A0A061I765_CRIGR Loading...

Wee1-like protein kinase

AlphaFold DB , UniProt , Accession A0A061I765, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene Wee1, Length 645 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	35.3	Very low	38.9	Very low	231 Å²	231	162.8 Å²	162.8	100%	1.138	86%	0.856	S	S	*	*				0	100.1	0	-61.5	174.8	-173.4	0	0	105.1
2	S	33.7	Very low	39.1	Very low	103 Å²	103	161.3 Å²	161.3	72%	0.72	86%	0.858	S	S	*	*				67.8	120.2	54	-38.2	0	0	0	0	109.8
3	F	33.2	Very low	38.8	Very low	205 Å²	205	167.8 Å²	167.8	90%	0.899	86%	0.863	S	S	*	*			cis	-133.5	161.5	13.8	-98.3	-90	0	0	0	113.8
4	L	39.6	Very low	38.4	Very low	168 Å²	168	173.2 Å²	173.2	88%	0.88	87%	0.867	S	S	*	*			trans	-84.8	150.8	163.7	-76.1	160.3	0	0	0	110.6
5	S	36	Very low	38.5	Very low	115 Å²	115	168.7 Å²	168.7	80%	0.804	87%	0.868	S	S	*	*			trans	-139.8	117.5	157.7	-170.8	0	0	0	0	110.3
6	R	35.3	Very low	38	Very low	236 Å²	236	164.3 Å²	164.3	89%	0.891	86%	0.864	S	S	*	*	P	Polyproline II helix	trans	-96	131.1	167.5	-79.5	177.5	165	-178	-5.4	107.7
7	Q	40.4	Very low	38	Very low	191 Å²	191	161.1 Å²	161.1	89%	0.893	87%	0.866	S	S	*	*	P	Polyproline II helix	trans	-88.8	141.9	160	-67.9	-170.7	-1.4	0	0	109.8
8	Q	40.8	Very low	37.7	Very low	183 Å²	183	157.8 Å²	157.8	86%	0.855	87%	0.865	S	S	*	*	P	Polyproline II helix	trans	-96.9	153.4	177	-68.1	177.6	-59.2	0	0	110.5
9	P	46.3	Very low	37.2	Very low	116 Å²	116	156.2 Å²	156.2	75%	0.753	87%	0.865	S	S	*	*	P	Polyproline II helix	trans	-68	155.4	165.9	31.2	-35.2	0	0	0	111.3
10	P	45.6	Very low	36.9	Very low	120 Å²	120	153.4 Å²	153.4	78%	0.779	86%	0.857	S	S	*	*	P	Polyproline II helix	trans	-69.5	154	-179.9	29.2	-35.6	0	0	0	112.8
11	P	41.8	Very low	36.6	Very low	123 Å²	123	154.2 Å²	154.2	80%	0.799	86%	0.858	S	S	*	*	P	Polyproline II helix	trans	-79	144.8	-173.6	31.6	-35.9	0	0	0	113.6
12	T	41.6	Very low	36.3	Very low	144 Å²	144	153.4 Å²	153.4	88%	0.883	84%	0.843	S	S	*	*	P	Polyproline II helix	trans	-70.9	129.8	168.2	45.3	0	0	0	0	110.8
13	R	34.1	Very low	36.2	Very low	246 Å²	246	157.7 Å²	157.7	93%	0.928	85%	0.851	S	S	*	*	P	Polyproline II helix	trans	-89.7	126.3	170.6	-89.8	-172.6	165.7	-170.2	-4.3	110.6
14	R	33.8	Very low	36.1	Very low	244 Å²	244	156 Å²	156	92%	0.921	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-62.8	152.3	170.4	-86.2	175.1	156.9	167.6	-8.5	111.2
15	A	39.5	Very low	35.7	Very low	106 Å²	106	155.7 Å²	155.7	88%	0.876	84%	0.842	S	S	*	*	P	Polyproline II helix	trans	-61.6	147.4	167.4	0	0	0	0	0	111.6
16	A	30.8	Very low	35.4	Very low	97 Å²	97	157.4 Å²	157.4	80%	0.802	84%	0.841	S	S	*	*			trans	-127.7	133.9	165.9	0	0	0	0	0	107.8	A18	A16-A18 PolarHBondContact O-N 3.33Å
17	A	38.8	Very low	35.2	Very low	110 Å²	110	155.5 Å²	155.5	91%	0.909	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-72.9	127.8	-177.1	0	0	0	0	0	111
18	A	31.1	Very low	34.7	Very low	102 Å²	102	150.6 Å²	150.6	84%	0.843	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-88.2	120.2	172.9	0	0	0	0	0	110	A16	A16-A18 PolarHBondContact O-N 3.33Å
19	C	29.3	Very low	34.5	Very low	127 Å²	127	148.4 Å²	148.4	86%	0.858	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-76.4	130.4	178.2	-172.1	0	0	0	0	111	L21	C19-L21 PolarHBondContact O-N 3.42Å
20	S	31.3	Very low	33.6	Very low	101 Å²	101	146.5 Å²	146.5	71%	0.706	83%	0.834	S	S	*	*			trans	-85.9	97.7	-177	52.8	0	0	0	0	112.4	R22	S20-R22 VanDerWaalsContact C-N 3.35Å; S20-R22 PolarHBondContact O-N 3.25Å
21	L	29.6	Very low	32.9	Very low	170 Å²	170	146.3 Å²	146.3	89%	0.89	84%	0.836	S	S	*	*			trans	-70.2	86.3	170.5	-88.8	163.3	0	0	0	111.3	C19 Q23	C19-L21 PolarHBondContact O-N 3.42Å; L21-Q23 PolarHBondContact O-N 2.77Å; L21-Q23 VanDerWaalsContact O-N 3.15Å
22	R	30.5	Very low	32.4	Very low	214 Å²	214	147.5 Å²	147.5	81%	0.808	84%	0.835	S	S	*	*			trans	-70.8	98.9	169.1	-84.8	-176.2	161	-172.2	-6.1	110.8	S20 K24	S20-R22 VanDerWaalsContact C-N 3.35Å; S20-R22 PolarHBondContact O-N 3.25Å; R22-K24 PolarHBondContact O-N 2.92Å
23	Q	31.4	Very low	31.7	Very low	193 Å²	193	146.2 Å²	146.2	90%	0.902	83%	0.831	S	S	*	*			trans	-75	107.3	157.9	-75.6	-175.8	-30.4	0	0	109.2	L21	L21-Q23 PolarHBondContact O-N 2.77Å; L21-Q23 VanDerWaalsContact O-N 3.15Å
24	K	29.8	Very low	31.6	Very low	171 Å²	171	143.4 Å²	143.4	74%	0.743	83%	0.829	S	S	*	*			trans	-84.2	114.4	167.3	-74.1	-175.7	175.7	-177.9	0	109	R22	R22-K24 PolarHBondContact O-N 2.92Å
25	L	31.4	Very low	31.5	Very low	160 Å²	160	141.1 Å²	141.1	84%	0.838	83%	0.828	S	S	*	*			trans	-77.7	135.1	156.5	-75.5	167.5	0	0	0	108.3
26	I	29.5	Very low	31.1	Very low	152 Å²	152	145.6 Å²	145.6	78%	0.779	83%	0.831	S	S	*	*			trans	-113.7	118.3	178.2	-61	174.3	0	0	0	106.8
27	F	31.7	Very low	31.3	Very low	196 Å²	196	150 Å²	150	86%	0.86	84%	0.835	S	S	*	*			trans	-89.1	143	165.8	-78.2	-90	0	0	0	109.6
28	A	30.7	Very low	31	Very low	88 Å²	88	154.4 Å²	154.4	73%	0.727	84%	0.837	S	S	*	*			trans	-118.7	140.7	167.9	0	0	0	0	0	108.3
29	P	35.4	Very low	31.1	Very low	137 Å²	137	158.6 Å²	158.6	89%	0.89	84%	0.839	S	S	*	*			trans	-78.5	153.7	179.3	33.3	-35.2	0	0	0	111.5
30	G	29	Very low	31.3	Very low	75 Å²	75	162 Å²	162	77%	0.773	84%	0.842	S	S	*	*			trans	-177.2	132	172.2	0	0	0	0	0	115.1
31	S	29.8	Very low	31.4	Very low	116 Å²	116	166.5 Å²	166.5	81%	0.811	85%	0.852	S	S	*	*			trans	70.8	114.3	170.9	-150.2	0	0	0	0	118
32	D	31.3	Very low	31.6	Very low	148 Å²	148	167.9 Å²	167.9	79%	0.791	85%	0.854	S	S	*	*			trans	-66.6	160.1	160	-34.3	-94.6	0	0	0	111.3
33	C	27.6	Very low	31.7	Very low	118 Å²	118	161.6 Å²	161.6	80%	0.797	86%	0.855	S	S	*	*			trans	-165.5	100	151.5	-94.1	0	0	0	0	110
34	E	31.3	Very low	32	Very low	187 Å²	187	158.4 Å²	158.4	87%	0.874	86%	0.855	S	S	*	*			trans	50.2	107.8	142.1	-64.2	166.9	-176.9	0	0	119.5
35	E	32.6	Very low	32.2	Very low	195 Å²	195	154.2 Å²	154.2	91%	0.911	86%	0.86	S	S	*	*			trans	-104.7	137.8	153.7	-68.1	179.6	136	0	0	108.2
36	E	31.2	Very low	32.4	Very low	201 Å²	201	155.3 Å²	155.3	94%	0.939	86%	0.86	S	S	*	*	P	Polyproline II helix	trans	-98.7	119.4	173	-67	-178.3	136.7	0	0	109.2
37	E	34	Very low	32.8	Very low	189 Å²	189	153.1 Å²	153.1	88%	0.883	86%	0.859	S	S	*	*	P	Polyproline II helix	trans	-103.4	130.3	170.4	-66.8	-171.1	131.1	0	0	109.7
38	E	33	Very low	33	Very low	202 Å²	202	150.1 Å²	150.1	94%	0.944	86%	0.856	S	S	*	*	P	Polyproline II helix	trans	-89	130.9	171.4	-68.5	-173.2	130.7	0	0	110.3
39	E	33.1	Very low	33.1	Very low	191 Å²	191	149.3 Å²	149.3	89%	0.893	86%	0.857	S	S	*	*	P	Polyproline II helix	trans	-86.5	136.5	-179.2	-59.7	178.8	132.8	0	0	112.3
40	E	33.8	Very low	33.1	Very low	198 Å²	198	152.2 Å²	152.2	93%	0.925	86%	0.858	S	S	*	*			trans	-128	131	154.1	-73.4	-161.1	146.6	0	0	109.9
41	E	33	Very low	33.4	Very low	196 Å²	196	156.1 Å²	156.1	92%	0.916	86%	0.862	S	S	*	*			trans	-83	136.4	-170.9	-63.3	-177.7	106.9	0	0	114.2
42	E	34.3	Very low	33.7	Very low	199 Å²	199	157 Å²	157	93%	0.93	87%	0.867	S	S	*	*			trans	-84.2	110.5	158.3	-81.4	-157.7	146.2	0	0	111.4	S44	E42-S44 PolarHBondContact O-N 3.29Å
43	G	32.8	Very low	33.8	Very low	81 Å²	81	154.5 Å²	154.5	84%	0.835	87%	0.868	S	S	*	*			trans	-74.9	109.6	174.6	0	0	0	0	0	113.4
44	S	37.6	Very low	33.9	Very low	127 Å²	127	157.8 Å²	157.8	89%	0.888	87%	0.869	S	S	*	*			trans	-69	142.9	-179.5	67	0	0	0	0	114.4	E42	E42-S44 PolarHBondContact O-N 3.29Å
45	G	33.2	Very low	34	Very low	83 Å²	83	156.5 Å²	156.5	86%	0.856	86%	0.863	S	S	*	*			trans	-144	124	172.8	0	0	0	0	0	113.4
46	H	36.3	Very low	34.4	Very low	183 Å²	183	156.4 Å²	156.4	85%	0.847	86%	0.862	S	S	*	*			trans	-122	123.6	-170.4	-133.9	-32.7	0	0	0	111.6
47	S	37.2	Very low	34.8	Very low	106 Å²	106	152.9 Å²	152.9	74%	0.741	86%	0.857	S	S	*	*			trans	-166.1	122.1	159.2	-77.6	0	0	0	0	107.8
48	T	36.3	Very low	34.7	Very low	132 Å²	132	151.4 Å²	151.4	81%	0.81	86%	0.855	S	S	*	*				65	116	59.7	68.5	0	0	0	0	114.5
49	G	33.2	Very low	35.1	Very low	71 Å²	71	147 Å²	147	73%	0.732	85%	0.846	S	S	*	*			trans	148.8	84.5	155.4	0	0	0	0	0	119.2
50	E	33.8	Very low	35.7	Very low	199 Å²	199	143.7 Å²	143.7	93%	0.93	84%	0.842	S	S	*	*			trans	68.7	162.7	134.7	-58.5	-174.8	157.4	0	0	122.6
51	D	35.7	Very low	35.7	Very low	157 Å²	157	142.3 Å²	142.3	84%	0.84	84%	0.84	S	S	*	*			trans	-89	159	-165.9	-61.9	-77.4	0	0	0	115.1
52	S	36.4	Very low	36.8	Very low	133 Å²	133	138.3 Å²	138.3	93%	0.93	83%	0.831	S	S	*	*			trans	-159.7	137.9	140.9	-84.2	0	0	0	0	111.5
53	A	34.2	Very low	36.6	Very low	97 Å²	97	134.5 Å²	134.5	80%	0.802	83%	0.826	S	S	*	*			trans	-113.4	135.1	178.2	0	0	0	0	0	111.2
54	F	29.4	Very low	36.5	Very low	186 Å²	186	135.1 Å²	135.1	82%	0.816	82%	0.824	S	S	*	*			trans	-160.5	106.6	158.5	-129.7	-103.9	0	0	0	107.1
55	Q	32.2	Very low	36.2	Very low	161 Å²	161	141.1 Å²	141.1	75%	0.752	83%	0.827	S	S	*	*				73.7	122.5	92.4	-100	179.8	0.5	0	0	115.2
56	E	40.5	Very low	36.2	Very low	192 Å²	192	142.3 Å²	142.3	90%	0.897	82%	0.822	S	S	*	*			trans	-74.3	158.6	174.7	-57.8	167	124.9	0	0	111.7
57	P	40.7	Very low	36.8	Very low	128 Å²	128	139.5 Å²	139.5	83%	0.831	82%	0.82	S	S	*	*			trans	-118.4	133.7	149.5	34.8	-25.7	0	0	0	112
58	D	31.6	Very low	36.5	Very low	157 Å²	157	138.4 Å²	138.4	84%	0.84	82%	0.817	S	S	*	*			trans	-82.3	172	-176.6	-142.8	-29.1	0	0	0	113.3
59	S	41.1	Very low	36.3	Very low	109 Å²	109	141.4 Å²	141.4	76%	0.762	82%	0.822	S	S	*	*			trans	-74.6	152.6	174.6	-61.8	0	0	0	0	112.7
60	P	46.9	Very low	36.2	Very low	123 Å²	123	142.5 Å²	142.5	80%	0.799	82%	0.824	S	S	*	*			trans	-145.1	148.6	138.5	35.8	-20.7	0	0	0	117.3
61	L	33.8	Very low	36.1	Very low	169 Å²	169	141 Å²	141	89%	0.885	82%	0.817	S	S	*	*			trans	-146.6	167.1	157.9	-84.3	178.5	0	0	0	106.6
62	P	56.1	Low	36.1	Very low	111 Å²	111	136.9 Å²	136.9	72%	0.721	81%	0.805	S	S	*	*			cis	-129	179.4	-9.6	40	-25.5	0	0	0	113.4
63	S	29.3	Very low	36	Very low	119 Å²	119	136.6 Å²	136.6	83%	0.832	79%	0.788	S	S	*	*			trans	-170.4	115.3	141.9	19.2	0	0	0	0	116.6
64	A	31.6	Very low	36.1	Very low	95 Å²	95	140.2 Å²	140.2	79%	0.785	78%	0.781	S	S	*	*				51.7	136.1	127.8	0	0	0	0	0	125.3
65	R	30.4	Very low	36.4	Very low	253 Å²	253	141 Å²	141	96%	0.955	78%	0.779	S	S	*	*			trans	93.6	142.6	149.1	-74	177.3	176.9	178.2	-0.8	121.2
66	S	33.6	Very low	36.4	Very low	108 Å²	108	144.1 Å²	144.1	76%	0.755	78%	0.784	S	S	*	*			trans	-103.9	168.5	175.3	54.8	0	0	0	0	111.4
67	P	48	Very low	36.2	Very low	124 Å²	124	139.8 Å²	139.8	81%	0.805	77%	0.774	S	S	*	*				-138.6	-169	90.8	19.6	3.9	0	0	0	111.7
68	A	31.4	Very low	37.1	Very low	82 Å²	82	139.9 Å²	139.9	68%	0.678	78%	0.775	S	S	*	*			cis	-175.1	177	-38.1	0	0	0	0	0	107.2
69	E	31.5	Very low	37	Very low	196 Å²	196	136.1 Å²	136.1	92%	0.916	77%	0.773	S	S	*	*			trans	67.8	151.4	170.5	-59.9	176.2	-173.1	0	0	116.6
70	A	32.9	Very low	36.6	Very low	93 Å²	93	136.1 Å²	136.1	77%	0.769	78%	0.78	S	S	*	*			cis	-170.8	174	-25.2	0	0	0	0	0	106.7
71	E	29.7	Very low	36.1	Very low	169 Å²	169	139.1 Å²	139.1	79%	0.79	78%	0.783	S	S	*	*			cis	-160.4	171.3	-9.6	-137.2	-58.2	73.9	0	0	107.4
72	A	36.4	Very low	37.3	Very low	70 Å²	70	136.5 Å²	136.5	58%	0.579	78%	0.776	S	S	*	*			trans	70	145.2	142.4	0	0	0	0	0	121
73	E	35.1	Very low	36.2	Very low	126 Å²	126	136.8 Å²	136.8	59%	0.589	78%	0.781	S	S	*	*			cis	-149.5	145.5	1.2	-96.9	-123.3	141.7	0	0	111.6
74	R	36.8	Very low	36.7	Very low	173 Å²	173	136.6 Å²	136.6	65%	0.653	78%	0.78	S	S	*	*			trans	45.4	139.4	138.3	-61.5	-168.2	-149.6	-121.2	-6.8	120.5
75	R	35.3	Very low	38.1	Very low	203 Å²	203	138.2 Å²	138.2	77%	0.766	78%	0.782	S	S	*	*			cis	-160	-175.4	22.2	-112.6	150.7	-172.8	132	-3	107.3
76	R	31.1	Very low	38.2	Very low	227 Å²	227	129.6 Å²	129.6	86%	0.857	77%	0.772	S	S	*	*			cis	-151.9	-175.6	13.2	-152.3	-172.9	164	148.1	-1.9	109.8
77	S	36.8	Very low	38.5	Very low	100 Å²	100	133 Å²	133	70%	0.699	78%	0.776	S	S	*	*			trans	-154.6	-169.2	179.3	-33.8	0	0	0	0	108.7
78	P	58.8	Low	37.8	Very low	131 Å²	131	133.5 Å²	133.5	85%	0.851	77%	0.771	S	S	*	*			cis	-145.3	-179.7	10.9	44.5	-25.1	0	0	0	119
79	G	30.4	Very low	38.1	Very low	77 Å²	77	137.5 Å²	137.5	79%	0.794	78%	0.776	S	S	*	*			trans	124.8	132.5	147.9	0	0	0	0	0	115.8
80	A	32.6	Very low	38.2	Very low	109 Å²	109	135 Å²	135	90%	0.901	77%	0.769	S	S	*	*			cis	-155.6	172.3	-10.1	0	0	0	0	0	110.6
81	E	35.5	Very low	38.2	Very low	187 Å²	187	137.2 Å²	137.2	87%	0.874	77%	0.768	S	S	*	*			trans	-111.3	169.3	-157.4	-82.2	-113.2	131	0	0	117.3
82	P	61.1	Low	38.3	Very low	113 Å²	113	135.3 Å²	135.3	73%	0.734	76%	0.762	S	S	*	*			trans	-103.3	-170.7	-178.9	42	-36	0	0	0	114.9
83	S	32	Very low	38	Very low	117 Å²	117	138.7 Å²	138.7	82%	0.818	77%	0.77	S	S	*	*			trans	-156.6	153.8	175.1	58.7	0	0	0	0	115.6
84	S	40.1	Very low	37.9	Very low	116 Å²	116	139.9 Å²	139.9	81%	0.811	78%	0.779	S	S	*	*			trans	-130	-155.3	174.1	-48.1	0	0	0	0	109
85	P	60.9	Low	37.6	Very low	129 Å²	129	143.7 Å²	143.7	84%	0.838	79%	0.794	S	S	*	*			cis	-138.8	-167.9	-16	42.1	-22.6	0	0	0	115.3
86	G	32.8	Very low	37.4	Very low	72 Å²	72	138 Å²	138	74%	0.742	80%	0.798	S	S	*	*			trans	94.3	160.1	157.7	0	0	0	0	0	118.6
87	E	38.8	Very low	37.3	Very low	179 Å²	179	131 Å²	131	84%	0.836	80%	0.797	S	S	*	*			cis	-170.2	164	-15.6	-139.7	170.8	-142.9	0	0	112.1
88	L	34.7	Very low	37	Very low	134 Å²	134	130.4 Å²	130.4	70%	0.702	81%	0.807	S	S	*	*			trans	70.9	121.9	158.6	-59.4	173.1	0	0	0	126.1
89	E	36.9	Very low	35.7	Very low	166 Å²	166	128 Å²	128	78%	0.776	81%	0.805	S	S	*	*				55.5	151.5	125.4	-64.8	179.6	155.1	0	0	128.5
90	D	33.9	Very low	35.9	Very low	144 Å²	144	128.2 Å²	128.2	77%	0.77	81%	0.808	S	S	*	*			trans	71	105.9	152.4	-71.5	4.6	0	0	0	128.2
91	D	32.6	Very low	36.1	Very low	140 Å²	140	126.8 Å²	126.8	75%	0.749	80%	0.796	S	S	*	*				69	152.2	113.3	-138.2	6.9	0	0	0	126.7
92	L	30.8	Very low	36.2	Very low	129 Å²	129	126.9 Å²	126.9	68%	0.675	80%	0.797	S	S	*	*			trans	67.7	110.8	159.8	-58	178.8	0	0	0	125.6
93	L	31.5	Very low	35	Very low	141 Å²	141	125.2 Å²	125.2	74%	0.738	79%	0.792	S	S	*	*				80.7	130.7	124.2	-64.3	175.3	0	0	0	126.4
94	L	32.5	Very low	35.2	Very low	150 Å²	150	126.1 Å²	126.1	79%	0.785	79%	0.793	S	S	*	*			trans	73.8	102.2	134.6	-72.2	168.5	0	0	0	124.4
95	R	31	Very low	34.7	Very low	253 Å²	253	124.6 Å²	124.6	96%	0.955	80%	0.796	S	S	*	*				171.3	149.2	119.3	-93.8	171.2	173.3	-144	-2.6	108.4
96	G	30	Very low	33.3	Very low	83 Å²	83	121.7 Å²	121.7	86%	0.856	79%	0.789	S	S	*	*			cis	116.8	129.3	14.2	0	0	0	0	0	109.9
97	G	30.6	Very low	33.2	Very low	80 Å²	80	123.4 Å²	123.4	83%	0.825	80%	0.797	S	S	*	*			cis	172.1	179	-2.8	0	0	0	0	0	112
98	G	30.5	Very low	32.9	Very low	89 Å²	89	119.9 Å²	119.9	92%	0.918	80%	0.798	S	S	*	*			trans	83.7	145.5	176.5	0	0	0	0	0	114.8
99	G	31.3	Very low	33	Very low	79 Å²	79	123.1 Å²	123.1	81%	0.814	81%	0.809	S	S	*	*			cis	-134.7	165.5	-13.6	0	0	0	0	0	108.8
100	G	34.1	Very low	32.8	Very low	83 Å²	83	118.7 Å²	118.7	86%	0.856	81%	0.809	S	S	*	*			cis	97	118.7	48.2	0	0	0	0	0	108.2
101	A	36.5	Very low	32.7	Very low	79 Å²	79	119.1 Å²	119.1	65%	0.653	81%	0.811	S	S	*	*			cis	-143.7	155.3	5.3	0	0	0	0	0	109.7
102	E	36.8	Very low	32.5	Very low	188 Å²	188	116.5 Å²	116.5	88%	0.879	80%	0.804	S	S	*	*				60	147.7	105.4	-67.5	-172.4	121.4	0	0	116
103	A	37	Very low	32.5	Very low	78 Å²	78	120.1 Å²	120.1	65%	0.645	81%	0.808	S	S	*	*			cis	-179.2	169.9	-11.1	0	0	0	0	0	105.7
104	T	35	Very low	32.6	Very low	137 Å²	137	121.1 Å²	121.1	84%	0.84	81%	0.809	S	S	*	*			cis	-162.1	153	1.1	-4	0	0	0	0	108.2
105	G	31.2	Very low	32.7	Very low	83 Å²	83	122.6 Å²	122.6	86%	0.856	81%	0.812	S	S	*	*			trans	55.3	152.9	144.5	0	0	0	0	0	120.6
106	G	30.4	Very low	33	Very low	68 Å²	68	118.8 Å²	118.8	70%	0.701	81%	0.805	S	S	*	*			cis	-169	141.7	-5	0	0	0	0	0	106.8
107	A	30.5	Very low	33	Very low	109 Å²	109	118.5 Å²	118.5	90%	0.901	80%	0.802	S	S	*	*				64.5	89.2	83.6	0	0	0	0	0	114.3
108	A	33.5	Very low	33.1	Very low	104 Å²	104	124.8 Å²	124.8	86%	0.86	81%	0.807	S	S	*	*			trans	-168.3	158.4	150.8	0	0	0	0	0	110.9
109	E	37.4	Very low	33	Very low	202 Å²	202	124.3 Å²	124.3	94%	0.944	80%	0.802	S	S	*	*			trans	-91.6	170.9	177.2	-63.1	154.1	119.5	0	0	111.9
110	G	30.8	Very low	33.1	Very low	74 Å²	74	126 Å²	126	76%	0.763	80%	0.802	S	S	*	*			trans	177.8	123.5	173.1	0	0	0	0	0	114.8
111	D	32.1	Very low	33	Very low	152 Å²	152	127.7 Å²	127.7	81%	0.813	80%	0.8	S	S	*	*			trans	-90.9	149	-165.3	-60.5	-69.7	0	0	0	117.3
112	S	28.7	Very low	32.9	Very low	86 Å²	86	129 Å²	129	60%	0.601	81%	0.805	S	S	*	*				76.5	158.6	129.2	66.1	0	0	0	0	124.4
113	W	31.2	Very low	33.8	Very low	204 Å²	204	125.6 Å²	125.6	77%	0.773	80%	0.799	S	S	*	*			trans	72.8	114.5	169.1	-48.7	105.6	0	0	0	116.1
114	E	32.7	Very low	33.6	Very low	162 Å²	162	127.2 Å²	127.2	76%	0.757	80%	0.8	S	S	*	*				70.6	145.1	91.3	-72.4	-178.2	179.3	0	0	113.7
115	E	35.5	Very low	33.4	Very low	181 Å²	181	130 Å²	130	85%	0.846	80%	0.801	S	S	*	*			cis	-145.4	-154.3	27	-150.8	-168.2	-157.9	0	0	113.3
116	E	37	Very low	33.5	Very low	173 Å²	173	131.1 Å²	131.1	81%	0.808	80%	0.795	S	S	*	*			trans	-82.2	173.5	-169.2	-57.9	-167.8	142.2	0	0	116.4
117	G	29.5	Very low	34.5	Very low	77 Å²	77	134 Å²	134	79%	0.794	80%	0.802	S	S	*	*			trans	-170	89.1	171.1	0	0	0	0	0	115.9
118	F	32.8	Very low	34.7	Very low	213 Å²	213	133.5 Å²	133.5	93%	0.934	80%	0.798	S	S	*	*			trans	-72.4	145	169.4	-98.5	-101.3	0	0	0	112.3
119	G	29.3	Very low	34.6	Very low	78 Å²	78	134.8 Å²	134.8	80%	0.804	80%	0.795	S	S	*	*			trans	177.7	133.3	167.1	0	0	0	0	0	114.5
120	S	32.3	Very low	34.5	Very low	116 Å²	116	129.3 Å²	129.3	81%	0.811	78%	0.784	S	S	*	*			trans	-135.8	177.1	179	74.9	0	0	0	0	112.6
121	S	32.7	Very low	34.5	Very low	117 Å²	117	136.6 Å²	136.6	82%	0.818	79%	0.79	S	S	*	*			trans	97.9	160.4	168.6	81.5	0	0	0	0	118.2
122	S	33.9	Very low	34.5	Very low	107 Å²	107	138.5 Å²	138.5	75%	0.748	79%	0.792	S	S	*	*			trans	-126.8	-150.6	-159.4	-32.3	0	0	0	0	109.6
123	P	57.3	Low	34.7	Very low	117 Å²	117	142.5 Å²	142.5	76%	0.76	81%	0.805	S	S	*	*			cis	-117.5	-154.6	-48.7	35.3	-20.3	0	0	0	110
124	V	31.8	Very low	34.6	Very low	111 Å²	111	136.1 Å²	136.1	67%	0.673	80%	0.803	S	S	*	*				156.8	124.7	129.1	159	0	0	0	0	117.2
125	K	30.8	Very low	34.5	Very low	197 Å²	197	134.5 Å²	134.5	86%	0.857	81%	0.81	S	S	*	*			trans	65.6	144.7	149	-75.8	167.8	-162.4	167.2	0	125
126	S	34.2	Very low	34.5	Very low	105 Å²	105	131.1 Å²	131.1	73%	0.734	81%	0.806	S	S	*	*			trans	-101.1	-173.2	161.2	39.8	0	0	0	0	111.8
127	P	49.8	Very low	34.2	Very low	130 Å²	130	132.8 Å²	132.8	84%	0.844	81%	0.811	S	S	*	*			trans	-136.5	167.7	139.9	39.3	-29	0	0	0	114.3
128	A	34.6	Very low	34.4	Very low	98 Å²	98	134.2 Å²	134.2	81%	0.81	81%	0.809	S	S	*	*			trans	-158.5	143.1	175.9	0	0	0	0	0	114.9
129	T	31.8	Very low	35.6	Very low	131 Å²	131	129.1 Å²	129.1	80%	0.804	80%	0.797	S	S	*	*			trans	-159.6	154.9	157.2	46.6	0	0	0	0	108.4
130	A	35.5	Very low	35.9	Very low	87 Å²	87	130.9 Å²	130.9	72%	0.719	79%	0.792	S	S	*	*			cis	92.7	104.7	2.9	0	0	0	0	0	119.1
131	Y	31.7	Very low	35.8	Very low	227 Å²	227	133 Å²	133	89%	0.89	79%	0.793	S	S	*	*			trans	-152.6	170	154.4	-91.6	-59.2	0	0	0	111.4
132	F	32.5	Very low	35.9	Very low	192 Å²	192	133.1 Å²	133.1	84%	0.842	79%	0.793	S	S	*	*			trans	-81.2	-179.9	-169.5	-78.9	-113.1	0	0	0	113.4
133	L	32.4	Very low	35.6	Very low	169 Å²	169	132.2 Å²	132.2	89%	0.885	80%	0.801	S	S	*	*			cis	-172.3	164.1	33.4	-143.6	141.3	0	0	0	111.4
134	G	27.7	Very low	34.3	Very low	70 Å²	70	130.4 Å²	130.4	72%	0.722	80%	0.803	S	S	*	*			trans	125.9	128.4	149.7	0	0	0	0	0	119.1
135	S	31.1	Very low	35.5	Very low	129 Å²	129	131.8 Å²	131.8	90%	0.902	81%	0.814	S	S	*	*			trans	-96.6	169.2	-174.4	-50.8	0	0	0	0	115.4
136	S	36.9	Very low	35.5	Very low	110 Å²	110	126.2 Å²	126.2	77%	0.769	81%	0.812	S	S	*	*			trans	-96.1	161.8	-176.7	43.1	0	0	0	0	115.7
137	F	28.8	Very low	35.5	Very low	207 Å²	207	129.3 Å²	129.3	91%	0.908	82%	0.821	S	S	*	*			trans	-152.9	166.7	168.5	-94.2	-71.3	0	0	0	114
138	S	33.6	Very low	34.6	Very low	107 Å²	107	127.4 Å²	127.4	75%	0.748	82%	0.816	S	S	*	*			trans	-146.6	-163.1	171.6	-52.3	0	0	0	0	106.6
139	P	58.8	Low	34.6	Very low	107 Å²	107	128.3 Å²	128.3	70%	0.695	82%	0.816	S	S	*	*			cis	-141.7	-152.1	-1.7	40.7	-17.5	0	0	0	114.6
140	V	34.8	Very low	36.1	Very low	114 Å²	114	128.3 Å²	128.3	69%	0.691	82%	0.819	S	S	*	*			trans	66.6	160.7	170.2	-77.3	0	0	0	0	117.6
141	L	31.9	Very low	35.9	Very low	161 Å²	161	127.8 Å²	127.8	84%	0.843	82%	0.822	S	S	*	*			cis	-111.4	-142.4	9.9	-77.6	79.4	0	0	0	115.1
142	C	33.7	Very low	35.8	Very low	120 Å²	120	124 Å²	124	81%	0.811	82%	0.817	S	S	*	*			trans	-166.3	163.6	-132.3	-71	0	0	0	0	113.2
143	G	28.1	Very low	35.6	Very low	88 Å²	88	120.2 Å²	120.2	91%	0.907	81%	0.813	S	S	*	*			trans	158.9	151.9	166.8	0	0	0	0	0	115.8
144	G	29.1	Very low	35.5	Very low	78 Å²	78	116.2 Å²	116.2	80%	0.804	81%	0.813	S	S	*	*			trans	-173.1	-164.7	175.6	0	0	0	0	0	109.5
145	P	58.4	Low	35.7	Very low	140 Å²	140	117.5 Å²	117.5	91%	0.909	82%	0.816	S	S	*	*			cis	-129.2	-168.8	-5.6	42.9	-26.4	0	0	0	113.5
146	G	30.8	Very low	36.6	Very low	80 Å²	80	117.7 Å²	117.7	83%	0.825	81%	0.814	S	S	*	*			trans	170.8	123.4	167.1	0	0	0	0	0	117.4
147	D	34	Very low	36.3	Very low	170 Å²	170	115.5 Å²	115.5	91%	0.909	81%	0.81	S	S	*	*			trans	-63.4	176.3	-169	-103	-55.5	0	0	0	121.9
148	A	30.9	Very low	36.4	Very low	91 Å²	91	110.3 Å²	110.3	75%	0.752	81%	0.805	S	S	*	*			trans	94.2	157.5	149.7	0	0	0	0	0	122.1
149	S	34.4	Very low	36.4	Very low	116 Å²	116	112.2 Å²	112.2	81%	0.811	81%	0.806	S	S	*	*			trans	-158	-176.3	-179.6	-38.9	0	0	0	0	108.1
150	P	63.9	Low	35.3	Very low	131 Å²	131	115.9 Å²	115.9	85%	0.851	81%	0.814	S	S	*	*			cis	-130.5	-170.4	-20.4	40.9	-24.5	0	0	0	113.3
151	G	30	Very low	35.3	Very low	76 Å²	76	113.6 Å²	113.6	78%	0.784	81%	0.814	S	S	*	*			trans	113.4	167.2	161.8	0	0	0	0	0	115.2
152	D	30.5	Very low	35.7	Very low	149 Å²	149	112.5 Å²	112.5	80%	0.797	82%	0.816	S	S	*	*			cis	-165.9	165.4	-25.3	-172	17.2	0	0	0	107.8
153	C	28.4	Very low	35.6	Very low	112 Å²	112	112.8 Å²	112.8	76%	0.757	82%	0.818	S	S	*	*			trans	40	126.6	158.3	68.4	0	0	0	0	121.8
154	G	29	Very low	36	Very low	85 Å²	85	113.9 Å²	113.9	88%	0.876	81%	0.812	S	S	*	*			trans	169.6	107.5	163.3	0	0	0	0	0	116.7
155	A	32.2	Very low	36.9	Very low	96 Å²	96	115.8 Å²	115.8	79%	0.793	81%	0.81	S	S	*	*			trans	-121	-173.4	165.5	0	0	0	0	0	108.1
156	P	49.5	Very low	35.6	Very low	133 Å²	133	118 Å²	118	86%	0.864	81%	0.808	S	S	*	*			cis	-137.9	-175.4	-1.4	43.2	-25.2	0	0	0	115.5
157	G	30.8	Very low	36.2	Very low	65 Å²	65	119.2 Å²	119.2	67%	0.67	80%	0.802	S	S	*	*			trans	151.8	117.3	165.6	0	0	0	0	0	111.6
158	A	31.9	Very low	36	Very low	98 Å²	98	118.7 Å²	118.7	81%	0.81	80%	0.799	S	S	*	*				70.1	122.1	69.5	0	0	0	0	0	111.7
159	L	33.8	Very low	36.2	Very low	147 Å²	147	124.7 Å²	124.7	77%	0.77	80%	0.803	S	S	*	*			cis	-154.5	163.9	17.7	-100.8	144.1	0	0	0	111.7
160	E	35.7	Very low	36.3	Very low	183 Å²	183	125.1 Å²	125.1	86%	0.855	80%	0.803	S	S	*	*			trans	60.3	163.1	160.4	-67.8	159.5	-139.5	0	0	117.4
161	G	33.4	Very low	34.8	Very low	67 Å²	67	124.4 Å²	124.4	69%	0.691	80%	0.802	S	S	*	*			cis	-169.1	151	-8.2	0	0	0	0	0	108.8
162	P	41.7	Very low	35.3	Very low	138 Å²	138	127.2 Å²	127.2	90%	0.896	80%	0.804	S	S	*	*			trans	-93.4	135.2	-157.5	34.1	-35.4	0	0	0	116.2
163	C	30.8	Very low	35.5	Very low	126 Å²	126	125.4 Å²	125.4	85%	0.851	80%	0.8	S	S	*	*			trans	-158	140.1	144	-157.5	0	0	0	0	111.4
164	S	37.2	Very low	36	Very low	111 Å²	111	126.2 Å²	126.2	78%	0.776	80%	0.804	S	S	*	*			trans	-124.4	149	170.1	-48.2	0	0	0	0	107.4
165	P	47.7	Very low	36.5	Very low	118 Å²	118	131.1 Å²	131.1	77%	0.766	80%	0.804	S	S	*	*				-152.9	153.8	78.8	39	-21.1	0	0	0	116.8
166	Q	30.9	Very low	36.6	Very low	186 Å²	186	135.8 Å²	135.8	87%	0.869	81%	0.806	S	S	*	*				174.1	166	127.3	-89.1	-128.2	-72.6	0	0	110.2
167	P	43.6	Very low	35.9	Very low	106 Å²	106	136 Å²	136	69%	0.688	81%	0.805	S	S	*	*			trans	-99.6	171	-159.7	39.3	-36.2	0	0	0	114
168	D	30.2	Very low	36.4	Very low	158 Å²	158	142.6 Å²	142.6	85%	0.845	82%	0.816	S	S	*	*			trans	-156.1	164.5	149.9	-124.8	-33.4	0	0	0	113.4
169	Y	34.7	Very low	36.5	Very low	217 Å²	217	149.5 Å²	149.5	85%	0.851	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-76.7	140.5	-178.7	-82.3	-109.8	0	0	0	113.3
170	P	37	Very low	36.7	Very low	125 Å²	125	150.9 Å²	150.9	81%	0.812	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-79.6	132.6	161.5	32.4	-31.4	0	0	0	111.1
171	S	32.5	Very low	37	Very low	116 Å²	116	150 Å²	150	81%	0.811	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-89.2	166.3	-175.1	53.5	0	0	0	0	114.3
172	T	39.5	Very low	37.8	Very low	135 Å²	135	156 Å²	156	83%	0.828	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-65	127.6	-173.8	-42.4	0	0	0	0	113.3
173	P	35.7	Very low	38.2	Very low	111 Å²	111	154 Å²	154	72%	0.721	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-75.9	151.4	174.3	31	-34.6	0	0	0	112.5
174	P	37.8	Very low	39.3	Very low	129 Å²	129	155.9 Å²	155.9	84%	0.838	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-81.3	153.4	-169	32	-36.8	0	0	0	114.9
175	H	40.2	Very low	39.5	Very low	188 Å²	188	156.7 Å²	156.7	87%	0.87	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-64	130.5	175.4	-72.1	-89.9	0	0	0	113.7
176	K	34.1	Very low	40.1	Very low	194 Å²	194	154.2 Å²	154.2	84%	0.843	78%	0.777	S	S	*	*			trans	-165	143.8	137.8	-107.1	151.3	-172.6	174.6	0	113.2
177	T	34.8	Very low	41	Very low	137 Å²	137	151.3 Å²	151.3	84%	0.84	77%	0.774	S	S	*	*			trans	50.9	102.8	163	52	0	0	0	0	119.2	R179	T177-R179 PolarHBondContact O-N 3.32Å
178	F	41	Very low	41.1	Very low	204 Å²	204	154.6 Å²	154.6	90%	0.895	78%	0.779	S	S	*	*			trans	-65.4	118.7	166.8	-73.8	-99.4	0	0	0	113.1
179	R	34.7	Very low	42.7	Very low	243 Å²	243	148.5 Å²	148.5	92%	0.917	75%	0.748	S	S	*	*			trans	-153.3	138.2	136.1	-72.1	-155.5	172.8	174.2	-2	110.4	T177	T177-R179 PolarHBondContact O-N 3.32Å
180	K	37.9	Very low	43.7	Very low	176 Å²	176	141.6 Å²	141.6	77%	0.765	73%	0.73	S	S	*	*			trans	50.1	80.6	176.1	-67.2	-162.3	174.1	-163.1	0	116.5
181	L	41.5	Very low	44.7	Very low	166 Å²	166	144.4 Å²	144.4	87%	0.869	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-68.4	133.4	148.7	-70	172.1	0	0	0	108.9
182	R	50.2	Low	45.8	Very low	191 Å²	191	142 Å²	142	72%	0.721	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-102.7	135	162.1	-75.5	178.4	165.1	168.1	-5.4	107.4	F184	R182-F184 PolarHBondContact O-N 3.33Å
183	L	50.1	Low	46	Very low	97 Å²	97	139.6 Å²	139.6	51%	0.508	69%	0.694	S	S	.	*	P	Polyproline II helix	trans	-68	132.5	166.1	-77.7	92.2	0	0	0	108.5	T189 L193 L194	L183-T189 HydrophobicContact CD2-CG2 3.91Å; L183-L193 HydrophobicContact CD2-CB 4.07Å; L183-L193 HydrophobicContact CD2-CD1 4.3Å; L183-L194 HydrophobicContact CB-CD2 4.15Å
184	F	53.4	Low	46.9	Very low	166 Å²	166	135.8 Å²	135.8	73%	0.728	67%	0.668	S	S	*	*	P	Polyproline II helix	trans	-93.5	135.9	170.4	-71.2	-86	0	0	0	109.4	R182 T186	R182-F184 PolarHBondContact O-N 3.33Å; F184-T186 PolarHBondContact O-N 2.93Å; F184-T186 PolarHBondContact O-OG1 3.24Å
185	D	41.4	Very low	47.4	Very low	128 Å²	128	133 Å²	133	68%	0.684	65%	0.651	S	S	*	*	P	Polyproline II helix	trans	-66.7	117.1	177.2	-158.3	-12.6	0	0	0	109.4	L194	D185-L194 HydrophobicContact CB-CD1 4.48Å
186	T	60.3	Low	47.9	Very low	66 Å²	66	131.2 Å²	131.2	41%	0.405	64%	0.641	S	S	.	*			trans	-144.9	147.2	-175.6	44.1	0	0	0	0	108	F184 H188 T189	F184-T186 PolarHBondContact O-N 2.93Å; F184-T186 PolarHBondContact O-OG1 3.24Å; T186-H188 PolarHBondContact O-N 3.31Å; T186-T189 WeakPolarHBondContact O-CB 3.45Å; T186-T189 PolarHBondContact O-N 2.9Å; T186-T189 PolarHBondContact OG1-OG1 3.02Å
187	P	50.4	Low	48.6	Very low	125 Å²	125	124.5 Å²	124.5	81%	0.812	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.7	-6.9	-168.6	24.4	-35	0	0	0	115.3
188	H	46.4	Very low	49.2	Very low	174 Å²	174	128 Å²	128	81%	0.806	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.9	3.1	177.1	-52.6	-59.1	0	0	0	113.6	T186	T186-H188 PolarHBondContact O-N 3.31Å
189	T	62.9	Low	49.3	Very low	31 Å²	31	124 Å²	124	19%	0.19	61%	0.611	C	S	.	*	S	Bend	trans	-84.8	125.2	176.3	-68.1	0	0	0	0	111	L183 T186 K191 L194	L183-T189 HydrophobicContact CD2-CG2 3.91Å; T186-T189 WeakPolarHBondContact O-CB 3.45Å; T186-T189 PolarHBondContact O-N 2.9Å; T186-T189 PolarHBondContact OG1-OG1 3.02Å; T189-K191 PolarHBondContact O-N 3.05Å; T189-L194 HydrophobicContact CG2-CD1 4.25Å; T189-L194 HydrophobicContact CG2-CD2 4.38Å; T189-L194 HydrophobicContact CG2-CG 4.07Å
190	P	56.2	Low	49.6	Very low	72 Å²	72	119 Å²	119	47%	0.468	60%	0.601	S	S	.	*			trans	-58.3	125	175.1	-26.2	34.8	0	0	0	112.6	S192 L193	P190-S192 PolarHBondContact O-N 3.45Å; P190-S192 VanDerWaalsContact O-N 3.1Å; P190-L193 HydrophobicContact CB-CD1 4.43Å; P190-L193 HydrophobicContact CG-CD1 4.36Å; P190-L193 PolarHBondContact O-N 2.9Å
191	K	58.6	Low	49.5	Very low	183 Å²	183	116.2 Å²	116.2	80%	0.796	60%	0.595	S	S	*	*	H	α-helix	trans	-62.2	-21.4	-177.6	-65.6	179.2	-179.7	175.7	0	113.2	T189 L193 L194 S195	T189-K191 PolarHBondContact O-N 3.05Å; K191-L193 VanDerWaalsContact C-N 3.34Å; K191-L194 PolarHBondContact O-N 2.94Å; K191-S195 PolarHBondContact O-N 3.22Å
192	S	55.1	Low	49	Very low	66 Å²	66	113.9 Å²	113.9	46%	0.462	59%	0.592	S	S	.	*	H	α-helix	trans	-66.4	-26.8	172.5	54.1	0	0	0	0	114.2	P190 S195 K196	P190-S192 PolarHBondContact O-N 3.45Å; P190-S192 VanDerWaalsContact O-N 3.1Å; S192-S195 PolarHBondContact O-OG 2.95Å; S192-S195 VanDerWaalsContact O-OG 3.07Å; S192-K196 WeakPolarHBondContact O-CG 3.44Å; S192-K196 PolarHBondContact O-N 3.42Å
193	L	44.1	Very low	48.1	Very low	84 Å²	84	110.1 Å²	110.1	44%	0.44	60%	0.595	S	S	.	*	H	α-helix	trans	-77.4	-39.1	172.5	-76	166.4	0	0	0	111.4	L183 P190 K191 K196 A197	L183-L193 HydrophobicContact CD2-CB 4.07Å; L183-L193 HydrophobicContact CD2-CD1 4.3Å; P190-L193 HydrophobicContact CB-CD1 4.43Å; P190-L193 HydrophobicContact CG-CD1 4.36Å; P190-L193 PolarHBondContact O-N 2.9Å; K191-L193 VanDerWaalsContact C-N 3.34Å; L193-K196 PolarHBondContact O-N 3.28Å; L193-A197 WeakPolarHBondContact O-CB 3.48Å; L193-A197 PolarHBondContact O-N 2.89Å
194	L	53.7	Low	47.2	Very low	32 Å²	32	111.2 Å²	111.2	17%	0.168	61%	0.611	C	S	.	*	H	α-helix	trans	-68.1	-34.1	177.8	-65.4	173.9	0	0	0	112.4	L183 D185 T189 K191 R198	L183-L194 HydrophobicContact CB-CD2 4.15Å; D185-L194 HydrophobicContact CB-CD1 4.48Å; T189-L194 HydrophobicContact CG2-CD1 4.25Å; T189-L194 HydrophobicContact CG2-CD2 4.38Å; T189-L194 HydrophobicContact CG2-CG 4.07Å; K191-L194 PolarHBondContact O-N 2.94Å; L194-R198 PolarHBondContact O-N 3.18Å
195	S	48.8	Very low	46.1	Very low	69 Å²	69	109.9 Å²	109.9	48%	0.483	62%	0.616	S	S	.	*	H	α-helix	trans	-67.2	-47.3	173.6	64.5	0	0	0	0	111.8	K191 S192 A197 R198	K191-S195 PolarHBondContact O-N 3.22Å; S192-S195 PolarHBondContact O-OG 2.95Å; S192-S195 VanDerWaalsContact O-OG 3.07Å; S195-A197 VanDerWaalsContact C-N 3.3Å; S195-A197 PolarHBondContact O-N 3.36Å; S195-R198 PolarHBondContact O-N 3.44Å
196	K	49.4	Very low	45.7	Very low	152 Å²	152	113.6 Å²	113.6	66%	0.661	63%	0.626	S	S	*	*	H	α-helix	trans	-60.6	-36.9	176	-72.2	177	179.3	178.2	0	112.5	S192 L193 R198 V199	S192-K196 WeakPolarHBondContact O-CG 3.44Å; S192-K196 PolarHBondContact O-N 3.42Å; L193-K196 PolarHBondContact O-N 3.28Å; K196-R198 VanDerWaalsContact C-N 3.34Å; K196-R198 PolarHBondContact O-N 2.94Å; K196-V199 PolarHBondContact O-N 3.5Å
197	A	48.7	Very low	44.2	Very low	52 Å²	52	117.7 Å²	117.7	43%	0.43	65%	0.645	S	S	.	*	H	α-helix	trans	-65.9	-30.3	177.5	0	0	0	0	0	114	L193 S195 V199	L193-A197 WeakPolarHBondContact O-CB 3.48Å; L193-A197 PolarHBondContact O-N 2.89Å; S195-A197 VanDerWaalsContact C-N 3.3Å; S195-A197 PolarHBondContact O-N 3.36Å; A197-V199 VanDerWaalsContact C-N 3.33Å; A197-V199 PolarHBondContact O-N 3.12Å
198	R	47.6	Very low	43.2	Very low	210 Å²	210	123 Å²	123	79%	0.792	65%	0.649	S	S	*	*	H	α-helix	trans	-75.8	-14.9	-179.8	-74.6	-175.1	-177.8	-164.2	2.5	114.6	L194 S195 K196	L194-R198 PolarHBondContact O-N 3.18Å; S195-R198 PolarHBondContact O-N 3.44Å; K196-R198 VanDerWaalsContact C-N 3.34Å; K196-R198 PolarHBondContact O-N 2.94Å
199	V	44.3	Very low	42.2	Very low	121 Å²	121	118.6 Å²	118.6	73%	0.733	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.1	-12.9	-175.7	178.2	0	0	0	0	112.8	K196 A197	K196-V199 PolarHBondContact O-N 3.5Å; A197-V199 VanDerWaalsContact C-N 3.33Å; A197-V199 PolarHBondContact O-N 3.12Å
200	I	41.1	Very low	40.5	Very low	138 Å²	138	121 Å²	121	71%	0.708	68%	0.682	S	S	*	*	S	Bend	trans	-97	-28.5	-167.7	-61.8	177	0	0	0	113.8	S202	I200-S202 PolarHBondContact O-N 3.11Å
201	D	34.6	Very low	39.3	Very low	118 Å²	118	122.3 Å²	122.3	63%	0.631	69%	0.693	S	S	*	*	S	Bend	trans	-95.4	74.4	178.8	-90.7	-20.7	0	0	0	111.4
202	S	32.2	Very low	38	Very low	116 Å²	116	121.9 Å²	121.9	81%	0.811	70%	0.698	S	S	*	*			trans	-162.8	86.7	163.5	-84.8	0	0	0	0	114.1	I200	I200-S202 PolarHBondContact O-N 3.11Å
203	S	30.2	Very low	36.8	Very low	112 Å²	112	126.6 Å²	126.6	78%	0.783	71%	0.71	S	S	*	*			trans	-154.7	84.6	170.2	65.9	0	0	0	0	114.2
204	S	31.1	Very low	36.2	Very low	121 Å²	121	131 Å²	131	85%	0.846	73%	0.731	S	S	*	*			trans	179	68.1	156.9	46.8	0	0	0	0	116.2
