N406-K409 PolarHBondContact O-N 2.93Å; N406-A410 WeakPolarHBondContact O-CB 3.27Å; N406-A410 PolarHBondContact O-N 3Å; N406-A410 VanDerWaalsContact O-N 3.11Å
407	A	94.6	Very high	95.2	Very high	33 Å²	33	55 Å²	55	27%	0.273	29%	0.286	S	S	.	.	H	α-helix	trans	-60.9	-45.3	174.5	0	0	0	0	0	112.1	L169 C403 A410 D411	L169-A407 HydrophobicContact CD2-CB 4.02Å; C403-A407 VanDerWaalsContact O-CB 3.26Å; C403-A407 WeakPolarHBondContact O-CB 3.24Å; C403-A407 PolarHBondContact O-N 2.86Å; A407-A410 PolarHBondContact O-N 3.19Å; A407-D411 PolarHBondContact O-N 2.95Å; A407-D411 VanDerWaalsContact O-N 3.11Å
408	L	96.5	Very high	95.3	Very high	1 Å²	1	55.8 Å²	55.8	1%	0.005	29%	0.29	C	S	.	.	H	α-helix	trans	-63.9	-46.3	178.3	-179.6	45.9	0	0	0	111.7	F264 M267 V362 M363 R366 A404 N405 A410 D411 W412	F264-L408 HydrophobicContact CD1-CD2 4.34Å; F264-L408 HydrophobicContact CE1-CD2 3.94Å; F264-L408 HydrophobicContact CE1-CG 4.37Å; M267-L408 HydrophobicContact CE-CD2 3.96Å; M267-L408 HydrophobicContact CE-CG 3.99Å; M267-L408 HydrophobicContact SD-CD1 4.31Å; M267-L408 HydrophobicContact SD-CD2 4.49Å; M267-L408 HydrophobicContact SD-CG 4.23Å; V362-L408 HydrophobicContact CG1-CD1 3.42Å; V362-L408 VanDerWaalsContact CG1-CD1 3.42Å; V362-L408 HydrophobicContact CG1-CD2 3.96Å; V362-L408 HydrophobicContact CG1-CG 4.31Å; M363-L408 HydrophobicContact SD-CD2 3.88Å; R366-L408 HydrophobicContact CB-CD2 4.08Å; R366-L408 HydrophobicContact CG-CD2 4.1Å; A404-L408 WeakPolarHBondContact O-CB 3.38Å; A404-L408 PolarHBondContact O-N 3.33Å; A404-L408 VanDerWaalsContact O-N 3.14Å; N405-L408 PolarHBondContact O-N 3.25Å; L408-A410 VanDerWaalsContact C-N 3.34Å; L408-A410 PolarHBondContact O-N 2.65Å; L408-D411 PolarHBondContact O-N 3.28Å; L408-W412 WeakPolarHBondContact O-CB 3.4Å; L408-W412 PolarHBondContact O-N 2.97Å
409	K	95.2	Very high	95.4	Very high	71 Å²	71	51.7 Å²	51.7	31%	0.309	27%	0.271	S	S	.	.	H	α-helix	trans	-58.7	-44.6	178.1	-69.5	175.2	-163.1	-164.7	0	112.4	E263 F264 N405 N406 E413	E263-K409 WeakPolarHBondContact OE1-CE 3.3Å; E263-K409 IonicContact OE1-NZ 2.79Å; E263-K409 PolarHBondContact OE1-NZ 2.9Å; E263-K409 WeakPolarHBondContact OE2-CE 3.29Å; E263-K409 IonicContact OE2-NZ 3.65Å; E263-K409 PolarHBondContact OE2-NZ 3.35Å; F264-K409 HydrophobicContact CZ-CG 4.47Å; N405-K409 VanDerWaalsContact O-CG 3.31Å; N405-K409 WeakPolarHBondContact O-CG 3.37Å; N405-K409 PolarHBondContact O-N 2.96Å; N406-K409 PolarHBondContact O-N 2.93Å; K409-E413 PolarHBondContact O-N 3.42Å
410	A	94	Very high	95.5	Very high	69 Å²	69	51.9 Å²	51.9	57%	0.57	27%	0.269	S	S	*	.	H	α-helix	trans	-64.9	-45.3	-179.2	0	0	0	0	0	112.3	N406 A407 L408 R414	N406-A410 WeakPolarHBondContact O-CB 3.27Å; N406-A410 PolarHBondContact O-N 3Å; N406-A410 VanDerWaalsContact O-N 3.11Å; A407-A410 PolarHBondContact O-N 3.19Å; L408-A410 VanDerWaalsContact C-N 3.34Å; L408-A410 PolarHBondContact O-N 2.65Å; A410-R414 PolarHBondContact O-N 2.69Å
411	D	96.4	Very high	95.6	Very high	5 Å²	5	51.5 Å²	51.5	3%	0.027	27%	0.271	C	S	.	.	H	α-helix	trans	-79	-22.8	-179.6	-162.3	32.7	0	0	0	112.6	L169 I170 H209 A407 L408 R414 W415	L169-D411 HydrophobicContact CD2-CB 3.82Å; I170-D411 WeakPolarHBondContact CA-OD2 3.43Å; I170-D411 WeakPolarHBondContact CB-OD2 3.29Å; I170-D411 PolarHBondContact N-OD2 3.49Å; H209-D411 IonicContact CD2-OD1 3.39Å; H209-D411 IonicContact CD2-OD2 3.63Å; H209-D411 IonicContact NE2-OD1 3.5Å; H209-D411 PolarHBondContact NE2-OD1 2.96Å; H209-D411 IonicContact NE2-OD2 2.72Å; H209-D411 PolarHBondContact NE2-OD2 2.65Å; A407-D411 PolarHBondContact O-N 2.95Å; A407-D411 VanDerWaalsContact O-N 3.11Å; L408-D411 PolarHBondContact O-N 3.28Å; D411-R414 PolarHBondContact O-N 3.35Å; D411-R414 IonicContact OD1-NH1 3.72Å; D411-R414 PolarHBondContact OD1-NH1 2.95Å; D411-R414 VanDerWaalsContact OD1-NH1 3.15Å; D411-W415 VanDerWaalsContact O-CB 3.25Å; D411-W415 WeakPolarHBondContact O-CB 3.38Å; D411-W415 PolarHBondContact O-N 2.91Å
412	W	97	Very high	95.8	Very high	21 Å²	21	52.3 Å²	52.3	8%	0.08	28%	0.275	C	S	.	.	