SPT13_HUMAN Loading...

Spermatogenesis-associated protein 13

Acts as a guanine nucleotide exchange factor (GEF) for RHOA, RAC1 and CDC42 GTPases. Regulates cell migration and adhesion assembly and disassembly through a RAC1, PI3K, RHOA and AKT1-dependent mechanism. Increases both RAC1 and CDC42 activity, but decreases the amount of active RHOA. Required for MMP9 up-regulation via the JNK signaling pathway in colorectal tumor cells. Involved in tumor angiogenesis and may play a role in intestinal adenoma formation and tumor progression.

AlphaFold DB , UniProt , Accession Q96N96, Species HUMAN (Homo sapiens, Human), Gene SPATA13, Length 652 aa.

Structure Viewer

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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	41.5	Very low	41.5	Very low	231 Å²	231	133.3 Å²	133.3	100%	1.138	79%	0.786	S	S	*	*				0	90.6	0	-68.9	-179.1	164.6	0	0	106.1
2	T	40.2	Very low	41.6	Very low	127 Å²	127	131.9 Å²	131.9	78%	0.779	78%	0.784	S	S	*	*				63.1	97.9	111.1	49.3	0	0	0	0	111
3	S	40.2	Very low	41.6	Very low	108 Å²	108	133.2 Å²	133.2	76%	0.755	79%	0.793	S	S	*	*				104.8	133.5	61.1	56.9	0	0	0	0	111
4	A	40	Very low	41.3	Very low	100 Å²	100	129.2 Å²	129.2	83%	0.826	79%	0.794	S	S	*	*			trans	84.9	120.5	149.6	0	0	0	0	0	120.6
5	S	41.3	Very low	40.6	Very low	112 Å²	112	128.7 Å²	128.7	78%	0.783	80%	0.795	S	S	*	*			trans	-58.7	-169.8	155	-33.2	0	0	0	0	111.9
6	P	51.7	Low	40.5	Very low	98 Å²	98	128.3 Å²	128.3	64%	0.636	80%	0.795	S	S	*	*			cis	-150.6	-173	25.3	40.5	-15.8	0	0	0	117.9
7	E	41.7	Very low	40.3	Very low	174 Å²	174	132.8 Å²	132.8	81%	0.813	80%	0.801	S	S	*	*			trans	61.5	143.1	148.7	-73	156.7	-167.9	0	0	119.1
8	D	42	Very low	40	Very low	120 Å²	120	130.1 Å²	130.1	64%	0.642	80%	0.804	S	S	*	*			cis	-170.1	154.2	37.6	-148.2	3.3	0	0	0	113.7
9	Q	40.9	Very low	39.8	Very low	146 Å²	146	128.4 Å²	128.4	68%	0.682	81%	0.805	S	S	*	*			trans	27.2	126.2	149.8	-72.6	163.4	55.8	0	0	125.1
10	N	41.1	Very low	39.9	Very low	162 Å²	162	134.6 Å²	134.6	87%	0.866	81%	0.812	S	S	*	*				169.1	136.8	109.8	-93.7	-36	0	0	0	114.6
11	A	36.4	Very low	39.8	Very low	88 Å²	88	140.4 Å²	140.4	73%	0.727	82%	0.82	S	S	*	*			trans	-115	-176.6	162.8	0	0	0	0	0	108.1
12	P	42.2	Very low	39.7	Very low	117 Å²	117	141.1 Å²	141.1	76%	0.76	81%	0.81	S	S	*	*			cis	-143.2	-165.8	4.9	30.9	-4	0	0	0	115.6
13	V	42	Very low	39.6	Very low	148 Å²	148	146.6 Å²	146.6	90%	0.897	82%	0.816	S	S	*	*			trans	101.5	119.4	153	-167.5	0	0	0	0	119.2
14	G	37	Very low	39.5	Very low	78 Å²	78	147.6 Å²	147.6	80%	0.804	82%	0.82	S	S	*	*			trans	142.1	103	149.8	0	0	0	0	0	116.2
15	C	30.9	Very low	39.4	Very low	121 Å²	121	150.4 Å²	150.4	82%	0.818	82%	0.819	S	S	*	*			trans	-105.7	146.3	165.9	-160	0	0	0	0	108.4
16	P	39.6	Very low	39.1	Very low	122 Å²	122	150.8 Å²	150.8	79%	0.792	82%	0.822	S	S	*	*				-151.3	148.4	97.9	34.8	-15	0	0	0	117.4
17	K	36.5	Very low	38.2	Very low	205 Å²	205	152.2 Å²	152.2	89%	0.891	83%	0.829	S	S	*	*			trans	22.3	125.2	142.8	-65.7	179.7	176.2	177	0	121
18	G	34.4	Very low	38	Very low	84 Å²	84	152.3 Å²	152.3	87%	0.866	83%	0.833	S	S	*	*				123.4	92	129.1	0	0	0	0	0	116.7
19	A	37.3	Very low	37.5	Very low	99 Å²	99	150 Å²	150	82%	0.818	84%	0.838	S	S	*	*			trans	-127.6	109	166	0	0	0	0	0	111.2
20	R	40.3	Very low	37.2	Very low	252 Å²	252	146.6 Å²	146.6	95%	0.951	84%	0.842	S	S	*	*			trans	-62	132.5	170.1	-68.9	178.2	170	-162.1	-3.5	110.2
21	R	38.1	Very low	36.9	Very low	257 Å²	257	146 Å²	146	97%	0.97	84%	0.844	S	S	*	*			trans	-94.6	107.3	168.4	-69.8	-173.4	178.6	-166.2	0.4	110.4
22	R	39.4	Very low	36.8	Very low	245 Å²	245	146.2 Å²	146.2	93%	0.925	84%	0.84	S	S	*	*			trans	-105	138.2	155.9	-89.5	-169	176.8	-154.3	0.8	108.3
23	R	38	Very low	36.5	Very low	242 Å²	242	146.7 Å²	146.7	91%	0.913	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-82.3	144.2	174.8	-77	-175.5	178.8	-174.6	0.2	111.1
24	P	38.2	Very low	36.3	Very low	130 Å²	130	150.1 Å²	150.1	84%	0.844	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-77.4	143.2	174.2	-5.2	22.9	0	0	0	112
25	I	38	Very low	36.3	Very low	158 Å²	158	149.2 Å²	149.2	81%	0.81	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-89	132.9	165.3	-65.1	169	0	0	0	107.4	V27	I25-V27 HydrophobicContact CG2-CG2 4.19Å
26	S	34.4	Very low	36.6	Very low	121 Å²	121	149.3 Å²	149.3	85%	0.846	82%	0.822	S	S	*	*			trans	-119.3	126.9	164.5	66.6	0	0	0	0	110.6
27	V	34.3	Very low	36.3	Very low	127 Å²	127	150 Å²	150	77%	0.77	82%	0.819	S	S	*	*			trans	-100.1	128.7	-178.3	173.3	0	0	0	0	109.5	I25	I25-V27 HydrophobicContact CG2-CG2 4.19Å
28	I	36.4	Very low	36.4	Very low	176 Å²	176	148.5 Å²	148.5	90%	0.903	82%	0.815	S	S	*	*			trans	-158.7	130.2	157.5	-54.3	-178.5	0	0	0	105.3
29	G	32.9	Very low	36.4	Very low	72 Å²	72	149.2 Å²	149.2	74%	0.742	80%	0.803	S	S	*	*			cis	159.2	138.9	4.7	0	0	0	0	0	108.3
30	G	33.5	Very low	36.3	Very low	75 Å²	75	152.5 Å²	152.5	77%	0.773	80%	0.801	S	S	*	*			trans	93.3	132.8	167.8	0	0	0	0	0	115.8
31	V	35.8	Very low	36.2	Very low	148 Å²	148	147.9 Å²	147.9	90%	0.897	79%	0.79	S	S	*	*			cis	-154.1	148.3	14.9	172	0	0	0	0	109.3
32	S	33.6	Very low	36.2	Very low	93 Å²	93	142.5 Å²	142.5	65%	0.65	78%	0.78	S	S	*	*			trans	-57.2	155.8	-176.4	-175	0	0	0	0	117.3
33	L	35.3	Very low	36	Very low	128 Å²	128	136.3 Å²	136.3	67%	0.67	77%	0.765	S	S	*	*				173.1	121.3	111.8	-86	153.9	0	0	0	113.7
34	Y	38.8	Very low	35.9	Very low	219 Å²	219	130.4 Å²	130.4	86%	0.859	75%	0.752	S	S	*	*			trans	66	132.4	161.6	-55.5	-71.3	0	0	0	120
35	G	35.6	Very low	35.7	Very low	60 Å²	60	131.3 Å²	131.3	62%	0.619	75%	0.749	S	S	*	*			cis	173.6	151.2	-1.9	0	0	0	0	0	112.5
36	T	37.2	Very low	35.5	Very low	123 Å²	123	130.9 Å²	130.9	76%	0.755	75%	0.747	S	S	*	*			trans	71.4	104.3	144	11	0	0	0	0	119.4
37	N	35.1	Very low	35.4	Very low	137 Å²	137	130.8 Å²	130.8	73%	0.733	74%	0.742	S	S	*	*				79.2	133	94	-63.6	-2.3	0	0	0	111.8
38	Q	36.9	Very low	35.7	Very low	173 Å²	173	133.7 Å²	133.7	81%	0.808	75%	0.747	S	S	*	*			cis	-162.9	137.2	46.9	-72.5	178.3	15.8	0	0	108.1
39	T	34.7	Very low	35.7	Very low	98 Å²	98	131.4 Å²	131.4	60%	0.601	74%	0.744	S	S	*	*				98.6	110.4	66.8	-51.5	0	0	0	0	112.7
40	E	36.7	Very low	35.8	Very low	168 Å²	168	132.7 Å²	132.7	79%	0.785	75%	0.748	S	S	*	*			trans	72	144.2	142.5	-66.3	165.6	-170	0	0	119.3
41	E	37.8	Very low	35.9	Very low	155 Å²	155	134.8 Å²	134.8	72%	0.724	75%	0.75	S	S	*	*			cis	-169.1	146.3	37.3	-138.9	168.1	-161.2	0	0	110.5
42	L	37.4	Very low	35.9	Very low	145 Å²	145	138.5 Å²	138.5	76%	0.759	75%	0.748	S	S	*	*			trans	42.9	145.5	140.3	-95.4	79	0	0	0	122
43	D	34.6	Very low	36.1	Very low	114 Å²	114	139.7 Å²	139.7	61%	0.61	75%	0.754	S	S	*	*			cis	-173.2	155.6	-1.4	-140.1	-9.4	0	0	0	108.2
44	N	35.7	Very low	36.2	Very low	119 Å²	119	139.4 Å²	139.4	64%	0.636	76%	0.759	S	S	*	*			trans	70.1	108.5	142.5	-71.6	-30.8	0	0	0	124.3
45	L	34.9	Very low	36	Very low	148 Å²	148	137 Å²	137	78%	0.775	76%	0.758	S	S	*	*				116.2	124.6	118.3	-73.5	163.8	0	0	0	119.5
46	L	33.8	Very low	36.2	Very low	149 Å²	149	139.8 Å²	139.8	78%	0.78	77%	0.766	S	S	*	*			trans	99	97.1	149.5	-67.1	151.9	0	0	0	120.4
47	T	33.1	Very low	35.9	Very low	119 Å²	119	137.9 Å²	137.9	73%	0.73	76%	0.762	S	S	*	*				55.1	104.4	128	0.3	0	0	0	0	121.3
48	Q	39.3	Very low	36	Very low	188 Å²	188	140.6 Å²	140.6	88%	0.879	77%	0.77	S	S	*	*				164.4	134.8	124	-90.5	-170.5	26	0	0	111.2
49	P	36.7	Very low	35.8	Very low	129 Å²	129	141 Å²	141	84%	0.838	77%	0.772	S	S	*	*			trans	-91.4	130.5	-178.4	32.5	-28.8	0	0	0	114.3
50	A	36.1	Very low	35.8	Very low	99 Å²	99	142.9 Å²	142.9	82%	0.818	78%	0.783	S	S	*	*			trans	81.1	68.1	147.1	0	0	0	0	0	118.6
51	S	35.4	Very low	35.7	Very low	119 Å²	119	140.5 Å²	140.5	83%	0.832	78%	0.782	S	S	*	*			trans	-64.1	138.1	152.1	48.1	0	0	0	0	113
52	R	35	Very low	35.5	Very low	225 Å²	225	139.1 Å²	139.1	85%	0.849	79%	0.786	S	S	*	*			trans	-41.7	142.3	167	-144.3	178.3	-160.4	-158.8	4.2	112.9
53	P	38.5	Very low	35.2	Very low	118 Å²	118	143.6 Å²	143.6	77%	0.766	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-72	147.8	167.2	5.9	8.8	0	0	0	110.5
54	P	36.9	Very low	35.2	Very low	122 Å²	122	147 Å²	147	79%	0.792	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-78.9	142.4	-165.6	31.9	-33.9	0	0	0	112.8
55	M	35.3	Very low	34.9	Very low	168 Å²	168	145.9 Å²	145.9	83%	0.828	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-69.8	135.9	165	-88.7	-173.5	51.3	0	0	110.6
56	P	39.3	Very low	34.7	Very low	120 Å²	120	145.4 Å²	145.4	78%	0.779	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-74.6	123.8	160.5	-9.2	26.2	0	0	0	109.8
57	A	30.4	Very low	34.4	Very low	82 Å²	82	144 Å²	144	68%	0.678	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-78	128.8	169	0	0	0	0	0	109.7
58	H	38.3	Very low	34.3	Very low	195 Å²	195	143.2 Å²	143.2	90%	0.903	82%	0.823	S	S	*	*			trans	-141.1	122.3	149.5	-107.8	-72.1	0	0	0	110
59	Q	31.5	Very low	34	Very low	182 Å²	182	145.6 Å²	145.6	85%	0.85	82%	0.823	S	S	*	*			trans	-71.2	130.6	179.4	-62.5	163.8	-3.5	0	0	109.8
60	V	35.2	Very low	33.5	Very low	137 Å²	137	149 Å²	149	83%	0.83	83%	0.826	S	S	*	*			trans	-140.4	136.3	152.4	-176.6	0	0	0	0	107.4
61	P	35.3	Very low	33	Very low	117 Å²	117	155.6 Å²	155.6	76%	0.76	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-80.8	168.4	-155.1	-10.8	29.3	0	0	0	115.5
62	P	33.2	Very low	32.6	Very low	126 Å²	126	154.9 Å²	154.9	82%	0.818	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-89.5	135.2	-163.5	34.9	-31	0	0	0	112.8
63	Y	30.5	Very low	32.1	Very low	239 Å²	239	153 Å²	153	94%	0.937	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-101.8	132.9	162.6	-150.4	-93.7	0	0	0	110.6
64	K	35.2	Very low	31.6	Very low	187 Å²	187	153.7 Å²	153.7	81%	0.813	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-81.9	146.7	-162.8	-74.5	174	173.2	173.9	0	114.1
65	A	29.6	Very low	31.1	Very low	94 Å²	94	154 Å²	154	78%	0.777	81%	0.811	S	S	*	*			trans	65	142.8	145.3	0	0	0	0	0	117.3
66	V	30.3	Very low	30.8	Very low	139 Å²	139	150.2 Å²	150.2	84%	0.842	80%	0.801	S	S	*	*			cis	-150.1	139	40.7	170.2	0	0	0	0	110
67	S	26.9	Very low	30.6	Very low	119 Å²	119	146 Å²	146	83%	0.832	77%	0.771	S	S	*	*			trans	-67.1	136	168.5	-80.3	0	0	0	0	112.3
68	A	31.4	Very low	30.6	Very low	103 Å²	103	142.7 Å²	142.7	85%	0.851	74%	0.744	S	S	*	*			trans	-144.9	136.9	149.9	0	0	0	0	0	110.2
69	R	32.2	Very low	30.3	Very low	237 Å²	237	136.4 Å²	136.4	89%	0.894	72%	0.719	S	S	*	*			trans	-78.3	144.9	-164.3	-70.1	167.4	166.5	171.6	-6.3	113.6
70	F	26.2	Very low	30.3	Very low	202 Å²	202	130.5 Å²	130.5	89%	0.886	70%	0.696	S	S	*	*			trans	10	126.4	144.9	-67.2	-87.9	0	0	0	119.7
71	R	27.4	Very low	30.3	Very low	236 Å²	236	128.1 Å²	128.1	89%	0.891	68%	0.678	S	S	*	*				-157.8	152.1	120.6	-72.8	-148.2	-178.3	-161.5	-0.2	110.5
72	P	26.2	Very low	30.3	Very low	104 Å²	104	124.7 Å²	124.7	68%	0.675	66%	0.664	S	S	*	*			trans	-108.1	110.6	-160.6	33.8	-19.8	0	0	0	112.3
73	F	24.7	Very low	30.2	Very low	185 Å²	185	123.6 Å²	123.6	81%	0.811	65%	0.651	S	S	*	*			trans	-149.8	119.3	172.6	-74	-71.2	0	0	0	114.8
74	T	27.8	Very low	29.9	Very low	133 Å²	133	116 Å²	116	82%	0.816	63%	0.626	S	S	*	*			trans	54.4	99.1	152	66.1	0	0	0	0	119.4
75	F	25.9	Very low	29.7	Very low	128 Å²	128	116 Å²	116	56%	0.561	62%	0.621	S	S	*	*			trans	-77	142.4	171.3	-88.4	-94.1	0	0	0	113	Q77 A139	F75-Q77 HydrophobicContact CB-CG 3.99Å; F75-Q77 HydrophobicContact CD1-CG 4.2Å; F75-Q77 HydrophobicContact CG-CG 4.49Å; F75-A139 HydrophobicContact CD1-CB 4.13Å; F75-A139 HydrophobicContact CE1-CB 3.61Å; F75-A139 HydrophobicContact CZ-CB 4.22Å
76	S	28.7	Very low	29.6	Very low	89 Å²	89	119.2 Å²	119.2	62%	0.622	63%	0.631	S	S	*	*			trans	-106.3	112.8	161.5	175.3	0	0	0	0	107.9
77	Q	35.1	Very low	29.4	Very low	31 Å²	31	116 Å²	116	15%	0.145	63%	0.625	C	S	.	*			trans	-117.3	35.4	-172.3	-62.2	-166	-6.3	0	0	113.9	F75 T79 A139 I140 L143 L203	F75-Q77 HydrophobicContact CB-CG 3.99Å; F75-Q77 HydrophobicContact CD1-CG 4.2Å; F75-Q77 HydrophobicContact CG-CG 4.49Å; Q77-T79 PolarHBondContact O-N 3.5Å; Q77-A139 VanDerWaalsContact NE2-CB 3.31Å; Q77-A139 PolarHBondContact NE2-O 3.12Å; Q77-I140 VanDerWaalsContact OE1-CG1 3.25Å; Q77-L143 HydrophobicContact CG-CD1 4.41Å; Q77-L203 HydrophobicContact CB-CD1 4.27Å; Q77-L203 VanDerWaalsContact O-CD1 3.32Å; Q77-L203 WeakPolarHBondContact O-CD1 3.39Å
78	S	30.5	Very low	29.6	Very low	14 Å²	14	119.7 Å²	119.7	10%	0.098	62%	0.621	C	S	.	*			trans	-99.5	60.3	-175.8	57	0	0	0	0	114.2	E247	S78-E247 WeakPolarHBondContact CB-OE1 3.41Å; S78-E247 WeakPolarHBondContact OG-CG 3.48Å; S78-E247 PolarHBondContact OG-OE1 3.46Å
79	T	32.2	Very low	29.4	Very low	62 Å²	62	126.9 Å²	126.9	38%	0.38	63%	0.626	S	S	.	*			trans	-141.8	117.1	161.3	-36	0	0	0	0	110.2	Q77 I81 E136	Q77-T79 PolarHBondContact O-N 3.5Å; T79-I81 HydrophobicContact CG2-CG1 4.37Å; T79-E136 VanDerWaalsContact O-OE2 3.09Å
80	P	32	Very low	29.4	Very low	59 Å²	59	126.1 Å²	126.1	38%	0.383	62%	0.623	S	S	.	*			trans	-88.5	112	162.9	-1.7	19.7	0	0	0	109
81	I	36	Very low	29.5	Very low	86 Å²	86	125.7 Å²	125.7	44%	0.441	62%	0.624	S	S	.	*			trans	-89	123.4	167.6	-60.6	171.3	0	0	0	108.2	T79 E136	T79-I81 HydrophobicContact CG2-CG1 4.37Å; I81-E136 WeakPolarHBondContact CD1-OE2 3.5Å
82	G	34.6	Very low	29.8	Very low	45 Å²	45	123 Å²	123	46%	0.464	62%	0.624	S	S	.	*			trans	-164.2	47.3	-173.7	0	0	0	0	0	116.6
83	L	30.6	Very low	29.9	Very low	104 Å²	104	129.7 Å²	129.7	55%	0.545	64%	0.635	S	S	.	*			trans	-139.4	44.6	175.4	-79.4	175.3	0	0	0	115.1	L377	L83-L377 HydrophobicContact CD1-CD2 3.19Å
84	D	25.7	Very low	30.3	Very low	79 Å²	79	125.5 Å²	125.5	42%	0.422	64%	0.635	S	S	.	*			trans	-128.4	89.9	161.8	-61.7	-54.4	0	0	0	110.3	K182	D84-K182 PolarHBondContact O-NZ 2.82Å
85	R	29	Very low	30.6	Very low	186 Å²	186	124.3 Å²	124.3	70%	0.702	63%	0.632	S	S	*	*			trans	-175.8	67.4	156.4	-104	174.1	-155.3	-176.5	2.6	113.2	K182 D183	R85-K182 VanDerWaalsContact CD-CE 3.43Å; R85-K182 VanDerWaalsContact CZ-CE 3.42Å; R85-K182 VanDerWaalsContact NE-CE 3.35Å; R85-D183 IonicContact NH1-OD2 3.01Å
86	V	28	Very low	30.7	Very low	163 Å²	163	125.9 Å²	125.9	99%	0.988	65%	0.647	S	S	*	*	S	Bend	trans	-143.9	55.2	156.6	-119.3	0	0	0	0	111.9
87	G	27.1	Very low	31	Very low	70 Å²	70	128.5 Å²	128.5	72%	0.722	66%	0.658	S	S	*	*	S	Bend	trans	-170.7	99.8	176.4	0	0	0	0	0	116.1
88	R	31.4	Very low	30.9	Very low	197 Å²	197	132 Å²	132	74%	0.743	69%	0.686	S	S	*	*			trans	77.8	97.9	161.9	-53.4	-157.4	-170.6	-87.9	3.6	119.1
89	R	26.3	Very low	31.4	Very low	254 Å²	254	137.3 Å²	137.3	96%	0.958	72%	0.723	S	S	*	*			trans	-81	117.9	135.6	-93.6	-174	174.8	-167.4	-0.2	108.6
90	R	32.9	Very low	31.6	Very low	222 Å²	222	142.5 Å²	142.5	84%	0.838	75%	0.749	S	S	*	*			trans	-141.5	111	148.6	-99.1	-169.1	178.9	-168.6	-1.4	108.4
91	Q	28.4	Very low	31.8	Very low	192 Å²	192	143.1 Å²	143.1	90%	0.897	77%	0.766	S	S	*	*			trans	-62.6	126.7	157	-86.4	163.4	-48.3	0	0	108.1
92	M	32.3	Very low	31.6	Very low	179 Å²	179	142.3 Å²	142.3	88%	0.882	78%	0.779	S	S	*	*			trans	-137.8	116.9	146.7	-85.2	-59.1	-172.9	0	0	107.5
93	R	27.8	Very low	31.7	Very low	245 Å²	245	147.2 Å²	147.2	93%	0.925	80%	0.8	S	S	*	*			trans	-79.2	163.9	163.2	-87.8	-177	172.1	178.8	-3.1	109
94	A	33.8	Very low	31.9	Very low	97 Å²	97	150.8 Å²	150.8	80%	0.802	81%	0.814	S	S	*	*			trans	97.5	129.6	171.6	0	0	0	0	0	113
95	S	34.3	Very low	32.6	Very low	109 Å²	109	152.1 Å²	152.1	76%	0.762	83%	0.827	S	S	*	*			cis	-173.8	135.3	-1.7	36.2	0	0	0	0	105.6
96	N	28.3	Very low	32.9	Very low	161 Å²	161	149.1 Å²	149.1	86%	0.861	84%	0.835	S	S	*	*			trans	-70.7	134.1	174.9	-69.6	-13.3	0	0	0	110.5
97	V	35.9	Very low	33.2	Very low	143 Å²	143	144.8 Å²	144.8	87%	0.867	82%	0.816	S	S	*	*			trans	-135.9	116.9	149.4	175.2	0	0	0	0	107.2
98	S	31.9	Very low	33.5	Very low	105 Å²	105	149.2 Å²	149.2	73%	0.734	82%	0.822	S	S	*	*			trans	-77.2	145.6	174.5	-39.1	0	0	0	0	110.3
99	S	41.4	Very low	33.9	Very low	125 Å²	125	146.2 Å²	146.2	87%	0.874	83%	0.825	S	S	*	*			trans	-159.1	106	144.9	-117.3	0	0	0	0	110.8
100	D	35.4	Very low	34.2	Very low	171 Å²	171	141.2 Å²	141.2	91%	0.914	82%	0.818	S	S	*	*			trans	-0.5	149.4	145.6	-140.2	-2.7	0	0	0	121.2
101	G	37.3	Very low	34.5	Very low	72 Å²	72	138.6 Å²	138.6	74%	0.742	82%	0.82	S	S	*	*			trans	142.7	90.8	164.2	0	0	0	0	0	114.6
102	G	31.5	Very low	34.7	Very low	69 Å²	69	136.9 Å²	136.9	71%	0.711	82%	0.817	S	S	*	*			trans	-82.1	178.8	-177.9	0	0	0	0	0	116.8
103	T	36.2	Very low	34.7	Very low	149 Å²	149	131.7 Å²	131.7	91%	0.914	81%	0.81	S	S	*	*				169.7	136.6	122	-60.9	0	0	0	0	109.6
104	E	34.8	Very low	35.2	Very low	179 Å²	179	125.4 Å²	125.4	84%	0.836	80%	0.803	S	S	*	*			trans	-71.1	174.4	-173.9	-91.1	-92.1	128.9	0	0	115.9
105	P	39.8	Very low	35.2	Very low	106 Å²	106	129.5 Å²	129.5	69%	0.688	81%	0.806	S	S	*	*			trans	-109.7	175.7	-150.7	42.7	-35.3	0	0	0	115.2
106	S	36.9	Very low	35.1	Very low	124 Å²	124	133.2 Å²	133.2	87%	0.867	81%	0.811	S	S	*	*			trans	-173.1	151.6	166.4	-143.4	0	0	0	0	108.2
107	A	32.9	Very low	35.5	Very low	72 Å²	72	133.3 Å²	133.3	60%	0.595	81%	0.811	S	S	*	*			cis	176.7	136.8	-19.5	0	0	0	0	0	104.3
108	L	34.4	Very low	35.2	Very low	162 Å²	162	136 Å²	136	85%	0.848	81%	0.812	S	S	*	*			trans	65.8	141.3	154	-51	169.2	0	0	0	116.3
109	V	40.1	Very low	35.1	Very low	135 Å²	135	136.6 Å²	136.6	82%	0.818	82%	0.816	S	S	*	*				-160.7	149	61.3	174.9	0	0	0	0	110.1
110	D	32	Very low	34.7	Very low	149 Å²	149	139 Å²	139	80%	0.797	81%	0.807	S	S	*	*			trans	-46.2	149.6	174	-61.8	-59.9	0	0	0	116.8
111	D	39.1	Very low	34.5	Very low	167 Å²	167	139.2 Å²	139.2	89%	0.893	80%	0.802	S	S	*	*			trans	-145.4	134.8	133.7	-164.2	20.5	0	0	0	110.6
112	N	32.1	Very low	34.2	Very low	156 Å²	156	143.5 Å²	143.5	83%	0.834	81%	0.808	S	S	*	*			trans	-111	134.9	-161.5	-159.4	17	0	0	0	108.4
113	G	33.7	Very low	34.2	Very low	70 Å²	70	146.5 Å²	146.5	72%	0.722	81%	0.807	S	S	*	*			trans	-169.4	99.3	179.3	0	0	0	0	0	115.8
114	S	37.6	Very low	33.8	Very low	112 Å²	112	145 Å²	145	78%	0.783	80%	0.802	S	S	*	*			trans	73.5	95.4	145.2	-165.9	0	0	0	0	118.2
115	E	33.5	Very low	33.3	Very low	183 Å²	183	145.3 Å²	145.3	86%	0.855	80%	0.803	S	S	*	*				76.8	130.9	91.9	-53	-133.7	166.7	0	0	114.1
116	E	33	Very low	32.6	Very low	187 Å²	187	145.2 Å²	145.2	87%	0.874	81%	0.811	S	S	*	*			trans	90.4	84.8	-175	-53.3	-169.6	-166.5	0	0	116.3
117	D	35.4	Very low	32	Very low	163 Å²	163	144.9 Å²	144.9	87%	0.872	81%	0.809	S	S	*	*			trans	-171.1	141	131	-101.5	-26.7	0	0	0	113.5
118	F	30.9	Very low	31.8	Very low	201 Å²	201	147 Å²	147	88%	0.882	82%	0.816	S	S	*	*			trans	-61.4	132.8	-169.5	-74	-103.5	0	0	0	113.8	Y120	F118-Y120 PolarHBondContact O-N 3.4Å
119	S	28.2	Very low	31.4	Very low	116 Å²	116	150.6 Å²	150.6	81%	0.811	82%	0.819	S	S	*	*			trans	-40.5	118.6	170.7	166	0	0	0	0	113.7
120	Y	33.2	Very low	30.8	Very low	175 Å²	175	152.4 Å²	152.4	69%	0.686	81%	0.812	S	S	*	*			trans	-127.2	54.6	168.9	-170.4	-99.6	0	0	0	109.4	F118 L123	F118-Y120 PolarHBondContact O-N 3.4Å; Y120-L123 HydrophobicContact CE2-CB 4.31Å; Y120-L123 HydrophobicContact CE2-CD1 3.91Å
121	E	31.1	Very low	30.6	Very low	176 Å²	176	152.6 Å²	152.6	82%	0.822	81%	0.812	S	S	*	*			trans	-119.6	70.9	165.6	-77.3	-158.9	161.6	0	0	108.8
122	D	31.1	Very low	30	Very low	162 Å²	162	152.3 Å²	152.3	87%	0.866	81%	0.806	S	S	*	*	S	Bend	trans	-162.2	12.4	162.6	-114.9	-15.2	0	0	0	115.6
123	L	31.4	Very low	29.8	Very low	132 Å²	132	149.2 Å²	149.2	69%	0.691	79%	0.794	S	S	*	*			trans	-113.8	12.7	176.2	-84.2	157.5	0	0	0	113.8	Y120 Q125	Y120-L123 HydrophobicContact CE2-CB 4.31Å; Y120-L123 HydrophobicContact CE2-CD1 3.91Å; L123-Q125 VanDerWaalsContact C-N 3.32Å; L123-Q125 PolarHBondContact O-N 3.08Å
124	C	27.7	Very low	29.8	Very low	117 Å²	117	147.8 Å²	147.8	79%	0.791	78%	0.779	S	S	*	*			trans	-90.8	57	175.3	-69.1	0	0	0	0	111.9
125	Q	26	Very low	29.8	Very low	187 Å²	187	143.2 Å²	143.2	87%	0.874	75%	0.75	S	S	*	*	S	Bend	trans	-126.9	115.6	161.7	-78	-177.4	-0.2	0	0	109.3	L123	L123-Q125 VanDerWaalsContact C-N 3.32Å; L123-Q125 PolarHBondContact O-N 3.08Å
126	A	24.7	Very low	30.6	Very low	104 Å²	104	138.2 Å²	138.2	86%	0.86	73%	0.726	S	S	*	*			trans	70.3	70.1	174.4	0	0	0	0	0	117.5
127	S	24.4	Very low	31.9	Very low	116 Å²	116	131.5 Å²	131.5	81%	0.811	70%	0.695	S	S	*	*			trans	-99.8	115	158.6	-142.6	0	0	0	0	109.6	R129	S127-R129 PolarHBondContact O-N 2.9Å
128	P	28.1	Very low	32.9	Very low	116 Å²	116	129 Å²	129	75%	0.753	68%	0.681	S	S	*	*			trans	-64.8	132.2	179.6	-17.1	29.8	0	0	0	111.1	Y130	P128-Y130 PolarHBondContact O-N 2.8Å
129	R	25.5	Very low	34.6	Very low	239 Å²	239	119.8 Å²	119.8	90%	0.902	64%	0.642	S	S	*	*			trans	-55	124.9	178.6	-68.3	-178.3	172.2	159.8	-2	111.2	S127 L131	S127-R129 PolarHBondContact O-N 2.9Å; R129-L131 PolarHBondContact O-N 2.82Å; R129-L131 VanDerWaalsContact O-N 3.17Å
130	Y	27.6	Very low	36.6	Very low	173 Å²	173	114.6 Å²	114.6	68%	0.678	61%	0.606	S	S	*	*			trans	-54.7	114.6	168.9	-89.7	-103	0	0	0	110.4	P128	P128-Y130 PolarHBondContact O-N 2.8Å
131	L	27.7	Very low	38.5	Very low	153 Å²	153	107.9 Å²	107.9	80%	0.801	58%	0.581	S	S	*	*			trans	-74.1	143.3	167	-83.7	159.3	0	0	0	109.7	R129	R129-L131 PolarHBondContact O-N 2.82Å; R129-L131 VanDerWaalsContact O-N 3.17Å
132	Q	26.2	Very low	40.6	Very low	161 Å²	161	104.3 Å²	104.3	75%	0.752	57%	0.565	S	S	*	*			trans	-59.2	157.5	-175	-64.8	-142.9	-30	0	0	114	G134 G135	Q132-G134 PolarHBondContact O-N 3.36Å; Q132-G135 PolarHBondContact O-N 3.12Å
133	P	28.2	Very low	42.5	Very low	91 Å²	91	98.1 Å²	98.1	59%	0.591	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	112.8	167.7	-19.2	31.1	0	0	0	110.1
134	G	33.3	Very low	44.8	Very low	40 Å²	40	93.7 Å²	93.7	41%	0.412	51%	0.508	S	S	.	.	T	Hydrogen-bonded Turn	trans	123.6	-18.2	-165.6	0	0	0	0	0	113.7	Q132 Q137 L138	Q132-G134 PolarHBondContact O-N 3.36Å; G134-Q137 PolarHBondContact O-N 3.19Å; G134-L138 PolarHBondContact O-N 3.4Å
135	G	38.3	Very low	47.1	Very low	16 Å²	16	92.9 Å²	92.9	17%	0.165	50%	0.504	C	S	.	.	H	α-helix	trans	-67.9	-35.2	175.4	0	0	0	0	0	113.7	Q132 Q137 L138 A139	Q132-G135 PolarHBondContact O-N 3.12Å; G135-Q137 VanDerWaalsContact C-N 3.32Å; G135-Q137 PolarHBondContact O-N 3.4Å; G135-L138 PolarHBondContact O-N 3.41Å; G135-A139 WeakPolarHBondContact O-CB 3.46Å; G135-A139 PolarHBondContact O-N 3.34Å
136	E	50.6	Low	49.4	Very low	77 Å²	77	90 Å²	90	36%	0.36	49%	0.494	S	S	.	.	H	α-helix	trans	-64.2	-39.1	175.8	-65.2	173.2	171.1	0	0	111.5	T79 I81 A139 I140	T79-E136 VanDerWaalsContact O-OE2 3.09Å; I81-E136 WeakPolarHBondContact CD1-OE2 3.5Å; E136-A139 PolarHBondContact O-N 3.36Å; E136-I140 VanDerWaalsContact O-CG1 3.28Å; E136-I140 WeakPolarHBondContact O-CG1 3.5Å; E136-I140 PolarHBondContact O-N 2.81Å
137	Q	59.3	Low	51.8	Low	47 Å²	47	88.1 Å²	88.1	22%	0.22	49%	0.485	C	S	.	.	H	α-helix	trans	-66.6	-39.1	177	177.8	146.1	62.3	0	0	112.2	G134 G135 N141 A179 S180 N181 K182	G134-Q137 PolarHBondContact O-N 3.19Å; G135-Q137 VanDerWaalsContact C-N 3.32Å; G135-Q137 PolarHBondContact O-N 3.4Å; Q137-N141 PolarHBondContact O-N 3.13Å; Q137-N141 VanDerWaalsContact O-N 3.16Å; Q137-N141 PolarHBondContact O-ND2 3.36Å; Q137-A179 WeakPolarHBondContact CG-O 3.39Å; Q137-A179 PolarHBondContact NE2-O 3.07Å; Q137-S180 PolarHBondContact NE2-O 3.32Å; Q137-N181 PolarHBondContact NE2-O 2.82Å; Q137-K182 VanDerWaalsContact NE2-N 3.11Å
138	L	56.5	Low	54.3	Low	109 Å²	109	86.6 Å²	86.6	57%	0.571	47%	0.468	S	S	*	.	H	α-helix	trans	-64.8	-43.7	171.5	-69.2	169.4	0	0	0	110.5	G134 G135 I140 N141 E142	G134-L138 PolarHBondContact O-N 3.4Å; G135-L138 PolarHBondContact O-N 3.41Å; L138-I140 PolarHBondContact O-N 3.46Å; L138-N141 PolarHBondContact O-N 3.18Å; L138-E142 WeakPolarHBondContact O-CB 3.43Å; L138-E142 VanDerWaalsContact O-CG 3.25Å; L138-E142 WeakPolarHBondContact O-CG 3.37Å; L138-E142 PolarHBondContact O-N 2.78Å
139	A	66.7	Low	56.9	Low	9 Å²	9	83.5 Å²	83.5	7%	0.074	45%	0.447	C	S	.	.	H	α-helix	trans	-64.7	-37.4	-179.7	0	0	0	0	0	113.3	F75 Q77 G135 E136 L143	F75-A139 HydrophobicContact CD1-CB 4.13Å; F75-A139 HydrophobicContact CE1-CB 3.61Å; F75-A139 HydrophobicContact CZ-CB 4.22Å; Q77-A139 VanDerWaalsContact NE2-CB 3.31Å; Q77-A139 PolarHBondContact NE2-O 3.12Å; G135-A139 WeakPolarHBondContact O-CB 3.46Å; G135-A139 PolarHBondContact O-N 3.34Å; E136-A139 PolarHBondContact O-N 3.36Å; A139-L143 WeakPolarHBondContact O-CG 3.47Å; A139-L143 PolarHBondContact O-N 3.04Å
140	I	71.7	Confident	59.8	Low	7 Å²	7	72.2 Å²	72.2	4%	0.036	40%	0.404	C	S	.	.	H	α-helix	trans	-67.1	-47.4	174.5	-63.2	158.3	0	0	0	110	Q77 E136 L138 E142 L143 I144 V150 A179 W185 L203	Q77-I140 VanDerWaalsContact OE1-CG1 3.25Å; E136-I140 VanDerWaalsContact O-CG1 3.28Å; E136-I140 WeakPolarHBondContact O-CG1 3.5Å; E136-I140 PolarHBondContact O-N 2.81Å; L138-I140 PolarHBondContact O-N 3.46Å; I140-E142 VanDerWaalsContact C-N 3.29Å; I140-E142 PolarHBondContact O-N 3.33Å; I140-L143 PolarHBondContact O-N 3.28Å; I140-I144 HydrophobicContact CG2-CD1 3.76Å; I140-I144 HydrophobicContact CG2-CG1 4.42Å; I140-I144 VanDerWaalsContact O-CG1 3.27Å; I140-I144 WeakPolarHBondContact O-CG1 3.48Å; I140-I144 PolarHBondContact O-N 2.85Å; I140-V150 HydrophobicContact CG2-CG1 4.38Å; I140-A179 HydrophobicContact CB-CB 4.07Å; I140-A179 HydrophobicContact CD1-CB 4.49Å; I140-A179 HydrophobicContact CG2-CB 3.5Å; I140-A179 VanDerWaalsContact CG2-CB 3.5Å; I140-W185 HydrophobicContact CD1-CH2 3.96Å; I140-W185 HydrophobicContact CD1-CZ2 3.88Å; I140-L203 HydrophobicContact CD1-CD1 3.67Å; I140-L203 HydrophobicContact CG1-CD1 3.9Å
141	N	73.1	Confident	62.7	Low	33 Å²	33	64.1 Å²	64.1	18%	0.176	37%	0.373	C	S	.	.	H	α-helix	trans	-67	-30.7	179.5	-70.5	-49.8	0	0	0	112.3	Q137 L138 S145 A179	Q137-N141 PolarHBondContact O-N 3.13Å; Q137-N141 VanDerWaalsContact O-N 3.16Å; Q137-N141 PolarHBondContact O-ND2 3.36Å; L138-N141 PolarHBondContact O-N 3.18Å; N141-S145 WeakPolarHBondContact O-CB 3.49Å; N141-S145 PolarHBondContact O-N 2.85Å; N141-S145 PolarHBondContact O-OG 2.92Å; N141-A179 VanDerWaalsContact ND2-C 3.33Å; N141-A179 PolarHBondContact ND2-O 2.97Å; N141-A179 VanDerWaalsContact OD1-C 3.28Å; N141-A179 WeakPolarHBondContact OD1-CA 3.33Å; N141-A179 PolarHBondContact OD1-N 2.85Å
142	E	73.4	Confident	65.5	Low	101 Å²	101	56.9 Å²	56.9	47%	0.472	34%	0.335	S	S	.	.	H	α-helix	trans	-64.6	-48.7	170.8	-78.7	172.4	-175.1	0	0	110.7	L138 I140 I144 S145 D146	L138-E142 WeakPolarHBondContact O-CB 3.43Å; L138-E142 VanDerWaalsContact O-CG 3.25Å; L138-E142 WeakPolarHBondContact O-CG 3.37Å; L138-E142 PolarHBondContact O-N 2.78Å; I140-E142 VanDerWaalsContact C-N 3.29Å; I140-E142 PolarHBondContact O-N 3.33Å; E142-I144 VanDerWaalsContact C-N 3.31Å; E142-I144 PolarHBondContact O-N 3.16Å; E142-S145 PolarHBondContact O-N 3Å; E142-S145 VanDerWaalsContact O-N 3.13Å; E142-D146 WeakPolarHBondContact O-CB 3.5Å; E142-D146 VanDerWaalsContact O-CG 3.3Å; E142-D146 PolarHBondContact O-N 3.49Å
143	L	71.6	Confident	68.2	Low	32 Å²	32	51.7 Å²	51.7	17%	0.168	31%	0.311	C	S	.	.	H	α-helix	trans	-57.5	-44.3	175.5	-75.2	-179	0	0	0	112.4	Q77 A139 I140 D146 N148 V150	Q77-L143 HydrophobicContact CG-CD1 4.41Å; A139-L143 WeakPolarHBondContact O-CG 3.47Å; A139-L143 PolarHBondContact O-N 3.04Å; I140-L143 PolarHBondContact O-N 3.28Å; L143-D146 PolarHBondContact O-N 3.08Å; L143-N148 HydrophobicContact CB-CB 4.49Å; L143-N148 VanDerWaalsContact O-CB 3.31Å; L143-N148 WeakPolarHBondContact O-CB 2.97Å; L143-N148 PolarHBondContact O-N 3.15Å; L143-N148 PolarHBondContact O-ND2 2.63Å; L143-V150 HydrophobicContact CB-CG2 3.88Å; L143-V150 HydrophobicContact CD1-CG2 4.31Å
144	I	79.6	Confident	70.8	Confident	40 Å²	40	47.4 Å²	47.4	21%	0.205	28%	0.283	C	S	.	.	H	α-helix	trans	-63.9	-43.9	176.9	-67.4	168.3	0	0	0	110.5	I140 E142 D146 G147 V150 V176 L177	I140-I144 HydrophobicContact CG2-CD1 3.76Å; I140-I144 HydrophobicContact CG2-CG1 4.42Å; I140-I144 VanDerWaalsContact O-CG1 3.27Å; I140-I144 WeakPolarHBondContact O-CG1 3.48Å; I140-I144 PolarHBondContact O-N 2.85Å; E142-I144 VanDerWaalsContact C-N 3.31Å; E142-I144 PolarHBondContact O-N 3.16Å; I144-D146 VanDerWaalsContact C-N 3.28Å; I144-D146 PolarHBondContact O-N 2.69Å; I144-G147 PolarHBondContact O-N 3.34Å; I144-G147 VanDerWaalsContact O-N 3.07Å; I144-V150 HydrophobicContact CG1-CB 4.35Å; I144-V150 HydrophobicContact CG1-CG2 3.88Å; I144-V176 HydrophobicContact CD1-CG1 4.18Å; I144-L177 WeakPolarHBondContact CG2-O 3.49Å
145	S	76.1	Confident	72.5	Confident	100 Å²	100	48.1 Å²	48.1	70%	0.699	28%	0.277	S	S	*	.	H	α-helix	trans	-66.8	-30.2	-180	-60.6	0	0	0	0	112.5	N141 E142 G147	N141-S145 WeakPolarHBondContact O-CB 3.49Å; N141-S145 PolarHBondContact O-N 2.85Å; N141-S145 PolarHBondContact O-OG 2.92Å; E142-S145 PolarHBondContact O-N 3Å; E142-S145 VanDerWaalsContact O-N 3.13Å; S145-G147 PolarHBondContact O-N 2.8Å
146	D	75.6	Confident	73.8	Confident	126 Å²	126	52.1 Å²	52.1	67%	0.674	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.2	-0	174.4	-72.3	-11.6	0	0	0	112.9	E142 L143 I144	E142-D146 WeakPolarHBondContact O-CB 3.5Å; E142-D146 VanDerWaalsContact O-CG 3.3Å; E142-D146 PolarHBondContact O-N 3.49Å; L143-D146 PolarHBondContact O-N 3.08Å; I144-D146 VanDerWaalsContact C-N 3.28Å; I144-D146 PolarHBondContact O-N 2.69Å
147	G	73.6	Confident	74.9	Confident	64 Å²	64	49.7 Å²	49.7	66%	0.66	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.4	8.2	178.5	0	0	0	0	0	114.4	I144 S145	I144-G147 PolarHBondContact O-N 3.34Å; I144-G147 VanDerWaalsContact O-N 3.07Å; S145-G147 PolarHBondContact O-N 2.8Å
148	N	78.1	Confident	75.9	Confident	85 Å²	85	48.4 Å²	48.4	46%	0.455	27%	0.271	S	S	.	.			trans	-75.2	140.6	177	-60.5	-55.3	0	0	0	110.8	L143 V150	L143-N148 HydrophobicContact CB-CB 4.49Å; L143-N148 VanDerWaalsContact O-CB 3.31Å; L143-N148 WeakPolarHBondContact O-CB 2.97Å; L143-N148 PolarHBondContact O-N 3.15Å; L143-N148 PolarHBondContact O-ND2 2.63Å; N148-V150 PolarHBondContact O-N 2.66Å
149	V	81.7	Confident	77	Confident	51 Å²	51	49.1 Å²	49.1	31%	0.309	28%	0.28	S	S	.	.			trans	-76.4	120.5	171.7	179.3	0	0	0	0	108.8	Q175	V149-Q175 HydrophobicContact CG1-CG 4.12Å
150	V	86	Confident	77.4	Confident	1 Å²	1	50.3 Å²	50.3	1%	0.006	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	115.9	175.8	-179.4	0	0	0	0	108.6	I140 L143 I144 N148 Q175 V176 L203	I140-V150 HydrophobicContact CG2-CG1 4.38Å; L143-V150 HydrophobicContact CB-CG2 3.88Å; L143-V150 HydrophobicContact CD1-CG2 4.31Å; I144-V150 HydrophobicContact CG1-CB 4.35Å; I144-V150 HydrophobicContact CG1-CG2 3.88Å; N148-V150 PolarHBondContact O-N 2.66Å; V150-Q175 CarbonylContact O-C 3.49Å; V150-Q175 WeakPolarHBondContact O-CA 3.41Å; V150-V176 HydrophobicContact CB-CB 4.28Å; V150-V176 HydrophobicContact CG1-CB 4.09Å; V150-V176 HydrophobicContact CG1-CG2 4.19Å; V150-V176 PolarHBondContact O-N 3.37Å; V150-L203 HydrophobicContact CG1-CD2 3.54Å
151	C	89	Confident	77.4	Confident	4 Å²	4	59.3 Å²	59.3	3%	0.027	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	135.9	177.4	-65.3	0	0	0	0	110.6	V173 R204 Q207	C151-V173 HydrophobicContact CB-CG1 3.96Å; C151-R204 PolarHBondContact O-N 2.77Å; C151-R204 VanDerWaalsContact O-N 3.12Å; C151-Q207 VanDerWaalsContact CB-OE1 3.29Å; C151-Q207 PolarHBondContact O-OE1 3.2Å
152	A	86.9	Confident	77.5	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	147.8	169.5	0	0	0	0	0	109.5	V173 I174 V176 V201 R202 L203	A152-V173 CarbonylContact O-C 3.49Å; A152-V173 WeakPolarHBondContact O-CA 3.43Å; A152-I174 PolarHBondContact N-O 2.87Å; A152-I174 PolarHBondContact O-N 3.41Å; A152-V176 HydrophobicContact CB-CG2 3.79Å; A152-V201 HydrophobicContact CB-CB 3.9Å; A152-V201 HydrophobicContact CB-CG2 3.82Å; A152-R202 CarbonylContact C-O 3.54Å; A152-R202 VanDerWaalsContact CA-O 3.28Å; A152-R202 WeakPolarHBondContact CA-O 3.38Å; A152-L203 HydrophobicContact CB-CD2 4.2Å