205	V	30.2	Very low	34.9	Very low	138 Å²	138	135 Å²	135	84%	0.836	75%	0.752	S	S	*	*			trans	-138.3	126.7	154.5	-173.1	0	0	0	0	110.5
206	K	33.1	Very low	33.9	Very low	206 Å²	206	138.5 Å²	138.5	90%	0.896	77%	0.771	S	S	*	*			trans	-102.2	115.1	163.4	-75.6	-176.9	176.4	-178.3	0	108.8
207	L	29.3	Very low	32.8	Very low	151 Å²	151	137.8 Å²	137.8	79%	0.791	77%	0.77	S	S	*	*			trans	-144.2	120.6	156.6	-86.2	-174.4	0	0	0	112.7
208	R	29.3	Very low	31.8	Very low	237 Å²	237	143.4 Å²	143.4	89%	0.894	79%	0.785	S	S	*	*			trans	21.4	125.7	138.4	-145.1	174.8	-64	-116	2.7	117.8
209	G	25.9	Very low	30.9	Very low	82 Å²	82	139 Å²	139	85%	0.845	79%	0.787	S	S	*	*			trans	-78.7	174.6	-177.5	0	0	0	0	0	115.9
210	G	27.1	Very low	30.1	Very low	82 Å²	82	136.9 Å²	136.9	85%	0.845	79%	0.789	S	S	*	*			trans	-164.8	129.6	171.6	0	0	0	0	0	109.5
211	S	30.5	Very low	29.5	Very low	99 Å²	99	140.6 Å²	140.6	69%	0.692	80%	0.8	S	S	*	*			trans	-94.2	136.2	177.3	177.2	0	0	0	0	110.2
212	L	31.4	Very low	29	Very low	174 Å²	174	146.2 Å²	146.2	91%	0.911	81%	0.812	S	S	*	*			trans	-142.9	129.7	156.7	-77.6	-177.8	0	0	0	109.7
213	F	29.5	Very low	28.7	Very low	164 Å²	164	149.9 Å²	149.9	72%	0.719	82%	0.816	S	S	*	*			trans	-79.2	158.4	171.1	-79.7	-115.8	0	0	0	110.9
214	M	32	Very low	28.5	Very low	176 Å²	176	154.1 Å²	154.1	87%	0.867	82%	0.821	S	S	*	*				-159	130.6	124.3	-104	-70.5	91.7	0	0	110.7
215	D	27.1	Very low	28.3	Very low	117 Å²	117	155.2 Å²	155.2	63%	0.626	82%	0.818	S	S	*	*			trans	-79.4	156	177	-74.7	-75.8	0	0	0	113
216	T	27.6	Very low	28.2	Very low	143 Å²	143	154.6 Å²	154.6	88%	0.877	81%	0.814	S	S	*	*			trans	-153.5	125.4	132.6	-66.5	0	0	0	0	108.9
217	E	26.4	Very low	28.1	Very low	137 Å²	137	155.4 Å²	155.4	64%	0.64	81%	0.812	S	S	*	*			trans	-77.4	154.9	-177.5	-37.9	170.6	113.1	0	0	113.1
218	K	28.5	Very low	28.2	Very low	169 Å²	169	157 Å²	157	74%	0.735	82%	0.815	S	S	*	*				-178	138.6	90.4	-116.7	137.2	177.8	121.2	0	117.1
219	S	27.9	Very low	28.3	Very low	119 Å²	119	151.6 Å²	151.6	83%	0.832	81%	0.808	S	S	*	*			trans	50.5	116.6	147.9	62.8	0	0	0	0	121.3
220	G	27.5	Very low	28.7	Very low	75 Å²	75	153.3 Å²	153.3	77%	0.773	80%	0.804	S	S	*	*			trans	171.9	94.4	159.5	0	0	0	0	0	112.1	R222	G220-R222 PolarHBondContact O-N 3.4Å
221	K	27.3	Very low	29	Very low	217 Å²	217	157.6 Å²	157.6	94%	0.943	81%	0.807	S	S	*	*			trans	-63	134	-178.8	-67.7	-176.9	178.5	-176.9	0	110.9
222	R	25.5	Very low	29.3	Very low	236 Å²	236	159.1 Å²	159.1	89%	0.891	81%	0.812	S	S	*	*			trans	-119.1	125.1	161.8	-96.7	-173.5	172.7	179.9	-1.3	108.9	G220	G220-R222 PolarHBondContact O-N 3.4Å
223	E	26.3	Very low	29.4	Very low	193 Å²	193	158.1 Å²	158.1	90%	0.902	81%	0.807	S	S	*	*			trans	-82.8	143.5	163.7	-68.9	171.4	152.5	0	0	108.7
224	F	25.6	Very low	30.1	Very low	201 Å²	201	156.9 Å²	156.9	88%	0.882	81%	0.807	S	S	*	*			trans	-91.6	102.7	177.5	-112.9	-98.8	0	0	0	108.6
225	D	26.4	Very low	30.7	Very low	144 Å²	144	152.6 Å²	152.6	77%	0.77	79%	0.787	S	S	*	*			trans	-87.1	115.8	171.8	-176.8	24.1	0	0	0	110.3	R227	D225-R227 PolarHBondContact O-N 3.41Å
226	T	28.9	Very low	31.4	Very low	124 Å²	124	152.1 Å²	152.1	76%	0.761	79%	0.791	S	S	*	*			trans	-79.2	85.2	-175.7	-54.9	0	0	0	0	109.9	Q228	T226-Q228 PolarHBondContact O-N 3.12Å
227	R	29.5	Very low	31.7	Very low	224 Å²	224	153.8 Å²	153.8	85%	0.845	79%	0.786	S	S	*	*			trans	-50.4	115.7	177.3	-75.5	-173.4	170.8	-169.3	-3.9	111.7	D225	D225-R227 PolarHBondContact O-N 3.41Å
228	Q	32.6	Very low	32.9	Very low	185 Å²	185	151.3 Å²	151.3	86%	0.864	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-58.1	134.6	170.6	-64.4	173.5	-6.5	0	0	110.1	T226	T226-Q228 PolarHBondContact O-N 3.12Å
229	T	31.2	Very low	33.3	Very low	123 Å²	123	148.7 Å²	148.7	76%	0.755	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-72.5	135.9	165.1	39	0	0	0	0	109.3	L231	T229-L231 PolarHBondContact O-N 2.91Å
230	P	33.2	Very low	33.9	Very low	117 Å²	117	150.3 Å²	150.3	76%	0.76	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-69.1	131.6	176.5	28.7	-33.4	0	0	0	109.8	V232	P230-V232 PolarHBondContact O-N 3.37Å
231	L	34.8	Very low	34.4	Very low	172 Å²	172	152.3 Å²	152.3	90%	0.901	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-66	127.8	170.8	-75.5	84.7	0	0	0	109.1	T229	T229-L231 PolarHBondContact O-N 2.91Å
232	V	36.4	Very low	34.7	Very low	132 Å²	132	147.9 Å²	147.9	80%	0.8	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-70.5	135.6	173.8	-179.1	0	0	0	0	108.8	P230 I234	P230-V232 PolarHBondContact O-N 3.37Å; V232-I234 PolarHBondContact O-N 3.41Å; V232-I234 VanDerWaalsContact O-N 3.07Å
233	N	33.6	Very low	35	Very low	152 Å²	152	144.3 Å²	144.3	81%	0.813	77%	0.768	S	S	*	*			trans	-65.6	105	-173.4	-172.9	21.7	0	0	0	111.9
234	I	44.8	Very low	35.2	Very low	139 Å²	139	142.8 Å²	142.8	71%	0.713	77%	0.765	S	S	*	*			trans	-82.9	132.1	173.8	-61.4	179	0	0	0	109	V232 P236	V232-I234 PolarHBondContact O-N 3.41Å; V232-I234 VanDerWaalsContact O-N 3.07Å; I234-P236 WeakPolarHBondContact O-CD 2.81Å
235	N	44	Very low	35.6	Very low	85 Å²	85	142.4 Å²	142.4	46%	0.455	77%	0.766	S	S	.	*			trans	-58.3	117.1	177.2	174.1	25.5	0	0	0	111.5	F237 T238	N235-F237 PolarHBondContact O-N 3.27Å; N235-F237 VanDerWaalsContact O-N 3.08Å; N235-F237 PolarHBondContact OD1-N 3.14Å; N235-T238 PolarHBondContact O-N 3.02Å; N235-T238 PolarHBondContact O-OG1 2.84Å
236	P	40.9	Very low	35.8	Very low	108 Å²	108	141.2 Å²	141.2	70%	0.701	77%	0.769	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.6	-6.8	-178.1	29.6	-36.4	0	0	0	114	I234	I234-P236 WeakPolarHBondContact O-CD 2.81Å
237	F	34.8	Very low	35.9	Very low	177 Å²	177	141.4 Å²	141.4	78%	0.776	78%	0.776	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.8	17.7	176.2	-58.4	-72.5	0	0	0	113.9	N235 P239	N235-F237 PolarHBondContact O-N 3.27Å; N235-F237 VanDerWaalsContact O-N 3.08Å; N235-F237 PolarHBondContact OD1-N 3.14Å; F237-P239 WeakPolarHBondContact O-CD 3.5Å
238	T	50.3	Low	35.9	Very low	85 Å²	85	134.6 Å²	134.6	52%	0.521	78%	0.775	S	S	.	*	P	Polyproline II helix	trans	-79.3	116	167.3	-49.2	0	0	0	0	108.5	N235	N235-T238 PolarHBondContact O-N 3.02Å; N235-T238 PolarHBondContact O-OG1 2.84Å
239	P	38.7	Very low	35.8	Very low	115 Å²	115	137.6 Å²	137.6	75%	0.747	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-73.4	130.8	-179.1	29.3	-33.8	0	0	0	111.1	F237	F237-P239 WeakPolarHBondContact O-CD 3.5Å
240	D	39.3	Very low	35.8	Very low	152 Å²	152	137.4 Å²	137.4	81%	0.813	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-60.6	141.9	177	-87.7	-43.8	0	0	0	112.1	V242	D240-V242 PolarHBondContact O-N 3Å
241	P	38.4	Very low	35.6	Very low	117 Å²	117	143.7 Å²	143.7	76%	0.76	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-67.2	116.9	179.1	26.8	-33.4	0	0	0	111.4	L243	P241-L243 PolarHBondContact O-N 3.31Å
242	V	32.9	Very low	35.5	Very low	125 Å²	125	139.1 Å²	139.1	76%	0.758	78%	0.783	S	S	*	*			trans	-43.5	120.3	-172.8	-179.1	0	0	0	0	114.1	D240 L244	D240-V242 PolarHBondContact O-N 3Å; V242-L244 PolarHBondContact O-N 3.12Å
243	L	32	Very low	35.4	Very low	160 Å²	160	144.7 Å²	144.7	84%	0.838	79%	0.79	S	S	*	*			trans	-65.2	98.4	170.7	-87.8	166.3	0	0	0	111.6	P241 H245	P241-L243 PolarHBondContact O-N 3.31Å; L243-H245 PolarHBondContact O-N 3.38Å
244	L	30.5	Very low	35.4	Very low	161 Å²	161	147.1 Å²	147.1	84%	0.843	79%	0.793	S	S	*	*			trans	-73.5	104.7	168.2	-80.9	171.4	0	0	0	110.8	V242 S246	V242-L244 PolarHBondContact O-N 3.12Å; L244-S246 PolarHBondContact O-N 2.92Å
245	H	35	Very low	34.6	Very low	193 Å²	193	151.8 Å²	151.8	89%	0.894	80%	0.802	S	S	*	*			trans	-55.9	126.8	169.4	-75.4	-84.6	0	0	0	111.6	L243	L243-H245 PolarHBondContact O-N 3.38Å
246	S	29.2	Very low	34	Very low	119 Å²	119	151.5 Å²	151.5	83%	0.832	81%	0.811	S	S	*	*			trans	-135.5	144.8	157.3	57	0	0	0	0	110.1	L244	L244-S246 PolarHBondContact O-N 2.92Å
247	S	32	Very low	33.3	Very low	129 Å²	129	155.9 Å²	155.9	90%	0.902	82%	0.815	S	S	*	*			trans	-94.5	128.7	-161.5	49.3	0	0	0	0	113.3
248	G	28.7	Very low	33.1	Very low	80 Å²	80	155.2 Å²	155.2	83%	0.825	81%	0.812	S	S	*	*			trans	-144.4	60.3	-178.6	0	0	0	0	0	113.4
249	R	30.9	Very low	32.1	Very low	249 Å²	249	156.8 Å²	156.8	94%	0.94	82%	0.818	S	S	*	*			trans	-74.4	130.9	-169.1	-152.8	178.9	-171.6	-165.8	3.9	113.1
250	C	30.6	Very low	31.5	Very low	118 Å²	118	157.2 Å²	157.2	80%	0.797	81%	0.814	S	S	*	*			trans	-35.3	137.1	-177.5	-46.2	0	0	0	0	118
251	R	30	Very low	31.2	Very low	250 Å²	250	154.7 Å²	154.7	94%	0.943	81%	0.808	S	S	*	*			trans	-143.8	107.4	143.8	-80.4	-164.1	170.5	171.8	-0.7	111.7
252	G	32.7	Very low	30.9	Very low	75 Å²	75	153 Å²	153	77%	0.773	80%	0.799	S	S	*	*			trans	-97.7	144.1	163.9	0	0	0	0	0	111.5
253	R	33.5	Very low	31	Very low	249 Å²	249	155 Å²	155	94%	0.94	80%	0.8	S	S	*	*			trans	-143.3	131.6	164.7	-78.6	-167.9	169.4	-177.3	-4.2	110.9
254	K	33.7	Very low	31.2	Very low	204 Å²	204	154.2 Å²	154.2	89%	0.887	80%	0.797	S	S	*	*			trans	-64.7	158.6	161.1	-58.6	175.9	178.6	-180	0	108.2
255	R	29	Very low	31.6	Very low	236 Å²	236	154.1 Å²	154.1	89%	0.891	79%	0.794	S	S	*	*				171.8	150.2	73.2	-159.9	-173.4	-171.9	155	1.4	110.8
256	A	29.9	Very low	31.7	Very low	80 Å²	80	153.5 Å²	153.5	66%	0.661	79%	0.791	S	S	*	*			trans	66.4	155.5	147.8	0	0	0	0	0	119.9
257	Y	27.8	Very low	32.1	Very low	199 Å²	199	152.6 Å²	152.6	78%	0.78	79%	0.791	S	S	*	*			cis	-168	142	-10.8	-131.2	-144.2	0	0	0	109.7
258	F	30.4	Very low	32.3	Very low	163 Å²	163	152.1 Å²	152.1	72%	0.715	79%	0.788	S	S	*	*			trans	55.6	162.3	154.9	-76	-122.2	0	0	0	117.7
259	N	29.3	Very low	32.8	Very low	119 Å²	119	156.3 Å²	156.3	64%	0.636	79%	0.791	S	S	*	*			cis	-133	-173.5	-15.7	-139.7	33.2	0	0	0	105.8
260	D	26.3	Very low	33	Very low	124 Å²	124	154.8 Å²	154.8	66%	0.663	79%	0.787	S	S	*	*			cis	-158.4	-179.1	22	-145.4	-44.8	0	0	0	111.1
261	S	32.7	Very low	33.2	Very low	99 Å²	99	157.3 Å²	157.3	69%	0.692	79%	0.787	S	S	*	*			trans	-49.3	169.4	171.9	-37.5	0	0	0	0	114.6
262	S	32.7	Very low	33.3	Very low	82 Å²	82	154.3 Å²	154.3	57%	0.573	78%	0.781	S	S	*	*			cis	-165.1	164.9	23.4	-152.7	0	0	0	0	111.5
263	E	34	Very low	33.4	Very low	166 Å²	166	158.4 Å²	158.4	78%	0.776	78%	0.78	S	S	*	*			trans	49.4	144.7	149.6	-70.1	143.7	160.6	0	0	120.2
264	D	36.3	Very low	33.6	Very low	143 Å²	143	151.9 Å²	151.9	77%	0.765	76%	0.764	S	S	*	*			cis	-156.7	172.2	-4.4	-134.4	-23.2	0	0	0	113
265	M	39.3	Very low	33.6	Very low	159 Å²	159	149.1 Å²	149.1	78%	0.783	75%	0.754	S	S	*	*			trans	-18.5	125.8	160	-171	171.5	176.7	0	0	119.2
266	E	36.4	Very low	34	Very low	181 Å²	181	143.1 Å²	143.1	85%	0.846	74%	0.744	S	S	*	*				-174.4	165.3	109.5	-99.2	-162.3	156.7	0	0	112.4
267	A	38.5	Very low	34.2	Very low	100 Å²	100	148.4 Å²	148.4	83%	0.826	75%	0.747	S	S	*	*			trans	-114.6	135.7	178.1	0	0	0	0	0	111.1
268	S	36.2	Very low	34.6	Very low	118 Å²	118	144.6 Å²	144.6	83%	0.825	75%	0.746	S	S	*	*			trans	-146.8	138.8	166.4	49.8	0	0	0	0	110.2
269	D	38.4	Very low	34.9	Very low	168 Å²	168	141.4 Å²	141.4	90%	0.898	75%	0.75	S	S	*	*			trans	-66.9	136	175.6	-61.9	-70.8	0	0	0	110.2
270	Y	35.9	Very low	35.5	Very low	218 Å²	218	144.9 Å²	144.9	86%	0.855	76%	0.76	S	S	*	*			trans	-135.3	135.6	163.8	-150.9	-86.2	0	0	0	109.7
271	E	34.6	Very low	36.2	Very low	170 Å²	170	149.9 Å²	149.9	79%	0.794	77%	0.769	S	S	*	*			trans	-71.5	143.2	-167.2	-63.4	174.7	122.5	0	0	111.7	E273	E271-E273 VanDerWaalsContact C-N 3.3Å; E271-E273 PolarHBondContact O-N 3.09Å
272	F	30.8	Very low	36.5	Very low	188 Å²	188	152 Å²	152	83%	0.825	77%	0.772	S	S	*	*			trans	-76.6	84.2	173.9	-171.8	-89.7	0	0	0	109.2	D274	F272-D274 HydrophobicContact CD1-CB 4.44Å; F272-D274 HydrophobicContact CE1-CB 4.25Å; F272-D274 PolarHBondContact O-N 3.43Å; F272-D274 VanDerWaalsContact O-N 3.12Å
273	E	36.2	Very low	36.7	Very low	160 Å²	160	154.1 Å²	154.1	75%	0.748	78%	0.781	S	S	*	*			trans	-58.4	110.1	162.2	-81.6	-83.7	110.7	0	0	108.4	E271 E275	E271-E273 VanDerWaalsContact C-N 3.3Å; E271-E273 PolarHBondContact O-N 3.09Å; E273-E275 PolarHBondContact O-N 3.42Å
274	D	36.6	Very low	37.3	Very low	112 Å²	112	152.1 Å²	152.1	60%	0.599	77%	0.774	S	S	*	*			trans	-73.4	75.5	175.6	-175	28.9	0	0	0	110.1	F272 T276	F272-D274 HydrophobicContact CD1-CB 4.44Å; F272-D274 HydrophobicContact CE1-CB 4.25Å; F272-D274 PolarHBondContact O-N 3.43Å; F272-D274 VanDerWaalsContact O-N 3.12Å; D274-T276 PolarHBondContact O-N 2.9Å
275	E	34	Very low	37.5	Very low	147 Å²	147	150.6 Å²	150.6	69%	0.687	77%	0.77	S	S	*	*			trans	-61.1	84.2	162.6	-87.5	-151.8	148.4	0	0	109	E273 R277	E273-E275 PolarHBondContact O-N 3.42Å; E275-R277 PolarHBondContact O-N 2.84Å
276	T	38.3	Very low	37.9	Very low	110 Å²	110	152.8 Å²	152.8	68%	0.675	78%	0.778	S	S	*	*			trans	-64.4	73.7	161.2	39.8	0	0	0	0	109	D274 P278	D274-T276 PolarHBondContact O-N 2.9Å; T276-P278 VanDerWaalsContact O-N 3.07Å
277	R	33.7	Very low	38.5	Very low	191 Å²	191	148.5 Å²	148.5	72%	0.721	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-46	118.2	178.7	-71.6	173.8	175.8	166.4	0.5	108.3	E275 A279	E275-R277 PolarHBondContact O-N 2.84Å; R277-A279 PolarHBondContact O-N 3.41Å; R277-A279 VanDerWaalsContact O-N 3.13Å
278	P	36.8	Very low	39.3	Very low	118 Å²	118	150.6 Å²	150.6	77%	0.766	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-55.9	127.8	-179.7	22.7	-32.8	0	0	0	107.8	T276 K280	T276-P278 VanDerWaalsContact O-N 3.07Å; P278-K280 PolarHBondContact O-N 2.96Å
279	A	35.3	Very low	40.5	Very low	97 Å²	97	153.2 Å²	153.2	80%	0.802	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-47	117.1	-173	0	0	0	0	0	108.9	R277 R281	R277-A279 PolarHBondContact O-N 3.41Å; R277-A279 VanDerWaalsContact O-N 3.13Å; A279-R281 PolarHBondContact O-N 3.18Å
280	K	42.7	Very low	42.4	Very low	191 Å²	191	152.6 Å²	152.6	83%	0.83	76%	0.757	S	S	*	*			trans	-55.2	106	-166.9	-76.6	-174.5	177.3	-178.6	0	108.9	P278 I282	P278-K280 PolarHBondContact O-N 2.96Å; K280-I282 PolarHBondContact O-N 3.27Å
281	R	41.5	Very low	45	Very low	229 Å²	229	143.1 Å²	143.1	86%	0.864	72%	0.722	S	S	*	*			trans	-46.1	116.6	175.9	-178.5	-179.9	-171.7	165.1	3.4	106.8	A279 T283	A279-R281 PolarHBondContact O-N 3.18Å; R281-T283 VanDerWaalsContact C-N 3.34Å; R281-T283 PolarHBondContact O-N 3.39Å
282	I	38.3	Very low	47.8	Very low	145 Å²	145	138.4 Å²	138.4	74%	0.744	70%	0.697	S	S	*	*			trans	-62.8	104	178.1	-58.7	175.4	0	0	0	105.5	K280 I284	K280-I282 PolarHBondContact O-N 3.27Å; I282-I284 HydrophobicContact CG2-CG1 4.29Å; I282-I284 PolarHBondContact O-N 2.93Å
283	T	37.6	Very low	50.9	Low	126 Å²	126	130.2 Å²	130.2	77%	0.773	66%	0.661	S	S	*	*			trans	-68.7	87.8	166.4	20.3	0	0	0	0	106.2	R281 T285	R281-T283 VanDerWaalsContact C-N 3.34Å; R281-T283 PolarHBondContact O-N 3.39Å; T283-T285 PolarHBondContact O-N 3.44Å
284	I	45.5	Very low	53.7	Low	124 Å²	124	128.7 Å²	128.7	64%	0.636	65%	0.654	S	S	*	*			trans	-54.5	107.5	167.5	-59.3	173.8	0	0	0	105.3	I282 E286	I282-I284 HydrophobicContact CG2-CG1 4.29Å; I282-I284 PolarHBondContact O-N 2.93Å; I284-E286 PolarHBondContact O-N 2.89Å; I284-E286 VanDerWaalsContact O-N 3.16Å
285	T	40.6	Very low	56.5	Low	111 Å²	111	126.9 Å²	126.9	68%	0.681	65%	0.647	S	S	*	*			trans	-65.1	117.5	179.7	45	0	0	0	0	107.8	T283 S287	T283-T285 PolarHBondContact O-N 3.44Å; T285-S287 PolarHBondContact O-N 2.92Å
286	E	48.1	Very low	59.4	Low	204 Å²	204	121.9 Å²	121.9	95%	0.953	62%	0.624	S	S	*	*			trans	-68.3	22.8	-163.5	-57.4	173.1	126.2	0	0	115	I284	I284-E286 PolarHBondContact O-N 2.89Å; I284-E286 VanDerWaalsContact O-N 3.16Å
287	S	49.8	Very low	62.3	Low	92 Å²	92	116.8 Å²	116.8	64%	0.643	59%	0.592	S	S	*	*	S	Bend	trans	-107.1	100.4	-177	59.6	0	0	0	0	112	T285	T285-S287 PolarHBondContact O-N 2.92Å
288	N	54.2	Low	65.3	Low	144 Å²	144	112.4 Å²	112.4	77%	0.77	58%	0.58	S	S	*	*			trans	80.1	28	154.5	-153.6	32.3	0	0	0	118.8	K290	N288-K290 PolarHBondContact O-N 3.3Å
289	M	61.5	Low	68.2	Low	172 Å²	172	110.5 Å²	110.5	85%	0.847	56%	0.56	S	S	*	*			trans	-79.2	99.4	152.1	-61.9	-154.2	80.8	0	0	108.2
290	K	79	Confident	71.2	Confident	155 Å²	155	109.9 Å²	109.9	67%	0.674	54%	0.543	S	S	*	.			trans	-67.2	143.7	171	-77	-171	173.1	-175	0	110	N288 R292 T295	N288-K290 PolarHBondContact O-N 3.3Å; K290-R292 PolarHBondContact O-N 3.43Å; K290-T295 WeakPolarHBondContact CB-OG1 3.33Å
291	S	90.3	Very high	73.8	Confident	19 Å²	19	105.2 Å²	105.2	13%	0.133	52%	0.524	C	S	.	.			trans	-56.6	135.4	173.5	164.6	0	0	0	0	111.5	Y293 E294 T295 E366	S291-Y293 WeakPolarHBondContact OG-CB 3.4Å; S291-Y293 PolarHBondContact OG-N 3.05Å; S291-Y293 VanDerWaalsContact OG-N 3.13Å; S291-E294 PolarHBondContact O-N 3.43Å; S291-E294 PolarHBondContact OG-N 3.04Å; S291-E294 VanDerWaalsContact OG-N 3.13Å; S291-T295 WeakPolarHBondContact O-CB 3.4Å; S291-T295 PolarHBondContact O-N 3.5Å; S291-T295 PolarHBondContact O-OG1 2.92Å; S291-E366 WeakPolarHBondContact CA-OE1 3.46Å; S291-E366 WeakPolarHBondContact CB-OE1 3.43Å; S291-E366 VanDerWaalsContact OG-CD 3.3Å; S291-E366 PolarHBondContact OG-OE1 3.08Å
292	R	94	Very high	76.4	Confident	72 Å²	72	99.4 Å²	99.4	27%	0.272	51%	0.505	S	S	.	.	H	α-helix	trans	-60.2	-46.2	168.6	-174.6	-177.4	179.6	-134.6	-21	110	K290 E294 T295 E296 S362 W364 E366	K290-R292 PolarHBondContact O-N 3.43Å; R292-E294 PolarHBondContact O-N 3.39Å; R292-T295 PolarHBondContact O-N 2.87Å; R292-E296 HydrophobicContact CG-CG 4.4Å; R292-E296 WeakPolarHBondContact CG-OE1 3.47Å; R292-E296 IonicContact CZ-OE1 2.66Å; R292-E296 IonicContact CZ-OE2 3.69Å; R292-E296 IonicContact NE-OE1 3.78Å; R292-E296 PolarHBondContact NE-OE1 2.85Å; R292-E296 IonicContact NE-OE2 3.05Å; R292-E296 IonicContact NH2-OE1 2.65Å; R292-E296 PolarHBondContact NH2-OE1 3.38Å; R292-E296 IonicContact NH2-OE2 2.72Å; R292-E296 PolarHBondContact NH2-OE2 3.39Å; R292-E296 WeakPolarHBondContact O-CB 3.49Å; R292-E296 PolarHBondContact O-N 3.4Å; R292-S362 PolarHBondContact NH1-OG 3.38Å; R292-W364 VanDerWaalsContact NH1-CD2 3.32Å; R292-E366 PolarHBondContact N-OE1 3.06Å
293	Y	95.2	Very high	79.1	Confident	15 Å²	15	96.1 Å²	96.1	6%	0.059	49%	0.488	C	S	.	.	H	α-helix	trans	-54.8	-51.3	174.7	-179.7	-105.7	0	0	0	112.1	S291 T295 F297 E299 C314 I325 W364 E366 L371	S291-Y293 WeakPolarHBondContact OG-CB 3.4Å; S291-Y293 PolarHBondContact OG-N 3.05Å; S291-Y293 VanDerWaalsContact OG-N 3.13Å; Y293-T295 PolarHBondContact O-N 2.97Å; Y293-F297 HydrophobicContact CD2-CD2 4.49Å; Y293-F297 WeakPolarHBondContact O-CA 3.37Å; Y293-F297 VanDerWaalsContact O-CB 3.32Å; Y293-F297 WeakPolarHBondContact O-CB 3.42Å; Y293-F297 PolarHBondContact O-N 2.86Å; Y293-E299 WeakPolarHBondContact CE1-OE2 3.43Å; Y293-E299 PolarHBondContact OH-OE2 3.04Å; Y293-C314 PolarHBondContact OH-SG 2.89Å; Y293-I325 HydrophobicContact CD2-CD1 4.17Å; Y293-I325 HydrophobicContact CD2-CG2 4.18Å; Y293-I325 HydrophobicContact CE2-CB 4.18Å; Y293-I325 HydrophobicContact CE2-CD1 3.88Å; Y293-I325 HydrophobicContact CE2-CG2 3.85Å; Y293-W364 HydrophobicContact CD2-CZ2 4.41Å; Y293-E366 WeakPolarHBondContact CB-OE2 3.31Å; Y293-E366 PolarHBondContact N-OE2 3.06Å; Y293-L371 HydrophobicContact CD2-CD2 3.61Å; Y293-L371 HydrophobicContact CE2-CD2 4.4Å; Y293-L371 HydrophobicContact CG-CD2 3.88Å
294	E	94.4	Very high	81.6	Confident	129 Å²	129	91.2 Å²	91.2	60%	0.603	46%	0.463	S	S	*	.	H	α-helix	trans	-67.9	-33.4	180	-63.2	-176.4	152	0	0	113.5	S291 R292 F297 R317	S291-E294 PolarHBondContact O-N 3.43Å; S291-E294 PolarHBondContact OG-N 3.04Å; S291-E294 VanDerWaalsContact OG-N 3.13Å; R292-E294 PolarHBondContact O-N 3.39Å; E294-F297 VanDerWaalsContact O-O 3.12Å; E294-R317 PolarHBondContact O-NE 3.39Å; E294-R317 PolarHBondContact O-NH2 2.93Å
295	T	95.1	Very high	83.7	Confident	74 Å²	74	89.1 Å²	89.1	45%	0.454	46%	0.459	S	S	.	.	H	α-helix	trans	-80.7	-43.3	-175.4	-58.7	0	0	0	0	112.4	K290 S291 R292 Y293 R317	K290-T295 WeakPolarHBondContact CB-OG1 3.33Å; S291-T295 WeakPolarHBondContact O-CB 3.4Å; S291-T295 PolarHBondContact O-N 3.5Å; S291-T295 PolarHBondContact O-OG1 2.92Å; R292-T295 PolarHBondContact O-N 2.87Å; Y293-T295 PolarHBondContact O-N 2.97Å; T295-R317 VanDerWaalsContact O-CD 3.26Å; T295-R317 WeakPolarHBondContact O-CD 3.4Å; T295-R317 PolarHBondContact O-NE 3.48Å
296	E	96.3	Very high	85.5	Confident	42 Å²	42	85.9 Å²	85.9	20%	0.196	45%	0.448	C	S	.	.	H	α-helix	trans	-84.7	-25.4	179	-77.9	-178.6	-142	0	0	113.3	R292 R317	R292-E296 HydrophobicContact CG-CG 4.4Å; R292-E296 WeakPolarHBondContact CG-OE1 3.47Å; R292-E296 IonicContact CZ-OE1 2.66Å; R292-E296 IonicContact CZ-OE2 3.69Å; R292-E296 IonicContact NE-OE1 3.78Å; R292-E296 PolarHBondContact NE-OE1 2.85Å; R292-E296 IonicContact NE-OE2 3.05Å; R292-E296 IonicContact NH2-OE1 2.65Å; R292-E296 PolarHBondContact NH2-OE1 3.38Å; R292-E296 IonicContact NH2-OE2 2.72Å; R292-E296 PolarHBondContact NH2-OE2 3.39Å; R292-E296 WeakPolarHBondContact O-CB 3.49Å; R292-E296 PolarHBondContact O-N 3.4Å; E296-R317 WeakPolarHBondContact O-CB 3.42Å; E296-R317 WeakPolarHBondContact O-CG 3.42Å; E296-R317 PolarHBondContact O-N 2.92Å
297	F	97.8	Very high	86.7	Confident	3 Å²	3	83.4 Å²	83.4	1%	0.013	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	158.2	-170.9	-54.7	-92.5	0	0	0	113.5	Y293 E294 C314 V315 K316 R317 Y323 I325 W364 Q373	Y293-F297 HydrophobicContact CD2-CD2 4.49Å; Y293-F297 WeakPolarHBondContact O-CA 3.37Å; Y293-F297 VanDerWaalsContact O-CB 3.32Å; Y293-F297 WeakPolarHBondContact O-CB 3.42Å; Y293-F297 PolarHBondContact O-N 2.86Å; E294-F297 VanDerWaalsContact O-O 3.12Å; F297-C314 HydrophobicContact CB-CB 4.17Å; F297-C314 HydrophobicContact CD1-CB 4.34Å; F297-V315 CarbonylContact C-O 3.46Å; F297-V315 WeakPolarHBondContact CA-O 3.31Å; F297-K316 HydrophobicContact CD1-CB 3.66Å; F297-K316 HydrophobicContact CD1-CG 4.04Å; F297-K316 HydrophobicContact CE1-CB 3.6Å; F297-K316 HydrophobicContact CE1-CD 3.72Å; F297-K316 HydrophobicContact CE1-CG 3.72Å; F297-K316 HydrophobicContact CZ-CD 4.01Å; F297-K316 HydrophobicContact CZ-CG 4.26Å; F297-R317 VanDerWaalsContact O-CZ 3.24Å; F297-R317 PolarHBondContact O-NE 2.91Å; F297-R317 VanDerWaalsContact O-NE 3.07Å; F297-R317 PolarHBondContact O-NH2 3.33Å; F297-Y323 HydrophobicContact CE1-CD2 4.37Å; F297-I325 HydrophobicContact CB-CD1 4.4Å; F297-I325 HydrophobicContact CD1-CD1 3.49Å; F297-I325 VanDerWaalsContact CD1-CD1 3.49Å; F297-I325 HydrophobicContact CD2-CD1 4.06Å; F297-I325 HydrophobicContact CE1-CD1 3.62Å; F297-I325 HydrophobicContact CE2-CD1 4.21Å; F297-I325 HydrophobicContact CG-CD1 3.72Å; F297-I325 HydrophobicContact CZ-CD1 3.99Å; F297-W364 HydrophobicContact CD2-CH2 4.3Å; F297-W364 AromaticContact CE2-CH2 3.5Å; F297-W364 HydrophobicContact CE2-CH2 3.5Å; F297-W364 VanDerWaalsContact CE2-CH2 3.5Å; F297-W364 HydrophobicContact CE2-CZ2 4.02Å; F297-W364 HydrophobicContact CE2-CZ3 4.37Å; F297-W364 AromaticContact CZ-CH2 3.94Å; F297-W364 HydrophobicContact CZ-CH2 3.94Å; F297-W364 HydrophobicContact CZ-CZ3 4.5Å; F297-Q373 HydrophobicContact CE1-CG 4.35Å; F297-Q373 HydrophobicContact CZ-CG 4.4Å
298	H	97.8	Very high	87.9	Confident	99 Å²	99	81.9 Å²	81.9	46%	0.458	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	110	167.9	178.7	23.8	0	0	0	108.5	L300 C314 V315	H298-L300 PolarHBondContact O-N 2.67Å; H298-C314 CarbonylContact O-C 3.55Å; H298-C314 VanDerWaalsContact O-CA 3.28Å; H298-C314 WeakPolarHBondContact O-CA 3.16Å; H298-V315 PolarHBondContact N-O 3.41Å; H298-V315 PolarHBondContact O-N 3.37Å
299	E	97.8	Very high	89.5	Confident	78 Å²	78	75.2 Å²	75.2	36%	0.364	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	128	172.9	-173	172.6	130.5	0	0	110.3	Y293 F312	Y293-E299 WeakPolarHBondContact CE1-OE2 3.43Å; Y293-E299 PolarHBondContact OH-OE2 3.04Å; E299-F312 HydrophobicContact CG-CB 4.19Å; E299-F312 HydrophobicContact CG-CD1 3.86Å; E299-F312 HydrophobicContact CG-CG 4.32Å; E299-F312 WeakPolarHBondContact OE1-CD1 3.44Å; E299-F312 WeakPolarHBondContact OE1-CE1 3.18Å; E299-F312 WeakPolarHBondContact OE2-CD1 3.42Å
300	L	97.8	Very high	91	Very high	84 Å²	84	67.8 Å²	67.8	44%	0.44	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	-52.2	176.6	-60.8	-177.3	0	0	0	111.6	H298 K313 V315	H298-L300 PolarHBondContact O-N 2.67Å; L300-K313 WeakPolarHBondContact CB-O 3.35Å; L300-K313 HydrophobicContact CD1-CD 4.26Å; L300-K313 HydrophobicContact CD1-CG 4.33Å; L300-K313 PolarHBondContact N-O 3.45Å; L300-V315 HydrophobicContact CD1-CG2 3.75Å; L300-V315 HydrophobicContact CD2-CG2 4Å; L300-V315 HydrophobicContact CG-CG2 3.98Å
301	E	97	Very high	91.8	Very high	93 Å²	93	62.3 Å²	62.3	44%	0.435	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158	152.1	-174.9	60.5	-173.3	148.9	0	0	111.2	I303 F312 K313	E301-I303 HydrophobicContact CG-CG2 3.93Å; E301-F312 WeakPolarHBondContact O-CA 3.46Å; E301-K313 HydrophobicContact CG-CB 3.92Å; E301-K313 HydrophobicContact CG-CD 3.73Å; E301-K313 HydrophobicContact CG-CG 4.49Å; E301-K313 PolarHBondContact O-N 3.48Å; E301-K313 WeakPolarHBondContact OE1-CD 3.49Å; E301-K313 WeakPolarHBondContact OE1-CE 3.28Å; E301-K313 IonicContact OE1-NZ 2.68Å; E301-K313 PolarHBondContact OE1-NZ 3.28Å
302	K	96.6	Very high	92.1	Very high	107 Å²	107	62 Å²	62	47%	0.465	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	108.6	174.4	178.8	169.6	165.1	165.8	0	109.8	G304 S310 V311 F312	K302-G304 WeakPolarHBondContact CE-O 3.43Å; K302-S310 PolarHBondContact NZ-OG 2.71Å; K302-V311 CarbonylContact C-O 3.56Å; K302-F312 HydrophobicContact CB-CD1 3.73Å; K302-F312 HydrophobicContact CB-CE1 3.77Å; K302-F312 HydrophobicContact CD-CD1 4.49Å; K302-F312 HydrophobicContact CD-CE1 3.81Å; K302-F312 HydrophobicContact CD-CZ 4.14Å; K302-F312 HydrophobicContact CG-CD1 4.05Å; K302-F312 HydrophobicContact CG-CE1 3.87Å; K302-F312 HydrophobicContact CG-CZ 4.48Å
303	I	95.1	Very high	92.3	Very high	75 Å²	75	60.2 Å²	60.2	39%	0.385	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	-12.5	-176.1	61.9	174.8	0	0	0	114.1	E301 V311 K313 A324 Y376	E301-I303 HydrophobicContact CG-CG2 3.93Å; I303-V311 HydrophobicContact CD1-CG1 3.96Å; I303-V311 HydrophobicContact CG1-CB 4.12Å; I303-V311 HydrophobicContact CG1-CG1 3.85Å; I303-V311 WeakPolarHBondContact CG1-O 3.38Å; I303-V311 PolarHBondContact N-O 2.82Å; I303-K313 HydrophobicContact CD1-CB 4.37Å; I303-K313 HydrophobicContact CG2-CB 3.76Å; I303-A324 HydrophobicContact CD1-CB 4.19Å; I303-Y376 HydrophobicContact CD1-CD2 4.16Å; I303-Y376 HydrophobicContact CD1-CE2 4.03Å
304	G	90.4	Very high	92.4	Very high	24 Å²	24	59.5 Å²	59.5	25%	0.247	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.5	156	-179.4	0	0	0	0	0	115.1	K302 S310 V311	K302-G304 WeakPolarHBondContact CE-O 3.43Å; G304-S310 WeakPolarHBondContact O-CA 3.36Å; G304-V311 PolarHBondContact N-O 3.02Å; G304-V311 PolarHBondContact O-N 3.45Å
305	S	88.6	Confident	92.6	Very high	79 Å²	79	55 Å²	55	55%	0.552	30%	0.298	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-154.7	111.3	173.2	175.5	0	0	0	0	110.1	K329	S305-K329 PolarHBondContact OG-NZ 2.91Å
306	G	79.3	Confident	92.8	Very high	43 Å²	43	53.5 Å²	53.5	44%	0.443	29%	0.285	S	S	.	.			trans	-125	-165.1	178.3	0	0	0	0	0	112	G309 K329	G306-G309 PolarHBondContact N-O 3.16Å; G306-G309 VanDerWaalsContact N-O 3.07Å; G306-K329 PolarHBondContact O-NZ 2.66Å
307	E	73.1	Confident	92.8	Very high	152 Å²	152	58.3 Å²	58.3	71%	0.71	30%	0.301	S	S	*	.	S	Bend	trans	-62.5	-51.2	171.4	-176.4	151.8	-155	0	0	110.8	G309	E307-G309 PolarHBondContact O-N 2.97Å
308	F	75.4	Confident	92.7	Very high	60 Å²	60	64.9 Å²	64.9	26%	0.263	34%	0.336	S	S	.	.	S	Bend	trans	-65.3	-9.2	-177.2	-46.9	-55.2	0	0	0	116	S328	F308-S328 WeakPolarHBondContact O-CA 3.21Å
309	G	86.7	Confident	92.7	Very high	5 Å²	5	63.2 Å²	63.2	5%	0.052	33%	0.33	C	S	.	.			trans	157.5	-157.7	-177.5	0	0	0	0	0	117.4	G306 E307 R327 K329	G306-G309 PolarHBondContact N-O 3.16Å; G306-G309 VanDerWaalsContact N-O 3.07Å; E307-G309 PolarHBondContact O-N 2.97Å; G309-R327 CarbonylContact C-O 3.59Å; G309-R327 WeakPolarHBondContact CA-O 3.18Å; G309-K329 WeakPolarHBondContact O-CE 3.47Å; G309-K329 PolarHBondContact O-NZ 3.08Å; G309-K329 VanDerWaalsContact O-NZ 3.14Å
310	S	92.8	Very high	92.6	Very high	16 Å²	16	62 Å²	62	11%	0.112	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	144.1	163.4	-57.1	0	0	0	0	109.2	K302 G304 R327	K302-S310 PolarHBondContact NZ-OG 2.71Å; G304-S310 WeakPolarHBondContact O-CA 3.36Å; S310-R327 PolarHBondContact N-O 3.02Å; S310-R327 PolarHBondContact O-N 2.93Å
311	V	95.6	Very high	92.6	Very high	40 Å²	40	60.9 Å²	60.9	24%	0.242	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	131.2	175.7	-169.4	0	0	0	0	109.1	K302 I303 G304 A324 I325 K326	K302-V311 CarbonylContact C-O 3.56Å; I303-V311 HydrophobicContact CD1-CG1 3.96Å; I303-V311 HydrophobicContact CG1-CB 4.12Å; I303-V311 HydrophobicContact CG1-CG1 3.85Å; I303-V311 WeakPolarHBondContact CG1-O 3.38Å; I303-V311 PolarHBondContact N-O 2.82Å; G304-V311 PolarHBondContact N-O 3.02Å; G304-V311 PolarHBondContact O-N 3.45Å; V311-A324 HydrophobicContact CG1-CB 4.25Å; V311-I325 WeakPolarHBondContact CA-O 3.32Å; V311-K326 HydrophobicContact CG2-CB 4.14Å; V311-K326 HydrophobicContact CG2-CG 4.18Å
312	F	97.4	Very high	92.6	Very high	13 Å²	13	60 Å²	60	6%	0.057	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	145.5	-177.6	-59.3	-88.9	0	0	0	110.5	E299 E301 K302 A324 I325 R327	E299-F312 HydrophobicContact CG-CB 4.19Å; E299-F312 HydrophobicContact CG-CD1 3.86Å; E299-F312 HydrophobicContact CG-CG 4.32Å; E299-F312 WeakPolarHBondContact OE1-CD1 3.44Å; E299-F312 WeakPolarHBondContact OE1-CE1 3.18Å; E299-F312 WeakPolarHBondContact OE2-CD1 3.42Å; E301-F312 WeakPolarHBondContact O-CA 3.46Å; K302-F312 HydrophobicContact CB-CD1 3.73Å; K302-F312 HydrophobicContact CB-CE1 3.77Å; K302-F312 HydrophobicContact CD-CD1 4.49Å; K302-F312 HydrophobicContact CD-CE1 3.81Å; K302-F312 HydrophobicContact CD-CZ 4.14Å; K302-F312 HydrophobicContact CG-CD1 4.05Å; K302-F312 HydrophobicContact CG-CE1 3.87Å; K302-F312 HydrophobicContact CG-CZ 4.48Å; F312-A324 CarbonylContact O-C 3.57Å; F312-A324 WeakPolarHBondContact O-CA 3.44Å; F312-I325 PolarHBondContact N-O 3.3Å; F312-I325 PolarHBondContact O-N 3.25Å; F312-R327 HydrophobicContact CE2-CB 4.46Å
313	K	98.1	Very high	92.7	Very high	33 Å²	33	55.9 Å²	55.9	14%	0.143	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	119.7	169.4	177	-167.6	-176.2	171	0	107.7	L300 E301 I303 I322 Y323 Y376	L300-K313 WeakPolarHBondContact CB-O 3.35Å; L300-K313 HydrophobicContact CD1-CD 4.26Å; L300-K313 HydrophobicContact CD1-CG 4.33Å; L300-K313 PolarHBondContact N-O 3.45Å; E301-K313 HydrophobicContact CG-CB 3.92Å; E301-K313 HydrophobicContact CG-CD 3.73Å; E301-K313 HydrophobicContact CG-CG 4.49Å; E301-K313 PolarHBondContact O-N 3.48Å; E301-K313 WeakPolarHBondContact OE1-CD 3.49Å; E301-K313 WeakPolarHBondContact OE1-CE 3.28Å; E301-K313 IonicContact OE1-NZ 2.68Å; E301-K313 PolarHBondContact OE1-NZ 3.28Å; I303-K313 HydrophobicContact CD1-CB 4.37Å; I303-K313 HydrophobicContact CG2-CB 3.76Å; K313-I322 HydrophobicContact CD-CG2 4.34Å; K313-I322 HydrophobicContact CG-CG2 3.54Å; K313-Y323 WeakPolarHBondContact CA-O 3.48Å; K313-Y376 HydrophobicContact CB-CD2 4.35Å; K313-Y376 HydrophobicContact CB-CE2 4.14Å; K313-Y376 HydrophobicContact CD-CD2 4.43Å; K313-Y376 HydrophobicContact CD-CE1 4.18Å; K313-Y376 HydrophobicContact CD-CE2 3.78Å; K313-Y376 VanDerWaalsContact CE-CZ 3.45Å; K313-Y376 WeakPolarHBondContact CE-OH 3.42Å; K313-Y376 HydrophobicContact CG-CD2 3.91Å; K313-Y376 HydrophobicContact CG-CE1 4.45Å; K313-Y376 HydrophobicContact CG-CE2 3.73Å; K313-Y376 HydrophobicContact CG-CG 4.36Å; K313-Y376 PolarHBondContact NZ-OH 2.86Å; K313-Y376 VanDerWaalsContact NZ-OH 3.14Å
314	C	98.3	Very high	92.8	Very high	0 Å²	0	53 Å²	53	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	139.8	-171.2	-53.2	0	0	0	0	111	Y293 F297 H298 I322 Y323 I325	Y293-C314 PolarHBondContact OH-SG 2.89Å; F297-C314 HydrophobicContact CB-CB 4.17Å; F297-C314 HydrophobicContact CD1-CB 4.34Å; H298-C314 CarbonylContact O-C 3.55Å; H298-C314 VanDerWaalsContact O-CA 3.28Å; H298-C314 WeakPolarHBondContact O-CA 3.16Å; C314-I322 WeakPolarHBondContact O-CA 3.33Å; C314-Y323 PolarHBondContact N-O 3.08Å; C314-Y323 PolarHBondContact O-N 2.89Å; C314-I325 HydrophobicContact CB-CD1 3.85Å; C314-I325 HydrophobicContact CB-CG1 4.37Å
315	V	98.3	Very high	93.1	Very high	36 Å²	36	51.9 Å²	51.9	22%	0.218	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	126.5	166.6	-176.8	0	0	0	0	108.1	F297 H298 L300 C321	F297-V315 CarbonylContact C-O 3.46Å; F297-V315 WeakPolarHBondContact CA-O 3.31Å; H298-V315 PolarHBondContact N-O 3.41Å; H298-V315 PolarHBondContact O-N 3.37Å; L300-V315 HydrophobicContact CD1-CG2 3.75Å; L300-V315 HydrophobicContact CD2-CG2 4Å; L300-V315 HydrophobicContact CG-CG2 3.98Å; V315-C321 WeakPolarHBondContact CA-O 3.28Å