H	α-helix	trans	-60.8	-46.2	171.8	178	-114	0	0	0	112.6	I170 M267 F270 I271 L359 L408 W415 K416	I170-W412 HydrophobicContact CD1-CE3 4.24Å; M267-W412 HydrophobicContact CB-CZ2 4.36Å; M267-W412 HydrophobicContact CG-CD2 3.98Å; M267-W412 HydrophobicContact CG-CE3 4.05Å; M267-W412 HydrophobicContact CG-CH2 3.8Å; M267-W412 HydrophobicContact CG-CZ2 3.71Å; M267-W412 HydrophobicContact CG-CZ3 3.95Å; M267-W412 HydrophobicContact SD-CB 4.25Å; M267-W412 HydrophobicContact SD-CD2 3.4Å; M267-W412 HydrophobicContact SD-CE3 3.58Å; M267-W412 VanDerWaalsContact SD-CE3 3.58Å; M267-W412 HydrophobicContact SD-CG 3.7Å; M267-W412 HydrophobicContact SD-CH2 4.42Å; M267-W412 HydrophobicContact SD-CZ2 4.28Å; M267-W412 HydrophobicContact SD-CZ3 4.08Å; F270-W412 HydrophobicContact CB-CZ2 4.34Å; F270-W412 AromaticContact CD1-CH2 3.46Å; F270-W412 HydrophobicContact CD1-CH2 3.46Å; F270-W412 VanDerWaalsContact CD1-CH2 3.46Å; F270-W412 AromaticContact CD1-CZ2 3.69Å; F270-W412 HydrophobicContact CD1-CZ2 3.69Å; F270-W412 AromaticContact CE1-CH2 3.9Å; F270-W412 HydrophobicContact CE1-CH2 3.9Å; F270-W412 HydrophobicContact CE1-CZ2 4.16Å; F270-W412 HydrophobicContact CG-CH2 4.22Å; F270-W412 HydrophobicContact CG-CZ2 4.03Å; I271-W412 HydrophobicContact CD1-CH2 4.07Å; I271-W412 HydrophobicContact CD1-CZ3 3.89Å; I271-W412 HydrophobicContact CG1-CH2 3.68Å; I271-W412 HydrophobicContact CG1-CZ3 3.85Å; L359-W412 HydrophobicContact CD1-CZ3 4.14Å; L359-W412 HydrophobicContact CD2-CE3 4.19Å; L359-W412 HydrophobicContact CD2-CZ3 3.84Å; L359-W412 HydrophobicContact CG-CZ3 4.48Å; L408-W412 WeakPolarHBondContact O-CB 3.4Å; L408-W412 PolarHBondContact O-N 2.97Å; W412-W415 AromaticContact CE3-CE3 3.93Å; W412-W415 HydrophobicContact CE3-CE3 3.93Å; W412-W415 HydrophobicContact CE3-CZ3 4.3Å; W412-W415 HydrophobicContact CH2-CE3 4.32Å; W412-W415 AromaticContact CH2-CZ3 3.86Å; W412-W415 HydrophobicContact CH2-CZ3 3.86Å; W412-W415 AromaticContact CZ3-CE3 3.83Å; W412-W415 HydrophobicContact CZ3-CE3 3.83Å; W412-W415 AromaticContact CZ3-CZ3 3.77Å; W412-W415 HydrophobicContact CZ3-CZ3 3.77Å; W412-W415 PolarHBondContact O-N 3.16Å; W412-K416 HydrophobicContact CZ2-CD 4.21Å; W412-K416 VanDerWaalsContact NE1-CE 3.27Å; W412-K416 WeakPolarHBondContact O-CG 3.36Å; W412-K416 PolarHBondContact O-N 3.49Å
413	E	94.5	Very high	95.9	Very high	109 Å²	109	48 Å²	48	51%	0.509	26%	0.256	S	S	.	.	H	α-helix	trans	-65.7	-43.4	175.3	-62.3	-50.4	137.9	0	0	111.6	K409 W415 K416 Q417	K409-E413 PolarHBondContact O-N 3.42Å; E413-W415 VanDerWaalsContact C-N 3.35Å; E413-W415 PolarHBondContact O-N 3.12Å; E413-K416 VanDerWaalsContact CD-CE 3.46Å; E413-K416 PolarHBondContact O-N 2.93Å; E413-K416 WeakPolarHBondContact OE1-CE 3.22Å; E413-K416 IonicContact OE1-NZ 2.67Å; E413-K416 PolarHBondContact OE1-NZ 2.86Å; E413-K416 WeakPolarHBondContact OE2-CE 3.38Å; E413-K416 IonicContact OE2-NZ 3.61Å; E413-K416 PolarHBondContact OE2-NZ 3.07Å; E413-Q417 PolarHBondContact O-N 3.27Å
414	R	95.6	Very high	96	Very high	58 Å²	58	51 Å²	51	22%	0.219	26%	0.259	C	S	.	.	H	α-helix	trans	-59.2	-44.4	174.8	178.4	178.3	169.7	-82.8	-4.3	111.7	R205 D208 H209 A410 D411 Q417 N418	R205-R414 PolarHBondContact O-NH2 3.42Å; D208-R414 VanDerWaalsContact C-NH2 3.34Å; D208-R414 PolarHBondContact O-NH2 3.38Å; H209-R414 PolarHBondContact CD2-NH1 3.36Å; A410-R414 PolarHBondContact O-N 2.69Å; D411-R414 PolarHBondContact O-N 3.35Å; D411-R414 IonicContact OD1-NH1 3.72Å; D411-R414 PolarHBondContact OD1-NH1 2.95Å; D411-R414 VanDerWaalsContact OD1-NH1 3.15Å; R414-Q417 PolarHBondContact O-N 3.24Å; R414-N418 WeakPolarHBondContact O-CB 3.49Å; R414-N418 VanDerWaalsContact O-CG 3.32Å; R414-N418 PolarHBondContact O-N 3.37Å; R414-N418 PolarHBondContact O-ND2 3.2Å
415	W	97.1	Very high	96.2	Very high	6 Å²	6	53.5 Å²	53.5	2%	0.023	28%	0.276	C	S	.	.	H	α-helix	trans	-64.2	-46.4	177.4	172.1	79.9	0	0	0	111.5	I170 F270 F274 Y352 Y355 L359 D411 W412 E413 Q417 N418 M419	I170-W415 HydrophobicContact CD1-CB 3.59Å; I170-W415 HydrophobicContact CD1-CG 3.97Å; I170-W415 HydrophobicContact CG2-CB 4.5Å; I170-W415 HydrophobicContact CG2-CG 4.17Å; F270-W415 HydrophobicContact CE1-CH2 4.02Å; F270-W415 AromaticContact CE1-CZ3 3.9Å; F270-W415 HydrophobicContact CE1-CZ3 3.9Å; F274-W415 HydrophobicContact CD1-CH2 4.18Å; F274-W415 AromaticContact CE1-CH2 3.92Å; F274-W415 HydrophobicContact CE1-CH2 3.92Å; F274-W415 AromaticContact CE1-CZ2 3.82Å; F274-W415 HydrophobicContact CE1-CZ2 3.82Å; F274-W415 HydrophobicContact CE2-CH2 4.33Å; F274-W415 HydrophobicContact CG-CH2 4.49Å; F274-W415 AromaticContact CZ-CH2 3.99Å; F274-W415 HydrophobicContact CZ-CH2 3.99Å; F274-W415 AromaticContact CZ-CZ2 3.82Å; F274-W415 HydrophobicContact CZ-CZ2 3.82Å; Y352-W415 HydrophobicContact CD1-CZ2 4.29Å; Y352-W415 HydrophobicContact CE1-CZ2 4.45Å; Y352-W415 AromaticContact CE1-NE1 3.95Å; Y355-W415 AromaticContact CD1-CD1 3.62Å; Y355-W415 AromaticContact CD1-NE1 3.26Å; Y355-W415 VanDerWaalsContact CD1-NE1 3.26Å; Y355-W415 AromaticContact CE1-CD1 3.67Å; Y355-W415 AromaticContact CE1-NE1 3.74Å; Y355-W415 AromaticContact CG-NE1 3.49Å; L359-W415 HydrophobicContact CD1-CD2 4.26Å; L359-W415 HydrophobicContact CD1-CE3 4.23Å; L359-W415 HydrophobicContact CD1-CH2 3.53Å; L359-W415 HydrophobicContact CD1-CZ2 3.53Å; L359-W415 HydrophobicContact CD1-CZ3 