153	E	83.9	Confident	77.9	Confident	52 Å²	52	62 Å²	62	24%	0.243	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	131.3	174.8	-174.3	170.6	143.9	0	0	109.6	L155 D172 V201 R202 R204	E153-L155 PolarHBondContact O-N 2.65Å; E153-D172 WeakPolarHBondContact CA-O 3.44Å; E153-V201 CarbonylContact O-C 3.46Å; E153-V201 VanDerWaalsContact O-CA 3.26Å; E153-V201 WeakPolarHBondContact O-CA 3.35Å; E153-R202 PolarHBondContact N-O 3.22Å; E153-R202 PolarHBondContact O-N 3.38Å; E153-R204 HydrophobicContact CB-CG 4.38Å; E153-R204 IonicContact OE2-CZ 2.84Å; E153-R204 IonicContact OE2-NE 3.19Å; E153-R204 PolarHBondContact OE2-NE 2.91Å; E153-R204 VanDerWaalsContact OE2-NE 3.13Å; E153-R204 IonicContact OE2-NH2 3.03Å; E153-R204 PolarHBondContact OE2-NH2 3.33Å
154	A	81.5	Confident	78.6	Confident	2 Å²	2	66.5 Å²	66.5	2%	0.017	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	120.2	176.5	0	0	0	0	0	110.9	F168 K169 A170 G171 D172	A154-F168 HydrophobicContact CB-CD2 3.37Å; A154-F168 HydrophobicContact CB-CE2 3.65Å; A154-F168 HydrophobicContact CB-CG 4.37Å; A154-K169 WeakPolarHBondContact CB-O 3.47Å; A154-A170 CarbonylContact O-C 3.59Å; A154-A170 WeakPolarHBondContact O-CA 3.35Å; A154-G171 PolarHBondContact O-N 2.96Å; A154-D172 HydrophobicContact CB-CB 4.41Å; A154-D172 PolarHBondContact N-O 3Å
155	L	68.4	Low	79	Confident	54 Å²	54	65.6 Å²	65.6	28%	0.283	36%	0.363	S	S	.	.	S	Bend	trans	-81.5	-29.7	171.2	-63.2	177.7	0	0	0	111.5	E153 F200 R202 L388	E153-L155 PolarHBondContact O-N 2.65Å; L155-F200 PolarHBondContact N-O 2.94Å; L155-R202 HydrophobicContact CD1-CB 4.02Å; L155-R202 HydrophobicContact CD2-CB 3.83Å; L155-R202 HydrophobicContact CG-CB 3.94Å; L155-L388 HydrophobicContact CD2-CD1 3.79Å
156	W	65.8	Low	79.6	Confident	100 Å²	100	60.9 Å²	60.9	38%	0.379	33%	0.33	S	S	.	.	S	Bend	trans	-135.8	150.8	-175.6	-51.9	115.1	0	0	0	110.5	H158 F168 F200	W156-H158 PolarHBondContact O-N 3.48Å; W156-F168 VanDerWaalsContact O-CE2 3.28Å; W156-F168 WeakPolarHBondContact O-CE2 3.48Å; W156-F200 HydrophobicContact CB-CD1 3.76Å; W156-F200 HydrophobicContact CB-CE1 4.18Å; W156-F200 HydrophobicContact CB-CG 4.27Å; W156-F200 PolarHBondContact N-O 2.92Å
157	D	74.4	Confident	80.1	Confident	27 Å²	27	56.9 Å²	56.9	14%	0.144	32%	0.318	C	S	.	.			trans	-63.7	130.3	169.6	-67.9	30.4	0	0	0	110.4	V159 F168 A170 F200 Q625	D157-V159 HydrophobicContact CB-CG2 4.38Å; D157-F168 CarbonylContact C-O 3.57Å; D157-F168 WeakPolarHBondContact CA-O 3.4Å; D157-A170 WeakPolarHBondContact OD1-CB 3.43Å; D157-A170 PolarHBondContact OD1-N 3.31Å; D157-F200 WeakPolarHBondContact O-CE1 3.17Å; D157-Q625 PolarHBondContact OD2-NE2 3.09Å
158	H	79.9	Confident	80.7	Confident	19 Å²	19	54.3 Å²	54.3	9%	0.088	29%	0.289	C	S	.	.	B	Isolated β-bridge	trans	-105.7	95.5	166.6	-173.1	37.3	0	0	0	109.1	W156 E165 L166 G167 F168 P197 F200	W156-H158 PolarHBondContact O-N 3.48Å; H158-E165 IonicContact CE1-OE2 2.77Å; H158-E165 IonicContact NE2-OE2 2.64Å; H158-L166 PolarHBondContact CD2-O 3Å; H158-G167 WeakPolarHBondContact O-CA 3.13Å; H158-F168 HydrophobicContact CB-CD1 4.02Å; H158-F168 HydrophobicContact CB-CD2 4.05Å; H158-F168 HydrophobicContact CB-CE1 3.55Å; H158-F168 HydrophobicContact CB-CE2 3.62Å; H158-F168 HydrophobicContact CB-CG 4.25Å; H158-F168 HydrophobicContact CB-CZ 3.35Å; H158-F168 AromaticContact CD2-CE1 3.95Å; H158-F168 PolarHBondContact N-O 2.99Å; H158-F168 PolarHBondContact O-N 3.45Å; H158-P197 WeakPolarHBondContact CD2-CD 3.36Å; H158-P197 WeakPolarHBondContact NE2-CD 3.13Å; H158-F200 HydrophobicContact CB-CD1 4.02Å
159	V	79.6	Confident	80.8	Confident	125 Å²	125	56.6 Å²	56.6	76%	0.758	30%	0.295	S	S	*	.			trans	-89.4	115	177.1	-175.5	0	0	0	0	108.8	D157	D157-V159 HydrophobicContact CB-CG2 4.38Å
160	T	75.3	Confident	80.4	Confident	34 Å²	34	54.5 Å²	54.5	21%	0.209	28%	0.283	C	S	.	.			trans	-132.7	148.5	179.1	-172.1	0	0	0	0	112.2	D162 E165	T160-D162 PolarHBondContact OG1-N 3.34Å; T160-E165 VanDerWaalsContact CB-OE2 3.27Å; T160-E165 WeakPolarHBondContact CB-OE2 2.8Å; T160-E165 HydrophobicContact CG2-CB 3.54Å; T160-E165 WeakPolarHBondContact OG1-CB 3.43Å; T160-E165 PolarHBondContact OG1-OE2 3.01Å
161	M	71	Confident	80	Confident	196 Å²	196	55.6 Å²	55.6	97%	0.966	29%	0.294	S	S	*	.			trans	-107	-0.6	169.2	-63.8	-151.9	73.3	0	0	112
162	D	76.1	Confident	79.8	Confident	64 Å²	64	58.4 Å²	58.4	34%	0.342	31%	0.309	S	S	.	.			trans	-81.6	129.4	178.6	-163.5	-43.7	0	0	0	109.1	T160 Q164 E165	T160-D162 PolarHBondContact OG1-N 3.34Å; D162-Q164 PolarHBondContact O-N 3.47Å; D162-Q164 WeakPolarHBondContact OD1-CB 3.39Å; D162-Q164 PolarHBondContact OD1-N 2.92Å; D162-E165 HydrophobicContact CB-CB 4.05Å; D162-E165 HydrophobicContact CB-CG 3.83Å; D162-E165 PolarHBondContact O-N 3.29Å
163	D	82.8	Confident	79.9	Confident	126 Å²	126	60.7 Å²	60.7	67%	0.674	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-18.5	-179.7	60.8	-23.8	0	0	0	112.2	K192	D163-K192 WeakPolarHBondContact O-CE 3.36Å; D163-K192 PolarHBondContact O-NZ 3.04Å
164	Q	85.5	Confident	80.2	Confident	126 Å²	126	58.2 Å²	58.2	59%	0.589	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	-6.7	174.2	-63.5	171.4	45.3	0	0	113.9	D162 A194 W195	D162-Q164 PolarHBondContact O-N 3.47Å; D162-Q164 WeakPolarHBondContact OD1-CB 3.39Å; D162-Q164 PolarHBondContact OD1-N 2.92Å; Q164-A194 WeakPolarHBondContact O-CB 3.36Å; Q164-W195 PolarHBondContact O-N 2.82Å
165	E	87.2	Confident	80.7	Confident	21 Å²	21	60.1 Å²	60.1	10%	0.098	32%	0.32	C	S	.	.	B	Isolated β-bridge	trans	-103.8	143.9	177.9	-64.1	178.1	-178.1	0	0	110.9	H158 T160 D162 W184 K192 W195 R635	H158-E165 IonicContact CE1-OE2 2.77Å; H158-E165 IonicContact NE2-OE2 2.64Å; T160-E165 VanDerWaalsContact CB-OE2 3.27Å; T160-E165 WeakPolarHBondContact CB-OE2 2.8Å; T160-E165 HydrophobicContact CG2-CB 3.54Å; T160-E165 WeakPolarHBondContact OG1-CB 3.43Å; T160-E165 PolarHBondContact OG1-OE2 3.01Å; D162-E165 HydrophobicContact CB-CB 4.05Å; D162-E165 HydrophobicContact CB-CG 3.83Å; D162-E165 PolarHBondContact O-N 3.29Å; E165-W184 HydrophobicContact CG-CH2 4.27Å; E165-W184 HydrophobicContact CG-CZ3 4.04Å; E165-K192 PolarHBondContact O-NZ 2.85Å; E165-W195 CarbonylContact C-O 3.53Å; E165-W195 VanDerWaalsContact CA-O 3.23Å; E165-W195 WeakPolarHBondContact CA-O 3.39Å; E165-R635 IonicContact OE1-NH2 2.81Å; E165-R635 PolarHBondContact OE1-NH2 2.87Å; E165-R635 IonicContact OE2-NH2 3.88Å; E165-R635 PolarHBondContact OE2-NH2 2.9Å
166	L	88.9	Confident	81.8	Confident	2 Å²	2	57.7 Å²	57.7	1%	0.01	31%	0.307	C	S	.	.			trans	-92.1	111.4	-179.3	-171.4	67.1	0	0	0	109.2	H158 F168 I174 K192 A194 W195 F196	H158-L166 PolarHBondContact CD2-O 3Å; L166-F168 HydrophobicContact CG-CD1 4.37Å; L166-F168 VanDerWaalsContact O-CD1 3.22Å; L166-F168 WeakPolarHBondContact O-CD1 3.45Å; L166-F168 WeakPolarHBondContact O-CE1 3.32Å; L166-I174 HydrophobicContact CD2-CG2 3.85Å; L166-K192 HydrophobicContact CD1-CB 3.95Å; L166-K192 HydrophobicContact CD1-CD 4.39Å; L166-K192 HydrophobicContact CD1-CG 4.25Å; L166-K192 WeakPolarHBondContact CD1-O 3.43Å; L166-A194 HydrophobicContact CB-CB 3.71Å; L166-A194 HydrophobicContact CD1-CB 4.22Å; L166-A194 VanDerWaalsContact N-CB 3.34Å; L166-W195 PolarHBondContact N-O 2.9Å; L166-F196 HydrophobicContact CB-CB 4.24Å; L166-F196 HydrophobicContact CD2-CD1 4.26Å
167	G	85.6	Confident	82.9	Confident	41 Å²	41	55.1 Å²	55.1	42%	0.423	30%	0.301	S	S	.	.			trans	-81.9	138.3	174.5	0	0	0	0	0	112.1	H158	H158-G167 WeakPolarHBondContact O-CA 3.13Å
168	F	86.1	Confident	83.6	Confident	11 Å²	11	57.7 Å²	57.7	5%	0.048	31%	0.312	C	S	.	.	B	Isolated β-bridge	trans	-155.6	165.9	177.5	50.8	-95.6	0	0	0	111.7	A154 W156 D157 H158 L166 D172 I174 F196 F200 V201	A154-F168 HydrophobicContact CB-CD2 3.37Å; A154-F168 HydrophobicContact CB-CE2 3.65Å; A154-F168 HydrophobicContact CB-CG 4.37Å; W156-F168 VanDerWaalsContact O-CE2 3.28Å; W156-F168 WeakPolarHBondContact O-CE2 3.48Å; D157-F168 CarbonylContact C-O 3.57Å; D157-F168 WeakPolarHBondContact CA-O 3.4Å; H158-F168 HydrophobicContact CB-CD1 4.02Å; H158-F168 HydrophobicContact CB-CD2 4.05Å; H158-F168 HydrophobicContact CB-CE1 3.55Å; H158-F168 HydrophobicContact CB-CE2 3.62Å; H158-F168 HydrophobicContact CB-CG 4.25Å; H158-F168 HydrophobicContact CB-CZ 3.35Å; H158-F168 AromaticContact CD2-CE1 3.95Å; H158-F168 PolarHBondContact N-O 2.99Å; H158-F168 PolarHBondContact O-N 3.45Å; L166-F168 HydrophobicContact CG-CD1 4.37Å; L166-F168 VanDerWaalsContact O-CD1 3.22Å; L166-F168 WeakPolarHBondContact O-CD1 3.45Å; L166-F168 WeakPolarHBondContact O-CE1 3.32Å; F168-D172 HydrophobicContact CB-CB 4.12Å; F168-I174 HydrophobicContact CB-CD1 4.37Å; F168-I174 HydrophobicContact CD1-CD1 3.46Å; F168-I174 VanDerWaalsContact CD1-CD1 3.46Å; F168-I174 HydrophobicContact CD1-CG1 4.41Å; F168-I174 HydrophobicContact CD2-CD1 3.96Å; F168-I174 HydrophobicContact CE1-CD1 3.55Å; F168-I174 HydrophobicContact CE2-CD1 4.01Å; F168-I174 HydrophobicContact CG-CD1 3.66Å; F168-I174 HydrophobicContact CZ-CD1 3.81Å; F168-F196 HydrophobicContact CE1-CB 3.55Å; F168-F196 HydrophobicContact CE1-CD2 4.27Å; F168-F196 HydrophobicContact CE1-CG 4.12Å; F168-F196 HydrophobicContact CZ-CB 4.17Å; F168-F196 HydrophobicContact CZ-CD2 4.32Å; F168-F200 HydrophobicContact CE2-CB 4.17Å; F168-F200 HydrophobicContact CZ-CB 4.07Å; F168-V201 HydrophobicContact CE2-CG1 4.33Å; F168-V201 HydrophobicContact CZ-CG1 4.15Å
169	K	81.3	Confident	84	Confident	133 Å²	133	56.8 Å²	56.8	58%	0.578	31%	0.308	S	S	*	.			trans	-104.6	154.7	175.1	-64.1	179.8	-179.5	-63.6	0	110.7	A154 G171 D172	A154-K169 WeakPolarHBondContact CB-O 3.47Å; K169-G171 PolarHBondContact O-N 2.87Å; K169-D172 PolarHBondContact N-OD2 2.82Å; K169-D172 VanDerWaalsContact O-CB 3.28Å; K169-D172 WeakPolarHBondContact O-CB 3.42Å; K169-D172 VanDerWaalsContact O-CG 3.23Å; K169-D172 PolarHBondContact O-N 3.03Å; K169-D172 VanDerWaalsContact O-N 3.07Å
170	A	73.5	Confident	84	Confident	7 Å²	7	53.8 Å²	53.8	6%	0.058	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	131.1	171.7	0	0	0	0	0	110.8	A154 D157	A154-A170 CarbonylContact O-C 3.59Å; A154-A170 WeakPolarHBondContact O-CA 3.35Å; D157-A170 WeakPolarHBondContact OD1-CB 3.43Å; D157-A170 PolarHBondContact OD1-N 3.31Å
171	G	76.3	Confident	84.4	Confident	24 Å²	24	55.4 Å²	55.4	25%	0.247	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	97.9	-18.6	-173.3	0	0	0	0	0	114.5	A154 K169	A154-G171 PolarHBondContact O-N 2.96Å; K169-G171 PolarHBondContact O-N 2.87Å
172	D	85.2	Confident	84.7	Confident	62 Å²	62	49.3 Å²	49.3	33%	0.332	27%	0.267	S	S	.	.			trans	-64.8	142.5	178.2	-66.9	-5.5	0	0	0	110.8	E153 A154 F168 K169	E153-D172 WeakPolarHBondContact CA-O 3.44Å; A154-D172 HydrophobicContact CB-CB 4.41Å; A154-D172 PolarHBondContact N-O 3Å; F168-D172 HydrophobicContact CB-CB 4.12Å; K169-D172 PolarHBondContact N-OD2 2.82Å; K169-D172 VanDerWaalsContact O-CB 3.28Å; K169-D172 WeakPolarHBondContact O-CB 3.42Å; K169-D172 VanDerWaalsContact O-CG 3.23Å; K169-D172 PolarHBondContact O-N 3.03Å; K169-D172 VanDerWaalsContact O-N 3.07Å
173	V	88.6	Confident	84.8	Confident	48 Å²	48	48.9 Å²	48.9	29%	0.291	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	129.1	176.4	-172.4	0	0	0	0	109.3	C151 A152	C151-V173 HydrophobicContact CB-CG1 3.96Å; A152-V173 CarbonylContact O-C 3.49Å; A152-V173 WeakPolarHBondContact O-CA 3.43Å
174	I	90.4	Very high	84.9	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	125.6	-178.8	-57.5	162.4	0	0	0	107.7	A152 L166 F168 V176 F196 V201	A152-I174 PolarHBondContact N-O 2.87Å; A152-I174 PolarHBondContact O-N 3.41Å; L166-I174 HydrophobicContact CD2-CG2 3.85Å; F168-I174 HydrophobicContact CB-CD1 4.37Å; F168-I174 HydrophobicContact CD1-CD1 3.46Å; F168-I174 VanDerWaalsContact CD1-CD1 3.46Å; F168-I174 HydrophobicContact CD1-CG1 4.41Å; F168-I174 HydrophobicContact CD2-CD1 3.96Å; F168-I174 HydrophobicContact CE1-CD1 3.55Å; F168-I174 HydrophobicContact CE2-CD1 4.01Å; F168-I174 HydrophobicContact CG-CD1 3.66Å; F168-I174 HydrophobicContact CZ-CD1 3.81Å; I174-V176 PolarHBondContact O-N 2.82Å; I174-F196 HydrophobicContact CD1-CD2 4.39Å; I174-F196 HydrophobicContact CG2-CD1 4.15Å; I174-F196 HydrophobicContact CG2-CE1 3.7Å; I174-F196 HydrophobicContact CG2-CE2 4.48Å; I174-F196 HydrophobicContact CG2-CZ 3.88Å; I174-V201 HydrophobicContact CD1-CG1 3.82Å
175	Q	92.8	Very high	85.3	Confident	43 Å²	43	42 Å²	42	20%	0.201	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	117.1	170.3	-177.5	-179.8	17	0	0	108.7	V149 V150 L177 G187 R188	V149-Q175 HydrophobicContact CG1-CG 4.12Å; V150-Q175 CarbonylContact O-C 3.49Å; V150-Q175 WeakPolarHBondContact O-CA 3.41Å; Q175-L177 HydrophobicContact CG-CD2 4.17Å; Q175-L177 PolarHBondContact O-N 2.97Å; Q175-G187 CarbonylContact O-C 3.55Å; Q175-G187 WeakPolarHBondContact O-CA 3.45Å; Q175-R188 HydrophobicContact CB-CB 4.33Å; Q175-R188 PolarHBondContact N-O 2.93Å; Q175-R188 PolarHBondContact O-N 3.38Å
176	V	91.1	Very high	85.5	Confident	3 Å²	3	44 Å²	44	2%	0.018	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	115.8	177.9	-168.1	0	0	0	0	108.8	I144 V150 A152 I174 A179 W185 F196 L203	I144-V176 HydrophobicContact CD1-CG1 4.18Å; V150-V176 HydrophobicContact CB-CB 4.28Å; V150-V176 HydrophobicContact CG1-CB 4.09Å; V150-V176 HydrophobicContact CG1-CG2 4.19Å; V150-V176 PolarHBondContact O-N 3.37Å; A152-V176 HydrophobicContact CB-CG2 3.79Å; I174-V176 PolarHBondContact O-N 2.82Å; V176-A179 HydrophobicContact CG1-CB 4.26Å; V176-W185 HydrophobicContact CG1-CB 4.32Å; V176-W185 HydrophobicContact CG1-CD2 4.39Å; V176-W185 HydrophobicContact CG1-CE3 4.08Å; V176-W185 HydrophobicContact CG2-CE3 4.33Å; V176-F196 HydrophobicContact CG2-CZ 4.17Å; V176-L203 HydrophobicContact CG2-CD2 4.33Å
177	L	90	Very high	85.7	Confident	46 Å²	46	44 Å²	44	24%	0.241	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	-30.3	-177.8	-65.4	-179.4	0	0	0	112.8	I144 Q175 W186 R188 E193	I144-L177 WeakPolarHBondContact CG2-O 3.49Å; Q175-L177 HydrophobicContact CG-CD2 4.17Å; Q175-L177 PolarHBondContact O-N 2.97Å; L177-W186 PolarHBondContact N-O 2.93Å; L177-R188 HydrophobicContact CD1-CB 4Å; L177-R188 HydrophobicContact CG-CB 4.36Å; L177-E193 HydrophobicContact CD1-CG 4.1Å
178	E	89.2	Confident	86.1	Confident	81 Å²	81	47.2 Å²	47.2	38%	0.379	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	126.6	174.9	-165.6	-173.5	148.1	0	0	109.7	S180 W185 W186	E178-S180 WeakPolarHBondContact OE1-CB 2.98Å; E178-S180 PolarHBondContact OE1-OG 3.5Å; E178-W185 CarbonylContact O-C 3.53Å; E178-W185 WeakPolarHBondContact O-CA 3.43Å; E178-W186 HydrophobicContact CB-CB 3.79Å; E178-W186 PolarHBondContact N-O 3.14Å; E178-W186 PolarHBondContact O-N 3.39Å
179	A	86.9	Confident	86.1	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	24%	0.239	C	C	.	.			trans	-118	39.5	176.8	0	0	0	0	0	110.5	Q137 I140 N141 V176 W185	Q137-A179 WeakPolarHBondContact CG-O 3.39Å; Q137-A179 PolarHBondContact NE2-O 3.07Å; I140-A179 HydrophobicContact CB-CB 4.07Å; I140-A179 HydrophobicContact CD1-CB 4.49Å; I140-A179 HydrophobicContact CG2-CB 3.5Å; I140-A179 VanDerWaalsContact CG2-CB 3.5Å; N141-A179 VanDerWaalsContact ND2-C 3.33Å; N141-A179 PolarHBondContact ND2-O 2.97Å; N141-A179 VanDerWaalsContact OD1-C 3.28Å; N141-A179 WeakPolarHBondContact OD1-CA 3.33Å; N141-A179 PolarHBondContact OD1-N 2.85Å; V176-A179 HydrophobicContact CG1-CB 4.26Å; A179-W185 HydrophobicContact CB-CD2 4.16Å; A179-W185 HydrophobicContact CB-CG 4.07Å
180	S	81.3	Confident	85.9	Confident	61 Å²	61	50 Å²	50	43%	0.427	25%	0.249	S	C	.	.			trans	-73.7	-25.5	-175.6	64.6	0	0	0	0	113.9	Q137 E178	Q137-S180 PolarHBondContact NE2-O 3.32Å; E178-S180 WeakPolarHBondContact OE1-CB 2.98Å; E178-S180 PolarHBondContact OE1-OG 3.5Å
181	N	82.4	Confident	86.1	Confident	68 Å²	68	57.3 Å²	57.3	36%	0.364	29%	0.287	S	S	.	.	S	Bend	trans	-106.4	134.6	178.1	178	-23.4	0	0	0	110.7	Q137 D183 W184 W185	Q137-N181 PolarHBondContact NE2-O 2.82Å; N181-D183 VanDerWaalsContact C-N 3.25Å; N181-D183 PolarHBondContact O-N 2.64Å; N181-D183 PolarHBondContact OD1-N 2.76Å; N181-W184 WeakPolarHBondContact CB-O 3.18Å; N181-W185 PolarHBondContact O-NE1 3.5Å; N181-W185 VanDerWaalsContact O-NE1 3.15Å
182	K	77.1	Confident	86.6	Confident	68 Å²	68	60 Å²	60	30%	0.296	29%	0.292	S	S	.	.	S	Bend	trans	-63.4	-27.6	-175.5	68	170	-151.3	161.1	0	114.6	D84 R85 Q137	D84-K182 PolarHBondContact O-NZ 2.82Å; R85-K182 VanDerWaalsContact CD-CE 3.43Å; R85-K182 VanDerWaalsContact CZ-CE 3.42Å; R85-K182 VanDerWaalsContact NE-CE 3.35Å; Q137-K182 VanDerWaalsContact NE2-N 3.11Å
183	D	78.2	Confident	86.9	Confident	55 Å²	55	61 Å²	61	29%	0.294	30%	0.295	S	S	.	.	S	Bend	trans	-104.3	-27.9	-172	-61.6	-43.8	0	0	0	111.3	R85 N181 P197 A198	R85-D183 IonicContact NH1-OD2 3.01Å; N181-D183 VanDerWaalsContact C-N 3.25Å; N181-D183 PolarHBondContact O-N 2.64Å; N181-D183 PolarHBondContact OD1-N 2.76Å; D183-P197 WeakPolarHBondContact O-CA 3.5Å; D183-A198 PolarHBondContact O-N 2.79Å
184	W	85.6	Confident	87.1	Confident	89 Å²	89	58.7 Å²	58.7	34%	0.337	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	122.8	-173.3	-70.7	87.4	0	0	0	110.7	E165 N181 W195 F196	E165-W184 HydrophobicContact CG-CH2 4.27Å; E165-W184 HydrophobicContact CG-CZ3 4.04Å; N181-W184 WeakPolarHBondContact CB-O 3.18Å; W184-W195 HydrophobicContact CB-CE3 4.05Å; W184-W195 HydrophobicContact CE3-CB 3.98Å; W184-W195 HydrophobicContact CZ3-CB 4.49Å; W184-W195 WeakPolarHBondContact O-CZ3 3.2Å; W184-F196 CarbonylContact C-O 3.59Å; W184-F196 WeakPolarHBondContact CA-O 3.32Å
185	W	93.1	Very high	87.2	Confident	19 Å²	19	62.4 Å²	62.4	7%	0.072	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	149.8	176.7	-64	-12.8	0	0	0	110	I140 V176 E178 A179 N181 W195 F196 A198 V201 L203	I140-W185 HydrophobicContact CD1-CH2 3.96Å; I140-W185 HydrophobicContact CD1-CZ2 3.88Å; V176-W185 HydrophobicContact CG1-CB 4.32Å; V176-W185 HydrophobicContact CG1-CD2 4.39Å; V176-W185 HydrophobicContact CG1-CE3 4.08Å; V176-W185 HydrophobicContact CG2-CE3 4.33Å; E178-W185 CarbonylContact O-C 3.53Å; E178-W185 WeakPolarHBondContact O-CA 3.43Å; A179-W185 HydrophobicContact CB-CD2 4.16Å; A179-W185 HydrophobicContact CB-CG 4.07Å; N181-W185 PolarHBondContact O-NE1 3.5Å; N181-W185 VanDerWaalsContact O-NE1 3.15Å; W185-W195 CarbonylContact O-C 3.54Å; W185-W195 WeakPolarHBondContact O-CA 3.21Å; W185-F196 HydrophobicContact CB-CD1 4.47Å; W185-F196 HydrophobicContact CB-CE1 3.83Å; W185-F196 HydrophobicContact CB-CE2 4.13Å; W185-F196 HydrophobicContact CB-CZ 3.66Å; W185-F196 AromaticContact CE3-CE2 3.99Å; W185-F196 HydrophobicContact CE3-CE2 3.99Å; W185-F196 AromaticContact CE3-CZ 4Å; W185-F196 HydrophobicContact CE3-CZ 4Å; W185-F196 PolarHBondContact N-O 3.23Å; W185-F196 VanDerWaalsContact O-CD1 3.28Å; W185-F196 WeakPolarHBondContact O-CD1 3.38Å; W185-F196 PolarHBondContact O-N 2.98Å; W185-A198 HydrophobicContact CD2-CB 3.51Å; W185-A198 HydrophobicContact CE3-CB 4Å; W185-A198 HydrophobicContact CG-CB 3.95Å; W185-A198 HydrophobicContact CH2-CB 4.1Å; W185-A198 HydrophobicContact CZ2-CB 3.62Å; W185-A198 HydrophobicContact CZ3-CB 4.26Å; W185-V201 HydrophobicContact CE3-CG2 4.09Å; W185-V201 HydrophobicContact CZ3-CG2 3.78Å; W185-L203 HydrophobicContact CH2-CD1 4.32Å; W185-L203 HydrophobicContact CH2-CG 4.45Å; W185-L203 HydrophobicContact CZ3-CD2 4.41Å; W185-L203 HydrophobicContact CZ3-CG 4.4Å
186	W	92.8	Very high	87.1	Confident	64 Å²	64	60.3 Å²	60.3	24%	0.242	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	131.3	170.3	-169.7	-107.2	0	0	0	108	L177 E178 E193 A194 W195	L177-W186 PolarHBondContact N-O 2.93Å; E178-W186 HydrophobicContact CB-CB 3.79Å; E178-W186 PolarHBondContact N-O 3.14Å; E178-W186 PolarHBondContact O-N 3.39Å; W186-E193 HydrophobicContact CZ2-CB 3.87Å; W186-A194 VanDerWaalsContact CZ3-C 3.44Å; W186-W195 HydrophobicContact CB-CE3 4.17Å; W186-W195 HydrophobicContact CB-CH2 4.11Å; W186-W195 HydrophobicContact CB-CZ2 4.48Å; W186-W195 HydrophobicContact CB-CZ3 3.96Å; W186-W195 HydrophobicContact CE3-CB 4.23Å; W186-W195 AromaticContact CE3-CD1 3.45Å; W186-W195 VanDerWaalsContact CE3-CD1 3.45Å; W186-W195 AromaticContact CE3-CD2 3.56Å; W186-W195 HydrophobicContact CE3-CD2 3.56Å; W186-W195 AromaticContact CE3-CE2 3.45Å; W186-W195 VanDerWaalsContact CE3-CE2 3.45Å; W186-W195 HydrophobicContact CE3-CE3 4.31Å; W186-W195 AromaticContact CE3-CG 3.52Å; W186-W195 HydrophobicContact CE3-CG 3.52Å; W186-W195 HydrophobicContact CE3-CZ2 4.09Å; W186-W195 VanDerWaalsContact CE3-N 3.32Å; W186-W195 AromaticContact CE3-NE1 3.37Å; W186-W195 HydrophobicContact CZ3-CB 4.44Å; W186-W195 AromaticContact CZ3-CD1 3.27Å; W186-W195 HydrophobicContact CZ3-CD2 4.21Å; W186-W195 AromaticContact CZ3-CE2 3.96Å; W186-W195 AromaticContact CZ3-CG 3.77Å; W186-W195 HydrophobicContact CZ3-CG 3.77Å; W186-W195 VanDerWaalsContact CZ3-N 3.34Å; W186-W195 AromaticContact CZ3-NE1 3.35Å
187	G	92.9	Very high	86.8	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	169.6	178.8	0	0	0	0	0	113.2	Q175 E193 A194	Q175-G187 CarbonylContact O-C 3.55Å; Q175-G187 WeakPolarHBondContact O-CA 3.45Å; G187-E193 WeakPolarHBondContact O-CA 3.28Å; G187-A194 PolarHBondContact N-O 3.47Å; G187-A194 VanDerWaalsContact N-O 3.14Å; G187-A194 PolarHBondContact O-N 2.91Å; G187-A194 VanDerWaalsContact O-N 3.07Å
188	R	92.7	Very high	86.6	Confident	109 Å²	109	58.8 Å²	58.8	41%	0.411	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	131.1	179.8	-175	-174.7	-67.3	161.4	-5.1	109.5	Q175 L177 E193	Q175-R188 HydrophobicContact CB-CB 4.33Å; Q175-R188 PolarHBondContact N-O 2.93Å; Q175-R188 PolarHBondContact O-N 3.38Å; L177-R188 HydrophobicContact CD1-CB 4Å; L177-R188 HydrophobicContact CG-CB 4.36Å; R188-E193 HydrophobicContact CB-CG 3.93Å; R188-E193 HydrophobicContact CG-CG 3.91Å; R188-E193 IonicContact CZ-OE1 3.32Å; R188-E193 IonicContact NE-OE1 2.67Å; R188-E193 PolarHBondContact NE-OE1 2.84Å; R188-E193 IonicContact NH2-OE1 2.79Å; R188-E193 PolarHBondContact NH2-OE1 2.88Å
189	S	87	Confident	86.1	Confident	33 Å²	33	58.3 Å²	58.3	23%	0.231	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	170.9	159.1	-174.5	0	0	0	0	108.3	D191 K192	S189-D191 PolarHBondContact O-N 3.35Å; S189-K192 PolarHBondContact N-O 3.34Å; S189-K192 PolarHBondContact O-N 3Å
190	E	77.6	Confident	85.8	Confident	171 Å²	171	60.4 Å²	60.4	80%	0.799	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-43.5	-39.9	-170.8	-70.1	177.8	-178	0	0	113.7
191	D	75.9	Confident	85.8	Confident	160 Å²	160	57.6 Å²	57.6	86%	0.856	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.4	-2	-173.9	-64.3	-40	0	0	0	115.7	S189	S189-D191 PolarHBondContact O-N 3.35Å
192	K	86.8	Confident	85.8	Confident	81 Å²	81	56.1 Å²	56.1	35%	0.352	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.6	141.9	-170.4	-166.1	-178	179.3	-163.6	0	113.9	D163 E165 L166 S189 A194	D163-K192 WeakPolarHBondContact O-CE 3.36Å; D163-K192 PolarHBondContact O-NZ 3.04Å; E165-K192 PolarHBondContact O-NZ 2.85Å; L166-K192 HydrophobicContact CD1-CB 3.95Å; L166-K192 HydrophobicContact CD1-CD 4.39Å; L166-K192 HydrophobicContact CD1-CG 4.25Å; L166-K192 WeakPolarHBondContact CD1-O 3.43Å; S189-K192 PolarHBondContact N-O 3.34Å; S189-K192 PolarHBondContact O-N 3Å; K192-A194 HydrophobicContact CD-CB 4.4Å; K192-A194 HydrophobicContact CG-CB 4.47Å
193	E	93.4	Very high	86.1	Confident	81 Å²	81	53.3 Å²	53.3	38%	0.379	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	127.6	164.1	-65.1	-176.2	-173	0	0	110.2	L177 W186 G187 R188	L177-E193 HydrophobicContact CD1-CG 4.1Å; W186-E193 HydrophobicContact CZ2-CB 3.87Å; G187-E193 WeakPolarHBondContact O-CA 3.28Å; R188-E193 HydrophobicContact CB-CG 3.93Å; R188-E193 HydrophobicContact CG-CG 3.91Å; R188-E193 IonicContact CZ-OE1 3.32Å; R188-E193 IonicContact NE-OE1 2.67Å; R188-E193 PolarHBondContact NE-OE1 2.84Å; R188-E193 IonicContact NH2-OE1 2.79Å; R188-E193 PolarHBondContact NH2-OE1 2.88Å
194	A	91.3	Very high	86.1	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.8	172	179.1	0	0	0	0	0	112.1	Q164 L166 W186 G187 K192	Q164-A194 WeakPolarHBondContact O-CB 3.36Å; L166-A194 HydrophobicContact CB-CB 3.71Å; L166-A194 HydrophobicContact CD1-CB 4.22Å; L166-A194 VanDerWaalsContact N-CB 3.34Å; W186-A194 VanDerWaalsContact CZ3-C 3.44Å; G187-A194 PolarHBondContact N-O 3.47Å; G187-A194 VanDerWaalsContact N-O 3.14Å; G187-A194 PolarHBondContact O-N 2.91Å; G187-A194 VanDerWaalsContact O-N 3.07Å; K192-A194 HydrophobicContact CD-CB 4.4Å; K192-A194 HydrophobicContact CG-CB 4.47Å
195	W	92.9	Very high	85.4	Confident	78 Å²	78	50.6 Å²	50.6	30%	0.295	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	139.9	176.1	-71.2	103.2	0	0	0	110.9	Q164 E165 L166 W184 W185 W186	Q164-W195 PolarHBondContact O-N 2.82Å; E165-W195 CarbonylContact C-O 3.53Å; E165-W195 VanDerWaalsContact CA-O 3.23Å; E165-W195 WeakPolarHBondContact CA-O 3.39Å; L166-W195 PolarHBondContact N-O 2.9Å; W184-W195 HydrophobicContact CB-CE3 4.05Å; W184-W195 HydrophobicContact CE3-CB 3.98Å; W184-W195 HydrophobicContact CZ3-CB 4.49Å; W184-W195 WeakPolarHBondContact O-CZ3 3.2Å; W185-W195 CarbonylContact O-C 3.54Å; W185-W195 WeakPolarHBondContact O-CA 3.21Å; W186-W195 HydrophobicContact CB-CE3 4.17Å; W186-W195 HydrophobicContact CB-CH2 4.11Å; W186-W195 HydrophobicContact CB-CZ2 4.48Å; W186-W195 HydrophobicContact CB-CZ3 3.96Å; W186-W195 HydrophobicContact CE3-CB 4.23Å; W186-W195 AromaticContact CE3-CD1 3.45Å; W186-W195 VanDerWaalsContact CE3-CD1 3.45Å; W186-W195 AromaticContact CE3-CD2 3.56Å; W186-W195 HydrophobicContact CE3-CD2 3.56Å; W186-W195 AromaticContact CE3-CE2 3.45Å; W186-W195 VanDerWaalsContact CE3-CE2 3.45Å; W186-W195 HydrophobicContact CE3-CE3 4.31Å; W186-W195 AromaticContact CE3-CG 3.52Å; W186-W195 HydrophobicContact CE3-CG 3.52Å; W186-W195 HydrophobicContact CE3-CZ2 4.09Å; W186-W195 VanDerWaalsContact CE3-N 3.32Å; W186-W195 AromaticContact CE3-NE1 3.37Å; W186-W195 HydrophobicContact CZ3-CB 4.44Å; W186-W195 AromaticContact CZ3-CD1 3.27Å; W186-W195 HydrophobicContact CZ3-CD2 4.21Å; W186-W195 AromaticContact CZ3-CE2 3.96Å; W186-W195 AromaticContact CZ3-CG 3.77Å; W186-W195 HydrophobicContact CZ3-CG 3.77Å; W186-W195 VanDerWaalsContact CZ3-N 3.34Å; W186-W195 AromaticContact CZ3-NE1 3.35Å
196	F	90.7	Very high	84.3	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	154	171.3	65.9	-80.6	0	0	0	112.5	L166 F168 I174 V176 W184 W185 A198 V201	L166-F196 HydrophobicContact CB-CB 4.24Å; L166-F196 HydrophobicContact CD2-CD1 4.26Å; F168-F196 HydrophobicContact CE1-CB 3.55Å; F168-F196 HydrophobicContact CE1-CD2 4.27Å; F168-F196 HydrophobicContact CE1-CG 4.12Å; F168-F196 HydrophobicContact CZ-CB 4.17Å; F168-F196 HydrophobicContact CZ-CD2 4.32Å; I174-F196 HydrophobicContact CD1-CD2 4.39Å; I174-F196 HydrophobicContact CG2-CD1 4.15Å; I174-F196 HydrophobicContact CG2-CE1 3.7Å; I174-F196 HydrophobicContact CG2-CE2 4.48Å; I174-F196 HydrophobicContact CG2-CZ 3.88Å; V176-F196 HydrophobicContact CG2-CZ 4.17Å; W184-F196 CarbonylContact C-O 3.59Å; W184-F196 WeakPolarHBondContact CA-O 3.32Å; W185-F196 HydrophobicContact CB-CD1 4.47Å; W185-F196 HydrophobicContact CB-CE1 3.83Å; W185-F196 HydrophobicContact CB-CE2 4.13Å; W185-F196 HydrophobicContact CB-CZ 3.66Å; W185-F196 AromaticContact CE3-CE2 3.99Å; W185-F196 HydrophobicContact CE3-CE2 3.99Å; W185-F196 AromaticContact CE3-CZ 4Å; W185-F196 HydrophobicContact CE3-CZ 4Å; W185-F196 PolarHBondContact N-O 3.23Å; W185-F196 VanDerWaalsContact O-CD1 3.28Å; W185-F196 WeakPolarHBondContact O-CD1 3.38Å; W185-F196 PolarHBondContact O-N 2.98Å; F196-A198 PolarHBondContact O-N 2.8Å; F196-V201 HydrophobicContact CD2-CG1 3.83Å; F196-V201 HydrophobicContact CD2-CG2 4.49Å; F196-V201 HydrophobicContact CE2-CB 4.35Å; F196-V201 HydrophobicContact CE2-CG1 3.66Å; F196-V201 HydrophobicContact CE2-CG2 3.74Å
197	P	85.6	Confident	83.4	Confident	10 Å²	10	49.8 Å²	49.8	7%	0.065	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	124.5	178.9	25.9	-30.9	0	0	0	111.5	H158 D183 S199 F200	H158-P197 WeakPolarHBondContact CD2-CD 3.36Å; H158-P197 WeakPolarHBondContact NE2-CD 3.13Å; D183-P197 WeakPolarHBondContact O-CA 3.5Å; P197-S199 PolarHBondContact O-N 2.93Å; P197-F200 HydrophobicContact CB-CD2 3.89Å; P197-F200 HydrophobicContact CB-CE2 4.45Å; P197-F200 HydrophobicContact CB-CG 4.37Å; P197-F200 HydrophobicContact CG-CB 3.96Å; P197-F200 HydrophobicContact CG-CD1 4.22Å; P197-F200 HydrophobicContact CG-CD2 3.6Å; P197-F200 HydrophobicContact CG-CE2 4.15Å; P197-F200 HydrophobicContact CG-CG 3.65Å; P197-F200 PolarHBondContact O-N 2.85Å
198	A	85.9	Confident	81.8	Confident	6 Å²	6	53.8 Å²	53.8	5%	0.05	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-58.5	-31.4	178.5	0	0	0	0	0	112.9	D183 W185 F196 F200 V201	D183-A198 PolarHBondContact O-N 2.79Å; W185-A198 HydrophobicContact CD2-CB 3.51Å; W185-A198 HydrophobicContact CE3-CB 4Å; W185-A198 HydrophobicContact CG-CB 3.95Å; W185-A198 HydrophobicContact CH2-CB 4.1Å; W185-A198 HydrophobicContact CZ2-CB 3.62Å; W185-A198 HydrophobicContact CZ3-CB 4.26Å; F196-A198 PolarHBondContact O-N 2.8Å; A198-F200 PolarHBondContact O-N 3.33Å; A198-V201 WeakPolarHBondContact O-CG2 3.13Å; A198-V201 PolarHBondContact O-N 2.84Å
199	S	78.7	Confident	79.8	Confident	72 Å²	72	56.3 Å²	56.3	50%	0.503	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-69.4	-11.4	179	55.5	0	0	0	0	114.2	P197	P197-S199 PolarHBondContact O-N 2.93Å
200	F	79.9	Confident	77.8	Confident	44 Å²	44	60.7 Å²	60.7	19%	0.193	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-92.9	-4.3	-179.7	-80.6	-131.2	0	0	0	113	L155 W156 D157 H158 F168 P197 A198	L155-F200 PolarHBondContact N-O 2.94Å; W156-F200 HydrophobicContact CB-CD1 3.76Å; W156-F200 HydrophobicContact CB-CE1 4.18Å; W156-F200 HydrophobicContact CB-CG 4.27Å; W156-F200 PolarHBondContact N-O 2.92Å; D157-F200 WeakPolarHBondContact O-CE1 3.17Å; H158-F200 HydrophobicContact CB-CD1 4.02Å; F168-F200 HydrophobicContact CE2-CB 4.17Å; F168-F200 HydrophobicContact CZ-CB 4.07Å; P197-F200 HydrophobicContact CB-CD2 3.89Å; P197-F200 HydrophobicContact CB-CE2 4.45Å; P197-F200 HydrophobicContact CB-CG 4.37Å; P197-F200 HydrophobicContact CG-CB 3.96Å; P197-F200 HydrophobicContact CG-CD1 4.22Å; P197-F200 HydrophobicContact CG-CD2 3.6Å; P197-F200 HydrophobicContact CG-CE2 4.15Å; P197-F200 HydrophobicContact CG-CG 3.65Å; P197-F200 PolarHBondContact O-N 2.85Å; A198-F200 PolarHBondContact O-N 3.33Å
201	V	82.2	Confident	75.8	Confident	1 Å²	1	58 Å²	58	1%	0.006	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	160.9	-174.8	-54.4	0	0	0	0	111.6	A152 E153 F168 I174 W185 F196 A198	A152-V201 HydrophobicContact CB-CB 3.9Å; A152-V201 HydrophobicContact CB-CG2 3.82Å; E153-V201 CarbonylContact O-C 3.46Å; E153-V201 VanDerWaalsContact O-CA 3.26Å; E153-V201 WeakPolarHBondContact O-CA 3.35Å; F168-V201 HydrophobicContact CE2-CG1 4.33Å; F168-V201 HydrophobicContact CZ-CG1 4.15Å; I174-V201 HydrophobicContact CD1-CG1 3.82Å; W185-V201 HydrophobicContact CE3-CG2 4.09Å; W185-V201 HydrophobicContact CZ3-CG2 3.78Å; F196-V201 HydrophobicContact CD2-CG1 3.83Å; F196-V201 HydrophobicContact CD2-CG2 4.49Å; F196-V201 HydrophobicContact CE2-CB 4.35Å; F196-V201 HydrophobicContact CE2-CG1 3.66Å; F196-V201 HydrophobicContact CE2-CG2 3.74Å; A198-V201 WeakPolarHBondContact O-CG2 3.13Å; A198-V201 PolarHBondContact O-N 2.84Å