316	K	97.9	Very high	93.4	Very high	41 Å²	41	49.6 Å²	49.6	18%	0.178	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	126.9	169.7	-176.9	169.8	162.6	-125.4	0	109.1	F297 L318 D319 G320 C321 Y323	F297-K316 HydrophobicContact CD1-CB 3.66Å; F297-K316 HydrophobicContact CD1-CG 4.04Å; F297-K316 HydrophobicContact CE1-CB 3.6Å; F297-K316 HydrophobicContact CE1-CD 3.72Å; F297-K316 HydrophobicContact CE1-CG 3.72Å; F297-K316 HydrophobicContact CZ-CD 4.01Å; F297-K316 HydrophobicContact CZ-CG 4.26Å; K316-L318 VanDerWaalsContact C-N 3.28Å; K316-L318 PolarHBondContact O-N 3.49Å; K316-D319 WeakPolarHBondContact CB-OD1 3.29Å; K316-D319 VanDerWaalsContact CD-OD2 3.28Å; K316-D319 WeakPolarHBondContact CD-OD2 3.35Å; K316-D319 WeakPolarHBondContact CE-OD2 3.49Å; K316-D319 IonicContact NZ-OD2 3.13Å; K316-D319 PolarHBondContact NZ-OD2 3.34Å; K316-G320 WeakPolarHBondContact O-CA 3.49Å; K316-G320 PolarHBondContact O-N 2.88Å; K316-C321 PolarHBondContact N-O 2.98Å; K316-Y323 HydrophobicContact CB-CD2 3.74Å; K316-Y323 HydrophobicContact CB-CE2 3.56Å; K316-Y323 HydrophobicContact CD-CE2 4.01Å; K316-Y323 HydrophobicContact CG-CE2 4.43Å
317	R	97.3	Very high	94	Very high	144 Å²	144	51.7 Å²	51.7	54%	0.543	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-22.6	-167.9	-61.2	179.2	-164.9	-92.7	6.1	113.9	E294 T295 E296 F297	E294-R317 PolarHBondContact O-NE 3.39Å; E294-R317 PolarHBondContact O-NH2 2.93Å; T295-R317 VanDerWaalsContact O-CD 3.26Å; T295-R317 WeakPolarHBondContact O-CD 3.4Å; T295-R317 PolarHBondContact O-NE 3.48Å; E296-R317 WeakPolarHBondContact O-CB 3.42Å; E296-R317 WeakPolarHBondContact O-CG 3.42Å; E296-R317 PolarHBondContact O-N 2.92Å; F297-R317 VanDerWaalsContact O-CZ 3.24Å; F297-R317 PolarHBondContact O-NE 2.91Å; F297-R317 VanDerWaalsContact O-NE 3.07Å; F297-R317 PolarHBondContact O-NH2 3.33Å
318	L	96.5	Very high	94.6	Very high	141 Å²	141	45.2 Å²	45.2	74%	0.738	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.1	-33.9	-176.9	-66.9	173.7	0	0	0	113.7	K316	K316-L318 VanDerWaalsContact C-N 3.28Å; K316-L318 PolarHBondContact O-N 3.49Å
319	D	96.6	Very high	94.6	Very high	63 Å²	63	46.9 Å²	46.9	34%	0.337	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-120.1	-3.7	-175.2	52.9	43.5	0	0	0	113.5	K316 C321	K316-D319 WeakPolarHBondContact CB-OD1 3.29Å; K316-D319 VanDerWaalsContact CD-OD2 3.28Å; K316-D319 WeakPolarHBondContact CD-OD2 3.35Å; K316-D319 WeakPolarHBondContact CE-OD2 3.49Å; K316-D319 IonicContact NZ-OD2 3.13Å; K316-D319 PolarHBondContact NZ-OD2 3.34Å; D319-C321 PolarHBondContact O-N 2.93Å; D319-C321 VanDerWaalsContact O-N 3.1Å; D319-C321 PolarHBondContact O-SG 3.2Å; D319-C321 VanDerWaalsContact OD1-CB 3.32Å; D319-C321 WeakPolarHBondContact OD1-CB 3.24Å; D319-C321 PolarHBondContact OD1-N 2.93Å
320	G	96.3	Very high	93.8	Very high	52 Å²	52	51.3 Å²	51.3	54%	0.536	26%	0.263	S	S	.	.			trans	67.3	4.1	-179.3	0	0	0	0	0	114.6	K316	K316-G320 WeakPolarHBondContact O-CA 3.49Å; K316-G320 PolarHBondContact O-N 2.88Å
321	C	97.3	Very high	92.3	Very high	62 Å²	62	54.7 Å²	54.7	42%	0.419	29%	0.285	S	S	.	.			trans	-83.2	152.3	-173.4	-68.2	0	0	0	0	112	V315 K316 D319 Y323	V315-C321 WeakPolarHBondContact CA-O 3.28Å; K316-C321 PolarHBondContact N-O 2.98Å; D319-C321 PolarHBondContact O-N 2.93Å; D319-C321 VanDerWaalsContact O-N 3.1Å; D319-C321 PolarHBondContact O-SG 3.2Å; D319-C321 VanDerWaalsContact OD1-CB 3.32Å; D319-C321 WeakPolarHBondContact OD1-CB 3.24Å; D319-C321 PolarHBondContact OD1-N 2.93Å; C321-Y323 HydrophobicContact CB-CD2 4.49Å; C321-Y323 HydrophobicContact CB-CE2 3.63Å; C321-Y323 WeakPolarHBondContact O-CD2 3.38Å; C321-Y323 WeakPolarHBondContact O-CE2 3.49Å
322	I	97.8	Very high	90.6	Very high	75 Å²	75	53.4 Å²	53.4	39%	0.385	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	128.9	-179.3	-49.4	-179.5	0	0	0	109.9	K313 C314 Y376	K313-I322 HydrophobicContact CD-CG2 4.34Å; K313-I322 HydrophobicContact CG-CG2 3.54Å; C314-I322 WeakPolarHBondContact O-CA 3.33Å; I322-Y376 HydrophobicContact CB-CD1 4.2Å; I322-Y376 HydrophobicContact CB-CG 4.44Å; I322-Y376 HydrophobicContact CG2-CD1 3.6Å; I322-Y376 HydrophobicContact CG2-CD2 4.39Å; I322-Y376 HydrophobicContact CG2-CE1 4.27Å; I322-Y376 HydrophobicContact CG2-CG 3.66Å; I322-Y376 WeakPolarHBondContact O-CB 3.31Å
323	Y	98.2	Very high	88.9	Confident	19 Å²	19	57.4 Å²	57.4	8%	0.075	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	155.2	-179.5	-64.5	-83.9	0	0	0	111.4	F297 K313 C314 K316 C321 F361 Q373	F297-Y323 HydrophobicContact CE1-CD2 4.37Å; K313-Y323 WeakPolarHBondContact CA-O 3.48Å; C314-Y323 PolarHBondContact N-O 3.08Å; C314-Y323 PolarHBondContact O-N 2.89Å; K316-Y323 HydrophobicContact CB-CD2 3.74Å; K316-Y323 HydrophobicContact CB-CE2 3.56Å; K316-Y323 HydrophobicContact CD-CE2 4.01Å; K316-Y323 HydrophobicContact CG-CE2 4.43Å; C321-Y323 HydrophobicContact CB-CD2 4.49Å; C321-Y323 HydrophobicContact CB-CE2 3.63Å; C321-Y323 WeakPolarHBondContact O-CD2 3.38Å; C321-Y323 WeakPolarHBondContact O-CE2 3.49Å; Y323-F361 AromaticContact CD1-CD2 3.87Å; Y323-F361 HydrophobicContact CD1-CD2 3.87Å; Y323-F361 HydrophobicContact CD1-CE2 4.03Å; Y323-F361 HydrophobicContact CD1-CG 4.28Å; Y323-F361 HydrophobicContact CE1-CB 4.49Å; Y323-F361 AromaticContact CE1-CD1 3.85Å; Y323-F361 HydrophobicContact CE1-CD1 3.85Å; Y323-F361 AromaticContact CE1-CD2 3.61Å; Y323-F361 HydrophobicContact CE1-CD2 3.61Å; Y323-F361 AromaticContact CE1-CE1 3.86Å; Y323-F361 HydrophobicContact CE1-CE1 3.86Å; Y323-F361 AromaticContact CE1-CE2 3.62Å; Y323-F361 HydrophobicContact CE1-CE2 3.62Å; Y323-F361 AromaticContact CE1-CG 3.72Å; Y323-F361 HydrophobicContact CE1-CG 3.72Å; Y323-F361 AromaticContact CE1-CZ 3.75Å; Y323-F361 HydrophobicContact CE1-CZ 3.75Å; Y323-Q373 HydrophobicContact CD1-CG 3.78Å; Y323-Q373 HydrophobicContact CG-CG 3.93Å; Y323-Q373 VanDerWaalsContact CG-NE2 3.31Å
324	A	97.9	Very high	87.2	Confident	16 Å²	16	59.5 Å²	59.5	13%	0.132	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	118.3	165.2	0	0	0	0	0	108.5	I303 V311 F312 N374	I303-A324 HydrophobicContact CD1-CB 4.19Å; V311-A324 HydrophobicContact CG1-CB 4.25Å; F312-A324 CarbonylContact O-C 3.57Å; F312-A324 WeakPolarHBondContact O-CA 3.44Å; A324-N374 PolarHBondContact N-O 2.93Å; A324-N374 PolarHBondContact O-N 2.74Å
325	I	96.7	Very high	86	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	112.8	-180	-57.7	-179.6	0	0	0	109.5	Y293 F297 V311 F312 C314 W364 L371 I372 Q373	Y293-I325 HydrophobicContact CD2-CD1 4.17Å; Y293-I325 HydrophobicContact CD2-CG2 4.18Å; Y293-I325 HydrophobicContact CE2-CB 4.18Å; Y293-I325 HydrophobicContact CE2-CD1 3.88Å; Y293-I325 HydrophobicContact CE2-CG2 3.85Å; F297-I325 HydrophobicContact CB-CD1 4.4Å; F297-I325 HydrophobicContact CD1-CD1 3.49Å; F297-I325 VanDerWaalsContact CD1-CD1 3.49Å; F297-I325 HydrophobicContact CD2-CD1 4.06Å; F297-I325 HydrophobicContact CE1-CD1 3.62Å; F297-I325 HydrophobicContact CE2-CD1 4.21Å; F297-I325 HydrophobicContact CG-CD1 3.72Å; F297-I325 HydrophobicContact CZ-CD1 3.99Å; V311-I325 WeakPolarHBondContact CA-O 3.32Å; F312-I325 PolarHBondContact N-O 3.3Å; F312-I325 PolarHBondContact O-N 3.25Å; C314-I325 HydrophobicContact CB-CD1 3.85Å; C314-I325 HydrophobicContact CB-CG1 4.37Å; I325-W364 HydrophobicContact CD1-CH2 4.48Å; I325-L371 HydrophobicContact CG2-CB 4.4Å; I325-L371 HydrophobicContact CG2-CD2 4.26Å; I325-I372 CarbonylContact C-O 3.58Å; I325-I372 WeakPolarHBondContact CA-O 3.27Å; I325-Q373 HydrophobicContact CG1-CB 4.34Å; I325-Q373 HydrophobicContact CG1-CG 4.27Å
326	K	93.8	Very high	84.7	Confident	30 Å²	30	64 Å²	64	13%	0.13	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	112.1	175.3	179.7	178.6	179.3	-175.6	0	107.9	V311 E344 L371 I372 D461	V311-K326 HydrophobicContact CG2-CB 4.14Å; V311-K326 HydrophobicContact CG2-CG 4.18Å; K326-E344 WeakPolarHBondContact CE-OE2 3.31Å; K326-E344 IonicContact NZ-OE1 3.68Å; K326-E344 PolarHBondContact NZ-OE1 3.21Å; K326-E344 IonicContact NZ-OE2 2.67Å; K326-E344 PolarHBondContact NZ-OE2 2.96Å; K326-L371 CarbonylContact O-C 3.55Å; K326-L371 WeakPolarHBondContact O-CA 3.48Å; K326-I372 HydrophobicContact CB-CB 4.42Å; K326-I372 PolarHBondContact N-O 3.2Å; K326-I372 PolarHBondContact O-N 2.65Å; K326-D461 IonicContact NZ-OD1 3.53Å; K326-D461 PolarHBondContact NZ-OD1 3.39Å
327	R	91.8	Very high	83.4	Confident	87 Å²	87	63.4 Å²	63.4	33%	0.328	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	132.1	173	-173.6	170.6	83.2	-148.1	6.8	109.4	G309 S310 F312 H369 M370 L371	G309-R327 CarbonylContact C-O 3.59Å; G309-R327 WeakPolarHBondContact CA-O 3.18Å; S310-R327 PolarHBondContact N-O 3.02Å; S310-R327 PolarHBondContact O-N 2.93Å; F312-R327 HydrophobicContact CE2-CB 4.46Å; R327-H369 HydrophobicContact CG-CB 4.06Å; R327-M370 WeakPolarHBondContact CA-O 3.39Å; R327-L371 HydrophobicContact CB-CG 4.2Å; R327-L371 HydrophobicContact CG-CD1 4.23Å; R327-L371 HydrophobicContact CG-CD2 4.39Å; R327-L371 HydrophobicContact CG-CG 3.95Å
328	S	87.3	Confident	82.5	Confident	16 Å²	16	59.4 Å²	59.4	11%	0.112	36%	0.358	C	S	.	.			trans	-62.9	176.8	177.8	76.1	0	0	0	0	112.7	F308 K330 L332 H369 M370	F308-S328 WeakPolarHBondContact O-CA 3.21Å; S328-K330 PolarHBondContact OG-O 3.04Å; S328-L332 VanDerWaalsContact OG-CD1 3.26Å; S328-L332 WeakPolarHBondContact OG-CD1 3.26Å; S328-H369 PolarHBondContact O-CD2 3.45Å; S328-H369 VanDerWaalsContact O-CD2 3.3Å; S328-H369 WeakPolarHBondContact OG-CA 3.1Å; S328-H369 WeakPolarHBondContact OG-CB 3.43Å; S328-H369 PolarHBondContact OG-CD2 2.82Å; S328-M370 PolarHBondContact N-O 3.47Å; S328-M370 PolarHBondContact OG-N 3.17Å
329	K	74.4	Confident	81.6	Confident	96 Å²	96	57 Å²	57	42%	0.417	34%	0.343	S	S	.	.	S	Bend	trans	-116.1	-5.2	-177.6	-97.1	171.2	179.7	169.9	0	115.4	S305 G306 G309	S305-K329 PolarHBondContact OG-NZ 2.91Å; G306-K329 PolarHBondContact O-NZ 2.66Å; G309-K329 WeakPolarHBondContact O-CE 3.47Å; G309-K329 PolarHBondContact O-NZ 3.08Å; G309-K329 VanDerWaalsContact O-NZ 3.14Å
330	K	69.1	Low	80.9	Confident	97 Å²	97	54.3 Å²	54.3	42%	0.422	33%	0.329	S	S	.	.	S	Bend	trans	-143.3	149.3	-172.9	-55.6	173.6	-161.8	151.3	0	109.2	S328 L332 D337	S328-K330 PolarHBondContact OG-O 3.04Å; K330-L332 WeakPolarHBondContact O-CD1 3.26Å; K330-L332 PolarHBondContact O-N 3.35Å; K330-D337 WeakPolarHBondContact CD-OD2 3.34Å; K330-D337 IonicContact NZ-OD1 3.79Å; K330-D337 IonicContact NZ-OD2 2.65Å; K330-D337 PolarHBondContact NZ-OD2 3.45Å
331	P	61.1	Low	80.1	Confident	88 Å²	88	52.4 Å²	52.4	57%	0.571	31%	0.308	S	S	*	.			trans	-51.9	129.5	156.1	-26.7	37	0	0	0	110.7	D368	P331-D368 WeakPolarHBondContact CA-O 3.24Å; P331-D368 HydrophobicContact CB-CB 3.8Å; P331-D368 HydrophobicContact CG-CB 4.07Å
332	L	61.8	Low	79.5	Confident	12 Å²	12	53.6 Å²	53.6	6%	0.063	31%	0.31	C	S	.	.			trans	-93.1	-27.1	-158.9	-81.1	115.9	0	0	0	116.7	S328 K330 G334 S335 D337 E338 A341 D368 M370	S328-L332 VanDerWaalsContact OG-CD1 3.26Å; S328-L332 WeakPolarHBondContact OG-CD1 3.26Å; K330-L332 WeakPolarHBondContact O-CD1 3.26Å; K330-L332 PolarHBondContact O-N 3.35Å; L332-G334 PolarHBondContact O-N 3.36Å; L332-G334 VanDerWaalsContact O-N 3.1Å; L332-S335 VanDerWaalsContact O-CB 3.23Å; L332-S335 WeakPolarHBondContact O-CB 3.42Å; L332-S335 PolarHBondContact O-N 2.65Å; L332-S335 PolarHBondContact O-OG 3.44Å; L332-D337 HydrophobicContact CD2-CB 4.5Å; L332-E338 HydrophobicContact CB-CB 3.94Å; L332-E338 HydrophobicContact CB-CG 4.08Å; L332-E338 VanDerWaalsContact CD2-CA 3.46Å; L332-E338 HydrophobicContact CD2-CB 3.84Å; L332-E338 HydrophobicContact CD2-CG 4.32Å; L332-E338 HydrophobicContact CG-CB 4.5Å; L332-E338 WeakPolarHBondContact O-CB 3.46Å; L332-A341 HydrophobicContact CD2-CB 4.49Å; L332-D368 VanDerWaalsContact CD1-O 3.24Å; L332-D368 WeakPolarHBondContact CD1-O 3.36Å; L332-M370 HydrophobicContact CD1-CB 3.87Å; L332-M370 HydrophobicContact CD1-CG 3.7Å; L332-M370 HydrophobicContact CD2-CB 4.3Å; L332-M370 HydrophobicContact CD2-CG 3.95Å; L332-M370 HydrophobicContact CG-CG 4.39Å
333	A	60.9	Low	79	Confident	98 Å²	98	51.5 Å²	51.5	81%	0.81	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49	112.5	-164.6	0	0	0	0	0	114.9
334	G	63.1	Low	78.5	Confident	77 Å²	77	50.8 Å²	50.8	79%	0.794	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.6	11.9	177.3	0	0	0	0	0	115.6	L332 E338	L332-G334 PolarHBondContact O-N 3.36Å; L332-G334 VanDerWaalsContact O-N 3.1Å; G334-E338 PolarHBondContact N-OE2 2.94Å
335	S	73.3	Confident	78	Confident	34 Å²	34	51.6 Å²	51.6	24%	0.238	30%	0.298	C	S	.	.			trans	-92.7	160.4	-177.5	69.7	0	0	0	0	113.9	L332 D337 E338 Q339	L332-S335 VanDerWaalsContact O-CB 3.23Å; L332-S335 WeakPolarHBondContact O-CB 3.42Å; L332-S335 PolarHBondContact O-N 2.65Å; L332-S335 PolarHBondContact O-OG 3.44Å; S335-D337 VanDerWaalsContact C-N 3.27Å; S335-D337 PolarHBondContact O-N 2.66Å; S335-E338 WeakPolarHBondContact O-CB 3.28Å; S335-E338 PolarHBondContact O-N 3.28Å; S335-E338 PolarHBondContact OG-N 2.68Å; S335-E338 VanDerWaalsContact OG-N 3.08Å; S335-Q339 PolarHBondContact O-N 2.95Å
336	V	71.1	Confident	77.7	Confident	95 Å²	95	56.9 Å²	56.9	58%	0.576	32%	0.318	S	S	*	.	H	α-helix	trans	-63.2	-37.9	169	-179.2	0	0	0	0	110.4	E338 Q339 N340	V336-E338 PolarHBondContact O-N 3.31Å; V336-Q339 PolarHBondContact O-N 3.28Å; V336-Q339 VanDerWaalsContact O-N 3.15Å; V336-N340 WeakPolarHBondContact O-CB 3.49Å; V336-N340 PolarHBondContact O-N 3.01Å; V336-N340 PolarHBondContact O-OD1 3.03Å
337	D	70	Confident	77.4	Confident	30 Å²	30	55.4 Å²	55.4	16%	0.16	31%	0.312	C	S	.	.	H	α-helix	trans	-56.7	-34.3	175	-58.6	-64.2	0	0	0	112.1	K330 L332 S335 A341	K330-D337 WeakPolarHBondContact CD-OD2 3.34Å; K330-D337 IonicContact NZ-OD1 3.79Å; K330-D337 IonicContact NZ-OD2 2.65Å; K330-D337 PolarHBondContact NZ-OD2 3.45Å; L332-D337 HydrophobicContact CD2-CB 4.5Å; S335-D337 VanDerWaalsContact C-N 3.27Å; S335-D337 PolarHBondContact O-N 2.66Å; D337-A341 WeakPolarHBondContact O-CB 3.41Å; D337-A341 PolarHBondContact O-N 3.05Å
338	E	77.6	Confident	77.2	Confident	60 Å²	60	51.8 Å²	51.8	28%	0.28	30%	0.299	S	S	.	.	H	α-helix	trans	-70.6	-48.6	175.2	-171.6	174.7	-122.1	0	0	112	L332 G334 S335 V336 N340 A341 L342	L332-E338 HydrophobicContact CB-CB 3.94Å; L332-E338 HydrophobicContact CB-CG 4.08Å; L332-E338 VanDerWaalsContact CD2-CA 3.46Å; L332-E338 HydrophobicContact CD2-CB 3.84Å; L332-E338 HydrophobicContact CD2-CG 4.32Å; L332-E338 HydrophobicContact CG-CB 4.5Å; L332-E338 WeakPolarHBondContact O-CB 3.46Å; G334-E338 PolarHBondContact N-OE2 2.94Å; S335-E338 WeakPolarHBondContact O-CB 3.28Å; S335-E338 PolarHBondContact O-N 3.28Å; S335-E338 PolarHBondContact OG-N 2.68Å; S335-E338 VanDerWaalsContact OG-N 3.08Å; V336-E338 PolarHBondContact O-N 3.31Å; E338-N340 PolarHBondContact O-N 3.38Å; E338-A341 PolarHBondContact O-N 3.23Å; E338-L342 HydrophobicContact CG-CD1 4.01Å; E338-L342 HydrophobicContact CG-CG 4.41Å; E338-L342 WeakPolarHBondContact O-CB 3.49Å; E338-L342 VanDerWaalsContact O-CG 3.29Å; E338-L342 WeakPolarHBondContact O-CG 3.47Å; E338-L342 PolarHBondContact O-N 3.13Å
339	Q	78.6	Confident	77.2	Confident	89 Å²	89	54.9 Å²	54.9	42%	0.416	33%	0.325	S	S	.	.	H	α-helix	trans	-59.7	-37.3	176.3	-169.5	63.5	22.2	0	0	111	S335 V336 L342 R343	S335-Q339 PolarHBondContact O-N 2.95Å; V336-Q339 PolarHBondContact O-N 3.28Å; V336-Q339 VanDerWaalsContact O-N 3.15Å; Q339-L342 PolarHBondContact O-N 3.05Å; Q339-R343 WeakPolarHBondContact O-CB 3.48Å; Q339-R343 VanDerWaalsContact O-CG 3.28Å; Q339-R343 WeakPolarHBondContact O-CG 3.5Å; Q339-R343 PolarHBondContact O-N 3Å
340	N	80.1	Confident	77.9	Confident	7 Å²	7	52.2 Å²	52.2	4%	0.037	32%	0.317	C	S	.	.	H	α-helix	trans	-70.3	-41.1	179.4	-65.9	20.4	0	0	0	111.4	V336 E338 R343 E344 E474	V336-N340 WeakPolarHBondContact O-CB 3.49Å; V336-N340 PolarHBondContact O-N 3.01Å; V336-N340 PolarHBondContact O-OD1 3.03Å; E338-N340 PolarHBondContact O-N 3.38Å; N340-R343 PolarHBondContact ND2-NH2 3.16Å; N340-R343 PolarHBondContact O-N 3.08Å; N340-R343 PolarHBondContact OD1-NH1 3.34Å; N340-R343 PolarHBondContact OD1-NH2 3.01Å; N340-E344 PolarHBondContact O-N 3.16Å; N340-E474 PolarHBondContact ND2-OE1 2.9Å; N340-E474 PolarHBondContact ND2-OE2 2.87Å; N340-E474 VanDerWaalsContact ND2-OE2 3.11Å; N340-E474 PolarHBondContact OD1-OE2 2.8Å
341	A	80.6	Confident	78.8	Confident	12 Å²	12	48 Å²	48	10%	0.099	30%	0.299	C	S	.	.	H	α-helix	trans	-65.5	-40.2	172.8	0	0	0	0	0	112.5	L332 D337 E338 E344 V345 M370	L332-A341 HydrophobicContact CD2-CB 4.49Å; D337-A341 WeakPolarHBondContact O-CB 3.41Å; D337-A341 PolarHBondContact O-N 3.05Å; E338-A341 PolarHBondContact O-N 3.23Å; A341-E344 PolarHBondContact O-N 2.73Å; A341-V345 WeakPolarHBondContact O-CG2 3.41Å; A341-V345 PolarHBondContact O-N 3.18Å; A341-M370 HydrophobicContact CB-CB 4.43Å; A341-M370 HydrophobicContact CB-CG 4.43Å
342	L	84.3	Confident	80	Confident	87 Å²	87	45.7 Å²	45.7	46%	0.455	29%	0.291	S	S	.	.	H	α-helix	trans	-66.8	-36.3	175.2	-71.1	173.6	0	0	0	112	E338 Q339 Y346	E338-L342 HydrophobicContact CG-CD1 4.01Å; E338-L342 HydrophobicContact CG-CG 4.41Å; E338-L342 WeakPolarHBondContact O-CB 3.49Å; E338-L342 VanDerWaalsContact O-CG 3.29Å; E338-L342 WeakPolarHBondContact O-CG 3.47Å; E338-L342 PolarHBondContact O-N 3.13Å; Q339-L342 PolarHBondContact O-N 3.05Å; L342-Y346 VanDerWaalsContact O-CB 3.22Å; L342-Y346 WeakPolarHBondContact O-CB 3.48Å; L342-Y346 PolarHBondContact O-N 2.74Å
343	R	86.6	Confident	81.4	Confident	32 Å²	32	52.2 Å²	52.2	12%	0.121	32%	0.321	C	S	.	.	H	α-helix	trans	-65.4	-41.7	171.3	-74.3	-172.1	-39.9	-120.2	11.5	111.8	Q339 N340 Y346 A347 G463 E474	Q339-R343 WeakPolarHBondContact O-CB 3.48Å; Q339-R343 VanDerWaalsContact O-CG 3.28Å; Q339-R343 WeakPolarHBondContact O-CG 3.5Å; Q339-R343 PolarHBondContact O-N 3Å; N340-R343 PolarHBondContact ND2-NH2 3.16Å; N340-R343 PolarHBondContact O-N 3.08Å; N340-R343 PolarHBondContact OD1-NH1 3.34Å; N340-R343 PolarHBondContact OD1-NH2 3.01Å; R343-Y346 PolarHBondContact O-N 2.74Å; R343-A347 WeakPolarHBondContact O-CB 3.38Å; R343-A347 PolarHBondContact O-N 3.19Å; R343-G463 PolarHBondContact NE-O 3.34Å; R343-G463 PolarHBondContact NH2-O 3.43Å; R343-E474 IonicContact CZ-OE2 2.71Å; R343-E474 IonicContact NH1-OE2 3.77Å; R343-E474 PolarHBondContact NH1-OE2 3.33Å; R343-E474 VanDerWaalsContact NH1-OE2 3.13Å; R343-E474 IonicContact NH2-OE2 2.77Å; R343-E474 PolarHBondContact NH2-OE2 3.18Å
344	E	88.4	Confident	83	Confident	4 Å²	4	49.4 Å²	49.4	2%	0.019	29%	0.291	C	S	.	.	H	α-helix	trans	-61.1	-47.1	175.6	-175.9	174.4	-171.5	0	0	111.7	K326 N340 A341 A347 H348 I372 L462	K326-E344 WeakPolarHBondContact CE-OE2 3.31Å; K326-E344 IonicContact NZ-OE1 3.68Å; K326-E344 PolarHBondContact NZ-OE1 3.21Å; K326-E344 IonicContact NZ-OE2 2.67Å; K326-E344 PolarHBondContact NZ-OE2 2.96Å; N340-E344 PolarHBondContact O-N 3.16Å; A341-E344 PolarHBondContact O-N 2.73Å; E344-A347 PolarHBondContact O-N 3.25Å; E344-H348 PolarHBondContact O-CD2 3.25Å; E344-H348 PolarHBondContact O-N 3.18Å; E344-I372 HydrophobicContact CB-CD1 4.23Å; E344-I372 HydrophobicContact CG-CD1 3.97Å; E344-I372 WeakPolarHBondContact OE2-CD1 2.97Å; E344-L462 HydrophobicContact CG-CB 4.25Å
345	V	87.8	Confident	84.6	Confident	33 Å²	33	49.2 Å²	49.2	20%	0.2	28%	0.278	C	S	.	.	H	α-helix	trans	-64.7	-43.6	176.1	173.5	0	0	0	0	111.8	A341 H348 A349 A363 M370 I372	A341-V345 WeakPolarHBondContact O-CG2 3.41Å; A341-V345 PolarHBondContact O-N 3.18Å; V345-H348 PolarHBondContact O-N 3.11Å; V345-A349 WeakPolarHBondContact O-CB 3.29Å; V345-A349 PolarHBondContact O-N 3.38Å; V345-A363 HydrophobicContact CG2-CB 3.6Å; V345-M370 HydrophobicContact CG2-CE 4.34Å; V345-I372 HydrophobicContact CG2-CD1 4.03Å; V345-I372 HydrophobicContact CG2-CG1 4.21Å
346	Y	89.3	Confident	85.7	Confident	110 Å²	110	48.2 Å²	48.2	43%	0.431	27%	0.269	S	S	.	.	H	α-helix	trans	-64.5	-42.2	176.5	176.9	-89.5	0	0	0	112	L342 R343 H348 A349 V350 R467	L342-Y346 VanDerWaalsContact O-CB 3.22Å; L342-Y346 WeakPolarHBondContact O-CB 3.48Å; L342-Y346 PolarHBondContact O-N 2.74Å; R343-Y346 PolarHBondContact O-N 2.74Å; Y346-H348 VanDerWaalsContact C-N 3.34Å; Y346-H348 PolarHBondContact O-N 2.78Å; Y346-A349 PolarHBondContact O-N 3.35Å; Y346-A349 VanDerWaalsContact O-N 3.16Å; Y346-V350 HydrophobicContact CD1-CG2 4.37Å; Y346-V350 HydrophobicContact CE1-CG2 3.66Å; Y346-V350 HydrophobicContact CE2-CG2 4.17Å; Y346-V350 PolarHBondContact O-N 3.1Å; Y346-V350 VanDerWaalsContact O-N 3.1Å; Y346-V350 WeakPolarHBondContact OH-CG2 3.36Å; Y346-R467 PolarHBondContact OH-NH2 3.37Å
347	A	88.9	Confident	87	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-59.9	-45.7	176.2	0	0	0	0	0	110.7	R343 E344 A349 V350 L351 L462 V465	R343-A347 WeakPolarHBondContact O-CB 3.38Å; R343-A347 PolarHBondContact O-N 3.19Å; E344-A347 PolarHBondContact O-N 3.25Å; A347-A349 VanDerWaalsContact C-N 3.33Å; A347-A349 PolarHBondContact O-N 3.41Å; A347-V350 PolarHBondContact O-N 3.07Å; A347-L351 HydrophobicContact CB-CD1 4.44Å; A347-L351 WeakPolarHBondContact O-CB 3.4Å; A347-L351 VanDerWaalsContact O-CG 3.3Å; A347-L351 WeakPolarHBondContact O-CG 3.34Å; A347-L351 PolarHBondContact O-N 3.42Å; A347-L462 HydrophobicContact CB-CB 3.93Å; A347-L462 HydrophobicContact CB-CD1 3.92Å; A347-V465 HydrophobicContact CB-CB 3.78Å; A347-V465 HydrophobicContact CB-CG1 3.65Å; A347-V465 HydrophobicContact CB-CG2 4.2Å
348	H	86.9	Confident	88.3	Confident	11 Å²	11	42.9 Å²	42.9	5%	0.051	24%	0.238	C	C	.	.	H	α-helix	trans	-67.8	-26.2	174.5	-77.7	-57.8	0	0	0	114.5	E344 V345 Y346 V358 Y360 L462	E344-H348 PolarHBondContact O-CD2 3.25Å; E344-H348 PolarHBondContact O-N 3.18Å; V345-H348 PolarHBondContact O-N 3.11Å; Y346-H348 VanDerWaalsContact C-N 3.34Å; Y346-H348 PolarHBondContact O-N 2.78Å; H348-V358 PolarHBondContact CE1-O 3.18Å; H348-V358 VanDerWaalsContact CE1-O 3.28Å; H348-Y360 HydrophobicContact CB-CD1 3.9Å; H348-Y360 HydrophobicContact CB-CD2 3.96Å; H348-Y360 HydrophobicContact CB-CG 3.58Å; H348-Y360 AromaticContact CD2-CD2 3.92Å; H348-Y360 AromaticContact CG-CG 3.8Å; H348-Y360 WeakPolarHBondContact ND1-CB 3.5Å; H348-L462 WeakPolarHBondContact CE1-CD1 3.31Å; H348-L462 WeakPolarHBondContact ND1-CD1 3.31Å
349	A	86.8	Confident	89.1	Confident	80 Å²	80	44.8 Å²	44.8	66%	0.661	24%	0.243	S	C	*	.	H	α-helix	trans	-73.3	-28.5	173.3	0	0	0	0	0	112.9	V345 Y346 A347	V345-A349 WeakPolarHBondContact O-CB 3.29Å; V345-A349 PolarHBondContact O-N 3.38Å; Y346-A349 PolarHBondContact O-N 3.35Å; Y346-A349 VanDerWaalsContact O-N 3.16Å; A347-A349 VanDerWaalsContact C-N 3.33Å; A347-A349 PolarHBondContact O-N 3.41Å
350	V	89.8	Confident	89.8	Confident	41 Å²	41	43.4 Å²	43.4	25%	0.248	23%	0.234	C	C	.	.	H	α-helix	trans	-87.4	-40.3	173.8	177.2	0	0	0	0	111.6	Y346 A347 G352 M418 L420	Y346-V350 HydrophobicContact CD1-CG2 4.37Å; Y346-V350 HydrophobicContact CE1-CG2 3.66Å; Y346-V350 HydrophobicContact CE2-CG2 4.17Å; Y346-V350 PolarHBondContact O-N 3.1Å; Y346-V350 VanDerWaalsContact O-N 3.1Å; Y346-V350 WeakPolarHBondContact OH-CG2 3.36Å; A347-V350 PolarHBondContact O-N 3.07Å; V350-G352 PolarHBondContact O-N 3.38Å; V350-M418 HydrophobicContact CG1-CB 4.35Å; V350-M418 HydrophobicContact CG1-CE 3.99Å; V350-L420 HydrophobicContact CB-CD1 4.2Å; V350-L420 HydrophobicContact CG1-CD1 3.9Å
351	L	88.1	Confident	90.5	Very high	8 Å²	8	46.8 Å²	46.8	4%	0.042	25%	0.249	C	C	.	.	S	Bend	trans	-85.7	86	179.2	-64.3	166.1	0	0	0	109.8	A347 Y414 I415 M418 L420 L462	A347-L351 HydrophobicContact CB-CD1 4.44Å; A347-L351 WeakPolarHBondContact O-CB 3.4Å; A347-L351 VanDerWaalsContact O-CG 3.3Å; A347-L351 WeakPolarHBondContact O-CG 3.34Å; A347-L351 PolarHBondContact O-N 3.42Å; L351-Y414 HydrophobicContact CB-CE1 4.24Å; L351-Y414 HydrophobicContact CD2-CD1 4.09Å; L351-Y414 HydrophobicContact CD2-CE1 3.72Å; L351-I415 HydrophobicContact CD1-CG1 4.17Å; L351-I415 HydrophobicContact CD2-CB 4.4Å; L351-I415 HydrophobicContact CD2-CG1 4.04Å; L351-M418 HydrophobicContact CD2-CB 4.13Å; L351-M418 HydrophobicContact CD2-CG 3.97Å; L351-L420 HydrophobicContact CD1-CD1 4.03Å; L351-L420 HydrophobicContact CD2-CD1 4.09Å; L351-L420 HydrophobicContact CG-CD1 3.83Å; L351-L462 HydrophobicContact CD1-CD1 3.81Å
352	G	85.8	Confident	91.1	Very high	40 Å²	40	47.5 Å²	47.5	41%	0.412	25%	0.253	S	S	.	.			trans	-57.6	-179.2	166.3	0	0	0	0	0	113.6	V350 H354 Y414	V350-G352 PolarHBondContact O-N 3.38Å; G352-H354 PolarHBondContact O-N 3.09Å; G352-Y414 PolarHBondContact N-OH 2.82Å; G352-Y414 PolarHBondContact O-OH 3.12Å
353	Q	90.6	Very high	91.5	Very high	149 Å²	149	44.5 Å²	44.5	70%	0.696	24%	0.241	S	C	*	.			trans	-64.7	119.8	-170.5	-175.2	178.2	-16.7	0	0	112.9
354	H	95.6	Very high	91.7	Very high	39 Å²	39	44.2 Å²	44.2	18%	0.181	24%	0.24	C	C	.	.			trans	-135.6	138	172	178.5	-105.1	0	0	0	110.7	G352 H356 V357 R410 Y414	G352-H354 PolarHBondContact O-N 3.09Å; H354-H356 AromaticContact CE1-CD2 3.92Å; H354-H356 PolarHBondContact ND1-N 3.41Å; H354-H356 PolarHBondContact O-N 2.95Å; H354-H356 VanDerWaalsContact O-N 3.08Å; H354-V357 HydrophobicContact CB-CG2 4.41Å; H354-V357 PolarHBondContact O-N 3.17Å; H354-V357 VanDerWaalsContact O-O 3.11Å; H354-R410 PolarHBondContact CE1-O 3.48Å; H354-Y414 HydrophobicContact CB-CD1 3.42Å; H354-Y414 VanDerWaalsContact CB-CD1 3.42Å; H354-Y414 HydrophobicContact CB-CD2 4.44Å; H354-Y414 HydrophobicContact CB-CE1 3.56Å; H354-Y414 HydrophobicContact CB-CG 3.9Å; H354-Y414 AromaticContact CD2-CG 3.96Å; H354-Y414 AromaticContact CG-CD1 3.67Å; H354-Y414 AromaticContact CG-CG 3.72Å
355	S	96	Very high	91.7	Very high	73 Å²	73	47.7 Å²	47.7	51%	0.51	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-30	-169.5	-50.5	0	0	0	0	114.8	K458	S355-K458 WeakPolarHBondContact O-CG 3.36Å; S355-K458 PolarHBondContact O-NZ 3.07Å; S355-K458 VanDerWaalsContact O-NZ 3.12Å
356	H	97.8	Very high	91.7	Very high	12 Å²	12	47.4 Å²	47.4	6%	0.056	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.2	20.2	-178.9	-54.1	-67.9	0	0	0	113.7	H354 Q407 M456 F457 I459	H354-H356 AromaticContact CE1-CD2 3.92Å; H354-H356 PolarHBondContact ND1-N 3.41Å; H354-H356 PolarHBondContact O-N 2.95Å; H354-H356 VanDerWaalsContact O-N 3.08Å; H356-Q407 WeakPolarHBondContact CB-O 3.42Å; H356-Q407 VanDerWaalsContact CE1-CG 3.48Å; H356-Q407 WeakPolarHBondContact CE1-CG 3.32Å; H356-Q407 PolarHBondContact CE1-OE1 2.86Å; H356-Q407 VanDerWaalsContact CG-O 3.25Å; H356-Q407 PolarHBondContact ND1-OE1 3.13Å; H356-M456 WeakPolarHBondContact CE1-CE 3.35Å; H356-F457 WeakPolarHBondContact CA-O 3.44Å; H356-F457 PolarHBondContact ND1-O 3.29Å; H356-F457 VanDerWaalsContact ND1-O 3.09Å; H356-I459 PolarHBondContact O-N 3.26Å
357	V	97.4	Very high	91.5	Very high	5 Å²	5	48.5 Å²	48.5	3%	0.03	28%	0.279	C	S	.	.	B	Isolated β-bridge	trans	-121.6	146.6	165.5	179.5	0	0	0	0	107.5	H354 R359 Y414 I415 I459	H354-V357 HydrophobicContact CB-CG2 4.41Å; H354-V357 PolarHBondContact O-N 3.17Å; H354-V357 VanDerWaalsContact O-O 3.11Å; V357-R359 PolarHBondContact O-N 3.19Å; V357-Y414 HydrophobicContact CG2-CD1 4.13Å; V357-I415 HydrophobicContact CG2-CD1 4.23Å; V357-I415 HydrophobicContact CG2-CG1 4.26Å; V357-I459 CarbonylContact C-O 3.6Å; V357-I459 WeakPolarHBondContact CA-O 3.45Å
358	V	96.8	Very high	91.2	Very high	8 Å²	8	54.2 Å²	54.2	5%	0.048	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-66.5	119	175	171.1	0	0	0	0	108.7	H348 Y360 N374 E375 F431 K458 I459	H348-V358 PolarHBondContact CE1-O 3.18Å; H348-V358 VanDerWaalsContact CE1-O 3.28Å; V358-Y360 PolarHBondContact O-N 3.19Å; V358-N374 HydrophobicContact CG1-CB 3.83Å; V358-E375 VanDerWaalsContact CA-OE1 3.32Å; V358-E375 WeakPolarHBondContact CA-OE1 3.44Å; V358-E375 HydrophobicContact CG1-CG 4.15Å; V358-F431 HydrophobicContact CG2-CB 4.25Å; V358-F431 HydrophobicContact CG2-CD2 3.71Å; V358-F431 HydrophobicContact CG2-CG 4.25Å; V358-K458 HydrophobicContact CG2-CB 3.89Å; V358-I459 WeakPolarHBondContact CG2-O 3.22Å; V358-I459 PolarHBondContact N-O 3.06Å
359	R	94.9	Very high	91.1	Very high	100 Å²	100	56 Å²	56	38%	0.377	32%	0.317	S	S	.	.	P	Polyproline II helix	trans	-69.8	127.2	179.1	177.5	175.5	179.7	157.9	7.9	110.8	V357 F361 N374 E375	V357-R359 PolarHBondContact O-N 3.19Å; R359-F361 HydrophobicContact CB-CE2 4.33Å; R359-F361 HydrophobicContact CG-CD2 4.32Å; R359-F361 HydrophobicContact CG-CE2 3.8Å; R359-F361 HydrophobicContact CG-CZ 4Å; R359-N374 CarbonylContact O-C 3.57Å; R359-N374 WeakPolarHBondContact O-CA 3.22Å; R359-E375 HydrophobicContact CB-CB 4.29Å; R359-E375 HydrophobicContact CB-CG 4.24Å; R359-E375 PolarHBondContact N-OE1 3.14Å; R359-E375 PolarHBondContact O-N 2.76Å
360	Y	93.9	Very high	91.1	Very high	61 Å²	61	53.6 Å²	53.6	24%	0.239	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	153.2	168.4	166.7	-93.8	0	0	0	112	H348 V358 S362 A363 I372 N374	H348-Y360 HydrophobicContact CB-CD1 3.9Å; H348-Y360 HydrophobicContact CB-CD2 3.96Å; H348-Y360 HydrophobicContact CB-CG 3.58Å; H348-Y360 AromaticContact CD2-CD2 3.92Å; H348-Y360 AromaticContact CG-CG 3.8Å; H348-Y360 WeakPolarHBondContact ND1-CB 3.5Å; V358-Y360 PolarHBondContact O-N 3.19Å; Y360-S362 VanDerWaalsContact CE2-C 3.46Å; Y360-S362 WeakPolarHBondContact CE2-O 3.49Å; Y360-A363 HydrophobicContact CE2-CB 3.91Å; Y360-A363 WeakPolarHBondContact OH-CB 3.35Å; Y360-A363 PolarHBondContact OH-N 3.17Å; Y360-A363 VanDerWaalsContact OH-N 3.09Å; Y360-I372 HydrophobicContact CD2-CG2 4.03Å; Y360-I372 HydrophobicContact CE2-CG2 4.13Å; Y360-N374 WeakPolarHBondContact CA-OD1 3.43Å
361	F	93.7	Very high	91.2	Very high	78 Å²	78	51.7 Å²	51.7	34%	0.342	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	-44.1	177.5	-69.4	-94.7	0	0	0	113.4	Y323 R359 Q373 E375	Y323-F361 AromaticContact CD1-CD2 3.87Å; Y323-F361 HydrophobicContact CD1-CD2 3.87Å; Y323-F361 HydrophobicContact CD1-CE2 4.03Å; Y323-F361 HydrophobicContact CD1-CG 4.28Å; Y323-F361 HydrophobicContact CE1-CB 4.49Å; Y323-F361 AromaticContact CE1-CD1 3.85Å; Y323-F361 HydrophobicContact CE1-CD1 3.85Å; Y323-F361 AromaticContact CE1-CD2 3.61Å; Y323-F361 HydrophobicContact CE1-CD2 3.61Å; Y323-F361 AromaticContact CE1-CE1 3.86Å; Y323-F361 HydrophobicContact CE1-CE1 3.86Å; Y323-F361 AromaticContact CE1-CE2 3.62Å; Y323-F361 HydrophobicContact CE1-CE2 3.62Å; Y323-F361 AromaticContact CE1-CG 3.72Å; Y323-F361 HydrophobicContact CE1-CG 3.72Å; Y323-F361 AromaticContact CE1-CZ 3.75Å; Y323-F361 HydrophobicContact CE1-CZ 3.75Å; R359-F361 HydrophobicContact CB-CE2 4.33Å; R359-F361 HydrophobicContact CG-CD2 4.32Å; R359-F361 HydrophobicContact CG-CE2 3.8Å; R359-F361 HydrophobicContact CG-CZ 4Å; F361-Q373 HydrophobicContact CB-CG 4.17Å; F361-Q373 PolarHBondContact N-O 3.06Å; F361-E375 HydrophobicContact CE2-CB 3.96Å
362	S	93.7	Very high	91.5	Very high	27 Å²	27	51.5 Å²	51.5	19%	0.189	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.3	153.5	-175.6	-166.8	0	0	0	0	110.9	R292 Y360 Q373	R292-S362 PolarHBondContact NH1-OG 3.38Å; Y360-S362 VanDerWaalsContact CE2-C 3.46Å; Y360-S362 WeakPolarHBondContact CE2-O 3.49Å; S362-Q373 PolarHBondContact N-O 3.11Å; S362-Q373 WeakPolarHBondContact O-CB 3.49Å; S362-Q373 PolarHBondContact O-N 3.32Å
363	A	92.1	Very high	92	Very high	24 Å²	24	49.9 Å²	49.9	20%	0.198	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	151.9	162	0	0	0	0	0	109.7	V345 Y360 L371 I372	V345-A363 HydrophobicContact CG2-CB 3.6Å; Y360-A363 HydrophobicContact CE2-CB 3.91Å; Y360-A363 WeakPolarHBondContact OH-CB 3.35Å; Y360-A363 PolarHBondContact OH-N 3.17Å; Y360-A363 VanDerWaalsContact OH-N 3.09Å; A363-L371 CarbonylContact C-O 3.57Å; A363-L371 WeakPolarHBondContact CA-O 3.21Å; A363-L371 WeakPolarHBondContact CB-O 3.31Å; A363-I372 HydrophobicContact CB-CG1 4.07Å
364	W	91.6	Very high	92.2	Very high	26 Å²	26	43.5 Å²	43.5	10%	0.098	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	162.9	175.6	65.2	100.7	0	0	0	110.9	R292 Y293 F297 I325 E366 L371 Q373	R292-W364 VanDerWaalsContact NH1-CD2 3.32Å; Y293-W364 HydrophobicContact CD2-CZ2 4.41Å; F297-W364 HydrophobicContact CD2-CH2 4.3Å; F297-W364 AromaticContact CE2-CH2 3.5Å; F297-W364 HydrophobicContact CE2-CH2 3.5Å; F297-W364 VanDerWaalsContact CE2-CH2 3.5Å; F297-W364 HydrophobicContact CE2-CZ2 4.02Å; F297-W364 HydrophobicContact CE2-CZ3 4.37Å; F297-W364 AromaticContact CZ-CH2 3.94Å; F297-W364 HydrophobicContact CZ-CH2 3.94Å; F297-W364 HydrophobicContact CZ-CZ3 4.5Å; I325-W364 HydrophobicContact CD1-CH2 4.48Å; W364-E366 PolarHBondContact NE1-OE2 3.3Å; W364-L371 HydrophobicContact CD2-CB 4Å; W364-L371 HydrophobicContact CE3-CB 4.34Å; W364-L371 HydrophobicContact CH2-CB 4.28Å; W364-L371 HydrophobicContact CH2-CD2 4.49Å; W364-L371 HydrophobicContact CZ2-CB 3.92Å; W364-L371 HydrophobicContact CZ2-CD2 3.66Å; W364-L371 HydrophobicContact CZ2-CG 4.37Å; W364-L371 HydrophobicContact CZ3-CB 4.47Å; W364-L371 PolarHBondContact N-O 3.49Å; W364-L371 PolarHBondContact O-N 2.97Å; W364-Q373 HydrophobicContact CZ3-CB 4.09Å
365	A	88.3	Confident	92.2	Very high	77 Å²	77	43.6 Å²	43.6	64%	0.636	23%	0.233	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-103.5	139.2	170.9	0	0	0	0	0	109.9	H369 M370	A365-H369 CarbonylContact C-O 3.5Å; A365-H369 VanDerWaalsContact CA-O 3.29Å; A365-H369 WeakPolarHBondContact CA-O 3.43Å; A365-M370 HydrophobicContact CB-SD 3.95Å