3.88Å; L359-W415 HydrophobicContact CD2-CD2 4.17Å; L359-W415 HydrophobicContact CD2-CE3 4.35Å; D411-W415 VanDerWaalsContact O-CB 3.25Å; D411-W415 WeakPolarHBondContact O-CB 3.38Å; D411-W415 PolarHBondContact O-N 2.91Å; W412-W415 AromaticContact CE3-CE3 3.93Å; W412-W415 HydrophobicContact CE3-CE3 3.93Å; W412-W415 HydrophobicContact CE3-CZ3 4.3Å; W412-W415 HydrophobicContact CH2-CE3 4.32Å; W412-W415 AromaticContact CH2-CZ3 3.86Å; W412-W415 HydrophobicContact CH2-CZ3 3.86Å; W412-W415 AromaticContact CZ3-CE3 3.83Å; W412-W415 HydrophobicContact CZ3-CE3 3.83Å; W412-W415 AromaticContact CZ3-CZ3 3.77Å; W412-W415 HydrophobicContact CZ3-CZ3 3.77Å; W412-W415 PolarHBondContact O-N 3.16Å; E413-W415 VanDerWaalsContact C-N 3.35Å; E413-W415 PolarHBondContact O-N 3.12Å; W415-Q417 VanDerWaalsContact C-N 3.35Å; W415-Q417 PolarHBondContact O-N 3.29Å; W415-N418 PolarHBondContact O-N 2.89Å; W415-M419 HydrophobicContact CH2-CE 4.5Å; W415-M419 HydrophobicContact CH2-CG 4.4Å; W415-M419 HydrophobicContact CH2-SD 3.37Å; W415-M419 WeakPolarHBondContact CH2-SD 3.49Å; W415-M419 HydrophobicContact CZ2-CB 4.16Å; W415-M419 HydrophobicContact CZ2-CG 4.12Å; W415-M419 HydrophobicContact CZ2-SD 3.65Å; W415-M419 HydrophobicContact CZ3-SD 4.15Å; W415-M419 WeakPolarHBondContact O-CB 3.4Å; W415-M419 PolarHBondContact O-N 3.1Å
416	K	96.5	Very high	96.2	Very high	43 Å²	43	52.7 Å²	52.7	19%	0.187	27%	0.271	C	S	.	.	H	α-helix	trans	-58.7	-43.7	176.4	-79.1	-175.8	-67.2	171.2	0	112.3	W412 E413 M419 Q420	W412-K416 HydrophobicContact CZ2-CD 4.21Å; W412-K416 VanDerWaalsContact NE1-CE 3.27Å; W412-K416 WeakPolarHBondContact O-CG 3.36Å; W412-K416 PolarHBondContact O-N 3.49Å; E413-K416 VanDerWaalsContact CD-CE 3.46Å; E413-K416 PolarHBondContact O-N 2.93Å; E413-K416 WeakPolarHBondContact OE1-CE 3.22Å; E413-K416 IonicContact OE1-NZ 2.67Å; E413-K416 PolarHBondContact OE1-NZ 2.86Å; E413-K416 WeakPolarHBondContact OE2-CE 3.38Å; E413-K416 IonicContact OE2-NZ 3.61Å; E413-K416 PolarHBondContact OE2-NZ 3.07Å; K416-M419 PolarHBondContact O-N 2.99Å; K416-Q420 WeakPolarHBondContact O-CB 3.47Å; K416-Q420 WeakPolarHBondContact O-CG 3.27Å; K416-Q420 PolarHBondContact O-N 3.45Å
417	Q	96.2	Very high	96.3	Very high	96 Å²	96	53.2 Å²	53.2	45%	0.449	27%	0.27	S	S	.	.	H	α-helix	trans	-64	-43	177.4	-172.3	62.1	68.5	0	0	111.8	E413 R414 W415 Q420 N421	E413-Q417 PolarHBondContact O-N 3.27Å; R414-Q417 PolarHBondContact O-N 3.24Å; W415-Q417 VanDerWaalsContact C-N 3.35Å; W415-Q417 PolarHBondContact O-N 3.29Å; Q417-Q420 PolarHBondContact O-N 3.41Å; Q417-N421 PolarHBondContact NE2-OD1 3.31Å; Q417-N421 WeakPolarHBondContact O-CB 3.41Å; Q417-N421 PolarHBondContact O-N 2.67Å; Q417-N421 PolarHBondContact O-ND2 3.08Å; Q417-N421 PolarHBondContact O-OD1 3.19Å
418	N	96.1	Very high	96.4	Very high	31 Å²	31	54.6 Å²	54.6	17%	0.166	28%	0.275	C	S	.	.	H	α-helix	trans	-61.5	-45.6	174.9	-76.3	-39.6	0	0	0	111.8	R205 R414 W415 N421 D422	R205-N418 PolarHBondContact NH1-OD1 3.43Å; R414-N418 WeakPolarHBondContact O-CB 3.49Å; R414-N418 VanDerWaalsContact O-CG 3.32Å; R414-N418 PolarHBondContact O-N 3.37Å; R414-N418 PolarHBondContact O-ND2 3.2Å; W415-N418 PolarHBondContact O-N 2.89Å; N418-N421 PolarHBondContact O-N 2.81Å; N418-D422 WeakPolarHBondContact O-CB 3.49Å; N418-D422 PolarHBondContact O-N 3.11Å
419	M	97.3	Very high	96.3	Very high	18 Å²	18	58 Å²	58	9%	0.089	29%	0.293	C	S	.	.	H	α-helix	trans	-58.7	-47.6	176.2	179.7	-158.7	70.9	0	0	112.2	F270 F274 Y352 W415 K416 N421 L423	F270-M419 HydrophobicContact CZ-CE 4.49Å; F274-M419 HydrophobicContact CD2-SD 4.03Å; F274-M419 HydrophobicContact CE2-CG 4.4Å; F274-M419 HydrophobicContact CE2-SD 3.35Å; F274-M419 WeakPolarHBondContact CE2-SD 3.33Å; F274-M419 HydrophobicContact CZ-SD 3.8Å; Y352-M419 HydrophobicContact CD1-CB 4.19Å; Y352-M419 HydrophobicContact CD1-CG 3.77Å; Y352-M419 HydrophobicContact CE1-CB 3.58Å; Y352-M419 HydrophobicContact CE1-CG 3.67Å; Y352-M419 HydrophobicContact CG-CG 4.37Å; Y352-M419 WeakPolarHBondContact OH-CA 3.37Å; W415-M419 HydrophobicContact CH2-CE 4.5Å; W415-M419 HydrophobicContact CH2-CG 4.4Å; W415-M419 HydrophobicContact CH2-SD 3.37Å; W415-M419 WeakPolarHBondContact CH2-SD 3.49Å; W415-M419 HydrophobicContact CZ2-CB 4.16Å; W415-M419 HydrophobicContact CZ2-CG 4.12Å; W415-M419 HydrophobicContact CZ2-SD 3.65Å; W415-M419 HydrophobicContact CZ3-SD 4.15Å; W415-M419 WeakPolarHBondContact O-CB 3.4Å; W415-M419 PolarHBondContact O-N 3.1Å; K416-M419 PolarHBondContact O-N 2.99Å; M419-N421 PolarHBondContact O-N 3.28Å; M419-L423 HydrophobicContact CG-CD1 3.79Å; M419-L423 HydrophobicContact CG-CG 4.48Å; M419-L423 WeakPolarHBondContact O-CB 3.48Å; M419-L423 WeakPolarHBondContact O-CG 3.48Å; M419-L423 PolarHBondContact O-N 3.28Å