202	R	81	Confident	73.9	Confident	38 Å²	38	57 Å²	57	14%	0.143	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	132.6	166.5	174.4	-175	176.7	-157.8	1.4	108.5	A152 E153 L155 R204 E247	A152-R202 CarbonylContact C-O 3.54Å; A152-R202 VanDerWaalsContact CA-O 3.28Å; A152-R202 WeakPolarHBondContact CA-O 3.38Å; E153-R202 PolarHBondContact N-O 3.22Å; E153-R202 PolarHBondContact O-N 3.38Å; L155-R202 HydrophobicContact CD1-CB 4.02Å; L155-R202 HydrophobicContact CD2-CB 3.83Å; L155-R202 HydrophobicContact CG-CB 3.94Å; R202-R204 PolarHBondContact O-N 2.9Å; R202-E247 IonicContact NH2-OE1 2.83Å; R202-E247 PolarHBondContact NH2-OE1 3.01Å; R202-E247 VanDerWaalsContact NH2-OE1 3.12Å; R202-E247 IonicContact NH2-OE2 2.69Å
203	L	83.5	Confident	71.3	Confident	9 Å²	9	59.9 Å²	59.9	5%	0.047	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	131.7	169.2	-72.6	166.8	0	0	0	110.6	Q77 I140 V150 A152 V176 W185	Q77-L203 HydrophobicContact CB-CD1 4.27Å; Q77-L203 VanDerWaalsContact O-CD1 3.32Å; Q77-L203 WeakPolarHBondContact O-CD1 3.39Å; I140-L203 HydrophobicContact CD1-CD1 3.67Å; I140-L203 HydrophobicContact CG1-CD1 3.9Å; V150-L203 HydrophobicContact CG1-CD2 3.54Å; A152-L203 HydrophobicContact CB-CD2 4.2Å; V176-L203 HydrophobicContact CG2-CD2 4.33Å; W185-L203 HydrophobicContact CH2-CD1 4.32Å; W185-L203 HydrophobicContact CH2-CG 4.45Å; W185-L203 HydrophobicContact CZ3-CD2 4.41Å; W185-L203 HydrophobicContact CZ3-CG 4.4Å
204	R	79.1	Confident	68.4	Low	59 Å²	59	61.1 Å²	61.1	22%	0.223	32%	0.322	C	S	.	.			trans	-68.8	141.3	174.8	-72.5	-172.6	164.1	-175.7	-2.8	110	C151 E153 R202 N206	C151-R204 PolarHBondContact O-N 2.77Å; C151-R204 VanDerWaalsContact O-N 3.12Å; E153-R204 HydrophobicContact CB-CG 4.38Å; E153-R204 IonicContact OE2-CZ 2.84Å; E153-R204 IonicContact OE2-NE 3.19Å; E153-R204 PolarHBondContact OE2-NE 2.91Å; E153-R204 VanDerWaalsContact OE2-NE 3.13Å; E153-R204 IonicContact OE2-NH2 3.03Å; E153-R204 PolarHBondContact OE2-NH2 3.33Å; R202-R204 PolarHBondContact O-N 2.9Å; R204-N206 VanDerWaalsContact C-N 3.34Å
205	V	70	Confident	65.6	Low	28 Å²	28	66.6 Å²	66.6	17%	0.17	36%	0.361	C	S	.	.	S	Bend	trans	-66.5	-43.5	178.3	-177	0	0	0	0	109.7	N243 V244 E247	V205-N243 HydrophobicContact CG1-CB 4.11Å; V205-V244 HydrophobicContact CG1-CG2 4.47Å; V205-E247 WeakPolarHBondContact CG2-OE2 3.42Å
206	N	70.9	Confident	63	Low	4 Å²	4	68.1 Å²	68.1	2%	0.021	38%	0.383	C	S	.	.	S	Bend	trans	-108.4	114.2	178	-55.5	-45.7	0	0	0	108.3	R204 E208 M240 N243 Y396	R204-N206 VanDerWaalsContact C-N 3.34Å; N206-E208 PolarHBondContact O-N 3.06Å; N206-M240 HydrophobicContact CB-CE 3.97Å; N206-M240 HydrophobicContact CB-CG 4.25Å; N206-M240 HydrophobicContact CB-SD 3.62Å; N206-M240 WeakPolarHBondContact ND2-CB 3.21Å; N206-M240 PolarHBondContact OD1-SD 3.38Å; N206-N243 PolarHBondContact OD1-ND2 2.83Å; N206-Y396 WeakPolarHBondContact ND2-CE2 3.31Å; N206-Y396 PolarHBondContact ND2-OH 3.36Å
207	Q	74.2	Confident	60.3	Low	62 Å²	62	74.4 Å²	74.4	29%	0.29	42%	0.422	S	S	.	.			trans	-79.3	89.6	174.7	-57.2	-63.5	4.8	0	0	108.3	C151	C151-Q207 VanDerWaalsContact CB-OE1 3.29Å; C151-Q207 PolarHBondContact O-OE1 3.2Å
208	E	58.9	Low	58.1	Low	84 Å²	84	80 Å²	80	39%	0.393	46%	0.458	S	S	.	.			trans	-74.4	132.8	173.7	-74.1	170.5	175.4	0	0	109.9	N206 L210 K395	N206-E208 PolarHBondContact O-N 3.06Å; E208-L210 PolarHBondContact O-N 3.01Å; E208-K395 WeakPolarHBondContact OE1-CE 3.4Å; E208-K395 IonicContact OE1-NZ 2.78Å; E208-K395 PolarHBondContact OE1-NZ 2.93Å; E208-K395 IonicContact OE2-NZ 3.78Å; E208-K395 PolarHBondContact OE2-NZ 3.22Å
209	E	51	Low	55.9	Low	162 Å²	162	84.5 Å²	84.5	76%	0.757	49%	0.489	S	S	*	.			trans	-67.9	118.1	170.1	-69.3	-171.3	169	0	0	109.6	S211	E209-S211 VanDerWaalsContact C-N 3.29Å; E209-S211 PolarHBondContact O-N 3.17Å
210	L	44.9	Very low	54.1	Low	124 Å²	124	90.4 Å²	90.4	65%	0.649	51%	0.509	S	S	*	.			trans	-64.4	88.5	168.2	-72.5	164.6	0	0	0	109	E208 E212	E208-L210 PolarHBondContact O-N 3.01Å; L210-E212 PolarHBondContact O-N 3.29Å
211	S	34.5	Very low	52.6	Low	116 Å²	116	97 Å²	97	81%	0.811	54%	0.54	S	S	*	.			trans	-90.6	77.5	171.1	42.5	0	0	0	0	109.7	E209	E209-S211 VanDerWaalsContact C-N 3.29Å; E209-S211 PolarHBondContact O-N 3.17Å
212	E	36.3	Very low	50.7	Low	138 Å²	138	103.8 Å²	103.8	65%	0.645	57%	0.572	S	S	*	*			trans	-89.8	127.5	165.6	-68.6	-165.4	153.8	0	0	110.6	L210	L210-E212 PolarHBondContact O-N 3.29Å
213	N	31.5	Very low	49.5	Very low	141 Å²	141	109 Å²	109	75%	0.754	60%	0.603	S	S	*	*			trans	56.6	116.5	155.4	-56.5	-24.8	0	0	0	116.3
214	S	33.4	Very low	47.9	Very low	108 Å²	108	116.1 Å²	116.1	76%	0.755	64%	0.635	S	S	*	*				-175.4	129.3	75.2	-59.6	0	0	0	0	110.7
215	S	33.4	Very low	46.5	Very low	115 Å²	115	119.5 Å²	119.5	80%	0.804	65%	0.654	S	S	*	*			trans	-12.4	127	155.4	54.3	0	0	0	0	119.1
216	S	36.8	Very low	45.4	Very low	110 Å²	110	120 Å²	120	77%	0.769	66%	0.661	S	S	*	*			trans	-167.8	116.2	130.7	53.2	0	0	0	0	113.4
217	T	35.4	Very low	44.7	Very low	132 Å²	132	123.2 Å²	123.2	81%	0.81	68%	0.684	S	S	*	*			trans	67.8	124.2	150.2	24.7	0	0	0	0	121.3
218	P	38.2	Very low	43.8	Very low	126 Å²	126	125.7 Å²	125.7	82%	0.818	70%	0.695	S	S	*	*			trans	-86.5	137.6	175.6	34.9	-29.5	0	0	0	111.2
219	S	40	Very low	43.8	Very low	101 Å²	101	124.9 Å²	124.9	71%	0.706	70%	0.699	S	S	*	*			trans	-130.6	128.4	162.1	34.2	0	0	0	0	108.6	E221	S219-E221 PolarHBondContact O-N 2.89Å
220	E	41.5	Very low	44.3	Very low	196 Å²	196	126.6 Å²	126.6	92%	0.916	70%	0.699	S	S	*	*	S	Bend	trans	-79.4	89.3	-163.4	-62.3	172.1	154.4	0	0	112.3
221	E	47.2	Very low	45	Very low	184 Å²	184	126.4 Å²	126.4	86%	0.86	69%	0.694	S	S	*	*			trans	-144.8	35.6	167.2	-67.8	-168.7	171.6	0	0	112.7	S219	S219-E221 PolarHBondContact O-N 2.89Å
222	Q	44	Very low	46.3	Very low	142 Å²	142	128.4 Å²	128.4	66%	0.664	68%	0.684	S	S	*	*			trans	-109.3	31.5	-155.8	-83.5	-171.1	-9.9	0	0	119.5	A226	Q222-A226 WeakPolarHBondContact O-CB 3.4Å
223	D	54.2	Low	47.9	Very low	149 Å²	149	128.2 Å²	128.2	80%	0.797	68%	0.683	S	S	*	*	S	Bend	trans	-94.5	-33.5	175.7	-88.5	-25.8	0	0	0	115.1	S227	D223-S227 PolarHBondContact O-OG 2.92Å
224	E	51.5	Low	49.8	Very low	157 Å²	157	124.4 Å²	124.4	73%	0.734	67%	0.666	S	S	*	*	H	α-helix	trans	-85.4	-33	177.4	-68.3	-151.4	170.9	0	0	113.7	A226 S227 Q228	E224-A226 VanDerWaalsContact C-N 3.29Å; E224-A226 PolarHBondContact O-N 2.8Å; E224-S227 PolarHBondContact O-N 2.78Å; E224-S227 PolarHBondContact O-OG 3.01Å; E224-S227 VanDerWaalsContact O-OG 3.05Å; E224-Q228 PolarHBondContact O-N 3.46Å
225	E	48.8	Very low	51.8	Low	131 Å²	131	123.7 Å²	123.7	61%	0.612	65%	0.651	S	S	*	*	H	α-helix	trans	-68.8	-29.3	173.5	-72.6	-168.7	151.7	0	0	112.2	S227 S229	E225-S227 VanDerWaalsContact C-N 3.31Å; E225-S227 PolarHBondContact O-N 3.4Å; E225-S229 WeakPolarHBondContact O-CB 3.44Å; E225-S229 PolarHBondContact O-N 2.81Å; E225-S229 PolarHBondContact O-OG 2.57Å
226	A	46.8	Very low	54.2	Low	37 Å²	37	123 Å²	123	31%	0.306	64%	0.639	S	S	.	*	H	α-helix	trans	-65.7	-32.5	176.3	0	0	0	0	0	112.6	Q222 E224 S229 R230	Q222-A226 WeakPolarHBondContact O-CB 3.4Å; E224-A226 VanDerWaalsContact C-N 3.29Å; E224-A226 PolarHBondContact O-N 2.8Å; A226-S229 WeakPolarHBondContact CA-OG 3.48Å; A226-S229 PolarHBondContact O-OG 3.41Å; A226-R230 WeakPolarHBondContact O-CB 3.32Å; A226-R230 VanDerWaalsContact O-CG 3.23Å; A226-R230 WeakPolarHBondContact O-CG 3.43Å; A226-R230 PolarHBondContact O-N 3.14Å
227	S	56.6	Low	56.5	Low	73 Å²	73	120.7 Å²	120.7	51%	0.51	61%	0.614	S	S	.	*	H	α-helix	trans	-79.7	-37.5	178.5	26.7	0	0	0	0	112.1	D223 E224 E225 H231	D223-S227 PolarHBondContact O-OG 2.92Å; E224-S227 PolarHBondContact O-N 2.78Å; E224-S227 PolarHBondContact O-OG 3.01Å; E224-S227 VanDerWaalsContact O-OG 3.05Å; E225-S227 VanDerWaalsContact C-N 3.31Å; E225-S227 PolarHBondContact O-N 3.4Å; S227-H231 PolarHBondContact O-N 2.93Å
228	Q	54.6	Low	59.2	Low	113 Å²	113	118.3 Å²	118.3	53%	0.528	59%	0.594	S	S	.	*	H	α-helix	trans	-67.1	-40.7	172.6	-68	-173.6	15.7	0	0	112.8	E224 H231 R232	E224-Q228 PolarHBondContact O-N 3.46Å; Q228-H231 PolarHBondContact O-N 2.93Å; Q228-R232 WeakPolarHBondContact O-CG 3.02Å; Q228-R232 PolarHBondContact O-N 3.13Å
229	S	60	Low	61.8	Low	68 Å²	68	116.8 Å²	116.8	48%	0.476	58%	0.576	S	S	.	*	H	α-helix	trans	-64.6	-39.5	176.5	56.8	0	0	0	0	112.1	E225 A226 H233	E225-S229 WeakPolarHBondContact O-CB 3.44Å; E225-S229 PolarHBondContact O-N 2.81Å; E225-S229 PolarHBondContact O-OG 2.57Å; A226-S229 WeakPolarHBondContact CA-OG 3.48Å; A226-S229 PolarHBondContact O-OG 3.41Å; S229-H233 WeakPolarHBondContact O-CB 3.42Å; S229-H233 PolarHBondContact O-N 2.93Å
230	R	59.8	Low	64.2	Low	198 Å²	198	114.3 Å²	114.3	75%	0.747	55%	0.554	S	S	*	*	H	α-helix	trans	-63.4	-41.8	172.1	-76.8	177.5	-177.9	-170.7	4.1	112.7	A226 H233 C234	A226-R230 WeakPolarHBondContact O-CB 3.32Å; A226-R230 VanDerWaalsContact O-CG 3.23Å; A226-R230 WeakPolarHBondContact O-CG 3.43Å; A226-R230 PolarHBondContact O-N 3.14Å; R230-H233 PolarHBondContact O-N 2.94Å; R230-C234 PolarHBondContact O-N 2.8Å
231	H	60.9	Low	66.8	Low	119 Å²	119	105.2 Å²	105.2	55%	0.551	51%	0.511	S	S	*	.	H	α-helix	trans	-63.9	-46.9	178.2	-153.9	-65.8	0	0	0	111.4	S227 Q228 H233 C234 E235	S227-H231 PolarHBondContact O-N 2.93Å; Q228-H231 PolarHBondContact O-N 2.93Å; H231-H233 VanDerWaalsContact C-N 3.32Å; H231-H233 PolarHBondContact O-N 2.84Å; H231-C234 PolarHBondContact O-N 2.84Å; H231-E235 IonicContact CE1-OE1 3.3Å; H231-E235 PolarHBondContact CE1-OE1 2.84Å; H231-E235 IonicContact ND1-OE1 2.98Å; H231-E235 PolarHBondContact ND1-OE1 2.96Å; H231-E235 WeakPolarHBondContact O-CG 3.28Å; H231-E235 PolarHBondContact O-N 3.49Å
232	R	62.5	Low	69.1	Low	158 Å²	158	96.7 Å²	96.7	60%	0.596	47%	0.472	S	S	*	.	H	α-helix	trans	-60.2	-40.5	174.8	-72.5	-178.8	-175.6	176.8	5.3	112.3	Q228 C234 N236	Q228-R232 WeakPolarHBondContact O-CG 3.02Å; Q228-R232 PolarHBondContact O-N 3.13Å; R232-C234 VanDerWaalsContact C-N 3.35Å; R232-C234 PolarHBondContact O-N 2.84Å; R232-N236 VanDerWaalsContact O-CB 3.3Å; R232-N236 WeakPolarHBondContact O-CB 3.45Å; R232-N236 PolarHBondContact O-N 2.95Å; R232-N236 PolarHBondContact O-ND2 2.87Å; R232-N236 PolarHBondContact O-OD1 3.26Å
233	H	68.6	Low	71.4	Confident	134 Å²	134	92.3 Å²	92.3	62%	0.62	45%	0.453	S	S	*	.	H	α-helix	trans	-65	-38.2	177.1	-172.5	-70.5	0	0	0	112.2	S229 R230 H231 K237	S229-H233 WeakPolarHBondContact O-CB 3.42Å; S229-H233 PolarHBondContact O-N 2.93Å; R230-H233 PolarHBondContact O-N 2.94Å; H231-H233 VanDerWaalsContact C-N 3.32Å; H231-H233 PolarHBondContact O-N 2.84Å; H233-K237 PolarHBondContact O-N 2.78Å; H233-K237 VanDerWaalsContact O-N 3.09Å
234	C	71.7	Confident	73.2	Confident	61 Å²	61	85.2 Å²	85.2	41%	0.412	42%	0.415	S	S	.	.	H	α-helix	trans	-66.1	-49	176.2	-167.8	0	0	0	0	111.7	R230 H231 R232 N236 K237 Q238	R230-C234 PolarHBondContact O-N 2.8Å; H231-C234 PolarHBondContact O-N 2.84Å; R232-C234 VanDerWaalsContact C-N 3.35Å; R232-C234 PolarHBondContact O-N 2.84Å; C234-N236 VanDerWaalsContact C-N 3.32Å; C234-N236 PolarHBondContact O-N 3.18Å; C234-K237 PolarHBondContact O-N 3.03Å; C234-K237 VanDerWaalsContact O-N 3.14Å; C234-Q238 WeakPolarHBondContact O-CG 3.46Å; C234-Q238 PolarHBondContact O-N 3.04Å
235	E	74.5	Confident	75.4	Confident	94 Å²	94	77.8 Å²	77.8	44%	0.439	38%	0.38	S	S	.	.	H	α-helix	trans	-58.7	-43	176.5	-72.2	172.7	175.4	0	0	111.6	H231 K237 Q238 Q239	H231-E235 IonicContact CE1-OE1 3.3Å; H231-E235 PolarHBondContact CE1-OE1 2.84Å; H231-E235 IonicContact ND1-OE1 2.98Å; H231-E235 PolarHBondContact ND1-OE1 2.96Å; H231-E235 WeakPolarHBondContact O-CG 3.28Å; H231-E235 PolarHBondContact O-N 3.49Å; E235-K237 PolarHBondContact O-N 3.34Å; E235-Q238 PolarHBondContact O-N 3.07Å; E235-Q239 WeakPolarHBondContact O-CB 3.43Å; E235-Q239 PolarHBondContact O-N 3.18Å
236	N	83.7	Confident	77.6	Confident	101 Å²	101	77 Å²	77	54%	0.54	37%	0.372	S	S	.	.	H	α-helix	trans	-59.9	-45.2	175.6	-74.1	-12.7	0	0	0	111.3	R232 C234 Q238 Q239 M240	R232-N236 VanDerWaalsContact O-CB 3.3Å; R232-N236 WeakPolarHBondContact O-CB 3.45Å; R232-N236 PolarHBondContact O-N 2.95Å; R232-N236 PolarHBondContact O-ND2 2.87Å; R232-N236 PolarHBondContact O-OD1 3.26Å; C234-N236 VanDerWaalsContact C-N 3.32Å; C234-N236 PolarHBondContact O-N 3.18Å; N236-Q238 PolarHBondContact O-N 3.09Å; N236-Q239 PolarHBondContact O-N 2.67Å; N236-M240 VanDerWaalsContact O-CG 3.25Å; N236-M240 WeakPolarHBondContact O-CG 3.33Å; N236-M240 PolarHBondContact O-N 2.83Å
237	K	86.5	Confident	79.7	Confident	60 Å²	60	75.7 Å²	75.7	26%	0.261	36%	0.359	S	S	.	.	H	α-helix	trans	-64.9	-40	178.5	-170.1	173.4	-179.6	177.3	0	112.1	H233 C234 E235 M240 R241 Y396 T398	H233-K237 PolarHBondContact O-N 2.78Å; H233-K237 VanDerWaalsContact O-N 3.09Å; C234-K237 PolarHBondContact O-N 3.03Å; C234-K237 VanDerWaalsContact O-N 3.14Å; E235-K237 PolarHBondContact O-N 3.34Å; K237-M240 PolarHBondContact O-N 3.31Å; K237-R241 PolarHBondContact O-N 3.49Å; K237-Y396 WeakPolarHBondContact CE-O 3.47Å; K237-Y396 HydrophobicContact CG-CD1 4.46Å; K237-T398 HydrophobicContact CD-CG2 4.11Å
238	Q	91.5	Very high	81.5	Confident	82 Å²	82	72.2 Å²	72.2	38%	0.383	34%	0.335	S	S	.	.	H	α-helix	trans	-64.5	-40.3	174.5	-71	175.5	-10.5	0	0	112	C234 E235 N236 R241 T242 H313	C234-Q238 WeakPolarHBondContact O-CG 3.46Å; C234-Q238 PolarHBondContact O-N 3.04Å; E235-Q238 PolarHBondContact O-N 3.07Å; N236-Q238 PolarHBondContact O-N 3.09Å; Q238-R241 PolarHBondContact O-N 2.6Å; Q238-T242 PolarHBondContact O-N 2.82Å; Q238-T242 PolarHBondContact O-OG1 3.2Å; Q238-T242 VanDerWaalsContact O-OG1 3.11Å; Q238-H313 HydrophobicContact CB-CB 4.37Å; Q238-H313 WeakPolarHBondContact O-CB 3.47Å
239	Q	92	Very high	83.5	Confident	95 Å²	95	66.8 Å²	66.8	44%	0.444	31%	0.31	S	S	.	.	H	α-helix	trans	-64.7	-42.7	174.7	-174.3	57.6	54.9	0	0	111.4	E235 N236 R241 T242 N243	E235-Q239 WeakPolarHBondContact O-CB 3.43Å; E235-Q239 PolarHBondContact O-N 3.18Å; N236-Q239 PolarHBondContact O-N 2.67Å; Q239-R241 PolarHBondContact O-N 3.29Å; Q239-T242 VanDerWaalsContact O-CB 3.3Å; Q239-T242 WeakPolarHBondContact O-CB 3.42Å; Q239-T242 PolarHBondContact O-N 2.94Å; Q239-N243 PolarHBondContact NE2-OD1 3.3Å; Q239-N243 PolarHBondContact O-N 3.43Å; Q239-N243 PolarHBondContact O-OD1 3.07Å
240	M	90.9	Very high	85.1	Confident	48 Å²	48	67.6 Å²	67.6	24%	0.236	31%	0.309	C	S	.	.	H	α-helix	trans	-60.5	-44.1	174.5	-67.4	-33.2	-174	0	0	111.6	N206 N236 K237 T242 N243 V244 Y396	N206-M240 HydrophobicContact CB-CE 3.97Å; N206-M240 HydrophobicContact CB-CG 4.25Å; N206-M240 HydrophobicContact CB-SD 3.62Å; N206-M240 WeakPolarHBondContact ND2-CB 3.21Å; N206-M240 PolarHBondContact OD1-SD 3.38Å; N236-M240 VanDerWaalsContact O-CG 3.25Å; N236-M240 WeakPolarHBondContact O-CG 3.33Å; N236-M240 PolarHBondContact O-N 2.83Å; K237-M240 PolarHBondContact O-N 3.31Å; M240-T242 VanDerWaalsContact C-N 3.34Å; M240-T242 PolarHBondContact O-N 3.3Å; M240-N243 WeakPolarHBondContact O-CB 3.22Å; M240-N243 PolarHBondContact O-N 2.94Å; M240-V244 WeakPolarHBondContact O-CG2 3.43Å; M240-V244 PolarHBondContact O-N 3.03Å; M240-V244 VanDerWaalsContact O-N 3.16Å; M240-Y396 HydrophobicContact CB-CD1 3.45Å; M240-Y396 VanDerWaalsContact CB-CD1 3.45Å; M240-Y396 HydrophobicContact CB-CD2 3.96Å; M240-Y396 HydrophobicContact CB-CE1 3.8Å; M240-Y396 HydrophobicContact CB-CE2 4.26Å; M240-Y396 HydrophobicContact CB-CG 3.55Å; M240-Y396 HydrophobicContact CG-CD1 3.99Å; M240-Y396 HydrophobicContact CG-CE1 3.94Å
241	R	95.5	Very high	86.6	Confident	5 Å²	5	60 Å²	60	2%	0.019	28%	0.284	C	S	.	.	H	α-helix	trans	-60.4	-42.8	173.5	-177.9	171	164.8	81.1	7.5	111.6	K237 Q238 Q239 N243 V244 I245 H313 S315 L393 T397 H401 D403	K237-R241 PolarHBondContact O-N 3.49Å; Q238-R241 PolarHBondContact O-N 2.6Å; Q239-R241 PolarHBondContact O-N 3.29Å; R241-N243 VanDerWaalsContact C-N 3.33Å; R241-N243 PolarHBondContact O-N 3.47Å; R241-V244 PolarHBondContact O-N 2.94Å; R241-I245 HydrophobicContact CG-CG1 4.46Å; R241-I245 WeakPolarHBondContact O-CG1 3.32Å; R241-I245 PolarHBondContact O-N 2.56Å; R241-H313 HydrophobicContact CB-CB 4.36Å; R241-H313 WeakPolarHBondContact CD-O 3.41Å; R241-H313 HydrophobicContact CG-CB 4.33Å; R241-H313 PolarHBondContact NE-O 2.82Å; R241-S315 PolarHBondContact NH2-O 3.45Å; R241-L393 HydrophobicContact CG-CD1 3.9Å; R241-T397 PolarHBondContact NH1-OG1 3.49Å; R241-H401 PolarHBondContact NE-NE2 2.9Å; R241-H401 PolarHBondContact NH2-CE1 3.43Å; R241-H401 PolarHBondContact NH2-NE2 3.23Å; R241-D403 IonicContact NH2-OD2 2.68Å
242	T	95.4	Very high	88.2	Confident	5 Å²	5	54.3 Å²	54.3	3%	0.031	26%	0.258	C	S	.	.	H	α-helix	trans	-56.1	-46.2	174.4	-70.3	0	0	0	0	111.8	Q238 Q239 M240 V244 I245 R246 P312 H313	Q238-T242 PolarHBondContact O-N 2.82Å; Q238-T242 PolarHBondContact O-OG1 3.2Å; Q238-T242 VanDerWaalsContact O-OG1 3.11Å; Q239-T242 VanDerWaalsContact O-CB 3.3Å; Q239-T242 WeakPolarHBondContact O-CB 3.42Å; Q239-T242 PolarHBondContact O-N 2.94Å; M240-T242 VanDerWaalsContact C-N 3.34Å; M240-T242 PolarHBondContact O-N 3.3Å; T242-V244 PolarHBondContact O-N 3.35Å; T242-I245 PolarHBondContact O-N 2.76Å; T242-R246 WeakPolarHBondContact O-CG 3.19Å; T242-R246 PolarHBondContact O-N 3.04Å; T242-P312 HydrophobicContact CG2-CB 3.89Å; T242-P312 HydrophobicContact CG2-CG 4.13Å; T242-H313 WeakPolarHBondContact OG1-CB 3.35Å; T242-H313 PolarHBondContact OG1-N 3.1Å
243	N	92.8	Very high	89.8	Confident	51 Å²	51	51 Å²	51	27%	0.273	25%	0.245	S	C	.	.	H	α-helix	trans	-60.5	-46	-179.8	-63	-14.2	0	0	0	111.2	V205 N206 Q239 M240 R241 R246 E247	V205-N243 HydrophobicContact CG1-CB 4.11Å; N206-N243 PolarHBondContact OD1-ND2 2.83Å; Q239-N243 PolarHBondContact NE2-OD1 3.3Å; Q239-N243 PolarHBondContact O-N 3.43Å; Q239-N243 PolarHBondContact O-OD1 3.07Å; M240-N243 WeakPolarHBondContact O-CB 3.22Å; M240-N243 PolarHBondContact O-N 2.94Å; R241-N243 VanDerWaalsContact C-N 3.33Å; R241-N243 PolarHBondContact O-N 3.47Å; N243-R246 PolarHBondContact O-N 3.49Å; N243-E247 WeakPolarHBondContact O-CB 3.27Å; N243-E247 PolarHBondContact O-N 3.01Å
244	V	93.1	Very high	90.9	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-65	-43.5	179.2	-179.4	0	0	0	0	111.5	V205 M240 R241 T242 R246 E247 I248 E392 L393 Y396	V205-V244 HydrophobicContact CG1-CG2 4.47Å; M240-V244 WeakPolarHBondContact O-CG2 3.43Å; M240-V244 PolarHBondContact O-N 3.03Å; M240-V244 VanDerWaalsContact O-N 3.16Å; R241-V244 PolarHBondContact O-N 2.94Å; T242-V244 PolarHBondContact O-N 3.35Å; V244-R246 PolarHBondContact O-N 3.36Å; V244-E247 PolarHBondContact O-N 3.05Å; V244-I248 HydrophobicContact CG1-CD1 4.01Å; V244-I248 WeakPolarHBondContact O-CG1 3.23Å; V244-I248 PolarHBondContact O-N 2.78Å; V244-E392 HydrophobicContact CG1-CB 4.46Å; V244-E392 HydrophobicContact CG1-CG 4.46Å; V244-E392 HydrophobicContact CG2-CG 3.74Å; V244-L393 HydrophobicContact CB-CD1 4.29Å; V244-L393 HydrophobicContact CG1-CB 3.8Å; V244-L393 HydrophobicContact CG1-CD1 4.08Å; V244-Y396 HydrophobicContact CG2-CD2 4.04Å; V244-Y396 HydrophobicContact CG2-CE2 4.22Å
245	I	96.3	Very high	92	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-60.4	-46.6	176.7	-68.4	-67.1	0	0	0	110.8	R241 T242 E247 I248 M249 Y307 I317 L393	R241-I245 HydrophobicContact CG-CG1 4.46Å; R241-I245 WeakPolarHBondContact O-CG1 3.32Å; R241-I245 PolarHBondContact O-N 2.56Å; T242-I245 PolarHBondContact O-N 2.76Å; I245-E247 PolarHBondContact O-N 2.99Å; I245-I248 PolarHBondContact O-N 3.36Å; I245-M249 WeakPolarHBondContact O-CG 3.49Å; I245-M249 PolarHBondContact O-N 2.73Å; I245-Y307 HydrophobicContact CG2-CD2 3.83Å; I245-Y307 HydrophobicContact CG2-CE2 3.75Å; I245-I317 HydrophobicContact CD1-CD1 3.53Å; I245-I317 HydrophobicContact CD1-CG1 3.82Å; I245-L393 HydrophobicContact CD1-CD1 3.59Å; I245-L393 HydrophobicContact CD1-CD2 3.78Å; I245-L393 HydrophobicContact CD1-CG 4.36Å; I245-L393 HydrophobicContact CG1-CD1 3.85Å
246	R	95.1	Very high	93	Very high	116 Å²	116	41 Å²	41	44%	0.438	20%	0.196	S	C	.	.	H	α-helix	trans	-61.1	-44.5	177.9	-72.6	-179.6	-174.2	172.5	4.2	111.7	T242 N243 V244 I248 M249 D250	T242-R246 WeakPolarHBondContact O-CG 3.19Å; T242-R246 PolarHBondContact O-N 3.04Å; N243-R246 PolarHBondContact O-N 3.49Å; V244-R246 PolarHBondContact O-N 3.36Å; R246-I248 VanDerWaalsContact C-N 3.34Å; R246-I248 PolarHBondContact O-N 3.42Å; R246-M249 PolarHBondContact O-N 3.4Å; R246-D250 WeakPolarHBondContact O-CB 3.48Å; R246-D250 VanDerWaalsContact O-CG 3.3Å; R246-D250 PolarHBondContact O-N 3.37Å
247	E	91.8	Very high	93.5	Very high	8 Å²	8	39.7 Å²	39.7	4%	0.037	19%	0.185	C	C	.	.	H	α-helix	trans	-57.2	-46.6	175	-176.1	-158.3	-178.9	0	0	111.6	S78 R202 V205 N243 V244 I245 M249 D250 T251	S78-E247 WeakPolarHBondContact CB-OE1 3.41Å; S78-E247 WeakPolarHBondContact OG-CG 3.48Å; S78-E247 PolarHBondContact OG-OE1 3.46Å; R202-E247 IonicContact NH2-OE1 2.83Å; R202-E247 PolarHBondContact NH2-OE1 3.01Å; R202-E247 VanDerWaalsContact NH2-OE1 3.12Å; R202-E247 IonicContact NH2-OE2 2.69Å; V205-E247 WeakPolarHBondContact CG2-OE2 3.42Å; N243-E247 WeakPolarHBondContact O-CB 3.27Å; N243-E247 PolarHBondContact O-N 3.01Å; V244-E247 PolarHBondContact O-N 3.05Å; I245-E247 PolarHBondContact O-N 2.99Å; E247-M249 VanDerWaalsContact C-N 3.34Å; E247-M249 PolarHBondContact O-N 3.22Å; E247-D250 PolarHBondContact O-N 3.08Å; E247-T251 HydrophobicContact CG-CG2 4.06Å; E247-T251 VanDerWaalsContact O-CB 3.3Å; E247-T251 WeakPolarHBondContact O-CB 3.42Å; E247-T251 WeakPolarHBondContact O-CG2 3.36Å; E247-T251 PolarHBondContact O-N 3.2Å; E247-T251 PolarHBondContact O-OG1 3.46Å
248	I	94.2	Very high	93.8	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-58	-49.2	178	-70.5	168.4	0	0	0	110	V244 I245 R246 T251 E252 I317 Q389 L393	V244-I248 HydrophobicContact CG1-CD1 4.01Å; V244-I248 WeakPolarHBondContact O-CG1 3.23Å; V244-I248 PolarHBondContact O-N 2.78Å; I245-I248 PolarHBondContact O-N 3.36Å; R246-I248 VanDerWaalsContact C-N 3.34Å; R246-I248 PolarHBondContact O-N 3.42Å; I248-T251 PolarHBondContact O-OG1 2.92Å; I248-T251 VanDerWaalsContact O-OG1 3.11Å; I248-E252 VanDerWaalsContact O-CB 3.25Å; I248-E252 WeakPolarHBondContact O-CB 3.44Å; I248-E252 PolarHBondContact O-N 3.23Å; I248-I317 HydrophobicContact CD1-CD1 3.94Å; I248-I317 HydrophobicContact CG2-CD1 4.07Å; I248-Q389 HydrophobicContact CD1-CB 4.22Å; I248-Q389 HydrophobicContact CG1-CB 4.02Å; I248-Q389 HydrophobicContact CG1-CG 4.46Å; I248-L393 HydrophobicContact CD1-CD2 4.24Å
249	M	96.4	Very high	94	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-62.8	-45.5	-179.7	-64.4	-53.8	-65.2	0	0	112.7	I245 R246 E247 E252 R253 L300 L303 E304 Y307	I245-M249 WeakPolarHBondContact O-CG 3.49Å; I245-M249 PolarHBondContact O-N 2.73Å; R246-M249 PolarHBondContact O-N 3.4Å; E247-M249 VanDerWaalsContact C-N 3.34Å; E247-M249 PolarHBondContact O-N 3.22Å; M249-E252 WeakPolarHBondContact O-CB 3.33Å; M249-E252 PolarHBondContact O-N 3.4Å; M249-R253 WeakPolarHBondContact O-CG 3.38Å; M249-R253 PolarHBondContact O-N 2.78Å; M249-R253 VanDerWaalsContact O-N 3.07Å; M249-L300 HydrophobicContact CE-CD1 4.28Å; M249-L303 HydrophobicContact CE-CB 4.02Å; M249-L303 HydrophobicContact SD-CB 3.95Å; M249-E304 HydrophobicContact CE-CB 4.31Å; M249-E304 HydrophobicContact CE-CG 3.52Å; M249-Y307 HydrophobicContact CE-CG 4.34Å; M249-Y307 HydrophobicContact CG-CD2 3.77Å; M249-Y307 HydrophobicContact CG-CE2 4.09Å; M249-Y307 HydrophobicContact CG-CG 4.29Å; M249-Y307 HydrophobicContact SD-CD2 4.42Å
250	D	92.8	Very high	94.3	Very high	85 Å²	85	34.6 Å²	34.6	46%	0.455	16%	0.159	S	C	.	.	H	α-helix	trans	-70.9	-42.8	-176.4	-68.2	-19.9	0	0	0	111.6	R246 E247 E252 R253 V254	R246-D250 WeakPolarHBondContact O-CB 3.48Å; R246-D250 VanDerWaalsContact O-CG 3.3Å; R246-D250 PolarHBondContact O-N 3.37Å; E247-D250 PolarHBondContact O-N 3.08Å; D250-E252 PolarHBondContact O-N 2.94Å; D250-R253 PolarHBondContact O-N 2.77Å; D250-R253 IonicContact OD1-NH1 2.87Å; D250-R253 PolarHBondContact OD1-NH1 3.07Å; D250-V254 WeakPolarHBondContact O-CG2 3.44Å; D250-V254 PolarHBondContact O-N 2.91Å
251	T	91.4	Very high	94.5	Very high	37 Å²	37	32.4 Å²	32.4	23%	0.227	15%	0.148	C	C	.	.	H	α-helix	trans	-64.1	-31	175.2	59.6	0	0	0	0	112	E247 I248 Y255 Q389	E247-T251 HydrophobicContact CG-CG2 4.06Å; E247-T251 VanDerWaalsContact O-CB 3.3Å; E247-T251 WeakPolarHBondContact O-CB 3.42Å; E247-T251 WeakPolarHBondContact O-CG2 3.36Å; E247-T251 PolarHBondContact O-N 3.2Å; E247-T251 PolarHBondContact O-OG1 3.46Å; I248-T251 PolarHBondContact O-OG1 2.92Å; I248-T251 VanDerWaalsContact O-OG1 3.11Å; T251-Y255 VanDerWaalsContact O-CB 3.29Å; T251-Y255 WeakPolarHBondContact O-CB 3.4Å; T251-Y255 PolarHBondContact O-N 3.49Å; T251-Q389 PolarHBondContact OG1-NE2 3.07Å; T251-Q389 VanDerWaalsContact OG1-NE2 3.16Å
252	E	95.6	Very high	94.5	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-68.7	-45.8	175.2	-162.4	53.7	-120.6	0	0	112.5	I248 M249 D250 V254 Y255 I256 Q296 L300 L303 K382	I248-E252 VanDerWaalsContact O-CB 3.25Å; I248-E252 WeakPolarHBondContact O-CB 3.44Å; I248-E252 PolarHBondContact O-N 3.23Å; M249-E252 WeakPolarHBondContact O-CB 3.33Å; M249-E252 PolarHBondContact O-N 3.4Å; D250-E252 PolarHBondContact O-N 2.94Å; E252-V254 VanDerWaalsContact C-N 3.34Å; E252-V254 PolarHBondContact O-N 3.46Å; E252-Y255 PolarHBondContact O-N 2.87Å; E252-I256 HydrophobicContact CG-CD1 4.42Å; E252-I256 PolarHBondContact O-N 2.67Å; E252-Q296 VanDerWaalsContact CD-NE2 3.3Å; E252-Q296 VanDerWaalsContact OE1-CD 3.31Å; E252-Q296 VanDerWaalsContact OE1-CG 3.29Å; E252-Q296 WeakPolarHBondContact OE1-CG 3.04Å; E252-Q296 PolarHBondContact OE1-NE2 2.75Å; E252-L300 HydrophobicContact CB-CD1 4.11Å; E252-L300 HydrophobicContact CG-CB 4.26Å; E252-L300 HydrophobicContact CG-CD1 3.8Å; E252-L303 HydrophobicContact CG-CD1 3.95Å; E252-K382 WeakPolarHBondContact OE2-CE 3.01Å; E252-K382 IonicContact OE2-NZ 3.91Å; E252-K382 PolarHBondContact OE2-NZ 3.39Å
253	R	96.2	Very high	94.6	Very high	90 Å²	90	32.6 Å²	32.6	34%	0.34	15%	0.15	S	C	.	.	H	α-helix	trans	-60.4	-44	175.4	-69.9	169.3	-177	134.2	2.4	111.8	M249 D250 I256 K257 L300 E304	M249-R253 WeakPolarHBondContact O-CG 3.38Å; M249-R253 PolarHBondContact O-N 2.78Å; M249-R253 VanDerWaalsContact O-N 3.07Å; D250-R253 PolarHBondContact O-N 2.77Å; D250-R253 IonicContact OD1-NH1 2.87Å; D250-R253 PolarHBondContact OD1-NH1 3.07Å; R253-I256 PolarHBondContact O-N 3.11Å; R253-K257 WeakPolarHBondContact O-CB 3.35Å; R253-K257 PolarHBondContact O-N 3Å; R253-L300 HydrophobicContact CG-CD1 4.13Å; R253-L300 HydrophobicContact CG-CD2 4.09Å; R253-E304 IonicContact CZ-OE1 3.02Å; R253-E304 IonicContact NE-OE1 3.77Å; R253-E304 PolarHBondContact NE-OE1 3.27Å; R253-E304 IonicContact NH2-OE1 3.77Å; R253-E304 PolarHBondContact NH2-OE1 2.79Å
254	V	90.6	Very high	94.7	Very high	49 Å²	49	32.7 Å²	32.7	30%	0.297	15%	0.149	S	C	.	.	H	α-helix	trans	-63.1	-44.3	176.6	172	0	0	0	0	110.9	D250 E252 I256 K257 H258	D250-V254 WeakPolarHBondContact O-CG2 3.44Å; D250-V254 PolarHBondContact O-N 2.91Å; E252-V254 VanDerWaalsContact C-N 3.34Å; E252-V254 PolarHBondContact O-N 3.46Å; V254-I256 PolarHBondContact O-N 2.78Å; V254-K257 WeakPolarHBondContact O-CB 3.04Å; V254-K257 PolarHBondContact O-N 2.89Å; V254-H258 WeakPolarHBondContact CG1-NE2 3.31Å; V254-H258 PolarHBondContact O-CD2 3.15Å; V254-H258 PolarHBondContact O-N 2.86Å
255	Y	94.9	Very high	94.8	Very high	10 Å²	10	32.9 Å²	32.9	4%	0.039	15%	0.15	C	C	.	.	H	α-helix	trans	-61.5	-45	178.1	175.1	-123.5	0	0	0	112.4	T251 E252 K257 H258 L259 I292 Q296 Y331 P379 K382	T251-Y255 VanDerWaalsContact O-CB 3.29Å; T251-Y255 WeakPolarHBondContact O-CB 3.4Å; T251-Y255 PolarHBondContact O-N 3.49Å; E252-Y255 PolarHBondContact O-N 2.87Å; Y255-K257 VanDerWaalsContact C-N 3.32Å; Y255-K257 PolarHBondContact O-N 2.76Å; Y255-H258 WeakPolarHBondContact O-CB 3.28Å; Y255-H258 PolarHBondContact O-N 3.32Å; Y255-H258 VanDerWaalsContact O-N 3.13Å; Y255-L259 HydrophobicContact CD1-CD1 4.18Å; Y255-L259 HydrophobicContact CD2-CG 4.37Å; Y255-L259 HydrophobicContact CE1-CD1 3.65Å; Y255-L259 HydrophobicContact CE1-CG 4.37Å; Y255-L259 HydrophobicContact CE2-CD1 4.11Å; Y255-L259 HydrophobicContact CE2-CD2 4.03Å; Y255-L259 HydrophobicContact CE2-CG 3.93Å; Y255-L259 WeakPolarHBondContact O-CG 3.48Å; Y255-L259 PolarHBondContact O-N 3.37Å; Y255-I292 WeakPolarHBondContact OH-CG2 3.38Å; Y255-Q296 HydrophobicContact CD1-CG 3.76Å; Y255-Q296 HydrophobicContact CE1-CG 3.63Å; Y255-Y331 VanDerWaalsContact CE1-OH 3.29Å; Y255-Y331 WeakPolarHBondContact CE1-OH 3.43Å; Y255-Y331 WeakPolarHBondContact OH-CE1 3.43Å; Y255-Y331 PolarHBondContact OH-OH 3.13Å; Y255-P379 HydrophobicContact CE2-CG 4.34Å; Y255-P379 WeakPolarHBondContact OH-CA 3.45Å; Y255-P379 WeakPolarHBondContact OH-CB 3.4Å; Y255-K382 HydrophobicContact CD1-CB 4.44Å; Y255-K382 HydrophobicContact CD1-CD 4.22Å; Y255-K382 HydrophobicContact CD1-CG 3.73Å; Y255-K382 HydrophobicContact CD2-CB 4.23Å; Y255-K382 HydrophobicContact CD2-CG 4.32Å; Y255-K382 HydrophobicContact CE1-CB 4.18Å; Y255-K382 HydrophobicContact CE1-CG 3.68Å; Y255-K382 HydrophobicContact CE2-CB 3.98Å; Y255-K382 HydrophobicContact CE2-CG 4.3Å; Y255-K382 HydrophobicContact CG-CB 4.46Å; Y255-K382 HydrophobicContact CG-CD 4.3Å; Y255-K382 HydrophobicContact CG-CG 4.04Å
256	I	96.3	Very high	94.8	Very high	19 Å²	19	32.9 Å²	32.9	10%	0.097	15%	0.15	C	C	.	.	H	α-helix	trans	-64.1	-37.9	176	-74.3	167	0	0	0	111.8	E252 R253 V254 H258 L259 R260 Y293 Q296 R297 L300	E252-I256 HydrophobicContact CG-CD1 4.42Å; E252-I256 PolarHBondContact O-N 2.67Å; R253-I256 PolarHBondContact O-N 3.11Å; V254-I256 PolarHBondContact O-N 2.78Å; I256-H258 VanDerWaalsContact C-N 3.32Å; I256-H258 PolarHBondContact O-N 3.35Å; I256-L259 PolarHBondContact O-N 2.55Å; I256-R260 WeakPolarHBondContact O-CB 3.21Å; I256-R260 PolarHBondContact O-N 2.95Å; I256-Y293 HydrophobicContact CG2-CE2 4Å; I256-Q296 HydrophobicContact CD1-CB 4.35Å; I256-Q296 HydrophobicContact CD1-CG 3.87Å; I256-Q296 WeakPolarHBondContact CD1-O 3.36Å; I256-Q296 HydrophobicContact CG1-CB 3.95Å; I256-Q296 HydrophobicContact CG1-CG 3.51Å; I256-R297 HydrophobicContact CG2-CG 4.27Å; I256-L300 HydrophobicContact CD1-CB 3.19Å; I256-L300 HydrophobicContact CD1-CD2 3.41Å; I256-L300 VanDerWaalsContact CD1-CD2 3.41Å; I256-L300 HydrophobicContact CD1-CG 3.83Å
257	K	94	Very high	94.9	Very high	73 Å²	73	27.6 Å²	27.6	32%	0.317	13%	0.131	S	C	.	.	H	α-helix	trans	-58	-45.9	172.1	-178.1	-174.4	179.3	-65.5	0	110.7	R253 V254 Y255 R260 D261	R253-K257 WeakPolarHBondContact O-CB 3.35Å; R253-K257 PolarHBondContact O-N 3Å; V254-K257 WeakPolarHBondContact O-CB 3.04Å; V254-K257 PolarHBondContact O-N 2.89Å; Y255-K257 VanDerWaalsContact C-N 3.32Å; Y255-K257 PolarHBondContact O-N 2.76Å; K257-R260 PolarHBondContact O-N 2.84Å; K257-D261 IonicContact NZ-OD2 3.09Å; K257-D261 PolarHBondContact NZ-OD2 2.8Å; K257-D261 WeakPolarHBondContact O-CB 3.26Å; K257-D261 PolarHBondContact O-N 3.03Å
258	H	92.2	Very high	95.2	Very high	35 Å²	35	32.9 Å²	32.9	16%	0.162	15%	0.15	C	C	.	.	H	α-helix	trans	-61.3	-44.8	176.3	-64.2	-27.9	0	0	0	112.4	V254 Y255 I256 R260 D261 I262 F375	V254-H258 WeakPolarHBondContact CG1-NE2 3.31Å; V254-H258 PolarHBondContact O-CD2 3.15Å; V254-H258 PolarHBondContact O-N 2.86Å; Y255-H258 WeakPolarHBondContact O-CB 3.28Å; Y255-H258 PolarHBondContact O-N 3.32Å; Y255-H258 VanDerWaalsContact O-N 3.13Å; I256-H258 VanDerWaalsContact C-N 3.32Å; I256-H258 PolarHBondContact O-N 3.35Å; H258-R260 VanDerWaalsContact C-N 3.35Å; H258-R260 PolarHBondContact O-N 2.84Å; H258-D261 PolarHBondContact O-N 3.37Å; H258-I262 VanDerWaalsContact O-CG1 3.26Å; H258-I262 WeakPolarHBondContact O-CG1 3.31Å; H258-I262 PolarHBondContact O-N 2.77Å; H258-F375 HydrophobicContact CB-CD1 4.36Å; H258-F375 AromaticContact ND1-CE1 3.77Å