366	E	88.3	Confident	92.3	Very high	27 Å²	27	42.7 Å²	42.7	13%	0.126	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.5	132.6	-174	174.4	166	-145	0	0	110.1	S291 R292 Y293 W364 D368 H369 L371	S291-E366 WeakPolarHBondContact CA-OE1 3.46Å; S291-E366 WeakPolarHBondContact CB-OE1 3.43Å; S291-E366 VanDerWaalsContact OG-CD 3.3Å; S291-E366 PolarHBondContact OG-OE1 3.08Å; R292-E366 PolarHBondContact N-OE1 3.06Å; Y293-E366 WeakPolarHBondContact CB-OE2 3.31Å; Y293-E366 PolarHBondContact N-OE2 3.06Å; W364-E366 PolarHBondContact NE1-OE2 3.3Å; E366-D368 VanDerWaalsContact C-N 3.27Å; E366-D368 PolarHBondContact O-N 3.46Å; E366-H369 PolarHBondContact N-O 3.45Å; E366-H369 WeakPolarHBondContact O-CA 3.4Å; E366-H369 WeakPolarHBondContact O-CB 3.41Å; E366-H369 PolarHBondContact O-N 2.78Å; E366-L371 HydrophobicContact CB-CD1 3.87Å
367	D	84.7	Confident	92.2	Very high	132 Å²	132	42.6 Å²	42.6	71%	0.706	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.1	43.5	-176.1	-58.1	-31.1	0	0	0	113.8	H369	D367-H369 PolarHBondContact O-CE1 3.17Å; D367-H369 PolarHBondContact O-N 2.89Å; D367-H369 VanDerWaalsContact O-N 3.1Å; D367-H369 PolarHBondContact O-ND1 3.09Å
368	D	82.1	Confident	92.1	Very high	120 Å²	120	46.4 Å²	46.4	64%	0.642	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.7	4	-169.9	-63.8	-30.3	0	0	0	116.1	P331 L332 E366	P331-D368 WeakPolarHBondContact CA-O 3.24Å; P331-D368 HydrophobicContact CB-CB 3.8Å; P331-D368 HydrophobicContact CG-CB 4.07Å; L332-D368 VanDerWaalsContact CD1-O 3.24Å; L332-D368 WeakPolarHBondContact CD1-O 3.36Å; E366-D368 VanDerWaalsContact C-N 3.27Å; E366-D368 PolarHBondContact O-N 3.46Å
369	H	84.7	Confident	92	Very high	48 Å²	48	46.9 Å²	46.9	22%	0.222	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	151	177.2	-62.1	83.8	0	0	0	112.1	R327 S328 A365 E366 D367 L371	R327-H369 HydrophobicContact CG-CB 4.06Å; S328-H369 PolarHBondContact O-CD2 3.45Å; S328-H369 VanDerWaalsContact O-CD2 3.3Å; S328-H369 WeakPolarHBondContact OG-CA 3.1Å; S328-H369 WeakPolarHBondContact OG-CB 3.43Å; S328-H369 PolarHBondContact OG-CD2 2.82Å; A365-H369 CarbonylContact C-O 3.5Å; A365-H369 VanDerWaalsContact CA-O 3.29Å; A365-H369 WeakPolarHBondContact CA-O 3.43Å; E366-H369 PolarHBondContact N-O 3.45Å; E366-H369 WeakPolarHBondContact O-CA 3.4Å; E366-H369 WeakPolarHBondContact O-CB 3.41Å; E366-H369 PolarHBondContact O-N 2.78Å; D367-H369 PolarHBondContact O-CE1 3.17Å; D367-H369 PolarHBondContact O-N 2.89Å; D367-H369 VanDerWaalsContact O-N 3.1Å; D367-H369 PolarHBondContact O-ND1 3.09Å; H369-L371 HydrophobicContact CB-CD1 4.38Å
370	M	87.4	Confident	92.1	Very high	31 Å²	31	43.3 Å²	43.3	15%	0.153	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	134.5	168	-81.3	-66.9	-71.1	0	0	109.1	R327 S328 L332 A341 V345 A365	R327-M370 WeakPolarHBondContact CA-O 3.39Å; S328-M370 PolarHBondContact N-O 3.47Å; S328-M370 PolarHBondContact OG-N 3.17Å; L332-M370 HydrophobicContact CD1-CB 3.87Å; L332-M370 HydrophobicContact CD1-CG 3.7Å; L332-M370 HydrophobicContact CD2-CB 4.3Å; L332-M370 HydrophobicContact CD2-CG 3.95Å; L332-M370 HydrophobicContact CG-CG 4.39Å; A341-M370 HydrophobicContact CB-CB 4.43Å; A341-M370 HydrophobicContact CB-CG 4.43Å; V345-M370 HydrophobicContact CG2-CE 4.34Å; A365-M370 HydrophobicContact CB-SD 3.95Å
371	L	92.6	Very high	92.3	Very high	1 Å²	1	40.9 Å²	40.9	1%	0.005	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	132.9	174.4	-68	86.2	0	0	0	109.5	Y293 I325 K326 R327 A363 W364 E366 H369	Y293-L371 HydrophobicContact CD2-CD2 3.61Å; Y293-L371 HydrophobicContact CE2-CD2 4.4Å; Y293-L371 HydrophobicContact CG-CD2 3.88Å; I325-L371 HydrophobicContact CG2-CB 4.4Å; I325-L371 HydrophobicContact CG2-CD2 4.26Å; K326-L371 CarbonylContact O-C 3.55Å; K326-L371 WeakPolarHBondContact O-CA 3.48Å; R327-L371 HydrophobicContact CB-CG 4.2Å; R327-L371 HydrophobicContact CG-CD1 4.23Å; R327-L371 HydrophobicContact CG-CD2 4.39Å; R327-L371 HydrophobicContact CG-CG 3.95Å; A363-L371 CarbonylContact C-O 3.57Å; A363-L371 WeakPolarHBondContact CA-O 3.21Å; A363-L371 WeakPolarHBondContact CB-O 3.31Å; W364-L371 HydrophobicContact CD2-CB 4Å; W364-L371 HydrophobicContact CE3-CB 4.34Å; W364-L371 HydrophobicContact CH2-CB 4.28Å; W364-L371 HydrophobicContact CH2-CD2 4.49Å; W364-L371 HydrophobicContact CZ2-CB 3.92Å; W364-L371 HydrophobicContact CZ2-CD2 3.66Å; W364-L371 HydrophobicContact CZ2-CG 4.37Å; W364-L371 HydrophobicContact CZ3-CB 4.47Å; W364-L371 PolarHBondContact N-O 3.49Å; W364-L371 PolarHBondContact O-N 2.97Å; E366-L371 HydrophobicContact CB-CD1 3.87Å; H369-L371 HydrophobicContact CB-CD1 4.38Å
372	I	93.1	Very high	92.5	Very high	4 Å²	4	37.2 Å²	37.2	2%	0.021	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	121.8	178.5	-59.9	176.3	0	0	0	108.4	I325 K326 E344 V345 Y360 A363	I325-I372 CarbonylContact C-O 3.58Å; I325-I372 WeakPolarHBondContact CA-O 3.27Å; K326-I372 HydrophobicContact CB-CB 4.42Å; K326-I372 PolarHBondContact N-O 3.2Å; K326-I372 PolarHBondContact O-N 2.65Å; E344-I372 HydrophobicContact CB-CD1 4.23Å; E344-I372 HydrophobicContact CG-CD1 3.97Å; E344-I372 WeakPolarHBondContact OE2-CD1 2.97Å; V345-I372 HydrophobicContact CG2-CD1 4.03Å; V345-I372 HydrophobicContact CG2-CG1 4.21Å; Y360-I372 HydrophobicContact CD2-CG2 4.03Å; Y360-I372 HydrophobicContact CE2-CG2 4.13Å; A363-I372 HydrophobicContact CB-CG1 4.07Å
373	Q	96	Very high	92.7	Very high	5 Å²	5	37.2 Å²	37.2	2%	0.023	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	112.3	-179.3	-178.9	-163.6	-1.3	0	0	110.6	F297 Y323 I325 F361 S362 W364	F297-Q373 HydrophobicContact CE1-CG 4.35Å; F297-Q373 HydrophobicContact CZ-CG 4.4Å; Y323-Q373 HydrophobicContact CD1-CG 3.78Å; Y323-Q373 HydrophobicContact CG-CG 3.93Å; Y323-Q373 VanDerWaalsContact CG-NE2 3.31Å; I325-Q373 HydrophobicContact CG1-CB 4.34Å; I325-Q373 HydrophobicContact CG1-CG 4.27Å; F361-Q373 HydrophobicContact CB-CG 4.17Å; F361-Q373 PolarHBondContact N-O 3.06Å; S362-Q373 PolarHBondContact N-O 3.11Å; S362-Q373 WeakPolarHBondContact O-CB 3.49Å; S362-Q373 PolarHBondContact O-N 3.32Å; W364-Q373 HydrophobicContact CZ3-CB 4.09Å
374	N	96.1	Very high	92.9	Very high	15 Å²	15	40.5 Å²	40.5	8%	0.08	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	166.3	179.3	-71.3	-15.2	0	0	0	111.4	A324 V358 R359 Y360	A324-N374 PolarHBondContact N-O 2.93Å; A324-N374 PolarHBondContact O-N 2.74Å; V358-N374 HydrophobicContact CG1-CB 3.83Å; R359-N374 CarbonylContact O-C 3.57Å; R359-N374 WeakPolarHBondContact O-CA 3.22Å; Y360-N374 WeakPolarHBondContact CA-OD1 3.43Å
375	E	95.6	Very high	93.2	Very high	41 Å²	41	39.9 Å²	39.9	19%	0.192	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.2	141.7	173.9	72.7	-174.1	138.3	0	0	111.6	V358 R359 F361 C377 K458	V358-E375 VanDerWaalsContact CA-OE1 3.32Å; V358-E375 WeakPolarHBondContact CA-OE1 3.44Å; V358-E375 HydrophobicContact CG1-CG 4.15Å; R359-E375 HydrophobicContact CB-CB 4.29Å; R359-E375 HydrophobicContact CB-CG 4.24Å; R359-E375 PolarHBondContact N-OE1 3.14Å; R359-E375 PolarHBondContact O-N 2.76Å; F361-E375 HydrophobicContact CE2-CB 3.96Å; E375-C377 PolarHBondContact O-N 3.26Å; E375-K458 WeakPolarHBondContact OE1-CD 3.31Å; E375-K458 WeakPolarHBondContact OE1-CE 3.29Å; E375-K458 IonicContact OE1-NZ 2.7Å; E375-K458 PolarHBondContact OE1-NZ 2.8Å; E375-K458 WeakPolarHBondContact OE2-CE 3.4Å; E375-K458 IonicContact OE2-NZ 3.38Å; E375-K458 PolarHBondContact OE2-NZ 2.88Å
376	Y	97.3	Very high	93.6	Very high	54 Å²	54	37.7 Å²	37.7	21%	0.212	21%	0.21	C	C	.	.			trans	-82.6	113.9	174.5	176.9	-110.9	0	0	0	111.4	I303 K313 I322 N378	I303-Y376 HydrophobicContact CD1-CD2 4.16Å; I303-Y376 HydrophobicContact CD1-CE2 4.03Å; K313-Y376 HydrophobicContact CB-CD2 4.35Å; K313-Y376 HydrophobicContact CB-CE2 4.14Å; K313-Y376 HydrophobicContact CD-CD2 4.43Å; K313-Y376 HydrophobicContact CD-CE1 4.18Å; K313-Y376 HydrophobicContact CD-CE2 3.78Å; K313-Y376 VanDerWaalsContact CE-CZ 3.45Å; K313-Y376 WeakPolarHBondContact CE-OH 3.42Å; K313-Y376 HydrophobicContact CG-CD2 3.91Å; K313-Y376 HydrophobicContact CG-CE1 4.45Å; K313-Y376 HydrophobicContact CG-CE2 3.73Å; K313-Y376 HydrophobicContact CG-CG 4.36Å; K313-Y376 PolarHBondContact NZ-OH 2.86Å; K313-Y376 VanDerWaalsContact NZ-OH 3.14Å; I322-Y376 HydrophobicContact CB-CD1 4.2Å; I322-Y376 HydrophobicContact CB-CG 4.44Å; I322-Y376 HydrophobicContact CG2-CD1 3.6Å; I322-Y376 HydrophobicContact CG2-CD2 4.39Å; I322-Y376 HydrophobicContact CG2-CE1 4.27Å; I322-Y376 HydrophobicContact CG2-CG 3.66Å; I322-Y376 WeakPolarHBondContact O-CB 3.31Å; Y376-N378 HydrophobicContact CD1-CB 4.28Å; Y376-N378 HydrophobicContact CE1-CB 3.82Å; Y376-N378 PolarHBondContact O-N 3.49Å
377	C	96.8	Very high	94	Very high	10 Å²	10	40.1 Å²	40.1	7%	0.068	23%	0.23	C	C	.	.			trans	-85.9	101.1	172.6	-70	0	0	0	0	110.5	E375 G379 G380 F431 I432	E375-C377 PolarHBondContact O-N 3.26Å; C377-G379 PolarHBondContact O-N 3.49Å; C377-G379 VanDerWaalsContact O-N 3.15Å; C377-G380 PolarHBondContact O-N 2.95Å; C377-F431 HydrophobicContact CB-CB 3.66Å; C377-F431 HydrophobicContact CB-CG 4.48Å; C377-I432 CarbonylContact C-O 3.58Å; C377-I432 WeakPolarHBondContact CB-O 3.45Å
378	N	95	Very high	94.5	Very high	86 Å²	86	38 Å²	38	46%	0.46	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-11.2	-173.7	65.9	-25.9	0	0	0	116	Y376 S433 R434	Y376-N378 HydrophobicContact CD1-CB 4.28Å; Y376-N378 HydrophobicContact CE1-CB 3.82Å; Y376-N378 PolarHBondContact O-N 3.49Å; N378-S433 WeakPolarHBondContact OD1-CA 3.25Å; N378-R434 PolarHBondContact ND2-O 3.21Å; N378-R434 PolarHBondContact OD1-N 2.82Å
379	G	94.8	Very high	95.2	Very high	17 Å²	17	34 Å²	34	18%	0.175	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.1	3.5	177	0	0	0	0	0	115.1	C377 I432	C377-G379 PolarHBondContact O-N 3.49Å; C377-G379 VanDerWaalsContact O-N 3.15Å; G379-I432 WeakPolarHBondContact CA-O 3.49Å; G379-I432 PolarHBondContact N-O 3.18Å
380	G	95.9	Very high	95.6	Very high	26 Å²	26	39.2 Å²	39.2	27%	0.268	21%	0.213	S	C	.	.			trans	76.9	-159.7	-176.7	0	0	0	0	0	113.4	C377 F431 I432	C377-G380 PolarHBondContact O-N 2.95Å; G380-F431 WeakPolarHBondContact O-CA 3.4Å; G380-I432 PolarHBondContact O-N 2.92Å
381	S	97.6	Very high	95.9	Very high	10 Å²	10	45.7 Å²	45.7	7%	0.07	24%	0.236	C	C	.	.	B	Isolated β-bridge	trans	-90.8	162.1	169.2	75	0	0	0	0	111.7	A383 D384 A385 I430	S381-A383 PolarHBondContact O-N 2.97Å; S381-A383 PolarHBondContact OG-N 2.86Å; S381-D384 WeakPolarHBondContact CA-OD2 3.3Å; S381-D384 VanDerWaalsContact CB-OD2 3.31Å; S381-D384 WeakPolarHBondContact CB-OD2 3.49Å; S381-D384 PolarHBondContact N-OD2 3.41Å; S381-D384 PolarHBondContact O-N 2.82Å; S381-D384 PolarHBondContact OG-N 3.47Å; S381-D384 PolarHBondContact OG-OD2 3.41Å; S381-A385 PolarHBondContact O-N 3.26Å; S381-I430 CarbonylContact C-O 3.49Å; S381-I430 WeakPolarHBondContact CA-O 3.32Å
382	L	98.3	Very high	96.1	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-63	-29.3	170.8	178.3	66.4	0	0	0	111.4	D384 A385 I386 F396 L404 P427 I430 F457 T504	L382-D384 VanDerWaalsContact C-N 3.34Å; L382-D384 PolarHBondContact O-N 3.42Å; L382-A385 PolarHBondContact O-N 3.27Å; L382-I386 HydrophobicContact CD1-CD1 4.24Å; L382-I386 HydrophobicContact CD1-CG1 4.21Å; L382-I386 HydrophobicContact CD2-CD1 4.41Å; L382-I386 HydrophobicContact CG-CD1 3.85Å; L382-I386 HydrophobicContact CG-CG1 4.27Å; L382-I386 WeakPolarHBondContact O-CB 3.28Å; L382-I386 WeakPolarHBondContact O-CG1 3.46Å; L382-I386 PolarHBondContact O-N 3.04Å; L382-F396 HydrophobicContact CD1-CE2 3.69Å; L382-F396 HydrophobicContact CD1-CZ 3.77Å; L382-L404 HydrophobicContact CD1-CD2 4.32Å; L382-L404 HydrophobicContact CD2-CD1 3.84Å; L382-L404 HydrophobicContact CD2-CD2 3.8Å; L382-L404 HydrophobicContact CD2-CG 4.48Å; L382-P427 CarbonylContact C-O 3.47Å; L382-P427 HydrophobicContact CB-CB 4.3Å; L382-P427 WeakPolarHBondContact CB-O 3.46Å; L382-P427 HydrophobicContact CD2-CB 4.32Å; L382-P427 HydrophobicContact CG-CB 4.18Å; L382-P427 PolarHBondContact N-O 3.37Å; L382-I430 HydrophobicContact CB-CB 4.18Å; L382-I430 HydrophobicContact CB-CG2 4.26Å; L382-I430 HydrophobicContact CD2-CB 4.47Å; L382-I430 HydrophobicContact CD2-CD1 4.26Å; L382-I430 HydrophobicContact CD2-CG2 4.44Å; L382-I430 PolarHBondContact N-O 2.91Å; L382-F457 HydrophobicContact CD1-CE1 4.36Å; L382-T504 HydrophobicContact CD2-CG2 3.87Å
383	A	97.8	Very high	96	Very high	28 Å²	28	56.6 Å²	56.6	23%	0.231	29%	0.294	C	S	.	.	H	α-helix	trans	-62.7	-38.9	172.9	0	0	0	0	0	112.4	S381 S387 P427	S381-A383 PolarHBondContact O-N 2.97Å; S381-A383 PolarHBondContact OG-N 2.86Å; A383-S387 WeakPolarHBondContact O-CB 3.39Å; A383-S387 PolarHBondContact O-N 3.2Å; A383-S387 PolarHBondContact O-OG 3.3Å; A383-P427 HydrophobicContact CB-CB 3.94Å; A383-P427 PolarHBondContact N-O 3.45Å
384	D	96.7	Very high	95.9	Very high	93 Å²	93	59.1 Å²	59.1	50%	0.497	31%	0.312	S	S	.	.	H	α-helix	trans	-66.6	-45.3	176.9	-52.8	-55.3	0	0	0	110.4	S381 L382 S387 E388	S381-D384 WeakPolarHBondContact CA-OD2 3.3Å; S381-D384 VanDerWaalsContact CB-OD2 3.31Å; S381-D384 WeakPolarHBondContact CB-OD2 3.49Å; S381-D384 PolarHBondContact N-OD2 3.41Å; S381-D384 PolarHBondContact O-N 2.82Å; S381-D384 PolarHBondContact OG-N 3.47Å; S381-D384 PolarHBondContact OG-OD2 3.41Å; L382-D384 VanDerWaalsContact C-N 3.34Å; L382-D384 PolarHBondContact O-N 3.42Å; D384-S387 PolarHBondContact O-N 2.86Å; D384-E388 PolarHBondContact O-N 3.01Å
385	A	97.2	Very high	95.9	Very high	13 Å²	13	63 Å²	63	11%	0.107	33%	0.326	C	S	.	.	H	α-helix	trans	-64.4	-40.1	177.8	0	0	0	0	0	113	S381 L382 S387 E388 N389 F396 I432	S381-A385 PolarHBondContact O-N 3.26Å; L382-A385 PolarHBondContact O-N 3.27Å; A385-S387 VanDerWaalsContact C-N 3.33Å; A385-E388 PolarHBondContact O-N 3.03Å; A385-N389 WeakPolarHBondContact O-CB 3.48Å; A385-N389 VanDerWaalsContact O-CG 3.31Å; A385-N389 PolarHBondContact O-N 3.24Å; A385-F396 HydrophobicContact CB-CE2 4.3Å; A385-F396 HydrophobicContact CB-CZ 3.87Å; A385-I432 HydrophobicContact CB-CD1 3.77Å
386	I	97.7	Very high	95.9	Very high	31 Å²	31	62 Å²	62	16%	0.159	32%	0.321	C	S	.	.	H	α-helix	trans	-63.9	-40.1	172.9	-69.5	171.1	0	0	0	110.8	L382 N389 Y390 F396 P427 C507 A508	L382-I386 HydrophobicContact CD1-CD1 4.24Å; L382-I386 HydrophobicContact CD1-CG1 4.21Å; L382-I386 HydrophobicContact CD2-CD1 4.41Å; L382-I386 HydrophobicContact CG-CD1 3.85Å; L382-I386 HydrophobicContact CG-CG1 4.27Å; L382-I386 WeakPolarHBondContact O-CB 3.28Å; L382-I386 WeakPolarHBondContact O-CG1 3.46Å; L382-I386 PolarHBondContact O-N 3.04Å; I386-N389 PolarHBondContact O-N 3.37Å; I386-Y390 WeakPolarHBondContact O-CB 3.38Å; I386-Y390 PolarHBondContact O-N 3.1Å; I386-F396 HydrophobicContact CG1-CD2 4.43Å; I386-F396 HydrophobicContact CG1-CE2 3.96Å; I386-P427 HydrophobicContact CD1-CB 3.99Å; I386-P427 HydrophobicContact CD1-CG 4.03Å; I386-C507 HydrophobicContact CD1-CB 4.05Å; I386-A508 HydrophobicContact CD1-CB 4Å; I386-A508 HydrophobicContact CG1-CB 4.36Å
387	S	96.8	Very high	95.9	Very high	77 Å²	77	62.7 Å²	62.7	54%	0.538	33%	0.331	S	S	.	.	H	α-helix	trans	-66.5	-39.7	179.5	-58.2	0	0	0	0	112	A383 D384 A385 Y390 R391	A383-S387 WeakPolarHBondContact O-CB 3.39Å; A383-S387 PolarHBondContact O-N 3.2Å; A383-S387 PolarHBondContact O-OG 3.3Å; D384-S387 PolarHBondContact O-N 2.86Å; A385-S387 VanDerWaalsContact C-N 3.33Å; S387-Y390 PolarHBondContact O-N 2.78Å; S387-R391 WeakPolarHBondContact O-CB 3.4Å; S387-R391 PolarHBondContact O-N 3.01Å
388	E	96.1	Very high	95.8	Very high	89 Å²	89	64.1 Å²	64.1	42%	0.416	34%	0.337	S	S	.	.	H	α-helix	trans	-70.1	-39	174.9	179.1	59.6	-170.6	0	0	112.3	D384 A385 R391 T392	D384-E388 PolarHBondContact O-N 3.01Å; A385-E388 PolarHBondContact O-N 3.03Å; E388-R391 PolarHBondContact O-N 3.49Å; E388-R391 IonicContact OE1-CZ 3.47Å; E388-R391 IonicContact OE1-NE 3.46Å; E388-R391 PolarHBondContact OE1-NE 2.72Å; E388-R391 IonicContact OE1-NH2 3.6Å; E388-R391 PolarHBondContact OE1-NH2 3.46Å; E388-R391 IonicContact OE2-CZ 2.73Å; E388-R391 IonicContact OE2-NE 3.53Å; E388-R391 PolarHBondContact OE2-NE 2.71Å; E388-R391 IonicContact OE2-NH2 2.68Å; E388-T392 WeakPolarHBondContact O-CB 3.49Å; E388-T392 WeakPolarHBondContact O-CG2 3.32Å; E388-T392 PolarHBondContact O-N 3.38Å; E388-T392 PolarHBondContact O-OG1 2.93Å
389	N	95.3	Very high	95.7	Very high	35 Å²	35	64.6 Å²	64.6	19%	0.187	34%	0.343	C	S	.	.	H	α-helix	trans	-59.1	-48	171.1	-80.3	-2.1	0	0	0	110.7	A385 I386 R391 T392 M393 S394 F396	A385-N389 WeakPolarHBondContact O-CB 3.48Å; A385-N389 VanDerWaalsContact O-CG 3.31Å; A385-N389 PolarHBondContact O-N 3.24Å; I386-N389 PolarHBondContact O-N 3.37Å; N389-R391 VanDerWaalsContact C-N 3.33Å; N389-R391 PolarHBondContact O-N 3.29Å; N389-T392 WeakPolarHBondContact CA-OG1 3.42Å; N389-T392 CarbonylContact O-C 3.51Å; N389-T392 PolarHBondContact O-N 3.48Å; N389-T392 PolarHBondContact O-OG1 2.77Å; N389-M393 PolarHBondContact O-N 2.94Å; N389-S394 CarbonylContact C-O 3.49Å; N389-S394 VanDerWaalsContact C-O 3.28Å; N389-S394 WeakPolarHBondContact CB-O 3.3Å; N389-S394 PolarHBondContact O-N 3.39Å; N389-S394 VanDerWaalsContact O-O 3.11Å; N389-F396 WeakPolarHBondContact ND2-CD2 3.18Å; N389-F396 WeakPolarHBondContact ND2-CE2 3.28Å
390	Y	93.2	Very high	95.7	Very high	158 Å²	158	67.8 Å²	67.8	62%	0.62	35%	0.353	S	S	*	.	H	α-helix	trans	-60.5	-40.3	175.9	-162.1	-84.6	0	0	0	112.2	I386 S387 T392 M393	I386-Y390 WeakPolarHBondContact O-CB 3.38Å; I386-Y390 PolarHBondContact O-N 3.1Å; S387-Y390 PolarHBondContact O-N 2.78Å; Y390-T392 VanDerWaalsContact C-N 3.27Å; Y390-T392 PolarHBondContact O-N 3.16Å; Y390-M393 PolarHBondContact O-N 3.41Å
391	R	94.8	Very high	95.8	Very high	166 Å²	166	66.6 Å²	66.6	63%	0.626	34%	0.34	S	S	*	.	H	α-helix	trans	-64.8	-28.4	175.2	-165	-160.7	64.7	71.1	-3.9	113.2	S387 E388 N389	S387-R391 WeakPolarHBondContact O-CB 3.4Å; S387-R391 PolarHBondContact O-N 3.01Å; E388-R391 PolarHBondContact O-N 3.49Å; E388-R391 IonicContact OE1-CZ 3.47Å; E388-R391 IonicContact OE1-NE 3.46Å; E388-R391 PolarHBondContact OE1-NE 2.72Å; E388-R391 IonicContact OE1-NH2 3.6Å; E388-R391 PolarHBondContact OE1-NH2 3.46Å; E388-R391 IonicContact OE2-CZ 2.73Å; E388-R391 IonicContact OE2-NE 3.53Å; E388-R391 PolarHBondContact OE2-NE 2.71Å; E388-R391 IonicContact OE2-NH2 2.68Å; N389-R391 VanDerWaalsContact C-N 3.33Å; N389-R391 PolarHBondContact O-N 3.29Å
392	T	95.4	Very high	95.8	Very high	65 Å²	65	67 Å²	67	40%	0.399	34%	0.341	S	S	.	.	H	α-helix	trans	-97.9	3.6	-179	51.5	0	0	0	0	113.6	E388 N389 Y390 S394	E388-T392 WeakPolarHBondContact O-CB 3.49Å; E388-T392 WeakPolarHBondContact O-CG2 3.32Å; E388-T392 PolarHBondContact O-N 3.38Å; E388-T392 PolarHBondContact O-OG1 2.93Å; N389-T392 WeakPolarHBondContact CA-OG1 3.42Å; N389-T392 CarbonylContact O-C 3.51Å; N389-T392 PolarHBondContact O-N 3.48Å; N389-T392 PolarHBondContact O-OG1 2.77Å; Y390-T392 VanDerWaalsContact C-N 3.27Å; Y390-T392 PolarHBondContact O-N 3.16Å; T392-S394 PolarHBondContact O-N 3.3Å
393	M	92.1	Very high	95.6	Very high	170 Å²	170	69.7 Å²	69.7	84%	0.837	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.9	32.9	-172.1	-59.3	-62.7	-62.7	0	0	113.2	N389 Y390	N389-M393 PolarHBondContact O-N 2.94Å; Y390-M393 PolarHBondContact O-N 3.41Å
394	S	94.2	Very high	95.6	Very high	58 Å²	58	68.4 Å²	68.4	41%	0.406	34%	0.344	S	S	.	.			trans	-111.7	171.5	176.5	-168.6	0	0	0	0	111	N389 T392	N389-S394 CarbonylContact C-O 3.49Å; N389-S394 VanDerWaalsContact C-O 3.28Å; N389-S394 WeakPolarHBondContact CB-O 3.3Å; N389-S394 PolarHBondContact O-N 3.39Å; N389-S394 VanDerWaalsContact O-O 3.11Å; T392-S394 PolarHBondContact O-N 3.3Å
395	Y	94.4	Very high	95.7	Very high	97 Å²	97	64 Å²	64	38%	0.38	32%	0.321	S	S	.	.			trans	-155.2	161.6	173.9	38.1	-106.8	0	0	0	109.6	T397 P533 Q534	Y395-T397 PolarHBondContact O-N 3.49Å; Y395-P533 HydrophobicContact CD1-CG 4.42Å; Y395-Q534 HydrophobicContact CD2-CB 4.1Å; Y395-Q534 VanDerWaalsContact CD2-CD 3.46Å; Y395-Q534 HydrophobicContact CD2-CG 4.23Å; Y395-Q534 HydrophobicContact CE1-CB 4.35Å; Y395-Q534 HydrophobicContact CE2-CB 3.52Å; Y395-Q534 HydrophobicContact CE2-CG 4.12Å
396	F	96.8	Very high	95.8	Very high	18 Å²	18	63.6 Å²	63.6	8%	0.079	32%	0.317	C	S	.	.			trans	-66.4	133	174.5	-71.9	-85	0	0	0	110	L382 A385 I386 N389 E400 L401 A508 Q534	L382-F396 HydrophobicContact CD1-CE2 3.69Å; L382-F396 HydrophobicContact CD1-CZ 3.77Å; A385-F396 HydrophobicContact CB-CE2 4.3Å; A385-F396 HydrophobicContact CB-CZ 3.87Å; I386-F396 HydrophobicContact CG1-CD2 4.43Å; I386-F396 HydrophobicContact CG1-CE2 3.96Å; N389-F396 WeakPolarHBondContact ND2-CD2 3.18Å; N389-F396 WeakPolarHBondContact ND2-CE2 3.28Å; F396-E400 HydrophobicContact CB-CB 4.21Å; F396-E400 HydrophobicContact CD1-CB 3.91Å; F396-L401 HydrophobicContact CB-CD2 3.79Å; F396-L401 HydrophobicContact CB-CG 4.06Å; F396-A508 HydrophobicContact CD2-CB 3.83Å; F396-A508 WeakPolarHBondContact CD2-O 3.36Å; F396-A508 HydrophobicContact CE2-CB 4.44Å; F396-A508 HydrophobicContact CG-CB 4.46Å; F396-A508 PolarHBondContact N-O 3.04Å; F396-Q534 PolarHBondContact O-NE2 3.38Å; F396-Q534 PolarHBondContact O-OE1 3.1Å
397	T	96.1	Very high	95.8	Very high	69 Å²	69	62.4 Å²	62.4	42%	0.423	31%	0.311	S	S	.	.			trans	-71.2	161.5	177.8	63.2	0	0	0	0	111.7	Y395 V399 E400 L401	Y395-T397 PolarHBondContact O-N 3.49Å; T397-V399 PolarHBondContact O-N 3Å; T397-V399 VanDerWaalsContact O-N 3.07Å; T397-E400 WeakPolarHBondContact CB-OE2 3.4Å; T397-E400 WeakPolarHBondContact CG2-OE2 3.49Å; T397-E400 PolarHBondContact N-OE2 3.41Å; T397-E400 PolarHBondContact O-N 3.02Å; T397-E400 WeakPolarHBondContact OG1-CG 3.45Å; T397-E400 PolarHBondContact OG1-OE2 2.87Å; T397-L401 VanDerWaalsContact O-CG 3.3Å; T397-L401 WeakPolarHBondContact O-CG 3.28Å; T397-L401 PolarHBondContact O-N 2.94Å
398	E	95.5	Very high	95.9	Very high	41 Å²	41	58.8 Å²	58.8	19%	0.192	29%	0.285	C	S	.	.	H	α-helix	trans	-52.4	-34.2	177.5	177.7	164.8	158.3	0	0	113.7	K402 L536 S537 L540	E398-K402 HydrophobicContact CG-CD 4.05Å; E398-K402 HydrophobicContact CG-CG 4.49Å; E398-K402 WeakPolarHBondContact O-CB 3.48Å; E398-K402 WeakPolarHBondContact O-CG 3.49Å; E398-K402 PolarHBondContact O-N 2.88Å; E398-K402 WeakPolarHBondContact OE1-CE 3.4Å; E398-K402 IonicContact OE1-NZ 2.65Å; E398-K402 PolarHBondContact OE1-NZ 3.37Å; E398-L536 HydrophobicContact CB-CD2 3.99Å; E398-L536 HydrophobicContact CG-CD2 4.49Å; E398-L536 WeakPolarHBondContact OE2-CA 3.07Å; E398-S537 VanDerWaalsContact OE1-CB 3.26Å; E398-S537 WeakPolarHBondContact OE1-CB 3.45Å; E398-S537 PolarHBondContact OE1-OG 3.34Å; E398-S537 PolarHBondContact OE2-N 3.4Å; E398-S537 PolarHBondContact OE2-OG 3.49Å; E398-L540 HydrophobicContact CG-CD2 3.81Å
399	V	93.4	Very high	96	Very high	96 Å²	96	54.5 Å²	54.5	58%	0.582	27%	0.265	S	S	*	.	H	α-helix	trans	-67.7	-44.6	178.1	-178.5	0	0	0	0	111	T397 K402 D403	T397-V399 PolarHBondContact O-N 3Å; T397-V399 VanDerWaalsContact O-N 3.07Å; V399-K402 PolarHBondContact O-N 2.92Å; V399-D403 PolarHBondContact O-N 2.99Å
400	E	95.4	Very high	96.2	Very high	84 Å²	84	56.7 Å²	56.7	39%	0.393	27%	0.271	S	S	.	.	H	α-helix	trans	-70.2	-36.6	177.6	-63.4	164.5	105.8	0	0	111.9	F396 T397 K402 D403 L404	F396-E400 HydrophobicContact CB-CB 4.21Å; F396-E400 HydrophobicContact CD1-CB 3.91Å; T397-E400 WeakPolarHBondContact CB-OE2 3.4Å; T397-E400 WeakPolarHBondContact CG2-OE2 3.49Å; T397-E400 PolarHBondContact N-OE2 3.41Å; T397-E400 PolarHBondContact O-N 3.02Å; T397-E400 WeakPolarHBondContact OG1-CG 3.45Å; T397-E400 PolarHBondContact OG1-OE2 2.87Å; E400-K402 VanDerWaalsContact C-N 3.32Å; E400-K402 PolarHBondContact O-N 3.49Å; E400-D403 PolarHBondContact O-N 3.24Å; E400-L404 VanDerWaalsContact O-CB 3.26Å; E400-L404 WeakPolarHBondContact O-CB 3.19Å; E400-L404 PolarHBondContact O-N 3.02Å
401	L	97.6	Very high	96.4	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-62.5	-39.5	173.8	-66.8	172.6	0	0	0	111.6	F396 T397 L405 V505 A508 A509 L536 L540	F396-L401 HydrophobicContact CB-CD2 3.79Å; F396-L401 HydrophobicContact CB-CG 4.06Å; T397-L401 VanDerWaalsContact O-CG 3.3Å; T397-L401 WeakPolarHBondContact O-CG 3.28Å; T397-L401 PolarHBondContact O-N 2.94Å; L401-L405 WeakPolarHBondContact O-CB 3.39Å; L401-L405 PolarHBondContact O-N 3.22Å; L401-V505 HydrophobicContact CB-CG1 4.17Å; L401-V505 HydrophobicContact CD2-CG1 3.98Å; L401-A508 HydrophobicContact CD2-CB 3.59Å; L401-A509 HydrophobicContact CD1-CB 3.65Å; L401-A509 HydrophobicContact CD2-CB 4.09Å; L401-L536 HydrophobicContact CD1-CD1 4.3Å; L401-L536 HydrophobicContact CD1-CD2 3.81Å; L401-L540 HydrophobicContact CB-CD2 4.49Å
402	K	96.9	Very high	96.6	Very high	20 Å²	20	41.3 Å²	41.3	9%	0.087	21%	0.211	C	C	.	.	H	α-helix	trans	-67.1	-42.9	174.4	-75.9	170.1	179.4	-173.9	0	112.3	E398 V399 E400 L405 L406 L540 V566 L567	E398-K402 HydrophobicContact CG-CD 4.05Å; E398-K402 HydrophobicContact CG-CG 4.49Å; E398-K402 WeakPolarHBondContact O-CB 3.48Å; E398-K402 WeakPolarHBondContact O-CG 3.49Å; E398-K402 PolarHBondContact O-N 2.88Å; E398-K402 WeakPolarHBondContact OE1-CE 3.4Å; E398-K402 IonicContact OE1-NZ 2.65Å; E398-K402 PolarHBondContact OE1-NZ 3.37Å; V399-K402 PolarHBondContact O-N 2.92Å; E400-K402 VanDerWaalsContact C-N 3.32Å; E400-K402 PolarHBondContact O-N 3.49Å; K402-L405 PolarHBondContact O-N 2.86Å; K402-L406 WeakPolarHBondContact O-CB 3.45Å; K402-L406 PolarHBondContact O-N 3.08Å; K402-L540 HydrophobicContact CG-CD1 4.39Å; K402-L540 HydrophobicContact CG-CD2 4.25Å; K402-V566 VanDerWaalsContact CD-O 3.27Å; K402-V566 WeakPolarHBondContact CD-O 3.28Å; K402-V566 VanDerWaalsContact CE-O 3.31Å; K402-V566 WeakPolarHBondContact CE-O 3.26Å; K402-V566 PolarHBondContact NZ-O 2.97Å; K402-L567 HydrophobicContact CB-CD2 4.23Å; K402-L567 HydrophobicContact CG-CD2 4.06Å
403	D	95.2	Very high	96.7	Very high	56 Å²	56	42.3 Å²	42.3	30%	0.299	21%	0.208	S	C	.	.	H	α-helix	trans	-65.6	-47.5	176.7	-177.2	55.4	0	0	0	111.4	V399 E400 L405 L406 Q407	V399-D403 PolarHBondContact O-N 2.99Å; E400-D403 PolarHBondContact O-N 3.24Å; D403-L405 VanDerWaalsContact C-N 3.35Å; D403-L405 PolarHBondContact O-N 3.4Å; D403-L406 PolarHBondContact O-N 3.48Å; D403-Q407 VanDerWaalsContact CG-NE2 3.33Å; D403-Q407 WeakPolarHBondContact O-CB 3.41Å; D403-Q407 VanDerWaalsContact O-CG 3.29Å; D403-Q407 WeakPolarHBondContact O-CG 3.39Å; D403-Q407 PolarHBondContact O-N 3.32Å; D403-Q407 PolarHBondContact OD1-NE2 2.78Å; D403-Q407 PolarHBondContact OD2-NE2 2.93Å
404	L	97.9	Very high	97	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-50.9	-52.4	171.7	169.8	63.6	0	0	0	111.7	L382 E400 L406 Q407 V408 I430 F457 V505 A508	L382-L404 HydrophobicContact CD1-CD2 4.32Å; L382-L404 HydrophobicContact CD2-CD1 3.84Å; L382-L404 HydrophobicContact CD2-CD2 3.8Å; L382-L404 HydrophobicContact CD2-CG 4.48Å; E400-L404 VanDerWaalsContact O-CB 3.26Å; E400-L404 WeakPolarHBondContact O-CB 3.19Å; E400-L404 PolarHBondContact O-N 3.02Å; L404-L406 VanDerWaalsContact C-N 3.35Å; L404-L406 PolarHBondContact O-N 2.75Å; L404-Q407 PolarHBondContact O-N 3.28Å; L404-V408 HydrophobicContact CD1-CG2 3.79Å; L404-V408 WeakPolarHBondContact O-CB 3.45Å; L404-V408 VanDerWaalsContact O-CG2 3.32Å; L404-V408 WeakPolarHBondContact O-CG2 3.32Å; L404-V408 PolarHBondContact O-N 2.95Å; L404-I430 HydrophobicContact CD1-CG2 4.39Å; L404-F457 HydrophobicContact CB-CD2 4.29Å; L404-F457 HydrophobicContact CB-CE2 3.99Å; L404-F457 HydrophobicContact CB-CZ 4.18Å; L404-F457 HydrophobicContact CD1-CB 4.34Å; L404-F457 HydrophobicContact CD1-CD1 3.64Å; L404-F457 HydrophobicContact CD1-CD2 4.15Å; L404-F457 HydrophobicContact CD1-CE1 3.88Å; L404-F457 HydrophobicContact CD1-CE2 4.36Å; L404-F457 HydrophobicContact CD1-CG 3.77Å; L404-F457 HydrophobicContact CD1-CZ 4.23Å; L404-V505 HydrophobicContact CD2-CG2 4.12Å; L404-V505 HydrophobicContact CG-CG2 4.28Å; L404-A508 HydrophobicContact CD2-CB 3.7Å
405	L	98.5	Very high	97.2	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-62.6	-39.6	-179.8	-179.8	49.5	0	0	0	112.1	L401 K402 D403 G409 L501 V505 L540 L543 L544 M547 L561 L567	L401-L405 WeakPolarHBondContact O-CB 3.39Å; L401-L405 PolarHBondContact O-N 3.22Å; K402-L405 PolarHBondContact O-N 2.86Å; D403-L405 VanDerWaalsContact C-N 3.35Å; D403-L405 PolarHBondContact O-N 3.4Å; L405-G409 WeakPolarHBondContact O-CA 3.33Å; L405-G409 PolarHBondContact O-N 3.37Å; L405-L501 HydrophobicContact CD1-CD1 4.48Å; L405-L501 HydrophobicContact CD1-CD2 3.85Å; L405-L501 HydrophobicContact CD1-CG 3.88Å; L405-V505 HydrophobicContact CB-CG2 4.01Å; L405-V505 HydrophobicContact CD1-CG2 4.19Å; L405-L540 HydrophobicContact CD2-CD1 4.03Å; L405-L543 HydrophobicContact CD2-CD2 4.18Å; L405-L544 HydrophobicContact CD2-CD2 4.21Å; L405-M547 HydrophobicContact CD1-CE 3.68Å; L405-M547 HydrophobicContact CD1-SD 4.04Å; L405-M547 HydrophobicContact CD2-SD 4.4Å; L405-L561 HydrophobicContact CD1-CD1 4.18Å; L405-L561 HydrophobicContact CD1-CD2 3.94Å; L405-L561 HydrophobicContact CD1-CG 4.47Å; L405-L561 HydrophobicContact CG-CD1 4.41Å; L405-L567 HydrophobicContact CB-CD2 4.34Å; L405-L567 HydrophobicContact CD2-CD1 4.38Å; L405-L567 HydrophobicContact CD2-CD2 3.82Å; L405-L567 HydrophobicContact CG-CD1 3.96Å; L405-L567 HydrophobicContact CG-CD2 4.05Å
406	L	97.8	Very high	97.4	Very high	5 Å²	5	30.3 Å²	30.3	3%	0.026	15%	0.145	C	C	.	.	H	α-helix	trans	-71.3	-44.6	178	-178.3	58.1	0	0	0	112.5	K402 D403 L404 R410 V562 L567	K402-L406 WeakPolarHBondContact O-CB 3.45Å; K402-L406 PolarHBondContact O-N 3.08Å; D403-L406 PolarHBondContact O-N 3.48Å; L404-L406 VanDerWaalsContact C-N 3.35Å; L404-L406 PolarHBondContact O-N 2.75Å; L406-R410 VanDerWaalsContact O-CG 3.24Å; L406-R410 WeakPolarHBondContact O-CG 3.26Å; L406-R410 PolarHBondContact O-N 2.84Å; L406-V562 HydrophobicContact CD1-CB 3.93Å; L406-V562 HydrophobicContact CD1-CG1 4.26Å; L406-L567 HydrophobicContact CB-CB 4.38Å; L406-L567 HydrophobicContact CB-CD1 4.38Å; L406-L567 HydrophobicContact CD1-CB 4.29Å; L406-L567 HydrophobicContact CD1-CD1 4.44Å
407	Q	98	Very high	97.4	Very high	7 Å²	7	33.3 Å²	33.3	3%	0.033	17%	0.168	C	C	.	.	H	α-helix	trans	-65.6	-50.6	179.2	-71.9	-155.9	39.2	0	0	111.4	H356 D403 L404 G409 R410 G411 V455 M456 F457	H356-Q407 WeakPolarHBondContact CB-O 3.42Å; H356-Q407 VanDerWaalsContact CE1-CG 3.48Å; H356-Q407 WeakPolarHBondContact CE1-CG 3.32Å; H356-Q407 PolarHBondContact CE1-OE1 2.86Å; H356-Q407 VanDerWaalsContact CG-O 3.25Å; H356-Q407 PolarHBondContact ND1-OE1 3.13Å; D403-Q407 VanDerWaalsContact CG-NE2 3.33Å; D403-Q407 WeakPolarHBondContact O-CB 3.41Å; D403-Q407 VanDerWaalsContact O-CG 3.29Å; D403-Q407 WeakPolarHBondContact O-CG 3.39Å; D403-Q407 PolarHBondContact O-N 3.32Å; D403-Q407 PolarHBondContact OD1-NE2 2.78Å; D403-Q407 PolarHBondContact OD2-NE2 2.93Å; L404-Q407 PolarHBondContact O-N 3.28Å; Q407-G409 VanDerWaalsContact C-N 3.34Å; Q407-G409 PolarHBondContact O-N 2.99Å; Q407-R410 WeakPolarHBondContact O-CB 3.29Å; Q407-R410 PolarHBondContact O-N 3.34Å; Q407-R410 VanDerWaalsContact O-N 3.17Å; Q407-G411 PolarHBondContact O-N 3.39Å; Q407-G411 VanDerWaalsContact O-N 3.11Å; Q407-V455 PolarHBondContact NE2-O 2.89Å; Q407-M456 VanDerWaalsContact OE1-CA 3.31Å; Q407-F457 HydrophobicContact CB-CB 4.11Å; Q407-F457 HydrophobicContact CB-CD2 4.17Å; Q407-F457 HydrophobicContact CG-CD2 4.32Å
408	V	98.8	Very high	97.4	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-69.2	-35.3	178.5	-178.2	0	0	0	0	110.8	L404 R410 G411 L412 I430 F457 I459 L501	L404-V408 HydrophobicContact CD1-CG2 3.79Å; L404-V408 WeakPolarHBondContact O-CB 3.45Å; L404-V408 VanDerWaalsContact O-CG2 3.32Å; L404-V408 WeakPolarHBondContact O-CG2 3.32Å; L404-V408 PolarHBondContact O-N 2.95Å; V408-R410 VanDerWaalsContact C-N 3.31Å; V408-R410 PolarHBondContact O-N 3.03Å; V408-G411 WeakPolarHBondContact O-CA 3.26Å; V408-G411 PolarHBondContact O-N 3.01Å; V408-L412 PolarHBondContact O-N 3.49Å; V408-I430 HydrophobicContact CG1-CD1 4.06Å; V408-I430 HydrophobicContact CG1-CG1 4.46Å; V408-I430 HydrophobicContact CG2-CD1 4.05Å; V408-I430 HydrophobicContact CG2-CG1 4.35Å; V408-I430 HydrophobicContact CG2-CG2 3.99Å; V408-F457 HydrophobicContact CG2-CB 3.94Å; V408-I459 HydrophobicContact CG1-CD1 3.93Å; V408-I459 HydrophobicContact CG1-CG1 3.89Å; V408-L501 HydrophobicContact CB-CD1 3.86Å; V408-L501 HydrophobicContact CB-CD2 4.46Å; V408-L501 HydrophobicContact CG1-CD1 3.54Å; V408-L501 HydrophobicContact CG1-CD2 4.18Å; V408-L501 HydrophobicContact CG1-CG 4.49Å
409	G	98.7	Very high	97.4	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-59.4	-36.8	170.4	0	0	0	0	0	113.4	L405 Q407 R413	L405-G409 WeakPolarHBondContact O-CA 3.33Å; L405-G409 PolarHBondContact O-N 3.37Å; Q407-G409 VanDerWaalsContact C-N 3.34Å; Q407-G409 PolarHBondContact O-N 2.99Å; G409-R413 WeakPolarHBondContact O-CB 3.44Å; G409-R413 PolarHBondContact O-N 2.75Å