420	Q	97.4	Very high	96.3	Very high	109 Å²	109	55.6 Å²	55.6	51%	0.509	29%	0.285	S	S	.	.	H	α-helix	trans	-62.5	-42.3	178.2	-74	176.3	-2.3	0	0	111.8	K416 Q417 K424	K416-Q420 WeakPolarHBondContact O-CB 3.47Å; K416-Q420 WeakPolarHBondContact O-CG 3.27Å; K416-Q420 PolarHBondContact O-N 3.45Å; Q417-Q420 PolarHBondContact O-N 3.41Å; Q420-K424 WeakPolarHBondContact O-CB 3.08Å; Q420-K424 PolarHBondContact O-N 2.94Å
421	N	97.1	Very high	96.5	Very high	81 Å²	81	54.6 Å²	54.6	43%	0.433	28%	0.277	S	S	.	.	H	α-helix	trans	-65.8	-47.9	179.1	-69.9	-7.9	0	0	0	111.9	Q417 N418 M419 K424 S425	Q417-N421 PolarHBondContact NE2-OD1 3.31Å; Q417-N421 WeakPolarHBondContact O-CB 3.41Å; Q417-N421 PolarHBondContact O-N 2.67Å; Q417-N421 PolarHBondContact O-ND2 3.08Å; Q417-N421 PolarHBondContact O-OD1 3.19Å; N418-N421 PolarHBondContact O-N 2.81Å; M419-N421 PolarHBondContact O-N 3.28Å; N421-K424 PolarHBondContact O-N 3.49Å; N421-S425 PolarHBondContact O-N 3.35Å
422	D	96.9	Very high	96.4	Very high	28 Å²	28	58.5 Å²	58.5	15%	0.15	30%	0.295	C	S	.	.	H	α-helix	trans	-63.8	-50.5	-178.7	-78.7	29.3	0	0	0	112.1	K201 R205 V348 Y352 N418 K424 S425 A426	K201-D422 WeakPolarHBondContact CE-OD2 3.19Å; K201-D422 IonicContact NZ-OD2 3.99Å; K201-D422 PolarHBondContact NZ-OD2 3.22Å; R205-D422 IonicContact CZ-OD1 2.61Å; R205-D422 IonicContact CZ-OD2 2.91Å; R205-D422 IonicContact NH2-OD1 3.46Å; R205-D422 PolarHBondContact NH2-OD1 2.85Å; R205-D422 IonicContact NH2-OD2 3.36Å; R205-D422 PolarHBondContact NH2-OD2 2.91Å; V348-D422 HydrophobicContact CG1-CB 4.2Å; Y352-D422 HydrophobicContact CE2-CB 3.65Å; Y352-D422 PolarHBondContact OH-OD2 3.48Å; N418-D422 WeakPolarHBondContact O-CB 3.49Å; N418-D422 PolarHBondContact O-N 3.11Å; D422-K424 VanDerWaalsContact C-N 3.33Å; D422-K424 PolarHBondContact O-N 3.29Å; D422-S425 PolarHBondContact O-N 3.41Å; D422-A426 PolarHBondContact O-N 3.3Å
423	L	97.1	Very high	96.3	Very high	29 Å²	29	58.7 Å²	58.7	15%	0.152	30%	0.297	C	S	.	.	H	α-helix	trans	-64.3	-40.6	178.7	-69.1	174.2	0	0	0	110.9	V348 Y352 M419 S425 A426 F427	V348-L423 HydrophobicContact CG1-CD2 4.18Å; Y352-L423 HydrophobicContact CD2-CD2 3.97Å; Y352-L423 HydrophobicContact CD2-CG 4.11Å; Y352-L423 HydrophobicContact CE2-CG 4.43Å; M419-L423 HydrophobicContact CG-CD1 3.79Å; M419-L423 HydrophobicContact CG-CG 4.48Å; M419-L423 WeakPolarHBondContact O-CB 3.48Å; M419-L423 WeakPolarHBondContact O-CG 3.48Å; M419-L423 PolarHBondContact O-N 3.28Å; L423-S425 PolarHBondContact O-N 3.06Å; L423-A426 PolarHBondContact O-N 2.58Å; L423-F427 HydrophobicContact CB-CD2 4.34Å; L423-F427 HydrophobicContact CB-CE2 4.34Å; L423-F427 HydrophobicContact CD2-CE2 4.32Å; L423-F427 WeakPolarHBondContact O-CB 3.48Å; L423-F427 WeakPolarHBondContact O-CD2 3.47Å; L423-F427 PolarHBondContact O-N 3.09Å
424	K	97.7	Very high	96.4	Very high	151 Å²	151	56 Å²	56	66%	0.657	29%	0.285	S	S	*	.	H	α-helix	trans	-60.8	-44.2	175.9	-178.7	-176.3	176.3	-171.2	0	111.4	Q420 N421 D422 T428	Q420-K424 WeakPolarHBondContact O-CB 3.08Å; Q420-K424 PolarHBondContact O-N 2.94Å; N421-K424 PolarHBondContact O-N 3.49Å; D422-K424 VanDerWaalsContact C-N 3.33Å; D422-K424 PolarHBondContact O-N 3.29Å; K424-T428 VanDerWaalsContact O-CB 3.27Å; K424-T428 WeakPolarHBondContact O-CB 3.37Å; K424-T428 PolarHBondContact O-N 3.35Å; K424-T428 PolarHBondContact O-OG1 2.92Å
425	S	96.9	Very high	96.4	Very high	60 Å²	60	57.7 Å²	57.7	42%	0.42	30%	0.298	S	S	.	.	H	α-helix	trans	-59.3	-59.1	175.2	-162.3	0	0	0	0	109.5	N421 D422 L423 F427 T428 D429	N421-S425 PolarHBondContact O-N 3.35Å; D422-S425 PolarHBondContact O-N 3.41Å; L423-S425 PolarHBondContact O-N 3.06Å; S425-F427 VanDerWaalsContact C-N 3.3Å; S425-F427 PolarHBondContact O-N 3.35Å; S425-F427 VanDerWaalsContact O-N 3.15Å; S425-T428 CarbonylContact O-C 3.57Å; S425-T428 WeakPolarHBondContact O-CA 3.35Å; S425-T428 PolarHBondContact O-N 3.35Å; S425-D429 WeakPolarHBondContact O-CB 3.32Å; S425-D429 PolarHBondContact O-N 3.12Å; S425-D429 PolarHBondContact OG-OD2 2.76Å
426	A	95.8	Very high	96.4	Very high	4 Å²	4	62.6 Å²	62.6	3%	0.033	32%	0.316	C	S	.	.	H	α-helix	trans	-54.6	-42	-175.2	0	0	0	0	0	113.5	L345 V348 D422 L423 T430	L345-A426 HydrophobicContact CD1-CB 4.17Å; V348-A426 HydrophobicContact CB-CB 4.1Å; V348-A426 HydrophobicContact CG1-CB 4.01Å; V348-A426 HydrophobicContact CG2-CB 4.29Å; D422-A426 PolarHBondContact O-N 3.3Å; L423-A426 PolarHBondContact O-N 2.58Å; A426-T430 VanDerWaalsContact O-CB 3.31Å; A426-T430 WeakPolarHBondContact O-CB 3.31Å; A426-T430 PolarHBondContact O-N 3.3Å; A426-T430 PolarHBondContact O-OG1 3.43Å