259	L	97.2	Very high	95.3	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-60.1	-43.7	176.3	-69.3	176.3	0	0	0	112.2	Y255 I256 I262 C263 I289 I292 Y293 Q296 P379	Y255-L259 HydrophobicContact CD1-CD1 4.18Å; Y255-L259 HydrophobicContact CD2-CG 4.37Å; Y255-L259 HydrophobicContact CE1-CD1 3.65Å; Y255-L259 HydrophobicContact CE1-CG 4.37Å; Y255-L259 HydrophobicContact CE2-CD1 4.11Å; Y255-L259 HydrophobicContact CE2-CD2 4.03Å; Y255-L259 HydrophobicContact CE2-CG 3.93Å; Y255-L259 WeakPolarHBondContact O-CG 3.48Å; Y255-L259 PolarHBondContact O-N 3.37Å; I256-L259 PolarHBondContact O-N 2.55Å; L259-I262 PolarHBondContact O-N 2.8Å; L259-C263 PolarHBondContact O-N 2.69Å; L259-C263 PolarHBondContact O-SG 2.83Å; L259-I289 HydrophobicContact CD2-CD1 4.14Å; L259-I289 HydrophobicContact CD2-CG1 3.9Å; L259-I292 HydrophobicContact CD1-CG2 3.97Å; L259-I292 HydrophobicContact CD2-CG2 4.19Å; L259-Y293 HydrophobicContact CB-CD2 3.55Å; L259-Y293 HydrophobicContact CB-CE2 4.34Å; L259-Y293 HydrophobicContact CB-CG 4.1Å; L259-Y293 HydrophobicContact CD1-CD2 4.38Å; L259-Q296 HydrophobicContact CD1-CB 3.86Å; L259-Q296 HydrophobicContact CD1-CG 4.14Å; L259-P379 HydrophobicContact CD2-CG 4.11Å
260	R	97	Very high	95.3	Very high	96 Å²	96	34.9 Å²	34.9	36%	0.362	16%	0.16	S	C	.	.	H	α-helix	trans	-59.3	-51.7	173.9	-178	-166.6	66.8	-176.9	4.8	110.7	I256 K257 H258 I262 C263 E264 Y293	I256-R260 WeakPolarHBondContact O-CB 3.21Å; I256-R260 PolarHBondContact O-N 2.95Å; K257-R260 PolarHBondContact O-N 2.84Å; H258-R260 VanDerWaalsContact C-N 3.35Å; H258-R260 PolarHBondContact O-N 2.84Å; R260-I262 PolarHBondContact O-N 3.25Å; R260-C263 PolarHBondContact O-N 2.95Å; R260-C263 VanDerWaalsContact O-N 3.07Å; R260-E264 HydrophobicContact CG-CG 3.99Å; R260-E264 WeakPolarHBondContact CG-OE2 3.19Å; R260-E264 WeakPolarHBondContact O-CB 3.44Å; R260-E264 WeakPolarHBondContact O-CG 3.16Å; R260-E264 PolarHBondContact O-N 2.84Å; R260-Y293 HydrophobicContact CB-CE1 4.49Å; R260-Y293 HydrophobicContact CB-CE2 3.77Å; R260-Y293 WeakPolarHBondContact CB-OH 3.4Å; R260-Y293 WeakPolarHBondContact CG-OH 3.47Å
261	D	94.9	Very high	95.4	Very high	2 Å²	2	37.1 Å²	37.1	1%	0.011	16%	0.162	C	C	.	.	H	α-helix	trans	-60.8	-32.5	-177.8	-64.4	-16.4	0	0	0	110.9	K257 H258 G265 Q365 M367	K257-D261 IonicContact NZ-OD2 3.09Å; K257-D261 PolarHBondContact NZ-OD2 2.8Å; K257-D261 WeakPolarHBondContact O-CB 3.26Å; K257-D261 PolarHBondContact O-N 3.03Å; H258-D261 PolarHBondContact O-N 3.37Å; D261-G265 WeakPolarHBondContact O-CA 3.33Å; D261-G265 PolarHBondContact O-N 2.88Å; D261-Q365 HydrophobicContact CB-CG 3.84Å; D261-Q365 PolarHBondContact OD1-NE2 3.42Å; D261-M367 HydrophobicContact CB-CE 3.61Å; D261-M367 HydrophobicContact CB-CG 4.03Å; D261-M367 HydrophobicContact CB-SD 3.9Å
262	I	96.6	Very high	95.6	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	18%	0.179	C	C	.	.	I	π-helix	trans	-68.1	-48.9	171.6	-62.2	160	0	0	0	112.1	H258 L259 R260 Y266 I267 F286 I289 M367 F375 L376	H258-I262 VanDerWaalsContact O-CG1 3.26Å; H258-I262 WeakPolarHBondContact O-CG1 3.31Å; H258-I262 PolarHBondContact O-N 2.77Å; L259-I262 PolarHBondContact O-N 2.8Å; R260-I262 PolarHBondContact O-N 3.25Å; I262-Y266 HydrophobicContact CG1-CD2 4.5Å; I262-Y266 HydrophobicContact CG2-CD2 4.45Å; I262-Y266 WeakPolarHBondContact O-CA 3.2Å; I262-Y266 WeakPolarHBondContact O-CB 3.37Å; I262-Y266 PolarHBondContact O-N 2.82Å; I262-I267 PolarHBondContact O-N 2.75Å; I262-F286 HydrophobicContact CG2-CD1 4.22Å; I262-F286 HydrophobicContact CG2-CE1 4.18Å; I262-I289 HydrophobicContact CB-CD1 4.35Å; I262-I289 HydrophobicContact CD1-CD1 3.74Å; I262-I289 HydrophobicContact CG2-CD1 3.85Å; I262-M367 HydrophobicContact CG1-CE 4.5Å; I262-F375 HydrophobicContact CD1-CB 3.92Å; I262-F375 HydrophobicContact CG1-CB 3.98Å; I262-L376 HydrophobicContact CG2-CD2 4.14Å
263	C	97.1	Very high	95.6	Very high	13 Å²	13	45.5 Å²	45.5	9%	0.088	20%	0.196	C	C	.	.	I	π-helix	trans	-64.3	-43.7	-178.1	-64.5	0	0	0	0	111.8	L259 R260 I267 R268 Y293	L259-C263 PolarHBondContact O-N 2.69Å; L259-C263 PolarHBondContact O-SG 2.83Å; R260-C263 PolarHBondContact O-N 2.95Å; R260-C263 VanDerWaalsContact O-N 3.07Å; C263-I267 WeakPolarHBondContact O-CB 3.28Å; C263-R268 PolarHBondContact O-N 3.29Å; C263-Y293 HydrophobicContact CB-CD1 4.36Å
264	E	95.4	Very high	95.3	Very high	54 Å²	54	46.9 Å²	46.9	25%	0.252	21%	0.214	S	C	.	.	I	π-helix	trans	-86.8	-39.5	-175.1	-58.2	-159.5	125.1	0	0	113.2	R260 R268	R260-E264 HydrophobicContact CG-CG 3.99Å; R260-E264 WeakPolarHBondContact CG-OE2 3.19Å; R260-E264 WeakPolarHBondContact O-CB 3.44Å; R260-E264 WeakPolarHBondContact O-CG 3.16Å; R260-E264 PolarHBondContact O-N 2.84Å; E264-R268 WeakPolarHBondContact O-CB 3.42Å; E264-R268 IonicContact OE1-CZ 3.55Å; E264-R268 IonicContact OE1-NH1 3.39Å; E264-R268 PolarHBondContact OE1-NH1 3.14Å; E264-R268 IonicContact OE1-NH2 2.82Å; E264-R268 PolarHBondContact OE1-NH2 2.86Å
265	G	95	Very high	95.4	Very high	3 Å²	3	48.2 Å²	48.2	3%	0.031	24%	0.238	C	C	.	.	I	π-helix	trans	-82.7	-40.3	-177.1	0	0	0	0	0	113.2	D261 Q269 C361	D261-G265 WeakPolarHBondContact O-CA 3.33Å; D261-G265 PolarHBondContact O-N 2.88Å; G265-Q269 WeakPolarHBondContact O-CG 3.36Å; G265-C361 WeakPolarHBondContact O-CB 3.28Å
266	Y	97.1	Very high	95.4	Very high	1 Å²	1	49.6 Å²	49.6	0%	0.004	25%	0.245	C	C	.	.	I	π-helix	trans	-102	-60.2	-178.6	-65.4	-63.9	0	0	0	112.9	I262 R268 Q269 C270 F358 C361 R362 M367 I372	I262-Y266 HydrophobicContact CG1-CD2 4.5Å; I262-Y266 HydrophobicContact CG2-CD2 4.45Å; I262-Y266 WeakPolarHBondContact O-CA 3.2Å; I262-Y266 WeakPolarHBondContact O-CB 3.37Å; I262-Y266 PolarHBondContact O-N 2.82Å; Y266-R268 PolarHBondContact O-N 3.33Å; Y266-Q269 PolarHBondContact O-N 2.95Å; Y266-Q269 VanDerWaalsContact O-N 3.17Å; Y266-C270 WeakPolarHBondContact O-CB 3.47Å; Y266-C270 PolarHBondContact O-N 3.42Å; Y266-C270 PolarHBondContact O-SG 3.42Å; Y266-F358 AromaticContact CD1-CD1 3.92Å; Y266-F358 HydrophobicContact CD1-CD1 3.92Å; Y266-F358 HydrophobicContact CE1-CB 4.38Å; Y266-F358 HydrophobicContact CE1-CD1 4.12Å; Y266-F358 WeakPolarHBondContact CE1-O 3.43Å; Y266-C361 HydrophobicContact CD1-CB 3.53Å; Y266-C361 HydrophobicContact CE1-CB 3.57Å; Y266-R362 WeakPolarHBondContact OH-CB 3.48Å; Y266-M367 HydrophobicContact CD2-CE 4.46Å; Y266-M367 HydrophobicContact CD2-SD 4.37Å; Y266-M367 HydrophobicContact CE2-CE 3.76Å; Y266-M367 HydrophobicContact CE2-SD 3.65Å; Y266-I372 HydrophobicContact CD1-CD1 3.66Å; Y266-I372 HydrophobicContact CD1-CG1 4.29Å; Y266-I372 HydrophobicContact CD2-CD1 3.99Å; Y266-I372 HydrophobicContact CD2-CG1 3.98Å; Y266-I372 HydrophobicContact CE1-CB 4.23Å; Y266-I372 HydrophobicContact CE1-CD1 3.99Å; Y266-I372 HydrophobicContact CE1-CG1 4.23Å; Y266-I372 HydrophobicContact CE2-CB 4.29Å; Y266-I372 HydrophobicContact CE2-CD1 4.32Å; Y266-I372 HydrophobicContact CE2-CG1 3.94Å; Y266-I372 HydrophobicContact CG-CD1 3.67Å; Y266-I372 HydrophobicContact CG-CG1 4.17Å
267	I	97.2	Very high	95.4	Very high	5 Å²	5	49 Å²	49	3%	0.026	24%	0.242	C	C	.	.	I	π-helix	trans	-61.6	-48.6	-170.5	-61	-179.8	0	0	0	111.1	I262 C263 Q269 C270 R271 F286 I289 E290	I262-I267 PolarHBondContact O-N 2.75Å; C263-I267 WeakPolarHBondContact O-CB 3.28Å; I267-Q269 VanDerWaalsContact C-N 3.28Å; I267-Q269 PolarHBondContact O-N 2.89Å; I267-C270 PolarHBondContact O-N 2.96Å; I267-R271 HydrophobicContact CG2-CG 4.4Å; I267-R271 VanDerWaalsContact CG2-CZ 3.47Å; I267-R271 WeakPolarHBondContact O-CG 3.37Å; I267-R271 PolarHBondContact O-N 2.84Å; I267-F286 HydrophobicContact CD1-CB 3.93Å; I267-F286 HydrophobicContact CD1-CD1 3.8Å; I267-F286 HydrophobicContact CD1-CD2 4.48Å; I267-F286 HydrophobicContact CD1-CE1 4.45Å; I267-F286 HydrophobicContact CD1-CG 3.82Å; I267-F286 HydrophobicContact CG1-CB 4.27Å; I267-F286 HydrophobicContact CG1-CD1 3.48Å; I267-F286 VanDerWaalsContact CG1-CD1 3.48Å; I267-F286 HydrophobicContact CG1-CD2 3.91Å; I267-F286 HydrophobicContact CG1-CE1 3.66Å; I267-F286 HydrophobicContact CG1-CE2 4.07Å; I267-F286 HydrophobicContact CG1-CG 3.61Å; I267-F286 HydrophobicContact CG1-CZ 3.96Å; I267-I289 HydrophobicContact CD1-CG2 3.51Å; I267-E290 HydrophobicContact CD1-CG 3.85Å
268	R	96.3	Very high	95.5	Very high	119 Å²	119	49 Å²	49	45%	0.449	25%	0.249	S	C	.	.	H	α-helix	trans	-56.8	-41	177.8	-170.1	-177.6	-72.3	157.7	-1	111.9	C263 E264 Y266 K272	C263-R268 PolarHBondContact O-N 3.29Å; E264-R268 WeakPolarHBondContact O-CB 3.42Å; E264-R268 IonicContact OE1-CZ 3.55Å; E264-R268 IonicContact OE1-NH1 3.39Å; E264-R268 PolarHBondContact OE1-NH1 3.14Å; E264-R268 IonicContact OE1-NH2 2.82Å; E264-R268 PolarHBondContact OE1-NH2 2.86Å; Y266-R268 PolarHBondContact O-N 3.33Å; R268-K272 WeakPolarHBondContact O-CG 3.03Å; R268-K272 PolarHBondContact O-N 3.44Å
269	Q	96.3	Very high	95.6	Very high	41 Å²	41	53.4 Å²	53.4	19%	0.192	28%	0.277	C	S	.	.	H	α-helix	trans	-73	-41.9	178.8	-60.1	-58.8	-18.2	0	0	112.2	G265 Y266 I267 R271 K272 H273 F357	G265-Q269 WeakPolarHBondContact O-CG 3.36Å; Y266-Q269 PolarHBondContact O-N 2.95Å; Y266-Q269 VanDerWaalsContact O-N 3.17Å; I267-Q269 VanDerWaalsContact C-N 3.28Å; I267-Q269 PolarHBondContact O-N 2.89Å; Q269-R271 VanDerWaalsContact C-N 3.33Å; Q269-R271 PolarHBondContact O-N 3.1Å; Q269-K272 PolarHBondContact O-N 3.17Å; Q269-H273 PolarHBondContact O-N 3.17Å; Q269-H273 PolarHBondContact O-ND1 3.42Å; Q269-F357 HydrophobicContact CB-CZ 3.98Å
270	C	96.8	Very high	95.4	Very high	1 Å²	1	56.6 Å²	56.6	1%	0.007	30%	0.304	C	S	.	.	H	α-helix	trans	-61.1	-41.9	177.9	-65.3	0	0	0	0	111.7	Y266 I267 K272 H273 F277 L282 F286	Y266-C270 WeakPolarHBondContact O-CB 3.47Å; Y266-C270 PolarHBondContact O-N 3.42Å; Y266-C270 PolarHBondContact O-SG 3.42Å; I267-C270 PolarHBondContact O-N 2.96Å; C270-K272 VanDerWaalsContact C-N 3.31Å; C270-K272 PolarHBondContact O-N 2.7Å; C270-H273 PolarHBondContact O-N 2.81Å; C270-H273 VanDerWaalsContact O-N 3.1Å; C270-F277 HydrophobicContact CB-CD2 3.9Å; C270-F277 HydrophobicContact CB-CE2 4.05Å; C270-F277 HydrophobicContact CB-CG 4.3Å; C270-L282 HydrophobicContact CB-CD2 3.54Å; C270-F286 HydrophobicContact CB-CE2 4.38Å
271	R	96.5	Very high	95.4	Very high	131 Å²	131	54 Å²	54	49%	0.494	30%	0.296	S	S	.	.	H	α-helix	trans	-63	-32.8	176.9	-75.6	178	174	150.9	2.4	113.3	I267 Q269 H273 L282 E290	I267-R271 HydrophobicContact CG2-CG 4.4Å; I267-R271 VanDerWaalsContact CG2-CZ 3.47Å; I267-R271 WeakPolarHBondContact O-CG 3.37Å; I267-R271 PolarHBondContact O-N 2.84Å; Q269-R271 VanDerWaalsContact C-N 3.33Å; Q269-R271 PolarHBondContact O-N 3.1Å; R271-H273 VanDerWaalsContact C-N 3.26Å; R271-H273 PolarHBondContact O-N 3.3Å; R271-L282 HydrophobicContact CG-CD1 3.97Å; R271-E290 IonicContact CZ-OE1 3.53Å; R271-E290 IonicContact CZ-OE2 3.47Å; R271-E290 IonicContact NH1-OE1 2.72Å; R271-E290 PolarHBondContact NH1-OE1 3.07Å; R271-E290 IonicContact NH1-OE2 3.39Å; R271-E290 PolarHBondContact NH1-OE2 2.77Å; R271-E290 IonicContact NH2-OE1 3.51Å; R271-E290 IonicContact NH2-OE2 2.67Å; R271-E290 PolarHBondContact NH2-OE2 3.36Å
272	K	95.4	Very high	95.4	Very high	137 Å²	137	55 Å²	55	60%	0.596	30%	0.302	S	S	*	.	H	α-helix	trans	-68.9	-24.4	174.6	-70.6	175.4	179.9	-176	0	112.8	R268 Q269 C270	R268-K272 WeakPolarHBondContact O-CG 3.03Å; R268-K272 PolarHBondContact O-N 3.44Å; Q269-K272 PolarHBondContact O-N 3.17Å; C270-K272 VanDerWaalsContact C-N 3.31Å; C270-K272 PolarHBondContact O-N 2.7Å
273	H	94	Very high	95.4	Very high	77 Å²	77	58 Å²	58	36%	0.356	33%	0.326	S	S	.	.			trans	-105.1	62.2	-173.7	-67.8	60.4	0	0	0	111.3	Q269 C270 R271 G275 M276 F277 F357	Q269-H273 PolarHBondContact O-N 3.17Å; Q269-H273 PolarHBondContact O-ND1 3.42Å; C270-H273 PolarHBondContact O-N 2.81Å; C270-H273 VanDerWaalsContact O-N 3.1Å; R271-H273 VanDerWaalsContact C-N 3.26Å; R271-H273 PolarHBondContact O-N 3.3Å; H273-G275 PolarHBondContact O-N 2.96Å; H273-G275 VanDerWaalsContact O-N 3.14Å; H273-M276 HydrophobicContact CB-CB 4.22Å; H273-M276 HydrophobicContact CB-CG 4.4Å; H273-M276 HydrophobicContact CB-SD 4.43Å; H273-M276 PolarHBondContact O-N 3.46Å; H273-F277 HydrophobicContact CB-CD2 4.38Å; H273-F277 PolarHBondContact O-N 3.37Å; H273-F357 HydrophobicContact CB-CE2 4.32Å; H273-F357 AromaticContact CD2-CE2 3.66Å; H273-F357 AromaticContact CG-CE2 3.73Å; H273-F357 AromaticContact ND1-CE2 3.93Å; H273-F357 AromaticContact NE2-CE2 3.85Å
274	T	91.1	Very high	95.3	Very high	118 Å²	118	59.7 Å²	59.7	72%	0.724	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-24	-177.4	55.7	0	0	0	0	114	M276	T274-M276 VanDerWaalsContact C-N 3.28Å; T274-M276 PolarHBondContact O-N 3.04Å
275	G	92.9	Very high	95.4	Very high	77 Å²	77	57.1 Å²	57.1	79%	0.794	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-14.3	172	0	0	0	0	0	114.6	H273	H273-G275 PolarHBondContact O-N 2.96Å; H273-G275 VanDerWaalsContact O-N 3.14Å
276	M	94.7	Very high	95.5	Very high	39 Å²	39	57.4 Å²	57.4	19%	0.192	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.9	-33.7	177.9	-68.9	-172.8	61.3	0	0	112.9	H273 T274 K353 Y354 F357	H273-M276 HydrophobicContact CB-CB 4.22Å; H273-M276 HydrophobicContact CB-CG 4.4Å; H273-M276 HydrophobicContact CB-SD 4.43Å; H273-M276 PolarHBondContact O-N 3.46Å; T274-M276 VanDerWaalsContact C-N 3.28Å; T274-M276 PolarHBondContact O-N 3.04Å; M276-K353 HydrophobicContact CE-CG 4.41Å; M276-Y354 HydrophobicContact CB-CE1 4.11Å; M276-Y354 HydrophobicContact CE-CD1 3.8Å; M276-Y354 HydrophobicContact CE-CE1 3.93Å; M276-Y354 HydrophobicContact CE-CG 4.47Å; M276-Y354 VanDerWaalsContact O-CE1 3.29Å; M276-Y354 WeakPolarHBondContact O-CE1 3.49Å; M276-Y354 PolarHBondContact O-OH 3.3Å; M276-F357 HydrophobicContact CE-CB 3.8Å; M276-F357 HydrophobicContact CE-CD2 4.06Å; M276-F357 HydrophobicContact CE-CG 3.9Å; M276-F357 HydrophobicContact SD-CD2 4Å; M276-F357 HydrophobicContact SD-CG 4.45Å
277	F	96.3	Very high	95.4	Very high	6 Å²	6	58.8 Å²	58.8	3%	0.026	34%	0.339	C	S	.	.			trans	-129	129.5	-174.3	-55.3	-83	0	0	0	111.5	C270 H273 L282 L348 Y354 F357 F358	C270-F277 HydrophobicContact CB-CD2 3.9Å; C270-F277 HydrophobicContact CB-CE2 4.05Å; C270-F277 HydrophobicContact CB-CG 4.3Å; H273-F277 HydrophobicContact CB-CD2 4.38Å; H273-F277 PolarHBondContact O-N 3.37Å; F277-L282 HydrophobicContact CB-CD1 4.37Å; F277-L282 HydrophobicContact CB-CD2 3.65Å; F277-L282 HydrophobicContact CB-CG 3.97Å; F277-L282 HydrophobicContact CD1-CD2 4.15Å; F277-L282 HydrophobicContact CG-CD2 3.93Å; F277-L348 HydrophobicContact CD1-CD1 4.37Å; F277-L348 HydrophobicContact CE1-CD1 4.13Å; F277-Y354 HydrophobicContact CD1-CE1 4.09Å; F277-Y354 AromaticContact CE1-CD1 3.67Å; F277-Y354 HydrophobicContact CE1-CD1 3.67Å; F277-Y354 AromaticContact CE1-CE1 3.65Å; F277-Y354 HydrophobicContact CE1-CE1 3.65Å; F277-Y354 AromaticContact CZ-CD1 3.74Å; F277-Y354 HydrophobicContact CZ-CD1 3.74Å; F277-Y354 AromaticContact CZ-CE1 3.91Å; F277-Y354 HydrophobicContact CZ-CE1 3.91Å; F277-F357 AromaticContact CE2-CD1 3.89Å; F277-F357 HydrophobicContact CE2-CD1 3.89Å; F277-F357 AromaticContact CE2-CE1 3.5Å; F277-F357 HydrophobicContact CE2-CE1 3.5Å; F277-F357 VanDerWaalsContact CE2-CE1 3.5Å; F277-F357 HydrophobicContact CE2-CE2 4.37Å; F277-F357 HydrophobicContact CE2-CG 4.49Å; F277-F357 AromaticContact CE2-CZ 3.76Å; F277-F357 HydrophobicContact CE2-CZ 3.76Å; F277-F357 AromaticContact CZ-CD1 3.69Å; F277-F357 HydrophobicContact CZ-CD1 3.69Å; F277-F357 AromaticContact CZ-CE1 3.61Å; F277-F357 HydrophobicContact CZ-CE1 3.61Å; F277-F357 HydrophobicContact CZ-CG 4.49Å; F277-F357 HydrophobicContact CZ-CZ 4.34Å; F277-F358 HydrophobicContact CE1-CE1 4.35Å; F277-F358 HydrophobicContact CE1-CE2 4.48Å; F277-F358 AromaticContact CE1-CZ 3.75Å; F277-F358 HydrophobicContact CE1-CZ 3.75Å; F277-F358 HydrophobicContact CZ-CE1 4.14Å; F277-F358 AromaticContact CZ-CZ 3.9Å; F277-F358 HydrophobicContact CZ-CZ 3.9Å
278	T	95.4	Very high	95.4	Very high	75 Å²	75	59 Å²	59	46%	0.46	34%	0.34	S	S	.	.			trans	-81.7	156	168.7	65.5	0	0	0	0	110.8	A280 Q281 L282	T278-A280 PolarHBondContact O-N 3.43Å; T278-Q281 WeakPolarHBondContact O-CB 3.37Å; T278-Q281 PolarHBondContact O-N 3.42Å; T278-Q281 VanDerWaalsContact O-N 3.11Å; T278-Q281 WeakPolarHBondContact OG1-CB 3.29Å; T278-Q281 WeakPolarHBondContact OG1-CG 3.45Å; T278-Q281 PolarHBondContact OG1-N 3.48Å; T278-Q281 PolarHBondContact OG1-OE1 2.71Å; T278-L282 WeakPolarHBondContact O-CG 3.38Å; T278-L282 PolarHBondContact O-N 3.23Å
279	V	94.6	Very high	95.5	Very high	126 Å²	126	53.3 Å²	53.3	76%	0.764	32%	0.319	S	S	*	.	H	α-helix	trans	-56.9	-40.2	176.7	-179.5	0	0	0	0	111.5	Q281 L282 A283	V279-Q281 PolarHBondContact O-N 3.21Å; V279-L282 PolarHBondContact O-N 2.87Å; V279-A283 PolarHBondContact O-N 2.87Å
280	A	93.9	Very high	95.6	Very high	68 Å²	68	54.3 Å²	54.3	56%	0.562	32%	0.323	S	S	*	.	H	α-helix	trans	-64.7	-38.5	177.6	0	0	0	0	0	112.8	T278 A283 T284	T278-A280 PolarHBondContact O-N 3.43Å; A280-A283 PolarHBondContact O-N 2.81Å; A280-T284 WeakPolarHBondContact O-CB 3.44Å; A280-T284 PolarHBondContact O-N 3.23Å; A280-T284 PolarHBondContact O-OG1 2.91Å
281	Q	95.2	Very high	95.7	Very high	40 Å²	40	57.9 Å²	57.9	19%	0.187	34%	0.342	C	S	.	.	H	α-helix	trans	-65.7	-42.2	174.4	-74.1	173	-53.6	0	0	111.5	T278 V279 T284 I285 E344	T278-Q281 WeakPolarHBondContact O-CB 3.37Å; T278-Q281 PolarHBondContact O-N 3.42Å; T278-Q281 VanDerWaalsContact O-N 3.11Å; T278-Q281 WeakPolarHBondContact OG1-CB 3.29Å; T278-Q281 WeakPolarHBondContact OG1-CG 3.45Å; T278-Q281 PolarHBondContact OG1-N 3.48Å; T278-Q281 PolarHBondContact OG1-OE1 2.71Å; V279-Q281 PolarHBondContact O-N 3.21Å; Q281-T284 PolarHBondContact O-N 3.32Å; Q281-I285 WeakPolarHBondContact O-CB 3.43Å; Q281-I285 WeakPolarHBondContact O-CD1 3.36Å; Q281-I285 WeakPolarHBondContact O-CG1 3.37Å; Q281-I285 PolarHBondContact O-N 3.2Å; Q281-E344 WeakPolarHBondContact CG-OE1 3.22Å; Q281-E344 PolarHBondContact NE2-OE1 3.35Å
282	L	96.7	Very high	95.7	Very high	25 Å²	25	51.6 Å²	51.6	13%	0.131	32%	0.319	C	S	.	.	H	α-helix	trans	-63.1	-44	176.9	-62.3	-179	0	0	0	111.8	C270 R271 F277 T278 V279 T284 I285 F286	C270-L282 HydrophobicContact CB-CD2 3.54Å; R271-L282 HydrophobicContact CG-CD1 3.97Å; F277-L282 HydrophobicContact CB-CD1 4.37Å; F277-L282 HydrophobicContact CB-CD2 3.65Å; F277-L282 HydrophobicContact CB-CG 3.97Å; F277-L282 HydrophobicContact CD1-CD2 4.15Å; F277-L282 HydrophobicContact CG-CD2 3.93Å; T278-L282 WeakPolarHBondContact O-CG 3.38Å; T278-L282 PolarHBondContact O-N 3.23Å; V279-L282 PolarHBondContact O-N 2.87Å; L282-T284 VanDerWaalsContact C-N 3.28Å; L282-T284 PolarHBondContact O-N 3.33Å; L282-I285 PolarHBondContact O-N 3.47Å; L282-F286 HydrophobicContact CB-CD2 4.46Å; L282-F286 HydrophobicContact CD2-CD2 4.23Å; L282-F286 HydrophobicContact CD2-CE2 3.88Å; L282-F286 WeakPolarHBondContact O-CD2 3.47Å; L282-F286 PolarHBondContact O-N 2.81Å
283	A	95.6	Very high	95.9	Very high	61 Å²	61	47 Å²	47	50%	0.504	30%	0.298	S	S	.	.	H	α-helix	trans	-60.1	-39.5	174.8	0	0	0	0	0	111.7	V279 A280 G287	V279-A283 PolarHBondContact O-N 2.87Å; A280-A283 PolarHBondContact O-N 2.81Å; A283-G287 VanDerWaalsContact O-CA 3.26Å; A283-G287 WeakPolarHBondContact O-CA 3.38Å; A283-G287 PolarHBondContact O-N 2.8Å
284	T	94.8	Very high	96.1	Very high	49 Å²	49	49.5 Å²	49.5	30%	0.301	31%	0.308	S	S	.	.	H	α-helix	trans	-68.8	-44.9	177.3	-55.1	0	0	0	0	112	A280 Q281 L282 N337 A341 E344	A280-T284 WeakPolarHBondContact O-CB 3.44Å; A280-T284 PolarHBondContact O-N 3.23Å; A280-T284 PolarHBondContact O-OG1 2.91Å; Q281-T284 PolarHBondContact O-N 3.32Å; L282-T284 VanDerWaalsContact C-N 3.28Å; L282-T284 PolarHBondContact O-N 3.33Å; T284-N337 PolarHBondContact O-ND2 3.3Å; T284-A341 WeakPolarHBondContact O-CA 3.31Å; T284-A341 VanDerWaalsContact O-CB 3.31Å; T284-A341 WeakPolarHBondContact O-CB 3.32Å; T284-E344 HydrophobicContact CG2-CB 4.1Å
285	I	96.9	Very high	96.4	Very high	1 Å²	1	45.1 Å²	45.1	1%	0.005	28%	0.279	C	S	.	.	H	α-helix	trans	-71.9	-45	-175.1	-67.5	163.9	0	0	0	111.7	Q281 L282 A341 E344 L345 L348 L376	Q281-I285 WeakPolarHBondContact O-CB 3.43Å; Q281-I285 WeakPolarHBondContact O-CD1 3.36Å; Q281-I285 WeakPolarHBondContact O-CG1 3.37Å; Q281-I285 PolarHBondContact O-N 3.2Å; L282-I285 PolarHBondContact O-N 3.47Å; I285-A341 WeakPolarHBondContact O-CB 3.18Å; I285-E344 HydrophobicContact CD1-CG 4.05Å; I285-E344 HydrophobicContact CG1-CB 4.14Å; I285-E344 HydrophobicContact CG1-CG 3.81Å; I285-L345 HydrophobicContact CD1-CD2 4.31Å; I285-L345 HydrophobicContact CG1-CD2 4.38Å; I285-L345 HydrophobicContact CG1-CG 4.29Å; I285-L345 HydrophobicContact CG2-CD1 4.1Å; I285-L345 HydrophobicContact CG2-CD2 3.86Å; I285-L345 HydrophobicContact CG2-CG 3.95Å; I285-L348 HydrophobicContact CD1-CD1 3.53Å; I285-L376 HydrophobicContact CG2-CD1 4.08Å
286	F	97.6	Very high	96.7	Very high	8 Å²	8	41.4 Å²	41.4	4%	0.035	24%	0.241	C	C	.	.	H	α-helix	trans	-100.4	-19.7	-171.2	-63.2	-70.4	0	0	0	113.6	I262 I267 C270 L282 N288 I289 I372 L376	I262-F286 HydrophobicContact CG2-CD1 4.22Å; I262-F286 HydrophobicContact CG2-CE1 4.18Å; I267-F286 HydrophobicContact CD1-CB 3.93Å; I267-F286 HydrophobicContact CD1-CD1 3.8Å; I267-F286 HydrophobicContact CD1-CD2 4.48Å; I267-F286 HydrophobicContact CD1-CE1 4.45Å; I267-F286 HydrophobicContact CD1-CG 3.82Å; I267-F286 HydrophobicContact CG1-CB 4.27Å; I267-F286 HydrophobicContact CG1-CD1 3.48Å; I267-F286 VanDerWaalsContact CG1-CD1 3.48Å; I267-F286 HydrophobicContact CG1-CD2 3.91Å; I267-F286 HydrophobicContact CG1-CE1 3.66Å; I267-F286 HydrophobicContact CG1-CE2 4.07Å; I267-F286 HydrophobicContact CG1-CG 3.61Å; I267-F286 HydrophobicContact CG1-CZ 3.96Å; C270-F286 HydrophobicContact CB-CE2 4.38Å; L282-F286 HydrophobicContact CB-CD2 4.46Å; L282-F286 HydrophobicContact CD2-CD2 4.23Å; L282-F286 HydrophobicContact CD2-CE2 3.88Å; L282-F286 WeakPolarHBondContact O-CD2 3.47Å; L282-F286 PolarHBondContact O-N 2.81Å; F286-N288 PolarHBondContact O-N 3.23Å; F286-I289 HydrophobicContact CB-CG2 4Å; F286-I289 VanDerWaalsContact O-CB 3.3Å; F286-I289 WeakPolarHBondContact O-CB 3.32Å; F286-I289 VanDerWaalsContact O-CG2 3.29Å; F286-I289 WeakPolarHBondContact O-CG2 3.33Å; F286-I289 PolarHBondContact O-N 2.68Å; F286-I372 HydrophobicContact CE1-CD1 4.16Å; F286-I372 HydrophobicContact CZ-CD1 4.22Å; F286-L376 HydrophobicContact CD1-CD2 3.97Å; F286-L376 HydrophobicContact CE1-CD2 4.37Å
287	G	96	Very high	96.8	Very high	31 Å²	31	45.6 Å²	45.6	32%	0.32	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	53	-136.2	-177.6	0	0	0	0	0	112	A283	A283-G287 VanDerWaalsContact O-CA 3.26Å; A283-G287 WeakPolarHBondContact O-CA 3.38Å; A283-G287 PolarHBondContact O-N 2.8Å
288	N	97	Very high	96.9	Very high	8 Å²	8	51.3 Å²	51.3	4%	0.043	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.4	27	177.3	68.4	-18.7	0	0	0	113.5	F286 E290 D291 I292 I330 E333 Y334	F286-N288 PolarHBondContact O-N 3.23Å; N288-E290 PolarHBondContact O-N 3.34Å; N288-D291 WeakPolarHBondContact O-CB 3.45Å; N288-D291 PolarHBondContact O-N 3.35Å; N288-I292 PolarHBondContact O-N 2.8Å; N288-I292 VanDerWaalsContact O-N 3.12Å; N288-I330 PolarHBondContact ND2-O 3.19Å; N288-E333 PolarHBondContact ND2-OE2 2.98Å; N288-Y334 WeakPolarHBondContact OD1-CB 3.35Å
289	I	98.1	Very high	97	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-61.1	-29.7	-175.9	-160.9	171.3	0	0	0	113.9	L259 I262 I267 F286 D291 I292 Y293 Y334 L376 P379	L259-I289 HydrophobicContact CD2-CD1 4.14Å; L259-I289 HydrophobicContact CD2-CG1 3.9Å; I262-I289 HydrophobicContact CB-CD1 4.35Å; I262-I289 HydrophobicContact CD1-CD1 3.74Å; I262-I289 HydrophobicContact CG2-CD1 3.85Å; I267-I289 HydrophobicContact CD1-CG2 3.51Å; F286-I289 HydrophobicContact CB-CG2 4Å; F286-I289 VanDerWaalsContact O-CB 3.3Å; F286-I289 WeakPolarHBondContact O-CB 3.32Å; F286-I289 VanDerWaalsContact O-CG2 3.29Å; F286-I289 WeakPolarHBondContact O-CG2 3.33Å; F286-I289 PolarHBondContact O-N 2.68Å; I289-D291 VanDerWaalsContact C-N 3.27Å; I289-D291 PolarHBondContact O-N 3.02Å; I289-I292 PolarHBondContact O-N 2.87Å; I289-Y293 PolarHBondContact O-N 2.79Å; I289-Y334 HydrophobicContact CB-CD2 4.36Å; I289-Y334 HydrophobicContact CB-CE2 3.78Å; I289-Y334 HydrophobicContact CD1-CE2 4.21Å; I289-Y334 HydrophobicContact CG1-CE2 4.09Å; I289-L376 HydrophobicContact CD1-CD2 3.88Å; I289-P379 HydrophobicContact CD1-CG 4.43Å
290	E	98.2	Very high	97.2	Very high	62 Å²	62	42.6 Å²	42.6	29%	0.29	23%	0.226	S	C	.	.	H	α-helix	trans	-65.7	-32.5	174.5	-70.9	-176.8	124.5	0	0	111.7	I267 R271 N288 Y293 K294	I267-E290 HydrophobicContact CD1-CG 3.85Å; R271-E290 IonicContact CZ-OE1 3.53Å; R271-E290 IonicContact CZ-OE2 3.47Å; R271-E290 IonicContact NH1-OE1 2.72Å; R271-E290 PolarHBondContact NH1-OE1 3.07Å; R271-E290 IonicContact NH1-OE2 3.39Å; R271-E290 PolarHBondContact NH1-OE2 2.77Å; R271-E290 IonicContact NH2-OE1 3.51Å; R271-E290 IonicContact NH2-OE2 2.67Å; R271-E290 PolarHBondContact NH2-OE2 3.36Å; N288-E290 PolarHBondContact O-N 3.34Å; E290-Y293 PolarHBondContact O-N 2.84Å; E290-K294 VanDerWaalsContact O-CG 3.31Å; E290-K294 WeakPolarHBondContact O-CG 3.45Å; E290-K294 PolarHBondContact O-N 3.28Å
291	D	98.2	Very high	97.3	Very high	76 Å²	76	45.8 Å²	45.8	41%	0.406	23%	0.227	S	C	.	.	H	α-helix	trans	-75.9	-37.4	176.6	-60.1	-36.6	0	0	0	111.1	N288 I289 Y293 K294 F295	N288-D291 WeakPolarHBondContact O-CB 3.45Å; N288-D291 PolarHBondContact O-N 3.35Å; I289-D291 VanDerWaalsContact C-N 3.27Å; I289-D291 PolarHBondContact O-N 3.02Å; D291-Y293 VanDerWaalsContact C-N 3.3Å; D291-Y293 PolarHBondContact O-N 2.81Å; D291-K294 PolarHBondContact O-N 2.62Å; D291-K294 IonicContact OD1-NZ 2.8Å; D291-K294 PolarHBondContact OD1-NZ 3.09Å; D291-F295 WeakPolarHBondContact O-CB 3.5Å; D291-F295 PolarHBondContact O-N 2.64Å
292	I	98.3	Very high	97.4	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-56.9	-46.3	167.8	-68.1	174.6	0	0	0	110.4	Y255 L259 N288 I289 K294 F295 Q296 I330 Y331 Y334 P379	Y255-I292 WeakPolarHBondContact OH-CG2 3.38Å; L259-I292 HydrophobicContact CD1-CG2 3.97Å; L259-I292 HydrophobicContact CD2-CG2 4.19Å; N288-I292 PolarHBondContact O-N 2.8Å; N288-I292 VanDerWaalsContact O-N 3.12Å; I289-I292 PolarHBondContact O-N 2.87Å; I292-K294 PolarHBondContact O-N 3.14Å; I292-F295 PolarHBondContact O-N 2.85Å; I292-Q296 VanDerWaalsContact O-CB 3.29Å; I292-Q296 WeakPolarHBondContact O-CB 3.33Å; I292-Q296 PolarHBondContact O-N 3.44Å; I292-I330 HydrophobicContact CB-CD1 4.48Å; I292-I330 HydrophobicContact CG1-CD1 3.94Å; I292-I330 HydrophobicContact CG1-CG1 3.97Å; I292-Y331 HydrophobicContact CD1-CD1 4.24Å; I292-Y331 HydrophobicContact CD1-CE1 4.35Å; I292-Y331 HydrophobicContact CD1-CG 4.45Å; I292-Y331 HydrophobicContact CG2-CE1 4.13Å; I292-Y331 HydrophobicContact CG2-CE2 4.18Å; I292-Y334 HydrophobicContact CD1-CD1 4.28Å; I292-Y334 HydrophobicContact CD1-CD2 3.79Å; I292-Y334 HydrophobicContact CD1-CG 3.59Å; I292-P379 HydrophobicContact CD1-CB 4.17Å
293	Y	98.4	Very high	97.5	Very high	39 Å²	39	44.6 Å²	44.6	15%	0.153	22%	0.222	C	C	.	.	H	α-helix	trans	-61.5	-45	178.5	179	-132	0	0	0	112.8	I256 L259 R260 C263 I289 E290 D291 Q296 R297	I256-Y293 HydrophobicContact CG2-CE2 4Å; L259-Y293 HydrophobicContact CB-CD2 3.55Å; L259-Y293 HydrophobicContact CB-CE2 4.34Å; L259-Y293 HydrophobicContact CB-CG 4.1Å; L259-Y293 HydrophobicContact CD1-CD2 4.38Å; R260-Y293 HydrophobicContact CB-CE1 4.49Å; R260-Y293 HydrophobicContact CB-CE2 3.77Å; R260-Y293 WeakPolarHBondContact CB-OH 3.4Å; R260-Y293 WeakPolarHBondContact CG-OH 3.47Å; C263-Y293 HydrophobicContact CB-CD1 4.36Å; I289-Y293 PolarHBondContact O-N 2.79Å; E290-Y293 PolarHBondContact O-N 2.84Å; D291-Y293 VanDerWaalsContact C-N 3.3Å; D291-Y293 PolarHBondContact O-N 2.81Å; Y293-Q296 PolarHBondContact O-N 2.79Å; Y293-R297 HydrophobicContact CD2-CG 4.03Å; Y293-R297 HydrophobicContact CE2-CG 3.66Å; Y293-R297 WeakPolarHBondContact O-CG 3.34Å; Y293-R297 PolarHBondContact O-N 3.19Å
294	K	98.2	Very high	97.5	Very high	131 Å²	131	45.7 Å²	45.7	57%	0.57	22%	0.217	S	C	*	.	H	α-helix	trans	-59.6	-47.6	175.6	-69.8	168.5	-159.6	157.9	0	111.7	E290 D291 I292 K298	E290-K294 VanDerWaalsContact O-CG 3.31Å; E290-K294 WeakPolarHBondContact O-CG 3.45Å; E290-K294 PolarHBondContact O-N 3.28Å; D291-K294 PolarHBondContact O-N 2.62Å; D291-K294 IonicContact OD1-NZ 2.8Å; D291-K294 PolarHBondContact OD1-NZ 3.09Å; I292-K294 PolarHBondContact O-N 3.14Å; K294-K298 PolarHBondContact O-N 2.9Å
295	F	98.3	Very high	97.6	Very high	25 Å²	25	51.5 Å²	51.5	11%	0.11	24%	0.238	C	C	.	.	H	α-helix	trans	-59.7	-49.5	177	166.8	-104.3	0	0	0	111.3	D291 I292 R297 K298 F299 N324 F328 I330 Y331	D291-F295 WeakPolarHBondContact O-CB 3.5Å; D291-F295 PolarHBondContact O-N 2.64Å; I292-F295 PolarHBondContact O-N 2.85Å; F295-R297 VanDerWaalsContact C-N 3.33Å; F295-R297 PolarHBondContact O-N 3.32Å; F295-K298 WeakPolarHBondContact O-CB 3.29Å; F295-K298 PolarHBondContact O-N 3.44Å; F295-F299 HydrophobicContact CZ-CB 4.44Å; F295-F299 PolarHBondContact O-N 3.38Å; F295-N324 HydrophobicContact CE2-CB 4Å; F295-N324 HydrophobicContact CZ-CB 4.14Å; F295-F328 AromaticContact CE1-CD1 3.62Å; F295-F328 HydrophobicContact CE1-CD1 3.62Å; F295-F328 AromaticContact CE1-CE1 3.63Å; F295-F328 HydrophobicContact CE1-CE1 3.63Å; F295-F328 HydrophobicContact CE1-CG 4.15Å; F295-F328 HydrophobicContact CE1-CZ 4.16Å; F295-F328 AromaticContact CZ-CD1 3.86Å; F295-F328 HydrophobicContact CZ-CD1 3.86Å; F295-F328 HydrophobicContact CZ-CD2 4.04Å; F295-F328 AromaticContact CZ-CE1 3.84Å; F295-F328 HydrophobicContact CZ-CE1 3.84Å; F295-F328 HydrophobicContact CZ-CE2 4.02Å; F295-F328 AromaticContact CZ-CG 3.96Å; F295-F328 HydrophobicContact CZ-CG 3.96Å; F295-F328 AromaticContact CZ-CZ 3.92Å; F295-F328 HydrophobicContact CZ-CZ 3.92Å; F295-I330 HydrophobicContact CB-CD1 3.69Å; F295-I330 HydrophobicContact CD1-CD1 4.18Å; F295-I330 HydrophobicContact CG-CD1 4Å; F295-Y331 HydrophobicContact CD1-CE2 4.22Å; F295-Y331 HydrophobicContact CE1-CE2 4.18Å
296	Q	98	Very high	97.6	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-64.6	-37.3	-175.1	-152.1	66.4	35	0	0	112.3	E252 Y255 I256 L259 I292 Y293 K298 F299 L300 Y331 Y386	E252-Q296 VanDerWaalsContact CD-NE2 3.3Å; E252-Q296 VanDerWaalsContact OE1-CD 3.31Å; E252-Q296 VanDerWaalsContact OE1-CG 3.29Å; E252-Q296 WeakPolarHBondContact OE1-CG 3.04Å; E252-Q296 PolarHBondContact OE1-NE2 2.75Å; Y255-Q296 HydrophobicContact CD1-CG 3.76Å; Y255-Q296 HydrophobicContact CE1-CG 3.63Å; I256-Q296 HydrophobicContact CD1-CB 4.35Å; I256-Q296 HydrophobicContact CD1-CG 3.87Å; I256-Q296 WeakPolarHBondContact CD1-O 3.36Å; I256-Q296 HydrophobicContact CG1-CB 3.95Å; I256-Q296 HydrophobicContact CG1-CG 3.51Å; L259-Q296 HydrophobicContact CD1-CB 3.86Å; L259-Q296 HydrophobicContact CD1-CG 4.14Å; I292-Q296 VanDerWaalsContact O-CB 3.29Å; I292-Q296 WeakPolarHBondContact O-CB 3.33Å; I292-Q296 PolarHBondContact O-N 3.44Å; Y293-Q296 PolarHBondContact O-N 2.79Å; Q296-K298 VanDerWaalsContact C-N 3.29Å; Q296-K298 PolarHBondContact O-N 3.17Å; Q296-F299 PolarHBondContact O-N 3.43Å; Q296-L300 PolarHBondContact O-N 3.42Å; Q296-Y331 PolarHBondContact OE1-OH 3.41Å; Q296-Y386 PolarHBondContact NE2-OH 3.48Å