410	R	98.5	Very high	97.6	Very high	81 Å²	81	31.1 Å²	31.1	31%	0.306	16%	0.156	S	C	.	.	H	α-helix	trans	-66.5	-38.2	172.1	-72.3	163.2	-179	170.7	2.3	111.5	H354 L406 Q407 V408 Y414 V562	H354-R410 PolarHBondContact CE1-O 3.48Å; L406-R410 VanDerWaalsContact O-CG 3.24Å; L406-R410 WeakPolarHBondContact O-CG 3.26Å; L406-R410 PolarHBondContact O-N 2.84Å; Q407-R410 WeakPolarHBondContact O-CB 3.29Å; Q407-R410 PolarHBondContact O-N 3.34Å; Q407-R410 VanDerWaalsContact O-N 3.17Å; V408-R410 VanDerWaalsContact C-N 3.31Å; V408-R410 PolarHBondContact O-N 3.03Å; R410-Y414 PolarHBondContact O-N 3.05Å; R410-V562 HydrophobicContact CB-CG1 4.43Å; R410-V562 HydrophobicContact CG-CB 4.32Å; R410-V562 HydrophobicContact CG-CG1 3.83Å
411	G	98.5	Very high	97.7	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-59.4	-53.2	172.5	0	0	0	0	0	112.4	Q407 V408 R413 Y414 I415	Q407-G411 PolarHBondContact O-N 3.39Å; Q407-G411 VanDerWaalsContact O-N 3.11Å; V408-G411 WeakPolarHBondContact O-CA 3.26Å; V408-G411 PolarHBondContact O-N 3.01Å; G411-R413 VanDerWaalsContact C-N 3.35Å; G411-R413 PolarHBondContact O-N 3.17Å; G411-Y414 WeakPolarHBondContact O-CB 3.41Å; G411-Y414 PolarHBondContact O-N 2.68Å; G411-Y414 VanDerWaalsContact O-N 3.14Å; G411-I415 WeakPolarHBondContact O-CG1 3.37Å; G411-I415 PolarHBondContact O-N 2.87Å; G411-I415 VanDerWaalsContact O-N 3.09Å
412	L	98.7	Very high	97.7	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-59.1	-43.1	176	-74	-176.9	0	0	0	112.4	V408 Y414 I415 H416 H422 I425 I459 D497 I498 L501 A558	V408-L412 PolarHBondContact O-N 3.49Å; L412-Y414 PolarHBondContact O-N 2.59Å; L412-I415 PolarHBondContact O-N 2.87Å; L412-I415 VanDerWaalsContact O-N 3.17Å; L412-H416 WeakPolarHBondContact O-CB 3.33Å; L412-H416 PolarHBondContact O-N 3.02Å; L412-H422 HydrophobicContact CD2-CB 4.31Å; L412-I425 HydrophobicContact CD2-CD1 3.81Å; L412-I425 HydrophobicContact CD2-CG1 4.03Å; L412-I459 HydrophobicContact CD2-CD1 3.96Å; L412-I459 HydrophobicContact CG-CD1 3.99Å; L412-D497 HydrophobicContact CD1-CB 3.9Å; L412-D497 HydrophobicContact CD2-CB 3.78Å; L412-D497 HydrophobicContact CG-CB 4.48Å; L412-I498 HydrophobicContact CD1-CD1 4.36Å; L412-L501 HydrophobicContact CD1-CB 4.24Å; L412-L501 HydrophobicContact CD1-CD2 3.75Å; L412-A558 HydrophobicContact CB-CB 3.9Å
413	R	98.6	Very high	97.7	Very high	87 Å²	87	26.8 Å²	26.8	33%	0.328	14%	0.136	S	C	.	.	H	α-helix	trans	-56.4	-39.2	176.6	-178.5	-166.7	65.4	169.6	3	111.9	G409 G411 S417 A558 M559	G409-R413 WeakPolarHBondContact O-CB 3.44Å; G409-R413 PolarHBondContact O-N 2.75Å; G411-R413 VanDerWaalsContact C-N 3.35Å; G411-R413 PolarHBondContact O-N 3.17Å; R413-S417 WeakPolarHBondContact O-CB 3.45Å; R413-S417 PolarHBondContact O-N 3.03Å; R413-S417 VanDerWaalsContact O-N 3.07Å; R413-S417 PolarHBondContact O-OG 3.44Å; R413-A558 HydrophobicContact CB-CB 3.88Å; R413-M559 HydrophobicContact CG-CB 4.4Å; R413-M559 HydrophobicContact CG-CE 4.01Å; R413-M559 HydrophobicContact CG-SD 4.43Å
414	Y	98.4	Very high	97.8	Very high	45 Å²	45	24.3 Å²	24.3	18%	0.176	12%	0.123	C	C	.	.	H	α-helix	trans	-66.6	-51.2	175.4	175.5	-115	0	0	0	111.4	L351 G352 H354 V357 R410 G411 L412 H416 S417 M418	L351-Y414 HydrophobicContact CB-CE1 4.24Å; L351-Y414 HydrophobicContact CD2-CD1 4.09Å; L351-Y414 HydrophobicContact CD2-CE1 3.72Å; G352-Y414 PolarHBondContact N-OH 2.82Å; G352-Y414 PolarHBondContact O-OH 3.12Å; H354-Y414 HydrophobicContact CB-CD1 3.42Å; H354-Y414 VanDerWaalsContact CB-CD1 3.42Å; H354-Y414 HydrophobicContact CB-CD2 4.44Å; H354-Y414 HydrophobicContact CB-CE1 3.56Å; H354-Y414 HydrophobicContact CB-CG 3.9Å; H354-Y414 AromaticContact CD2-CG 3.96Å; H354-Y414 AromaticContact CG-CD1 3.67Å; H354-Y414 AromaticContact CG-CG 3.72Å; V357-Y414 HydrophobicContact CG2-CD1 4.13Å; R410-Y414 PolarHBondContact O-N 3.05Å; G411-Y414 WeakPolarHBondContact O-CB 3.41Å; G411-Y414 PolarHBondContact O-N 2.68Å; G411-Y414 VanDerWaalsContact O-N 3.14Å; L412-Y414 PolarHBondContact O-N 2.59Å; Y414-H416 PolarHBondContact O-N 3.07Å; Y414-S417 PolarHBondContact O-N 3.1Å; Y414-S417 VanDerWaalsContact O-N 3.1Å; Y414-S417 PolarHBondContact O-OG 3.18Å; Y414-M418 HydrophobicContact CE2-CG 4.22Å; Y414-M418 HydrophobicContact CE2-SD 4.44Å; Y414-M418 PolarHBondContact O-N 3.06Å
415	I	97.9	Very high	97.8	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-56.8	-48	178.7	-63.4	167.6	0	0	0	111.2	L351 V357 G411 L412 S417 M418 L420 I459	L351-I415 HydrophobicContact CD1-CG1 4.17Å; L351-I415 HydrophobicContact CD2-CB 4.4Å; L351-I415 HydrophobicContact CD2-CG1 4.04Å; V357-I415 HydrophobicContact CG2-CD1 4.23Å; V357-I415 HydrophobicContact CG2-CG1 4.26Å; G411-I415 WeakPolarHBondContact O-CG1 3.37Å; G411-I415 PolarHBondContact O-N 2.87Å; G411-I415 VanDerWaalsContact O-N 3.09Å; L412-I415 PolarHBondContact O-N 2.87Å; L412-I415 VanDerWaalsContact O-N 3.17Å; I415-S417 VanDerWaalsContact C-N 3.31Å; I415-S417 PolarHBondContact O-N 2.66Å; I415-M418 PolarHBondContact O-N 2.9Å; I415-M418 VanDerWaalsContact O-N 3.11Å; I415-L420 CarbonylContact C-O 3.56Å; I415-L420 HydrophobicContact CG2-CB 3.84Å; I415-L420 PolarHBondContact O-N 2.99Å; I415-I459 HydrophobicContact CD1-CD1 4.01Å; I415-I459 HydrophobicContact CD1-CG2 4.18Å
416	H	98	Very high	97.8	Very high	28 Å²	28	25.8 Å²	25.8	13%	0.13	13%	0.129	C	C	.	.	H	α-helix	trans	-63.6	-33.7	178.2	-62.4	170.9	0	0	0	112.7	L412 Y414 M418 C419 L420 P494 D497	L412-H416 WeakPolarHBondContact O-CB 3.33Å; L412-H416 PolarHBondContact O-N 3.02Å; Y414-H416 PolarHBondContact O-N 3.07Å; H416-M418 VanDerWaalsContact C-N 3.26Å; H416-M418 PolarHBondContact O-N 2.68Å; H416-C419 PolarHBondContact O-N 3.3Å; H416-L420 WeakPolarHBondContact CA-O 3.38Å; H416-L420 PolarHBondContact CD2-O 3.07Å; H416-P494 PolarHBondContact CE1-O 3.37Å; H416-P494 VanDerWaalsContact CE1-O 3.24Å; H416-D497 IonicContact CD2-OD2 3.92Å; H416-D497 IonicContact CE1-OD2 3.18Å; H416-D497 IonicContact NE2-OD2 3.96Å; H416-D497 PolarHBondContact NE2-OD2 2.81Å
417	S	97.1	Very high	97.8	Very high	80 Å²	80	26.1 Å²	26.1	56%	0.559	13%	0.132	S	C	*	.	H	α-helix	trans	-69.7	-21.3	175.7	69.6	0	0	0	0	113.9	R413 Y414 I415 C419	R413-S417 WeakPolarHBondContact O-CB 3.45Å; R413-S417 PolarHBondContact O-N 3.03Å; R413-S417 VanDerWaalsContact O-N 3.07Å; R413-S417 PolarHBondContact O-OG 3.44Å; Y414-S417 PolarHBondContact O-N 3.1Å; Y414-S417 VanDerWaalsContact O-N 3.1Å; Y414-S417 PolarHBondContact O-OG 3.18Å; I415-S417 VanDerWaalsContact C-N 3.31Å; I415-S417 PolarHBondContact O-N 2.66Å; S417-C419 PolarHBondContact O-N 3.1Å
418	M	96.5	Very high	97.8	Very high	76 Å²	76	28.2 Å²	28.2	37%	0.374	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.3	15.5	172.7	-59.7	-56.9	-66.4	0	0	112.9	V350 L351 Y414 I415 H416 L420	V350-M418 HydrophobicContact CG1-CB 4.35Å; V350-M418 HydrophobicContact CG1-CE 3.99Å; L351-M418 HydrophobicContact CD2-CB 4.13Å; L351-M418 HydrophobicContact CD2-CG 3.97Å; Y414-M418 HydrophobicContact CE2-CG 4.22Å; Y414-M418 HydrophobicContact CE2-SD 4.44Å; Y414-M418 PolarHBondContact O-N 3.06Å; I415-M418 PolarHBondContact O-N 2.9Å; I415-M418 VanDerWaalsContact O-N 3.11Å; H416-M418 VanDerWaalsContact C-N 3.26Å; H416-M418 PolarHBondContact O-N 2.68Å; M418-L420 HydrophobicContact CB-CD1 4.48Å; M418-L420 PolarHBondContact O-N 2.76Å
419	C	95.9	Very high	97.7	Very high	80 Å²	80	28.5 Å²	28.5	54%	0.541	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.4	25	-174.7	-59.9	0	0	0	0	115	H416 S417 I468	H416-C419 PolarHBondContact O-N 3.3Å; S417-C419 PolarHBondContact O-N 3.1Å; C419-I468 WeakPolarHBondContact O-CG1 3.39Å; C419-I468 PolarHBondContact O-N 3.13Å
420	L	96.8	Very high	97.7	Very high	4 Å²	4	28.5 Å²	28.5	2%	0.021	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	163.7	176.5	-64.8	174	0	0	0	111.2	V350 L351 I415 H416 M418 V465 T466 R467	V350-L420 HydrophobicContact CB-CD1 4.2Å; V350-L420 HydrophobicContact CG1-CD1 3.9Å; L351-L420 HydrophobicContact CD1-CD1 4.03Å; L351-L420 HydrophobicContact CD2-CD1 4.09Å; L351-L420 HydrophobicContact CG-CD1 3.83Å; I415-L420 CarbonylContact C-O 3.56Å; I415-L420 HydrophobicContact CG2-CB 3.84Å; I415-L420 PolarHBondContact O-N 2.99Å; H416-L420 WeakPolarHBondContact CA-O 3.38Å; H416-L420 PolarHBondContact CD2-O 3.07Å; M418-L420 HydrophobicContact CB-CD1 4.48Å; M418-L420 PolarHBondContact O-N 2.76Å; L420-V465 HydrophobicContact CB-CG1 4.1Å; L420-V465 HydrophobicContact CD1-CG1 4.06Å; L420-V465 HydrophobicContact CD2-CG1 4.03Å; L420-V465 HydrophobicContact CG-CG1 4.29Å; L420-T466 WeakPolarHBondContact CA-O 3.49Å; L420-R467 HydrophobicContact CD2-CG 3.95Å
421	V	97.6	Very high	97.7	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	153.8	170.7	-75.5	0	0	0	0	109.9	M423 V465 T466 I468 L493 P494	V421-M423 HydrophobicContact CB-CG 4.43Å; V421-M423 HydrophobicContact CB-SD 4.17Å; V421-M423 HydrophobicContact CG2-CG 3.92Å; V421-M423 HydrophobicContact CG2-SD 3.81Å; V421-V465 VanDerWaalsContact O-CA 3.31Å; V421-V465 WeakPolarHBondContact O-CA 3.5Å; V421-T466 HydrophobicContact CG2-CG2 3.7Å; V421-T466 WeakPolarHBondContact CG2-O 3.28Å; V421-T466 PolarHBondContact N-O 2.71Å; V421-T466 PolarHBondContact O-N 3.38Å; V421-I468 HydrophobicContact CG1-CD1 4.28Å; V421-I468 HydrophobicContact CG1-CG1 3.77Å; V421-L493 HydrophobicContact CB-CB 4.36Å; V421-L493 HydrophobicContact CG1-CB 3.91Å; V421-L493 HydrophobicContact CG2-CB 4Å; V421-L493 HydrophobicContact CG2-CD1 4Å; V421-P494 HydrophobicContact CG1-CB 4.19Å; V421-P494 HydrophobicContact CG1-CG 3.67Å
422	H	97.8	Very high	97.7	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.148	C	C	.	.			trans	-88.6	-37.2	-173.6	-167.9	-87.4	0	0	0	113.7	L412 D424 I425 I459 G460 L462 D497	L412-H422 HydrophobicContact CD2-CB 4.31Å; H422-D424 PolarHBondContact CE1-O 3.27Å; H422-D424 PolarHBondContact ND1-O 3.28Å; H422-D424 PolarHBondContact O-N 3.16Å; H422-I425 HydrophobicContact CB-CD1 3.86Å; H422-I425 HydrophobicContact CB-CG1 3.9Å; H422-I425 WeakPolarHBondContact ND1-CD1 3.49Å; H422-I459 WeakPolarHBondContact CD2-CG2 3.14Å; H422-I459 VanDerWaalsContact NE2-CG2 3.28Å; H422-I459 WeakPolarHBondContact NE2-CG2 3.43Å; H422-G460 PolarHBondContact NE2-O 3Å; H422-L462 WeakPolarHBondContact NE2-CD2 3.4Å; H422-D497 WeakPolarHBondContact CB-OD1 3.28Å; H422-D497 PolarHBondContact N-OD1 3.24Å; H422-D497 PolarHBondContact N-OD2 3.4Å
423	M	96.9	Very high	97.5	Very high	14 Å²	14	28.7 Å²	28.7	7%	0.069	16%	0.155	C	C	.	.	S	Bend	trans	64.2	-23.2	177.1	-58.7	-54	-56.6	0	0	117.1	V421 H464 T466 V473 V485 L493 D497	V421-M423 HydrophobicContact CB-CG 4.43Å; V421-M423 HydrophobicContact CB-SD 4.17Å; V421-M423 HydrophobicContact CG2-CG 3.92Å; V421-M423 HydrophobicContact CG2-SD 3.81Å; M423-H464 HydrophobicContact CB-CB 4.08Å; M423-T466 HydrophobicContact CG-CG2 4.21Å; M423-V473 HydrophobicContact CE-CG1 4.08Å; M423-V485 HydrophobicContact CE-CG1 3.71Å; M423-V485 HydrophobicContact CE-CG2 4.14Å; M423-L493 HydrophobicContact CE-CD2 3.83Å; M423-L493 HydrophobicContact SD-CB 4.14Å; M423-L493 HydrophobicContact SD-CD1 4.17Å; M423-L493 HydrophobicContact SD-CD2 3.92Å; M423-L493 HydrophobicContact SD-CG 4.3Å; M423-D497 PolarHBondContact N-OD1 2.91Å
424	D	96.6	Very high	97.2	Very high	3 Å²	3	30.8 Å²	30.8	2%	0.016	16%	0.163	C	C	.	.			trans	-126	52.3	178.9	-166.6	44.1	0	0	0	112.4	H422 K426 N429 H464 D477	H422-D424 PolarHBondContact CE1-O 3.27Å; H422-D424 PolarHBondContact ND1-O 3.28Å; H422-D424 PolarHBondContact O-N 3.16Å; D424-K426 PolarHBondContact O-N 3.01Å; D424-K426 WeakPolarHBondContact OD1-CD 3.44Å; D424-K426 WeakPolarHBondContact OD1-CE 3.28Å; D424-K426 IonicContact OD1-NZ 3.73Å; D424-K426 PolarHBondContact OD1-NZ 2.77Å; D424-K426 WeakPolarHBondContact OD2-CE 3.4Å; D424-K426 IonicContact OD2-NZ 2.78Å; D424-K426 PolarHBondContact OD2-NZ 2.69Å; D424-N429 PolarHBondContact O-ND2 3.29Å; D424-N429 PolarHBondContact OD2-ND2 3.44Å; D424-H464 HydrophobicContact CB-CB 3.94Å; D424-D477 PolarHBondContact OD1-N 2.89Å
425	I	98.7	Very high	96.4	Very high	2 Å²	2	31.8 Å²	31.8	1%	0.01	17%	0.174	C	C	.	.			trans	-76.3	117.3	173.4	-65.9	-69.4	0	0	0	109.8	L412 H422 I459 D497 A500 L501	L412-I425 HydrophobicContact CD2-CD1 3.81Å; L412-I425 HydrophobicContact CD2-CG1 4.03Å; H422-I425 HydrophobicContact CB-CD1 3.86Å; H422-I425 HydrophobicContact CB-CG1 3.9Å; H422-I425 WeakPolarHBondContact ND1-CD1 3.49Å; I425-I459 HydrophobicContact CD1-CD1 4.16Å; I425-I459 HydrophobicContact CD1-CG1 4.39Å; I425-I459 HydrophobicContact CD1-CG2 3.87Å; I425-D497 HydrophobicContact CG1-CB 4.38Å; I425-A500 HydrophobicContact CB-CB 3.91Å; I425-A500 HydrophobicContact CG2-CB 4.3Å; I425-L501 HydrophobicContact CG2-CB 4.21Å
426	K	98.4	Very high	95	Very high	29 Å²	29	35.5 Å²	35.5	13%	0.126	20%	0.2	C	C	.	.	S	Bend	trans	-161.1	164	178.6	61.4	-167.6	179.2	-154.7	0	110.7	D424 S428 N429 I430 D477 F480 T504	D424-K426 PolarHBondContact O-N 3.01Å; D424-K426 WeakPolarHBondContact OD1-CD 3.44Å; D424-K426 WeakPolarHBondContact OD1-CE 3.28Å; D424-K426 IonicContact OD1-NZ 3.73Å; D424-K426 PolarHBondContact OD1-NZ 2.77Å; D424-K426 WeakPolarHBondContact OD2-CE 3.4Å; D424-K426 IonicContact OD2-NZ 2.78Å; D424-K426 PolarHBondContact OD2-NZ 2.69Å; K426-S428 VanDerWaalsContact C-N 3.26Å; K426-S428 VanDerWaalsContact CE-OG 3.29Å; K426-S428 WeakPolarHBondContact CE-OG 3.38Å; K426-S428 WeakPolarHBondContact CG-OG 3.21Å; K426-S428 PolarHBondContact O-N 3.22Å; K426-S428 VanDerWaalsContact O-N 3.12Å; K426-N429 WeakPolarHBondContact CE-OD1 3.41Å; K426-N429 HydrophobicContact CG-CB 4.23Å; K426-N429 PolarHBondContact O-N 3.46Å; K426-I430 PolarHBondContact O-N 2.76Å; K426-D477 HydrophobicContact CD-CB 3.64Å; K426-F480 HydrophobicContact CB-CD1 4.31Å; K426-F480 HydrophobicContact CB-CD2 3.62Å; K426-F480 HydrophobicContact CB-CE1 4.37Å; K426-F480 HydrophobicContact CB-CE2 3.69Å; K426-F480 HydrophobicContact CB-CG 3.96Å; K426-F480 HydrophobicContact CB-CZ 4.09Å; K426-T504 WeakPolarHBondContact CA-OG1 3.35Å
427	P	98.6	Very high	93	Very high	13 Å²	13	37.6 Å²	37.6	8%	0.084	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-56.2	-28.6	-177.2	-28.8	35.3	0	0	0	116.4	L382 A383 I386 N429 F480 T504 C507	L382-P427 CarbonylContact C-O 3.47Å; L382-P427 HydrophobicContact CB-CB 4.3Å; L382-P427 WeakPolarHBondContact CB-O 3.46Å; L382-P427 HydrophobicContact CD2-CB 4.32Å; L382-P427 HydrophobicContact CG-CB 4.18Å; L382-P427 PolarHBondContact N-O 3.37Å; A383-P427 HydrophobicContact CB-CB 3.94Å; A383-P427 PolarHBondContact N-O 3.45Å; I386-P427 HydrophobicContact CD1-CB 3.99Å; I386-P427 HydrophobicContact CD1-CG 4.03Å; P427-N429 VanDerWaalsContact C-N 3.25Å; P427-N429 PolarHBondContact O-N 3.4Å; P427-F480 HydrophobicContact CG-CE1 4.47Å; P427-F480 HydrophobicContact CG-CZ 4.19Å; P427-T504 HydrophobicContact CG-CG2 4.04Å; P427-C507 HydrophobicContact CG-CB 4.19Å
428	S	96.8	Very high	90.9	Very high	50 Å²	50	39.2 Å²	39.2	35%	0.35	22%	0.219	S	C	.	.	G	3₁₀ helix	trans	-71.9	-19.9	176.8	54.4	0	0	0	0	113.7	K426	K426-S428 VanDerWaalsContact C-N 3.26Å; K426-S428 VanDerWaalsContact CE-OG 3.29Å; K426-S428 WeakPolarHBondContact CE-OG 3.38Å; K426-S428 WeakPolarHBondContact CG-OG 3.21Å; K426-S428 PolarHBondContact O-N 3.22Å; K426-S428 VanDerWaalsContact O-N 3.12Å
429	N	97.5	Very high	88.5	Confident	6 Å²	6	38.9 Å²	38.9	3%	0.032	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-106.3	4.4	-172.6	-60.5	28.6	0	0	0	111.5	D424 K426 P427 G460	D424-N429 PolarHBondContact O-ND2 3.29Å; D424-N429 PolarHBondContact OD2-ND2 3.44Å; K426-N429 WeakPolarHBondContact CE-OD1 3.41Å; K426-N429 HydrophobicContact CG-CB 4.23Å; K426-N429 PolarHBondContact O-N 3.46Å; P427-N429 VanDerWaalsContact C-N 3.25Å; P427-N429 PolarHBondContact O-N 3.4Å; N429-G460 PolarHBondContact O-N 3.2Å
430	I	98.6	Very high	86	Confident	1 Å²	1	39.5 Å²	39.5	1%	0.005	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	117.9	170.4	-65.9	161.5	0	0	0	107.4	S381 L382 L404 V408 K426 F457 K458 T504	S381-I430 CarbonylContact C-O 3.49Å; S381-I430 WeakPolarHBondContact CA-O 3.32Å; L382-I430 HydrophobicContact CB-CB 4.18Å; L382-I430 HydrophobicContact CB-CG2 4.26Å; L382-I430 HydrophobicContact CD2-CB 4.47Å; L382-I430 HydrophobicContact CD2-CD1 4.26Å; L382-I430 HydrophobicContact CD2-CG2 4.44Å; L382-I430 PolarHBondContact N-O 2.91Å; L404-I430 HydrophobicContact CD1-CG2 4.39Å; V408-I430 HydrophobicContact CG1-CD1 4.06Å; V408-I430 HydrophobicContact CG1-CG1 4.46Å; V408-I430 HydrophobicContact CG2-CD1 4.05Å; V408-I430 HydrophobicContact CG2-CG1 4.35Å; V408-I430 HydrophobicContact CG2-CG2 3.99Å; K426-I430 PolarHBondContact O-N 2.76Å; I430-F457 HydrophobicContact CG2-CB 4.13Å; I430-F457 HydrophobicContact CG2-CD1 4.16Å; I430-K458 CarbonylContact C-O 3.54Å; I430-K458 WeakPolarHBondContact CA-O 3.42Å; I430-T504 HydrophobicContact CD1-CG2 3.5Å
431	F	98.3	Very high	83.4	Confident	60 Å²	60	45.1 Å²	45.1	26%	0.263	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	146.9	-176.6	-63.3	-86.8	0	0	0	111	V358 C377 G380 F457 K458	V358-F431 HydrophobicContact CG2-CB 4.25Å; V358-F431 HydrophobicContact CG2-CD2 3.71Å; V358-F431 HydrophobicContact CG2-CG 4.25Å; C377-F431 HydrophobicContact CB-CB 3.66Å; C377-F431 HydrophobicContact CB-CG 4.48Å; G380-F431 WeakPolarHBondContact O-CA 3.4Å; F431-F457 WeakPolarHBondContact O-CA 3.26Å; F431-K458 PolarHBondContact N-O 3.06Å; F431-K458 PolarHBondContact O-N 3.31Å
432	I	97.9	Very high	80.7	Confident	3 Å²	3	50.1 Å²	50.1	2%	0.015	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	119.9	-176.5	-56.2	178.3	0	0	0	108.5	C377 G379 G380 A385 R434 V455 F457	C377-I432 CarbonylContact C-O 3.58Å; C377-I432 WeakPolarHBondContact CB-O 3.45Å; G379-I432 WeakPolarHBondContact CA-O 3.49Å; G379-I432 PolarHBondContact N-O 3.18Å; G380-I432 PolarHBondContact O-N 2.92Å; A385-I432 HydrophobicContact CB-CD1 3.77Å; I432-R434 HydrophobicContact CG2-CG 3.96Å; I432-V455 HydrophobicContact CG2-CG1 3.78Å; I432-F457 HydrophobicContact CD1-CE1 4.13Å; I432-F457 HydrophobicContact CG1-CD1 4.02Å; I432-F457 HydrophobicContact CG1-CE1 3.96Å
433	S	95.2	Very high	78.4	Confident	22 Å²	22	58.5 Å²	58.5	15%	0.154	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	131	164.5	-177.7	0	0	0	0	108.8	N378 M456	N378-S433 WeakPolarHBondContact OD1-CA 3.25Å; S433-M456 PolarHBondContact N-O 3.18Å; S433-M456 PolarHBondContact O-N 3.49Å
434	R	91.4	Very high	76	Confident	130 Å²	130	66.7 Å²	66.7	49%	0.491	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	113	177.7	-57.2	-173.7	-171.9	-147.6	3	108.4	N378 I432	N378-R434 PolarHBondContact ND2-O 3.21Å; N378-R434 PolarHBondContact OD1-N 2.82Å; I432-R434 HydrophobicContact CG2-CG 3.96Å
435	T	82.9	Confident	73.7	Confident	67 Å²	67	70.3 Å²	70.3	41%	0.411	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	107.1	173.6	-50.7	0	0	0	0	109.1	I437 K454	T435-I437 HydrophobicContact CG2-CG1 4.22Å; T435-I437 PolarHBondContact O-N 2.92Å; T435-K454 PolarHBondContact N-O 2.79Å; T435-K454 PolarHBondContact O-N 3.26Å
436	S	67.5	Low	71	Confident	77 Å²	77	77.6 Å²	77.6	54%	0.538	45%	0.454	S	S	.	.			trans	-69.2	103.4	158.4	53.8	0	0	0	0	107.4	P438	S436-P438 VanDerWaalsContact O-CD 3.31Å; S436-P438 WeakPolarHBondContact O-CD 3.41Å
437	I	57.2	Low	68.6	Low	73 Å²	73	85.9 Å²	85.9	37%	0.374	49%	0.493	S	S	.	.	P	Polyproline II helix	trans	-73.8	117.5	169	-58.8	173.9	0	0	0	106	T435 N439	T435-I437 HydrophobicContact CG2-CG1 4.22Å; T435-I437 PolarHBondContact O-N 2.92Å; I437-N439 PolarHBondContact O-N 3.28Å
438	P	52.8	Low	65.9	Low	113 Å²	113	92.9 Å²	92.9	73%	0.734	53%	0.529	S	S	*	.	P	Polyproline II helix	trans	-69.1	117.3	165.4	-6.2	24	0	0	0	106.1	S436 A440	S436-P438 VanDerWaalsContact O-CD 3.31Å; S436-P438 WeakPolarHBondContact O-CD 3.41Å; P438-A440 PolarHBondContact O-N 3.18Å
439	N	45.2	Very low	63.2	Low	69 Å²	69	95.3 Å²	95.3	37%	0.369	54%	0.539	S	S	.	.	P	Polyproline II helix	trans	-58.7	124.6	170.5	-78.2	-22.6	0	0	0	107.7	I437 V441 D449	I437-N439 PolarHBondContact O-N 3.28Å; N439-V441 PolarHBondContact O-N 3.41Å; N439-D449 VanDerWaalsContact ND2-CG 3.33Å; N439-D449 PolarHBondContact ND2-OD1 3.34Å; N439-D449 PolarHBondContact ND2-OD2 2.78Å; N439-D449 VanDerWaalsContact ND2-OD2 3.16Å
440	A	43.7	Very low	60.6	Low	94 Å²	94	105.5 Å²	105.5	78%	0.777	58%	0.577	S	S	*	*	P	Polyproline II helix	trans	-62.2	123.8	-175.7	0	0	0	0	0	108.5	P438 S442	P438-A440 PolarHBondContact O-N 3.18Å; A440-S442 PolarHBondContact O-N 3.43Å
441	V	41.4	Very low	57.8	Low	122 Å²	122	109.9 Å²	109.9	74%	0.739	60%	0.599	S	S	*	*			trans	-43.6	101.7	-156.8	-167.1	0	0	0	0	113.5	N439 E443	N439-V441 PolarHBondContact O-N 3.41Å; V441-E443 HydrophobicContact CG1-CG 3.59Å; V441-E443 PolarHBondContact O-N 2.87Å
442	S	41.5	Very low	55.6	Low	104 Å²	104	109.6 Å²	109.6	73%	0.727	60%	0.604	S	S	*	*			trans	-80.4	93.2	162.9	-65	0	0	0	0	108	A440 E444	A440-S442 PolarHBondContact O-N 3.43Å; S442-E444 PolarHBondContact O-N 3.42Å
443	E	49.2	Very low	53.9	Low	176 Å²	176	113.9 Å²	113.9	82%	0.822	63%	0.627	S	S	*	*			trans	-76.2	69.6	170.2	-67	-159.4	166.2	0	0	111.2	V441	V441-E443 HydrophobicContact CG1-CG 3.59Å; V441-E443 PolarHBondContact O-N 2.87Å
444	E	47	Very low	53.3	Low	187 Å²	187	118.5 Å²	118.5	87%	0.874	65%	0.645	S	S	*	*	S	Bend	trans	-163.7	137.1	149.7	-110.4	163.1	-154.8	0	0	107.9	S442	S442-E444 PolarHBondContact O-N 3.42Å
445	G	48.7	Very low	53.3	Low	78 Å²	78	114.7 Å²	114.7	80%	0.804	64%	0.636	S	S	*	*			trans	-99.6	121	-158.9	0	0	0	0	0	115.2
446	D	41.3	Very low	54	Low	156 Å²	156	112.9 Å²	112.9	83%	0.834	62%	0.623	S	S	*	*			trans	-124.9	126.2	155.1	-81.6	-51	0	0	0	107.9	D448	D446-D448 VanDerWaalsContact C-N 3.27Å; D446-D448 PolarHBondContact O-N 2.86Å
447	E	49.2	Very low	55.4	Low	203 Å²	203	109.5 Å²	109.5	95%	0.949	60%	0.599	S	S	*	*	S	Bend	trans	-82.1	54.6	-170.8	-67.4	-159.8	143.6	0	0	114.3
448	D	41.2	Very low	57.4	Low	159 Å²	159	106.9 Å²	106.9	85%	0.85	59%	0.585	S	S	*	*			trans	-141.8	34.2	172.6	-107.3	-37.8	0	0	0	112.5	D446 W450	D446-D448 VanDerWaalsContact C-N 3.27Å; D446-D448 PolarHBondContact O-N 2.86Å; D448-W450 PolarHBondContact O-N 2.91Å
449	D	39.2	Very low	59.5	Low	102 Å²	102	101.5 Å²	101.5	55%	0.545	55%	0.55	S	S	.	.			trans	-69.8	87.4	178	-167.4	46.2	0	0	0	111.9	N439 I451	N439-D449 VanDerWaalsContact ND2-CG 3.33Å; N439-D449 PolarHBondContact ND2-OD1 3.34Å; N439-D449 PolarHBondContact ND2-OD2 2.78Å; N439-D449 VanDerWaalsContact ND2-OD2 3.16Å; D449-I451 PolarHBondContact O-N 3.33Å
450	W	42.9	Very low	61.9	Low	220 Å²	220	98.2 Å²	98.2	83%	0.833	53%	0.532	S	S	*	.			trans	-64.8	95.1	176.1	-178.9	-93.1	0	0	0	110.6	D448 S452	D448-W450 PolarHBondContact O-N 2.91Å; W450-S452 PolarHBondContact O-N 2.8Å
451	I	41.5	Very low	64.2	Low	93 Å²	93	95.5 Å²	95.5	48%	0.477	51%	0.505	S	S	.	.			trans	-55.1	100.2	171.2	-56.9	176.3	0	0	0	108.3	D449 N453	D449-I451 PolarHBondContact O-N 3.33Å; I451-N453 PolarHBondContact O-N 3.48Å; I451-N453 PolarHBondContact O-ND2 3.37Å
452	S	50.5	Low	66.6	Low	53 Å²	53	89.7 Å²	89.7	37%	0.371	47%	0.469	S	S	.	.			trans	-73.7	77.1	-178.6	60.4	0	0	0	0	110.2	W450 K454	W450-S452 PolarHBondContact O-N 2.8Å; S452-K454 VanDerWaalsContact C-N 3.26Å; S452-K454 PolarHBondContact O-N 2.9Å
453	N	62.2	Low	68.9	Low	94 Å²	94	85 Å²	85	50%	0.503	44%	0.437	S	S	.	.			trans	-62.5	84.8	177	-79.7	-61.2	0	0	0	109.9	I451 V455	I451-N453 PolarHBondContact O-N 3.48Å; I451-N453 PolarHBondContact O-ND2 3.37Å; N453-V455 PolarHBondContact O-N 2.94Å; N453-V455 VanDerWaalsContact O-N 3.1Å
454	K	82.9	Confident	70.9	Confident	118 Å²	118	77.3 Å²	77.3	51%	0.513	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	111.5	-173.2	-173.6	176.9	179.5	179.3	0	109.4	T435 S452 M456	T435-K454 PolarHBondContact N-O 2.79Å; T435-K454 PolarHBondContact O-N 3.26Å; S452-K454 VanDerWaalsContact C-N 3.26Å; S452-K454 PolarHBondContact O-N 2.9Å; K454-M456 HydrophobicContact CG-CG 4.44Å
455	V	92.2	Very high	73.2	Confident	51 Å²	51	68.7 Å²	68.7	31%	0.309	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	128.7	174.7	-173.4	0	0	0	0	108.9	Q407 I432 N453 F457	Q407-V455 PolarHBondContact NE2-O 2.89Å; I432-V455 HydrophobicContact CG2-CG1 3.78Å; N453-V455 PolarHBondContact O-N 2.94Å; N453-V455 VanDerWaalsContact O-N 3.1Å; V455-F457 HydrophobicContact CG1-CD2 4.45Å; V455-F457 HydrophobicContact CG1-CE1 4.14Å; V455-F457 HydrophobicContact CG1-CE2 3.88Å; V455-F457 HydrophobicContact CG1-CZ 3.71Å
456	M	96	Very high	75.3	Confident	29 Å²	29	65.5 Å²	65.5	14%	0.143	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	115.6	178.6	-73.7	-67.3	-54.8	0	0	109.5	H356 Q407 S433 K454	H356-M456 WeakPolarHBondContact CE1-CE 3.35Å; Q407-M456 VanDerWaalsContact OE1-CA 3.31Å; S433-M456 PolarHBondContact N-O 3.18Å; S433-M456 PolarHBondContact O-N 3.49Å; K454-M456 HydrophobicContact CG-CG 4.44Å
457	F	98.1	Very high	77.8	Confident	5 Å²	5	63.7 Å²	63.7	2%	0.022	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	134.2	176	-59.7	-78.6	0	0	0	110.7	H356 L382 L404 Q407 V408 I430 F431 I432 V455	H356-F457 WeakPolarHBondContact CA-O 3.44Å; H356-F457 PolarHBondContact ND1-O 3.29Å; H356-F457 VanDerWaalsContact ND1-O 3.09Å; L382-F457 HydrophobicContact CD1-CE1 4.36Å; L404-F457 HydrophobicContact CB-CD2 4.29Å; L404-F457 HydrophobicContact CB-CE2 3.99Å; L404-F457 HydrophobicContact CB-CZ 4.18Å; L404-F457 HydrophobicContact CD1-CB 4.34Å; L404-F457 HydrophobicContact CD1-CD1 3.64Å; L404-F457 HydrophobicContact CD1-CD2 4.15Å; L404-F457 HydrophobicContact CD1-CE1 3.88Å; L404-F457 HydrophobicContact CD1-CE2 4.36Å; L404-F457 HydrophobicContact CD1-CG 3.77Å; L404-F457 HydrophobicContact CD1-CZ 4.23Å; Q407-F457 HydrophobicContact CB-CB 4.11Å; Q407-F457 HydrophobicContact CB-CD2 4.17Å; Q407-F457 HydrophobicContact CG-CD2 4.32Å; V408-F457 HydrophobicContact CG2-CB 3.94Å; I430-F457 HydrophobicContact CG2-CB 4.13Å; I430-F457 HydrophobicContact CG2-CD1 4.16Å; F431-F457 WeakPolarHBondContact O-CA 3.26Å; I432-F457 HydrophobicContact CD1-CE1 4.13Å; I432-F457 HydrophobicContact CG1-CD1 4.02Å; I432-F457 HydrophobicContact CG1-CE1 3.96Å; V455-F457 HydrophobicContact CG1-CD2 4.45Å; V455-F457 HydrophobicContact CG1-CE1 4.14Å; V455-F457 HydrophobicContact CG1-CE2 3.88Å; V455-F457 HydrophobicContact CG1-CZ 3.71Å
458	K	98.4	Very high	79.9	Confident	19 Å²	19	56.8 Å²	56.8	8%	0.083	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	127.9	-173.9	-73.3	163.8	167.5	-68.8	0	111.5	S355 V358 E375 I430 F431	S355-K458 WeakPolarHBondContact O-CG 3.36Å; S355-K458 PolarHBondContact O-NZ 3.07Å; S355-K458 VanDerWaalsContact O-NZ 3.12Å; V358-K458 HydrophobicContact CG2-CB 3.89Å; E375-K458 WeakPolarHBondContact OE1-CD 3.31Å; E375-K458 WeakPolarHBondContact OE1-CE 3.29Å; E375-K458 IonicContact OE1-NZ 2.7Å; E375-K458 PolarHBondContact OE1-NZ 2.8Å; E375-K458 WeakPolarHBondContact OE2-CE 3.4Å; E375-K458 IonicContact OE2-NZ 3.38Å; E375-K458 PolarHBondContact OE2-NZ 2.88Å; I430-K458 CarbonylContact C-O 3.54Å; I430-K458 WeakPolarHBondContact CA-O 3.42Å; F431-K458 PolarHBondContact N-O 3.06Å; F431-K458 PolarHBondContact O-N 3.31Å
459	I	98.5	Very high	82.2	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	131.1	173.9	-58.1	173.6	0	0	0	109.8	H356 V357 V358 V408 L412 I415 H422 I425	H356-I459 PolarHBondContact O-N 3.26Å; V357-I459 CarbonylContact C-O 3.6Å; V357-I459 WeakPolarHBondContact CA-O 3.45Å; V358-I459 WeakPolarHBondContact CG2-O 3.22Å; V358-I459 PolarHBondContact N-O 3.06Å; V408-I459 HydrophobicContact CG1-CD1 3.93Å; V408-I459 HydrophobicContact CG1-CG1 3.89Å; L412-I459 HydrophobicContact CD2-CD1 3.96Å; L412-I459 HydrophobicContact CG-CD1 3.99Å; I415-I459 HydrophobicContact CD1-CD1 4.01Å; I415-I459 HydrophobicContact CD1-CG2 4.18Å; H422-I459 WeakPolarHBondContact CD2-CG2 3.14Å; H422-I459 VanDerWaalsContact NE2-CG2 3.28Å; H422-I459 WeakPolarHBondContact NE2-CG2 3.43Å; I425-I459 HydrophobicContact CD1-CD1 4.16Å; I425-I459 HydrophobicContact CD1-CG1 4.39Å; I425-I459 HydrophobicContact CD1-CG2 3.87Å
460	G	95.4	Very high	84.6	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	27%	0.266	C	S	.	.			trans	-145.1	-172.8	175.7	0	0	0	0	0	113.3	H422 N429	H422-G460 PolarHBondContact NE2-O 3Å; N429-G460 PolarHBondContact O-N 3.2Å
461	D	91.9	Very high	86.6	Confident	37 Å²	37	44.1 Å²	44.1	20%	0.198	24%	0.241	C	C	.	.			trans	58.9	64.6	-169.6	-156.4	19.4	0	0	0	113.1	K326 G463	K326-D461 IonicContact NZ-OD1 3.53Å; K326-D461 PolarHBondContact NZ-OD1 3.39Å; D461-G463 PolarHBondContact O-N 2.99Å
462	L	91.7	Very high	88.7	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-75.2	15.2	-172.2	-54.6	-169.1	0	0	0	114.4	E344 A347 H348 L351 H422 H464 V465	E344-L462 HydrophobicContact CG-CB 4.25Å; A347-L462 HydrophobicContact CB-CB 3.93Å; A347-L462 HydrophobicContact CB-CD1 3.92Å; H348-L462 WeakPolarHBondContact CE1-CD1 3.31Å; H348-L462 WeakPolarHBondContact ND1-CD1 3.31Å; L351-L462 HydrophobicContact CD1-CD1 3.81Å; H422-L462 WeakPolarHBondContact NE2-CD2 3.4Å; L462-H464 VanDerWaalsContact C-N 3.26Å; L462-H464 PolarHBondContact O-N 2.99Å; L462-V465 HydrophobicContact CB-CB 4.45Å; L462-V465 HydrophobicContact CB-CG2 3.73Å; L462-V465 HydrophobicContact CD2-CG2 4.04Å; L462-V465 HydrophobicContact CG-CG2 4.35Å; L462-V465 VanDerWaalsContact O-CB 3.31Å; L462-V465 WeakPolarHBondContact O-CB 3.34Å; L462-V465 WeakPolarHBondContact O-CG2 3.27Å; L462-V465 PolarHBondContact O-N 3.3Å
463	G	88.9	Confident	90.4	Very high	5 Å²	5	45 Å²	45	5%	0.052	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-60.4	-30.1	-175.5	0	0	0	0	0	114.1	R343 D461	R343-G463 PolarHBondContact NE-O 3.34Å; R343-G463 PolarHBondContact NH2-O 3.43Å; D461-G463 PolarHBondContact O-N 2.99Å
464	H	91.1	Very high	91.5	Very high	14 Å²	14	43.1 Å²	43.1	7%	0.065	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	-91.2	2.8	177	-68.4	-101.9	0	0	0	114	M423 D424 L462 T466 E474	M423-H464 HydrophobicContact CB-CB 4.08Å; D424-H464 HydrophobicContact CB-CB 3.94Å; L462-H464 VanDerWaalsContact C-N 3.26Å; L462-H464 PolarHBondContact O-N 2.99Å; H464-T466 PolarHBondContact O-N 2.9Å; H464-E474 IonicContact CE1-OE1 2.64Å; H464-E474 PolarHBondContact ND1-O 2.8Å
465	V	94.7	Very high	91.8	Very high	7 Å²	7	42.8 Å²	42.8	4%	0.042	23%	0.228	C	C	.	.			trans	-63.8	132	-178.3	169.3	0	0	0	0	111.4	A347 L420 V421 L462	A347-V465 HydrophobicContact CB-CB 3.78Å; A347-V465 HydrophobicContact CB-CG1 3.65Å; A347-V465 HydrophobicContact CB-CG2 4.2Å; L420-V465 HydrophobicContact CB-CG1 4.1Å; L420-V465 HydrophobicContact CD1-CG1 4.06Å; L420-V465 HydrophobicContact CD2-CG1 4.03Å; L420-V465 HydrophobicContact CG-CG1 4.29Å; V421-V465 VanDerWaalsContact O-CA 3.31Å; V421-V465 WeakPolarHBondContact O-CA 3.5Å; L462-V465 HydrophobicContact CB-CB 4.45Å; L462-V465 HydrophobicContact CB-CG2 3.73Å; L462-V465 HydrophobicContact CD2-CG2 4.04Å; L462-V465 HydrophobicContact CG-CG2 4.35Å; L462-V465 VanDerWaalsContact O-CB 3.31Å; L462-V465 WeakPolarHBondContact O-CB 3.34Å; L462-V465 WeakPolarHBondContact O-CG2 3.27Å; L462-V465 PolarHBondContact O-N 3.3Å
466	T	93.6	Very high	91.6	Very high	10 Å²	10	40.9 Å²	40.9	6%	0.061	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	165.1	-179.8	-155.4	0	0	0	0	111.9	L420 V421 M423 H464 P471 Q472 L493	L420-T466 WeakPolarHBondContact CA-O 3.49Å; V421-T466 HydrophobicContact CG2-CG2 3.7Å; V421-T466 WeakPolarHBondContact CG2-O 3.28Å; V421-T466 PolarHBondContact N-O 2.71Å; V421-T466 PolarHBondContact O-N 3.38Å; M423-T466 HydrophobicContact CG-CG2 4.21Å; H464-T466 PolarHBondContact O-N 2.9Å; T466-P471 HydrophobicContact CG2-CB 4.33Å; T466-Q472 VanDerWaalsContact CB-O 3.27Å; T466-Q472 WeakPolarHBondContact CB-O 3.35Å; T466-Q472 PolarHBondContact OG1-N 3.25Å; T466-Q472 PolarHBondContact OG1-O 3.34Å; T466-L493 HydrophobicContact CG2-CD1 4.22Å
467	R	94.3	Very high	91.6	Very high	118 Å²	118	41.2 Å²	41.2	45%	0.445	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	138.4	-179.6	-69.9	-177.9	177.9	-168	0.1	111.2	Y346 L420 S469 S470 P471	Y346-R467 PolarHBondContact OH-NH2 3.37Å; L420-R467 HydrophobicContact CD2-CG 3.95Å; R467-S469 VanDerWaalsContact C-N 3.34Å; R467-S469 PolarHBondContact O-N 2.98Å; R467-S470 CarbonylContact O-C 3.52Å; R467-S470 PolarHBondContact O-N 3.31Å; R467-P471 VanDerWaalsContact O-CA 3.28Å; R467-P471 WeakPolarHBondContact O-CA 3.46Å
468	I	92.7	Very high	91.6	Very high	59 Å²	59	43 Å²	43	30%	0.303	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61	-41.6	176.9	-62	169	0	0	0	111.7	C419 V421 P494	C419-I468 WeakPolarHBondContact O-CG1 3.39Å; C419-I468 PolarHBondContact O-N 3.13Å; V421-I468 HydrophobicContact CG1-CD1 4.28Å; V421-I468 HydrophobicContact CG1-CG1 3.77Å; I468-P494 HydrophobicContact CD1-CG 3.57Å; I468-P494 HydrophobicContact CG1-CG 3.99Å
469	S	90.1	Very high	91.6	Very high	104 Å²	104	45.7 Å²	45.7	73%	0.727	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.7	-12.9	-173.8	53.6	0	0	0	0	115.1	R467	R467-S469 VanDerWaalsContact C-N 3.34Å; R467-S469 PolarHBondContact O-N 2.98Å
470	S	88.4	Confident	91.6	Very high	64 Å²	64	46 Å²	46	45%	0.448	25%	0.246	S	C	.	.	B	Isolated β-bridge	trans	-149	65.8	-179.1	66.2	0	0	0	0	109.7	R467 Q472	R467-S470 CarbonylContact O-C 3.52Å; R467-S470 PolarHBondContact O-N 3.31Å; S470-Q472 PolarHBondContact O-N 3.09Å