427	F	96.4	Very high	96.4	Very high	95 Å²	95	61.5 Å²	61.5	42%	0.417	31%	0.311	S	S	.	.	H	α-helix	trans	-72.6	-34.2	175.4	-73.7	-58.3	0	0	0	113.5	I281 L345 L423 S425 A431	I281-F427 HydrophobicContact CG2-CZ 4.29Å; L345-F427 HydrophobicContact CD1-CD1 3.91Å; L345-F427 HydrophobicContact CD1-CE1 3.77Å; L345-F427 HydrophobicContact CD1-CZ 4.35Å; L423-F427 HydrophobicContact CB-CD2 4.34Å; L423-F427 HydrophobicContact CB-CE2 4.34Å; L423-F427 HydrophobicContact CD2-CE2 4.32Å; L423-F427 WeakPolarHBondContact O-CB 3.48Å; L423-F427 WeakPolarHBondContact O-CD2 3.47Å; L423-F427 PolarHBondContact O-N 3.09Å; S425-F427 VanDerWaalsContact C-N 3.3Å; S425-F427 PolarHBondContact O-N 3.35Å; S425-F427 VanDerWaalsContact O-N 3.15Å; F427-A431 WeakPolarHBondContact O-CB 3.49Å; F427-A431 PolarHBondContact O-N 3.15Å
428	T	96.8	Very high	96.5	Very high	62 Å²	62	64 Å²	64	38%	0.38	32%	0.317	S	S	.	.	H	α-helix	trans	-68.7	-48.1	175.4	-54.4	0	0	0	0	110.4	K424 S425 T430 A431 E432	K424-T428 VanDerWaalsContact O-CB 3.27Å; K424-T428 WeakPolarHBondContact O-CB 3.37Å; K424-T428 PolarHBondContact O-N 3.35Å; K424-T428 PolarHBondContact O-OG1 2.92Å; S425-T428 CarbonylContact O-C 3.57Å; S425-T428 WeakPolarHBondContact O-CA 3.35Å; S425-T428 PolarHBondContact O-N 3.35Å; T428-T430 VanDerWaalsContact C-N 3.29Å; T428-T430 PolarHBondContact O-N 3.42Å; T428-A431 PolarHBondContact O-N 3.31Å; T428-E432 PolarHBondContact O-N 3.34Å
429	D	94.9	Very high	96.6	Very high	72 Å²	72	68.3 Å²	68.3	39%	0.385	34%	0.337	S	S	.	.	H	α-helix	trans	-58.1	-42.2	177.3	-60.1	-39.8	0	0	0	110.7	S425 E433	S425-D429 WeakPolarHBondContact O-CB 3.32Å; S425-D429 PolarHBondContact O-N 3.12Å; S425-D429 PolarHBondContact OG-OD2 2.76Å; D429-E433 WeakPolarHBondContact O-CB 3.46Å; D429-E433 PolarHBondContact O-N 3.02Å
430	T	95.2	Very high	96.6	Very high	20 Å²	20	71.3 Å²	71.3	12%	0.123	35%	0.351	C	S	.	.	H	α-helix	trans	-64.8	-42.5	173.8	-57	0	0	0	0	112.1	L345 A426 T428 E433 N434	L345-T430 HydrophobicContact CD2-CG2 4.25Å; A426-T430 VanDerWaalsContact O-CB 3.31Å; A426-T430 WeakPolarHBondContact O-CB 3.31Å; A426-T430 PolarHBondContact O-N 3.3Å; A426-T430 PolarHBondContact O-OG1 3.43Å; T428-T430 VanDerWaalsContact C-N 3.29Å; T428-T430 PolarHBondContact O-N 3.42Å; T430-E433 PolarHBondContact O-N 3.46Å; T430-N434 WeakPolarHBondContact O-CB 3.46Å; T430-N434 VanDerWaalsContact O-CG 3.27Å; T430-N434 PolarHBondContact O-N 3.28Å; T430-N434 PolarHBondContact O-ND2 2.96Å
431	A	96.6	Very high	96.6	Very high	49 Å²	49	66.8 Å²	66.8	41%	0.405	33%	0.331	S	S	.	.	H	α-helix	trans	-66.3	-42.1	179	0	0	0	0	0	112.1	F427 T428 N434 I435	F427-A431 WeakPolarHBondContact O-CB 3.49Å; F427-A431 PolarHBondContact O-N 3.15Å; T428-A431 PolarHBondContact O-N 3.31Å; A431-N434 PolarHBondContact O-N 3.49Å; A431-I435 VanDerWaalsContact O-CG1 3.32Å; A431-I435 WeakPolarHBondContact O-CG1 3.41Å; A431-I435 PolarHBondContact O-N 3.13Å
432	E	95.8	Very high	96.7	Very high	86 Å²	86	67.6 Å²	67.6	40%	0.402	33%	0.334	S	S	.	.	H	α-helix	trans	-61.3	-43.6	173.9	-72.9	-171.1	-173.5	0	0	112	T428 I435 R436	T428-E432 PolarHBondContact O-N 3.34Å; E432-I435 PolarHBondContact O-N 2.95Å; E432-R436 WeakPolarHBondContact O-CG 3.27Å; E432-R436 PolarHBondContact O-N 3.1Å; E432-R436 IonicContact OE2-CZ 3.42Å; E432-R436 IonicContact OE2-NH1 2.74Å; E432-R436 IonicContact OE2-NH2 3.96Å; E432-R436 PolarHBondContact OE2-NH2 2.93Å
433	E	94.6	Very high	96.7	Very high	26 Å²	26	68.7 Å²	68.7	12%	0.121	35%	0.348	C	S	.	.	H	α-helix	trans	-70.5	-33.3	-179.6	-164.6	56.3	-151.9	0	0	112.2	K336 D429 T430 R436 Y437	K336-E433 IonicContact NZ-OE1 3.88Å; K336-E433 PolarHBondContact NZ-OE1 2.93Å; K336-E433 IonicContact NZ-OE2 3.68Å; K336-E433 PolarHBondContact NZ-OE2 3.16Å; D429-E433 WeakPolarHBondContact O-CB 3.46Å; D429-E433 PolarHBondContact O-N 3.02Å; T430-E433 PolarHBondContact O-N 3.46Å; E433-R436 PolarHBondContact O-N 3.42Å; E433-R436 WeakPolarHBondContact OE2-CD 3.42Å; E433-R436 IonicContact OE2-CZ 3.59Å; E433-R436 IonicContact OE2-NH1 3.31Å; E433-R436 PolarHBondContact OE2-NH1 3.42Å; E433-Y437 WeakPolarHBondContact O-CB 3.48Å; E433-Y437 PolarHBondContact O-N 2.96Å
434	N	95.4	Very high	96.8	Very high	51 Å²	51	68 Å²	68	27%	0.273	34%	0.344	S	S	.	.	H	α-helix	trans	-63	-43.1	169.1	-76.7	-18.8	0	0	0	112.1	R337 T430 A431 Y437 Y438	R337-N434 VanDerWaalsContact CD-OD1 3.27Å; R337-N434 WeakPolarHBondContact CD-OD1 3.43Å; T430-N434 WeakPolarHBondContact O-CB 3.46Å; T430-N434 VanDerWaalsContact O-CG 3.27Å; T430-N434 PolarHBondContact O-N 3.28Å; T430-N434 PolarHBondContact O-ND2 2.96Å; A431-N434 PolarHBondContact O-N 3.49Å; N434-Y437 WeakPolarHBondContact O-CB 3.46Å; N434-Y437 PolarHBondContact O-N 3.12Å; N434-Y438 WeakPolarHBondContact O-CD2 3.36Å; N434-Y438 PolarHBondContact O-N 3.16Å; N434-Y438 VanDerWaalsContact O-N 3.1Å