297	R	97.9	Very high	97.5	Very high	126 Å²	126	56.5 Å²	56.5	48%	0.475	26%	0.259	S	S	.	.	H	α-helix	trans	-59.4	-39.4	172.6	-75.4	-178.9	73.4	-164.7	3.6	112.6	I256 Y293 F295 K301	I256-R297 HydrophobicContact CG2-CG 4.27Å; Y293-R297 HydrophobicContact CD2-CG 4.03Å; Y293-R297 HydrophobicContact CE2-CG 3.66Å; Y293-R297 WeakPolarHBondContact O-CG 3.34Å; Y293-R297 PolarHBondContact O-N 3.19Å; F295-R297 VanDerWaalsContact C-N 3.33Å; F295-R297 PolarHBondContact O-N 3.32Å; R297-K301 WeakPolarHBondContact O-CG 3.47Å; R297-K301 PolarHBondContact O-N 3.07Å
298	K	97.6	Very high	97.5	Very high	126 Å²	126	57.5 Å²	57.5	55%	0.548	26%	0.257	S	S	.	.	H	α-helix	trans	-67.5	-47.6	175.2	-175.1	-170	172.6	-163.5	0	110.1	K294 F295 Q296 L300 K301 D302	K294-K298 PolarHBondContact O-N 2.9Å; F295-K298 WeakPolarHBondContact O-CB 3.29Å; F295-K298 PolarHBondContact O-N 3.44Å; Q296-K298 VanDerWaalsContact C-N 3.29Å; Q296-K298 PolarHBondContact O-N 3.17Å; K298-L300 PolarHBondContact O-N 3.14Å; K298-K301 WeakPolarHBondContact O-CB 3.28Å; K298-K301 PolarHBondContact O-N 2.93Å; K298-K301 VanDerWaalsContact O-N 3.12Å; K298-D302 PolarHBondContact O-N 3.18Å; K298-D302 VanDerWaalsContact O-N 3.08Å
299	F	98.1	Very high	97.4	Very high	0 Å²	0	65.6 Å²	65.6	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-59.3	-43.2	-180	179.5	-110.3	0	0	0	113.3	F295 Q296 K301 D302 L303 C320 F321 N324 F328 Y386	F295-F299 HydrophobicContact CZ-CB 4.44Å; F295-F299 PolarHBondContact O-N 3.38Å; Q296-F299 PolarHBondContact O-N 3.43Å; F299-K301 VanDerWaalsContact C-N 3.34Å; F299-K301 PolarHBondContact O-N 2.86Å; F299-D302 PolarHBondContact O-N 2.85Å; F299-L303 HydrophobicContact CD1-CD1 3.88Å; F299-L303 HydrophobicContact CE1-CD1 3.39Å; F299-L303 HydrophobicContact CE1-CG 4.13Å; F299-L303 HydrophobicContact CE2-CD1 4.48Å; F299-L303 HydrophobicContact CE2-CG 4.37Å; F299-L303 HydrophobicContact CZ-CD1 3.73Å; F299-L303 HydrophobicContact CZ-CD2 4.25Å; F299-L303 HydrophobicContact CZ-CG 4.03Å; F299-L303 PolarHBondContact O-N 3.46Å; F299-C320 HydrophobicContact CE2-CB 4.22Å; F299-F321 HydrophobicContact CE1-CE1 4.35Å; F299-F321 HydrophobicContact CE1-CZ 4.39Å; F299-F321 HydrophobicContact CE2-CD1 4.31Å; F299-F321 HydrophobicContact CE2-CG 4.36Å; F299-F321 AromaticContact CZ-CD1 3.84Å; F299-F321 HydrophobicContact CZ-CD1 3.84Å; F299-F321 HydrophobicContact CZ-CD2 4.23Å; F299-F321 AromaticContact CZ-CE1 3.62Å; F299-F321 HydrophobicContact CZ-CE1 3.62Å; F299-F321 HydrophobicContact CZ-CE2 4.01Å; F299-F321 HydrophobicContact CZ-CG 4.15Å; F299-F321 AromaticContact CZ-CZ 3.72Å; F299-F321 HydrophobicContact CZ-CZ 3.72Å; F299-N324 HydrophobicContact CD2-CB 3.94Å; F299-N324 HydrophobicContact CE2-CB 4.44Å; F299-F328 HydrophobicContact CD2-CZ 4.18Å; F299-F328 HydrophobicContact CE1-CZ 4.2Å; F299-F328 HydrophobicContact CE2-CE2 4.38Å; F299-F328 AromaticContact CE2-CZ 3.9Å; F299-F328 HydrophobicContact CE2-CZ 3.9Å; F299-F328 HydrophobicContact CG-CZ 4.47Å; F299-F328 AromaticContact CZ-CZ 3.89Å; F299-F328 HydrophobicContact CZ-CZ 3.89Å; F299-Y386 HydrophobicContact CE1-CE1 4.39Å
300	L	97.5	Very high	97.1	Very high	19 Å²	19	74 Å²	74	10%	0.099	33%	0.331	C	S	.	.	H	α-helix	trans	-63.4	-39.1	174.8	174.3	68.3	0	0	0	112.1	M249 E252 R253 I256 Q296 K298 D302 L303 E304	M249-L300 HydrophobicContact CE-CD1 4.28Å; E252-L300 HydrophobicContact CB-CD1 4.11Å; E252-L300 HydrophobicContact CG-CB 4.26Å; E252-L300 HydrophobicContact CG-CD1 3.8Å; R253-L300 HydrophobicContact CG-CD1 4.13Å; R253-L300 HydrophobicContact CG-CD2 4.09Å; I256-L300 HydrophobicContact CD1-CB 3.19Å; I256-L300 HydrophobicContact CD1-CD2 3.41Å; I256-L300 VanDerWaalsContact CD1-CD2 3.41Å; I256-L300 HydrophobicContact CD1-CG 3.83Å; Q296-L300 PolarHBondContact O-N 3.42Å; K298-L300 PolarHBondContact O-N 3.14Å; L300-D302 VanDerWaalsContact C-N 3.27Å; L300-D302 PolarHBondContact O-N 3.29Å; L300-L303 PolarHBondContact O-N 3.36Å; L300-E304 HydrophobicContact CD1-CG 3.85Å; L300-E304 HydrophobicContact CG-CG 4.11Å; L300-E304 WeakPolarHBondContact O-CB 3.43Å; L300-E304 WeakPolarHBondContact O-CG 3.26Å; L300-E304 PolarHBondContact O-N 3.06Å
301	K	97.2	Very high	96.9	Very high	134 Å²	134	75.4 Å²	75.4	58%	0.583	34%	0.338	S	S	*	.	H	α-helix	trans	-60.5	-39.9	175.3	-73.8	177.4	176.9	-170.2	0	111.6	R297 K298 F299 K305	R297-K301 WeakPolarHBondContact O-CG 3.47Å; R297-K301 PolarHBondContact O-N 3.07Å; K298-K301 WeakPolarHBondContact O-CB 3.28Å; K298-K301 PolarHBondContact O-N 2.93Å; K298-K301 VanDerWaalsContact O-N 3.12Å; F299-K301 VanDerWaalsContact C-N 3.34Å; F299-K301 PolarHBondContact O-N 2.86Å; K301-K305 WeakPolarHBondContact O-CB 3.47Å; K301-K305 PolarHBondContact O-N 3.24Å; K301-K305 VanDerWaalsContact O-N 3.09Å
302	D	97.2	Very high	96.7	Very high	41 Å²	41	72 Å²	72	22%	0.219	32%	0.32	C	S	.	.	H	α-helix	trans	-65.3	-42.3	176.3	-64.2	-21.2	0	0	0	111	K298 F299 L300 K305 Q306 C320 N324	K298-D302 PolarHBondContact O-N 3.18Å; K298-D302 VanDerWaalsContact O-N 3.08Å; F299-D302 PolarHBondContact O-N 2.85Å; L300-D302 VanDerWaalsContact C-N 3.27Å; L300-D302 PolarHBondContact O-N 3.29Å; D302-K305 PolarHBondContact O-N 3.01Å; D302-Q306 PolarHBondContact O-N 2.84Å; D302-C320 PolarHBondContact O-SG 3.49Å; D302-C320 VanDerWaalsContact O-SG 3.39Å; D302-N324 PolarHBondContact OD2-ND2 3.03Å
303	L	97.6	Very high	96.5	Very high	0 Å²	0	73.4 Å²	73.4	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-63.5	-46.1	174.9	-75.3	173.5	0	0	0	112.6	M249 E252 F299 L300 K305 Q306 Y307 I317 C320 F321	M249-L303 HydrophobicContact CE-CB 4.02Å; M249-L303 HydrophobicContact SD-CB 3.95Å; E252-L303 HydrophobicContact CG-CD1 3.95Å; F299-L303 HydrophobicContact CD1-CD1 3.88Å; F299-L303 HydrophobicContact CE1-CD1 3.39Å; F299-L303 HydrophobicContact CE1-CG 4.13Å; F299-L303 HydrophobicContact CE2-CD1 4.48Å; F299-L303 HydrophobicContact CE2-CG 4.37Å; F299-L303 HydrophobicContact CZ-CD1 3.73Å; F299-L303 HydrophobicContact CZ-CD2 4.25Å; F299-L303 HydrophobicContact CZ-CG 4.03Å; F299-L303 PolarHBondContact O-N 3.46Å; L300-L303 PolarHBondContact O-N 3.36Å; L303-K305 PolarHBondContact O-N 3.23Å; L303-Q306 PolarHBondContact O-N 3.05Å; L303-Q306 VanDerWaalsContact O-N 3.08Å; L303-Y307 PolarHBondContact O-N 2.96Å; L303-I317 HydrophobicContact CD2-CB 3.78Å; L303-I317 HydrophobicContact CD2-CD1 4.5Å; L303-I317 HydrophobicContact CD2-CG2 4.05Å; L303-C320 HydrophobicContact CD2-CB 3.83Å; L303-C320 HydrophobicContact CG-CB 4.34Å; L303-F321 HydrophobicContact CD2-CE2 4.27Å
304	E	96.9	Very high	96.4	Very high	84 Å²	84	75 Å²	75	39%	0.393	34%	0.338	S	S	.	.	H	α-helix	trans	-64.6	-28.5	180	-74.2	-177.2	149.3	0	0	112.2	M249 R253 L300	M249-E304 HydrophobicContact CE-CB 4.31Å; M249-E304 HydrophobicContact CE-CG 3.52Å; R253-E304 IonicContact CZ-OE1 3.02Å; R253-E304 IonicContact NE-OE1 3.77Å; R253-E304 PolarHBondContact NE-OE1 3.27Å; R253-E304 IonicContact NH2-OE1 3.77Å; R253-E304 PolarHBondContact NH2-OE1 2.79Å; L300-E304 HydrophobicContact CD1-CG 3.85Å; L300-E304 HydrophobicContact CG-CG 4.11Å; L300-E304 WeakPolarHBondContact O-CB 3.43Å; L300-E304 WeakPolarHBondContact O-CG 3.26Å; L300-E304 PolarHBondContact O-N 3.06Å
305	K	96.6	Very high	96.4	Very high	171 Å²	171	68.8 Å²	68.8	74%	0.743	31%	0.311	S	S	*	.	H	α-helix	trans	-69.2	-33.5	173.1	-173.3	-179.7	177	-174.8	0	112.8	K301 D302 L303	K301-K305 WeakPolarHBondContact O-CB 3.47Å; K301-K305 PolarHBondContact O-N 3.24Å; K301-K305 VanDerWaalsContact O-N 3.09Å; D302-K305 PolarHBondContact O-N 3.01Å; L303-K305 PolarHBondContact O-N 3.23Å
306	Q	96.3	Very high	96.3	Very high	70 Å²	70	71.4 Å²	71.4	33%	0.327	32%	0.323	S	S	.	.	H	α-helix	trans	-89.4	-6.3	177.8	-61.5	-59.1	-12.9	0	0	113.7	D302 L303 N308 I317 C320	D302-Q306 PolarHBondContact O-N 2.84Å; L303-Q306 PolarHBondContact O-N 3.05Å; L303-Q306 VanDerWaalsContact O-N 3.08Å; Q306-N308 PolarHBondContact O-N 3.06Å; Q306-I317 HydrophobicContact CB-CG2 4.29Å; Q306-C320 WeakPolarHBondContact CG-SG 3.26Å
307	Y	96.7	Very high	96.3	Very high	43 Å²	43	71.4 Å²	71.4	17%	0.169	32%	0.323	C	S	.	.			trans	-78.9	113.5	-178.4	179.9	-110.7	0	0	0	111.5	I245 M249 L303 K309 P312	I245-Y307 HydrophobicContact CG2-CD2 3.83Å; I245-Y307 HydrophobicContact CG2-CE2 3.75Å; M249-Y307 HydrophobicContact CE-CG 4.34Å; M249-Y307 HydrophobicContact CG-CD2 3.77Å; M249-Y307 HydrophobicContact CG-CE2 4.09Å; M249-Y307 HydrophobicContact CG-CG 4.29Å; M249-Y307 HydrophobicContact SD-CD2 4.42Å; L303-Y307 PolarHBondContact O-N 2.96Å; Y307-K309 HydrophobicContact CD1-CG 3.94Å; Y307-K309 HydrophobicContact CE1-CB 4.48Å; Y307-K309 HydrophobicContact CE1-CG 3.9Å; Y307-K309 PolarHBondContact O-N 3.44Å; Y307-P312 HydrophobicContact CE2-CB 4.03Å; Y307-P312 HydrophobicContact CE2-CG 4.47Å
308	N	95.8	Very high	96.3	Very high	52 Å²	52	65.4 Å²	65.4	28%	0.278	30%	0.3	S	S	.	.			trans	-79.6	114	172.4	-174.5	-23.2	0	0	0	109.5	Q306 E310 E311 P312 S315	Q306-N308 PolarHBondContact O-N 3.06Å; N308-E310 PolarHBondContact OD1-N 2.93Å; N308-E311 WeakPolarHBondContact CB-O 3.03Å; N308-E311 PolarHBondContact OD1-N 3.3Å; N308-P312 VanDerWaalsContact O-CA 3.23Å; N308-P312 WeakPolarHBondContact O-CA 2.85Å; N308-S315 PolarHBondContact N-OG 3.32Å
309	K	93.3	Very high	96.3	Very high	178 Å²	178	60.4 Å²	60.4	77%	0.774	28%	0.281	S	S	*	.	S	Bend	trans	-72.9	-33.8	-178.2	-67.4	-178.2	-179.7	177.9	0	113	Y307	Y307-K309 HydrophobicContact CD1-CG 3.94Å; Y307-K309 HydrophobicContact CE1-CB 4.48Å; Y307-K309 HydrophobicContact CE1-CG 3.9Å; Y307-K309 PolarHBondContact O-N 3.44Å
310	E	93.6	Very high	96.3	Very high	176 Å²	176	60.4 Å²	60.4	82%	0.822	28%	0.282	S	S	*	.	S	Bend	trans	-79.2	-45.4	-176.6	-62.2	-178.6	178.9	0	0	110.2	N308 P312	N308-E310 PolarHBondContact OD1-N 2.93Å; E310-P312 WeakPolarHBondContact O-CD 3.27Å
311	E	93.3	Very high	96.3	Very high	93 Å²	93	59.6 Å²	59.6	44%	0.435	28%	0.277	S	S	.	.			trans	-127.8	79.4	-178.9	-64.6	-174.1	111.7	0	0	110.7	N308 H313 L314	N308-E311 WeakPolarHBondContact CB-O 3.03Å; N308-E311 PolarHBondContact OD1-N 3.3Å; E311-H313 PolarHBondContact O-N 2.96Å; E311-H313 VanDerWaalsContact O-N 3.07Å; E311-H313 IonicContact OE1-CE1 3.92Å; E311-L314 HydrophobicContact CB-CB 4.39Å; E311-L314 HydrophobicContact CB-CD1 3.85Å; E311-L314 HydrophobicContact CB-CG 4Å; E311-L314 HydrophobicContact CG-CD1 4.44Å; E311-L314 WeakPolarHBondContact O-CB 3.41Å; E311-L314 PolarHBondContact O-N 3.03Å; E311-L314 WeakPolarHBondContact OE2-CD1 3.28Å
312	P	94.8	Very high	96.3	Very high	5 Å²	5	55.8 Å²	55.8	3%	0.032	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-56.8	-30.2	-174.4	-28.3	35.6	0	0	0	114.7	T242 Y307 N308 E310 L314 S315	T242-P312 HydrophobicContact CG2-CB 3.89Å; T242-P312 HydrophobicContact CG2-CG 4.13Å; Y307-P312 HydrophobicContact CE2-CB 4.03Å; Y307-P312 HydrophobicContact CE2-CG 4.47Å; N308-P312 VanDerWaalsContact O-CA 3.23Å; N308-P312 WeakPolarHBondContact O-CA 2.85Å; E310-P312 WeakPolarHBondContact O-CD 3.27Å; P312-L314 PolarHBondContact O-N 3.19Å; P312-S315 VanDerWaalsContact O-CB 3.31Å; P312-S315 WeakPolarHBondContact O-CB 3.48Å; P312-S315 PolarHBondContact O-N 2.94Å; P312-S315 VanDerWaalsContact O-N 3.13Å; P312-S315 PolarHBondContact O-OG 2.98Å
313	H	94	Very high	96.2	Very high	28 Å²	28	60.5 Å²	60.5	13%	0.13	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-64.1	-20.3	175.8	64	-82.4	0	0	0	113.7	Q238 R241 T242 E311 S315 H401	Q238-H313 HydrophobicContact CB-CB 4.37Å; Q238-H313 WeakPolarHBondContact O-CB 3.47Å; R241-H313 HydrophobicContact CB-CB 4.36Å; R241-H313 WeakPolarHBondContact CD-O 3.41Å; R241-H313 HydrophobicContact CG-CB 4.33Å; R241-H313 PolarHBondContact NE-O 2.82Å; T242-H313 WeakPolarHBondContact OG1-CB 3.35Å; T242-H313 PolarHBondContact OG1-N 3.1Å; E311-H313 PolarHBondContact O-N 2.96Å; E311-H313 VanDerWaalsContact O-N 3.07Å; E311-H313 IonicContact OE1-CE1 3.92Å; H313-S315 VanDerWaalsContact C-N 3.34Å; H313-H401 PolarHBondContact O-NE2 2.89Å; H313-H401 VanDerWaalsContact O-NE2 3.16Å
314	L	96.3	Very high	96.1	Very high	73 Å²	73	60.9 Å²	60.9	38%	0.382	29%	0.286	S	S	.	.	G	3₁₀ helix	trans	-87.4	-0	175.7	-60.2	-177.5	0	0	0	113.4	E311 P312 E316	E311-L314 HydrophobicContact CB-CB 4.39Å; E311-L314 HydrophobicContact CB-CD1 3.85Å; E311-L314 HydrophobicContact CB-CG 4Å; E311-L314 HydrophobicContact CG-CD1 4.44Å; E311-L314 WeakPolarHBondContact O-CB 3.41Å; E311-L314 PolarHBondContact O-N 3.03Å; E311-L314 WeakPolarHBondContact OE2-CD1 3.28Å; P312-L314 PolarHBondContact O-N 3.19Å; L314-E316 PolarHBondContact O-N 2.93Å
315	S	97.4	Very high	95.9	Very high	1 Å²	1	60.8 Å²	60.8	1%	0.007	29%	0.285	C	S	.	.			trans	-63.8	134.1	179.9	-52.9	0	0	0	0	111.5	R241 N308 P312 H313	R241-S315 PolarHBondContact NH2-O 3.45Å; N308-S315 PolarHBondContact N-OG 3.32Å; P312-S315 VanDerWaalsContact O-CB 3.31Å; P312-S315 WeakPolarHBondContact O-CB 3.48Å; P312-S315 PolarHBondContact O-N 2.94Å; P312-S315 VanDerWaalsContact O-N 3.13Å; P312-S315 PolarHBondContact O-OG 2.98Å; H313-S315 VanDerWaalsContact C-N 3.34Å
316	E	97.3	Very high	95.6	Very high	79 Å²	79	61.1 Å²	61.1	37%	0.369	29%	0.289	S	S	.	.			trans	-108.6	65.8	-176.4	-56.5	-157.7	144.1	0	0	112.6	L314 S319 G402 D403	L314-E316 PolarHBondContact O-N 2.93Å; E316-S319 PolarHBondContact O-OG 2.95Å; E316-G402 WeakPolarHBondContact OE1-CA 3.33Å; E316-D403 VanDerWaalsContact CA-CG 3.42Å; E316-D403 WeakPolarHBondContact CA-OD2 3.42Å; E316-D403 HydrophobicContact CB-CB 4Å; E316-D403 HydrophobicContact CG-CB 4.04Å; E316-D403 PolarHBondContact OE1-N 3.47Å
317	I	97.7	Very high	95.5	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	29%	0.286	C	S	.	.			trans	-83.8	-12.2	-171.1	65.7	166.3	0	0	0	113.9	I245 I248 L303 Q306 S319 C320 F321 L393 D403	I245-I317 HydrophobicContact CD1-CD1 3.53Å; I245-I317 HydrophobicContact CD1-CG1 3.82Å; I248-I317 HydrophobicContact CD1-CD1 3.94Å; I248-I317 HydrophobicContact CG2-CD1 4.07Å; L303-I317 HydrophobicContact CD2-CB 3.78Å; L303-I317 HydrophobicContact CD2-CD1 4.5Å; L303-I317 HydrophobicContact CD2-CG2 4.05Å; Q306-I317 HydrophobicContact CB-CG2 4.29Å; I317-S319 PolarHBondContact O-N 3.37Å; I317-C320 WeakPolarHBondContact O-CB 3.38Å; I317-C320 PolarHBondContact O-N 3.42Å; I317-C320 VanDerWaalsContact O-N 3.11Å; I317-F321 HydrophobicContact CD1-CE2 4.48Å; I317-L393 HydrophobicContact CD1-CD2 3.95Å; I317-L393 HydrophobicContact CG1-CD2 4.06Å; I317-D403 PolarHBondContact N-OD2 3.15Å
318	G	97.5	Very high	95.4	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-58.5	-38.2	-179	0	0	0	0	0	112.5	C320 F321 L322 D403	G318-C320 VanDerWaalsContact C-N 3.29Å; G318-C320 PolarHBondContact O-N 3.26Å; G318-F321 PolarHBondContact O-N 3.38Å; G318-L322 PolarHBondContact O-N 2.99Å; G318-D403 WeakPolarHBondContact CA-OD1 3.37Å; G318-D403 PolarHBondContact N-OD1 3.32Å; G318-D403 PolarHBondContact N-OD2 2.75Å
319	S	97	Very high	95.1	Very high	21 Å²	21	57.2 Å²	57.2	15%	0.147	29%	0.288	C	S	.	.	H	α-helix	trans	-61	-33.8	177.3	66.9	0	0	0	0	113.4	E316 I317 F321 L322 Q323	E316-S319 PolarHBondContact O-OG 2.95Å; I317-S319 PolarHBondContact O-N 3.37Å; S319-F321 VanDerWaalsContact C-N 3.33Å; S319-F321 PolarHBondContact O-N 2.97Å; S319-L322 PolarHBondContact O-N 3.3Å; S319-Q323 VanDerWaalsContact O-CG 3.3Å; S319-Q323 WeakPolarHBondContact O-CG 3.42Å; S319-Q323 PolarHBondContact O-N 3.01Å
320	C	97.8	Very high	95.1	Very high	1 Å²	1	51.1 Å²	51.1	1%	0.007	26%	0.263	C	S	.	.	H	α-helix	trans	-62.6	-39.4	179	-61.1	0	0	0	0	112.1	F299 D302 L303 Q306 I317 G318 N324	F299-C320 HydrophobicContact CE2-CB 4.22Å; D302-C320 PolarHBondContact O-SG 3.49Å; D302-C320 VanDerWaalsContact O-SG 3.39Å; L303-C320 HydrophobicContact CD2-CB 3.83Å; L303-C320 HydrophobicContact CG-CB 4.34Å; Q306-C320 WeakPolarHBondContact CG-SG 3.26Å; I317-C320 WeakPolarHBondContact O-CB 3.38Å; I317-C320 PolarHBondContact O-N 3.42Å; I317-C320 VanDerWaalsContact O-N 3.11Å; G318-C320 VanDerWaalsContact C-N 3.29Å; G318-C320 PolarHBondContact O-N 3.26Å; C320-N324 WeakPolarHBondContact O-CB 3.04Å; C320-N324 PolarHBondContact O-N 3.14Å; C320-N324 PolarHBondContact O-ND2 3.4Å
321	F	97.9	Very high	95.1	Very high	2 Å²	2	42.7 Å²	42.7	1%	0.009	22%	0.224	C	C	.	.	H	α-helix	trans	-68.3	-42.6	178	-76.6	-89.8	0	0	0	111.7	F299 L303 I317 G318 S319 N324 Q325 F328 Y386 L390 A410 M414	F299-F321 HydrophobicContact CE1-CE1 4.35Å; F299-F321 HydrophobicContact CE1-CZ 4.39Å; F299-F321 HydrophobicContact CE2-CD1 4.31Å; F299-F321 HydrophobicContact CE2-CG 4.36Å; F299-F321 AromaticContact CZ-CD1 3.84Å; F299-F321 HydrophobicContact CZ-CD1 3.84Å; F299-F321 HydrophobicContact CZ-CD2 4.23Å; F299-F321 AromaticContact CZ-CE1 3.62Å; F299-F321 HydrophobicContact CZ-CE1 3.62Å; F299-F321 HydrophobicContact CZ-CE2 4.01Å; F299-F321 HydrophobicContact CZ-CG 4.15Å; F299-F321 AromaticContact CZ-CZ 3.72Å; F299-F321 HydrophobicContact CZ-CZ 3.72Å; L303-F321 HydrophobicContact CD2-CE2 4.27Å; I317-F321 HydrophobicContact CD1-CE2 4.48Å; G318-F321 PolarHBondContact O-N 3.38Å; S319-F321 VanDerWaalsContact C-N 3.33Å; S319-F321 PolarHBondContact O-N 2.97Å; F321-N324 CarbonylContact O-C 3.49Å; F321-N324 PolarHBondContact O-N 3.44Å; F321-Q325 PolarHBondContact O-N 2.56Å; F321-F328 HydrophobicContact CD1-CE2 4.34Å; F321-F328 HydrophobicContact CD1-CZ 4.19Å; F321-F328 HydrophobicContact CE1-CZ 4.48Å; F321-Y386 AromaticContact CE1-CD1 3.58Å; F321-Y386 HydrophobicContact CE1-CD1 3.58Å; F321-Y386 HydrophobicContact CE1-CE1 4.01Å; F321-Y386 HydrophobicContact CE1-CG 4.05Å; F321-Y386 HydrophobicContact CZ-CD1 4.02Å; F321-Y386 HydrophobicContact CZ-CE1 4.39Å; F321-L390 HydrophobicContact CD1-CD1 4.09Å; F321-L390 HydrophobicContact CD2-CD2 4.06Å; F321-L390 HydrophobicContact CE1-CD1 4.18Å; F321-L390 HydrophobicContact CE2-CD2 3.92Å; F321-L390 HydrophobicContact CG-CD1 4.29Å; F321-L390 HydrophobicContact CZ-CD1 4.48Å; F321-L390 HydrophobicContact CZ-CD2 4.28Å; F321-L390 HydrophobicContact CZ-CG 4.49Å; F321-A410 HydrophobicContact CB-CB 3.68Å; F321-A410 HydrophobicContact CG-CB 4.33Å; F321-M414 HydrophobicContact CD1-CG 3.79Å; F321-M414 HydrophobicContact CD1-SD 3.99Å; F321-M414 HydrophobicContact CE1-CG 4.37Å
322	L	96.9	Very high	94.9	Very high	53 Å²	53	38.6 Å²	38.6	28%	0.277	21%	0.205	S	C	.	.	H	α-helix	trans	-65	-46.2	179.5	-65	174.8	0	0	0	111.8	G318 S319 N324 Q325 N406 A409 A410 A413	G318-L322 PolarHBondContact O-N 2.99Å; S319-L322 PolarHBondContact O-N 3.3Å; L322-N324 PolarHBondContact O-N 2.95Å; L322-Q325 WeakPolarHBondContact O-CB 3.4Å; L322-Q325 PolarHBondContact O-N 3.33Å; L322-N406 HydrophobicContact CD1-CB 4.33Å; L322-A409 HydrophobicContact CD1-CB 4.02Å; L322-A409 HydrophobicContact CD2-CB 3.91Å; L322-A410 HydrophobicContact CD2-CB 4.37Å; L322-A410 HydrophobicContact CG-CB 4.33Å; L322-A413 HydrophobicContact CD2-CB 4.25Å
323	Q	96.1	Very high	94.6	Very high	140 Å²	140	43.6 Å²	43.6	65%	0.654	23%	0.228	S	C	*	.	H	α-helix	trans	-63.8	-26.9	179	-70.8	173.1	8.4	0	0	113.1	S319	S319-Q323 VanDerWaalsContact O-CG 3.3Å; S319-Q323 WeakPolarHBondContact O-CG 3.42Å; S319-Q323 PolarHBondContact O-N 3.01Å
324	N	95.7	Very high	94.6	Very high	9 Å²	9	42.5 Å²	42.5	5%	0.048	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.4	9.2	-178.6	-72.3	-76.9	0	0	0	113.2	F295 F299 D302 C320 F321 L322 E326 G327 F328	F295-N324 HydrophobicContact CE2-CB 4Å; F295-N324 HydrophobicContact CZ-CB 4.14Å; F299-N324 HydrophobicContact CD2-CB 3.94Å; F299-N324 HydrophobicContact CE2-CB 4.44Å; D302-N324 PolarHBondContact OD2-ND2 3.03Å; C320-N324 WeakPolarHBondContact O-CB 3.04Å; C320-N324 PolarHBondContact O-N 3.14Å; C320-N324 PolarHBondContact O-ND2 3.4Å; F321-N324 CarbonylContact O-C 3.49Å; F321-N324 PolarHBondContact O-N 3.44Å; L322-N324 PolarHBondContact O-N 2.95Å; N324-E326 PolarHBondContact O-N 2.9Å; N324-G327 WeakPolarHBondContact O-CA 3.14Å; N324-G327 PolarHBondContact O-N 2.8Å; N324-F328 HydrophobicContact CB-CE2 4.26Å; N324-F328 VanDerWaalsContact O-CD2 3.24Å; N324-F328 WeakPolarHBondContact O-CD2 3.16Å; N324-F328 PolarHBondContact O-N 3.22Å
325	Q	92.7	Very high	94.3	Very high	81 Å²	81	39.3 Å²	39.3	38%	0.379	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.7	-50.3	-174.1	179.1	-178.6	-29.8	0	0	112.8	F321 L322 G327 F328 A413	F321-Q325 PolarHBondContact O-N 2.56Å; L322-Q325 WeakPolarHBondContact O-CB 3.4Å; L322-Q325 PolarHBondContact O-N 3.33Å; Q325-G327 PolarHBondContact O-N 2.77Å; Q325-F328 PolarHBondContact O-N 2.77Å; Q325-A413 HydrophobicContact CG-CB 4.24Å
326	E	90.6	Very high	93.8	Very high	178 Å²	178	40.5 Å²	40.5	83%	0.832	21%	0.213	S	C	*	.	G	3₁₀ helix	trans	-62.7	-33.1	179.2	-64.6	-178.9	177.7	0	0	112.1	N324 F328 A329	N324-E326 PolarHBondContact O-N 2.9Å; E326-F328 PolarHBondContact O-N 2.81Å; E326-A329 WeakPolarHBondContact O-CB 3.39Å; E326-A329 PolarHBondContact O-N 3.27Å
327	G	93.6	Very high	93.5	Very high	24 Å²	24	39 Å²	39	25%	0.247	21%	0.207	C	C	.	.	G	3₁₀ helix	trans	-64.2	-26.6	178.9	0	0	0	0	0	113.4	N324 Q325 A329 I330	N324-G327 WeakPolarHBondContact O-CA 3.14Å; N324-G327 PolarHBondContact O-N 2.8Å; Q325-G327 PolarHBondContact O-N 2.77Å; G327-A329 PolarHBondContact O-N 2.87Å; G327-I330 WeakPolarHBondContact O-CG1 3.37Å
328	F	94.7	Very high	93.1	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-71.1	-12.8	174.9	-67.5	-77	0	0	0	113.5	F295 F299 F321 N324 Q325 E326 I330 Y331 I383 Y386 M414 V417	F295-F328 AromaticContact CE1-CD1 3.62Å; F295-F328 HydrophobicContact CE1-CD1 3.62Å; F295-F328 AromaticContact CE1-CE1 3.63Å; F295-F328 HydrophobicContact CE1-CE1 3.63Å; F295-F328 HydrophobicContact CE1-CG 4.15Å; F295-F328 HydrophobicContact CE1-CZ 4.16Å; F295-F328 AromaticContact CZ-CD1 3.86Å; F295-F328 HydrophobicContact CZ-CD1 3.86Å; F295-F328 HydrophobicContact CZ-CD2 4.04Å; F295-F328 AromaticContact CZ-CE1 3.84Å; F295-F328 HydrophobicContact CZ-CE1 3.84Å; F295-F328 HydrophobicContact CZ-CE2 4.02Å; F295-F328 AromaticContact CZ-CG 3.96Å; F295-F328 HydrophobicContact CZ-CG 3.96Å; F295-F328 AromaticContact CZ-CZ 3.92Å; F295-F328 HydrophobicContact CZ-CZ 3.92Å; F299-F328 HydrophobicContact CD2-CZ 4.18Å; F299-F328 HydrophobicContact CE1-CZ 4.2Å; F299-F328 HydrophobicContact CE2-CE2 4.38Å; F299-F328 AromaticContact CE2-CZ 3.9Å; F299-F328 HydrophobicContact CE2-CZ 3.9Å; F299-F328 HydrophobicContact CG-CZ 4.47Å; F299-F328 AromaticContact CZ-CZ 3.89Å; F299-F328 HydrophobicContact CZ-CZ 3.89Å; F321-F328 HydrophobicContact CD1-CE2 4.34Å; F321-F328 HydrophobicContact CD1-CZ 4.19Å; F321-F328 HydrophobicContact CE1-CZ 4.48Å; N324-F328 HydrophobicContact CB-CE2 4.26Å; N324-F328 VanDerWaalsContact O-CD2 3.24Å; N324-F328 WeakPolarHBondContact O-CD2 3.16Å; N324-F328 PolarHBondContact O-N 3.22Å; Q325-F328 PolarHBondContact O-N 2.77Å; E326-F328 PolarHBondContact O-N 2.81Å; F328-I330 PolarHBondContact O-N 2.98Å; F328-I330 VanDerWaalsContact O-N 3.15Å; F328-Y331 HydrophobicContact CD1-CD2 4.3Å; F328-Y331 HydrophobicContact CD1-CE2 4.02Å; F328-Y331 WeakPolarHBondContact O-CB 3.4Å; F328-Y331 WeakPolarHBondContact O-CD2 3.35Å; F328-Y331 PolarHBondContact O-N 3.41Å; F328-Y331 VanDerWaalsContact O-N 3.1Å; F328-I383 HydrophobicContact CB-CD1 4.27Å; F328-I383 HydrophobicContact CD1-CD1 3.92Å; F328-I383 HydrophobicContact CG-CD1 4.42Å; F328-Y386 HydrophobicContact CD1-CE2 4.18Å; F328-Y386 HydrophobicContact CE1-CD2 4.31Å; F328-Y386 AromaticContact CE1-CE2 3.63Å; F328-Y386 HydrophobicContact CE1-CE2 3.63Å; F328-Y386 AromaticContact CE1-CZ 3.9Å; F328-Y386 HydrophobicContact CZ-CE2 4.49Å; F328-M414 HydrophobicContact CD1-CE 3.9Å; F328-M414 HydrophobicContact CD2-CE 4.05Å; F328-M414 HydrophobicContact CD2-SD 3.74Å; F328-M414 HydrophobicContact CE1-CE 3.99Å; F328-M414 HydrophobicContact CE2-CE 4.14Å; F328-M414 HydrophobicContact CE2-SD 3.75Å; F328-M414 HydrophobicContact CG-CE 3.93Å; F328-M414 HydrophobicContact CG-SD 4.21Å; F328-M414 HydrophobicContact CZ-CE 4.11Å; F328-M414 HydrophobicContact CZ-SD 4.22Å; F328-V417 HydrophobicContact CB-CG1 3.93Å; F328-V417 HydrophobicContact CB-CG2 4.33Å
329	A	89.5	Confident	92.6	Very high	60 Å²	60	43 Å²	43	50%	0.496	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-59.9	-27.1	179.9	0	0	0	0	0	113.2	E326 G327 Y331 S332	E326-A329 WeakPolarHBondContact O-CB 3.39Å; E326-A329 PolarHBondContact O-N 3.27Å; G327-A329 PolarHBondContact O-N 2.87Å; A329-Y331 PolarHBondContact O-N 3.4Å; A329-S332 WeakPolarHBondContact O-CB 3.45Å; A329-S332 PolarHBondContact O-N 3.24Å
330	I	92.9	Very high	92.2	Very high	49 Å²	49	43.5 Å²	43.5	25%	0.251	24%	0.241	S	C	.	.	H	α-helix	trans	-61.3	-24.2	177.7	68.9	-174.9	0	0	0	113	N288 I292 F295 G327 F328 S332 E333 Y334	N288-I330 PolarHBondContact ND2-O 3.19Å; I292-I330 HydrophobicContact CB-CD1 4.48Å; I292-I330 HydrophobicContact CG1-CD1 3.94Å; I292-I330 HydrophobicContact CG1-CG1 3.97Å; F295-I330 HydrophobicContact CB-CD1 3.69Å; F295-I330 HydrophobicContact CD1-CD1 4.18Å; F295-I330 HydrophobicContact CG-CD1 4Å; G327-I330 WeakPolarHBondContact O-CG1 3.37Å; F328-I330 PolarHBondContact O-N 2.98Å; F328-I330 VanDerWaalsContact O-N 3.15Å; I330-S332 PolarHBondContact O-N 2.81Å; I330-E333 PolarHBondContact O-N 3.33Å; I330-Y334 PolarHBondContact O-N 3.32Å
331	Y	94	Very high	92	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-64.7	-24.2	175.2	-79.3	-99.4	0	0	0	112.3	Y255 I292 F295 Q296 F328 A329 Y334 C335 P379 I383	Y255-Y331 VanDerWaalsContact CE1-OH 3.29Å; Y255-Y331 WeakPolarHBondContact CE1-OH 3.43Å; Y255-Y331 WeakPolarHBondContact OH-CE1 3.43Å; Y255-Y331 PolarHBondContact OH-OH 3.13Å; I292-Y331 HydrophobicContact CD1-CD1 4.24Å; I292-Y331 HydrophobicContact CD1-CE1 4.35Å; I292-Y331 HydrophobicContact CD1-CG 4.45Å; I292-Y331 HydrophobicContact CG2-CE1 4.13Å; I292-Y331 HydrophobicContact CG2-CE2 4.18Å; F295-Y331 HydrophobicContact CD1-CE2 4.22Å; F295-Y331 HydrophobicContact CE1-CE2 4.18Å; Q296-Y331 PolarHBondContact OE1-OH 3.41Å; F328-Y331 HydrophobicContact CD1-CD2 4.3Å; F328-Y331 HydrophobicContact CD1-CE2 4.02Å; F328-Y331 WeakPolarHBondContact O-CB 3.4Å; F328-Y331 WeakPolarHBondContact O-CD2 3.35Å; F328-Y331 PolarHBondContact O-N 3.41Å; F328-Y331 VanDerWaalsContact O-N 3.1Å; A329-Y331 PolarHBondContact O-N 3.4Å; Y331-Y334 PolarHBondContact O-N 3.17Å; Y331-C335 WeakPolarHBondContact O-CB 3.35Å; Y331-C335 PolarHBondContact O-N 2.82Å; Y331-C335 PolarHBondContact O-SG 3.47Å; Y331-P379 HydrophobicContact CD1-CB 4.13Å; Y331-P379 WeakPolarHBondContact CD1-O 3.33Å; Y331-P379 HydrophobicContact CE1-CB 3.78Å; Y331-P379 WeakPolarHBondContact CE1-O 3.35Å; Y331-I383 HydrophobicContact CD1-CB 3.73Å; Y331-I383 HydrophobicContact CD1-CD1 4.34Å; Y331-I383 HydrophobicContact CD1-CG1 4.15Å; Y331-I383 HydrophobicContact CD1-CG2 4.27Å; Y331-I383 HydrophobicContact CD2-CD1 4.16Å; Y331-I383 HydrophobicContact CE1-CB 4.22Å; Y331-I383 HydrophobicContact CG-CB 4.16Å; Y331-I383 HydrophobicContact CG-CD1 4.02Å; Y331-I383 HydrophobicContact CG-CG1 4.05Å
332	S	88.6	Confident	91.7	Very high	6 Å²	6	45.9 Å²	45.9	4%	0.042	26%	0.257	C	S	.	.	H	α-helix	trans	-64	-46.1	177	-166.7	0	0	0	0	111.8	A329 I330 Y334 C335 N336 R424	A329-S332 WeakPolarHBondContact O-CB 3.45Å; A329-S332 PolarHBondContact O-N 3.24Å; I330-S332 PolarHBondContact O-N 2.81Å; S332-Y334 VanDerWaalsContact C-N 3.34Å; S332-Y334 PolarHBondContact O-N 2.83Å; S332-C335 PolarHBondContact O-N 2.92Å; S332-N336 WeakPolarHBondContact O-CB 3.34Å; S332-N336 PolarHBondContact O-N 3.31Å; S332-N336 PolarHBondContact O-ND2 3.42Å; S332-R424 WeakPolarHBondContact OG-CD 3.48Å; S332-R424 PolarHBondContact OG-NE 3.27Å
333	E	89.1	Confident	91.5	Very high	111 Å²	111	48.6 Å²	48.6	52%	0.519	27%	0.271	S	S	.	.	H	α-helix	trans	-59.5	-46	174.2	-179.7	-174.1	171.9	0	0	111.1	N288 I330 C335 N336 N337	N288-E333 PolarHBondContact ND2-OE2 2.98Å; I330-E333 PolarHBondContact O-N 3.33Å; E333-C335 PolarHBondContact O-N 3.24Å; E333-N336 PolarHBondContact O-N 2.88Å; E333-N337 PolarHBondContact O-N 3.02Å
334	Y	93.9	Very high	91.5	Very high	4 Å²	4	44.1 Å²	44.1	2%	0.016	25%	0.25	C	S	.	.	H	α-helix	trans	-59.2	-50.1	178.5	-167.9	-98	0	0	0	112.5	N288 I289 I292 I330 Y331 S332 N336 N337 H338 L376 P379 V380	N288-Y334 WeakPolarHBondContact OD1-CB 3.35Å; I289-Y334 HydrophobicContact CB-CD2 4.36Å; I289-Y334 HydrophobicContact CB-CE2 3.78Å; I289-Y334 HydrophobicContact CD1-CE2 4.21Å; I289-Y334 HydrophobicContact CG1-CE2 4.09Å; I292-Y334 HydrophobicContact CD1-CD1 4.28Å; I292-Y334 HydrophobicContact CD1-CD2 3.79Å; I292-Y334 HydrophobicContact CD1-CG 3.59Å; I330-Y334 PolarHBondContact O-N 3.32Å; Y331-Y334 PolarHBondContact O-N 3.17Å; S332-Y334 VanDerWaalsContact C-N 3.34Å; S332-Y334 PolarHBondContact O-N 2.83Å; Y334-N336 VanDerWaalsContact C-N 3.29Å; Y334-N336 PolarHBondContact O-N 3.1Å; Y334-N337 PolarHBondContact O-N 2.75Å; Y334-H338 WeakPolarHBondContact O-CB 3.34Å; Y334-H338 PolarHBondContact O-N 3.12Å; Y334-L376 WeakPolarHBondContact CE1-O 3.17Å; Y334-L376 WeakPolarHBondContact OH-CA 3.21Å; Y334-L376 PolarHBondContact OH-O 2.96Å; Y334-P379 HydrophobicContact CD1-CB 3.74Å; Y334-P379 HydrophobicContact CD1-CG 4.14Å; Y334-P379 HydrophobicContact CE1-CB 3.62Å; Y334-P379 HydrophobicContact CE1-CG 3.54Å; Y334-P379 HydrophobicContact CG-CB 4.49Å; Y334-V380 HydrophobicContact CD1-CG2 4.04Å; Y334-V380 HydrophobicContact CE1-CG2 4.04Å
335	C	90.5	Very high	91.4	Very high	7 Å²	7	44 Å²	44	5%	0.047	25%	0.25	C	C	.	.	H	α-helix	trans	-63	-35.3	-179.3	-67.8	0	0	0	0	112.3	Y331 S332 E333 P339 I421	Y331-C335 WeakPolarHBondContact O-CB 3.35Å; Y331-C335 PolarHBondContact O-N 2.82Å; Y331-C335 PolarHBondContact O-SG 3.47Å; S332-C335 PolarHBondContact O-N 2.92Å; E333-C335 PolarHBondContact O-N 3.24Å; C335-P339 WeakPolarHBondContact O-CD 3.4Å; C335-I421 HydrophobicContact CB-CG2 3.6Å
336	N	85.9	Confident	91.5	Very high	25 Å²	25	42.8 Å²	42.8	13%	0.134	25%	0.253	C	S	.	.	H	α-helix	trans	-72.8	-35	177.8	-70	-32.2	0	0	0	112.6	S332 E333 Y334 R424 K425 L428	S332-N336 WeakPolarHBondContact O-CB 3.34Å; S332-N336 PolarHBondContact O-N 3.31Å; S332-N336 PolarHBondContact O-ND2 3.42Å; E333-N336 PolarHBondContact O-N 2.88Å; Y334-N336 VanDerWaalsContact C-N 3.29Å; Y334-N336 PolarHBondContact O-N 3.1Å; N336-R424 WeakPolarHBondContact ND2-CD 3.34Å; N336-R424 WeakPolarHBondContact ND2-CG 3.47Å; N336-K425 WeakPolarHBondContact OD1-CA 3.45Å; N336-L428 HydrophobicContact CB-CD2 4.08Å
337	N	90.2	Very high	91.7	Very high	47 Å²	47	37.3 Å²	37.3	25%	0.251	23%	0.23	S	C	.	.	H	α-helix	trans	-78.1	-28.6	176.2	-179.4	66.7	0	0	0	112.9	T284 E333 Y334 G340 A341	T284-N337 PolarHBondContact O-ND2 3.3Å; E333-N337 PolarHBondContact O-N 3.02Å; Y334-N337 PolarHBondContact O-N 2.75Å; N337-G340 WeakPolarHBondContact O-CA 3.49Å; N337-G340 PolarHBondContact O-N 3.48Å; N337-A341 PolarHBondContact O-N 3.06Å; N337-A341 VanDerWaalsContact O-N 3.08Å
338	H	90.1	Very high	91.7	Very high	21 Å²	21	36.4 Å²	36.4	10%	0.097	22%	0.219	C	C	.	.	H	α-helix	trans	-51.6	-42.4	-172.4	-172.7	77.4	0	0	0	114.9	Y334 G340 A341 C342 L376 L377 V380	Y334-H338 WeakPolarHBondContact O-CB 3.34Å; Y334-H338 PolarHBondContact O-N 3.12Å; H338-G340 VanDerWaalsContact C-N 3.28Å; H338-G340 PolarHBondContact O-N 3.46Å; H338-A341 WeakPolarHBondContact O-CB 3.48Å; H338-A341 PolarHBondContact O-N 2.78Å; H338-A341 VanDerWaalsContact O-N 3.16Å; H338-C342 PolarHBondContact NE2-SG 3.46Å; H338-C342 PolarHBondContact O-N 3.37Å; H338-C342 PolarHBondContact O-SG 3.04Å; H338-L376 PolarHBondContact CE1-O 3.47Å; H338-L376 PolarHBondContact ND1-O 3.43Å; H338-L377 VanDerWaalsContact NE2-CD1 3.35Å; H338-L377 WeakPolarHBondContact NE2-CD1 3.39Å; H338-V380 HydrophobicContact CB-CG2 4.3Å