471	P	86.2	Confident	91.7	Very high	46 Å²	46	46.6 Å²	46.6	30%	0.299	25%	0.248	S	C	.	.			trans	-76.3	115.4	-165.1	30.5	-35.6	0	0	0	111.7	T466 R467 V473 Y490 L493	T466-P471 HydrophobicContact CG2-CB 4.33Å; R467-P471 VanDerWaalsContact O-CA 3.28Å; R467-P471 WeakPolarHBondContact O-CA 3.46Å; P471-V473 HydrophobicContact CB-CG2 3.93Å; P471-Y490 HydrophobicContact CG-CD2 4.25Å; P471-Y490 HydrophobicContact CG-CG 4.44Å; P471-L493 HydrophobicContact CB-CD1 3.6Å; P471-L493 HydrophobicContact CG-CD1 4.42Å
472	Q	85.6	Confident	92	Very high	129 Å²	129	44.9 Å²	44.9	60%	0.603	24%	0.24	S	C	*	.			trans	-92.9	98.2	159.9	-66.5	-178.8	-4.7	0	0	106.6	T466 S470	T466-Q472 VanDerWaalsContact CB-O 3.27Å; T466-Q472 WeakPolarHBondContact CB-O 3.35Å; T466-Q472 PolarHBondContact OG1-N 3.25Å; T466-Q472 PolarHBondContact OG1-O 3.34Å; S470-Q472 PolarHBondContact O-N 3.09Å
473	V	85.1	Confident	92.3	Very high	35 Å²	35	46.8 Å²	46.8	21%	0.212	25%	0.25	C	C	.	.			trans	-93.9	132.3	-175.3	-177	0	0	0	0	110.5	M423 P471 V485 Y490 L493	M423-V473 HydrophobicContact CE-CG1 4.08Å; P471-V473 HydrophobicContact CB-CG2 3.93Å; V473-V485 HydrophobicContact CG1-CG1 4.1Å; V473-Y490 HydrophobicContact CB-CE1 4.03Å; V473-Y490 HydrophobicContact CB-CE2 4.26Å; V473-Y490 HydrophobicContact CG1-CE1 4.02Å; V473-Y490 HydrophobicContact CG2-CD1 3.8Å; V473-Y490 HydrophobicContact CG2-CD2 3.93Å; V473-Y490 HydrophobicContact CG2-CE1 3.79Å; V473-Y490 HydrophobicContact CG2-CE2 3.94Å; V473-Y490 HydrophobicContact CG2-CG 3.87Å; V473-L493 HydrophobicContact CG2-CD1 4.05Å
474	E	86.6	Confident	92.7	Very high	55 Å²	55	47 Å²	47	26%	0.257	25%	0.249	S	C	.	.			trans	-120.3	122.8	164.3	-175.5	177	153.6	0	0	107	N340 R343 H464 G476	N340-E474 PolarHBondContact ND2-OE1 2.9Å; N340-E474 PolarHBondContact ND2-OE2 2.87Å; N340-E474 VanDerWaalsContact ND2-OE2 3.11Å; N340-E474 PolarHBondContact OD1-OE2 2.8Å; R343-E474 IonicContact CZ-OE2 2.71Å; R343-E474 IonicContact NH1-OE2 3.77Å; R343-E474 PolarHBondContact NH1-OE2 3.33Å; R343-E474 VanDerWaalsContact NH1-OE2 3.13Å; R343-E474 IonicContact NH2-OE2 2.77Å; R343-E474 PolarHBondContact NH2-OE2 3.18Å; H464-E474 IonicContact CE1-OE1 2.64Å; H464-E474 PolarHBondContact ND1-O 2.8Å; E474-G476 PolarHBondContact O-N 3.46Å
475	E	87.9	Confident	93	Very high	112 Å²	112	46.3 Å²	46.3	52%	0.523	25%	0.246	S	C	.	.			trans	-57.4	124.4	-175.1	-70.1	176.5	-147	0	0	111.4	L481	E475-L481 HydrophobicContact CB-CD2 4.46Å; E475-L481 HydrophobicContact CG-CD2 4.4Å
476	G	89.5	Confident	93.1	Very high	11 Å²	11	49.7 Å²	49.7	11%	0.113	26%	0.264	C	S	.	.			trans	-76.3	-169.4	172.1	0	0	0	0	0	112.7	E474 S478	E474-G476 PolarHBondContact O-N 3.46Å; G476-S478 PolarHBondContact O-N 3.12Å; G476-S478 VanDerWaalsContact O-N 3.16Å
477	D	95.4	Very high	93.2	Very high	36 Å²	36	55.7 Å²	55.7	19%	0.193	29%	0.291	C	S	.	.			trans	-57.7	119.3	-177.5	-168.8	-52.7	0	0	0	112.8	D424 K426 R479 F480 L481	D424-D477 PolarHBondContact OD1-N 2.89Å; K426-D477 HydrophobicContact CD-CB 3.64Å; D477-R479 PolarHBondContact O-N 2.82Å; D477-R479 VanDerWaalsContact OD1-CB 3.26Å; D477-R479 WeakPolarHBondContact OD1-CB 3.5Å; D477-R479 WeakPolarHBondContact OD1-CG 3.43Å; D477-R479 IonicContact OD1-CZ 2.87Å; D477-R479 PolarHBondContact OD1-N 2.86Å; D477-R479 IonicContact OD1-NE 3.75Å; D477-R479 PolarHBondContact OD1-NE 3.49Å; D477-R479 IonicContact OD1-NH2 3.42Å; D477-R479 IonicContact OD2-CZ 3.34Å; D477-R479 IonicContact OD2-NE 2.68Å; D477-R479 PolarHBondContact OD2-NE 3.27Å; D477-R479 IonicContact OD2-NH2 3.56Å; D477-R479 PolarHBondContact OD2-NH2 2.79Å; D477-F480 HydrophobicContact CB-CD2 4.07Å; D477-F480 PolarHBondContact O-N 2.86Å; D477-L481 PolarHBondContact O-N 3.45Å
478	S	97.6	Very high	93.3	Very high	43 Å²	43	57.1 Å²	57.1	30%	0.301	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-24.1	-173	80.4	0	0	0	0	113.8	G476 F480 R516 W521 R525	G476-S478 PolarHBondContact O-N 3.12Å; G476-S478 VanDerWaalsContact O-N 3.16Å; S478-F480 VanDerWaalsContact C-N 3.27Å; S478-F480 PolarHBondContact O-N 2.91Å; S478-R516 PolarHBondContact OG-O 3.39Å; S478-W521 PolarHBondContact O-NE1 2.89Å; S478-R525 PolarHBondContact O-NH2 3.44Å
479	R	98.4	Very high	93.4	Very high	74 Å²	74	57.5 Å²	57.5	28%	0.279	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-32.5	175.8	-62.1	175.8	-71.3	167.3	-0.5	112.3	D477 L514 R516 R525	D477-R479 PolarHBondContact O-N 2.82Å; D477-R479 VanDerWaalsContact OD1-CB 3.26Å; D477-R479 WeakPolarHBondContact OD1-CB 3.5Å; D477-R479 WeakPolarHBondContact OD1-CG 3.43Å; D477-R479 IonicContact OD1-CZ 2.87Å; D477-R479 PolarHBondContact OD1-N 2.86Å; D477-R479 IonicContact OD1-NE 3.75Å; D477-R479 PolarHBondContact OD1-NE 3.49Å; D477-R479 IonicContact OD1-NH2 3.42Å; D477-R479 IonicContact OD2-CZ 3.34Å; D477-R479 IonicContact OD2-NE 2.68Å; D477-R479 PolarHBondContact OD2-NE 3.27Å; D477-R479 IonicContact OD2-NH2 3.56Å; D477-R479 PolarHBondContact OD2-NH2 2.79Å; R479-L514 HydrophobicContact CB-CB 4.03Å; R479-L514 WeakPolarHBondContact CD-O 3.48Å; R479-L514 HydrophobicContact CG-CB 4.46Å; R479-L514 WeakPolarHBondContact CG-O 3.28Å; R479-R516 HydrophobicContact CG-CG 3.82Å; R479-R525 VanDerWaalsContact C-NH2 3.33Å; R479-R525 PolarHBondContact O-NH2 2.93Å
480	F	98.6	Very high	93.7	Very high	8 Å²	8	55.7 Å²	55.7	4%	0.035	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.7	-17.2	-177.4	-58.9	-88	0	0	0	112.9	K426 P427 D477 S478 A482 F499 A500 L503 L514	K426-F480 HydrophobicContact CB-CD1 4.31Å; K426-F480 HydrophobicContact CB-CD2 3.62Å; K426-F480 HydrophobicContact CB-CE1 4.37Å; K426-F480 HydrophobicContact CB-CE2 3.69Å; K426-F480 HydrophobicContact CB-CG 3.96Å; K426-F480 HydrophobicContact CB-CZ 4.09Å; P427-F480 HydrophobicContact CG-CE1 4.47Å; P427-F480 HydrophobicContact CG-CZ 4.19Å; D477-F480 HydrophobicContact CB-CD2 4.07Å; D477-F480 PolarHBondContact O-N 2.86Å; S478-F480 VanDerWaalsContact C-N 3.27Å; S478-F480 PolarHBondContact O-N 2.91Å; F480-A482 PolarHBondContact O-N 3.31Å; F480-F499 VanDerWaalsContact O-CD1 3.31Å; F480-F499 WeakPolarHBondContact O-CD1 3.49Å; F480-F499 WeakPolarHBondContact O-CE1 3.35Å; F480-A500 HydrophobicContact CB-CB 4.1Å; F480-L503 HydrophobicContact CD1-CB 3.8Å; F480-L503 HydrophobicContact CE1-CB 4.18Å; F480-L514 HydrophobicContact CD1-CD1 4.24Å; F480-L514 HydrophobicContact CE1-CD1 3.73Å; F480-L514 HydrophobicContact CZ-CD1 3.97Å
481	L	98.3	Very high	94	Very high	11 Å²	11	56.8 Å²	56.8	6%	0.058	29%	0.291	C	S	.	.			trans	-57.7	129.3	-179.7	-170.7	66.1	0	0	0	113.1	E475 D477 V485 L486 R525	E475-L481 HydrophobicContact CB-CD2 4.46Å; E475-L481 HydrophobicContact CG-CD2 4.4Å; D477-L481 PolarHBondContact O-N 3.45Å; L481-V485 HydrophobicContact CD1-CB 3.87Å; L481-V485 HydrophobicContact CD1-CG1 3.76Å; L481-L486 HydrophobicContact CD2-CB 4.15Å; L481-L486 HydrophobicContact CD2-CD1 4.32Å; L481-R525 VanDerWaalsContact O-CZ 3.29Å; L481-R525 PolarHBondContact O-NE 2.82Å; L481-R525 PolarHBondContact O-NH2 3.49Å
482	A	98.1	Very high	94.6	Very high	2 Å²	2	57.2 Å²	57.2	2%	0.017	29%	0.289	C	S	.	.			trans	-81.1	150.8	176.5	0	0	0	0	0	111.8	F480 E484 V485 L486 A496 F499	F480-A482 PolarHBondContact O-N 3.31Å; A482-E484 VanDerWaalsContact C-N 3.34Å; A482-E484 WeakPolarHBondContact CB-OE1 3.33Å; A482-E484 WeakPolarHBondContact CB-OE2 3.43Å; A482-E484 PolarHBondContact O-N 2.85Å; A482-V485 HydrophobicContact CB-CG2 4.45Å; A482-V485 PolarHBondContact O-N 3.19Å; A482-L486 PolarHBondContact O-N 2.93Å; A482-A496 HydrophobicContact CB-CB 4.17Å; A482-F499 HydrophobicContact CB-CB 4.05Å; A482-F499 HydrophobicContact CB-CD1 3.66Å; A482-F499 HydrophobicContact CB-CD2 4.25Å; A482-F499 HydrophobicContact CB-CE1 4.14Å; A482-F499 HydrophobicContact CB-CG 3.74Å
483	N	97.8	Very high	95.1	Very high	39 Å²	39	51.2 Å²	51.2	21%	0.209	26%	0.26	C	S	.	.	H	α-helix	trans	-64.1	-37.4	-169.4	-161.9	82	0	0	0	113.3	V485 L486 Q487 R525	N483-V485 VanDerWaalsContact C-N 3.26Å; N483-V485 PolarHBondContact O-N 3.29Å; N483-L486 PolarHBondContact O-N 2.95Å; N483-Q487 PolarHBondContact ND2-NE2 3.19Å; N483-Q487 PolarHBondContact ND2-OE1 3.32Å; N483-Q487 WeakPolarHBondContact O-CG 3.2Å; N483-Q487 PolarHBondContact O-N 2.79Å; N483-Q487 VanDerWaalsContact O-N 3.08Å; N483-R525 HydrophobicContact CB-CB 4Å; N483-R525 HydrophobicContact CB-CG 3.78Å
484	E	97.8	Very high	95.8	Very high	9 Å²	9	50.9 Å²	50.9	4%	0.042	26%	0.259	C	S	.	.	H	α-helix	trans	-64.5	-31	-179.3	70.3	-76.1	-179.6	0	0	112.5	A482 Q487 E488 N489 P552 R555	A482-E484 VanDerWaalsContact C-N 3.34Å; A482-E484 WeakPolarHBondContact CB-OE1 3.33Å; A482-E484 WeakPolarHBondContact CB-OE2 3.43Å; A482-E484 PolarHBondContact O-N 2.85Å; E484-Q487 CarbonylContact O-C 3.28Å; E484-Q487 PolarHBondContact O-N 2.82Å; E484-E488 PolarHBondContact O-N 3.47Å; E484-N489 HydrophobicContact CB-CB 4.32Å; E484-N489 WeakPolarHBondContact O-CA 3.35Å; E484-N489 WeakPolarHBondContact O-CB 3.49Å; E484-N489 PolarHBondContact O-N 2.89Å; E484-P552 HydrophobicContact CB-CG 4.16Å; E484-P552 HydrophobicContact CG-CG 3.69Å; E484-R555 IonicContact OE1-CZ 2.72Å; E484-R555 IonicContact OE1-NH1 3.44Å; E484-R555 PolarHBondContact OE1-NH1 3.39Å; E484-R555 IonicContact OE1-NH2 3.56Å; E484-R555 PolarHBondContact OE1-NH2 2.81Å; E484-R555 IonicContact OE2-CZ 2.66Å; E484-R555 IonicContact OE2-NH1 2.66Å; E484-R555 IonicContact OE2-NH2 3.34Å; E484-R555 PolarHBondContact OE2-NH2 3.15Å
485	V	97.3	Very high	96.4	Very high	1 Å²	1	49.9 Å²	49.9	1%	0.006	25%	0.254	C	S	.	.	H	α-helix	trans	-71.4	-42.1	177.6	-173.8	0	0	0	0	110.4	M423 V473 L481 A482 N483 Q487 E488 Y490 L493 A496	M423-V485 HydrophobicContact CE-CG1 3.71Å; M423-V485 HydrophobicContact CE-CG2 4.14Å; V473-V485 HydrophobicContact CG1-CG1 4.1Å; L481-V485 HydrophobicContact CD1-CB 3.87Å; L481-V485 HydrophobicContact CD1-CG1 3.76Å; A482-V485 HydrophobicContact CB-CG2 4.45Å; A482-V485 PolarHBondContact O-N 3.19Å; N483-V485 VanDerWaalsContact C-N 3.26Å; N483-V485 PolarHBondContact O-N 3.29Å; V485-Q487 PolarHBondContact O-N 2.95Å; V485-E488 PolarHBondContact O-N 3.08Å; V485-Y490 HydrophobicContact CG1-CE1 4.12Å; V485-L493 HydrophobicContact CG2-CD2 4.23Å; V485-A496 HydrophobicContact CG2-CB 3.62Å
486	L	95.5	Very high	96.9	Very high	78 Å²	78	44.9 Å²	44.9	41%	0.408	23%	0.232	S	C	.	.	H	α-helix	trans	-66.1	-19.9	173.2	-175.1	63.5	0	0	0	112.7	L481 A482 N483 E488 W521	L481-L486 HydrophobicContact CD2-CB 4.15Å; L481-L486 HydrophobicContact CD2-CD1 4.32Å; A482-L486 PolarHBondContact O-N 2.93Å; N483-L486 PolarHBondContact O-N 2.95Å; L486-E488 VanDerWaalsContact C-N 3.32Å; L486-W521 HydrophobicContact CD2-CH2 3.57Å; L486-W521 HydrophobicContact CD2-CZ2 4.03Å; L486-W521 HydrophobicContact CD2-CZ3 4.32Å
487	Q	95.9	Very high	97.3	Very high	135 Å²	135	44.4 Å²	44.4	63%	0.631	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.2	14.4	172.9	-69.7	177.2	-39.1	0	0	113.1	N483 E484 V485 N489	N483-Q487 PolarHBondContact ND2-NE2 3.19Å; N483-Q487 PolarHBondContact ND2-OE1 3.32Å; N483-Q487 WeakPolarHBondContact O-CG 3.2Å; N483-Q487 PolarHBondContact O-N 2.79Å; N483-Q487 VanDerWaalsContact O-N 3.08Å; E484-Q487 CarbonylContact O-C 3.28Å; E484-Q487 PolarHBondContact O-N 2.82Å; V485-Q487 PolarHBondContact O-N 2.95Å; Q487-N489 PolarHBondContact O-N 3.04Å; Q487-N489 VanDerWaalsContact O-N 3.08Å
488	E	95.6	Very high	97.5	Very high	148 Å²	148	42.7 Å²	42.7	69%	0.692	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.6	15.8	-178.4	-54.7	-177.9	149.5	0	0	114.2	E484 V485 L486 Y490	E484-E488 PolarHBondContact O-N 3.47Å; V485-E488 PolarHBondContact O-N 3.08Å; L486-E488 VanDerWaalsContact C-N 3.32Å; E488-Y490 PolarHBondContact O-N 3.42Å
489	N	95.9	Very high	97.5	Very high	67 Å²	67	40.7 Å²	40.7	36%	0.358	20%	0.204	S	C	.	.			trans	-89.3	90.5	178.8	-179.4	6.5	0	0	0	111.2	E484 Q487 S491	E484-N489 HydrophobicContact CB-CB 4.32Å; E484-N489 WeakPolarHBondContact O-CA 3.35Å; E484-N489 WeakPolarHBondContact O-CB 3.49Å; E484-N489 PolarHBondContact O-N 2.89Å; Q487-N489 PolarHBondContact O-N 3.04Å; Q487-N489 VanDerWaalsContact O-N 3.08Å; N489-S491 VanDerWaalsContact C-N 3.31Å; N489-S491 PolarHBondContact O-N 3.26Å; N489-S491 VanDerWaalsContact OD1-CB 3.29Å; N489-S491 WeakPolarHBondContact OD1-CB 3.4Å; N489-S491 PolarHBondContact OD1-N 3.23Å; N489-S491 PolarHBondContact OD1-OG 2.78Å
490	Y	96.3	Very high	97.6	Very high	66 Å²	66	37.5 Å²	37.5	26%	0.259	19%	0.193	S	C	.	.	G	3₁₀ helix	trans	-88.2	12.9	-177.6	-48.9	-38.7	0	0	0	114.5	P471 V473 V485 E488 H492 L493	P471-Y490 HydrophobicContact CG-CD2 4.25Å; P471-Y490 HydrophobicContact CG-CG 4.44Å; V473-Y490 HydrophobicContact CB-CE1 4.03Å; V473-Y490 HydrophobicContact CB-CE2 4.26Å; V473-Y490 HydrophobicContact CG1-CE1 4.02Å; V473-Y490 HydrophobicContact CG2-CD1 3.8Å; V473-Y490 HydrophobicContact CG2-CD2 3.93Å; V473-Y490 HydrophobicContact CG2-CE1 3.79Å; V473-Y490 HydrophobicContact CG2-CE2 3.94Å; V473-Y490 HydrophobicContact CG2-CG 3.87Å; V485-Y490 HydrophobicContact CG1-CE1 4.12Å; E488-Y490 PolarHBondContact O-N 3.42Å; Y490-H492 PolarHBondContact O-N 3Å; Y490-H492 VanDerWaalsContact O-N 3.16Å; Y490-L493 HydrophobicContact CD1-CD2 3.8Å; Y490-L493 HydrophobicContact CG-CD2 4.24Å
491	S	95.7	Very high	97.6	Very high	87 Å²	87	37.1 Å²	37.1	61%	0.608	19%	0.191	S	C	*	.	G	3₁₀ helix	trans	-62.5	-24.3	-176.1	-50.4	0	0	0	0	114.1	N489	N489-S491 VanDerWaalsContact C-N 3.31Å; N489-S491 PolarHBondContact O-N 3.26Å; N489-S491 VanDerWaalsContact OD1-CB 3.29Å; N489-S491 WeakPolarHBondContact OD1-CB 3.4Å; N489-S491 PolarHBondContact OD1-N 3.23Å; N489-S491 PolarHBondContact OD1-OG 2.78Å
492	H	97	Very high	97.6	Very high	56 Å²	56	36.6 Å²	36.6	26%	0.259	19%	0.188	S	C	.	.	G	3₁₀ helix	trans	-134.6	34.8	-173.3	-50.4	-74.7	0	0	0	113.7	Y490 P494 K495 P552 E553	Y490-H492 PolarHBondContact O-N 3Å; Y490-H492 VanDerWaalsContact O-N 3.16Å; H492-P494 VanDerWaalsContact C-N 3.3Å; H492-P494 WeakPolarHBondContact O-CD 3.49Å; H492-K495 HydrophobicContact CB-CB 4.35Å; H492-K495 HydrophobicContact CB-CG 4.02Å; H492-K495 VanDerWaalsContact O-CB 3.25Å; H492-K495 WeakPolarHBondContact O-CB 3.44Å; H492-K495 PolarHBondContact O-N 3.3Å; H492-P552 HydrophobicContact CB-CB 3.9Å; H492-E553 IonicContact CE1-OE1 3.44Å; H492-E553 PolarHBondContact CE1-OE1 3.25Å; H492-E553 IonicContact ND1-OE1 3.27Å; H492-E553 IonicContact NE2-OE1 3.49Å
493	L	97.7	Very high	97.6	Very high	2 Å²	2	36.5 Å²	36.5	1%	0.01	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-45.1	-37.9	-175.7	-66.7	-176.3	0	0	0	116.4	V421 M423 T466 P471 V473 V485 Y490 K495 A496	V421-L493 HydrophobicContact CB-CB 4.36Å; V421-L493 HydrophobicContact CG1-CB 3.91Å; V421-L493 HydrophobicContact CG2-CB 4Å; V421-L493 HydrophobicContact CG2-CD1 4Å; M423-L493 HydrophobicContact CE-CD2 3.83Å; M423-L493 HydrophobicContact SD-CB 4.14Å; M423-L493 HydrophobicContact SD-CD1 4.17Å; M423-L493 HydrophobicContact SD-CD2 3.92Å; M423-L493 HydrophobicContact SD-CG 4.3Å; T466-L493 HydrophobicContact CG2-CD1 4.22Å; P471-L493 HydrophobicContact CB-CD1 3.6Å; P471-L493 HydrophobicContact CG-CD1 4.42Å; V473-L493 HydrophobicContact CG2-CD1 4.05Å; V485-L493 HydrophobicContact CG2-CD2 4.23Å; Y490-L493 HydrophobicContact CD1-CD2 3.8Å; Y490-L493 HydrophobicContact CG-CD2 4.24Å; L493-K495 PolarHBondContact O-N 3.23Å; L493-A496 WeakPolarHBondContact O-CB 3.39Å; L493-A496 PolarHBondContact O-N 3.48Å
494	P	98.6	Very high	97.7	Very high	29 Å²	29	34.6 Å²	34.6	19%	0.188	18%	0.178	C	C	.	.	H	α-helix	trans	-57.6	-21.2	174.8	-27.6	36.6	0	0	0	114.9	H416 V421 I468 H492 I498	H416-P494 PolarHBondContact CE1-O 3.37Å; H416-P494 VanDerWaalsContact CE1-O 3.24Å; V421-P494 HydrophobicContact CG1-CB 4.19Å; V421-P494 HydrophobicContact CG1-CG 3.67Å; I468-P494 HydrophobicContact CD1-CG 3.57Å; I468-P494 HydrophobicContact CG1-CG 3.99Å; H492-P494 VanDerWaalsContact C-N 3.3Å; H492-P494 WeakPolarHBondContact O-CD 3.49Å; P494-I498 WeakPolarHBondContact O-CG1 3.32Å
495	K	98.7	Very high	97.7	Very high	33 Å²	33	34.2 Å²	34.2	14%	0.143	18%	0.176	C	C	.	.	H	α-helix	trans	-84.5	-15.5	176.7	-54	-60.8	-160.9	77.8	0	112.8	H492 L493 F499 P552 E553 R555	H492-K495 HydrophobicContact CB-CB 4.35Å; H492-K495 HydrophobicContact CB-CG 4.02Å; H492-K495 VanDerWaalsContact O-CB 3.25Å; H492-K495 WeakPolarHBondContact O-CB 3.44Å; H492-K495 PolarHBondContact O-N 3.3Å; L493-K495 PolarHBondContact O-N 3.23Å; K495-F499 PolarHBondContact O-N 3.49Å; K495-P552 HydrophobicContact CB-CB 3.8Å; K495-P552 HydrophobicContact CG-CB 4.22Å; K495-P552 VanDerWaalsContact CG-O 3.3Å; K495-P552 WeakPolarHBondContact CG-O 3.42Å; K495-P552 PolarHBondContact NZ-O 3.34Å; K495-E553 PolarHBondContact NZ-O 2.9Å; K495-R555 HydrophobicContact CD-CB 4.35Å; K495-R555 WeakPolarHBondContact CE-O 3.49Å; K495-R555 PolarHBondContact NZ-O 3.36Å; K495-R555 WeakPolarHBondContact O-CD 3.4Å; K495-R555 PolarHBondContact O-NH1 3.44Å
496	A	98.6	Very high	97.8	Very high	8 Å²	8	34.1 Å²	34.1	7%	0.066	18%	0.175	C	C	.	.	H	α-helix	trans	-74.3	-42.5	170.5	0	0	0	0	0	110.8	A482 V485 L493 I498 F499 A500	A482-A496 HydrophobicContact CB-CB 4.17Å; V485-A496 HydrophobicContact CG2-CB 3.62Å; L493-A496 WeakPolarHBondContact O-CB 3.39Å; L493-A496 PolarHBondContact O-N 3.48Å; A496-I498 PolarHBondContact O-N 3.11Å; A496-F499 WeakPolarHBondContact O-CB 3.3Å; A496-F499 PolarHBondContact O-N 2.75Å; A496-A500 WeakPolarHBondContact O-CB 3.32Å; A496-A500 PolarHBondContact O-N 2.7Å
497	D	98.8	Very high	97.9	Very high	1 Å²	1	31.3 Å²	31.3	1%	0.005	16%	0.162	C	C	.	.	H	α-helix	trans	-57.3	-35.9	172.2	-71.5	-24.7	0	0	0	112.1	L412 H416 H422 M423 I425 L501	L412-D497 HydrophobicContact CD1-CB 3.9Å; L412-D497 HydrophobicContact CD2-CB 3.78Å; L412-D497 HydrophobicContact CG-CB 4.48Å; H416-D497 IonicContact CD2-OD2 3.92Å; H416-D497 IonicContact CE1-OD2 3.18Å; H416-D497 IonicContact NE2-OD2 3.96Å; H416-D497 PolarHBondContact NE2-OD2 2.81Å; H422-D497 WeakPolarHBondContact CB-OD1 3.28Å; H422-D497 PolarHBondContact N-OD1 3.24Å; H422-D497 PolarHBondContact N-OD2 3.4Å; M423-D497 PolarHBondContact N-OD1 2.91Å; I425-D497 HydrophobicContact CG1-CB 4.38Å; D497-L501 VanDerWaalsContact O-CB 3.27Å; D497-L501 WeakPolarHBondContact O-CB 3.44Å; D497-L501 PolarHBondContact O-N 3.47Å
498	I	98.9	Very high	98	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-69.6	-43.3	177.2	-65.9	-72.5	0	0	0	111.8	L412 P494 A496 L501 A502 M547 R555 P556 A558 L561	L412-I498 HydrophobicContact CD1-CD1 4.36Å; P494-I498 WeakPolarHBondContact O-CG1 3.32Å; A496-I498 PolarHBondContact O-N 3.11Å; I498-L501 PolarHBondContact O-N 2.77Å; I498-A502 PolarHBondContact O-N 2.97Å; I498-M547 HydrophobicContact CG2-CB 3.93Å; I498-M547 HydrophobicContact CG2-CE 3.98Å; I498-M547 HydrophobicContact CG2-CG 3.81Å; I498-M547 WeakPolarHBondContact O-CE 3.42Å; I498-R555 HydrophobicContact CG2-CB 4.26Å; I498-P556 WeakPolarHBondContact CG1-O 3.32Å; I498-P556 HydrophobicContact CG2-CG 4.38Å; I498-A558 HydrophobicContact CD1-CB 4.14Å; I498-L561 HydrophobicContact CD1-CD2 3.9Å
499	F	98.9	Very high	98.2	Very high	1 Å²	1	17.9 Å²	17.9	0%	0.004	10%	0.1	C	C	.	.	H	α-helix	trans	-60.6	-47	174.4	177.1	-80.9	0	0	0	110.9	F480 A482 K495 A496 L501 A502 L503 I524 R525 M547 I548	F480-F499 VanDerWaalsContact O-CD1 3.31Å; F480-F499 WeakPolarHBondContact O-CD1 3.49Å; F480-F499 WeakPolarHBondContact O-CE1 3.35Å; A482-F499 HydrophobicContact CB-CB 4.05Å; A482-F499 HydrophobicContact CB-CD1 3.66Å; A482-F499 HydrophobicContact CB-CD2 4.25Å; A482-F499 HydrophobicContact CB-CE1 4.14Å; A482-F499 HydrophobicContact CB-CG 3.74Å; K495-F499 PolarHBondContact O-N 3.49Å; A496-F499 WeakPolarHBondContact O-CB 3.3Å; A496-F499 PolarHBondContact O-N 2.75Å; F499-L501 PolarHBondContact O-N 2.96Å; F499-A502 PolarHBondContact O-N 3.44Å; F499-L503 HydrophobicContact CD1-CD1 3.96Å; F499-L503 HydrophobicContact CE1-CD1 3.38Å; F499-L503 HydrophobicContact CE1-CG 4.33Å; F499-L503 HydrophobicContact CZ-CD1 3.96Å; F499-L503 PolarHBondContact O-N 3.16Å; F499-I524 HydrophobicContact CZ-CG2 4.19Å; F499-R525 HydrophobicContact CE2-CG 4.47Å; F499-R525 HydrophobicContact CZ-CG 3.89Å; F499-M547 WeakPolarHBondContact CA-O 3.3Å; F499-I548 HydrophobicContact CD2-CB 3.94Å; F499-I548 HydrophobicContact CD2-CG2 4.21Å; F499-I548 HydrophobicContact CE2-CB 3.91Å; F499-I548 HydrophobicContact CE2-CG2 4.33Å
500	A	98.9	Very high	98.2	Very high	6 Å²	6	15.8 Å²	15.8	5%	0.05	9%	0.093	C	C	.	.	H	α-helix	trans	-64.8	-36.3	177.7	0	0	0	0	0	112.9	I425 F480 A496 L503 T504	I425-A500 HydrophobicContact CB-CB 3.91Å; I425-A500 HydrophobicContact CG2-CB 4.3Å; F480-A500 HydrophobicContact CB-CB 4.1Å; A496-A500 WeakPolarHBondContact O-CB 3.32Å; A496-A500 PolarHBondContact O-N 2.7Å; A500-L503 PolarHBondContact O-N 3.13Å; A500-T504 WeakPolarHBondContact O-CB 3.43Å; A500-T504 PolarHBondContact O-N 2.96Å; A500-T504 PolarHBondContact O-OG1 2.85Å
501	L	98.9	Very high	98.2	Very high	0 Å²	0	13.1 Å²	13.1	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-65.4	-41.6	173.6	178.2	54.5	0	0	0	112.4	L405 V408 L412 I425 D497 I498 F499 T504 V505 M547 L561	L405-L501 HydrophobicContact CD1-CD1 4.48Å; L405-L501 HydrophobicContact CD1-CD2 3.85Å; L405-L501 HydrophobicContact CD1-CG 3.88Å; V408-L501 HydrophobicContact CB-CD1 3.86Å; V408-L501 HydrophobicContact CB-CD2 4.46Å; V408-L501 HydrophobicContact CG1-CD1 3.54Å; V408-L501 HydrophobicContact CG1-CD2 4.18Å; V408-L501 HydrophobicContact CG1-CG 4.49Å; L412-L501 HydrophobicContact CD1-CB 4.24Å; L412-L501 HydrophobicContact CD1-CD2 3.75Å; I425-L501 HydrophobicContact CG2-CB 4.21Å; D497-L501 VanDerWaalsContact O-CB 3.27Å; D497-L501 WeakPolarHBondContact O-CB 3.44Å; D497-L501 PolarHBondContact O-N 3.47Å; I498-L501 PolarHBondContact O-N 2.77Å; F499-L501 PolarHBondContact O-N 2.96Å; L501-T504 WeakPolarHBondContact O-CB 3.49Å; L501-T504 PolarHBondContact O-N 3.01Å; L501-V505 HydrophobicContact CD1-CG2 4.23Å; L501-V505 WeakPolarHBondContact O-CG2 3.17Å; L501-V505 PolarHBondContact O-N 3.32Å; L501-M547 HydrophobicContact CB-CE 4.2Å; L501-M547 HydrophobicContact CD2-CE 4.3Å; L501-M547 HydrophobicContact CG-CE 4.08Å; L501-L561 HydrophobicContact CD2-CD2 3.98Å
502	A	98.9	Very high	98.2	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-61.3	-48	175.3	0	0	0	0	0	111.5	I498 F499 T504 V505 I506 L544 M547 I548	I498-A502 PolarHBondContact O-N 2.97Å; F499-A502 PolarHBondContact O-N 3.44Å; A502-T504 VanDerWaalsContact C-N 3.25Å; A502-T504 PolarHBondContact O-N 3.28Å; A502-V505 PolarHBondContact O-N 3.4Å; A502-V505 VanDerWaalsContact O-N 3.13Å; A502-I506 VanDerWaalsContact O-CD1 3.28Å; A502-I506 WeakPolarHBondContact O-CD1 3.43Å; A502-I506 WeakPolarHBondContact O-CG1 3.33Å; A502-I506 PolarHBondContact O-N 2.83Å; A502-L544 HydrophobicContact CB-CD2 4.11Å; A502-M547 HydrophobicContact CB-CB 3.59Å; A502-M547 HydrophobicContact CB-CE 3.91Å; A502-M547 HydrophobicContact CB-SD 4.33Å; A502-I548 HydrophobicContact CB-CG2 3.62Å
503	L	98.9	Very high	98.1	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-60.5	-34.6	176	-68	-178.1	0	0	0	112.8	F480 F499 A500 I506 C507 L514 I524 P530 I548	F480-L503 HydrophobicContact CD1-CB 3.8Å; F480-L503 HydrophobicContact CE1-CB 4.18Å; F499-L503 HydrophobicContact CD1-CD1 3.96Å; F499-L503 HydrophobicContact CE1-CD1 3.38Å; F499-L503 HydrophobicContact CE1-CG 4.33Å; F499-L503 HydrophobicContact CZ-CD1 3.96Å; F499-L503 PolarHBondContact O-N 3.16Å; A500-L503 PolarHBondContact O-N 3.13Å; L503-I506 HydrophobicContact CD2-CD1 4.18Å; L503-I506 PolarHBondContact O-N 3.03Å; L503-C507 PolarHBondContact O-N 3.22Å; L503-C507 PolarHBondContact O-SG 2.98Å; L503-C507 VanDerWaalsContact O-SG 3.41Å; L503-L514 HydrophobicContact CB-CD1 3.92Å; L503-L514 HydrophobicContact CD2-CD1 4.47Å; L503-I524 HydrophobicContact CD1-CG2 4.11Å; L503-I524 HydrophobicContact CD2-CG2 3.68Å; L503-P530 HydrophobicContact CD2-CG 4.22Å; L503-I548 HydrophobicContact CD2-CG2 4.15Å; L503-I548 HydrophobicContact CG-CG2 4.19Å
504	T	98.9	Very high	98.1	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-63.3	-44.6	172.9	-66.2	0	0	0	0	112.5	L382 K426 P427 I430 A500 L501 A502 I506 C507 A508	L382-T504 HydrophobicContact CD2-CG2 3.87Å; K426-T504 WeakPolarHBondContact CA-OG1 3.35Å; P427-T504 HydrophobicContact CG-CG2 4.04Å; I430-T504 HydrophobicContact CD1-CG2 3.5Å; A500-T504 WeakPolarHBondContact O-CB 3.43Å; A500-T504 PolarHBondContact O-N 2.96Å; A500-T504 PolarHBondContact O-OG1 2.85Å; L501-T504 WeakPolarHBondContact O-CB 3.49Å; L501-T504 PolarHBondContact O-N 3.01Å; A502-T504 VanDerWaalsContact C-N 3.25Å; A502-T504 PolarHBondContact O-N 3.28Å; T504-I506 VanDerWaalsContact C-N 3.33Å; T504-C507 PolarHBondContact O-N 2.99Å; T504-A508 PolarHBondContact O-N 3.34Å; T504-A508 VanDerWaalsContact O-N 3.11Å
505	V	98.8	Very high	98.1	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-68.2	-34.3	175.8	175.5	0	0	0	0	111.1	L401 L404 L405 L501 A502 A508 A509 L544	L401-V505 HydrophobicContact CB-CG1 4.17Å; L401-V505 HydrophobicContact CD2-CG1 3.98Å; L404-V505 HydrophobicContact CD2-CG2 4.12Å; L404-V505 HydrophobicContact CG-CG2 4.28Å; L405-V505 HydrophobicContact CB-CG2 4.01Å; L405-V505 HydrophobicContact CD1-CG2 4.19Å; L501-V505 HydrophobicContact CD1-CG2 4.23Å; L501-V505 WeakPolarHBondContact O-CG2 3.17Å; L501-V505 PolarHBondContact O-N 3.32Å; A502-V505 PolarHBondContact O-N 3.4Å; A502-V505 VanDerWaalsContact O-N 3.13Å; V505-A508 CarbonylContact O-C 3.51Å; V505-A508 WeakPolarHBondContact O-CA 3.46Å; V505-A508 WeakPolarHBondContact O-CB 3.37Å; V505-A508 PolarHBondContact O-N 2.86Å; V505-A508 VanDerWaalsContact O-N 3.12Å; V505-A509 PolarHBondContact O-N 3.46Å; V505-L544 HydrophobicContact CB-CD2 4.03Å; V505-L544 HydrophobicContact CG1-CD1 4.43Å; V505-L544 HydrophobicContact CG1-CD2 3.96Å
506	I	98.5	Very high	98	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-66.7	-37.7	175.9	-67.6	157.1	0	0	0	111.2	A502 L503 T504 A509 A511 L529 P530 I532 L544	A502-I506 VanDerWaalsContact O-CD1 3.28Å; A502-I506 WeakPolarHBondContact O-CD1 3.43Å; A502-I506 WeakPolarHBondContact O-CG1 3.33Å; A502-I506 PolarHBondContact O-N 2.83Å; L503-I506 HydrophobicContact CD2-CD1 4.18Å; L503-I506 PolarHBondContact O-N 3.03Å; T504-I506 VanDerWaalsContact C-N 3.33Å; I506-A509 PolarHBondContact O-N 3.5Å; I506-A511 HydrophobicContact CG2-CB 3.6Å; I506-A511 VanDerWaalsContact O-CB 3.22Å; I506-A511 WeakPolarHBondContact O-CB 3.32Å; I506-A511 PolarHBondContact O-N 3.45Å; I506-L529 HydrophobicContact CD1-CD2 3.4Å; I506-L529 HydrophobicContact CG1-CD2 4.33Å; I506-P530 HydrophobicContact CG2-CB 3.87Å; I506-P530 HydrophobicContact CG2-CG 3.91Å; I506-I532 HydrophobicContact CG1-CD1 4.34Å; I506-I532 HydrophobicContact CG2-CD1 4.37Å; I506-I532 HydrophobicContact CG2-CG1 4.17Å; I506-L544 HydrophobicContact CD1-CB 4.5Å; I506-L544 HydrophobicContact CG1-CD1 4.21Å
507	C	98.4	Very high	98	Very high	18 Å²	18	30.6 Å²	30.6	12%	0.122	16%	0.162	C	C	.	.	H	α-helix	trans	-61.6	-42.4	167.5	-68.7	0	0	0	0	112.2	I386 P427 L503 T504 A509 G510 L514	I386-C507 HydrophobicContact CD1-CB 4.05Å; P427-C507 HydrophobicContact CG-CB 4.19Å; L503-C507 PolarHBondContact O-N 3.22Å; L503-C507 PolarHBondContact O-SG 2.98Å; L503-C507 VanDerWaalsContact O-SG 3.41Å; T504-C507 PolarHBondContact O-N 2.99Å; C507-A509 PolarHBondContact O-N 2.66Å; C507-G510 PolarHBondContact O-N 2.66Å; C507-G510 VanDerWaalsContact O-N 3.1Å; C507-L514 VanDerWaalsContact SG-CD1 3.57Å
508	A	98.3	Very high	97.9	Very high	2 Å²	2	32.3 Å²	32.3	2%	0.017	18%	0.18	C	C	.	.	H	α-helix	trans	-63.5	-30.6	176.7	0	0	0	0	0	112.8	I386 F396 L401 L404 T504 V505 G510	I386-A508 HydrophobicContact CD1-CB 4Å; I386-A508 HydrophobicContact CG1-CB 4.36Å; F396-A508 HydrophobicContact CD2-CB 3.83Å; F396-A508 WeakPolarHBondContact CD2-O 3.36Å; F396-A508 HydrophobicContact CE2-CB 4.44Å; F396-A508 HydrophobicContact CG-CB 4.46Å; F396-A508 PolarHBondContact N-O 3.04Å; L401-A508 HydrophobicContact CD2-CB 3.59Å; L404-A508 HydrophobicContact CD2-CB 3.7Å; T504-A508 PolarHBondContact O-N 3.34Å; T504-A508 VanDerWaalsContact O-N 3.11Å; V505-A508 CarbonylContact O-C 3.51Å; V505-A508 WeakPolarHBondContact O-CA 3.46Å; V505-A508 WeakPolarHBondContact O-CB 3.37Å; V505-A508 PolarHBondContact O-N 2.86Å; V505-A508 VanDerWaalsContact O-N 3.12Å; A508-G510 PolarHBondContact O-N 3.12Å
509	A	98.1	Very high	97.9	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-1.1	175.4	0	0	0	0	0	114	L401 V505 I506 C507 I532 Q534 L536	L401-A509 HydrophobicContact CD1-CB 3.65Å; L401-A509 HydrophobicContact CD2-CB 4.09Å; V505-A509 PolarHBondContact O-N 3.46Å; I506-A509 PolarHBondContact O-N 3.5Å; C507-A509 PolarHBondContact O-N 2.66Å; A509-I532 HydrophobicContact CB-CD1 4.29Å; A509-I532 HydrophobicContact CB-CG1 4.41Å; A509-I532 HydrophobicContact CB-CG2 3.77Å; A509-Q534 PolarHBondContact O-NE2 2.96Å; A509-L536 HydrophobicContact CB-CD1 4.48Å
510	G	96.6	Very high	97.8	Very high	22 Å²	22	44.7 Å²	44.7	23%	0.227	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	91.7	15.3	177.1	0	0	0	0	0	115.1	C507 A508 P533	C507-G510 PolarHBondContact O-N 2.66Å; C507-G510 VanDerWaalsContact O-N 3.1Å; A508-G510 PolarHBondContact O-N 3.12Å; G510-P533 VanDerWaalsContact C-CD 3.47Å; G510-P533 VanDerWaalsContact O-CD 3.28Å; G510-P533 WeakPolarHBondContact O-CD 3.5Å; G510-P533 VanDerWaalsContact O-CG 3.3Å; G510-P533 WeakPolarHBondContact O-CG 3.33Å
511	A	96.6	Very high	97.8	Very high	10 Å²	10	44.9 Å²	44.9	8%	0.083	24%	0.242	C	C	.	.			trans	-61	153.7	175.6	0	0	0	0	0	112.9	I506 P530 R531	I506-A511 HydrophobicContact CG2-CB 3.6Å; I506-A511 VanDerWaalsContact O-CB 3.22Å; I506-A511 WeakPolarHBondContact O-CB 3.32Å; I506-A511 PolarHBondContact O-N 3.45Å; A511-P530 HydrophobicContact CB-CB 4.41Å; A511-R531 WeakPolarHBondContact CA-O 3.41Å; A511-R531 VanDerWaalsContact CB-O 3.25Å; A511-R531 WeakPolarHBondContact CB-O 3.4Å
512	E	94.8	Very high	97.8	Very high	137 Å²	137	49.4 Å²	49.4	64%	0.64	26%	0.263	S	S	*	.			trans	-57.3	153.3	176.2	-70.3	179.6	-175.1	0	0	112.4	L514	E512-L514 PolarHBondContact O-N 2.99Å; E512-L514 VanDerWaalsContact O-N 3.07Å
513	P	96.1	Very high	97.8	Very high	112 Å²	112	52.9 Å²	52.9	73%	0.727	28%	0.279	S	S	*	.			trans	-54.2	115.5	-178.8	-27.2	35.5	0	0	0	112.8
514	L	98	Very high	97.8	Very high	11 Å²	11	53.4 Å²	53.4	6%	0.058	28%	0.281	C	S	.	.			trans	-55.7	137.2	-172.4	-64.4	179.1	0	0	0	112.8	R479 F480 L503 C507 E512 I524 P530	R479-L514 HydrophobicContact CB-CB 4.03Å; R479-L514 WeakPolarHBondContact CD-O 3.48Å; R479-L514 HydrophobicContact CG-CB 4.46Å; R479-L514 WeakPolarHBondContact CG-O 3.28Å; F480-L514 HydrophobicContact CD1-CD1 4.24Å; F480-L514 HydrophobicContact CE1-CD1 3.73Å; F480-L514 HydrophobicContact CZ-CD1 3.97Å; L503-L514 HydrophobicContact CB-CD1 3.92Å; L503-L514 HydrophobicContact CD2-CD1 4.47Å; C507-L514 VanDerWaalsContact SG-CD1 3.57Å; E512-L514 PolarHBondContact O-N 2.99Å; E512-L514 VanDerWaalsContact O-N 3.07Å; L514-I524 HydrophobicContact CD2-CD1 4.34Å; L514-P530 HydrophobicContact CD2-CB 4.25Å; L514-P530 HydrophobicContact CD2-CG 3.78Å
515	P	97.9	Very high	97.7	Very high	23 Å²	23	53.9 Å²	53.9	15%	0.149	28%	0.283	C	S	.	.			trans	-65.2	146.2	-178.9	28.7	-36.8	0	0	0	111	Q520 W521 I524	P515-Q520 HydrophobicContact CB-CB 4.19Å; P515-Q520 HydrophobicContact CG-CB 3.9Å; P515-W521 HydrophobicContact CB-CB 4.33Å; P515-W521 HydrophobicContact CG-CB 4.16Å; P515-I524 HydrophobicContact CG-CD1 3.84Å
516	R	97.4	Very high	97.7	Very high	174 Å²	174	59.1 Å²	59.1	66%	0.657	31%	0.308	S	S	*	.	S	Bend	trans	-85.2	-24.3	176.2	-67.8	-175.3	178	-158.1	-1.7	113.5	S478 R479	S478-R516 PolarHBondContact OG-O 3.39Å; R479-R516 HydrophobicContact CG-CG 3.82Å
517	N	97.3	Very high	97.7	Very high	126 Å²	126	59.8 Å²	59.8	67%	0.674	32%	0.315	S	S	*	.	S	Bend	trans	-170.1	-177.5	-176	53.5	10.7	0	0	0	109.4	W521	N517-W521 VanDerWaalsContact C-CB 3.46Å
518	G	97.6	Very high	97.7	Very high	36 Å²	36	65.3 Å²	65.3	37%	0.371	33%	0.333	S	S	.	.	S	Bend	trans	86.1	-174.7	177.5	0	0	0	0	0	114.3	Q520 W521 H522	G518-Q520 PolarHBondContact O-N 3.41Å; G518-W521 WeakPolarHBondContact O-CA 3.39Å; G518-W521 VanDerWaalsContact O-CB 3.25Å; G518-W521 WeakPolarHBondContact O-CB 3.49Å; G518-W521 PolarHBondContact O-N 3.47Å; G518-H522 PolarHBondContact O-CD2 3.41Å; G518-H522 VanDerWaalsContact O-CD2 3.3Å; G518-H522 PolarHBondContact O-N 2.87Å
519	D	98.1	Very high	97.6	Very high	136 Å²	136	67.4 Å²	67.4	73%	0.727	34%	0.344	S	S	*	.	H	α-helix	trans	-59.9	-45.6	-168.9	-55.9	-52.5	0	0	0	112.8	W521 H522 E523	D519-W521 PolarHBondContact O-N 3.01Å; D519-H522 CarbonylContact O-C 3.59Å; D519-H522 WeakPolarHBondContact O-CA 3.49Å; D519-H522 PolarHBondContact O-N 2.91Å; D519-E523 WeakPolarHBondContact O-CG 3.31Å; D519-E523 PolarHBondContact O-N 3.22Å
520	Q	97.9	Very high	97.5	Very high	126 Å²	126	68.5 Å²	68.5	59%	0.589	35%	0.351	S	S	*	.	H	α-helix	trans	-58.5	-32.2	175.2	-66.5	-179.1	-25.4	0	0	112.8	P515 G518 I524	P515-Q520 HydrophobicContact CB-CB 4.19Å; P515-Q520 HydrophobicContact CG-CB 3.9Å; G518-Q520 PolarHBondContact O-N 3.41Å; Q520-I524 WeakPolarHBondContact O-CD1 3.39Å; Q520-I524 WeakPolarHBondContact O-CG1 3.27Å; Q520-I524 PolarHBondContact O-N 3.11Å