435	I	97.3	Very high	96.8	Very high	95 Å²	95	65 Å²	65	49%	0.487	33%	0.329	S	S	.	.	H	α-helix	trans	-59.9	-51.7	175.6	-70	163	0	0	0	110	A431 E432 Y437 Y438 E439	A431-I435 VanDerWaalsContact O-CG1 3.32Å; A431-I435 WeakPolarHBondContact O-CG1 3.41Å; A431-I435 PolarHBondContact O-N 3.13Å; E432-I435 PolarHBondContact O-N 2.95Å; I435-Y437 VanDerWaalsContact C-N 3.27Å; I435-Y437 PolarHBondContact O-N 2.98Å; I435-Y438 PolarHBondContact O-N 2.87Å; I435-Y438 VanDerWaalsContact O-N 3.16Å; I435-E439 HydrophobicContact CG2-CG 4.22Å; I435-E439 WeakPolarHBondContact O-CG 3.26Å; I435-E439 PolarHBondContact O-N 3.4Å
436	R	96.4	Very high	96.8	Very high	108 Å²	108	67.1 Å²	67.1	41%	0.408	33%	0.333	S	S	.	.	H	α-helix	trans	-56.8	-39.9	178	-69.3	173.9	-166.4	126	11.7	112.4	E432 E433 Q440	E432-R436 WeakPolarHBondContact O-CG 3.27Å; E432-R436 PolarHBondContact O-N 3.1Å; E432-R436 IonicContact OE2-CZ 3.42Å; E432-R436 IonicContact OE2-NH1 2.74Å; E432-R436 IonicContact OE2-NH2 3.96Å; E432-R436 PolarHBondContact OE2-NH2 2.93Å; E433-R436 PolarHBondContact O-N 3.42Å; E433-R436 WeakPolarHBondContact OE2-CD 3.42Å; E433-R436 IonicContact OE2-CZ 3.59Å; E433-R436 IonicContact OE2-NH1 3.31Å; E433-R436 PolarHBondContact OE2-NH1 3.42Å; R436-Q440 VanDerWaalsContact O-CB 3.22Å; R436-Q440 WeakPolarHBondContact O-CB 3.47Å; R436-Q440 PolarHBondContact O-N 3.21Å
437	Y	96.8	Very high	96.8	Very high	21 Å²	21	71 Å²	71	8%	0.082	36%	0.359	C	S	.	.	H	α-helix	trans	-59.7	-52.2	175.7	165.2	-98.3	0	0	0	111.8	A333 T334 R337 E433 N434 I435 Q440 C441	A333-Y437 HydrophobicContact CB-CD2 3.75Å; A333-Y437 HydrophobicContact CB-CE2 4.07Å; T334-Y437 WeakPolarHBondContact OG1-CE2 3.39Å; R337-Y437 HydrophobicContact CB-CD2 4.28Å; R337-Y437 HydrophobicContact CB-CG 4.4Å; E433-Y437 WeakPolarHBondContact O-CB 3.48Å; E433-Y437 PolarHBondContact O-N 2.96Å; N434-Y437 WeakPolarHBondContact O-CB 3.46Å; N434-Y437 PolarHBondContact O-N 3.12Å; I435-Y437 VanDerWaalsContact C-N 3.27Å; I435-Y437 PolarHBondContact O-N 2.98Å; Y437-Q440 PolarHBondContact O-N 2.97Å; Y437-C441 WeakPolarHBondContact CE2-SG 3.44Å; Y437-C441 WeakPolarHBondContact O-CB 3.32Å; Y437-C441 PolarHBondContact O-N 2.98Å; Y437-C441 PolarHBondContact O-SG 2.77Å
438	Y	97.6	Very high	96.8	Very high	147 Å²	147	67.6 Å²	67.6	58%	0.576	34%	0.344	S	S	*	.	H	α-helix	trans	-66.9	-39	-178.8	-71.6	-64.1	0	0	0	112.2	N434 I435 L442	N434-Y438 WeakPolarHBondContact O-CD2 3.36Å; N434-Y438 PolarHBondContact O-N 3.16Å; N434-Y438 VanDerWaalsContact O-N 3.1Å; I435-Y438 PolarHBondContact O-N 2.87Å; I435-Y438 VanDerWaalsContact O-N 3.16Å; Y438-L442 VanDerWaalsContact O-CB 3.27Å; Y438-L442 WeakPolarHBondContact O-CB 3.49Å; Y438-L442 PolarHBondContact O-N 3.41Å
439	E	98.1	Very high	96.7	Very high	122 Å²	122	69.8 Å²	69.8	57%	0.57	35%	0.353	S	S	*	.	H	α-helix	trans	-61.1	-45.4	173.4	-71.5	176.9	156	0	0	112	I435 L442 A443	I435-E439 HydrophobicContact CG2-CG 4.22Å; I435-E439 WeakPolarHBondContact O-CG 3.26Å; I435-E439 PolarHBondContact O-N 3.4Å; E439-L442 PolarHBondContact O-N 3.39Å; E439-A443 WeakPolarHBondContact O-CB 3.42Å; E439-A443 PolarHBondContact O-N 2.91Å
440	Q	97.8	Very high	96.6	Very high	82 Å²	82	70.1 Å²	70.1	38%	0.383	36%	0.358	S	S	.	.	H	α-helix	trans	-64.6	-47	179	-177.7	176.4	-13.7	0	0	111.5	A333 R436 Y437 A443 T444	A333-Q440 HydrophobicContact CB-CG 4.23Å; R436-Q440 VanDerWaalsContact O-CB 3.22Å; R436-Q440 WeakPolarHBondContact O-CB 3.47Å; R436-Q440 PolarHBondContact O-N 3.21Å; Y437-Q440 PolarHBondContact O-N 2.97Å; Q440-A443 PolarHBondContact O-N 2.87Å; Q440-T444 PolarHBondContact O-N 2.62Å; Q440-T444 PolarHBondContact O-OG1 3.28Å; Q440-T444 VanDerWaalsContact O-OG1 3.12Å
441	C	97.7	Very high	96.4	Very high	13 Å²	13	72 Å²	72	9%	0.088	37%	0.372	C	S	.	.	H	α-helix	trans	-62.4	-43	177.3	-72.9	0	0	0	0	111.8	C330 Y437 T444 W445	C330-C441 VanDerWaalsContact SG-SG 3.68Å; Y437-C441 WeakPolarHBondContact CE2-SG 3.44Å; Y437-C441 WeakPolarHBondContact O-CB 3.32Å; Y437-C441 PolarHBondContact O-N 2.98Å; Y437-C441 PolarHBondContact O-SG 2.77Å; C441-T444 PolarHBondContact O-N 3.31Å; C441-W445 PolarHBondContact O-N 2.92Å
442	L	98.2	Very high	95.9	Very high	98 Å²	98	72.3 Å²	72.3	51%	0.513	37%	0.365	S	S	.	.	H	α-helix	trans	-59.9	-51.6	176	178.6	62.8	0	0	0	111.3	Y438 E439 T444 W445 E446	Y438-L442 VanDerWaalsContact O-CB 3.27Å; Y438-L442 WeakPolarHBondContact O-CB 3.49Å; Y438-L442 PolarHBondContact O-N 3.41Å; E439-L442 PolarHBondContact O-N 3.39Å; L442-T444 VanDerWaalsContact C-N 3.28Å; L442-T444 PolarHBondContact O-N 3.17Å; L442-W445 PolarHBondContact O-N 3.24Å; L442-W445 VanDerWaalsContact O-N 3.09Å; L442-E446 HydrophobicContact CD1-CG 3.97Å; L442-E446 HydrophobicContact CG-CG 4.2Å; L442-E446 WeakPolarHBondContact O-CG 3.31Å; L442-E446 PolarHBondContact O-N 2.86Å