339	P	86.7	Confident	91.7	Very high	64 Å²	64	39 Å²	39	42%	0.416	23%	0.232	S	C	.	.	H	α-helix	trans	-58.6	-36.8	173.8	-25	35.1	0	0	0	113.9	C335 L343	C335-P339 WeakPolarHBondContact O-CD 3.4Å; P339-L343 PolarHBondContact O-N 3.12Å
340	G	89.6	Confident	91.9	Very high	32 Å²	32	42.7 Å²	42.7	33%	0.33	24%	0.237	S	C	.	.	H	α-helix	trans	-67.9	-42.4	174.9	0	0	0	0	0	112.1	N337 H338 C342 L343 E344	N337-G340 WeakPolarHBondContact O-CA 3.49Å; N337-G340 PolarHBondContact O-N 3.48Å; H338-G340 VanDerWaalsContact C-N 3.28Å; H338-G340 PolarHBondContact O-N 3.46Å; G340-C342 PolarHBondContact O-N 3.49Å; G340-L343 PolarHBondContact O-N 2.89Å; G340-E344 PolarHBondContact O-N 3.36Å
341	A	93.9	Very high	92	Very high	3 Å²	3	44.8 Å²	44.8	3%	0.025	25%	0.245	C	C	.	.	H	α-helix	trans	-57.5	-46.8	173.8	0	0	0	0	0	112	T284 I285 N337 H338 L343 E344 L345	T284-A341 WeakPolarHBondContact O-CA 3.31Å; T284-A341 VanDerWaalsContact O-CB 3.31Å; T284-A341 WeakPolarHBondContact O-CB 3.32Å; I285-A341 WeakPolarHBondContact O-CB 3.18Å; N337-A341 PolarHBondContact O-N 3.06Å; N337-A341 VanDerWaalsContact O-N 3.08Å; H338-A341 WeakPolarHBondContact O-CB 3.48Å; H338-A341 PolarHBondContact O-N 2.78Å; H338-A341 VanDerWaalsContact O-N 3.16Å; A341-L343 VanDerWaalsContact C-N 3.32Å; A341-L343 PolarHBondContact O-N 3.19Å; A341-E344 PolarHBondContact O-N 3.41Å; A341-L345 WeakPolarHBondContact O-CB 3.45Å; A341-L345 WeakPolarHBondContact O-CG 3.46Å; A341-L345 PolarHBondContact O-N 2.97Å
342	C	91.1	Very high	92	Very high	49 Å²	49	46.1 Å²	46.1	33%	0.331	26%	0.26	S	S	.	.	H	α-helix	trans	-59.2	-42.1	176.7	-64.8	0	0	0	0	112.1	H338 G340 A346	H338-C342 PolarHBondContact NE2-SG 3.46Å; H338-C342 PolarHBondContact O-N 3.37Å; H338-C342 PolarHBondContact O-SG 3.04Å; G340-C342 PolarHBondContact O-N 3.49Å; C342-A346 VanDerWaalsContact O-CB 3.24Å; C342-A346 WeakPolarHBondContact O-CB 3.44Å; C342-A346 PolarHBondContact O-N 3.12Å
343	L	92.7	Very high	92.4	Very high	111 Å²	111	51 Å²	51	58%	0.581	28%	0.28	S	S	*	.	H	α-helix	trans	-66.4	-44.4	178.9	-179.7	61.3	0	0	0	111.9	P339 G340 A341 A346 N347	P339-L343 PolarHBondContact O-N 3.12Å; G340-L343 PolarHBondContact O-N 2.89Å; A341-L343 VanDerWaalsContact C-N 3.32Å; A341-L343 PolarHBondContact O-N 3.19Å; L343-A346 PolarHBondContact O-N 3.1Å; L343-N347 PolarHBondContact O-N 3.32Å; L343-N347 PolarHBondContact O-ND2 3.07Å
344	E	95.2	Very high	92.8	Very high	45 Å²	45	46.3 Å²	46.3	21%	0.21	26%	0.258	C	S	.	.	H	α-helix	trans	-63.9	-46.5	178.1	-172.7	59.5	-157	0	0	110.8	Q281 T284 I285 G340 A341 A346 N347 L348	Q281-E344 WeakPolarHBondContact CG-OE1 3.22Å; Q281-E344 PolarHBondContact NE2-OE1 3.35Å; T284-E344 HydrophobicContact CG2-CB 4.1Å; I285-E344 HydrophobicContact CD1-CG 4.05Å; I285-E344 HydrophobicContact CG1-CB 4.14Å; I285-E344 HydrophobicContact CG1-CG 3.81Å; G340-E344 PolarHBondContact O-N 3.36Å; A341-E344 PolarHBondContact O-N 3.41Å; E344-A346 PolarHBondContact O-N 3.42Å; E344-N347 WeakPolarHBondContact O-CB 3.36Å; E344-N347 PolarHBondContact O-N 2.94Å; E344-N347 VanDerWaalsContact O-N 3.12Å; E344-L348 HydrophobicContact CG-CD1 4.47Å; E344-L348 WeakPolarHBondContact O-CG 3.47Å; E344-L348 PolarHBondContact O-N 3.27Å
345	L	94.8	Very high	92.8	Very high	7 Å²	7	50.2 Å²	50.2	4%	0.037	27%	0.272	C	S	.	.	H	α-helix	trans	-60	-45.6	175	-78.5	173	0	0	0	112.2	I285 A341 N347 L348 M349 F358 I372 D373 L376	I285-L345 HydrophobicContact CD1-CD2 4.31Å; I285-L345 HydrophobicContact CG1-CD2 4.38Å; I285-L345 HydrophobicContact CG1-CG 4.29Å; I285-L345 HydrophobicContact CG2-CD1 4.1Å; I285-L345 HydrophobicContact CG2-CD2 3.86Å; I285-L345 HydrophobicContact CG2-CG 3.95Å; A341-L345 WeakPolarHBondContact O-CB 3.45Å; A341-L345 WeakPolarHBondContact O-CG 3.46Å; A341-L345 PolarHBondContact O-N 2.97Å; L345-N347 PolarHBondContact O-N 2.65Å; L345-L348 PolarHBondContact O-N 2.89Å; L345-M349 VanDerWaalsContact O-CB 3.23Å; L345-M349 WeakPolarHBondContact O-CB 3.47Å; L345-M349 WeakPolarHBondContact O-CG 3.28Å; L345-M349 PolarHBondContact O-N 3.16Å; L345-F358 HydrophobicContact CD2-CE2 3.97Å; L345-F358 HydrophobicContact CD2-CZ 3.9Å; L345-I372 HydrophobicContact CD1-CG2 4.29Å; L345-I372 HydrophobicContact CD2-CG2 4.08Å; L345-D373 HydrophobicContact CD1-CB 4.35Å; L345-L376 HydrophobicContact CD1-CD1 3.46Å; L345-L376 VanDerWaalsContact CD1-CD1 3.46Å
346	A	93.6	Very high	93.1	Very high	55 Å²	55	56.5 Å²	56.5	46%	0.455	30%	0.301	S	S	.	.	H	α-helix	trans	-59.5	-33.4	176.9	0	0	0	0	0	112.2	C342 L343 E344	C342-A346 VanDerWaalsContact O-CB 3.24Å; C342-A346 WeakPolarHBondContact O-CB 3.44Å; C342-A346 PolarHBondContact O-N 3.12Å; L343-A346 PolarHBondContact O-N 3.1Å; E344-A346 PolarHBondContact O-N 3.42Å
347	N	94.5	Very high	93.6	Very high	63 Å²	63	56.4 Å²	56.4	34%	0.337	30%	0.299	S	S	.	.	H	α-helix	trans	-72.9	-46.7	174.9	-74.7	-32.7	0	0	0	112.5	L343 E344 L345 M349 K350	L343-N347 PolarHBondContact O-N 3.32Å; L343-N347 PolarHBondContact O-ND2 3.07Å; E344-N347 WeakPolarHBondContact O-CB 3.36Å; E344-N347 PolarHBondContact O-N 2.94Å; E344-N347 VanDerWaalsContact O-N 3.12Å; L345-N347 PolarHBondContact O-N 2.65Å; N347-M349 VanDerWaalsContact C-N 3.35Å; N347-M349 PolarHBondContact O-N 2.85Å; N347-K350 VanDerWaalsContact O-CB 3.29Å; N347-K350 WeakPolarHBondContact O-CB 3.48Å; N347-K350 PolarHBondContact O-N 3.13Å; N347-K350 VanDerWaalsContact O-N 3.14Å; N347-K350 PolarHBondContact OD1-NZ 3.15Å
348	L	95.1	Very high	93.9	Very high	5 Å²	5	54.5 Å²	54.5	3%	0.026	29%	0.289	C	S	.	.	H	α-helix	trans	-61.4	-44.1	176.7	-68.1	-178.9	0	0	0	111.5	F277 I285 E344 L345 K350 Q351 Y354	F277-L348 HydrophobicContact CD1-CD1 4.37Å; F277-L348 HydrophobicContact CE1-CD1 4.13Å; I285-L348 HydrophobicContact CD1-CD1 3.53Å; E344-L348 HydrophobicContact CG-CD1 4.47Å; E344-L348 WeakPolarHBondContact O-CG 3.47Å; E344-L348 PolarHBondContact O-N 3.27Å; L345-L348 PolarHBondContact O-N 2.89Å; L348-K350 PolarHBondContact O-N 3.41Å; L348-Q351 PolarHBondContact O-N 3.32Å; L348-Y354 HydrophobicContact CB-CD1 4.37Å; L348-Y354 HydrophobicContact CB-CD2 4.09Å; L348-Y354 HydrophobicContact CB-CG 3.99Å; L348-Y354 HydrophobicContact CD1-CD1 4.48Å; L348-Y354 HydrophobicContact CD2-CD1 4.33Å; L348-Y354 HydrophobicContact CD2-CD2 4.08Å; L348-Y354 HydrophobicContact CD2-CE1 3.98Å; L348-Y354 HydrophobicContact CD2-CE2 3.73Å; L348-Y354 HydrophobicContact CD2-CG 4.4Å; L348-Y354 WeakPolarHBondContact O-CD2 3.39Å
349	M	93.4	Very high	94.1	Very high	56 Å²	56	57.3 Å²	57.3	28%	0.276	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-2.2	177.2	-68.9	-63.1	-87.4	0	0	113.4	L345 N347 R355 F358	L345-M349 VanDerWaalsContact O-CB 3.23Å; L345-M349 WeakPolarHBondContact O-CB 3.47Å; L345-M349 WeakPolarHBondContact O-CG 3.28Å; L345-M349 PolarHBondContact O-N 3.16Å; N347-M349 VanDerWaalsContact C-N 3.35Å; N347-M349 PolarHBondContact O-N 2.85Å; M349-R355 HydrophobicContact CE-CB 4.41Å; M349-R355 HydrophobicContact CE-CG 3.97Å; M349-R355 PolarHBondContact O-NE 2.97Å; M349-R355 PolarHBondContact O-NH2 3.16Å; M349-R355 HydrophobicContact SD-CB 4.42Å; M349-R355 HydrophobicContact SD-CG 3.91Å; M349-F358 HydrophobicContact SD-CD2 3.75Å; M349-F358 HydrophobicContact SD-CE2 4.36Å
350	K	94.6	Very high	94.6	Very high	137 Å²	137	56.9 Å²	56.9	60%	0.596	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-33.6	166.3	-69.9	167.8	-176.1	164.9	0	111.7	N347 L348 R355	N347-K350 VanDerWaalsContact O-CB 3.29Å; N347-K350 WeakPolarHBondContact O-CB 3.48Å; N347-K350 PolarHBondContact O-N 3.13Å; N347-K350 VanDerWaalsContact O-N 3.14Å; N347-K350 PolarHBondContact OD1-NZ 3.15Å; L348-K350 PolarHBondContact O-N 3.41Å; K350-R355 PolarHBondContact O-NH2 3.3Å
351	Q	94.8	Very high	94.9	Very high	92 Å²	92	55.7 Å²	55.7	43%	0.43	29%	0.29	S	S	.	.	S	Bend	trans	-90.6	135.9	-177.4	-39.3	176.9	23.7	0	0	110.4	L348 K353 Y354	L348-Q351 PolarHBondContact O-N 3.32Å; Q351-K353 VanDerWaalsContact C-N 3.32Å; Q351-K353 HydrophobicContact CB-CG 4.42Å; Q351-K353 PolarHBondContact O-N 2.97Å; Q351-Y354 HydrophobicContact CB-CD2 3.95Å; Q351-Y354 HydrophobicContact CB-CE2 4.41Å; Q351-Y354 HydrophobicContact CG-CD2 4.3Å; Q351-Y354 HydrophobicContact CG-CE2 4.43Å; Q351-Y354 PolarHBondContact O-N 2.94Å
352	G	94.5	Very high	94.9	Very high	29 Å²	29	56.5 Å²	56.5	30%	0.299	29%	0.293	S	S	.	.	H	α-helix	trans	-59.2	-39.7	-176.4	0	0	0	0	0	113.3	Y354 R355 H356	G352-Y354 VanDerWaalsContact C-N 3.31Å; G352-Y354 PolarHBondContact O-N 3.47Å; G352-R355 WeakPolarHBondContact O-CB 3.34Å; G352-R355 PolarHBondContact O-N 3.48Å; G352-R355 VanDerWaalsContact O-N 3.09Å; G352-H356 PolarHBondContact O-N 2.98Å; G352-H356 VanDerWaalsContact O-N 3.09Å; G352-H356 PolarHBondContact O-ND1 2.71Å
353	K	96.1	Very high	95.1	Very high	107 Å²	107	59.1 Å²	59.1	47%	0.465	30%	0.303	S	S	.	.	H	α-helix	trans	-55.4	-41	-178.3	68.5	-178.5	-172.2	179.4	0	113.6	M276 Q351 F357	M276-K353 HydrophobicContact CE-CG 4.41Å; Q351-K353 VanDerWaalsContact C-N 3.32Å; Q351-K353 HydrophobicContact CB-CG 4.42Å; Q351-K353 PolarHBondContact O-N 2.97Å; K353-F357 VanDerWaalsContact O-CB 3.28Å; K353-F357 WeakPolarHBondContact O-CB 3.5Å; K353-F357 PolarHBondContact O-N 3.47Å
354	Y	96.8	Very high	95.2	Very high	14 Å²	14	59.8 Å²	59.8	6%	0.055	31%	0.306	C	S	.	.	H	α-helix	trans	-72.6	-36.1	178.4	-65.7	-75.1	0	0	0	111.9	M276 F277 L348 Q351 G352 F357 F358	M276-Y354 HydrophobicContact CB-CE1 4.11Å; M276-Y354 HydrophobicContact CE-CD1 3.8Å; M276-Y354 HydrophobicContact CE-CE1 3.93Å; M276-Y354 HydrophobicContact CE-CG 4.47Å; M276-Y354 VanDerWaalsContact O-CE1 3.29Å; M276-Y354 WeakPolarHBondContact O-CE1 3.49Å; M276-Y354 PolarHBondContact O-OH 3.3Å; F277-Y354 HydrophobicContact CD1-CE1 4.09Å; F277-Y354 AromaticContact CE1-CD1 3.67Å; F277-Y354 HydrophobicContact CE1-CD1 3.67Å; F277-Y354 AromaticContact CE1-CE1 3.65Å; F277-Y354 HydrophobicContact CE1-CE1 3.65Å; F277-Y354 AromaticContact CZ-CD1 3.74Å; F277-Y354 HydrophobicContact CZ-CD1 3.74Å; F277-Y354 AromaticContact CZ-CE1 3.91Å; F277-Y354 HydrophobicContact CZ-CE1 3.91Å; L348-Y354 HydrophobicContact CB-CD1 4.37Å; L348-Y354 HydrophobicContact CB-CD2 4.09Å; L348-Y354 HydrophobicContact CB-CG 3.99Å; L348-Y354 HydrophobicContact CD1-CD1 4.48Å; L348-Y354 HydrophobicContact CD2-CD1 4.33Å; L348-Y354 HydrophobicContact CD2-CD2 4.08Å; L348-Y354 HydrophobicContact CD2-CE1 3.98Å; L348-Y354 HydrophobicContact CD2-CE2 3.73Å; L348-Y354 HydrophobicContact CD2-CG 4.4Å; L348-Y354 WeakPolarHBondContact O-CD2 3.39Å; Q351-Y354 HydrophobicContact CB-CD2 3.95Å; Q351-Y354 HydrophobicContact CB-CE2 4.41Å; Q351-Y354 HydrophobicContact CG-CD2 4.3Å; Q351-Y354 HydrophobicContact CG-CE2 4.43Å; Q351-Y354 PolarHBondContact O-N 2.94Å; G352-Y354 VanDerWaalsContact C-N 3.31Å; G352-Y354 PolarHBondContact O-N 3.47Å; Y354-F357 PolarHBondContact O-N 3.22Å; Y354-F358 WeakPolarHBondContact O-CD2 3.22Å; Y354-F358 PolarHBondContact O-N 2.72Å
355	R	95.2	Very high	95	Very high	85 Å²	85	59.8 Å²	59.8	32%	0.321	31%	0.306	S	S	.	.	H	α-helix	trans	-59.7	-50.6	175.3	-61.9	-170.6	-170.4	110.9	9.9	111.3	M349 K350 G352 F357 E359	M349-R355 HydrophobicContact CE-CB 4.41Å; M349-R355 HydrophobicContact CE-CG 3.97Å; M349-R355 PolarHBondContact O-NE 2.97Å; M349-R355 PolarHBondContact O-NH2 3.16Å; M349-R355 HydrophobicContact SD-CB 4.42Å; M349-R355 HydrophobicContact SD-CG 3.91Å; K350-R355 PolarHBondContact O-NH2 3.3Å; G352-R355 WeakPolarHBondContact O-CB 3.34Å; G352-R355 PolarHBondContact O-N 3.48Å; G352-R355 VanDerWaalsContact O-N 3.09Å; R355-F357 VanDerWaalsContact C-N 3.33Å; R355-F357 PolarHBondContact O-N 2.87Å; R355-E359 WeakPolarHBondContact O-CB 3.27Å; R355-E359 PolarHBondContact O-N 2.9Å
356	H	95.9	Very high	94.8	Very high	140 Å²	140	67.6 Å²	67.6	65%	0.648	34%	0.342	S	S	*	.	H	α-helix	trans	-65.4	-38.2	179.1	-56.6	110.4	0	0	0	111.6	G352 E359 A360	G352-H356 PolarHBondContact O-N 2.98Å; G352-H356 VanDerWaalsContact O-N 3.09Å; G352-H356 PolarHBondContact O-ND1 2.71Å; H356-E359 PolarHBondContact O-N 3.46Å; H356-A360 VanDerWaalsContact O-CB 3.31Å; H356-A360 WeakPolarHBondContact O-CB 3.47Å; H356-A360 PolarHBondContact O-N 3.34Å
357	F	97.1	Very high	94.4	Very high	23 Å²	23	65.5 Å²	65.5	10%	0.101	32%	0.323	C	S	.	.	H	α-helix	trans	-61.4	-50.8	177.1	177.1	-88.9	0	0	0	112.4	Q269 H273 M276 F277 K353 Y354 R355 E359 A360 C361	Q269-F357 HydrophobicContact CB-CZ 3.98Å; H273-F357 HydrophobicContact CB-CE2 4.32Å; H273-F357 AromaticContact CD2-CE2 3.66Å; H273-F357 AromaticContact CG-CE2 3.73Å; H273-F357 AromaticContact ND1-CE2 3.93Å; H273-F357 AromaticContact NE2-CE2 3.85Å; M276-F357 HydrophobicContact CE-CB 3.8Å; M276-F357 HydrophobicContact CE-CD2 4.06Å; M276-F357 HydrophobicContact CE-CG 3.9Å; M276-F357 HydrophobicContact SD-CD2 4Å; M276-F357 HydrophobicContact SD-CG 4.45Å; F277-F357 AromaticContact CE2-CD1 3.89Å; F277-F357 HydrophobicContact CE2-CD1 3.89Å; F277-F357 AromaticContact CE2-CE1 3.5Å; F277-F357 HydrophobicContact CE2-CE1 3.5Å; F277-F357 VanDerWaalsContact CE2-CE1 3.5Å; F277-F357 HydrophobicContact CE2-CE2 4.37Å; F277-F357 HydrophobicContact CE2-CG 4.49Å; F277-F357 AromaticContact CE2-CZ 3.76Å; F277-F357 HydrophobicContact CE2-CZ 3.76Å; F277-F357 AromaticContact CZ-CD1 3.69Å; F277-F357 HydrophobicContact CZ-CD1 3.69Å; F277-F357 AromaticContact CZ-CE1 3.61Å; F277-F357 HydrophobicContact CZ-CE1 3.61Å; F277-F357 HydrophobicContact CZ-CG 4.49Å; F277-F357 HydrophobicContact CZ-CZ 4.34Å; K353-F357 VanDerWaalsContact O-CB 3.28Å; K353-F357 WeakPolarHBondContact O-CB 3.5Å; K353-F357 PolarHBondContact O-N 3.47Å; Y354-F357 PolarHBondContact O-N 3.22Å; R355-F357 VanDerWaalsContact C-N 3.33Å; R355-F357 PolarHBondContact O-N 2.87Å; F357-E359 VanDerWaalsContact C-N 3.33Å; F357-E359 PolarHBondContact O-N 3.41Å; F357-A360 PolarHBondContact O-N 3.2Å; F357-C361 VanDerWaalsContact CE1-SG 3.59Å; F357-C361 PolarHBondContact O-N 3.05Å; F357-C361 PolarHBondContact O-SG 3.49Å
358	F	96.1	Very high	93.9	Very high	7 Å²	7	65.7 Å²	65.7	3%	0.031	32%	0.324	C	S	.	.	H	α-helix	trans	-67	-35.5	179.3	-70.5	-54.1	0	0	0	112.1	Y266 F277 L345 M349 Y354 C361 R362 I372	Y266-F358 AromaticContact CD1-CD1 3.92Å; Y266-F358 HydrophobicContact CD1-CD1 3.92Å; Y266-F358 HydrophobicContact CE1-CB 4.38Å; Y266-F358 HydrophobicContact CE1-CD1 4.12Å; Y266-F358 WeakPolarHBondContact CE1-O 3.43Å; F277-F358 HydrophobicContact CE1-CE1 4.35Å; F277-F358 HydrophobicContact CE1-CE2 4.48Å; F277-F358 AromaticContact CE1-CZ 3.75Å; F277-F358 HydrophobicContact CE1-CZ 3.75Å; F277-F358 HydrophobicContact CZ-CE1 4.14Å; F277-F358 AromaticContact CZ-CZ 3.9Å; F277-F358 HydrophobicContact CZ-CZ 3.9Å; L345-F358 HydrophobicContact CD2-CE2 3.97Å; L345-F358 HydrophobicContact CD2-CZ 3.9Å; M349-F358 HydrophobicContact SD-CD2 3.75Å; M349-F358 HydrophobicContact SD-CE2 4.36Å; Y354-F358 WeakPolarHBondContact O-CD2 3.22Å; Y354-F358 PolarHBondContact O-N 2.72Å; F358-C361 PolarHBondContact O-N 3.24Å; F358-R362 WeakPolarHBondContact O-CB 3.37Å; F358-R362 PolarHBondContact O-N 3.14Å; F358-I372 HydrophobicContact CD1-CD1 3.61Å; F358-I372 HydrophobicContact CD1-CG2 4.47Å; F358-I372 HydrophobicContact CD2-CG2 4.44Å; F358-I372 HydrophobicContact CE1-CD1 3.54Å; F358-I372 HydrophobicContact CG-CD1 4.41Å; F358-I372 HydrophobicContact CG-CG2 4.28Å; F358-I372 HydrophobicContact CZ-CD1 4.27Å
359	E	94.5	Very high	93.5	Very high	79 Å²	79	70.6 Å²	70.6	37%	0.369	35%	0.35	S	S	.	.	H	α-helix	trans	-65.7	-42.1	174.3	-177.2	59	-169.8	0	0	111.9	R355 H356 F357 C361 R362 L363	R355-E359 WeakPolarHBondContact O-CB 3.27Å; R355-E359 PolarHBondContact O-N 2.9Å; H356-E359 PolarHBondContact O-N 3.46Å; F357-E359 VanDerWaalsContact C-N 3.33Å; F357-E359 PolarHBondContact O-N 3.41Å; E359-C361 VanDerWaalsContact C-N 3.34Å; E359-C361 PolarHBondContact O-N 3.4Å; E359-R362 WeakPolarHBondContact O-CB 3.47Å; E359-R362 PolarHBondContact O-N 2.68Å; E359-R362 IonicContact OE1-CZ 3.85Å; E359-R362 IonicContact OE1-NE 3.23Å; E359-R362 PolarHBondContact OE1-NE 2.97Å; E359-R362 IonicContact OE1-NH2 3.62Å; E359-R362 PolarHBondContact OE1-NH2 3.12Å; E359-R362 IonicContact OE2-CZ 2.87Å; E359-R362 IonicContact OE2-NE 2.8Å; E359-R362 PolarHBondContact OE2-NE 2.87Å; E359-R362 IonicContact OE2-NH2 2.81Å; E359-L363 HydrophobicContact CG-CD1 4.23Å; E359-L363 WeakPolarHBondContact O-CG 3.4Å; E359-L363 PolarHBondContact O-N 3.3Å
360	A	96.2	Very high	92.9	Very high	55 Å²	55	69.7 Å²	69.7	46%	0.455	35%	0.346	S	S	.	.	H	α-helix	trans	-62	-41.7	174.6	0	0	0	0	0	112	H356 F357 L363 L364	H356-A360 VanDerWaalsContact O-CB 3.31Å; H356-A360 WeakPolarHBondContact O-CB 3.47Å; H356-A360 PolarHBondContact O-N 3.34Å; F357-A360 PolarHBondContact O-N 3.2Å; A360-L363 PolarHBondContact O-N 3.46Å; A360-L364 VanDerWaalsContact O-CB 3.27Å; A360-L364 WeakPolarHBondContact O-CB 3.46Å; A360-L364 PolarHBondContact O-N 3.24Å
361	C	96.1	Very high	92.6	Very high	7 Å²	7	65 Å²	65	5%	0.047	33%	0.333	C	S	.	.	H	α-helix	trans	-60.8	-44.1	174.6	-65.5	0	0	0	0	111.6	G265 Y266 F357 F358 E359 L364 Q365	G265-C361 WeakPolarHBondContact O-CB 3.28Å; Y266-C361 HydrophobicContact CD1-CB 3.53Å; Y266-C361 HydrophobicContact CE1-CB 3.57Å; F357-C361 VanDerWaalsContact CE1-SG 3.59Å; F357-C361 PolarHBondContact O-N 3.05Å; F357-C361 PolarHBondContact O-SG 3.49Å; F358-C361 PolarHBondContact O-N 3.24Å; E359-C361 VanDerWaalsContact C-N 3.34Å; E359-C361 PolarHBondContact O-N 3.4Å; C361-L364 PolarHBondContact O-N 3.12Å; C361-Q365 WeakPolarHBondContact O-CB 3.28Å; C361-Q365 PolarHBondContact O-N 3.26Å
362	R	95.6	Very high	92.5	Very high	21 Å²	21	60.9 Å²	60.9	8%	0.079	31%	0.314	C	S	.	.	H	α-helix	trans	-59.7	-48	178	-167.6	-171.1	66.1	81.1	-13.2	111.8	Y266 F358 E359 Q366 M367 I368 D369 I370	Y266-R362 WeakPolarHBondContact OH-CB 3.48Å; F358-R362 WeakPolarHBondContact O-CB 3.37Å; F358-R362 PolarHBondContact O-N 3.14Å; E359-R362 WeakPolarHBondContact O-CB 3.47Å; E359-R362 PolarHBondContact O-N 2.68Å; E359-R362 IonicContact OE1-CZ 3.85Å; E359-R362 IonicContact OE1-NE 3.23Å; E359-R362 PolarHBondContact OE1-NE 2.97Å; E359-R362 IonicContact OE1-NH2 3.62Å; E359-R362 PolarHBondContact OE1-NH2 3.12Å; E359-R362 IonicContact OE2-CZ 2.87Å; E359-R362 IonicContact OE2-NE 2.8Å; E359-R362 PolarHBondContact OE2-NE 2.87Å; E359-R362 IonicContact OE2-NH2 2.81Å; R362-Q366 PolarHBondContact O-N 2.91Å; R362-M367 HydrophobicContact CG-CB 3.81Å; R362-M367 PolarHBondContact NH1-O 3.35Å; R362-M367 PolarHBondContact O-N 3.35Å; R362-I368 PolarHBondContact NH1-O 3.26Å; R362-D369 IonicContact CZ-OD1 2.98Å; R362-D369 IonicContact NE-OD1 3.21Å; R362-D369 IonicContact NH1-OD1 3.44Å; R362-D369 IonicContact NH2-OD1 3.82Å; R362-D369 PolarHBondContact NH2-OD1 3.46Å; R362-I370 WeakPolarHBondContact CD-O 3.21Å
363	L	94	Very high	92.2	Very high	103 Å²	103	63.5 Å²	63.5	54%	0.539	32%	0.321	S	S	.	.	H	α-helix	trans	-66.4	-43.8	179.9	-69.4	172.8	0	0	0	111.9	E359 A360 Q365 Q366	E359-L363 HydrophobicContact CG-CD1 4.23Å; E359-L363 WeakPolarHBondContact O-CG 3.4Å; E359-L363 PolarHBondContact O-N 3.3Å; A360-L363 PolarHBondContact O-N 3.46Å; L363-Q365 VanDerWaalsContact C-N 3.33Å; L363-Q365 PolarHBondContact O-N 3.4Å; L363-Q366 PolarHBondContact O-N 2.88Å
364	L	94.6	Very high	91.8	Very high	125 Å²	125	59.2 Å²	59.2	65%	0.654	31%	0.308	S	S	*	.	H	α-helix	trans	-63.1	-40	179.9	-175.8	66.3	0	0	0	112	A360 C361 Q366	A360-L364 VanDerWaalsContact O-CB 3.27Å; A360-L364 WeakPolarHBondContact O-CB 3.46Å; A360-L364 PolarHBondContact O-N 3.24Å; C361-L364 PolarHBondContact O-N 3.12Å; L364-Q366 PolarHBondContact O-N 3.18Å
365	Q	91.8	Very high	91.5	Very high	46 Å²	46	58.8 Å²	58.8	22%	0.215	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.1	1	177.4	-164.7	64.2	24.9	0	0	112.7	D261 C361 L363 M367	D261-Q365 HydrophobicContact CB-CG 3.84Å; D261-Q365 PolarHBondContact OD1-NE2 3.42Å; C361-Q365 WeakPolarHBondContact O-CB 3.28Å; C361-Q365 PolarHBondContact O-N 3.26Å; L363-Q365 VanDerWaalsContact C-N 3.33Å; L363-Q365 PolarHBondContact O-N 3.4Å; Q365-M367 VanDerWaalsContact C-N 3.27Å; Q365-M367 HydrophobicContact CB-CG 3.86Å; Q365-M367 HydrophobicContact CB-SD 3.97Å; Q365-M367 HydrophobicContact CG-CG 3.9Å; Q365-M367 HydrophobicContact CG-SD 3.96Å; Q365-M367 PolarHBondContact O-N 3.05Å
366	Q	91.5	Very high	91.5	Very high	170 Å²	170	54.9 Å²	54.9	79%	0.794	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.6	41.3	-179.1	-57.4	-179.8	-13.1	0	0	113	R362 L363 L364	R362-Q366 PolarHBondContact O-N 2.91Å; L363-Q366 PolarHBondContact O-N 2.88Å; L364-Q366 PolarHBondContact O-N 3.18Å
367	M	85.1	Confident	91.2	Very high	11 Å²	11	50 Å²	50	5%	0.054	27%	0.27	C	S	.	.			trans	-81.6	151.2	179.6	-62.7	175.1	82.1	0	0	110.7	D261 I262 Y266 R362 Q365 F375	D261-M367 HydrophobicContact CB-CE 3.61Å; D261-M367 HydrophobicContact CB-CG 4.03Å; D261-M367 HydrophobicContact CB-SD 3.9Å; I262-M367 HydrophobicContact CG1-CE 4.5Å; Y266-M367 HydrophobicContact CD2-CE 4.46Å; Y266-M367 HydrophobicContact CD2-SD 4.37Å; Y266-M367 HydrophobicContact CE2-CE 3.76Å; Y266-M367 HydrophobicContact CE2-SD 3.65Å; R362-M367 HydrophobicContact CG-CB 3.81Å; R362-M367 PolarHBondContact NH1-O 3.35Å; R362-M367 PolarHBondContact O-N 3.35Å; Q365-M367 VanDerWaalsContact C-N 3.27Å; Q365-M367 HydrophobicContact CB-CG 3.86Å; Q365-M367 HydrophobicContact CB-SD 3.97Å; Q365-M367 HydrophobicContact CG-CG 3.9Å; Q365-M367 HydrophobicContact CG-SD 3.96Å; Q365-M367 PolarHBondContact O-N 3.05Å; M367-F375 HydrophobicContact CB-CE2 4.17Å; M367-F375 HydrophobicContact CB-CZ 3.9Å; M367-F375 HydrophobicContact CE-CD1 3.54Å; M367-F375 HydrophobicContact CE-CD2 3.76Å; M367-F375 HydrophobicContact CE-CE1 3.41Å; M367-F375 VanDerWaalsContact CE-CE1 3.41Å; M367-F375 HydrophobicContact CE-CE2 3.62Å; M367-F375 HydrophobicContact CE-CG 3.71Å; M367-F375 HydrophobicContact CE-CZ 3.45Å; M367-F375 VanDerWaalsContact CE-CZ 3.45Å; M367-F375 HydrophobicContact CG-CZ 4.47Å
368	I	82.3	Confident	90.9	Very high	68 Å²	68	49.9 Å²	49.9	35%	0.349	27%	0.271	S	S	.	.			trans	-55.9	157.9	171.4	55	176.4	0	0	0	110.9	R362 I370 F375	R362-I368 PolarHBondContact NH1-O 3.26Å; I368-I370 HydrophobicContact CD1-CD1 3.4Å; I368-I370 VanDerWaalsContact CD1-CD1 3.4Å; I368-I370 HydrophobicContact CD1-CG1 3.97Å; I368-I370 HydrophobicContact CG1-CB 4.43Å; I368-I370 HydrophobicContact CG1-CD1 3.99Å; I368-I370 HydrophobicContact CG1-CG1 4.01Å; I368-I370 PolarHBondContact O-N 2.93Å; I368-F375 HydrophobicContact CD1-CZ 4.38Å; I368-F375 HydrophobicContact CG1-CE1 4.31Å; I368-F375 HydrophobicContact CG1-CE2 4.44Å; I368-F375 HydrophobicContact CG1-CZ 3.6Å
369	D	86.9	Confident	90.8	Very high	108 Å²	108	49.5 Å²	49.5	58%	0.578	27%	0.269	S	S	*	.	S	Bend	trans	-75	60.9	-176.1	-162.1	36.4	0	0	0	112.2	R362	R362-D369 IonicContact CZ-OD1 2.98Å; R362-D369 IonicContact NE-OD1 3.21Å; R362-D369 IonicContact NH1-OD1 3.44Å; R362-D369 IonicContact NH2-OD1 3.82Å; R362-D369 PolarHBondContact NH2-OD1 3.46Å
370	I	81.7	Confident	90.5	Very high	36 Å²	36	46.5 Å²	46.5	19%	0.185	26%	0.256	C	S	.	.			trans	-119.5	133.9	174	-62.4	-174.9	0	0	0	106.7	R362 I368 F375	R362-I370 WeakPolarHBondContact CD-O 3.21Å; I368-I370 HydrophobicContact CD1-CD1 3.4Å; I368-I370 VanDerWaalsContact CD1-CD1 3.4Å; I368-I370 HydrophobicContact CD1-CG1 3.97Å; I368-I370 HydrophobicContact CG1-CB 4.43Å; I368-I370 HydrophobicContact CG1-CD1 3.99Å; I368-I370 HydrophobicContact CG1-CG1 4.01Å; I368-I370 PolarHBondContact O-N 2.93Å; I370-F375 HydrophobicContact CB-CD2 4.21Å; I370-F375 HydrophobicContact CB-CE2 3.76Å; I370-F375 HydrophobicContact CB-CZ 4.3Å; I370-F375 HydrophobicContact CG2-CD2 4.13Å; I370-F375 HydrophobicContact CG2-CE2 4.19Å; I370-F375 VanDerWaalsContact O-CE2 3.31Å; I370-F375 WeakPolarHBondContact O-CE2 3.48Å
371	A	87.9	Confident	90	Very high	40 Å²	40	47.8 Å²	47.8	33%	0.331	25%	0.253	S	S	.	.			trans	-66.9	158	176.7	0	0	0	0	0	111.6	D373 G374 F375	A371-D373 WeakPolarHBondContact CB-OD1 3.37Å; A371-D373 PolarHBondContact O-N 2.88Å; A371-D373 VanDerWaalsContact O-N 3.13Å; A371-G374 WeakPolarHBondContact O-CA 3.31Å; A371-G374 PolarHBondContact O-N 3.33Å; A371-F375 PolarHBondContact O-N 2.89Å
372	I	92.5	Very high	89.8	Confident	5 Å²	5	48 Å²	48	3%	0.026	25%	0.253	C	S	.	.	H	α-helix	trans	-54.8	-35.3	-175.9	-173.4	174.5	0	0	0	113.3	Y266 F286 L345 F358 G374 F375 L376	Y266-I372 HydrophobicContact CD1-CD1 3.66Å; Y266-I372 HydrophobicContact CD1-CG1 4.29Å; Y266-I372 HydrophobicContact CD2-CD1 3.99Å; Y266-I372 HydrophobicContact CD2-CG1 3.98Å; Y266-I372 HydrophobicContact CE1-CB 4.23Å; Y266-I372 HydrophobicContact CE1-CD1 3.99Å; Y266-I372 HydrophobicContact CE1-CG1 4.23Å; Y266-I372 HydrophobicContact CE2-CB 4.29Å; Y266-I372 HydrophobicContact CE2-CD1 4.32Å; Y266-I372 HydrophobicContact CE2-CG1 3.94Å; Y266-I372 HydrophobicContact CG-CD1 3.67Å; Y266-I372 HydrophobicContact CG-CG1 4.17Å; F286-I372 HydrophobicContact CE1-CD1 4.16Å; F286-I372 HydrophobicContact CZ-CD1 4.22Å; L345-I372 HydrophobicContact CD1-CG2 4.29Å; L345-I372 HydrophobicContact CD2-CG2 4.08Å; F358-I372 HydrophobicContact CD1-CD1 3.61Å; F358-I372 HydrophobicContact CD1-CG2 4.47Å; F358-I372 HydrophobicContact CD2-CG2 4.44Å; F358-I372 HydrophobicContact CE1-CD1 3.54Å; F358-I372 HydrophobicContact CG-CD1 4.41Å; F358-I372 HydrophobicContact CG-CG2 4.28Å; F358-I372 HydrophobicContact CZ-CD1 4.27Å; I372-G374 VanDerWaalsContact C-N 3.31Å; I372-G374 PolarHBondContact O-N 2.89Å; I372-F375 PolarHBondContact O-N 3.28Å; I372-L376 HydrophobicContact CG1-CD1 4.14Å; I372-L376 HydrophobicContact CG1-CG 4.39Å; I372-L376 WeakPolarHBondContact O-CG 3.26Å; I372-L376 PolarHBondContact O-N 3.36Å
373	D	89.2	Confident	89.6	Confident	83 Å²	83	47 Å²	47	44%	0.444	25%	0.25	S	C	.	.	H	α-helix	trans	-63.4	-35.2	176.4	53.6	-47.7	0	0	0	112.6	L345 A371 L376 L377	L345-D373 HydrophobicContact CD1-CB 4.35Å; A371-D373 WeakPolarHBondContact CB-OD1 3.37Å; A371-D373 PolarHBondContact O-N 2.88Å; A371-D373 VanDerWaalsContact O-N 3.13Å; D373-L376 PolarHBondContact O-N 3.41Å; D373-L377 PolarHBondContact O-N 3.17Å
374	G	86.5	Confident	89.2	Confident	18 Å²	18	44.9 Å²	44.9	19%	0.186	24%	0.242	C	C	.	.	H	α-helix	trans	-65.3	-41.9	172.6	0	0	0	0	0	112.5	A371 I372 L377	A371-G374 WeakPolarHBondContact O-CA 3.31Å; A371-G374 PolarHBondContact O-N 3.33Å; I372-G374 VanDerWaalsContact C-N 3.31Å; I372-G374 PolarHBondContact O-N 2.89Å; G374-L377 WeakPolarHBondContact O-CB 3.38Å; G374-L377 PolarHBondContact O-N 3.37Å
375	F	91.2	Very high	88.8	Confident	5 Å²	5	42.5 Å²	42.5	2%	0.022	23%	0.227	C	C	.	.	H	α-helix	trans	-64	-40.3	174.9	-81.1	-75	0	0	0	112.6	H258 I262 M367 I368 I370 A371 I372 L377 T378	H258-F375 HydrophobicContact CB-CD1 4.36Å; H258-F375 AromaticContact ND1-CE1 3.77Å; I262-F375 HydrophobicContact CD1-CB 3.92Å; I262-F375 HydrophobicContact CG1-CB 3.98Å; M367-F375 HydrophobicContact CB-CE2 4.17Å; M367-F375 HydrophobicContact CB-CZ 3.9Å; M367-F375 HydrophobicContact CE-CD1 3.54Å; M367-F375 HydrophobicContact CE-CD2 3.76Å; M367-F375 HydrophobicContact CE-CE1 3.41Å; M367-F375 VanDerWaalsContact CE-CE1 3.41Å; M367-F375 HydrophobicContact CE-CE2 3.62Å; M367-F375 HydrophobicContact CE-CG 3.71Å; M367-F375 HydrophobicContact CE-CZ 3.45Å; M367-F375 VanDerWaalsContact CE-CZ 3.45Å; M367-F375 HydrophobicContact CG-CZ 4.47Å; I368-F375 HydrophobicContact CD1-CZ 4.38Å; I368-F375 HydrophobicContact CG1-CE1 4.31Å; I368-F375 HydrophobicContact CG1-CE2 4.44Å; I368-F375 HydrophobicContact CG1-CZ 3.6Å; I370-F375 HydrophobicContact CB-CD2 4.21Å; I370-F375 HydrophobicContact CB-CE2 3.76Å; I370-F375 HydrophobicContact CB-CZ 4.3Å; I370-F375 HydrophobicContact CG2-CD2 4.13Å; I370-F375 HydrophobicContact CG2-CE2 4.19Å; I370-F375 VanDerWaalsContact O-CE2 3.31Å; I370-F375 WeakPolarHBondContact O-CE2 3.48Å; A371-F375 PolarHBondContact O-N 2.89Å; I372-F375 PolarHBondContact O-N 3.28Å; F375-L377 PolarHBondContact O-N 3.47Å; F375-T378 WeakPolarHBondContact O-CB 3.24Å; F375-T378 WeakPolarHBondContact O-CG2 3.29Å; F375-T378 PolarHBondContact O-N 3Å; F375-T378 VanDerWaalsContact O-N 3.15Å; F375-T378 PolarHBondContact O-OG1 3.26Å
376	L	94.1	Very high	88.9	Confident	2 Å²	2	40.3 Å²	40.3	1%	0.01	22%	0.216	C	C	.	.	H	α-helix	trans	-70.9	-12.9	176.9	-66.7	171.9	0	0	0	113.4	I262 I285 F286 I289 Y334 H338 L345 I372 D373 T378	I262-L376 HydrophobicContact CG2-CD2 4.14Å; I285-L376 HydrophobicContact CG2-CD1 4.08Å; F286-L376 HydrophobicContact CD1-CD2 3.97Å; F286-L376 HydrophobicContact CE1-CD2 4.37Å; I289-L376 HydrophobicContact CD1-CD2 3.88Å; Y334-L376 WeakPolarHBondContact CE1-O 3.17Å; Y334-L376 WeakPolarHBondContact OH-CA 3.21Å; Y334-L376 PolarHBondContact OH-O 2.96Å; H338-L376 PolarHBondContact CE1-O 3.47Å; H338-L376 PolarHBondContact ND1-O 3.43Å; L345-L376 HydrophobicContact CD1-CD1 3.46Å; L345-L376 VanDerWaalsContact CD1-CD1 3.46Å; I372-L376 HydrophobicContact CG1-CD1 4.14Å; I372-L376 HydrophobicContact CG1-CG 4.39Å; I372-L376 WeakPolarHBondContact O-CG 3.26Å; I372-L376 PolarHBondContact O-N 3.36Å; D373-L376 PolarHBondContact O-N 3.41Å; L376-T378 VanDerWaalsContact C-N 3.35Å
377	L	90	Very high	88.9	Confident	39 Å²	39	32.9 Å²	32.9	20%	0.204	18%	0.183	C	C	.	.	H	α-helix	trans	-80.7	-20	172.4	-172.7	64.6	0	0	0	112.2	L83 H338 D373 G374 F375 P379 V380 Q381	L83-L377 HydrophobicContact CD1-CD2 3.19Å; H338-L377 VanDerWaalsContact NE2-CD1 3.35Å; H338-L377 WeakPolarHBondContact NE2-CD1 3.39Å; D373-L377 PolarHBondContact O-N 3.17Å; G374-L377 WeakPolarHBondContact O-CB 3.38Å; G374-L377 PolarHBondContact O-N 3.37Å; F375-L377 PolarHBondContact O-N 3.47Å; L377-P379 VanDerWaalsContact C-CD 3.49Å; L377-V380 HydrophobicContact CD1-CB 4.08Å; L377-V380 HydrophobicContact CD1-CG1 4.42Å; L377-V380 HydrophobicContact CD1-CG2 4.38Å; L377-V380 WeakPolarHBondContact O-CB 3.33Å; L377-V380 PolarHBondContact O-N 3.3Å; L377-Q381 HydrophobicContact CD2-CG 4.46Å; L377-Q381 HydrophobicContact CG-CG 4.08Å; L377-Q381 PolarHBondContact O-N 2.93Å; L377-Q381 VanDerWaalsContact O-N 3.09Å
378	T	90.6	Very high	89.1	Confident	19 Å²	19	35.5 Å²	35.5	12%	0.117	20%	0.197	C	C	.	.	H	α-helix	trans	-56.9	-37.8	-172.4	61.7	0	0	0	0	114.7	F375 L376 V380 Q381 K382	F375-T378 WeakPolarHBondContact O-CB 3.24Å; F375-T378 WeakPolarHBondContact O-CG2 3.29Å; F375-T378 PolarHBondContact O-N 3Å; F375-T378 VanDerWaalsContact O-N 3.15Å; F375-T378 PolarHBondContact O-OG1 3.26Å; L376-T378 VanDerWaalsContact C-N 3.35Å; T378-V380 PolarHBondContact O-N 3.06Å; T378-Q381 PolarHBondContact O-N 3.02Å; T378-K382 WeakPolarHBondContact O-CB 3.13Å; T378-K382 PolarHBondContact O-N 2.93Å
379	P	94.4	Very high	89.5	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-67.7	-36.1	176.7	-21.4	36.2	0	0	0	113.1	Y255 L259 I289 I292 Y331 Y334 L377 Q381 K382 I383	Y255-P379 HydrophobicContact CE2-CG 4.34Å; Y255-P379 WeakPolarHBondContact OH-CA 3.45Å; Y255-P379 WeakPolarHBondContact OH-CB 3.4Å; L259-P379 HydrophobicContact CD2-CG 4.11Å; I289-P379 HydrophobicContact CD1-CG 4.43Å; I292-P379 HydrophobicContact CD1-CB 4.17Å; Y331-P379 HydrophobicContact CD1-CB 4.13Å; Y331-P379 WeakPolarHBondContact CD1-O 3.33Å; Y331-P379 HydrophobicContact CE1-CB 3.78Å; Y331-P379 WeakPolarHBondContact CE1-O 3.35Å; Y334-P379 HydrophobicContact CD1-CB 3.74Å; Y334-P379 HydrophobicContact CD1-CG 4.14Å; Y334-P379 HydrophobicContact CE1-CB 3.62Å; Y334-P379 HydrophobicContact CE1-CG 3.54Å; Y334-P379 HydrophobicContact CG-CB 4.49Å; L377-P379 VanDerWaalsContact C-CD 3.49Å; P379-Q381 VanDerWaalsContact C-N 3.3Å; P379-Q381 PolarHBondContact O-N 3.41Å; P379-K382 PolarHBondContact O-N 3.23Å; P379-I383 PolarHBondContact O-N 2.98Å; P379-I383 VanDerWaalsContact O-N 3.12Å