521	W	98.5	Very high	97.5	Very high	10 Å²	10	77.9 Å²	77.9	4%	0.038	38%	0.379	C	S	.	.	H	α-helix	trans	-66.4	-45.8	174.2	-176.5	99.6	0	0	0	110.3	S478 L486 P515 N517 G518 D519 I524 R525	S478-W521 PolarHBondContact O-NE1 2.89Å; L486-W521 HydrophobicContact CD2-CH2 3.57Å; L486-W521 HydrophobicContact CD2-CZ2 4.03Å; L486-W521 HydrophobicContact CD2-CZ3 4.32Å; P515-W521 HydrophobicContact CB-CB 4.33Å; P515-W521 HydrophobicContact CG-CB 4.16Å; N517-W521 VanDerWaalsContact C-CB 3.46Å; G518-W521 WeakPolarHBondContact O-CA 3.39Å; G518-W521 VanDerWaalsContact O-CB 3.25Å; G518-W521 WeakPolarHBondContact O-CB 3.49Å; G518-W521 PolarHBondContact O-N 3.47Å; D519-W521 PolarHBondContact O-N 3.01Å; W521-I524 PolarHBondContact O-N 3.1Å; W521-R525 VanDerWaalsContact CE2-CZ 3.45Å; W521-R525 VanDerWaalsContact CE2-NE 3.32Å; W521-R525 HydrophobicContact CE3-CG 4.4Å; W521-R525 HydrophobicContact CH2-CG 3.9Å; W521-R525 HydrophobicContact CZ2-CG 4.27Å; W521-R525 VanDerWaalsContact CZ2-NE 3.34Å; W521-R525 HydrophobicContact CZ3-CB 4.45Å; W521-R525 HydrophobicContact CZ3-CG 3.98Å; W521-R525 VanDerWaalsContact NE1-CZ 3.27Å; W521-R525 WeakPolarHBondContact O-CD 3.47Å; W521-R525 PolarHBondContact O-N 3.36Å; W521-R525 PolarHBondContact O-NH1 3.22Å
522	H	98.2	Very high	97.5	Very high	95 Å²	95	79.3 Å²	79.3	44%	0.44	39%	0.385	S	S	.	.	H	α-helix	trans	-66.6	-37.7	177.3	-69	-67.9	0	0	0	112.7	G518 D519 I524 R525 Q526	G518-H522 PolarHBondContact O-CD2 3.41Å; G518-H522 VanDerWaalsContact O-CD2 3.3Å; G518-H522 PolarHBondContact O-N 2.87Å; D519-H522 CarbonylContact O-C 3.59Å; D519-H522 WeakPolarHBondContact O-CA 3.49Å; D519-H522 PolarHBondContact O-N 2.91Å; H522-I524 VanDerWaalsContact C-N 3.31Å; H522-I524 PolarHBondContact O-N 2.92Å; H522-R525 CarbonylContact O-C 3.52Å; H522-R525 WeakPolarHBondContact O-CA 3.44Å; H522-R525 PolarHBondContact O-N 2.8Å; H522-R525 VanDerWaalsContact O-N 3.07Å; H522-Q526 WeakPolarHBondContact O-CG 3.39Å; H522-Q526 PolarHBondContact O-N 3.3Å
523	E	98.4	Very high	97.5	Very high	73 Å²	73	76.8 Å²	76.8	34%	0.341	38%	0.381	S	S	.	.	H	α-helix	trans	-56.9	-43.3	174.5	-75.6	-165.9	118.3	0	0	112.3	D519 R525 Q526 R528	D519-E523 WeakPolarHBondContact O-CG 3.31Å; D519-E523 PolarHBondContact O-N 3.22Å; E523-R525 VanDerWaalsContact C-N 3.31Å; E523-R525 PolarHBondContact O-N 3.28Å; E523-Q526 WeakPolarHBondContact O-CA 3.34Å; E523-Q526 WeakPolarHBondContact O-CB 3.29Å; E523-Q526 PolarHBondContact O-N 3.37Å; E523-Q526 VanDerWaalsContact O-N 3.11Å; E523-R528 WeakPolarHBondContact O-CB 3.28Å; E523-R528 WeakPolarHBondContact O-CG 3.47Å; E523-R528 PolarHBondContact O-N 2.93Å; E523-R528 VanDerWaalsContact O-N 3.16Å; E523-R528 IonicContact OE1-CZ 2.68Å; E523-R528 IonicContact OE1-NH1 3.52Å; E523-R528 PolarHBondContact OE1-NH1 2.83Å
524	I	98.6	Very high	97.4	Very high	10 Å²	10	72.8 Å²	72.8	5%	0.051	35%	0.352	C	S	.	.	H	α-helix	trans	-61.8	-41.1	175.1	-66.4	165.3	0	0	0	110.7	F499 L503 L514 P515 Q520 W521 H522 Q526 G527 R528 P530	F499-I524 HydrophobicContact CZ-CG2 4.19Å; L503-I524 HydrophobicContact CD1-CG2 4.11Å; L503-I524 HydrophobicContact CD2-CG2 3.68Å; L514-I524 HydrophobicContact CD2-CD1 4.34Å; P515-I524 HydrophobicContact CG-CD1 3.84Å; Q520-I524 WeakPolarHBondContact O-CD1 3.39Å; Q520-I524 WeakPolarHBondContact O-CG1 3.27Å; Q520-I524 PolarHBondContact O-N 3.11Å; W521-I524 PolarHBondContact O-N 3.1Å; H522-I524 VanDerWaalsContact C-N 3.31Å; H522-I524 PolarHBondContact O-N 2.92Å; I524-Q526 PolarHBondContact O-N 2.77Å; I524-G527 PolarHBondContact O-N 2.72Å; I524-R528 WeakPolarHBondContact CA-O 3.44Å; I524-P530 HydrophobicContact CD1-CG 3.91Å; I524-P530 HydrophobicContact CG1-CG 4.01Å
525	R	98.5	Very high	97.3	Very high	10 Å²	10	79.1 Å²	79.1	4%	0.038	39%	0.391	C	S	.	.	H	α-helix	trans	-74.8	-11.4	177.6	-79.4	76.5	-170.6	162.3	3	113	S478 R479 L481 N483 F499 W521 H522 E523 G527 P550	S478-R525 PolarHBondContact O-NH2 3.44Å; R479-R525 VanDerWaalsContact C-NH2 3.33Å; R479-R525 PolarHBondContact O-NH2 2.93Å; L481-R525 VanDerWaalsContact O-CZ 3.29Å; L481-R525 PolarHBondContact O-NE 2.82Å; L481-R525 PolarHBondContact O-NH2 3.49Å; N483-R525 HydrophobicContact CB-CB 4Å; N483-R525 HydrophobicContact CB-CG 3.78Å; F499-R525 HydrophobicContact CE2-CG 4.47Å; F499-R525 HydrophobicContact CZ-CG 3.89Å; W521-R525 VanDerWaalsContact CE2-CZ 3.45Å; W521-R525 VanDerWaalsContact CE2-NE 3.32Å; W521-R525 HydrophobicContact CE3-CG 4.4Å; W521-R525 HydrophobicContact CH2-CG 3.9Å; W521-R525 HydrophobicContact CZ2-CG 4.27Å; W521-R525 VanDerWaalsContact CZ2-NE 3.34Å; W521-R525 HydrophobicContact CZ3-CB 4.45Å; W521-R525 HydrophobicContact CZ3-CG 3.98Å; W521-R525 VanDerWaalsContact NE1-CZ 3.27Å; W521-R525 WeakPolarHBondContact O-CD 3.47Å; W521-R525 PolarHBondContact O-N 3.36Å; W521-R525 PolarHBondContact O-NH1 3.22Å; H522-R525 CarbonylContact O-C 3.52Å; H522-R525 WeakPolarHBondContact O-CA 3.44Å; H522-R525 PolarHBondContact O-N 2.8Å; H522-R525 VanDerWaalsContact O-N 3.07Å; E523-R525 VanDerWaalsContact C-N 3.31Å; E523-R525 PolarHBondContact O-N 3.28Å; R525-G527 VanDerWaalsContact C-N 3.27Å; R525-P550 WeakPolarHBondContact O-CG 3.42Å
526	Q	98.3	Very high	97.3	Very high	110 Å²	110	79 Å²	79	51%	0.514	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	6.1	164.9	-67.3	172	19.9	0	0	112.8	H522 E523 I524 R528 P550	H522-Q526 WeakPolarHBondContact O-CG 3.39Å; H522-Q526 PolarHBondContact O-N 3.3Å; E523-Q526 WeakPolarHBondContact O-CA 3.34Å; E523-Q526 WeakPolarHBondContact O-CB 3.29Å; E523-Q526 PolarHBondContact O-N 3.37Å; E523-Q526 VanDerWaalsContact O-N 3.11Å; I524-Q526 PolarHBondContact O-N 2.77Å; Q526-R528 VanDerWaalsContact OE1-NH2 3.12Å; Q526-P550 VanDerWaalsContact C-CG 3.42Å
527	G	97.6	Very high	97.2	Very high	14 Å²	14	72.5 Å²	72.5	14%	0.144	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	82	14.6	178.8	0	0	0	0	0	114.5	I524 R525	I524-G527 PolarHBondContact O-N 2.72Å; R525-G527 VanDerWaalsContact C-N 3.27Å
528	R	98.1	Very high	97.2	Very high	134 Å²	134	72.6 Å²	72.6	51%	0.506	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-81	120.1	171.5	-54.4	-176.1	-167.5	178.6	2.2	108.7	E523 I524 Q526	E523-R528 WeakPolarHBondContact O-CB 3.28Å; E523-R528 WeakPolarHBondContact O-CG 3.47Å; E523-R528 PolarHBondContact O-N 2.93Å; E523-R528 VanDerWaalsContact O-N 3.16Å; E523-R528 IonicContact OE1-CZ 2.68Å; E523-R528 IonicContact OE1-NH1 3.52Å; E523-R528 PolarHBondContact OE1-NH1 2.83Å; I524-R528 WeakPolarHBondContact CA-O 3.44Å; Q526-R528 VanDerWaalsContact OE1-NH2 3.12Å
529	L	96.6	Very high	97.1	Very high	46 Å²	46	76.4 Å²	76.4	24%	0.241	38%	0.375	C	S	.	.	P	Polyproline II helix	trans	-64.3	137.7	174.6	-77.3	172.1	0	0	0	110.6	I506 T541 L544 K545 I548	I506-L529 HydrophobicContact CD1-CD2 3.4Å; I506-L529 HydrophobicContact CG1-CD2 4.33Å; L529-T541 HydrophobicContact CD1-CG2 3.77Å; L529-L544 HydrophobicContact CD2-CB 4.08Å; L529-K545 HydrophobicContact CD1-CB 3.87Å; L529-K545 HydrophobicContact CD1-CG 4.47Å; L529-K545 HydrophobicContact CG-CB 4.11Å; L529-K545 HydrophobicContact CG-CG 4.49Å; L529-I548 HydrophobicContact CD2-CD1 3.76Å; L529-I548 HydrophobicContact CD2-CG1 4.21Å; L529-I548 HydrophobicContact CG-CD1 4.18Å
530	P	97.1	Very high	97.1	Very high	23 Å²	23	70 Å²	70	15%	0.149	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-53.8	154	161.9	-22.5	32.3	0	0	0	111.6	L503 I506 A511 L514 I524 I532	L503-P530 HydrophobicContact CD2-CG 4.22Å; I506-P530 HydrophobicContact CG2-CB 3.87Å; I506-P530 HydrophobicContact CG2-CG 3.91Å; A511-P530 HydrophobicContact CB-CB 4.41Å; L514-P530 HydrophobicContact CD2-CB 4.25Å; L514-P530 HydrophobicContact CD2-CG 3.78Å; I524-P530 HydrophobicContact CD1-CG 3.91Å; I524-P530 HydrophobicContact CG1-CG 4.01Å; P530-I532 PolarHBondContact O-N 3.18Å
531	R	96.3	Very high	97.1	Very high	220 Å²	220	65.6 Å²	65.6	83%	0.83	32%	0.322	S	S	*	.	P	Polyproline II helix	trans	-68	131.9	176.2	-65.3	179.4	-178.5	168.1	0.5	110.3	A511	A511-R531 WeakPolarHBondContact CA-O 3.41Å; A511-R531 VanDerWaalsContact CB-O 3.25Å; A511-R531 WeakPolarHBondContact CB-O 3.4Å
532	I	96.6	Very high	97.1	Very high	40 Å²	40	68.9 Å²	68.9	21%	0.205	34%	0.338	C	S	.	.			trans	-110.2	131.2	175.9	-63.4	173.8	0	0	0	107.2	I506 A509 P530 Q534 L536	I506-I532 HydrophobicContact CG1-CD1 4.34Å; I506-I532 HydrophobicContact CG2-CD1 4.37Å; I506-I532 HydrophobicContact CG2-CG1 4.17Å; A509-I532 HydrophobicContact CB-CD1 4.29Å; A509-I532 HydrophobicContact CB-CG1 4.41Å; A509-I532 HydrophobicContact CB-CG2 3.77Å; P530-I532 PolarHBondContact O-N 3.18Å; I532-Q534 VanDerWaalsContact C-N 3.26Å; I532-Q534 HydrophobicContact CG2-CG 3.62Å; I532-Q534 PolarHBondContact O-N 3.22Å; I532-L536 HydrophobicContact CD1-CD1 3.85Å; I532-L536 HydrophobicContact CG2-CD1 4.25Å; I532-L536 HydrophobicContact CG2-CG 4.48Å
533	P	95.2	Very high	97.1	Very high	84 Å²	84	64.5 Å²	64.5	55%	0.545	32%	0.318	S	S	.	.	S	Bend	trans	-80.8	-1.2	-174.8	34.3	-39.1	0	0	0	114.4	Y395 G510	Y395-P533 HydrophobicContact CD1-CG 4.42Å; G510-P533 VanDerWaalsContact C-CD 3.47Å; G510-P533 VanDerWaalsContact O-CD 3.28Å; G510-P533 WeakPolarHBondContact O-CD 3.5Å; G510-P533 VanDerWaalsContact O-CG 3.3Å; G510-P533 WeakPolarHBondContact O-CG 3.33Å
534	Q	94.2	Very high	97.1	Very high	28 Å²	28	61.1 Å²	61.1	13%	0.131	30%	0.302	C	S	.	.	S	Bend	trans	-119.2	154.6	-179.9	64.9	173.7	-62.4	0	0	111.5	Y395 F396 A509 I532 L536	Y395-Q534 HydrophobicContact CD2-CB 4.1Å; Y395-Q534 VanDerWaalsContact CD2-CD 3.46Å; Y395-Q534 HydrophobicContact CD2-CG 4.23Å; Y395-Q534 HydrophobicContact CE1-CB 4.35Å; Y395-Q534 HydrophobicContact CE2-CB 3.52Å; Y395-Q534 HydrophobicContact CE2-CG 4.12Å; F396-Q534 PolarHBondContact O-NE2 3.38Å; F396-Q534 PolarHBondContact O-OE1 3.1Å; A509-Q534 PolarHBondContact O-NE2 2.96Å; I532-Q534 VanDerWaalsContact C-N 3.26Å; I532-Q534 HydrophobicContact CG2-CG 3.62Å; I532-Q534 PolarHBondContact O-N 3.22Å; Q534-L536 HydrophobicContact CG-CD2 4.02Å; Q534-L536 HydrophobicContact CG-CG 4.32Å; Q534-L536 PolarHBondContact O-N 2.81Å
535	V	95.6	Very high	97.1	Very high	144 Å²	144	64.6 Å²	64.6	87%	0.873	32%	0.317	S	S	*	.			trans	-79	120.2	173.6	-178.4	0	0	0	0	109.1
536	L	96.6	Very high	97.1	Very high	19 Å²	19	66.4 Å²	66.4	10%	0.099	33%	0.329	C	S	.	.			trans	-110.1	155.4	170.1	-58.8	-179.7	0	0	0	109.7	E398 L401 A509 I532 Q534 L540	E398-L536 HydrophobicContact CB-CD2 3.99Å; E398-L536 HydrophobicContact CG-CD2 4.49Å; E398-L536 WeakPolarHBondContact OE2-CA 3.07Å; L401-L536 HydrophobicContact CD1-CD1 4.3Å; L401-L536 HydrophobicContact CD1-CD2 3.81Å; A509-L536 HydrophobicContact CB-CD1 4.48Å; I532-L536 HydrophobicContact CD1-CD1 3.85Å; I532-L536 HydrophobicContact CG2-CD1 4.25Å; I532-L536 HydrophobicContact CG2-CG 4.48Å; Q534-L536 HydrophobicContact CG-CD2 4.02Å; Q534-L536 HydrophobicContact CG-CG 4.32Å; Q534-L536 PolarHBondContact O-N 2.81Å; L536-L540 HydrophobicContact CD1-CD2 4.27Å; L536-L540 HydrophobicContact CD2-CD2 4.5Å
537	S	96.6	Very high	97.2	Very high	39 Å²	39	61.1 Å²	61.1	27%	0.273	30%	0.304	S	S	.	.			trans	-59.3	148.5	172.7	66.9	0	0	0	0	112	E398 E539 L540 T541	E398-S537 VanDerWaalsContact OE1-CB 3.26Å; E398-S537 WeakPolarHBondContact OE1-CB 3.45Å; E398-S537 PolarHBondContact OE1-OG 3.34Å; E398-S537 PolarHBondContact OE2-N 3.4Å; E398-S537 PolarHBondContact OE2-OG 3.49Å; S537-E539 PolarHBondContact O-N 2.89Å; S537-L540 PolarHBondContact O-N 2.95Å; S537-L540 PolarHBondContact OG-N 3.48Å; S537-T541 WeakPolarHBondContact O-CB 3.25Å; S537-T541 PolarHBondContact O-N 3.31Å; S537-T541 PolarHBondContact O-OG1 2.85Å
538	Q	96.7	Very high	97.2	Very high	127 Å²	127	60.5 Å²	60.5	59%	0.593	30%	0.298	S	S	*	.	H	α-helix	trans	-61.2	-34.7	177.8	-165.2	65.7	35.7	0	0	111.5	T541 E542	Q538-T541 PolarHBondContact O-N 3.34Å; Q538-E542 HydrophobicContact CG-CG 4.26Å; Q538-E542 PolarHBondContact NE2-OE1 3.04Å; Q538-E542 WeakPolarHBondContact O-CB 3.12Å; Q538-E542 WeakPolarHBondContact O-CG 3.33Å; Q538-E542 PolarHBondContact O-N 3.3Å
539	E	96.6	Very high	97.2	Very high	117 Å²	117	56 Å²	56	55%	0.547	28%	0.282	S	S	.	.	H	α-helix	trans	-61.8	-44.3	176.8	-67.3	-170.3	-169.5	0	0	112.6	S537 L543 V566	S537-E539 PolarHBondContact O-N 2.89Å; E539-L543 WeakPolarHBondContact O-CB 3.4Å; E539-L543 PolarHBondContact O-N 3.27Å; E539-L543 VanDerWaalsContact O-N 3.1Å; E539-V566 HydrophobicContact CB-CB 4.02Å; E539-V566 HydrophobicContact CB-CG2 3.39Å; E539-V566 HydrophobicContact CG-CG2 4.47Å; E539-V566 WeakPolarHBondContact OE2-CG2 3.47Å
540	L	97.5	Very high	97.3	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-71.6	-38.4	177.9	-179.9	60.6	0	0	0	110.8	E398 L401 K402 L405 L536 S537 L543 L544 V566	E398-L540 HydrophobicContact CG-CD2 3.81Å; L401-L540 HydrophobicContact CB-CD2 4.49Å; K402-L540 HydrophobicContact CG-CD1 4.39Å; K402-L540 HydrophobicContact CG-CD2 4.25Å; L405-L540 HydrophobicContact CD2-CD1 4.03Å; L536-L540 HydrophobicContact CD1-CD2 4.27Å; L536-L540 HydrophobicContact CD2-CD2 4.5Å; S537-L540 PolarHBondContact O-N 2.95Å; S537-L540 PolarHBondContact OG-N 3.48Å; L540-L543 PolarHBondContact O-N 3.38Å; L540-L544 HydrophobicContact CD1-CD1 4.4Å; L540-L544 HydrophobicContact CD1-CG 4.32Å; L540-L544 HydrophobicContact CG-CD1 4.17Å; L540-L544 WeakPolarHBondContact O-CG 3.22Å; L540-L544 PolarHBondContact O-N 2.8Å; L540-V566 HydrophobicContact CB-CG2 4.27Å
541	T	98.1	Very high	97.4	Very high	34 Å²	34	58.3 Å²	58.3	21%	0.209	30%	0.297	C	S	.	.	H	α-helix	trans	-63.2	-47.5	179	-56	0	0	0	0	111.5	L529 S537 Q538 L543 L544 K545	L529-T541 HydrophobicContact CD1-CG2 3.77Å; S537-T541 WeakPolarHBondContact O-CB 3.25Å; S537-T541 PolarHBondContact O-N 3.31Å; S537-T541 PolarHBondContact O-OG1 2.85Å; Q538-T541 PolarHBondContact O-N 3.34Å; T541-L543 PolarHBondContact O-N 3.4Å; T541-L544 PolarHBondContact O-N 2.88Å; T541-K545 VanDerWaalsContact O-CB 3.28Å; T541-K545 WeakPolarHBondContact O-CB 3.36Å; T541-K545 PolarHBondContact O-N 3.02Å
542	E	98.1	Very high	97.5	Very high	79 Å²	79	48.5 Å²	48.5	37%	0.369	26%	0.261	S	S	.	.	H	α-helix	trans	-68.5	-31.6	175.6	-67	-61.6	135	0	0	112.4	Q538 K545 V546	Q538-E542 HydrophobicContact CG-CG 4.26Å; Q538-E542 PolarHBondContact NE2-OE1 3.04Å; Q538-E542 WeakPolarHBondContact O-CB 3.12Å; Q538-E542 WeakPolarHBondContact O-CG 3.33Å; Q538-E542 PolarHBondContact O-N 3.3Å; E542-K545 PolarHBondContact O-N 3.48Å; E542-K545 IonicContact OE1-NZ 2.66Å; E542-K545 PolarHBondContact OE1-NZ 3.14Å; E542-K545 WeakPolarHBondContact OE2-CD 3.37Å; E542-K545 IonicContact OE2-NZ 2.79Å; E542-K545 PolarHBondContact OE2-NZ 2.92Å; E542-V546 PolarHBondContact O-N 2.67Å
543	L	98.6	Very high	97.6	Very high	4 Å²	4	52.8 Å²	52.8	2%	0.021	28%	0.28	C	S	.	.	H	α-helix	trans	-62.9	-48.8	172.1	177.5	59.7	0	0	0	111.7	L405 E539 L540 T541 K545 V546 M547 P556 L561 H564 V566 L567	L405-L543 HydrophobicContact CD2-CD2 4.18Å; E539-L543 WeakPolarHBondContact O-CB 3.4Å; E539-L543 PolarHBondContact O-N 3.27Å; E539-L543 VanDerWaalsContact O-N 3.1Å; L540-L543 PolarHBondContact O-N 3.38Å; T541-L543 PolarHBondContact O-N 3.4Å; L543-K545 VanDerWaalsContact C-N 3.28Å; L543-K545 PolarHBondContact O-N 3.07Å; L543-V546 HydrophobicContact CD1-CG1 4.33Å; L543-V546 WeakPolarHBondContact O-CG1 3.28Å; L543-V546 PolarHBondContact O-N 3.15Å; L543-M547 HydrophobicContact CD1-CG 4.37Å; L543-M547 HydrophobicContact CD1-SD 4.33Å; L543-M547 HydrophobicContact CG-SD 4.19Å; L543-M547 VanDerWaalsContact O-CG 3.28Å; L543-M547 WeakPolarHBondContact O-CG 3.38Å; L543-M547 PolarHBondContact O-N 3.29Å; L543-P556 HydrophobicContact CD1-CG 4.47Å; L543-L561 HydrophobicContact CD1-CD1 4.08Å; L543-L561 HydrophobicContact CD2-CD1 4.08Å; L543-L561 HydrophobicContact CG-CD1 4.4Å; L543-H564 HydrophobicContact CD2-CB 4.43Å; L543-V566 HydrophobicContact CB-CG1 4.43Å; L543-V566 HydrophobicContact CD2-CG1 3.48Å; L543-V566 VanDerWaalsContact CD2-CG1 3.48Å; L543-L567 HydrophobicContact CD2-CD1 4.39Å; L543-L567 HydrophobicContact CD2-CD2 4.08Å; L543-L567 HydrophobicContact CD2-CG 4.15Å
544	L	98.6	Very high	97.7	Very high	1 Å²	1	56.4 Å²	56.4	1%	0.005	28%	0.283	C	S	.	.	H	α-helix	trans	-61.5	-38.3	177.1	-70.7	170.6	0	0	0	111.5	L405 A502 V505 I506 L529 L540 T541 M547 I548	L405-L544 HydrophobicContact CD2-CD2 4.21Å; A502-L544 HydrophobicContact CB-CD2 4.11Å; V505-L544 HydrophobicContact CB-CD2 4.03Å; V505-L544 HydrophobicContact CG1-CD1 4.43Å; V505-L544 HydrophobicContact CG1-CD2 3.96Å; I506-L544 HydrophobicContact CD1-CB 4.5Å; I506-L544 HydrophobicContact CG1-CD1 4.21Å; L529-L544 HydrophobicContact CD2-CB 4.08Å; L540-L544 HydrophobicContact CD1-CD1 4.4Å; L540-L544 HydrophobicContact CD1-CG 4.32Å; L540-L544 HydrophobicContact CG-CD1 4.17Å; L540-L544 WeakPolarHBondContact O-CG 3.22Å; L540-L544 PolarHBondContact O-N 2.8Å; T541-L544 PolarHBondContact O-N 2.88Å; L544-M547 PolarHBondContact O-N 3.4Å; L544-I548 PolarHBondContact O-N 3.07Å
545	K	98.5	Very high	97.9	Very high	83 Å²	83	55.2 Å²	55.2	36%	0.361	28%	0.278	S	S	.	.	H	α-helix	trans	-65.7	-43.3	177.4	-172.6	176.2	163.5	-151.7	0	113	L529 T541 E542 L543 M547 I548 H549	L529-K545 HydrophobicContact CD1-CB 3.87Å; L529-K545 HydrophobicContact CD1-CG 4.47Å; L529-K545 HydrophobicContact CG-CB 4.11Å; L529-K545 HydrophobicContact CG-CG 4.49Å; T541-K545 VanDerWaalsContact O-CB 3.28Å; T541-K545 WeakPolarHBondContact O-CB 3.36Å; T541-K545 PolarHBondContact O-N 3.02Å; E542-K545 PolarHBondContact O-N 3.48Å; E542-K545 IonicContact OE1-NZ 2.66Å; E542-K545 PolarHBondContact OE1-NZ 3.14Å; E542-K545 WeakPolarHBondContact OE2-CD 3.37Å; E542-K545 IonicContact OE2-NZ 2.79Å; E542-K545 PolarHBondContact OE2-NZ 2.92Å; L543-K545 VanDerWaalsContact C-N 3.28Å; L543-K545 PolarHBondContact O-N 3.07Å; K545-M547 VanDerWaalsContact C-N 3.33Å; K545-I548 WeakPolarHBondContact O-CG1 3.31Å; K545-I548 PolarHBondContact O-N 2.66Å; K545-H549 PolarHBondContact O-N 2.76Å
546	V	98.6	Very high	98.1	Very high	48 Å²	48	49.2 Å²	49.2	29%	0.291	24%	0.242	S	C	.	.	H	α-helix	trans	-72.3	-27.4	175.4	73	0	0	0	0	112.2	E542 L543 I548 H549 R554	E542-V546 PolarHBondContact O-N 2.67Å; L543-V546 HydrophobicContact CD1-CG1 4.33Å; L543-V546 WeakPolarHBondContact O-CG1 3.28Å; L543-V546 PolarHBondContact O-N 3.15Å; V546-I548 VanDerWaalsContact C-N 3.32Å; V546-I548 PolarHBondContact O-N 2.9Å; V546-H549 VanDerWaalsContact O-CB 3.28Å; V546-H549 WeakPolarHBondContact O-CB 3.45Å; V546-H549 PolarHBondContact O-N 3.08Å; V546-R554 WeakPolarHBondContact CG2-O 3.36Å
547	M	98.8	Very high	98.2	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-66.8	-28.6	170.4	-72	172.7	67.5	0	0	113.4	L405 I498 F499 L501 A502 L543 L544 K545 R555 P556 L561	L405-M547 HydrophobicContact CD1-CE 3.68Å; L405-M547 HydrophobicContact CD1-SD 4.04Å; L405-M547 HydrophobicContact CD2-SD 4.4Å; I498-M547 HydrophobicContact CG2-CB 3.93Å; I498-M547 HydrophobicContact CG2-CE 3.98Å; I498-M547 HydrophobicContact CG2-CG 3.81Å; I498-M547 WeakPolarHBondContact O-CE 3.42Å; F499-M547 WeakPolarHBondContact CA-O 3.3Å; L501-M547 HydrophobicContact CB-CE 4.2Å; L501-M547 HydrophobicContact CD2-CE 4.3Å; L501-M547 HydrophobicContact CG-CE 4.08Å; A502-M547 HydrophobicContact CB-CB 3.59Å; A502-M547 HydrophobicContact CB-CE 3.91Å; A502-M547 HydrophobicContact CB-SD 4.33Å; L543-M547 HydrophobicContact CD1-CG 4.37Å; L543-M547 HydrophobicContact CD1-SD 4.33Å; L543-M547 HydrophobicContact CG-SD 4.19Å; L543-M547 VanDerWaalsContact O-CG 3.28Å; L543-M547 WeakPolarHBondContact O-CG 3.38Å; L543-M547 PolarHBondContact O-N 3.29Å; L544-M547 PolarHBondContact O-N 3.4Å; K545-M547 VanDerWaalsContact C-N 3.33Å; M547-R555 VanDerWaalsContact O-CD 3.26Å; M547-R555 WeakPolarHBondContact O-CD 3.44Å; M547-R555 WeakPolarHBondContact O-CG 3.49Å; M547-P556 HydrophobicContact CG-CG 3.72Å; M547-L561 HydrophobicContact CE-CD1 4.31Å; M547-L561 HydrophobicContact CE-CD2 3.93Å; M547-L561 HydrophobicContact SD-CD1 3.7Å; M547-L561 HydrophobicContact SD-CD2 4.42Å
548	I	98.7	Very high	98.3	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.6	14.3	172.8	67.5	159.6	0	0	0	114.3	F499 A502 L503 L529 L544 K545 V546	F499-I548 HydrophobicContact CD2-CB 3.94Å; F499-I548 HydrophobicContact CD2-CG2 4.21Å; F499-I548 HydrophobicContact CE2-CB 3.91Å; F499-I548 HydrophobicContact CE2-CG2 4.33Å; A502-I548 HydrophobicContact CB-CG2 3.62Å; L503-I548 HydrophobicContact CD2-CG2 4.15Å; L503-I548 HydrophobicContact CG-CG2 4.19Å; L529-I548 HydrophobicContact CD2-CD1 3.76Å; L529-I548 HydrophobicContact CD2-CG1 4.21Å; L529-I548 HydrophobicContact CG-CD1 4.18Å; L544-I548 PolarHBondContact O-N 3.07Å; K545-I548 WeakPolarHBondContact O-CG1 3.31Å; K545-I548 PolarHBondContact O-N 2.66Å; V546-I548 VanDerWaalsContact C-N 3.32Å; V546-I548 PolarHBondContact O-N 2.9Å
549	H	98.8	Very high	98.3	Very high	39 Å²	39	47 Å²	47	18%	0.181	23%	0.233	C	C	.	.			trans	-58.6	139.2	-176.3	-173.5	-87.1	0	0	0	112.3	K545 V546 D551 R554 R555	K545-H549 PolarHBondContact O-N 2.76Å; V546-H549 VanDerWaalsContact O-CB 3.28Å; V546-H549 WeakPolarHBondContact O-CB 3.45Å; V546-H549 PolarHBondContact O-N 3.08Å; H549-D551 PolarHBondContact ND1-N 3.11Å; H549-D551 VanDerWaalsContact ND1-N 3.2Å; H549-D551 PolarHBondContact ND1-O 3.06Å; H549-D551 PolarHBondContact O-N 2.94Å; H549-R554 PolarHBondContact NE2-NH1 2.88Å; H549-R555 HydrophobicContact CB-CG 4.18Å; H549-R555 PolarHBondContact O-NE 2.94Å; H549-R555 PolarHBondContact O-NH2 3.4Å
550	P	98.6	Very high	98.4	Very high	56 Å²	56	45.3 Å²	45.3	36%	0.364	23%	0.23	S	C	.	.	S	Bend	trans	-55	-56.2	-176.3	-28.4	35.6	0	0	0	113.4	R525 Q526 P552 R555	R525-P550 WeakPolarHBondContact O-CG 3.42Å; Q526-P550 VanDerWaalsContact C-CG 3.42Å; P550-P552 WeakPolarHBondContact O-CD 3.46Å; P550-R555 PolarHBondContact O-NH2 3.3Å
551	D	98.6	Very high	98.4	Very high	63 Å²	63	45.3 Å²	45.3	34%	0.337	23%	0.23	S	C	.	.	S	Bend	trans	-65	120.7	169.9	159.5	29.1	0	0	0	110.1	H549 E553 R554	H549-D551 PolarHBondContact ND1-N 3.11Å; H549-D551 VanDerWaalsContact ND1-N 3.2Å; H549-D551 PolarHBondContact ND1-O 3.06Å; H549-D551 PolarHBondContact O-N 2.94Å; D551-E553 VanDerWaalsContact C-N 3.32Å; D551-E553 PolarHBondContact O-N 3.16Å; D551-E553 WeakPolarHBondContact OD1-CB 3.46Å; D551-E553 PolarHBondContact OD1-N 3.28Å; D551-R554 VanDerWaalsContact OD2-CG 3.31Å; D551-R554 WeakPolarHBondContact OD2-CG 3.2Å
552	P	98.6	Very high	98.3	Very high	13 Å²	13	44.2 Å²	44.2	8%	0.084	22%	0.223	C	C	.	.	S	Bend	trans	-65.5	-26.4	179.2	-18.3	31.2	0	0	0	114.4	E484 H492 K495 P550 R554 R555	E484-P552 HydrophobicContact CB-CG 4.16Å; E484-P552 HydrophobicContact CG-CG 3.69Å; H492-P552 HydrophobicContact CB-CB 3.9Å; K495-P552 HydrophobicContact CB-CB 3.8Å; K495-P552 HydrophobicContact CG-CB 4.22Å; K495-P552 VanDerWaalsContact CG-O 3.3Å; K495-P552 WeakPolarHBondContact CG-O 3.42Å; K495-P552 PolarHBondContact NZ-O 3.34Å; P550-P552 WeakPolarHBondContact O-CD 3.46Å; P552-R554 VanDerWaalsContact C-N 3.35Å; P552-R554 PolarHBondContact O-N 2.78Å; P552-R555 WeakPolarHBondContact O-CB 3.46Å; P552-R555 PolarHBondContact O-N 2.79Å
553	E	98	Very high	98.1	Very high	130 Å²	130	46.9 Å²	46.9	61%	0.607	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-40.2	-177.1	-64.1	-142.1	121.6	0	0	111.5	H492 K495 D551 R555	H492-E553 IonicContact CE1-OE1 3.44Å; H492-E553 PolarHBondContact CE1-OE1 3.25Å; H492-E553 IonicContact ND1-OE1 3.27Å; H492-E553 IonicContact NE2-OE1 3.49Å; K495-E553 PolarHBondContact NZ-O 2.9Å; D551-E553 VanDerWaalsContact C-N 3.32Å; D551-E553 PolarHBondContact O-N 3.16Å; D551-E553 WeakPolarHBondContact OD1-CB 3.46Å; D551-E553 PolarHBondContact OD1-N 3.28Å; E553-R555 VanDerWaalsContact C-N 3.3Å; E553-R555 PolarHBondContact O-N 3.41Å
554	R	98.4	Very high	98	Very high	160 Å²	160	49.7 Å²	49.7	60%	0.604	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-19.4	176.1	-71.2	-176.4	76.4	-159.1	8.7	115.2	V546 H549 D551 P552	V546-R554 WeakPolarHBondContact CG2-O 3.36Å; H549-R554 PolarHBondContact NE2-NH1 2.88Å; D551-R554 VanDerWaalsContact OD2-CG 3.31Å; D551-R554 WeakPolarHBondContact OD2-CG 3.2Å; P552-R554 VanDerWaalsContact C-N 3.35Å; P552-R554 PolarHBondContact O-N 2.78Å
555	R	98.6	Very high	97.7	Very high	4 Å²	4	53.3 Å²	53.3	2%	0.015	27%	0.272	C	S	.	.	S	Bend	trans	-67.3	137.8	174.1	-54.6	177	-162.8	153.2	13.3	109.6	E484 K495 I498 M547 H549 P550 P552 E553	E484-R555 IonicContact OE1-CZ 2.72Å; E484-R555 IonicContact OE1-NH1 3.44Å; E484-R555 PolarHBondContact OE1-NH1 3.39Å; E484-R555 IonicContact OE1-NH2 3.56Å; E484-R555 PolarHBondContact OE1-NH2 2.81Å; E484-R555 IonicContact OE2-CZ 2.66Å; E484-R555 IonicContact OE2-NH1 2.66Å; E484-R555 IonicContact OE2-NH2 3.34Å; E484-R555 PolarHBondContact OE2-NH2 3.15Å; K495-R555 HydrophobicContact CD-CB 4.35Å; K495-R555 WeakPolarHBondContact CE-O 3.49Å; K495-R555 PolarHBondContact NZ-O 3.36Å; K495-R555 WeakPolarHBondContact O-CD 3.4Å; K495-R555 PolarHBondContact O-NH1 3.44Å; I498-R555 HydrophobicContact CG2-CB 4.26Å; M547-R555 VanDerWaalsContact O-CD 3.26Å; M547-R555 WeakPolarHBondContact O-CD 3.44Å; M547-R555 WeakPolarHBondContact O-CG 3.49Å; H549-R555 HydrophobicContact CB-CG 4.18Å; H549-R555 PolarHBondContact O-NE 2.94Å; H549-R555 PolarHBondContact O-NH2 3.4Å; P550-R555 PolarHBondContact O-NH2 3.3Å; P552-R555 WeakPolarHBondContact O-CB 3.46Å; P552-R555 PolarHBondContact O-N 2.79Å; E553-R555 VanDerWaalsContact C-N 3.3Å; E553-R555 PolarHBondContact O-N 3.41Å
556	P	98.5	Very high	97.4	Very high	18 Å²	18	49.4 Å²	49.4	12%	0.117	26%	0.256	C	S	.	.	P	Polyproline II helix	trans	-62.6	147.9	177.1	26.9	-34.6	0	0	0	111.2	I498 L543 M547 V560	I498-P556 WeakPolarHBondContact CG1-O 3.32Å; I498-P556 HydrophobicContact CG2-CG 4.38Å; L543-P556 HydrophobicContact CD1-CG 4.47Å; M547-P556 HydrophobicContact CG-CG 3.72Å; P556-V560 HydrophobicContact CB-CB 4.28Å; P556-V560 HydrophobicContact CB-CG1 4.08Å
557	S	98.7	Very high	97.1	Very high	47 Å²	47	47.2 Å²	47.2	33%	0.329	24%	0.242	S	C	.	.	P	Polyproline II helix	trans	-75.5	159.2	166.3	71.1	0	0	0	0	110.3	M559 V560 L561	S557-M559 PolarHBondContact O-N 3.24Å; S557-M559 VanDerWaalsContact O-N 3.13Å; S557-V560 PolarHBondContact O-N 3.02Å; S557-V560 PolarHBondContact OG-N 3.01Å; S557-L561 WeakPolarHBondContact O-CB 3.34Å; S557-L561 PolarHBondContact O-N 2.84Å
558	A	98.4	Very high	96.3	Very high	1 Å²	1	49.9 Å²	49.9	1%	0.008	26%	0.256	C	S	.	.	H	α-helix	trans	-58	-29.4	177.5	0	0	0	0	0	113.1	L412 R413 I498 V562	L412-A558 HydrophobicContact CB-CB 3.9Å; R413-A558 HydrophobicContact CB-CB 3.88Å; I498-A558 HydrophobicContact CD1-CB 4.14Å; A558-V562 WeakPolarHBondContact O-CG1 3.49Å; A558-V562 PolarHBondContact O-N 3.18Å
559	M	97.2	Very high	94.7	Very high	91 Å²	91	52.9 Å²	52.9	45%	0.448	28%	0.277	S	S	.	.	H	α-helix	trans	-68	-35.2	173.4	-179.9	61.7	76	0	0	113.3	R413 S557 K563	R413-M559 HydrophobicContact CG-CB 4.4Å; R413-M559 HydrophobicContact CG-CE 4.01Å; R413-M559 HydrophobicContact CG-SD 4.43Å; S557-M559 PolarHBondContact O-N 3.24Å; S557-M559 VanDerWaalsContact O-N 3.13Å; M559-K563 WeakPolarHBondContact O-CG 3.44Å
560	V	97.7	Very high	92.5	Very high	80 Å²	80	54.2 Å²	54.2	49%	0.485	30%	0.295	S	S	.	.	H	α-helix	trans	-77.2	-44	175.2	172.8	0	0	0	0	110.3	P556 S557 V562 K563 H564	P556-V560 HydrophobicContact CB-CB 4.28Å; P556-V560 HydrophobicContact CB-CG1 4.08Å; S557-V560 PolarHBondContact O-N 3.02Å; S557-V560 PolarHBondContact OG-N 3.01Å; V560-V562 PolarHBondContact O-N 3.29Å; V560-K563 PolarHBondContact O-N 2.89Å; V560-H564 PolarHBondContact O-N 3.15Å
561	L	97.8	Very high	90.3	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-52.6	-52.3	-179.3	179.2	62	0	0	0	112.1	L405 I498 L501 L543 M547 S557 K563 H564 L567	L405-L561 HydrophobicContact CD1-CD1 4.18Å; L405-L561 HydrophobicContact CD1-CD2 3.94Å; L405-L561 HydrophobicContact CD1-CG 4.47Å; L405-L561 HydrophobicContact CG-CD1 4.41Å; I498-L561 HydrophobicContact CD1-CD2 3.9Å; L501-L561 HydrophobicContact CD2-CD2 3.98Å; L543-L561 HydrophobicContact CD1-CD1 4.08Å; L543-L561 HydrophobicContact CD2-CD1 4.08Å; L543-L561 HydrophobicContact CG-CD1 4.4Å; M547-L561 HydrophobicContact CE-CD1 4.31Å; M547-L561 HydrophobicContact CE-CD2 3.93Å; M547-L561 HydrophobicContact SD-CD1 3.7Å; M547-L561 HydrophobicContact SD-CD2 4.42Å; S557-L561 WeakPolarHBondContact O-CB 3.34Å; S557-L561 PolarHBondContact O-N 2.84Å; L561-K563 PolarHBondContact O-N 3.2Å; L561-H564 VanDerWaalsContact O-CB 3.29Å; L561-H564 WeakPolarHBondContact O-CB 3.45Å; L561-H564 PolarHBondContact O-N 3.08Å; L561-L567 HydrophobicContact CD1-CD1 4Å; L561-L567 HydrophobicContact CG-CD1 4.28Å; L561-L567 WeakPolarHBondContact O-CD1 3.48Å
562	V	96.6	Very high	88.1	Confident	11 Å²	11	62 Å²	62	7%	0.067	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-2.7	-178.6	-55.8	0	0	0	0	114.7	L406 R410 A558 V560	L406-V562 HydrophobicContact CD1-CB 3.93Å; L406-V562 HydrophobicContact CD1-CG1 4.26Å; R410-V562 HydrophobicContact CB-CG1 4.43Å; R410-V562 HydrophobicContact CG-CB 4.32Å; R410-V562 HydrophobicContact CG-CG1 3.83Å; A558-V562 WeakPolarHBondContact O-CG1 3.49Å; A558-V562 PolarHBondContact O-N 3.18Å; V560-V562 PolarHBondContact O-N 3.29Å
563	K	94.9	Very high	86.1	Confident	136 Å²	136	66.3 Å²	66.3	59%	0.591	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.4	-2.3	174	-64.3	-178.2	-179	-176.8	0	112.6	M559 V560 L561	M559-K563 WeakPolarHBondContact O-CG 3.44Å; V560-K563 PolarHBondContact O-N 2.89Å; L561-K563 PolarHBondContact O-N 3.2Å
564	H	94.6	Very high	84.5	Confident	62 Å²	62	63.5 Å²	63.5	29%	0.287	34%	0.336	S	S	.	.			trans	-67	134.6	-176.7	-161.1	-84.8	0	0	0	111.5	L543 V560 L561 V566 L567 L568	L543-H564 HydrophobicContact CD2-CB 4.43Å; V560-H564 PolarHBondContact O-N 3.15Å; L561-H564 VanDerWaalsContact O-CB 3.29Å; L561-H564 WeakPolarHBondContact O-CB 3.45Å; L561-H564 PolarHBondContact O-N 3.08Å; H564-V566 VanDerWaalsContact C-N 3.31Å; H564-V566 VanDerWaalsContact ND1-CG1 3.31Å; H564-V566 WeakPolarHBondContact ND1-CG1 3.4Å; H564-V566 PolarHBondContact O-N 3.06Å; H564-L567 PolarHBondContact O-N 2.83Å; H564-L567 VanDerWaalsContact O-N 3.08Å; H564-L568 PolarHBondContact O-N 2.64Å
565	S	92.6	Very high	82.8	Confident	78 Å²	78	59.1 Å²	59.1	55%	0.545	33%	0.334	S	S	.	.	H	α-helix	trans	-50.4	-48.1	-174.9	49.6	0	0	0	0	112.9	L567 L568 S569	S565-L567 PolarHBondContact O-N 3.06Å; S565-L567 VanDerWaalsContact O-N 3.13Å; S565-L568 PolarHBondContact O-N 2.78Å; S565-S569 PolarHBondContact O-N 2.88Å
566	V	93.4	Very high	81.4	Confident	1 Å²	1	63.4 Å²	63.4	1%	0.006	35%	0.354	C	S	.	.	H	α-helix	trans	-60.2	-22.7	-177	84.9	0	0	0	0	114.5	K402 E539 L540 L543 H564 S569	K402-V566 VanDerWaalsContact CD-O 3.27Å; K402-V566 WeakPolarHBondContact CD-O 3.28Å; K402-V566 VanDerWaalsContact CE-O 3.31Å; K402-V566 WeakPolarHBondContact CE-O 3.26Å; K402-V566 PolarHBondContact NZ-O 2.97Å; E539-V566 HydrophobicContact CB-CB 4.02Å; E539-V566 HydrophobicContact CB-CG2 3.39Å; E539-V566 HydrophobicContact CG-CG2 4.47Å; E539-V566 WeakPolarHBondContact OE2-CG2 3.47Å; L540-V566 HydrophobicContact CB-CG2 4.27Å; L543-V566 HydrophobicContact CB-CG1 4.43Å; L543-V566 HydrophobicContact CD2-CG1 3.48Å; L543-V566 VanDerWaalsContact CD2-CG1 3.48Å; H564-V566 VanDerWaalsContact C-N 3.31Å; H564-V566 VanDerWaalsContact ND1-CG1 3.31Å; H564-V566 WeakPolarHBondContact ND1-CG1 3.4Å; H564-V566 PolarHBondContact O-N 3.06Å; V566-S569 PolarHBondContact O-OG 2.68Å
567	L	91.3	Very high	80.3	Confident	2 Å²	2	67.1 Å²	67.1	1%	0.01	37%	0.37	C	S	.	.	H	α-helix	trans	-92	-27.1	176.1	-54.1	-172	0	0	0	111.9	K402 L405 L406 L543 L561 H564 S565	K402-L567 HydrophobicContact CB-CD2 4.23Å; K402-L567 HydrophobicContact CG-CD2 4.06Å; L405-L567 HydrophobicContact CB-CD2 4.34Å; L405-L567 HydrophobicContact CD2-CD1 4.38Å; L405-L567 HydrophobicContact CD2-CD2 3.82Å; L405-L567 HydrophobicContact CG-CD1 3.96Å; L405-L567 HydrophobicContact CG-CD2 4.05Å; L406-L567 HydrophobicContact CB-CB 4.38Å; L406-L567 HydrophobicContact CB-CD1 4.38Å; L406-L567 HydrophobicContact CD1-CB 4.29Å; L406-L567 HydrophobicContact CD1-CD1 4.44Å; L543-L567 HydrophobicContact CD2-CD1 4.39Å; L543-L567 HydrophobicContact CD2-CD2 4.08Å; L543-L567 HydrophobicContact CD2-CG 4.15Å; L561-L567 HydrophobicContact CD1-CD1 4Å; L561-L567 HydrophobicContact CG-CD1 4.28Å; L561-L567 WeakPolarHBondContact O-CD1 3.48Å; H564-L567 PolarHBondContact O-N 2.83Å; H564-L567 VanDerWaalsContact O-N 3.08Å; S565-L567 PolarHBondContact O-N 3.06Å; S565-L567 VanDerWaalsContact O-N 3.13Å
568	L	82.4	Confident	79.3	Confident	55 Å²	55	69.3 Å²	69.3	29%	0.288	38%	0.377	S	S	.	.	H	α-helix	trans	-83.9	-11.9	178.4	-60.6	-179.9	0	0	0	112.9	H564 S565 A570 S571 R572	H564-L568 PolarHBondContact O-N 2.64Å; S565-L568 PolarHBondContact O-N 2.78Å; L568-A570 VanDerWaalsContact C-N 3.31Å; L568-A570 PolarHBondContact O-N 2.87Å; L568-S571 PolarHBondContact O-N 3.18Å; L568-R572 PolarHBondContact O-N 3.34Å; L568-R572 VanDerWaalsContact O-N 3.16Å