443	A	97.9	Very high	95.1	Very high	52 Å²	52	73.5 Å²	73.5	43%	0.43	38%	0.378	S	S	.	.	H	α-helix	trans	-60.7	-35.6	-179.3	0	0	0	0	0	112.8	E439 Q440 S447	E439-A443 WeakPolarHBondContact O-CB 3.42Å; E439-A443 PolarHBondContact O-N 2.91Å; Q440-A443 PolarHBondContact O-N 2.87Å; A443-S447 VanDerWaalsContact O-CB 3.26Å; A443-S447 WeakPolarHBondContact O-CB 3.39Å; A443-S447 PolarHBondContact O-N 3.09Å
444	T	98	Very high	93.5	Very high	13 Å²	13	78.5 Å²	78.5	8%	0.08	41%	0.406	C	S	.	.	H	α-helix	trans	-58.9	-50.6	172.2	-69.7	0	0	0	0	111.3	C326 Q329 Q440 C441 L442 F448	C326-T444 HydrophobicContact CB-CG2 3.77Å; Q329-T444 HydrophobicContact CB-CG2 3.83Å; Q329-T444 PolarHBondContact OE1-OG1 2.69Å; Q440-T444 PolarHBondContact O-N 2.62Å; Q440-T444 PolarHBondContact O-OG1 3.28Å; Q440-T444 VanDerWaalsContact O-OG1 3.12Å; C441-T444 PolarHBondContact O-N 3.31Å; L442-T444 VanDerWaalsContact C-N 3.28Å; L442-T444 PolarHBondContact O-N 3.17Å; T444-F448 PolarHBondContact O-N 3.33Å; T444-F448 VanDerWaalsContact O-N 3.17Å
445	W	97.7	Very high	91.8	Very high	88 Å²	88	81.3 Å²	81.3	33%	0.333	42%	0.42	S	S	.	.	H	α-helix	trans	-70.6	-39.4	-179.4	-71.9	111.2	0	0	0	113.1	I323 C326 I327 C330 C441 L442 F448 L449	I323-W445 HydrophobicContact CG2-CH2 4.23Å; C326-W445 HydrophobicContact CB-CD2 4.13Å; C326-W445 HydrophobicContact CB-CE3 3.89Å; C326-W445 HydrophobicContact CB-CH2 3.67Å; C326-W445 HydrophobicContact CB-CZ2 3.9Å; C326-W445 HydrophobicContact CB-CZ3 3.66Å; I327-W445 HydrophobicContact CG1-CH2 4.14Å; I327-W445 HydrophobicContact CG1-CZ2 4.19Å; C330-W445 PolarHBondContact SG-NE1 3.37Å; C330-W445 VanDerWaalsContact SG-NE1 3.42Å; C441-W445 PolarHBondContact O-N 2.92Å; L442-W445 PolarHBondContact O-N 3.24Å; L442-W445 VanDerWaalsContact O-N 3.09Å; W445-F448 HydrophobicContact CE3-CD1 4.13Å; W445-F448 HydrophobicContact CZ3-CD1 4.26Å; W445-F448 PolarHBondContact O-N 3.34Å; W445-L449 WeakPolarHBondContact O-CG 3.05Å; W445-L449 PolarHBondContact O-N 2.99Å
446	E	97.3	Very high	89.5	Confident	106 Å²	106	82.3 Å²	82.3	50%	0.495	43%	0.433	S	S	.	.	H	α-helix	trans	-61.2	-47.4	175.4	-72.5	-178.3	153	0	0	111.4	L442 F448 L449 T450	L442-E446 HydrophobicContact CD1-CG 3.97Å; L442-E446 HydrophobicContact CG-CG 4.2Å; L442-E446 WeakPolarHBondContact O-CG 3.31Å; L442-E446 PolarHBondContact O-N 2.86Å; E446-F448 VanDerWaalsContact C-N 3.26Å; E446-F448 PolarHBondContact O-N 3.45Å; E446-L449 PolarHBondContact O-N 2.89Å; E446-T450 PolarHBondContact O-N 3.16Å; E446-T450 PolarHBondContact O-OG1 3.25Å; E446-T450 VanDerWaalsContact O-OG1 3.04Å
447	S	96.1	Very high	87.3	Confident	84 Å²	84	85 Å²	85	59%	0.587	45%	0.454	S	S	*	.	H	α-helix	trans	-59.9	-36.7	176.7	-175.5	0	0	0	0	112.3	A443 S451	A443-S447 VanDerWaalsContact O-CB 3.26Å; A443-S447 WeakPolarHBondContact O-CB 3.39Å; A443-S447 PolarHBondContact O-N 3.09Å; S447-S451 PolarHBondContact O-N 2.9Å
448	F	96.4	Very high	84.9	Confident	24 Å²	24	92.7 Å²	92.7	11%	0.105	49%	0.491	C	S	.	.	H	α-helix	trans	-69.5	-49.5	175.3	170.1	-110.4	0	0	0	111.7	T319 I323 C326 T444 W445 E446 T450 S451 Q452	T319-F448 HydrophobicContact CG2-CZ 4.06Å; I323-F448 HydrophobicContact CD1-CZ 4.41Å; I323-F448 HydrophobicContact CG1-CE1 3.69Å; I323-F448 HydrophobicContact CG1-CZ 3.6Å; C326-F448 WeakPolarHBondContact SG-CB 3.42Å; T444-F448 PolarHBondContact O-N 3.33Å; T444-F448 VanDerWaalsContact O-N 3.17Å; W445-F448 HydrophobicContact CE3-CD1 4.13Å; W445-F448 HydrophobicContact CZ3-CD1 4.26Å; W445-F448 PolarHBondContact O-N 3.34Å; E446-F448 VanDerWaalsContact C-N 3.26Å; E446-F448 PolarHBondContact O-N 3.45Å; F448-T450 VanDerWaalsContact C-N 3.29Å; F448-T450 PolarHBondContact O-N 3.23Å; F448-S451 WeakPolarHBondContact O-CA 3.49Å; F448-S451 WeakPolarHBondContact O-CB 3.46Å; F448-S451 PolarHBondContact O-N 2.71Å; F448-S451 PolarHBondContact O-OG 3.21Å; F448-Q452 HydrophobicContact CD2-CG 4.21Å; F448-Q452 HydrophobicContact CE1-CG 4.14Å; F448-Q452 HydrophobicContact CE2-CG 3.67Å; F448-Q452 HydrophobicContact CZ-CG 3.64Å; F448-Q452 WeakPolarHBondContact O-CG 3.48Å; F448-Q452 PolarHBondContact O-N 3.14Å; F448-Q452 VanDerWaalsContact O-N 3.14Å
449	L	95.3	Very high	82.4	Confident	109 Å²	109	94.5 Å²	94.5	57%	0.571	51%	0.505	S	S	*	.	H	α-helix	trans	-57.8	-41.7	179.6	-71.6	171	0	0	0	112	W445 E446 Q452 T453	W445-L449 WeakPolarHBondContact O-CG 3.05Å; W445-L449 PolarHBondContact O-N 2.99Å; E446-L449 PolarHBondContact O-N 2.89Å; L449-Q452 PolarHBondContact O-N 2.8Å; L449-T453 PolarHBondContact O-N 3.31Å; L449-T453 PolarHBondContact O-OG1 3Å