380	V	88.9	Confident	89.9	Confident	16 Å²	16	27.5 Å²	27.5	10%	0.097	16%	0.155	C	C	.	.	H	α-helix	trans	-64.9	-38.4	175.8	-175	0	0	0	0	110.3	Y334 H338 L377 T378 I383 C384	Y334-V380 HydrophobicContact CD1-CG2 4.04Å; Y334-V380 HydrophobicContact CE1-CG2 4.04Å; H338-V380 HydrophobicContact CB-CG2 4.3Å; L377-V380 HydrophobicContact CD1-CB 4.08Å; L377-V380 HydrophobicContact CD1-CG1 4.42Å; L377-V380 HydrophobicContact CD1-CG2 4.38Å; L377-V380 WeakPolarHBondContact O-CB 3.33Å; L377-V380 PolarHBondContact O-N 3.3Å; T378-V380 PolarHBondContact O-N 3.06Å; V380-I383 WeakPolarHBondContact O-CG2 3.17Å; V380-C384 PolarHBondContact O-SG 3.14Å; V380-C384 VanDerWaalsContact O-SG 3.37Å
381	Q	85.5	Confident	90.5	Very high	81 Å²	81	27.6 Å²	27.6	38%	0.379	16%	0.16	S	C	.	.	H	α-helix	trans	-70.2	-45	175.3	-68.5	171.8	-23.2	0	0	111.8	L377 T378 P379 I383 C384 K385	L377-Q381 HydrophobicContact CD2-CG 4.46Å; L377-Q381 HydrophobicContact CG-CG 4.08Å; L377-Q381 PolarHBondContact O-N 2.93Å; L377-Q381 VanDerWaalsContact O-N 3.09Å; T378-Q381 PolarHBondContact O-N 3.02Å; P379-Q381 VanDerWaalsContact C-N 3.3Å; P379-Q381 PolarHBondContact O-N 3.41Å; Q381-I383 PolarHBondContact O-N 3.46Å; Q381-C384 PolarHBondContact O-N 3.12Å; Q381-K385 WeakPolarHBondContact O-CG 3.28Å; Q381-K385 PolarHBondContact O-N 2.99Å; Q381-K385 VanDerWaalsContact O-N 3.14Å
382	K	92.6	Very high	90.7	Very high	11 Å²	11	26.6 Å²	26.6	5%	0.048	15%	0.149	C	C	.	.	H	α-helix	trans	-62.7	-43.3	-174.6	-176.2	60.7	165.1	167.3	0	111.8	E252 Y255 T378 P379 C384 K385 Y386	E252-K382 WeakPolarHBondContact OE2-CE 3.01Å; E252-K382 IonicContact OE2-NZ 3.91Å; E252-K382 PolarHBondContact OE2-NZ 3.39Å; Y255-K382 HydrophobicContact CD1-CB 4.44Å; Y255-K382 HydrophobicContact CD1-CD 4.22Å; Y255-K382 HydrophobicContact CD1-CG 3.73Å; Y255-K382 HydrophobicContact CD2-CB 4.23Å; Y255-K382 HydrophobicContact CD2-CG 4.32Å; Y255-K382 HydrophobicContact CE1-CB 4.18Å; Y255-K382 HydrophobicContact CE1-CG 3.68Å; Y255-K382 HydrophobicContact CE2-CB 3.98Å; Y255-K382 HydrophobicContact CE2-CG 4.3Å; Y255-K382 HydrophobicContact CG-CB 4.46Å; Y255-K382 HydrophobicContact CG-CD 4.3Å; Y255-K382 HydrophobicContact CG-CG 4.04Å; T378-K382 WeakPolarHBondContact O-CB 3.13Å; T378-K382 PolarHBondContact O-N 2.93Å; P379-K382 PolarHBondContact O-N 3.23Å; K382-C384 PolarHBondContact O-N 3.41Å; K382-K385 WeakPolarHBondContact O-CB 3.31Å; K382-K385 PolarHBondContact O-N 3.28Å; K382-Y386 HydrophobicContact CD-CE1 4.09Å; K382-Y386 HydrophobicContact CD-CE2 4.49Å; K382-Y386 VanDerWaalsContact CE-CE1 3.4Å; K382-Y386 VanDerWaalsContact CE-CZ 3.49Å; K382-Y386 VanDerWaalsContact CE-OH 3.29Å; K382-Y386 WeakPolarHBondContact CE-OH 3.4Å; K382-Y386 HydrophobicContact CG-CE1 4.35Å; K382-Y386 HydrophobicContact CG-CE2 3.93Å; K382-Y386 WeakPolarHBondContact O-CD2 3.38Å; K382-Y386 PolarHBondContact O-N 3.25Å
383	I	90.3	Very high	90.8	Very high	2 Å²	2	26.4 Å²	26.4	1%	0.01	15%	0.148	C	C	.	.	H	α-helix	trans	-62.7	-32.6	-179.9	-162.4	57.6	0	0	0	112.6	F328 Y331 P379 V380 Q381 Y386 M414 V417 I421	F328-I383 HydrophobicContact CB-CD1 4.27Å; F328-I383 HydrophobicContact CD1-CD1 3.92Å; F328-I383 HydrophobicContact CG-CD1 4.42Å; Y331-I383 HydrophobicContact CD1-CB 3.73Å; Y331-I383 HydrophobicContact CD1-CD1 4.34Å; Y331-I383 HydrophobicContact CD1-CG1 4.15Å; Y331-I383 HydrophobicContact CD1-CG2 4.27Å; Y331-I383 HydrophobicContact CD2-CD1 4.16Å; Y331-I383 HydrophobicContact CE1-CB 4.22Å; Y331-I383 HydrophobicContact CG-CB 4.16Å; Y331-I383 HydrophobicContact CG-CD1 4.02Å; Y331-I383 HydrophobicContact CG-CG1 4.05Å; P379-I383 PolarHBondContact O-N 2.98Å; P379-I383 VanDerWaalsContact O-N 3.12Å; V380-I383 WeakPolarHBondContact O-CG2 3.17Å; Q381-I383 PolarHBondContact O-N 3.46Å; I383-Y386 HydrophobicContact CD1-CD2 4.03Å; I383-Y386 HydrophobicContact CD1-CE2 4.12Å; I383-M414 HydrophobicContact CD1-CE 3.85Å; I383-V417 HydrophobicContact CD1-CG1 3.83Å; I383-V417 HydrophobicContact CG1-CG1 4.2Å; I383-I421 HydrophobicContact CB-CD1 4.39Å; I383-I421 HydrophobicContact CD1-CD1 4.43Å; I383-I421 HydrophobicContact CG1-CD1 3.45Å; I383-I421 VanDerWaalsContact CG1-CD1 3.45Å; I383-I421 HydrophobicContact CG2-CD1 4.1Å
384	C	85.1	Confident	91.1	Very high	57 Å²	57	24.1 Å²	24.1	39%	0.385	14%	0.136	S	C	.	.	H	α-helix	trans	-77.7	-19.6	174.8	-63.2	0	0	0	0	113.5	V380 Q381 K382	V380-C384 PolarHBondContact O-SG 3.14Å; V380-C384 VanDerWaalsContact O-SG 3.37Å; Q381-C384 PolarHBondContact O-N 3.12Å; K382-C384 PolarHBondContact O-N 3.41Å
385	K	86.8	Confident	91.4	Very high	75 Å²	75	27.4 Å²	27.4	33%	0.326	15%	0.145	S	C	.	.	H	α-helix	trans	-81.3	-29.9	-179.1	-76.9	178.5	178.4	-171.5	0	113.2	Q381 K382 L388 Q389	Q381-K385 WeakPolarHBondContact O-CG 3.28Å; Q381-K385 PolarHBondContact O-N 2.99Å; Q381-K385 VanDerWaalsContact O-N 3.14Å; K382-K385 WeakPolarHBondContact O-CB 3.31Å; K382-K385 PolarHBondContact O-N 3.28Å; K385-L388 WeakPolarHBondContact O-CB 3.43Å; K385-L388 PolarHBondContact O-N 3.41Å; K385-Q389 PolarHBondContact O-N 3.04Å
386	Y	94.5	Very high	91.5	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-57.2	-44.6	-175.9	-63.3	-62.4	0	0	0	114.4	Q296 F299 F321 F328 K382 I383 L388 Q389 L390 M414	Q296-Y386 PolarHBondContact NE2-OH 3.48Å; F299-Y386 HydrophobicContact CE1-CE1 4.39Å; F321-Y386 AromaticContact CE1-CD1 3.58Å; F321-Y386 HydrophobicContact CE1-CD1 3.58Å; F321-Y386 HydrophobicContact CE1-CE1 4.01Å; F321-Y386 HydrophobicContact CE1-CG 4.05Å; F321-Y386 HydrophobicContact CZ-CD1 4.02Å; F321-Y386 HydrophobicContact CZ-CE1 4.39Å; F328-Y386 HydrophobicContact CD1-CE2 4.18Å; F328-Y386 HydrophobicContact CE1-CD2 4.31Å; F328-Y386 AromaticContact CE1-CE2 3.63Å; F328-Y386 HydrophobicContact CE1-CE2 3.63Å; F328-Y386 AromaticContact CE1-CZ 3.9Å; F328-Y386 HydrophobicContact CZ-CE2 4.49Å; K382-Y386 HydrophobicContact CD-CE1 4.09Å; K382-Y386 HydrophobicContact CD-CE2 4.49Å; K382-Y386 VanDerWaalsContact CE-CE1 3.4Å; K382-Y386 VanDerWaalsContact CE-CZ 3.49Å; K382-Y386 VanDerWaalsContact CE-OH 3.29Å; K382-Y386 WeakPolarHBondContact CE-OH 3.4Å; K382-Y386 HydrophobicContact CG-CE1 4.35Å; K382-Y386 HydrophobicContact CG-CE2 3.93Å; K382-Y386 WeakPolarHBondContact O-CD2 3.38Å; K382-Y386 PolarHBondContact O-N 3.25Å; I383-Y386 HydrophobicContact CD1-CD2 4.03Å; I383-Y386 HydrophobicContact CD1-CE2 4.12Å; Y386-L388 VanDerWaalsContact C-N 3.26Å; Y386-L388 PolarHBondContact O-N 2.86Å; Y386-Q389 PolarHBondContact O-N 3.24Å; Y386-L390 WeakPolarHBondContact O-CB 3.35Å; Y386-L390 WeakPolarHBondContact O-CG 3.34Å; Y386-L390 PolarHBondContact O-N 3.42Å; Y386-M414 HydrophobicContact CD2-CE 3.34Å; Y386-M414 HydrophobicContact CE2-CE 4.1Å; Y386-M414 HydrophobicContact CG-CE 3.78Å
387	P	91.1	Very high	91.5	Very high	15 Å²	15	27.8 Å²	27.8	10%	0.097	15%	0.147	C	C	.	.	H	α-helix	trans	-59	-37.6	175.8	-24.1	35.1	0	0	0	112.7	A391 Y411 M414 A418	P387-A391 VanDerWaalsContact O-CB 3.28Å; P387-A391 WeakPolarHBondContact O-CB 3.44Å; P387-A391 PolarHBondContact O-N 3.12Å; P387-Y411 HydrophobicContact CB-CE2 4.33Å; P387-Y411 WeakPolarHBondContact O-CD2 3.42Å; P387-Y411 WeakPolarHBondContact O-CE2 3.42Å; P387-M414 HydrophobicContact CG-CB 4.13Å; P387-A418 HydrophobicContact CG-CB 4.46Å
388	L	88.6	Confident	91.7	Very high	66 Å²	66	28.5 Å²	28.5	35%	0.346	15%	0.152	S	C	.	.	H	α-helix	trans	-69.9	-39.2	179.4	-54.6	178.1	0	0	0	112.1	L155 K385 Y386 E392	L155-L388 HydrophobicContact CD2-CD1 3.79Å; K385-L388 WeakPolarHBondContact O-CB 3.43Å; K385-L388 PolarHBondContact O-N 3.41Å; Y386-L388 VanDerWaalsContact C-N 3.26Å; Y386-L388 PolarHBondContact O-N 2.86Å; L388-E392 PolarHBondContact O-N 3.49Å; L388-E392 VanDerWaalsContact O-N 3.17Å
389	Q	91.1	Very high	91.9	Very high	7 Å²	7	34.6 Å²	34.6	3%	0.033	18%	0.18	C	C	.	.	H	α-helix	trans	-69.1	-41.7	177.1	-68.6	-178.2	-54.6	0	0	111.3	I248 T251 K385 Y386 E392 L393	I248-Q389 HydrophobicContact CD1-CB 4.22Å; I248-Q389 HydrophobicContact CG1-CB 4.02Å; I248-Q389 HydrophobicContact CG1-CG 4.46Å; T251-Q389 PolarHBondContact OG1-NE2 3.07Å; T251-Q389 VanDerWaalsContact OG1-NE2 3.16Å; K385-Q389 PolarHBondContact O-N 3.04Å; Y386-Q389 PolarHBondContact O-N 3.24Å; Q389-E392 PolarHBondContact O-N 3.29Å; Q389-L393 WeakPolarHBondContact O-CB 3.44Å; Q389-L393 PolarHBondContact O-N 3.48Å
390	L	96.1	Very high	91.8	Very high	1 Å²	1	42.1 Å²	42.1	1%	0.005	22%	0.215	C	C	.	.	H	α-helix	trans	-69.8	-35.6	177.7	-71.1	168.2	0	0	0	112.5	F321 Y386 L393 L394 A410 Y411 M414	F321-L390 HydrophobicContact CD1-CD1 4.09Å; F321-L390 HydrophobicContact CD2-CD2 4.06Å; F321-L390 HydrophobicContact CE1-CD1 4.18Å; F321-L390 HydrophobicContact CE2-CD2 3.92Å; F321-L390 HydrophobicContact CG-CD1 4.29Å; F321-L390 HydrophobicContact CZ-CD1 4.48Å; F321-L390 HydrophobicContact CZ-CD2 4.28Å; F321-L390 HydrophobicContact CZ-CG 4.49Å; Y386-L390 WeakPolarHBondContact O-CB 3.35Å; Y386-L390 WeakPolarHBondContact O-CG 3.34Å; Y386-L390 PolarHBondContact O-N 3.42Å; L390-L393 PolarHBondContact O-N 3.38Å; L390-L394 VanDerWaalsContact O-CB 3.31Å; L390-L394 WeakPolarHBondContact O-CB 3.24Å; L390-L394 PolarHBondContact O-N 3.45Å; L390-A410 HydrophobicContact CD1-CB 4.12Å; L390-A410 HydrophobicContact CD2-CB 4.35Å; L390-Y411 HydrophobicContact CB-CD2 4.25Å; L390-M414 HydrophobicContact CD1-CB 4.02Å; L390-M414 HydrophobicContact CD1-CG 3.63Å
391	A	93.2	Very high	92.1	Very high	37 Å²	37	43 Å²	43	31%	0.306	22%	0.218	S	C	.	.	H	α-helix	trans	-62.7	-46.9	173	0	0	0	0	0	111.8	P387 L393 L394 K395 Y411	P387-A391 VanDerWaalsContact O-CB 3.28Å; P387-A391 WeakPolarHBondContact O-CB 3.44Å; P387-A391 PolarHBondContact O-N 3.12Å; A391-L393 VanDerWaalsContact C-N 3.31Å; A391-L393 PolarHBondContact O-N 3.37Å; A391-L394 PolarHBondContact O-N 2.87Å; A391-K395 PolarHBondContact O-N 2.9Å; A391-Y411 HydrophobicContact CB-CD2 4.03Å; A391-Y411 HydrophobicContact CB-CE2 3.7Å
392	E	91.6	Very high	92.6	Very high	20 Å²	20	41.4 Å²	41.4	9%	0.093	22%	0.224	C	C	.	.	H	α-helix	trans	-62.5	-40.9	176.9	-168.8	67.5	-168.8	0	0	110.7	V244 L388 Q389 K395 Y396	V244-E392 HydrophobicContact CG1-CB 4.46Å; V244-E392 HydrophobicContact CG1-CG 4.46Å; V244-E392 HydrophobicContact CG2-CG 3.74Å; L388-E392 PolarHBondContact O-N 3.49Å; L388-E392 VanDerWaalsContact O-N 3.17Å; Q389-E392 PolarHBondContact O-N 3.29Å; E392-K395 WeakPolarHBondContact O-CB 3.41Å; E392-K395 PolarHBondContact O-N 3.09Å; E392-Y396 HydrophobicContact CG-CE2 3.98Å; E392-Y396 WeakPolarHBondContact O-CD2 3.39Å; E392-Y396 WeakPolarHBondContact OE1-CE2 3.02Å; E392-Y396 PolarHBondContact OE1-OH 3.31Å
393	L	95.2	Very high	92.8	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-62.7	-45.3	175.6	-176.6	60.7	0	0	0	111.4	R241 V244 I245 I248 I317 Q389 L390 A391 K395 Y396 T397 I407	R241-L393 HydrophobicContact CG-CD1 3.9Å; V244-L393 HydrophobicContact CB-CD1 4.29Å; V244-L393 HydrophobicContact CG1-CB 3.8Å; V244-L393 HydrophobicContact CG1-CD1 4.08Å; I245-L393 HydrophobicContact CD1-CD1 3.59Å; I245-L393 HydrophobicContact CD1-CD2 3.78Å; I245-L393 HydrophobicContact CD1-CG 4.36Å; I245-L393 HydrophobicContact CG1-CD1 3.85Å; I248-L393 HydrophobicContact CD1-CD2 4.24Å; I317-L393 HydrophobicContact CD1-CD2 3.95Å; I317-L393 HydrophobicContact CG1-CD2 4.06Å; Q389-L393 WeakPolarHBondContact O-CB 3.44Å; Q389-L393 PolarHBondContact O-N 3.48Å; L390-L393 PolarHBondContact O-N 3.38Å; A391-L393 VanDerWaalsContact C-N 3.31Å; A391-L393 PolarHBondContact O-N 3.37Å; L393-K395 VanDerWaalsContact C-N 3.28Å; L393-K395 PolarHBondContact O-N 3.36Å; L393-Y396 PolarHBondContact O-N 3.05Å; L393-T397 PolarHBondContact O-N 3.44Å; L393-T397 PolarHBondContact O-OG1 3.47Å; L393-I407 HydrophobicContact CD2-CD1 3.77Å; L393-I407 HydrophobicContact CD2-CG1 4.02Å; L393-I407 HydrophobicContact CD2-CG2 4.36Å; L393-I407 HydrophobicContact CG-CD1 3.95Å; L393-I407 HydrophobicContact CG-CG2 4.41Å
394	L	95.4	Very high	93.2	Very high	35 Å²	35	43.3 Å²	43.3	18%	0.183	23%	0.231	C	C	.	.	H	α-helix	trans	-59.6	-38.1	179.1	-173.6	61.5	0	0	0	111.7	L390 A391 Y396 T397 Y404 I407 K408	L390-L394 VanDerWaalsContact O-CB 3.31Å; L390-L394 WeakPolarHBondContact O-CB 3.24Å; L390-L394 PolarHBondContact O-N 3.45Å; A391-L394 PolarHBondContact O-N 2.87Å; L394-Y396 VanDerWaalsContact C-N 3.28Å; L394-Y396 PolarHBondContact O-N 3.06Å; L394-T397 PolarHBondContact O-N 3.12Å; L394-T397 VanDerWaalsContact O-N 3.12Å; L394-Y404 HydrophobicContact CD1-CD2 3.94Å; L394-Y404 HydrophobicContact CD1-CE2 3.63Å; L394-I407 HydrophobicContact CB-CG2 3.93Å; L394-I407 HydrophobicContact CD1-CB 4.5Å; L394-I407 HydrophobicContact CD1-CG2 4.06Å; L394-K408 HydrophobicContact CD1-CB 4.2Å; L394-K408 HydrophobicContact CD2-CB 4.46Å; L394-K408 HydrophobicContact CD2-CG 4.47Å
395	K	93.4	Very high	93.7	Very high	87 Å²	87	44.1 Å²	44.1	38%	0.378	24%	0.237	S	C	.	.	H	α-helix	trans	-54.4	-42.1	176.3	-173.6	-175.6	173.3	-160	0	112.2	E208 A391 E392 L393	E208-K395 WeakPolarHBondContact OE1-CE 3.4Å; E208-K395 IonicContact OE1-NZ 2.78Å; E208-K395 PolarHBondContact OE1-NZ 2.93Å; E208-K395 IonicContact OE2-NZ 3.78Å; E208-K395 PolarHBondContact OE2-NZ 3.22Å; A391-K395 PolarHBondContact O-N 2.9Å; E392-K395 WeakPolarHBondContact O-CB 3.41Å; E392-K395 PolarHBondContact O-N 3.09Å; L393-K395 VanDerWaalsContact C-N 3.28Å; L393-K395 PolarHBondContact O-N 3.36Å
396	Y	93.5	Very high	94.3	Very high	11 Å²	11	43 Å²	43	4%	0.043	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.9	12.4	-179.5	-48.4	-71	0	0	0	114.3	N206 K237 M240 V244 E392 L393 L394	N206-Y396 WeakPolarHBondContact ND2-CE2 3.31Å; N206-Y396 PolarHBondContact ND2-OH 3.36Å; K237-Y396 WeakPolarHBondContact CE-O 3.47Å; K237-Y396 HydrophobicContact CG-CD1 4.46Å; M240-Y396 HydrophobicContact CB-CD1 3.45Å; M240-Y396 VanDerWaalsContact CB-CD1 3.45Å; M240-Y396 HydrophobicContact CB-CD2 3.96Å; M240-Y396 HydrophobicContact CB-CE1 3.8Å; M240-Y396 HydrophobicContact CB-CE2 4.26Å; M240-Y396 HydrophobicContact CB-CG 3.55Å; M240-Y396 HydrophobicContact CG-CD1 3.99Å; M240-Y396 HydrophobicContact CG-CE1 3.94Å; V244-Y396 HydrophobicContact CG2-CD2 4.04Å; V244-Y396 HydrophobicContact CG2-CE2 4.22Å; E392-Y396 HydrophobicContact CG-CE2 3.98Å; E392-Y396 WeakPolarHBondContact O-CD2 3.39Å; E392-Y396 WeakPolarHBondContact OE1-CE2 3.02Å; E392-Y396 PolarHBondContact OE1-OH 3.31Å; L393-Y396 PolarHBondContact O-N 3.05Å; L394-Y396 VanDerWaalsContact C-N 3.28Å; L394-Y396 PolarHBondContact O-N 3.06Å
397	T	94.4	Very high	94.4	Very high	5 Å²	5	43 Å²	43	3%	0.031	24%	0.235	C	C	.	.			trans	-99.5	129.5	174.6	-48.3	0	0	0	0	109.7	R241 L393 L394 H401 Y404 I407	R241-T397 PolarHBondContact NH1-OG1 3.49Å; L393-T397 PolarHBondContact O-N 3.44Å; L393-T397 PolarHBondContact O-OG1 3.47Å; L394-T397 PolarHBondContact O-N 3.12Å; L394-T397 VanDerWaalsContact O-N 3.12Å; T397-H401 HydrophobicContact CG2-CB 3.73Å; T397-Y404 HydrophobicContact CG2-CD2 3.94Å; T397-Y404 HydrophobicContact CG2-CG 4.5Å; T397-I407 HydrophobicContact CG2-CD1 4.04Å
398	T	94.1	Very high	94.7	Very high	53 Å²	53	47.5 Å²	47.5	33%	0.325	25%	0.253	S	S	.	.			trans	-81.6	159	174.6	75.7	0	0	0	0	110.3	K237 E400 H401 Y404	K237-T398 HydrophobicContact CD-CG2 4.11Å; T398-E400 WeakPolarHBondContact CB-OE2 3.5Å; T398-E400 PolarHBondContact O-N 3.34Å; T398-E400 PolarHBondContact OG1-OE2 3.27Å; T398-H401 WeakPolarHBondContact O-CB 3.12Å; T398-H401 PolarHBondContact O-N 3.41Å; T398-Y404 WeakPolarHBondContact O-CB 3.41Å; T398-Y404 VanDerWaalsContact O-CD2 3.26Å; T398-Y404 WeakPolarHBondContact O-CD2 3.44Å
399	Q	93.8	Very high	95.2	Very high	148 Å²	148	46.5 Å²	46.5	69%	0.692	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-21.9	-177.1	-67	-176.4	5.8	0	0	112.5	H401 Y404	Q399-H401 VanDerWaalsContact C-N 3.33Å; Q399-Y404 HydrophobicContact CG-CE1 4.04Å; Q399-Y404 HydrophobicContact CG-CE2 4.08Å
400	E	92.8	Very high	95.5	Very high	158 Å²	158	46.2 Å²	46.2	74%	0.738	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-13.5	179	-49.7	74.9	-161.7	0	0	112.5	T398	T398-E400 WeakPolarHBondContact CB-OE2 3.5Å; T398-E400 PolarHBondContact O-N 3.34Å; T398-E400 PolarHBondContact OG1-OE2 3.27Å
401	H	95.6	Very high	95.6	Very high	33 Å²	33	48.5 Å²	48.5	15%	0.153	26%	0.262	C	S	.	.	S	Bend	trans	-69.1	133.3	178.9	-169.4	-63.8	0	0	0	110.4	R241 H313 T397 T398 Q399 D403 Y404	R241-H401 PolarHBondContact NE-NE2 2.9Å; R241-H401 PolarHBondContact NH2-CE1 3.43Å; R241-H401 PolarHBondContact NH2-NE2 3.23Å; H313-H401 PolarHBondContact O-NE2 2.89Å; H313-H401 VanDerWaalsContact O-NE2 3.16Å; T397-H401 HydrophobicContact CG2-CB 3.73Å; T398-H401 WeakPolarHBondContact O-CB 3.12Å; T398-H401 PolarHBondContact O-N 3.41Å; Q399-H401 VanDerWaalsContact C-N 3.33Å; H401-D403 VanDerWaalsContact C-N 3.26Å; H401-D403 WeakPolarHBondContact ND1-CB 3.2Å; H401-D403 PolarHBondContact ND1-N 3.45Å; H401-D403 PolarHBondContact O-N 3.44Å; H401-Y404 VanDerWaalsContact O-CB 3.3Å; H401-Y404 WeakPolarHBondContact O-CB 3.32Å; H401-Y404 PolarHBondContact O-N 2.78Å
402	G	95.4	Very high	95.7	Very high	49 Å²	49	50.4 Å²	50.4	51%	0.505	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-39	-177.2	0	0	0	0	0	114	E316 Y404	E316-G402 WeakPolarHBondContact OE1-CA 3.33Å; G402-Y404 PolarHBondContact O-N 2.82Å
403	D	96.7	Very high	95.8	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-5.6	175.8	-152.8	29.1	0	0	0	116.6	R241 E316 I317 G318 H401 S405 N406 I407	R241-D403 IonicContact NH2-OD2 2.68Å; E316-D403 VanDerWaalsContact CA-CG 3.42Å; E316-D403 WeakPolarHBondContact CA-OD2 3.42Å; E316-D403 HydrophobicContact CB-CB 4Å; E316-D403 HydrophobicContact CG-CB 4.04Å; E316-D403 PolarHBondContact OE1-N 3.47Å; I317-D403 PolarHBondContact N-OD2 3.15Å; G318-D403 WeakPolarHBondContact CA-OD1 3.37Å; G318-D403 PolarHBondContact N-OD1 3.32Å; G318-D403 PolarHBondContact N-OD2 2.75Å; H401-D403 VanDerWaalsContact C-N 3.26Å; H401-D403 WeakPolarHBondContact ND1-CB 3.2Å; H401-D403 PolarHBondContact ND1-N 3.45Å; H401-D403 PolarHBondContact O-N 3.44Å; D403-S405 PolarHBondContact O-N 3.15Å; D403-N406 PolarHBondContact O-N 2.9Å; D403-N406 WeakPolarHBondContact OD1-CB 3.38Å; D403-I407 HydrophobicContact CB-CD1 3.9Å; D403-I407 HydrophobicContact CB-CG1 4.33Å; D403-I407 VanDerWaalsContact O-CG1 3.29Å; D403-I407 WeakPolarHBondContact O-CG1 3.18Å; D403-I407 PolarHBondContact O-N 3.01Å; D403-I407 WeakPolarHBondContact OD2-CD1 3.39Å; D403-I407 VanDerWaalsContact OD2-CG1 3.27Å; D403-I407 WeakPolarHBondContact OD2-CG1 3.48Å
404	Y	97.7	Very high	95.8	Very high	52 Å²	52	49.8 Å²	49.8	20%	0.204	26%	0.262	C	S	.	.	H	α-helix	trans	-59	-47.7	-172.7	179.9	-93.5	0	0	0	113.2	L394 T397 T398 Q399 H401 G402 N406 I407 K408	L394-Y404 HydrophobicContact CD1-CD2 3.94Å; L394-Y404 HydrophobicContact CD1-CE2 3.63Å; T397-Y404 HydrophobicContact CG2-CD2 3.94Å; T397-Y404 HydrophobicContact CG2-CG 4.5Å; T398-Y404 WeakPolarHBondContact O-CB 3.41Å; T398-Y404 VanDerWaalsContact O-CD2 3.26Å; T398-Y404 WeakPolarHBondContact O-CD2 3.44Å; Q399-Y404 HydrophobicContact CG-CE1 4.04Å; Q399-Y404 HydrophobicContact CG-CE2 4.08Å; H401-Y404 VanDerWaalsContact O-CB 3.3Å; H401-Y404 WeakPolarHBondContact O-CB 3.32Å; H401-Y404 PolarHBondContact O-N 2.78Å; G402-Y404 PolarHBondContact O-N 2.82Å; Y404-N406 VanDerWaalsContact C-N 3.34Å; Y404-I407 PolarHBondContact O-N 3.23Å; Y404-K408 HydrophobicContact CE1-CD 4.48Å; Y404-K408 WeakPolarHBondContact O-CB 3.41Å; Y404-K408 PolarHBondContact O-N 3.2Å
405	S	97.6	Very high	95.6	Very high	75 Å²	75	50.9 Å²	50.9	52%	0.524	27%	0.265	S	S	.	.	H	α-helix	trans	-63.7	-41.6	178.9	56	0	0	0	0	111.5	D403 K408 A409	D403-S405 PolarHBondContact O-N 3.15Å; S405-K408 PolarHBondContact O-N 3.18Å; S405-A409 WeakPolarHBondContact O-CB 3.38Å; S405-A409 PolarHBondContact O-N 3.24Å
406	N	98	Very high	95.4	Very high	51 Å²	51	50.8 Å²	50.8	27%	0.273	27%	0.269	S	S	.	.	H	α-helix	trans	-66.7	-43.8	178.6	-70.4	-26.6	0	0	0	111.8	L322 D403 Y404 A409 A410	L322-N406 HydrophobicContact CD1-CB 4.33Å; D403-N406 PolarHBondContact O-N 2.9Å; D403-N406 WeakPolarHBondContact OD1-CB 3.38Å; Y404-N406 VanDerWaalsContact C-N 3.34Å; N406-A409 PolarHBondContact O-N 2.93Å; N406-A410 WeakPolarHBondContact O-CB 3.42Å; N406-A410 PolarHBondContact O-N 3.25Å
407	I	97.7	Very high	95.2	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-63.6	-43.5	176.7	-67.8	160.6	0	0	0	110.6	L393 L394 T397 D403 Y404 A409 A410 Y411	L393-I407 HydrophobicContact CD2-CD1 3.77Å; L393-I407 HydrophobicContact CD2-CG1 4.02Å; L393-I407 HydrophobicContact CD2-CG2 4.36Å; L393-I407 HydrophobicContact CG-CD1 3.95Å; L393-I407 HydrophobicContact CG-CG2 4.41Å; L394-I407 HydrophobicContact CB-CG2 3.93Å; L394-I407 HydrophobicContact CD1-CB 4.5Å; L394-I407 HydrophobicContact CD1-CG2 4.06Å; T397-I407 HydrophobicContact CG2-CD1 4.04Å; D403-I407 HydrophobicContact CB-CD1 3.9Å; D403-I407 HydrophobicContact CB-CG1 4.33Å; D403-I407 VanDerWaalsContact O-CG1 3.29Å; D403-I407 WeakPolarHBondContact O-CG1 3.18Å; D403-I407 PolarHBondContact O-N 3.01Å; D403-I407 WeakPolarHBondContact OD2-CD1 3.39Å; D403-I407 VanDerWaalsContact OD2-CG1 3.27Å; D403-I407 WeakPolarHBondContact OD2-CG1 3.48Å; Y404-I407 PolarHBondContact O-N 3.23Å; I407-A409 PolarHBondContact O-N 3.43Å; I407-A410 PolarHBondContact O-N 2.84Å; I407-Y411 WeakPolarHBondContact O-CB 3.28Å; I407-Y411 PolarHBondContact O-N 3.04Å
408	K	97.9	Very high	94.6	Very high	110 Å²	110	51.4 Å²	51.4	48%	0.478	28%	0.276	S	S	.	.	H	α-helix	trans	-61.3	-45.6	177.5	-174.3	177.1	-179.4	179.3	0	111.4	L394 Y404 S405 Y411 E412	L394-K408 HydrophobicContact CD1-CB 4.2Å; L394-K408 HydrophobicContact CD2-CB 4.46Å; L394-K408 HydrophobicContact CD2-CG 4.47Å; Y404-K408 HydrophobicContact CE1-CD 4.48Å; Y404-K408 WeakPolarHBondContact O-CB 3.41Å; Y404-K408 PolarHBondContact O-N 3.2Å; S405-K408 PolarHBondContact O-N 3.18Å; K408-Y411 PolarHBondContact O-N 3.3Å; K408-E412 PolarHBondContact O-N 3.45Å
409	A	97.7	Very high	94.1	Very high	45 Å²	45	51.5 Å²	51.5	37%	0.372	28%	0.278	S	S	.	.	H	α-helix	trans	-65.4	-41.1	175.9	0	0	0	0	0	112	L322 S405 N406 I407 Y411 E412 A413	L322-A409 HydrophobicContact CD1-CB 4.02Å; L322-A409 HydrophobicContact CD2-CB 3.91Å; S405-A409 WeakPolarHBondContact O-CB 3.38Å; S405-A409 PolarHBondContact O-N 3.24Å; N406-A409 PolarHBondContact O-N 2.93Å; I407-A409 PolarHBondContact O-N 3.43Å; A409-Y411 PolarHBondContact O-N 2.83Å; A409-E412 PolarHBondContact O-N 2.79Å; A409-A413 WeakPolarHBondContact O-CB 3.25Å; A409-A413 PolarHBondContact O-N 2.88Å
410	A	98	Very high	93.6	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-63.5	-39.9	177	0	0	0	0	0	112.1	F321 L322 L390 N406 I407 A413 M414	F321-A410 HydrophobicContact CB-CB 3.68Å; F321-A410 HydrophobicContact CG-CB 4.33Å; L322-A410 HydrophobicContact CD2-CB 4.37Å; L322-A410 HydrophobicContact CG-CB 4.33Å; L390-A410 HydrophobicContact CD1-CB 4.12Å; L390-A410 HydrophobicContact CD2-CB 4.35Å; N406-A410 WeakPolarHBondContact O-CB 3.42Å; N406-A410 PolarHBondContact O-N 3.25Å; I407-A410 PolarHBondContact O-N 2.84Å; A410-A413 PolarHBondContact O-N 2.72Å; A410-M414 WeakPolarHBondContact O-CB 3.34Å; A410-M414 WeakPolarHBondContact O-CG 3.38Å; A410-M414 PolarHBondContact O-N 3.08Å
411	Y	97.1	Very high	93.1	Very high	50 Å²	50	39.8 Å²	39.8	20%	0.196	23%	0.225	C	C	.	.	H	α-helix	trans	-58.5	-50	175.1	168.7	-107	0	0	0	111.1	P387 L390 A391 I407 K408 A409 M414 K415	P387-Y411 HydrophobicContact CB-CE2 4.33Å; P387-Y411 WeakPolarHBondContact O-CD2 3.42Å; P387-Y411 WeakPolarHBondContact O-CE2 3.42Å; L390-Y411 HydrophobicContact CB-CD2 4.25Å; A391-Y411 HydrophobicContact CB-CD2 4.03Å; A391-Y411 HydrophobicContact CB-CE2 3.7Å; I407-Y411 WeakPolarHBondContact O-CB 3.28Å; I407-Y411 PolarHBondContact O-N 3.04Å; K408-Y411 PolarHBondContact O-N 3.3Å; A409-Y411 PolarHBondContact O-N 2.83Å; Y411-M414 PolarHBondContact O-N 3.13Å; Y411-K415 VanDerWaalsContact O-CB 3.31Å; Y411-K415 WeakPolarHBondContact O-CB 3.33Å; Y411-K415 PolarHBondContact O-N 2.91Å
412	E	95.8	Very high	92.3	Very high	77 Å²	77	39.2 Å²	39.2	36%	0.36	22%	0.223	S	C	.	.	H	α-helix	trans	-64.6	-40.6	176.8	-65.9	-58.8	155	0	0	111.7	K408 A409 K415 N416	K408-E412 PolarHBondContact O-N 3.45Å; A409-E412 PolarHBondContact O-N 2.79Å; E412-K415 PolarHBondContact O-N 2.82Å; E412-N416 WeakPolarHBondContact O-CB 3.35Å; E412-N416 PolarHBondContact O-N 3.23Å; E412-N416 PolarHBondContact O-ND2 2.91Å
413	A	94.6	Very high	91.6	Very high	6 Å²	6	38.5 Å²	38.5	5%	0.05	21%	0.206	C	C	.	.	H	α-helix	trans	-59.9	-47.9	176.2	0	0	0	0	0	112.1	L322 Q325 A409 A410 N416 V417	L322-A413 HydrophobicContact CD2-CB 4.25Å; Q325-A413 HydrophobicContact CG-CB 4.24Å; A409-A413 WeakPolarHBondContact O-CB 3.25Å; A409-A413 PolarHBondContact O-N 2.88Å; A410-A413 PolarHBondContact O-N 2.72Å; A413-N416 WeakPolarHBondContact O-CB 3.4Å; A413-N416 PolarHBondContact O-N 3.45Å; A413-V417 WeakPolarHBondContact O-CG2 3.47Å; A413-V417 PolarHBondContact O-N 3.36Å
414	M	94.6	Very high	90.8	Very high	1 Å²	1	42.1 Å²	42.1	1%	0.005	22%	0.22	C	C	.	.	H	α-helix	trans	-70.8	-32	179.9	-67.5	-49.7	-64.2	0	0	112.7	F321 F328 I383 Y386 P387 L390 A410 Y411 V417 A418	F321-M414 HydrophobicContact CD1-CG 3.79Å; F321-M414 HydrophobicContact CD1-SD 3.99Å; F321-M414 HydrophobicContact CE1-CG 4.37Å; F328-M414 HydrophobicContact CD1-CE 3.9Å; F328-M414 HydrophobicContact CD2-CE 4.05Å; F328-M414 HydrophobicContact CD2-SD 3.74Å; F328-M414 HydrophobicContact CE1-CE 3.99Å; F328-M414 HydrophobicContact CE2-CE 4.14Å; F328-M414 HydrophobicContact CE2-SD 3.75Å; F328-M414 HydrophobicContact CG-CE 3.93Å; F328-M414 HydrophobicContact CG-SD 4.21Å; F328-M414 HydrophobicContact CZ-CE 4.11Å; F328-M414 HydrophobicContact CZ-SD 4.22Å; I383-M414 HydrophobicContact CD1-CE 3.85Å; Y386-M414 HydrophobicContact CD2-CE 3.34Å; Y386-M414 HydrophobicContact CE2-CE 4.1Å; Y386-M414 HydrophobicContact CG-CE 3.78Å; P387-M414 HydrophobicContact CG-CB 4.13Å; L390-M414 HydrophobicContact CD1-CB 4.02Å; L390-M414 HydrophobicContact CD1-CG 3.63Å; A410-M414 WeakPolarHBondContact O-CB 3.34Å; A410-M414 WeakPolarHBondContact O-CG 3.38Å; A410-M414 PolarHBondContact O-N 3.08Å; Y411-M414 PolarHBondContact O-N 3.13Å; M414-V417 PolarHBondContact O-N 3.39Å; M414-A418 PolarHBondContact O-N 3.32Å
415	K	90.6	Very high	89.9	Confident	57 Å²	57	41.1 Å²	41.1	25%	0.248	22%	0.217	C	C	.	.	H	α-helix	trans	-62.8	-43.7	170.1	-175.7	-179.8	173.2	-171.7	0	110.9	Y411 E412 A418 C419	Y411-K415 VanDerWaalsContact O-CB 3.31Å; Y411-K415 WeakPolarHBondContact O-CB 3.33Å; Y411-K415 PolarHBondContact O-N 2.91Å; E412-K415 PolarHBondContact O-N 2.82Å; K415-A418 PolarHBondContact O-N 2.96Å; K415-C419 WeakPolarHBondContact O-CB 3.33Å; K415-C419 PolarHBondContact O-N 3.27Å; K415-C419 PolarHBondContact O-SG 3.31Å; K415-C419 VanDerWaalsContact O-SG 3.33Å
416	N	89.6	Confident	89.1	Confident	86 Å²	86	41 Å²	41	46%	0.46	21%	0.205	S	C	.	.	H	α-helix	trans	-62.6	-42.7	175.1	-69.8	-21.3	0	0	0	111.8	E412 A413 A418 C419 L420	E412-N416 WeakPolarHBondContact O-CB 3.35Å; E412-N416 PolarHBondContact O-N 3.23Å; E412-N416 PolarHBondContact O-ND2 2.91Å; A413-N416 WeakPolarHBondContact O-CB 3.4Å; A413-N416 PolarHBondContact O-N 3.45Å; N416-A418 PolarHBondContact O-N 3.05Å; N416-C419 WeakPolarHBondContact O-CB 3.48Å; N416-C419 PolarHBondContact O-N 3.43Å; N416-L420 WeakPolarHBondContact O-CB 3.5Å; N416-L420 VanDerWaalsContact O-CG 3.24Å; N416-L420 WeakPolarHBondContact O-CG 3.31Å; N416-L420 PolarHBondContact O-N 3.04Å
417	V	89.4	Confident	88.5	Confident	10 Å²	10	38.8 Å²	38.8	6%	0.061	19%	0.193	C	C	.	.	H	α-helix	trans	-58.9	-46.3	174.4	172.4	0	0	0	0	111.6	F328 I383 A413 M414 C419 L420 I421	F328-V417 HydrophobicContact CB-CG1 3.93Å; F328-V417 HydrophobicContact CB-CG2 4.33Å; I383-V417 HydrophobicContact CD1-CG1 3.83Å; I383-V417 HydrophobicContact CG1-CG1 4.2Å; A413-V417 WeakPolarHBondContact O-CG2 3.47Å; A413-V417 PolarHBondContact O-N 3.36Å; M414-V417 PolarHBondContact O-N 3.39Å; V417-C419 VanDerWaalsContact C-N 3.35Å; V417-C419 PolarHBondContact O-N 3.21Å; V417-L420 WeakPolarHBondContact O-CB 3.41Å; V417-L420 PolarHBondContact O-N 2.96Å; V417-I421 HydrophobicContact CG1-CD1 4.08Å; V417-I421 WeakPolarHBondContact O-CG1 3.46Å; V417-I421 PolarHBondContact O-N 2.98Å
418	A	82.7	Confident	87.7	Confident	18 Å²	18	40.9 Å²	40.9	15%	0.149	20%	0.204	C	C	.	.	H	α-helix	trans	-62.8	-41.5	177	0	0	0	0	0	112	P387 M414 K415 N416 I421 N422	P387-A418 HydrophobicContact CG-CB 4.46Å; M414-A418 PolarHBondContact O-N 3.32Å; K415-A418 PolarHBondContact O-N 2.96Å; N416-A418 PolarHBondContact O-N 3.05Å; A418-I421 PolarHBondContact O-N 3.37Å; A418-N422 WeakPolarHBondContact O-CB 3.17Å; A418-N422 PolarHBondContact O-N 3.36Å; A418-N422 VanDerWaalsContact O-N 3.12Å
419	C	82.1	Confident	86.9	Confident	55 Å²	55	40.3 Å²	40.3	37%	0.372	20%	0.203	S	C	.	.	H	α-helix	trans	-61.2	-43.4	173.5	-73.7	0	0	0	0	112.2	K415 N416 V417 N422 E423	K415-C419 WeakPolarHBondContact O-CB 3.33Å; K415-C419 PolarHBondContact O-N 3.27Å; K415-C419 PolarHBondContact O-SG 3.31Å; K415-C419 VanDerWaalsContact O-SG 3.33Å; N416-C419 WeakPolarHBondContact O-CB 3.48Å; N416-C419 PolarHBondContact O-N 3.43Å; V417-C419 VanDerWaalsContact C-N 3.35Å; V417-C419 PolarHBondContact O-N 3.21Å; C419-N422 WeakPolarHBondContact O-CB 3.07Å; C419-N422 PolarHBondContact O-N 2.99Å; C419-E423 WeakPolarHBondContact O-CB 3.46Å; C419-E423 PolarHBondContact O-N 2.95Å
420	L	83.2	Confident	86.5	Confident	52 Å²	52	38.5 Å²	38.5	27%	0.272	19%	0.188	S	C	.	.	H	α-helix	trans	-61.2	-44.5	178.1	-77.6	167.7	0	0	0	112.4	N416 V417 N422 E423 R424 M569 M571	N416-L420 WeakPolarHBondContact O-CB 3.5Å; N416-L420 VanDerWaalsContact O-CG 3.24Å; N416-L420 WeakPolarHBondContact O-CG 3.31Å; N416-L420 PolarHBondContact O-N 3.04Å; V417-L420 WeakPolarHBondContact O-CB 3.41Å; V417-L420 PolarHBondContact O-N 2.96Å; L420-N422 VanDerWaalsContact C-N 3.34Å; L420-E423 PolarHBondContact O-N 3.38Å; L420-R424 WeakPolarHBondContact O-CB 3.39Å; L420-R424 PolarHBondContact O-N 3.09Å; L420-M569 HydrophobicContact CD2-CB 3.61Å; L420-M569 HydrophobicContact CD2-CE 4.4Å; L420-M569 HydrophobicContact CD2-CG 3.65Å; L420-M569 HydrophobicContact CD2-SD 3.32Å; L420-M569 WeakPolarHBondContact CD2-SD 3.34Å; L420-M569 HydrophobicContact CG-SD 4.34Å; L420-M571 HydrophobicContact CD2-CE 4.22Å; L420-M571 HydrophobicContact CD2-SD 4.32Å
421	I	83.8	Confident	86.2	Confident	8 Å²	8	38.7 Å²	38.7	4%	0.041	19%	0.188	C	C	.	.	H	α-helix	trans	-62	-46.3	177.6	-68	171.7	0	0	0	110.3	C335 I383 V417 A418 R424 K425	C335-I421 HydrophobicContact CB-CG2 3.6Å; I383-I421 HydrophobicContact CB-CD1 4.39Å; I383-I421 HydrophobicContact CD1-CD1 4.43Å; I383-I421 HydrophobicContact CG1-CD1 3.45Å; I383-I421 VanDerWaalsContact CG1-CD1 3.45Å; I383-I421 HydrophobicContact CG2-CD1 4.1Å; V417-I421 HydrophobicContact CG1-CD1 4.08Å; V417-I421 WeakPolarHBondContact O-CG1 3.46Å; V417-I421 PolarHBondContact O-N 2.98Å; A418-I421 PolarHBondContact O-N 3.37Å; I421-R424 PolarHBondContact O-N 3.4Å; I421-K425 PolarHBondContact O-N 3Å