569	S	64.6	Low	78.5	Confident	63 Å²	63	76 Å²	76	44%	0.441	40%	0.403	S	S	.	.	G	3₁₀ helix	trans	-57.2	-41.5	-178.6	70.6	0	0	0	0	112.6	S565 V566 S571 R572	S565-S569 PolarHBondContact O-N 2.88Å; V566-S569 PolarHBondContact O-OG 2.68Å; S569-S571 VanDerWaalsContact C-N 3.3Å; S569-S571 PolarHBondContact O-N 3.07Å; S569-R572 PolarHBondContact O-N 2.94Å
570	A	54.1	Low	77.9	Confident	68 Å²	68	76.3 Å²	76.3	56%	0.562	41%	0.405	S	S	*	.	G	3₁₀ helix	trans	-72.6	-19.6	177.2	0	0	0	0	0	113.8	L568	L568-A570 VanDerWaalsContact C-N 3.31Å; L568-A570 PolarHBondContact O-N 2.87Å
571	S	51.6	Low	77.3	Confident	75 Å²	75	76 Å²	76	52%	0.524	40%	0.398	S	S	.	.	G	3₁₀ helix	trans	-88.8	-13	175.5	-63	0	0	0	0	113.2	L568 S569 K573	L568-S571 PolarHBondContact O-N 3.18Å; S569-S571 VanDerWaalsContact C-N 3.3Å; S569-S571 PolarHBondContact O-N 3.07Å; S571-K573 VanDerWaalsContact C-N 3.32Å; S571-K573 PolarHBondContact O-N 2.87Å
572	R	52.7	Low	76.9	Confident	206 Å²	206	80.5 Å²	80.5	78%	0.777	42%	0.422	S	S	*	.			trans	-82.1	78.1	175.9	-75	-172.8	174.1	-164.7	-1.7	110.8	L568 S569 S574	L568-R572 PolarHBondContact O-N 3.34Å; L568-R572 VanDerWaalsContact O-N 3.16Å; S569-R572 PolarHBondContact O-N 2.94Å; R572-S574 PolarHBondContact O-N 2.88Å
573	K	56.4	Low	76.7	Confident	105 Å²	105	84.3 Å²	84.3	46%	0.457	44%	0.442	S	S	.	.			trans	-47.3	132.3	149.7	-66.3	-166.3	-177.8	-165	0	107.9	S571 Q577 L578 E581	S571-K573 VanDerWaalsContact C-N 3.32Å; S571-K573 PolarHBondContact O-N 2.87Å; K573-Q577 HydrophobicContact CB-CB 4.09Å; K573-Q577 HydrophobicContact CB-CG 4.13Å; K573-Q577 HydrophobicContact CD-CG 4.32Å; K573-Q577 HydrophobicContact CG-CG 4.42Å; K573-L578 HydrophobicContact CB-CD2 3.85Å; K573-L578 HydrophobicContact CB-CG 3.84Å; K573-L578 HydrophobicContact CD-CD2 4.17Å; K573-E581 WeakPolarHBondContact CD-OE1 3.4Å; K573-E581 WeakPolarHBondContact CD-OE2 3.41Å; K573-E581 WeakPolarHBondContact CE-OE1 2.99Å; K573-E581 IonicContact NZ-OE1 2.91Å; K573-E581 PolarHBondContact NZ-OE1 3.19Å; K573-E581 IonicContact NZ-OE2 2.82Å; K573-E581 PolarHBondContact NZ-OE2 2.66Å
574	S	63.2	Low	76.5	Confident	71 Å²	71	80.7 Å²	80.7	50%	0.497	44%	0.437	S	S	.	.			trans	-52.8	151.2	178.5	173.8	0	0	0	0	110.5	R572 E576 Q577 L578	R572-S574 PolarHBondContact O-N 2.88Å; S574-E576 PolarHBondContact O-N 2.59Å; S574-E576 VanDerWaalsContact O-N 3.08Å; S574-E576 PolarHBondContact OG-N 3.13Å; S574-Q577 WeakPolarHBondContact O-CA 3.48Å; S574-Q577 WeakPolarHBondContact O-CB 2.95Å; S574-Q577 PolarHBondContact O-N 3.13Å; S574-L578 WeakPolarHBondContact O-CG 3.47Å; S574-L578 PolarHBondContact O-N 2.89Å
575	A	63.8	Low	76.3	Confident	67 Å²	67	81.8 Å²	81.8	55%	0.554	44%	0.443	S	S	*	.	H	α-helix	trans	-53.7	-29.7	171.5	0	0	0	0	0	111.6	R579	A575-R579 WeakPolarHBondContact O-CD 3.47Å; A575-R579 VanDerWaalsContact O-CG 3.26Å; A575-R579 WeakPolarHBondContact O-CG 3.32Å; A575-R579 PolarHBondContact O-N 2.89Å; A575-R579 VanDerWaalsContact O-N 3.16Å
576	E	69.1	Low	76.3	Confident	94 Å²	94	83.7 Å²	83.7	44%	0.439	44%	0.441	S	S	.	.	H	α-helix	trans	-77	-41.3	174	-155.1	54.7	-138.7	0	0	113	S574 L578 R579 I580	S574-E576 PolarHBondContact O-N 2.59Å; S574-E576 VanDerWaalsContact O-N 3.08Å; S574-E576 PolarHBondContact OG-N 3.13Å; E576-L578 VanDerWaalsContact C-N 3.27Å; E576-L578 PolarHBondContact O-N 2.88Å; E576-R579 WeakPolarHBondContact O-CB 3.46Å; E576-R579 PolarHBondContact O-N 2.6Å; E576-R579 VanDerWaalsContact O-N 3.08Å; E576-R579 VanDerWaalsContact OE2-CD 3.26Å; E576-R579 WeakPolarHBondContact OE2-CD 3.37Å; E576-R579 IonicContact OE2-CZ 2.67Å; E576-R579 IonicContact OE2-NE 2.66Å; E576-R579 IonicContact OE2-NH1 3.69Å; E576-R579 PolarHBondContact OE2-NH1 3.24Å; E576-I580 HydrophobicContact CG-CD1 4.42Å; E576-I580 VanDerWaalsContact O-CG1 3.31Å; E576-I580 WeakPolarHBondContact O-CG1 3.37Å; E576-I580 PolarHBondContact O-N 3.45Å
577	Q	75	Confident	76.3	Confident	96 Å²	96	90.9 Å²	90.9	45%	0.449	47%	0.472	S	S	.	.	H	α-helix	trans	-57.3	-42.8	172.9	-163	83.8	30.8	0	0	111.3	K573 S574 I580 E581	K573-Q577 HydrophobicContact CB-CB 4.09Å; K573-Q577 HydrophobicContact CB-CG 4.13Å; K573-Q577 HydrophobicContact CD-CG 4.32Å; K573-Q577 HydrophobicContact CG-CG 4.42Å; S574-Q577 WeakPolarHBondContact O-CA 3.48Å; S574-Q577 WeakPolarHBondContact O-CB 2.95Å; S574-Q577 PolarHBondContact O-N 3.13Å; Q577-I580 PolarHBondContact O-N 2.71Å; Q577-E581 WeakPolarHBondContact O-CG 3.45Å; Q577-E581 PolarHBondContact O-N 3.19Å
578	L	77.6	Confident	76.4	Confident	94 Å²	94	95.9 Å²	95.9	49%	0.492	49%	0.494	S	S	.	.	H	α-helix	trans	-66.8	-34.4	176.2	-69.4	171.4	0	0	0	112.5	K573 S574 E576 L582	K573-L578 HydrophobicContact CB-CD2 3.85Å; K573-L578 HydrophobicContact CB-CG 3.84Å; K573-L578 HydrophobicContact CD-CD2 4.17Å; S574-L578 WeakPolarHBondContact O-CG 3.47Å; S574-L578 PolarHBondContact O-N 2.89Å; E576-L578 VanDerWaalsContact C-N 3.27Å; E576-L578 PolarHBondContact O-N 2.88Å; L578-L582 WeakPolarHBondContact O-CB 3.09Å; L578-L582 PolarHBondContact O-N 3Å
579	R	82.3	Confident	76.7	Confident	142 Å²	142	96.8 Å²	96.8	54%	0.536	50%	0.499	S	S	.	.	H	α-helix	trans	-67.2	-45	172.5	-76.5	162.7	176.2	169.1	-2.5	111.7	A575 E576 L582 N583	A575-R579 WeakPolarHBondContact O-CD 3.47Å; A575-R579 VanDerWaalsContact O-CG 3.26Å; A575-R579 WeakPolarHBondContact O-CG 3.32Å; A575-R579 PolarHBondContact O-N 2.89Å; A575-R579 VanDerWaalsContact O-N 3.16Å; E576-R579 WeakPolarHBondContact O-CB 3.46Å; E576-R579 PolarHBondContact O-N 2.6Å; E576-R579 VanDerWaalsContact O-N 3.08Å; E576-R579 VanDerWaalsContact OE2-CD 3.26Å; E576-R579 WeakPolarHBondContact OE2-CD 3.37Å; E576-R579 IonicContact OE2-CZ 2.67Å; E576-R579 IonicContact OE2-NE 2.66Å; E576-R579 IonicContact OE2-NH1 3.69Å; E576-R579 PolarHBondContact OE2-NH1 3.24Å; R579-L582 PolarHBondContact O-N 3.47Å; R579-N583 VanDerWaalsContact O-CB 3.28Å; R579-N583 WeakPolarHBondContact O-CB 3.39Å; R579-N583 PolarHBondContact O-N 3.41Å; R579-N583 PolarHBondContact O-ND2 3.45Å
580	I	84.7	Confident	78.2	Confident	97 Å²	97	97.3 Å²	97.3	50%	0.497	50%	0.503	S	S	.	.	H	α-helix	trans	-59	-50.9	178.4	-68.4	163.1	0	0	0	109.8	E576 Q577 N583 A584	E576-I580 HydrophobicContact CG-CD1 4.42Å; E576-I580 VanDerWaalsContact O-CG1 3.31Å; E576-I580 WeakPolarHBondContact O-CG1 3.37Å; E576-I580 PolarHBondContact O-N 3.45Å; Q577-I580 PolarHBondContact O-N 2.71Å; I580-N583 PolarHBondContact O-N 3.33Å; I580-A584 WeakPolarHBondContact O-CB 3.4Å; I580-A584 PolarHBondContact O-N 2.95Å
581	E	83.8	Confident	80.1	Confident	72 Å²	72	98.2 Å²	98.2	34%	0.336	50%	0.498	S	S	.	.	H	α-helix	trans	-64.1	-43.7	178.3	-70.9	174.5	-167.4	0	0	112.6	K573 Q577 N583 A584 E585	K573-E581 WeakPolarHBondContact CD-OE1 3.4Å; K573-E581 WeakPolarHBondContact CD-OE2 3.41Å; K573-E581 WeakPolarHBondContact CE-OE1 2.99Å; K573-E581 IonicContact NZ-OE1 2.91Å; K573-E581 PolarHBondContact NZ-OE1 3.19Å; K573-E581 IonicContact NZ-OE2 2.82Å; K573-E581 PolarHBondContact NZ-OE2 2.66Å; Q577-E581 WeakPolarHBondContact O-CG 3.45Å; Q577-E581 PolarHBondContact O-N 3.19Å; E581-N583 VanDerWaalsContact C-N 3.28Å; E581-N583 PolarHBondContact O-N 2.69Å; E581-A584 PolarHBondContact O-N 2.98Å; E581-E585 PolarHBondContact O-N 2.89Å
582	L	90.6	Very high	82	Confident	95 Å²	95	99.5 Å²	99.5	50%	0.497	50%	0.498	S	S	.	.	H	α-helix	trans	-61.9	-36.2	176.4	179.5	63.5	0	0	0	112	L578 R579 K586	L578-L582 WeakPolarHBondContact O-CB 3.09Å; L578-L582 PolarHBondContact O-N 3Å; R579-L582 PolarHBondContact O-N 3.47Å; L582-K586 HydrophobicContact CG-CD 4.3Å; L582-K586 WeakPolarHBondContact O-CB 3.49Å; L582-K586 WeakPolarHBondContact O-CD 3.33Å; L582-K586 WeakPolarHBondContact O-CG 3.26Å; L582-K586 PolarHBondContact O-N 2.91Å
583	N	91.2	Very high	83.9	Confident	92 Å²	92	95.2 Å²	95.2	49%	0.492	49%	0.487	S	S	.	.	H	α-helix	trans	-75	-37.8	177.7	-70.6	-18.2	0	0	0	112	R579 I580 E581 K586 F587	R579-N583 VanDerWaalsContact O-CB 3.28Å; R579-N583 WeakPolarHBondContact O-CB 3.39Å; R579-N583 PolarHBondContact O-N 3.41Å; R579-N583 PolarHBondContact O-ND2 3.45Å; I580-N583 PolarHBondContact O-N 3.33Å; E581-N583 VanDerWaalsContact C-N 3.28Å; E581-N583 PolarHBondContact O-N 2.69Å; N583-K586 PolarHBondContact O-N 3.45Å; N583-F587 WeakPolarHBondContact O-CB 3.29Å; N583-F587 PolarHBondContact O-N 2.6Å
584	A	92.1	Very high	85.7	Confident	60 Å²	60	96.6 Å²	96.6	50%	0.496	49%	0.493	S	S	.	.	H	α-helix	trans	-61.7	-47.3	172.7	0	0	0	0	0	111.6	I580 E581 K586 F587 K588	I580-A584 WeakPolarHBondContact O-CB 3.4Å; I580-A584 PolarHBondContact O-N 2.95Å; E581-A584 PolarHBondContact O-N 2.98Å; A584-K586 PolarHBondContact O-N 3.3Å; A584-F587 WeakPolarHBondContact O-CB 3.41Å; A584-F587 PolarHBondContact O-N 2.85Å; A584-K588 WeakPolarHBondContact O-CB 3.29Å; A584-K588 PolarHBondContact O-N 2.73Å
585	E	89.7	Confident	87.1	Confident	85 Å²	85	97 Å²	97	40%	0.397	49%	0.487	S	S	.	.	H	α-helix	trans	-70.9	-31.8	179.8	-161.6	58.6	-139.3	0	0	111.9	E581 K588 N589	E581-E585 PolarHBondContact O-N 2.89Å; E585-K588 VanDerWaalsContact CD-NZ 3.28Å; E585-K588 PolarHBondContact O-N 3.27Å; E585-K588 IonicContact OE1-NZ 3.9Å; E585-K588 PolarHBondContact OE1-NZ 2.95Å; E585-K588 IonicContact OE2-NZ 2.71Å; E585-K588 PolarHBondContact OE2-NZ 3.38Å; E585-N589 WeakPolarHBondContact O-CB 3.41Å; E585-N589 PolarHBondContact O-N 2.86Å; E585-N589 PolarHBondContact O-ND2 3.07Å; E585-N589 PolarHBondContact OE1-ND2 3.38Å
586	K	92.8	Very high	88.5	Confident	118 Å²	118	98.7 Å²	98.7	51%	0.513	49%	0.486	S	S	.	.	H	α-helix	trans	-61.9	-43.3	167.8	-80.3	168.9	-178.7	173.2	0	112.4	L582 N583 A584 N589 S590	L582-K586 HydrophobicContact CG-CD 4.3Å; L582-K586 WeakPolarHBondContact O-CB 3.49Å; L582-K586 WeakPolarHBondContact O-CD 3.33Å; L582-K586 WeakPolarHBondContact O-CG 3.26Å; L582-K586 PolarHBondContact O-N 2.91Å; N583-K586 PolarHBondContact O-N 3.45Å; A584-K586 PolarHBondContact O-N 3.3Å; K586-N589 PolarHBondContact O-N 2.88Å; K586-S590 WeakPolarHBondContact O-CB 2.98Å; K586-S590 PolarHBondContact O-N 3.37Å
587	F	94.1	Very high	89.6	Confident	152 Å²	152	100.4 Å²	100.4	67%	0.667	49%	0.492	S	S	*	.	H	α-helix	trans	-63.4	-45.7	177.1	179.4	-96.5	0	0	0	111.2	N583 A584 N589 S590 L591	N583-F587 WeakPolarHBondContact O-CB 3.29Å; N583-F587 PolarHBondContact O-N 2.6Å; A584-F587 WeakPolarHBondContact O-CB 3.41Å; A584-F587 PolarHBondContact O-N 2.85Å; F587-N589 PolarHBondContact O-N 3.06Å; F587-S590 WeakPolarHBondContact O-CB 3.48Å; F587-S590 PolarHBondContact O-N 2.93Å; F587-L591 PolarHBondContact O-N 2.89Å
588	K	92.1	Very high	90.4	Very high	107 Å²	107	101.3 Å²	101.3	47%	0.465	49%	0.494	S	S	.	.	H	α-helix	trans	-59.4	-44.3	175	179.7	166.3	157.7	-120.2	0	112.5	A584 E585 L591 L592	A584-K588 WeakPolarHBondContact O-CB 3.29Å; A584-K588 PolarHBondContact O-N 2.73Å; E585-K588 VanDerWaalsContact CD-NZ 3.28Å; E585-K588 PolarHBondContact O-N 3.27Å; E585-K588 IonicContact OE1-NZ 3.9Å; E585-K588 PolarHBondContact OE1-NZ 2.95Å; E585-K588 IonicContact OE2-NZ 2.71Å; E585-K588 PolarHBondContact OE2-NZ 3.38Å; K588-L591 PolarHBondContact O-N 2.78Å; K588-L592 HydrophobicContact CG-CD1 4.29Å; K588-L592 WeakPolarHBondContact O-CG 3.34Å; K588-L592 PolarHBondContact O-N 2.97Å
589	N	90.3	Very high	91	Very high	74 Å²	74	99.7 Å²	99.7	40%	0.396	50%	0.495	S	S	.	.	H	α-helix	trans	-63.9	-39.9	173.8	-84.5	-85.2	0	0	0	112.6	E585 K586 F587 L592 Q593	E585-N589 WeakPolarHBondContact O-CB 3.41Å; E585-N589 PolarHBondContact O-N 2.86Å; E585-N589 PolarHBondContact O-ND2 3.07Å; E585-N589 PolarHBondContact OE1-ND2 3.38Å; K586-N589 PolarHBondContact O-N 2.88Å; F587-N589 PolarHBondContact O-N 3.06Å; N589-L592 PolarHBondContact O-N 3.36Å; N589-Q593 WeakPolarHBondContact O-CB 3.12Å; N589-Q593 VanDerWaalsContact O-CG 3.29Å; N589-Q593 WeakPolarHBondContact O-CG 3.45Å; N589-Q593 PolarHBondContact O-N 3.03Å
590	S	94.8	Very high	91.4	Very high	74 Å²	74	98.7 Å²	98.7	52%	0.517	50%	0.496	S	S	.	.	H	α-helix	trans	-61.9	-41.6	174.6	-174.6	0	0	0	0	112.2	K586 F587 Q593 K594	K586-S590 WeakPolarHBondContact O-CB 2.98Å; K586-S590 PolarHBondContact O-N 3.37Å; F587-S590 WeakPolarHBondContact O-CB 3.48Å; F587-S590 PolarHBondContact O-N 2.93Å; S590-Q593 PolarHBondContact O-N 3.31Å; S590-K594 WeakPolarHBondContact O-CB 3.48Å; S590-K594 PolarHBondContact O-N 3.3Å
591	L	94.8	Very high	91.6	Very high	87 Å²	87	100.3 Å²	100.3	46%	0.455	50%	0.503	S	S	.	.	H	α-helix	trans	-64.4	-47.8	174.8	-176.5	61.1	0	0	0	111.6	F587 K588 Q593 K594 E595	F587-L591 PolarHBondContact O-N 2.89Å; K588-L591 PolarHBondContact O-N 2.78Å; L591-Q593 PolarHBondContact O-N 3.1Å; L591-K594 WeakPolarHBondContact O-CA 3.38Å; L591-K594 WeakPolarHBondContact O-CB 3.36Å; L591-K594 PolarHBondContact O-N 2.96Å; L591-E595 PolarHBondContact O-N 3.49Å
592	L	91.2	Very high	91.8	Very high	102 Å²	102	99.8 Å²	99.8	53%	0.534	51%	0.512	S	S	.	.	H	α-helix	trans	-60.3	-41.9	176.7	-71.3	170.1	0	0	0	112.1	K588 N589 K594 E595 L596	K588-L592 HydrophobicContact CG-CD1 4.29Å; K588-L592 WeakPolarHBondContact O-CG 3.34Å; K588-L592 PolarHBondContact O-N 2.97Å; N589-L592 PolarHBondContact O-N 3.36Å; L592-K594 VanDerWaalsContact C-N 3.28Å; L592-K594 PolarHBondContact O-N 2.68Å; L592-E595 PolarHBondContact O-N 3.46Å; L592-L596 VanDerWaalsContact O-CB 3.24Å; L592-L596 WeakPolarHBondContact O-CB 3.44Å; L592-L596 PolarHBondContact O-N 3.2Å
593	Q	92.3	Very high	91.6	Very high	115 Å²	115	98.2 Å²	98.2	54%	0.537	51%	0.512	S	S	.	.	H	α-helix	trans	-62.8	-33.3	173.5	-74.5	178	11.2	0	0	112.7	N589 S590 L591 K597	N589-Q593 WeakPolarHBondContact O-CB 3.12Å; N589-Q593 VanDerWaalsContact O-CG 3.29Å; N589-Q593 WeakPolarHBondContact O-CG 3.45Å; N589-Q593 PolarHBondContact O-N 3.03Å; S590-Q593 PolarHBondContact O-N 3.31Å; L591-Q593 PolarHBondContact O-N 3.1Å; Q593-K597 WeakPolarHBondContact O-CB 3.14Å; Q593-K597 VanDerWaalsContact O-CG 3.31Å; Q593-K597 WeakPolarHBondContact O-CG 3.44Å; Q593-K597 PolarHBondContact O-N 3.22Å
594	K	93.5	Very high	91.4	Very high	135 Å²	135	99.7 Å²	99.7	59%	0.587	51%	0.514	S	S	*	.	H	α-helix	trans	-70.5	-44.9	176.5	-169.3	179.5	-177.2	-179.3	0	111.6	S590 L591 L592 K597 K598	S590-K594 WeakPolarHBondContact O-CB 3.48Å; S590-K594 PolarHBondContact O-N 3.3Å; L591-K594 WeakPolarHBondContact O-CA 3.38Å; L591-K594 WeakPolarHBondContact O-CB 3.36Å; L591-K594 PolarHBondContact O-N 2.96Å; L592-K594 VanDerWaalsContact C-N 3.28Å; L592-K594 PolarHBondContact O-N 2.68Å; K594-K597 PolarHBondContact O-N 2.98Å; K594-K598 WeakPolarHBondContact O-CG 3.41Å; K594-K598 PolarHBondContact O-N 3.01Å
595	E	93.2	Very high	91.2	Very high	80 Å²	80	100.6 Å²	100.6	37%	0.374	51%	0.513	S	S	.	.	H	α-helix	trans	-67.7	-39.6	176.1	-60.2	-46.3	123	0	0	112	L591 L592 K597 K598 A599	L591-E595 PolarHBondContact O-N 3.49Å; L592-E595 PolarHBondContact O-N 3.46Å; E595-K597 VanDerWaalsContact C-N 3.34Å; E595-K597 PolarHBondContact O-N 3.35Å; E595-K598 WeakPolarHBondContact O-CB 3.41Å; E595-K598 PolarHBondContact O-N 2.66Å; E595-K598 VanDerWaalsContact O-N 3.14Å; E595-K598 WeakPolarHBondContact OE1-CE 3.48Å; E595-K598 IonicContact OE1-NZ 2.69Å; E595-K598 PolarHBondContact OE1-NZ 3.1Å; E595-K598 WeakPolarHBondContact OE2-CD 3.43Å; E595-K598 VanDerWaalsContact OE2-CE 3.32Å; E595-K598 WeakPolarHBondContact OE2-CE 3.41Å; E595-K598 IonicContact OE2-NZ 2.77Å; E595-K598 PolarHBondContact OE2-NZ 3.5Å; E595-A599 WeakPolarHBondContact O-CB 3.43Å; E595-A599 PolarHBondContact O-N 2.65Å
596	L	92.7	Very high	90.8	Very high	101 Å²	101	98.4 Å²	98.4	53%	0.529	51%	0.51	S	S	.	.	H	α-helix	trans	-60.2	-42.3	173.7	-174.2	149.8	0	0	0	111.5	L592 A599 Q600	L592-L596 VanDerWaalsContact O-CB 3.24Å; L592-L596 WeakPolarHBondContact O-CB 3.44Å; L592-L596 PolarHBondContact O-N 3.2Å; L596-A599 PolarHBondContact O-N 3.22Å; L596-Q600 HydrophobicContact CD2-CG 4.26Å; L596-Q600 WeakPolarHBondContact O-CG 3.38Å; L596-Q600 PolarHBondContact O-N 2.81Å
597	K	92.6	Very high	90.2	Very high	131 Å²	131	95.4 Å²	95.4	57%	0.57	51%	0.507	S	S	*	.	H	α-helix	trans	-64.8	-38.8	173	-77.7	175.2	178.9	177.4	0	112.9	Q593 K594 E595 M601	Q593-K597 WeakPolarHBondContact O-CB 3.14Å; Q593-K597 VanDerWaalsContact O-CG 3.31Å; Q593-K597 WeakPolarHBondContact O-CG 3.44Å; Q593-K597 PolarHBondContact O-N 3.22Å; K594-K597 PolarHBondContact O-N 2.98Å; E595-K597 VanDerWaalsContact C-N 3.34Å; E595-K597 PolarHBondContact O-N 3.35Å; K597-M601 WeakPolarHBondContact O-CB 3.25Å; K597-M601 WeakPolarHBondContact O-CG 3.23Å; K597-M601 PolarHBondContact O-N 3.06Å
598	K	92.3	Very high	89.6	Confident	114 Å²	114	92.8 Å²	92.8	50%	0.496	50%	0.497	S	S	.	.	H	α-helix	trans	-61.2	-46.1	171.9	-68.8	-174.7	-155.6	159.3	0	111.2	K594 E595 M601 A602	K594-K598 WeakPolarHBondContact O-CG 3.41Å; K594-K598 PolarHBondContact O-N 3.01Å; E595-K598 WeakPolarHBondContact O-CB 3.41Å; E595-K598 PolarHBondContact O-N 2.66Å; E595-K598 VanDerWaalsContact O-N 3.14Å; E595-K598 WeakPolarHBondContact OE1-CE 3.48Å; E595-K598 IonicContact OE1-NZ 2.69Å; E595-K598 PolarHBondContact OE1-NZ 3.1Å; E595-K598 WeakPolarHBondContact OE2-CD 3.43Å; E595-K598 VanDerWaalsContact OE2-CE 3.32Å; E595-K598 WeakPolarHBondContact OE2-CE 3.41Å; E595-K598 IonicContact OE2-NZ 2.77Å; E595-K598 PolarHBondContact OE2-NZ 3.5Å; K598-M601 PolarHBondContact O-N 2.95Å; K598-A602 WeakPolarHBondContact O-CB 3.5Å; K598-A602 PolarHBondContact O-N 3.46Å
599	A	89.8	Confident	89	Confident	61 Å²	61	94.1 Å²	94.1	50%	0.504	51%	0.505	S	S	.	.	H	α-helix	trans	-62.2	-43.7	-179.6	0	0	0	0	0	111.6	E595 L596 A602 A603	E595-A599 WeakPolarHBondContact O-CB 3.43Å; E595-A599 PolarHBondContact O-N 2.65Å; L596-A599 PolarHBondContact O-N 3.22Å; A599-A602 PolarHBondContact O-N 2.86Å; A599-A603 VanDerWaalsContact O-CB 3.28Å; A599-A603 WeakPolarHBondContact O-CB 3.45Å; A599-A603 PolarHBondContact O-N 3.44Å
600	Q	91.3	Very high	88.4	Confident	120 Å²	120	99.4 Å²	99.4	56%	0.561	52%	0.519	S	S	*	.	H	α-helix	trans	-60.7	-44.7	173.3	-74.8	176.1	-28.7	0	0	112.5	L596 A603 K604	L596-Q600 HydrophobicContact CD2-CG 4.26Å; L596-Q600 WeakPolarHBondContact O-CG 3.38Å; L596-Q600 PolarHBondContact O-N 2.81Å; Q600-A603 PolarHBondContact O-N 3.42Å; Q600-K604 WeakPolarHBondContact O-CB 3.47Å; Q600-K604 PolarHBondContact O-N 3.1Å
601	M	89.3	Confident	87.4	Confident	131 Å²	131	98.6 Å²	98.6	65%	0.645	52%	0.517	S	S	*	.	H	α-helix	trans	-66.8	-40.1	178.1	-68	-71.9	-82.2	0	0	111.9	K597 K598 K604 V605	K597-M601 WeakPolarHBondContact O-CB 3.25Å; K597-M601 WeakPolarHBondContact O-CG 3.23Å; K597-M601 PolarHBondContact O-N 3.06Å; K598-M601 PolarHBondContact O-N 2.95Å; M601-K604 PolarHBondContact O-N 2.81Å; M601-V605 WeakPolarHBondContact O-CG2 3.42Å; M601-V605 PolarHBondContact O-N 3.26Å
602	A	87.6	Confident	86.4	Confident	62 Å²	62	100 Å²	100	51%	0.512	52%	0.524	S	S	.	.	H	α-helix	trans	-65.9	-41.1	174.8	0	0	0	0	0	112.1	K598 A599 K604 V605 A606	K598-A602 WeakPolarHBondContact O-CB 3.5Å; K598-A602 PolarHBondContact O-N 3.46Å; A599-A602 PolarHBondContact O-N 2.86Å; A602-K604 VanDerWaalsContact C-N 3.35Å; A602-V605 PolarHBondContact O-N 3.4Å; A602-A606 WeakPolarHBondContact O-CB 3.41Å; A602-A606 PolarHBondContact O-N 3.3Å
603	A	86.3	Confident	85.5	Confident	62 Å²	62	101.1 Å²	101.1	51%	0.512	53%	0.525	S	S	.	.	H	α-helix	trans	-63.4	-40	174.3	0	0	0	0	0	111.8	A599 Q600 A606 A607	A599-A603 VanDerWaalsContact O-CB 3.28Å; A599-A603 WeakPolarHBondContact O-CB 3.45Å; A599-A603 PolarHBondContact O-N 3.44Å; Q600-A603 PolarHBondContact O-N 3.42Å; A603-A606 PolarHBondContact O-N 2.87Å; A603-A607 WeakPolarHBondContact O-CB 3.39Å; A603-A607 PolarHBondContact O-N 2.69Å
604	K	87	Confident	84.4	Confident	123 Å²	123	100 Å²	100	54%	0.535	53%	0.526	S	S	.	.	H	α-helix	trans	-63.7	-47.8	174.3	179.9	170.9	172.6	172.8	0	112	Q600 M601 A602 A606 A607 E608	Q600-K604 WeakPolarHBondContact O-CB 3.47Å; Q600-K604 PolarHBondContact O-N 3.1Å; M601-K604 PolarHBondContact O-N 2.81Å; A602-K604 VanDerWaalsContact C-N 3.35Å; K604-A606 VanDerWaalsContact C-N 3.32Å; K604-A606 PolarHBondContact O-N 3.07Å; K604-A607 WeakPolarHBondContact O-CB 3.49Å; K604-A607 PolarHBondContact O-N 2.74Å; K604-A607 VanDerWaalsContact O-N 3.12Å; K604-E608 WeakPolarHBondContact CE-OE1 3.38Å; K604-E608 IonicContact NZ-OE1 3.79Å; K604-E608 WeakPolarHBondContact O-CG 3.4Å; K604-E608 PolarHBondContact O-N 3.12Å
605	V	87.3	Confident	82.9	Confident	78 Å²	78	98 Å²	98	47%	0.473	52%	0.522	S	S	.	.	H	α-helix	trans	-60.3	-42.7	175.6	171.4	0	0	0	0	110.9	M601 A602 A607 E608 E609	M601-V605 WeakPolarHBondContact O-CG2 3.42Å; M601-V605 PolarHBondContact O-N 3.26Å; A602-V605 PolarHBondContact O-N 3.4Å; V605-A607 VanDerWaalsContact C-N 3.3Å; V605-A607 PolarHBondContact O-N 2.85Å; V605-E608 PolarHBondContact O-N 3.46Å; V605-E609 HydrophobicContact CG1-CG 4.48Å; V605-E609 WeakPolarHBondContact O-CG 3.24Å; V605-E609 PolarHBondContact O-N 2.73Å
606	A	81.9	Confident	81.5	Confident	39 Å²	39	103.4 Å²	103.4	32%	0.322	54%	0.539	S	S	.	.	H	α-helix	trans	-65.3	-30	175.9	0	0	0	0	0	113.3	A602 A603 K604 R610	A602-A606 WeakPolarHBondContact O-CB 3.41Å; A602-A606 PolarHBondContact O-N 3.3Å; A603-A606 PolarHBondContact O-N 2.87Å; K604-A606 VanDerWaalsContact C-N 3.32Å; K604-A606 PolarHBondContact O-N 3.07Å; A606-R610 WeakPolarHBondContact O-CB 3.41Å; A606-R610 WeakPolarHBondContact O-CD 3.47Å; A606-R610 WeakPolarHBondContact O-CG 3.26Å; A606-R610 PolarHBondContact O-N 3.14Å; A606-R610 VanDerWaalsContact O-N 3.09Å
607	A	80.4	Confident	80	Confident	56 Å²	56	103.9 Å²	103.9	46%	0.463	54%	0.54	S	S	.	.	H	α-helix	trans	-72.7	-41.5	172.4	0	0	0	0	0	112	A603 K604 V605 R610 A611	A603-A607 WeakPolarHBondContact O-CB 3.39Å; A603-A607 PolarHBondContact O-N 2.69Å; K604-A607 WeakPolarHBondContact O-CB 3.49Å; K604-A607 PolarHBondContact O-N 2.74Å; K604-A607 VanDerWaalsContact O-N 3.12Å; V605-A607 VanDerWaalsContact C-N 3.3Å; V605-A607 PolarHBondContact O-N 2.85Å; A607-R610 PolarHBondContact O-N 3.49Å; A607-A611 PolarHBondContact O-N 3.07Å
608	E	82.1	Confident	78.3	Confident	97 Å²	97	100.5 Å²	100.5	45%	0.453	54%	0.536	S	S	.	.	H	α-helix	trans	-64.8	-42.3	174.9	-71.4	172.8	-180	0	0	111.6	K604 V605 R610 A611 L612	K604-E608 WeakPolarHBondContact CE-OE1 3.38Å; K604-E608 IonicContact NZ-OE1 3.79Å; K604-E608 WeakPolarHBondContact O-CG 3.4Å; K604-E608 PolarHBondContact O-N 3.12Å; V605-E608 PolarHBondContact O-N 3.46Å; E608-R610 PolarHBondContact O-N 3.44Å; E608-A611 PolarHBondContact O-N 3.06Å; E608-L612 WeakPolarHBondContact O-CB 3.16Å; E608-L612 WeakPolarHBondContact O-CG 3.2Å; E608-L612 PolarHBondContact O-N 3.37Å
609	E	78.9	Confident	76.7	Confident	134 Å²	134	99.1 Å²	99.1	63%	0.626	54%	0.537	S	S	*	.	H	α-helix	trans	-62.4	-40.9	172.1	-75.2	-166.3	149.6	0	0	112.3	V605 L612 F613	V605-E609 HydrophobicContact CG1-CG 4.48Å; V605-E609 WeakPolarHBondContact O-CG 3.24Å; V605-E609 PolarHBondContact O-N 2.73Å; E609-L612 PolarHBondContact O-N 3.29Å; E609-F613 VanDerWaalsContact O-CB 3.28Å; E609-F613 WeakPolarHBondContact O-CB 3.5Å; E609-F613 PolarHBondContact O-N 2.93Å
610	R	76.9	Confident	75	Confident	186 Å²	186	106.1 Å²	106.1	70%	0.702	55%	0.551	S	S	*	*	H	α-helix	trans	-62.4	-42.8	174.4	-79.2	169.5	179.1	179	-0	111.8	A606 A607 E608 F613 T614	A606-R610 WeakPolarHBondContact O-CB 3.41Å; A606-R610 WeakPolarHBondContact O-CD 3.47Å; A606-R610 WeakPolarHBondContact O-CG 3.26Å; A606-R610 PolarHBondContact O-N 3.14Å; A606-R610 VanDerWaalsContact O-N 3.09Å; A607-R610 PolarHBondContact O-N 3.49Å; E608-R610 PolarHBondContact O-N 3.44Å; R610-F613 PolarHBondContact O-N 2.88Å; R610-T614 PolarHBondContact O-N 2.75Å; R610-T614 PolarHBondContact O-OG1 2.84Å
611	A	74.4	Confident	73.1	Confident	56 Å²	56	105.3 Å²	105.3	46%	0.463	56%	0.559	S	S	.	*	H	α-helix	trans	-64.2	-43.7	176.7	0	0	0	0	0	112.2	A607 E608 F613 T614 D615	A607-A611 PolarHBondContact O-N 3.07Å; E608-A611 PolarHBondContact O-N 3.06Å; A611-F613 VanDerWaalsContact C-N 3.28Å; A611-F613 PolarHBondContact O-N 2.84Å; A611-T614 WeakPolarHBondContact CA-OG1 3.14Å; A611-T614 PolarHBondContact O-N 2.72Å; A611-T614 PolarHBondContact O-OG1 3.16Å; A611-D615 PolarHBondContact O-N 3.03Å
612	L	73.3	Confident	71.3	Confident	116 Å²	116	104.8 Å²	104.8	61%	0.607	56%	0.563	S	S	*	*	H	α-helix	trans	-66.7	-30.1	175.2	-70.1	168.7	0	0	0	112.5	E608 E609 R616	E608-L612 WeakPolarHBondContact O-CB 3.16Å; E608-L612 WeakPolarHBondContact O-CG 3.2Å; E608-L612 PolarHBondContact O-N 3.37Å; E609-L612 PolarHBondContact O-N 3.29Å; L612-R616 WeakPolarHBondContact O-CB 3.4Å; L612-R616 WeakPolarHBondContact O-CG 3.2Å; L612-R616 PolarHBondContact O-N 2.98Å
613	F	72	Confident	69.5	Low	127 Å²	127	107.1 Å²	107.1	56%	0.557	57%	0.571	S	S	*	*	H	α-helix	trans	-71.9	-42.3	174.1	-174.8	-91.9	0	0	0	112.1	E609 R610 A611 R616 M617	E609-F613 VanDerWaalsContact O-CB 3.28Å; E609-F613 WeakPolarHBondContact O-CB 3.5Å; E609-F613 PolarHBondContact O-N 2.93Å; R610-F613 PolarHBondContact O-N 2.88Å; A611-F613 VanDerWaalsContact C-N 3.28Å; A611-F613 PolarHBondContact O-N 2.84Å; F613-R616 PolarHBondContact O-N 3.44Å; F613-M617 HydrophobicContact CE1-CE 3.65Å; F613-M617 HydrophobicContact CE1-CG 4.34Å; F613-M617 HydrophobicContact CE1-SD 3.82Å; F613-M617 HydrophobicContact CZ-CE 3.62Å; F613-M617 HydrophobicContact CZ-SD 4.37Å; F613-M617 PolarHBondContact O-N 3.2Å; F613-M617 VanDerWaalsContact O-N 3.12Å
614	T	69.4	Low	67.6	Low	91 Å²	91	113.3 Å²	113.3	56%	0.558	59%	0.589	S	S	*	*	H	α-helix	trans	-67.3	-40.7	176.7	49.9	0	0	0	0	112	R610 A611 R616 M617 A618	R610-T614 PolarHBondContact O-N 2.75Å; R610-T614 PolarHBondContact O-OG1 2.84Å; A611-T614 WeakPolarHBondContact CA-OG1 3.14Å; A611-T614 PolarHBondContact O-N 2.72Å; A611-T614 PolarHBondContact O-OG1 3.16Å; T614-R616 VanDerWaalsContact C-N 3.35Å; T614-R616 PolarHBondContact O-N 3.13Å; T614-M617 PolarHBondContact O-N 2.99Å; T614-A618 PolarHBondContact O-N 2.8Å
615	D	63.3	Low	65.5	Low	94 Å²	94	112.2 Å²	112.2	50%	0.503	60%	0.597	S	S	.	*	H	α-helix	trans	-62.5	-39.6	174.3	-176.3	51.6	0	0	0	112.3	A611 M617 A618 T619	A611-D615 PolarHBondContact O-N 3.03Å; D615-M617 VanDerWaalsContact C-N 3.26Å; D615-M617 PolarHBondContact O-N 2.97Å; D615-A618 PolarHBondContact O-N 3.47Å; D615-T619 WeakPolarHBondContact O-CB 3.5Å; D615-T619 WeakPolarHBondContact O-CG2 3.41Å; D615-T619 PolarHBondContact O-N 3.43Å; D615-T619 PolarHBondContact O-OG1 3.37Å
616	R	63.1	Low	63.6	Low	192 Å²	192	115.5 Å²	115.5	73%	0.725	61%	0.612	S	S	*	*	H	α-helix	trans	-65.3	-22.5	171.4	-83.9	-178.1	162.9	-175.3	-2.1	114.6	L612 F613 T614 T619 R620	L612-R616 WeakPolarHBondContact O-CB 3.4Å; L612-R616 WeakPolarHBondContact O-CG 3.2Å; L612-R616 PolarHBondContact O-N 2.98Å; F613-R616 PolarHBondContact O-N 3.44Å; T614-R616 VanDerWaalsContact C-N 3.35Å; T614-R616 PolarHBondContact O-N 3.13Å; R616-T619 WeakPolarHBondContact CA-OG1 3.41Å; R616-R620 WeakPolarHBondContact O-CB 3.19Å
617	M	59.9	Low	61.8	Low	112 Å²	112	125.8 Å²	125.8	55%	0.552	64%	0.642	S	S	*	*	H	α-helix	trans	-83.9	-39.5	171.2	-77.9	-162.2	160.6	0	0	112.4	F613 T614 D615 R620 S621	F613-M617 HydrophobicContact CE1-CE 3.65Å; F613-M617 HydrophobicContact CE1-CG 4.34Å; F613-M617 HydrophobicContact CE1-SD 3.82Å; F613-M617 HydrophobicContact CZ-CE 3.62Å; F613-M617 HydrophobicContact CZ-SD 4.37Å; F613-M617 PolarHBondContact O-N 3.2Å; F613-M617 VanDerWaalsContact O-N 3.12Å; T614-M617 PolarHBondContact O-N 2.99Å; D615-M617 VanDerWaalsContact C-N 3.26Å; D615-M617 PolarHBondContact O-N 2.97Å; M617-R620 PolarHBondContact O-N 3.37Å; M617-S621 PolarHBondContact O-N 3.31Å; M617-S621 PolarHBondContact O-OG 2.99Å; M617-S621 VanDerWaalsContact O-OG 3.12Å
618	A	58.6	Low	60.3	Low	60 Å²	60	130 Å²	130	50%	0.496	66%	0.662	S	S	.	*	H	α-helix	trans	-59.6	-53.5	174.5	0	0	0	0	0	110.9	T614 D615 R620 S621	T614-A618 PolarHBondContact O-N 2.8Å; D615-A618 PolarHBondContact O-N 3.47Å; A618-R620 VanDerWaalsContact C-N 3.27Å; A618-R620 PolarHBondContact O-N 2.82Å; A618-S621 PolarHBondContact O-N 3.21Å; A618-S621 VanDerWaalsContact O-N 3.11Å
619	T	57.6	Low	58.6	Low	84 Å²	84	130.8 Å²	130.8	52%	0.515	68%	0.679	S	S	.	*	H	α-helix	trans	-62.3	-28.4	-179.9	50.3	0	0	0	0	114	D615 R616	D615-T619 WeakPolarHBondContact O-CB 3.5Å; D615-T619 WeakPolarHBondContact O-CG2 3.41Å; D615-T619 PolarHBondContact O-N 3.43Å; D615-T619 PolarHBondContact O-OG1 3.37Å; R616-T619 WeakPolarHBondContact CA-OG1 3.41Å
620	R	55	Low	57.2	Low	208 Å²	208	135.7 Å²	135.7	79%	0.785	69%	0.692	S	S	*	*	H	α-helix	trans	-75.6	-20.9	175.6	-96.1	-175.7	160.8	-176.5	-4.7	114.7	R616 M617 A618 T622	R616-R620 WeakPolarHBondContact O-CB 3.19Å; M617-R620 PolarHBondContact O-N 3.37Å; A618-R620 VanDerWaalsContact C-N 3.27Å; A618-R620 PolarHBondContact O-N 2.82Å; R620-T622 PolarHBondContact O-N 3.38Å
621	S	50.2	Low	55.8	Low	104 Å²	104	134.4 Å²	134.4	73%	0.727	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.7	-16.9	-175.8	-63.9	0	0	0	0	113.5	M617 A618	M617-S621 PolarHBondContact O-N 3.31Å; M617-S621 PolarHBondContact O-OG 2.99Å; M617-S621 VanDerWaalsContact O-OG 3.12Å; A618-S621 PolarHBondContact O-N 3.21Å; A618-S621 VanDerWaalsContact O-N 3.11Å
622	T	51.2	Low	54.4	Low	120 Å²	120	138.7 Å²	138.7	74%	0.736	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.2	-15.8	-175.7	-51	0	0	0	0	114	R620	R620-T622 PolarHBondContact O-N 3.38Å
623	T	50.8	Low	53.2	Low	110 Å²	110	136.7 Å²	136.7	68%	0.675	72%	0.718	S	S	*	*	S	Bend	trans	-134.9	49.7	-170.5	65.6	0	0	0	0	116.2
624	Q	45.4	Very low	52	Low	193 Å²	193	140.5 Å²	140.5	90%	0.902	74%	0.735	S	S	*	*			trans	-157.7	87.2	141.6	-118.6	170.1	25.3	0	0	113.9
625	S	44.8	Very low	51	Low	100 Å²	100	145.2 Å²	145.2	70%	0.699	75%	0.748	S	S	*	*			trans	-72.4	150.8	158.6	-178.5	0	0	0	0	110.6
626	N	46.9	Very low	50	Low	147 Å²	147	149.7 Å²	149.7	79%	0.786	77%	0.768	S	S	*	*			trans	60.5	93.3	166.6	-63.9	-32.6	0	0	0	118.7
627	R	43.6	Very low	49.3	Very low	254 Å²	254	147.3 Å²	147.3	96%	0.958	77%	0.77	S	S	*	*				-160.7	134.4	117.6	-113.2	169.1	-179.9	-174.8	-0.9	113.9
628	T	49.2	Very low	48.7	Very low	144 Å²	144	153.4 Å²	153.4	88%	0.883	79%	0.786	S	S	*	*			trans	-94.3	128.6	178.1	51.3	0	0	0	0	111.9
629	S	45.2	Very low	48.3	Very low	114 Å²	114	156.2 Å²	156.2	80%	0.797	80%	0.802	S	S	*	*			trans	-151.6	133.3	165.3	56.3	0	0	0	0	112.1
630	R	50.5	Low	47.5	Very low	238 Å²	238	158.5 Å²	158.5	90%	0.898	82%	0.816	S	S	*	*			trans	-86.8	133.2	173.7	-73.3	-179.2	172.8	-174.9	-1.9	111.4
631	L	46.6	Very low	47.1	Very low	159 Å²	159	153.9 Å²	153.9	83%	0.832	82%	0.815	S	S	*	*			trans	-138.1	111.4	154.8	-73.9	168.4	0	0	0	105.5
632	I	45.3	Very low	46.9	Very low	146 Å²	146	156.1 Å²	156.1	75%	0.749	82%	0.819	S	S	*	*				53.9	92.1	68.5	-52.8	-179.6	0	0	0	110.3
633	G	47.8	Very low	46.5	Very low	73 Å²	73	155.8 Å²	155.8	75%	0.753	82%	0.816	S	S	*	*			trans	-82.1	163.5	-176.9	0	0	0	0	0	114.4
634	K	47.2	Very low	46.6	Very low	208 Å²	208	157.5 Å²	157.5	90%	0.904	82%	0.82	S	S	*	*			trans	-137.4	147.5	167.8	-74	-174.4	178.2	175.7	0	110.7
635	K	48.4	Very low	47	Very low	189 Å²	189	162.2 Å²	162.2	82%	0.822	83%	0.831	S	S	*	*			trans	-15.8	122	179.7	-64.7	-178.5	174.7	-176.2	0	117
636	M	44	Very low	47.1	Very low	189 Å²	189	165.3 Å²	165.3	93%	0.931	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-88.9	118.7	155.5	-171.3	159.5	66.2	0	0	108.5
637	N	47.2	Very low	47.1	Very low	142 Å²	142	166.3 Å²	166.3	76%	0.759	84%	0.841	S	S	*	*	P	Polyproline II helix	trans	-80	125.9	178.5	-71	-24.5	0	0	0	109.7	S639	N637-S639 PolarHBondContact O-N 3.5Å
638	R	47.8	Very low	47.3	Very low	240 Å²	240	161.4 Å²	161.4	91%	0.906	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-70.2	122.8	169.4	-79.1	178.4	162.5	-179.4	-7.2	109.6
639	S	49.8	Very low	47.2	Very low	119 Å²	119	162.4 Å²	162.4	83%	0.832	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-71.3	145.6	159	42.5	0	0	0	0	109.7	N637	N637-S639 PolarHBondContact O-N 3.5Å
640	V	40.8	Very low	47.4	Very low	131 Å²	131	165.4 Å²	165.4	79%	0.794	83%	0.833	S	S	*	*			trans	-110.3	119	-179.1	178.4	0	0	0	0	108.6	L642	V640-L642 PolarHBondContact O-N 3.41Å
641	S	47.2	Very low	47.2	Very low	111 Å²	111	160.6 Å²	160.6	78%	0.776	83%	0.829	S	S	*	*			trans	-78.4	114.1	169.4	52.7	0	0	0	0	109.6
642	L	45.5	Very low	47.2	Very low	152 Å²	152	160.7 Å²	160.7	80%	0.796	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-83.9	116.8	177.8	-172.1	75.8	0	0	0	110.2	V640 I644	V640-L642 PolarHBondContact O-N 3.41Å; L642-I644 HydrophobicContact CD2-CG1 4.44Å
643	T	43.8	Very low	47.3	Very low	112 Å²	112	161.8 Å²	161.8	69%	0.687	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-91.8	121	167.8	-53	0	0	0	0	109
644	I	51.7	Low	47.3	Very low	147 Å²	147	169.3 Å²	169.3	75%	0.754	84%	0.842	S	S	*	*	P	Polyproline II helix	trans	-86.4	139.8	166.8	-58.4	177.3	0	0	0	107.5	L642	L642-I644 HydrophobicContact CD2-CG1 4.44Å
645	Y	54.4	Low	47.3	Very low	291 Å²	291	165.7 Å²	165.7	100%	1.141	84%	0.836	S	S	*	*			trans	-85.1	0	-176.5	-82.1	-89.9	0	0	0	112.9

Retrieved 645 of 645 residues in 90.2 ms (Link to these results)

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