450	T	93.5	Very high	79.9	Confident	79 Å²	79	95.7 Å²	95.7	49%	0.485	52%	0.515	S	S	.	.	H	α-helix	trans	-59.2	-45.6	172.8	-53.7	0	0	0	0	111.7	E446 F448 Q452 T453 D454	E446-T450 PolarHBondContact O-N 3.16Å; E446-T450 PolarHBondContact O-OG1 3.25Å; E446-T450 VanDerWaalsContact O-OG1 3.04Å; F448-T450 VanDerWaalsContact C-N 3.29Å; F448-T450 PolarHBondContact O-N 3.23Å; T450-Q452 PolarHBondContact O-N 3Å; T450-Q452 VanDerWaalsContact O-N 3.16Å; T450-T453 WeakPolarHBondContact CA-OG1 3.42Å; T450-T453 PolarHBondContact O-N 3.04Å; T450-T453 PolarHBondContact O-OG1 2.98Å; T450-D454 PolarHBondContact O-N 3.31Å
451	S	90.1	Very high	77.6	Confident	60 Å²	60	97.5 Å²	97.5	42%	0.42	54%	0.537	S	S	.	.	H	α-helix	trans	-60.8	-26	178	78.9	0	0	0	0	114.1	S447 F448	S447-S451 PolarHBondContact O-N 2.9Å; F448-S451 WeakPolarHBondContact O-CA 3.49Å; F448-S451 WeakPolarHBondContact O-CB 3.46Å; F448-S451 PolarHBondContact O-N 2.71Å; F448-S451 PolarHBondContact O-OG 3.21Å
452	Q	86.4	Confident	75.4	Confident	55 Å²	55	105.4 Å²	105.4	26%	0.257	57%	0.573	S	S	.	*	H	α-helix	trans	-85.2	-21	176.3	-56.2	-54.1	-81	0	0	112.7	T319 F448 L449 T450	T319-Q452 PolarHBondContact OG1-OE1 3.19Å; F448-Q452 HydrophobicContact CD2-CG 4.21Å; F448-Q452 HydrophobicContact CE1-CG 4.14Å; F448-Q452 HydrophobicContact CE2-CG 3.67Å; F448-Q452 HydrophobicContact CZ-CG 3.64Å; F448-Q452 WeakPolarHBondContact O-CG 3.48Å; F448-Q452 PolarHBondContact O-N 3.14Å; F448-Q452 VanDerWaalsContact O-N 3.14Å; L449-Q452 PolarHBondContact O-N 2.8Å; T450-Q452 PolarHBondContact O-N 3Å; T450-Q452 VanDerWaalsContact O-N 3.16Å
453	T	77.8	Confident	73.2	Confident	111 Å²	111	108 Å²	108	68%	0.681	59%	0.587	S	S	*	*	H	α-helix	trans	-86.2	-20.8	-179.6	7.6	0	0	0	0	113.5	L449 T450 L455	L449-T453 PolarHBondContact O-N 3.31Å; L449-T453 PolarHBondContact O-OG1 3Å; T450-T453 WeakPolarHBondContact CA-OG1 3.42Å; T450-T453 PolarHBondContact O-N 3.04Å; T450-T453 PolarHBondContact O-OG1 2.98Å; T453-L455 VanDerWaalsContact C-N 3.29Å
454	D	62	Low	70.7	Confident	131 Å²	131	115 Å²	115	70%	0.701	61%	0.607	S	S	*	*	S	Bend	trans	-84.5	3.8	175.4	-74.1	-28.4	0	0	0	113.6	T450 P456	T450-D454 PolarHBondContact O-N 3.31Å; D454-P456 WeakPolarHBondContact O-CD 3.42Å
455	L	58.8	Low	68.1	Low	110 Å²	110	126 Å²	126	58%	0.576	66%	0.663	S	S	*	*	S	Bend	trans	-66.4	122.3	169.3	-75.1	169.1	0	0	0	109	T453 L457	T453-L455 VanDerWaalsContact C-N 3.29Å; L455-L457 PolarHBondContact O-N 3.16Å
456	P	50.5	Low	66.6	Low	115 Å²	115	127.9 Å²	127.9	75%	0.747	68%	0.68	S	S	*	*	P	Polyproline II helix	trans	-61.8	123.6	176.5	-18.8	31	0	0	0	109.5	D454 E458	D454-P456 WeakPolarHBondContact O-CD 3.42Å; P456-E458 PolarHBondContact O-N 3.18Å; P456-E458 VanDerWaalsContact O-N 3.16Å
457	L	49.9	Very low	65	Low	165 Å²	165	129.1 Å²	129.1	86%	0.864	69%	0.69	S	S	*	*	P	Polyproline II helix	trans	-57.6	119	154.5	-67.4	170.8	0	0	0	106.1	L455 E459	L455-L457 PolarHBondContact O-N 3.16Å; L457-E459 PolarHBondContact O-N 2.99Å
458	E	46.8	Very low	63.2	Low	183 Å²	183	131.6 Å²	131.6	86%	0.855	70%	0.695	S	S	*	*			trans	-61.5	106.3	167.5	-68.1	-161.3	141.7	0	0	107	P456 D460	P456-E458 PolarHBondContact O-N 3.18Å; P456-E458 VanDerWaalsContact O-N 3.16Å; E458-D460 PolarHBondContact O-N 2.94Å
459	E	44.7	Very low	61.3	Low	184 Å²	184	137.9 Å²	137.9	86%	0.86	73%	0.73	S	S	*	*			trans	-64.1	103.9	166.9	-75	-171.4	147.4	0	0	106.8	L457 S461	L457-E459 PolarHBondContact O-N 2.99Å; E459-S461 PolarHBondContact O-N 2.91Å
460	D	45	Very low	59.2	Low	148 Å²	148	139.7 Å²	139.7	79%	0.791	74%	0.74	S	S	*	*			trans	-50.4	99.1	173.4	-96.5	-37.1	0	0	0	109.7	E458 E462	E458-D460 PolarHBondContact O-N 2.94Å; D460-E462 PolarHBondContact O-N 2.81Å
461	S	50.5	Low	56.9	Low	119 Å²	119	143.7 Å²	143.7	83%	0.832	76%	0.757	S	S	*	*			trans	-81.7	46.3	177.1	61.7	0	0	0	0	111.6	E459 D463	E459-S461 PolarHBondContact O-N 2.91Å; S461-D463 PolarHBondContact O-N 2.96Å
462	E	50.5	Low	54.5	Low	180 Å²	180	149.7 Å²	149.7	84%	0.841	78%	0.781	S	S	*	*			trans	-75.1	66.4	167.7	-73.7	-148.6	139.6	0	0	110.9	D460	D460-E462 PolarHBondContact O-N 2.81Å
463	D	51.8	Low	52	Low	151 Å²	151	157 Å²	157	81%	0.807	82%	0.821	S	S	*	*			trans	-145.3	72.4	164.8	-135.9	-7.2	0	0	0	111.1	S461	S461-D463 PolarHBondContact O-N 2.96Å
464	K	46.1	Very low	49.9	Very low	199 Å²	199	160.8 Å²	160.8	87%	0.865	83%	0.833	S	S	*	*			trans	-171.9	96.9	159.3	-104.4	153.4	-167	165.1	0	112.9
465	I	42.1	Very low	48.8	Very low	245 Å²	245	163.5 Å²	163.5	100%	1.256	85%	0.845	S	S	*	*				-172.6	0	105	-90.9	160.4	0	0	0	109.7

Retrieved 465 of 465 residues in 122.7 ms (Link to these results)

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