422	N	79.1	Confident	85.7	Confident	22 Å²	22	39 Å²	39	12%	0.118	19%	0.194	C	C	.	.	H	α-helix	trans	-59.6	-48.8	175.5	168.6	41.5	0	0	0	112.1	A418 C419 L420 R424 K425 R426 V627	A418-N422 WeakPolarHBondContact O-CB 3.17Å; A418-N422 PolarHBondContact O-N 3.36Å; A418-N422 VanDerWaalsContact O-N 3.12Å; C419-N422 WeakPolarHBondContact O-CB 3.07Å; C419-N422 PolarHBondContact O-N 2.99Å; L420-N422 VanDerWaalsContact C-N 3.34Å; N422-R424 VanDerWaalsContact C-N 3.32Å; N422-R424 PolarHBondContact O-N 2.85Å; N422-K425 WeakPolarHBondContact O-CB 3.23Å; N422-K425 PolarHBondContact O-N 3.3Å; N422-R426 PolarHBondContact O-N 3.22Å; N422-V627 HydrophobicContact CB-CG1 3.77Å; N422-V627 HydrophobicContact CB-CG2 4.08Å; N422-V627 WeakPolarHBondContact ND2-CG2 3.5Å; N422-V627 WeakPolarHBondContact OD1-CG1 3.42Å; N422-V627 VanDerWaalsContact OD1-CG2 3.27Å; N422-V627 WeakPolarHBondContact OD1-CG2 3.46Å
423	E	79.7	Confident	85.4	Confident	33 Å²	33	39.7 Å²	39.7	15%	0.154	20%	0.195	C	C	.	.	H	α-helix	trans	-65.1	-39.3	-177	-166.6	60.2	-130.3	0	0	111	C419 L420 K425 R426 K427 M571	C419-E423 WeakPolarHBondContact O-CB 3.46Å; C419-E423 PolarHBondContact O-N 2.95Å; L420-E423 PolarHBondContact O-N 3.38Å; E423-K425 VanDerWaalsContact C-N 3.32Å; E423-K425 PolarHBondContact O-N 2.92Å; E423-R426 VanDerWaalsContact CD-NH1 3.3Å; E423-R426 WeakPolarHBondContact O-CB 3.35Å; E423-R426 PolarHBondContact O-N 3.41Å; E423-R426 IonicContact OE1-CZ 2.89Å; E423-R426 IonicContact OE1-NE 3.41Å; E423-R426 IonicContact OE1-NH1 2.94Å; E423-R426 PolarHBondContact OE1-NH1 3.14Å; E423-R426 VanDerWaalsContact OE1-NH1 3.11Å; E423-R426 IonicContact OE2-CZ 3.43Å; E423-R426 IonicContact OE2-NE 3.65Å; E423-R426 IonicContact OE2-NH1 3.86Å; E423-R426 PolarHBondContact OE2-NH1 3.44Å; E423-R426 IonicContact OE2-NH2 2.71Å; E423-R426 PolarHBondContact OE2-NH2 3.18Å; E423-K427 WeakPolarHBondContact O-CG 3.43Å; E423-K427 PolarHBondContact O-N 3.5Å; E423-M571 HydrophobicContact CB-CE 3.49Å; E423-M571 VanDerWaalsContact CB-CE 3.49Å; E423-M571 HydrophobicContact CG-CE 3.62Å
424	R	80.1	Confident	85.4	Confident	77 Å²	77	39.5 Å²	39.5	29%	0.291	19%	0.194	S	C	.	.	H	α-helix	trans	-62.3	-40.8	174.3	-167.5	173.1	-63.1	-173.7	-12	111.7	S332 N336 L420 I421 N422 K427 L428 M571	S332-R424 WeakPolarHBondContact OG-CD 3.48Å; S332-R424 PolarHBondContact OG-NE 3.27Å; N336-R424 WeakPolarHBondContact ND2-CD 3.34Å; N336-R424 WeakPolarHBondContact ND2-CG 3.47Å; L420-R424 WeakPolarHBondContact O-CB 3.39Å; L420-R424 PolarHBondContact O-N 3.09Å; I421-R424 PolarHBondContact O-N 3.4Å; N422-R424 VanDerWaalsContact C-N 3.32Å; N422-R424 PolarHBondContact O-N 2.85Å; R424-K427 PolarHBondContact O-N 3.22Å; R424-L428 WeakPolarHBondContact O-CB 3.02Å; R424-L428 PolarHBondContact O-N 3.48Å; R424-M571 HydrophobicContact CB-CE 4.27Å; R424-M571 HydrophobicContact CB-SD 4.38Å
425	K	78.6	Confident	85.4	Confident	30 Å²	30	39.5 Å²	39.5	13%	0.13	19%	0.193	C	C	.	.	H	α-helix	trans	-60.8	-46.6	173.8	-179.7	178.9	175.2	177.7	0	111.5	N336 I421 N422 E423 K427 L428 E429 F628	N336-K425 WeakPolarHBondContact OD1-CA 3.45Å; I421-K425 PolarHBondContact O-N 3Å; N422-K425 WeakPolarHBondContact O-CB 3.23Å; N422-K425 PolarHBondContact O-N 3.3Å; E423-K425 VanDerWaalsContact C-N 3.32Å; E423-K425 PolarHBondContact O-N 2.92Å; K425-K427 VanDerWaalsContact C-N 3.33Å; K425-K427 PolarHBondContact O-N 2.66Å; K425-L428 PolarHBondContact O-N 3.48Å; K425-E429 WeakPolarHBondContact CE-OE1 3.23Å; K425-E429 PolarHBondContact O-N 3.35Å; K425-F628 HydrophobicContact CD-CE1 4.04Å; K425-F628 HydrophobicContact CD-CZ 4.43Å; K425-F628 VanDerWaalsContact NZ-CE1 3.29Å
426	R	81.9	Confident	85.5	Confident	72 Å²	72	42.9 Å²	42.9	27%	0.272	21%	0.205	S	C	.	.	H	α-helix	trans	-58.7	-45	177.4	-172.5	-169.4	-60.2	152.3	8.7	111.5	N422 E423 E429 S430	N422-R426 PolarHBondContact O-N 3.22Å; E423-R426 VanDerWaalsContact CD-NH1 3.3Å; E423-R426 WeakPolarHBondContact O-CB 3.35Å; E423-R426 PolarHBondContact O-N 3.41Å; E423-R426 IonicContact OE1-CZ 2.89Å; E423-R426 IonicContact OE1-NE 3.41Å; E423-R426 IonicContact OE1-NH1 2.94Å; E423-R426 PolarHBondContact OE1-NH1 3.14Å; E423-R426 VanDerWaalsContact OE1-NH1 3.11Å; E423-R426 IonicContact OE2-CZ 3.43Å; E423-R426 IonicContact OE2-NE 3.65Å; E423-R426 IonicContact OE2-NH1 3.86Å; E423-R426 PolarHBondContact OE2-NH1 3.44Å; E423-R426 IonicContact OE2-NH2 2.71Å; E423-R426 PolarHBondContact OE2-NH2 3.18Å; R426-E429 PolarHBondContact O-N 2.84Å; R426-S430 WeakPolarHBondContact O-CB 3.35Å; R426-S430 PolarHBondContact O-N 3.39Å
427	K	83.5	Confident	85.8	Confident	6 Å²	6	39.7 Å²	39.7	3%	0.026	19%	0.186	C	C	.	.	H	α-helix	trans	-62.8	-40.5	177	-75.3	-173.5	167.2	-138	0	112.6	E423 R424 K425 E429 S430 I431 S454 D566 M571 I573	E423-K427 WeakPolarHBondContact O-CG 3.43Å; E423-K427 PolarHBondContact O-N 3.5Å; R424-K427 PolarHBondContact O-N 3.22Å; K425-K427 VanDerWaalsContact C-N 3.33Å; K425-K427 PolarHBondContact O-N 2.66Å; K427-E429 VanDerWaalsContact C-N 3.33Å; K427-E429 PolarHBondContact O-N 2.97Å; K427-S430 WeakPolarHBondContact O-CA 3.3Å; K427-S430 VanDerWaalsContact O-CB 3.29Å; K427-S430 WeakPolarHBondContact O-CB 3.26Å; K427-S430 PolarHBondContact O-N 3.5Å; K427-I431 PolarHBondContact O-N 2.64Å; K427-S454 PolarHBondContact NZ-OG 3.46Å; K427-S454 VanDerWaalsContact NZ-OG 3.09Å; K427-D566 VanDerWaalsContact CE-OD1 3.26Å; K427-D566 WeakPolarHBondContact CE-OD1 3.42Å; K427-D566 IonicContact NZ-OD1 3.29Å; K427-D566 PolarHBondContact NZ-OD1 3.03Å; K427-D566 IonicContact NZ-OD2 2.84Å; K427-D566 PolarHBondContact NZ-OD2 3.01Å; K427-M571 HydrophobicContact CD-CE 4.5Å; K427-I573 HydrophobicContact CB-CD1 4.19Å
428	L	82.1	Confident	86	Confident	43 Å²	43	39.6 Å²	39.6	23%	0.225	19%	0.185	C	C	.	.	H	α-helix	trans	-64.4	-37.6	176.5	-166.2	65.9	0	0	0	112.2	N336 R424 K425 S430 I431 Q577	N336-L428 HydrophobicContact CB-CD2 4.08Å; R424-L428 WeakPolarHBondContact O-CB 3.02Å; R424-L428 PolarHBondContact O-N 3.48Å; K425-L428 PolarHBondContact O-N 3.48Å; L428-S430 VanDerWaalsContact C-N 3.31Å; L428-I431 HydrophobicContact CD1-CD1 3.8Å; L428-I431 HydrophobicContact CD1-CG1 4.41Å; L428-I431 WeakPolarHBondContact O-CG1 3.41Å; L428-Q577 HydrophobicContact CD1-CB 4.21Å; L428-Q577 HydrophobicContact CD1-CG 4.22Å
429	E	81.2	Confident	86.6	Confident	99 Å²	99	41.6 Å²	41.6	46%	0.463	20%	0.195	S	C	.	.	H	α-helix	trans	-69.8	-29.5	171.8	-67.1	177	-169.8	0	0	112.6	K425 R426 K427	K425-E429 WeakPolarHBondContact CE-OE1 3.23Å; K425-E429 PolarHBondContact O-N 3.35Å; R426-E429 PolarHBondContact O-N 2.84Å; K427-E429 VanDerWaalsContact C-N 3.33Å; K427-E429 PolarHBondContact O-N 2.97Å
430	S	88.4	Confident	87.2	Confident	7 Å²	7	42.4 Å²	42.4	5%	0.049	20%	0.202	C	C	.	.	H	α-helix	trans	-69.1	-46.9	178.3	178.5	0	0	0	0	111.9	R426 K427 L428 D432 K433 I434 S454	R426-S430 WeakPolarHBondContact O-CB 3.35Å; R426-S430 PolarHBondContact O-N 3.39Å; K427-S430 WeakPolarHBondContact O-CA 3.3Å; K427-S430 VanDerWaalsContact O-CB 3.29Å; K427-S430 WeakPolarHBondContact O-CB 3.26Å; K427-S430 PolarHBondContact O-N 3.5Å; L428-S430 VanDerWaalsContact C-N 3.31Å; S430-D432 PolarHBondContact O-N 2.79Å; S430-D432 VanDerWaalsContact O-N 3.17Å; S430-K433 WeakPolarHBondContact O-CA 3.37Å; S430-K433 WeakPolarHBondContact O-CB 3.42Å; S430-K433 PolarHBondContact O-N 2.88Å; S430-I434 WeakPolarHBondContact O-CG1 3.4Å; S430-I434 PolarHBondContact O-N 3.47Å; S430-S454 VanDerWaalsContact CB-O 3.28Å; S430-S454 WeakPolarHBondContact CB-O 3.29Å; S430-S454 PolarHBondContact OG-O 3.36Å
431	I	91.1	Very high	87.7	Confident	3 Å²	3	40.4 Å²	40.4	2%	0.015	19%	0.191	C	C	.	.	H	α-helix	trans	-58.8	-35.2	-177.5	61.5	167	0	0	0	112.9	K427 L428 K433 I434 A435 L450 I573 Q577 A581	K427-I431 PolarHBondContact O-N 2.64Å; L428-I431 HydrophobicContact CD1-CD1 3.8Å; L428-I431 HydrophobicContact CD1-CG1 4.41Å; L428-I431 WeakPolarHBondContact O-CG1 3.41Å; I431-K433 VanDerWaalsContact C-N 3.31Å; I431-K433 PolarHBondContact O-N 2.93Å; I431-I434 PolarHBondContact O-N 2.97Å; I431-A435 WeakPolarHBondContact O-CB 3.3Å; I431-A435 PolarHBondContact O-N 3.49Å; I431-L450 HydrophobicContact CB-CD1 4.09Å; I431-L450 HydrophobicContact CB-CD2 3.69Å; I431-L450 HydrophobicContact CG2-CD2 3.68Å; I431-I573 HydrophobicContact CD1-CG2 3.85Å; I431-I573 HydrophobicContact CG2-CD1 3.28Å; I431-Q577 HydrophobicContact CD1-CB 4.21Å; I431-A581 HydrophobicContact CD1-CB 4.14Å; I431-A581 HydrophobicContact CG1-CB 4.28Å
432	D	87.9	Confident	88.2	Confident	57 Å²	57	42.9 Å²	42.9	31%	0.305	21%	0.207	S	C	.	.	H	α-helix	trans	-63.8	-37.4	175.7	-96.3	-10.9	0	0	0	111.7	S430 R436	S430-D432 PolarHBondContact O-N 2.79Å; S430-D432 VanDerWaalsContact O-N 3.17Å; D432-R436 VanDerWaalsContact O-CG 3.32Å; D432-R436 WeakPolarHBondContact O-CG 3.44Å; D432-R436 VanDerWaalsContact O-CZ 3.32Å; D432-R436 PolarHBondContact O-N 2.87Å; D432-R436 PolarHBondContact O-NH1 3.23Å; D432-R436 VanDerWaalsContact O-NH1 3.1Å; D432-R436 IonicContact OD2-NH2 3.11Å
433	K	89.6	Confident	89	Confident	92 Å²	92	44.2 Å²	44.2	40%	0.4	23%	0.225	S	C	.	.	H	α-helix	trans	-71.9	-42.8	176	-64	171.7	-173.5	167.4	0	111	S430 I431 R436 W437 L608	S430-K433 WeakPolarHBondContact O-CA 3.37Å; S430-K433 WeakPolarHBondContact O-CB 3.42Å; S430-K433 PolarHBondContact O-N 2.88Å; I431-K433 VanDerWaalsContact C-N 3.31Å; I431-K433 PolarHBondContact O-N 2.93Å; K433-R436 PolarHBondContact O-N 3.28Å; K433-W437 WeakPolarHBondContact O-CB 3.44Å; K433-W437 PolarHBondContact O-N 3.36Å; K433-L608 HydrophobicContact CB-CD2 4.06Å
434	I	94.5	Very high	89.8	Confident	2 Å²	2	45.1 Å²	45.1	1%	0.01	23%	0.227	C	C	.	.	H	α-helix	trans	-61.8	-47.7	177.8	-64.9	175.5	0	0	0	110.6	S430 I431 R436 W437 Q438 I449 L450 S454 F479	S430-I434 WeakPolarHBondContact O-CG1 3.4Å; S430-I434 PolarHBondContact O-N 3.47Å; I431-I434 PolarHBondContact O-N 2.97Å; I434-R436 PolarHBondContact O-N 2.82Å; I434-W437 WeakPolarHBondContact O-CB 3.27Å; I434-W437 PolarHBondContact O-N 3.3Å; I434-W437 VanDerWaalsContact O-N 3.17Å; I434-Q438 PolarHBondContact O-N 3.33Å; I434-I449 HydrophobicContact CG2-CB 3.8Å; I434-I449 HydrophobicContact CG2-CD1 4.27Å; I434-I449 HydrophobicContact CG2-CG2 3.47Å; I434-I449 VanDerWaalsContact CG2-CG2 3.47Å; I434-L450 HydrophobicContact CB-CD2 3.94Å; I434-L450 HydrophobicContact CD1-CD2 4.33Å; I434-L450 HydrophobicContact CG2-CD2 3.72Å; I434-L450 HydrophobicContact CG2-CG 4.31Å; I434-S454 WeakPolarHBondContact CD1-O 3.19Å; I434-F479 HydrophobicContact CD1-CD1 4.08Å; I434-F479 HydrophobicContact CD1-CE1 4.16Å; I434-F479 HydrophobicContact CG1-CD1 4.47Å; I434-F479 HydrophobicContact CG1-CE1 4.04Å; I434-F479 HydrophobicContact CG2-CE1 4.26Å
435	A	94.5	Very high	90.5	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-57.6	-47.7	177.6	0	0	0	0	0	112	I431 W437 Q438 V439 L450 A581 M582 A585	I431-A435 WeakPolarHBondContact O-CB 3.3Å; I431-A435 PolarHBondContact O-N 3.49Å; A435-W437 VanDerWaalsContact C-N 3.32Å; A435-W437 PolarHBondContact O-N 3.09Å; A435-Q438 PolarHBondContact O-N 3.06Å; A435-V439 WeakPolarHBondContact O-CG2 3.37Å; A435-V439 PolarHBondContact O-N 3.28Å; A435-V439 VanDerWaalsContact O-N 3.1Å; A435-L450 HydrophobicContact CB-CD1 4.09Å; A435-A581 HydrophobicContact CB-CB 4.08Å; A435-A581 WeakPolarHBondContact CB-O 3.25Å; A435-M582 HydrophobicContact CB-CG 4.48Å; A435-M582 HydrophobicContact CB-SD 3.65Å; A435-A585 VanDerWaalsContact C-CB 3.5Å; A435-A585 HydrophobicContact CB-CB 3.81Å
436	R	93.1	Very high	91.2	Very high	129 Å²	129	49.5 Å²	49.5	49%	0.487	27%	0.268	S	S	.	.	H	α-helix	trans	-61.4	-40.8	176.6	-72	-176	-137.2	101.3	-2.8	112.3	D432 K433 I434 S440 A585	D432-R436 VanDerWaalsContact O-CG 3.32Å; D432-R436 WeakPolarHBondContact O-CG 3.44Å; D432-R436 VanDerWaalsContact O-CZ 3.32Å; D432-R436 PolarHBondContact O-N 2.87Å; D432-R436 PolarHBondContact O-NH1 3.23Å; D432-R436 VanDerWaalsContact O-NH1 3.1Å; D432-R436 IonicContact OD2-NH2 3.11Å; K433-R436 PolarHBondContact O-N 3.28Å; I434-R436 PolarHBondContact O-N 2.82Å; R436-S440 PolarHBondContact O-N 2.63Å; R436-A585 HydrophobicContact CG-CB 4.05Å
437	W	94.4	Very high	91.7	Very high	19 Å²	19	51.6 Å²	51.6	7%	0.072	28%	0.284	C	S	.	.	H	α-helix	trans	-65.1	-45.8	176.5	170.6	87.1	0	0	0	111.7	K433 I434 A435 V439 S440 I441 W444 I449 F477 F479 V484 L608	K433-W437 WeakPolarHBondContact O-CB 3.44Å; K433-W437 PolarHBondContact O-N 3.36Å; I434-W437 WeakPolarHBondContact O-CB 3.27Å; I434-W437 PolarHBondContact O-N 3.3Å; I434-W437 VanDerWaalsContact O-N 3.17Å; A435-W437 VanDerWaalsContact C-N 3.32Å; A435-W437 PolarHBondContact O-N 3.09Å; W437-V439 VanDerWaalsContact C-N 3.33Å; W437-V439 PolarHBondContact O-N 3.16Å; W437-S440 WeakPolarHBondContact O-CA 3.37Å; W437-S440 WeakPolarHBondContact O-CB 3.48Å; W437-S440 PolarHBondContact O-N 3.47Å; W437-S440 PolarHBondContact O-OG 3.25Å; W437-I441 HydrophobicContact CD2-CD1 4.35Å; W437-I441 HydrophobicContact CD2-CG1 4.17Å; W437-I441 HydrophobicContact CE3-CG1 4.26Å; W437-I441 HydrophobicContact CH2-CD1 4.35Å; W437-I441 HydrophobicContact CH2-CG1 3.97Å; W437-I441 HydrophobicContact CZ2-CD1 3.8Å; W437-I441 HydrophobicContact CZ2-CG1 3.92Å; W437-I441 HydrophobicContact CZ3-CG1 4.05Å; W437-I441 WeakPolarHBondContact O-CG1 3.5Å; W437-I441 PolarHBondContact O-N 3.21Å; W437-W444 HydrophobicContact CH2-CH2 4.41Å; W437-W444 AromaticContact CH2-CZ3 3.96Å; W437-W444 HydrophobicContact CH2-CZ3 3.96Å; W437-W444 AromaticContact CZ3-CH2 3.99Å; W437-W444 HydrophobicContact CZ3-CH2 3.99Å; W437-W444 AromaticContact CZ3-CZ3 3.73Å; W437-W444 HydrophobicContact CZ3-CZ3 3.73Å; W437-I449 HydrophobicContact CE3-CD1 3.78Å; W437-I449 HydrophobicContact CH2-CD1 3.89Å; W437-I449 HydrophobicContact CZ3-CD1 3.1Å; W437-I449 HydrophobicContact CZ3-CG1 4.38Å; W437-F477 HydrophobicContact CH2-CD2 4.36Å; W437-F477 HydrophobicContact CH2-CG 4.35Å; W437-F477 HydrophobicContact CZ2-CB 4.16Å; W437-F477 AromaticContact CZ2-CD1 3.83Å; W437-F477 HydrophobicContact CZ2-CD1 3.83Å; W437-F477 AromaticContact CZ2-CD2 3.56Å; W437-F477 HydrophobicContact CZ2-CD2 3.56Å; W437-F477 HydrophobicContact CZ2-CE1 4.08Å; W437-F477 AromaticContact CZ2-CE2 3.81Å; W437-F477 HydrophobicContact CZ2-CE2 3.81Å; W437-F477 AromaticContact CZ2-CG 3.57Å; W437-F477 HydrophobicContact CZ2-CG 3.57Å; W437-F477 HydrophobicContact CZ2-CZ 4.07Å; W437-F477 AromaticContact NE1-CD1 3.98Å; W437-F477 AromaticContact NE1-CE1 3.55Å; W437-F477 AromaticContact NE1-CZ 3.78Å; W437-F479 HydrophobicContact CE3-CZ 4.15Å; W437-F479 HydrophobicContact CH2-CE2 4.14Å; W437-F479 HydrophobicContact CH2-CZ 4.05Å; W437-F479 HydrophobicContact CZ2-CZ 4.44Å; W437-F479 HydrophobicContact CZ3-CE2 4.34Å; W437-F479 AromaticContact CZ3-CZ 3.97Å; W437-F479 HydrophobicContact CZ3-CZ 3.97Å; W437-V484 HydrophobicContact CH2-CB 4.41Å; W437-V484 HydrophobicContact CH2-CG1 4.04Å; W437-L608 HydrophobicContact CB-CD1 3.32Å; W437-L608 HydrophobicContact CB-CG 3.94Å; W437-L608 HydrophobicContact CD2-CD1 3.78Å; W437-L608 HydrophobicContact CG-CD1 3.15Å; W437-L608 HydrophobicContact CG-CG 3.95Å
438	Q	95.5	Very high	92.3	Very high	7 Å²	7	53.9 Å²	53.9	3%	0.033	30%	0.297	C	S	.	.	H	α-helix	trans	-61	-44.2	-178.5	-169.5	-170.5	-56.3	0	0	111.2	I434 A435 S440 I441 W444 D448	I434-Q438 PolarHBondContact O-N 3.33Å; A435-Q438 PolarHBondContact O-N 3.06Å; Q438-S440 PolarHBondContact O-N 3.16Å; Q438-I441 WeakPolarHBondContact O-CB 3.38Å; Q438-I441 PolarHBondContact O-N 3.11Å; Q438-W444 VanDerWaalsContact CD-CE2 3.46Å; Q438-W444 HydrophobicContact CG-CD2 3.56Å; Q438-W444 VanDerWaalsContact CG-CE2 3.49Å; Q438-W444 HydrophobicContact CG-CE3 3.76Å; Q438-W444 HydrophobicContact CG-CG 4.21Å; Q438-W444 HydrophobicContact CG-CH2 3.92Å; Q438-W444 HydrophobicContact CG-CZ2 3.68Å; Q438-W444 HydrophobicContact CG-CZ3 3.93Å; Q438-D448 PolarHBondContact NE2-OD1 2.84Å
439	V	94.9	Very high	92.9	Very high	61 Å²	61	51.8 Å²	51.8	37%	0.37	29%	0.286	S	S	.	.	H	α-helix	trans	-60.2	-26.5	175	171.9	0	0	0	0	112.3	A435 W437 M582 A585 Q586	A435-V439 WeakPolarHBondContact O-CG2 3.37Å; A435-V439 PolarHBondContact O-N 3.28Å; A435-V439 VanDerWaalsContact O-N 3.1Å; W437-V439 VanDerWaalsContact C-N 3.33Å; W437-V439 PolarHBondContact O-N 3.16Å; V439-M582 HydrophobicContact CG2-CE 4.37Å; V439-A585 HydrophobicContact CB-CB 4.43Å; V439-A585 HydrophobicContact CG2-CB 3.79Å; V439-Q586 HydrophobicContact CG2-CG 4.04Å
440	S	93.2	Very high	93.5	Very high	72 Å²	72	47.2 Å²	47.2	50%	0.503	27%	0.265	S	S	.	.	H	α-helix	trans	-80.1	-15.9	176	80.3	0	0	0	0	114.3	R436 W437 Q438	R436-S440 PolarHBondContact O-N 2.63Å; W437-S440 WeakPolarHBondContact O-CA 3.37Å; W437-S440 WeakPolarHBondContact O-CB 3.48Å; W437-S440 PolarHBondContact O-N 3.47Å; W437-S440 PolarHBondContact O-OG 3.25Å; Q438-S440 PolarHBondContact O-N 3.16Å
441	I	94.5	Very high	93.8	Very high	10 Å²	10	50.5 Å²	50.5	5%	0.051	28%	0.282	C	S	.	.	S	Bend	trans	-79.2	126.8	179.4	-57.2	-55.8	0	0	0	110	W437 Q438 W444 L496	W437-I441 HydrophobicContact CD2-CD1 4.35Å; W437-I441 HydrophobicContact CD2-CG1 4.17Å; W437-I441 HydrophobicContact CE3-CG1 4.26Å; W437-I441 HydrophobicContact CH2-CD1 4.35Å; W437-I441 HydrophobicContact CH2-CG1 3.97Å; W437-I441 HydrophobicContact CZ2-CD1 3.8Å; W437-I441 HydrophobicContact CZ2-CG1 3.92Å; W437-I441 HydrophobicContact CZ3-CG1 4.05Å; W437-I441 WeakPolarHBondContact O-CG1 3.5Å; W437-I441 PolarHBondContact O-N 3.21Å; Q438-I441 WeakPolarHBondContact O-CB 3.38Å; Q438-I441 PolarHBondContact O-N 3.11Å; I441-W444 HydrophobicContact CB-CE3 3.96Å; I441-W444 HydrophobicContact CB-CZ3 4.48Å; I441-W444 HydrophobicContact CG1-CE3 4.37Å; I441-W444 HydrophobicContact CG1-CZ3 4.42Å; I441-W444 HydrophobicContact CG2-CE3 3.9Å; I441-W444 HydrophobicContact CG2-CZ3 4.42Å; I441-L496 HydrophobicContact CD1-CB 3.59Å; I441-L496 HydrophobicContact CD1-CD1 3.86Å; I441-L496 HydrophobicContact CD1-CG 4.38Å
442	V	95.1	Very high	93.8	Very high	60 Å²	60	55.2 Å²	55.2	36%	0.364	30%	0.299	S	S	.	.	B	Isolated β-bridge	trans	-83	135.4	-179.6	-176.4	0	0	0	0	110.6	M495 L496 Y497 Y498	V442-M495 HydrophobicContact CG2-CG 3.79Å; V442-M495 HydrophobicContact CG2-SD 3.86Å; V442-L496 PolarHBondContact N-O 3.29Å; V442-Y497 HydrophobicContact CB-CD1 3.74Å; V442-Y497 HydrophobicContact CB-CE1 3.87Å; V442-Y497 HydrophobicContact CB-CG 4.49Å; V442-Y497 HydrophobicContact CG1-CD1 3.71Å; V442-Y497 HydrophobicContact CG1-CE1 3.52Å; V442-Y497 WeakPolarHBondContact O-CA 3.47Å; V442-Y498 PolarHBondContact O-N 3.09Å
443	G	95	Very high	94.1	Very high	49 Å²	49	52.6 Å²	52.6	51%	0.505	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.9	36	178.3	0	0	0	0	0	112.9	E445 Y498	G443-E445 PolarHBondContact O-N 2.77Å; G443-Y498 WeakPolarHBondContact O-CB 3.33Å
444	W	96	Very high	94.1	Very high	52 Å²	52	48.8 Å²	48.8	20%	0.197	27%	0.27	C	S	.	.			trans	-57.3	132.9	174.7	-170.9	-96.4	0	0	0	111.1	W437 Q438 I441 L447 I449 V484 Y498 R501	W437-W444 HydrophobicContact CH2-CH2 4.41Å; W437-W444 AromaticContact CH2-CZ3 3.96Å; W437-W444 HydrophobicContact CH2-CZ3 3.96Å; W437-W444 AromaticContact CZ3-CH2 3.99Å; W437-W444 HydrophobicContact CZ3-CH2 3.99Å; W437-W444 AromaticContact CZ3-CZ3 3.73Å; W437-W444 HydrophobicContact CZ3-CZ3 3.73Å; Q438-W444 VanDerWaalsContact CD-CE2 3.46Å; Q438-W444 HydrophobicContact CG-CD2 3.56Å; Q438-W444 VanDerWaalsContact CG-CE2 3.49Å; Q438-W444 HydrophobicContact CG-CE3 3.76Å; Q438-W444 HydrophobicContact CG-CG 4.21Å; Q438-W444 HydrophobicContact CG-CH2 3.92Å; Q438-W444 HydrophobicContact CG-CZ2 3.68Å; Q438-W444 HydrophobicContact CG-CZ3 3.93Å; I441-W444 HydrophobicContact CB-CE3 3.96Å; I441-W444 HydrophobicContact CB-CZ3 4.48Å; I441-W444 HydrophobicContact CG1-CE3 4.37Å; I441-W444 HydrophobicContact CG1-CZ3 4.42Å; I441-W444 HydrophobicContact CG2-CE3 3.9Å; I441-W444 HydrophobicContact CG2-CZ3 4.42Å; W444-L447 PolarHBondContact NE1-O 2.75Å; W444-I449 HydrophobicContact CH2-CD1 3.62Å; W444-I449 HydrophobicContact CH2-CG1 3.48Å; W444-I449 VanDerWaalsContact CH2-CG1 3.48Å; W444-I449 HydrophobicContact CZ2-CD1 4.27Å; W444-I449 HydrophobicContact CZ2-CG1 3.64Å; W444-I449 HydrophobicContact CZ3-CD1 4.43Å; W444-V484 HydrophobicContact CH2-CG1 4.28Å; W444-V484 HydrophobicContact CH2-CG2 4.36Å; W444-V484 HydrophobicContact CZ3-CG1 4.17Å; W444-Y498 HydrophobicContact CD2-CD2 4.49Å; W444-Y498 AromaticContact CE3-CD2 3.84Å; W444-Y498 HydrophobicContact CE3-CD2 3.84Å; W444-Y498 HydrophobicContact CE3-CE2 4.45Å; W444-Y498 HydrophobicContact CE3-CG 4.42Å; W444-Y498 HydrophobicContact CH2-CD2 4.42Å; W444-Y498 HydrophobicContact CH2-CE2 4.36Å; W444-Y498 AromaticContact CZ3-CD2 3.81Å; W444-Y498 HydrophobicContact CZ3-CD2 3.81Å; W444-Y498 HydrophobicContact CZ3-CE2 4.21Å; W444-R501 VanDerWaalsContact CZ2-NH2 3.26Å
445	E	94.6	Very high	94	Very high	135 Å²	135	49 Å²	49	63%	0.631	27%	0.271	S	S	*	.			trans	-131.5	143.9	178.7	-63.7	167.4	-173.6	0	0	110	G443 Y498 R501	G443-E445 PolarHBondContact O-N 2.77Å; E445-Y498 HydrophobicContact CB-CD1 4Å; E445-Y498 HydrophobicContact CB-CE1 3.72Å; E445-Y498 HydrophobicContact CG-CD1 4.28Å; E445-Y498 HydrophobicContact CG-CE1 4.41Å; E445-Y498 PolarHBondContact O-OH 3.24Å; E445-R501 PolarHBondContact O-NH2 3.34Å
446	G	93.4	Very high	93.9	Very high	64 Å²	64	49.3 Å²	49.3	66%	0.66	27%	0.273	S	S	*	.	S	Bend	trans	86.7	-166.1	-179.9	0	0	0	0	0	113.7
447	L	94	Very high	93.9	Very high	116 Å²	116	43.6 Å²	43.6	61%	0.607	25%	0.252	S	S	*	.	S	Bend	trans	-63	158.7	-177.6	-66.8	179.6	0	0	0	112.9	W444 D451 R501	W444-L447 PolarHBondContact NE1-O 2.75Å; L447-D451 WeakPolarHBondContact CB-OD2 3.17Å; L447-R501 PolarHBondContact O-NH1 3.11Å; L447-R501 PolarHBondContact O-NH2 2.87Å
448	D	95.1	Very high	93.8	Very high	54 Å²	54	44.3 Å²	44.3	29%	0.289	26%	0.256	S	S	.	.			trans	-65.9	147.7	172.7	-72.5	-21.1	0	0	0	109	Q438 L450 D451	Q438-D448 PolarHBondContact NE2-OD1 2.84Å; D448-L450 PolarHBondContact O-N 3.1Å; D448-D451 PolarHBondContact N-OD2 3.3Å; D448-D451 WeakPolarHBondContact O-CB 3.24Å; D448-D451 PolarHBondContact O-N 3.19Å
449	I	95.3	Very high	93.8	Very high	0 Å²	0	45 Å²	45	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-57.4	-41.4	175.5	-72.4	-175.4	0	0	0	110	I434 W437 W444 D451 R452 S453 F479 Q482 V484	I434-I449 HydrophobicContact CG2-CB 3.8Å; I434-I449 HydrophobicContact CG2-CD1 4.27Å; I434-I449 HydrophobicContact CG2-CG2 3.47Å; I434-I449 VanDerWaalsContact CG2-CG2 3.47Å; W437-I449 HydrophobicContact CE3-CD1 3.78Å; W437-I449 HydrophobicContact CH2-CD1 3.89Å; W437-I449 HydrophobicContact CZ3-CD1 3.1Å; W437-I449 HydrophobicContact CZ3-CG1 4.38Å; W444-I449 HydrophobicContact CH2-CD1 3.62Å; W444-I449 HydrophobicContact CH2-CG1 3.48Å; W444-I449 VanDerWaalsContact CH2-CG1 3.48Å; W444-I449 HydrophobicContact CZ2-CD1 4.27Å; W444-I449 HydrophobicContact CZ2-CG1 3.64Å; W444-I449 HydrophobicContact CZ3-CD1 4.43Å; I449-D451 PolarHBondContact O-N 3.01Å; I449-R452 PolarHBondContact O-N 2.84Å; I449-R452 VanDerWaalsContact O-N 3.14Å; I449-S453 WeakPolarHBondContact O-CB 3.35Å; I449-S453 PolarHBondContact O-N 3.02Å; I449-F479 HydrophobicContact CD1-CD2 4.08Å; I449-F479 HydrophobicContact CD1-CE1 4.08Å; I449-F479 HydrophobicContact CD1-CE2 3.49Å; I449-F479 VanDerWaalsContact CD1-CE2 3.49Å; I449-F479 HydrophobicContact CD1-CZ 3.49Å; I449-F479 VanDerWaalsContact CD1-CZ 3.49Å; I449-F479 HydrophobicContact CG2-CD1 4.03Å; I449-F479 HydrophobicContact CG2-CE1 4.26Å; I449-F479 HydrophobicContact CG2-CG 4.16Å; I449-Q482 PolarHBondContact O-NE2 2.8Å; I449-V484 HydrophobicContact CD1-CG2 4.24Å
450	L	94.7	Very high	93.8	Very high	2 Å²	2	43.1 Å²	43.1	1%	0.01	25%	0.254	C	S	.	.	H	α-helix	trans	-62.5	-16.5	-176.4	-63.1	-171.9	0	0	0	113.8	I431 I434 A435 D448 R452 S453 K578 A581 M582	I431-L450 HydrophobicContact CB-CD1 4.09Å; I431-L450 HydrophobicContact CB-CD2 3.69Å; I431-L450 HydrophobicContact CG2-CD2 3.68Å; I434-L450 HydrophobicContact CB-CD2 3.94Å; I434-L450 HydrophobicContact CD1-CD2 4.33Å; I434-L450 HydrophobicContact CG2-CD2 3.72Å; I434-L450 HydrophobicContact CG2-CG 4.31Å; A435-L450 HydrophobicContact CB-CD1 4.09Å; D448-L450 PolarHBondContact O-N 3.1Å; L450-R452 VanDerWaalsContact C-N 3.28Å; L450-R452 PolarHBondContact O-N 2.93Å; L450-S453 WeakPolarHBondContact CA-O 2.91Å; L450-K578 HydrophobicContact CB-CB 4.26Å; L450-K578 HydrophobicContact CB-CG 4.32Å; L450-K578 WeakPolarHBondContact O-CD 3.4Å; L450-K578 WeakPolarHBondContact O-CE 3.34Å; L450-K578 PolarHBondContact O-NZ 3.15Å; L450-A581 HydrophobicContact CD1-CB 3.96Å; L450-M582 HydrophobicContact CD1-CG 4.13Å; L450-M582 HydrophobicContact CD1-SD 4.27Å
451	D	93.1	Very high	93.8	Very high	76 Å²	76	42.8 Å²	42.8	41%	0.406	25%	0.245	S	C	.	.	H	α-helix	trans	-61.8	-40.1	176	-66.7	-30.6	0	0	0	110.8	L447 D448 I449 K578	L447-D451 WeakPolarHBondContact CB-OD2 3.17Å; D448-D451 PolarHBondContact N-OD2 3.3Å; D448-D451 WeakPolarHBondContact O-CB 3.24Å; D448-D451 PolarHBondContact O-N 3.19Å; I449-D451 PolarHBondContact O-N 3.01Å; D451-K578 PolarHBondContact O-NZ 3.07Å
452	R	92.5	Very high	93.9	Very high	103 Å²	103	42.5 Å²	42.5	39%	0.389	24%	0.243	S	C	.	.	H	α-helix	trans	-115.3	-19.6	-179.1	-69.5	-171.6	66.3	179.8	-5.2	115.4	I449 L450 H481 D503 D505	I449-R452 PolarHBondContact O-N 2.84Å; I449-R452 VanDerWaalsContact O-N 3.14Å; L450-R452 VanDerWaalsContact C-N 3.28Å; L450-R452 PolarHBondContact O-N 2.93Å; R452-H481 PolarHBondContact O-CD2 3.09Å; R452-D503 IonicContact CZ-OD1 3.63Å; R452-D503 IonicContact CZ-OD2 3.11Å; R452-D503 VanDerWaalsContact CZ-OD2 3.3Å; R452-D503 IonicContact NH1-OD1 3.7Å; R452-D503 IonicContact NH1-OD2 2.77Å; R452-D503 PolarHBondContact NH1-OD2 2.97Å; R452-D503 VanDerWaalsContact NH2-CG 3.34Å; R452-D503 IonicContact NH2-OD1 3.57Å; R452-D503 PolarHBondContact NH2-OD1 3.17Å; R452-D503 IonicContact NH2-OD2 2.75Å; R452-D503 PolarHBondContact NH2-OD2 3.31Å; R452-D505 IonicContact NH2-OD2 3.51Å; R452-D505 PolarHBondContact NH2-OD2 3.43Å
453	S	93.3	Very high	93.9	Very high	2 Å²	2	41.2 Å²	41.2	1%	0.014	24%	0.236	C	C	.	.			trans	-126	154.2	-168.7	-54.1	0	0	0	0	112.6	I449 L450 D480 Q482	I449-S453 WeakPolarHBondContact O-CB 3.35Å; I449-S453 PolarHBondContact O-N 3.02Å; L450-S453 WeakPolarHBondContact CA-O 2.91Å; S453-D480 WeakPolarHBondContact CA-OD1 3.37Å; S453-D480 VanDerWaalsContact CB-O 3.31Å; S453-D480 WeakPolarHBondContact CB-O 3.26Å; S453-D480 WeakPolarHBondContact CB-OD1 3.29Å; S453-D480 PolarHBondContact OG-O 3.02Å; S453-Q482 WeakPolarHBondContact OG-CG 3.48Å; S453-Q482 PolarHBondContact OG-NE2 2.7Å
454	S	90.7	Very high	93.9	Very high	11 Å²	11	40.8 Å²	40.8	8%	0.077	22%	0.22	C	C	.	.			trans	-131.9	-14.6	-178.4	61	0	0	0	0	113.9	K427 S430 I434 D480	K427-S454 PolarHBondContact NZ-OG 3.46Å; K427-S454 VanDerWaalsContact NZ-OG 3.09Å; S430-S454 VanDerWaalsContact CB-O 3.28Å; S430-S454 WeakPolarHBondContact CB-O 3.29Å; S430-S454 PolarHBondContact OG-O 3.36Å; I434-S454 WeakPolarHBondContact CD1-O 3.19Å; S454-D480 VanDerWaalsContact N-CG 3.25Å; S454-D480 PolarHBondContact N-OD1 2.94Å; S454-D480 PolarHBondContact N-OD2 3.49Å; S454-D480 PolarHBondContact OG-OD2 3.35Å
455	E	90.9	Very high	93.6	Very high	6 Å²	6	39.4 Å²	39.4	3%	0.028	22%	0.216	C	C	.	.			trans	-140	138.2	-173.2	-169.2	179.6	172.2	0	0	112.4	I457 F479 D480 R562	E455-I457 HydrophobicContact CG-CG1 4.48Å; E455-F479 WeakPolarHBondContact O-CA 3.35Å; E455-F479 WeakPolarHBondContact O-CB 3.4Å; E455-F479 WeakPolarHBondContact O-CD1 3.45Å; E455-D480 PolarHBondContact N-OD1 2.99Å; E455-D480 PolarHBondContact O-N 3.46Å; E455-D480 VanDerWaalsContact O-OD1 3.1Å; E455-R562 IonicContact OE1-CZ 3.58Å; E455-R562 VanDerWaalsContact OE1-CZ 3.29Å; E455-R562 IonicContact OE1-NE 3.7Å; E455-R562 PolarHBondContact OE1-NE 3.4Å; E455-R562 IonicContact OE1-NH2 2.78Å; E455-R562 PolarHBondContact OE1-NH2 3.47Å; E455-R562 WeakPolarHBondContact OE2-CD 3.42Å; E455-R562 IonicContact OE2-CZ 3.38Å; E455-R562 IonicContact OE2-NE 2.73Å; E455-R562 PolarHBondContact OE2-NE 2.87Å
456	L	93.4	Very high	93.1	Very high	8 Å²	8	34.7 Å²	34.7	4%	0.042	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	116.3	164.9	176.1	71.2	0	0	0	109.4	H458 F477 L478 F479 L608	L456-H458 WeakPolarHBondContact CD1-O 3.35Å; L456-F477 HydrophobicContact CD1-CB 4.04Å; L456-F477 HydrophobicContact CD1-CD1 4.36Å; L456-L478 WeakPolarHBondContact CD1-O 3.33Å; L456-F479 HydrophobicContact CB-CD1 4Å; L456-F479 HydrophobicContact CB-CE1 3.83Å; L456-F479 HydrophobicContact CD1-CD1 4.03Å; L456-F479 HydrophobicContact CD1-CE1 3.7Å; L456-F479 HydrophobicContact CD1-CE2 4.26Å; L456-F479 HydrophobicContact CD1-CG 4.45Å; L456-F479 HydrophobicContact CD1-CZ 3.83Å; L456-F479 HydrophobicContact CG-CE1 4.32Å; L456-L608 HydrophobicContact CD2-CB 3.72Å; L456-L608 HydrophobicContact CD2-CD1 3.94Å; L456-L608 HydrophobicContact CD2-CG 4.31Å
457	I	91.6	Very high	92.3	Very high	9 Å²	9	38.6 Å²	38.6	5%	0.046	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	-45.3	-175.3	-63.4	166.8	0	0	0	110.9	E455 L478 D480 A555 D558 E559	E455-I457 HydrophobicContact CG-CG1 4.48Å; I457-L478 HydrophobicContact CB-CG 4.48Å; I457-L478 HydrophobicContact CG2-CD2 4.35Å; I457-L478 PolarHBondContact N-O 2.77Å; I457-D480 HydrophobicContact CD1-CB 4.48Å; I457-A555 HydrophobicContact CG2-CB 4.42Å; I457-D558 HydrophobicContact CG2-CB 4.42Å; I457-E559 HydrophobicContact CD1-CB 3.42Å; I457-E559 VanDerWaalsContact CD1-CB 3.42Å; I457-E559 HydrophobicContact CD1-CG 3.31Å; I457-E559 HydrophobicContact CG2-CB 4.48Å
458	H	94	Very high	91.5	Very high	33 Å²	33	40.4 Å²	40.4	15%	0.153	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151	155.8	178.4	-162.4	60.1	0	0	0	113.1	L456 L478 W552 A555	L456-H458 WeakPolarHBondContact CD1-O 3.35Å; H458-L478 HydrophobicContact CB-CB 4.38Å; H458-L478 PolarHBondContact N-O 2.71Å; H458-L478 PolarHBondContact O-N 3.29Å; H458-W552 AromaticContact CD2-CD2 3.69Å; H458-W552 AromaticContact CD2-CE2 3.64Å; H458-W552 AromaticContact CD2-CE3 3.92Å; H458-W552 AromaticContact CD2-CZ2 3.86Å; H458-A555 HydrophobicContact CB-CB 3.45Å; H458-A555 VanDerWaalsContact CB-CB 3.45Å
459	S	94.7	Very high	90.7	Very high	23 Å²	23	39.7 Å²	39.7	16%	0.161	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	144.4	176	72.9	0	0	0	0	110	F476 L608 P610	S459-F476 WeakPolarHBondContact CA-O 3.43Å; S459-L608 PolarHBondContact OG-O 3.05Å; S459-P610 WeakPolarHBondContact OG-CD 3.45Å; S459-P610 WeakPolarHBondContact OG-CG 3.38Å
460	G	94	Very high	90.3	Very high	20 Å²	20	45.5 Å²	45.5	21%	0.206	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	178.3	170.7	-174.1	0	0	0	0	0	113.4	T475 F476	G460-T475 CarbonylContact O-C 3.57Å; G460-T475 WeakPolarHBondContact O-CA 3.41Å; G460-F476 PolarHBondContact N-O 3.45Å; G460-F476 PolarHBondContact O-N 3Å
461	E	94.5	Very high	90	Very high	65 Å²	65	49.6 Å²	49.6	30%	0.304	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	130.8	174.4	-65.2	-175.5	175.8	0	0	110.6	Q473 R474 K488 K544	E461-Q473 PolarHBondContact OE2-NE2 3.29Å; E461-Q473 VanDerWaalsContact OE2-NE2 3.16Å; E461-R474 WeakPolarHBondContact CA-O 3.33Å; E461-K488 IonicContact OE1-NZ 3.89Å; E461-K488 PolarHBondContact OE1-NZ 3.23Å; E461-K544 IonicContact OE2-NZ 2.85Å; E461-K544 PolarHBondContact OE2-NZ 2.99Å
462	L	96.2	Very high	90	Very high	4 Å²	4	48.8 Å²	48.8	2%	0.021	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	156.7	170.5	-66.3	169.1	0	0	0	109.9	R474 F476 F528 F541 A543 W552	L462-R474 PolarHBondContact N-O 3.49Å; L462-R474 PolarHBondContact O-N 3.34Å; L462-R474 VanDerWaalsContact O-O 3.09Å; L462-F476 HydrophobicContact CB-CD2 3.65Å; L462-F476 HydrophobicContact CB-CE2 3.7Å; L462-F476 HydrophobicContact CD1-CD2 4.07Å; L462-F476 HydrophobicContact CD1-CG 4.49Å; L462-F476 HydrophobicContact CG-CD2 4.2Å; L462-F528 HydrophobicContact CD1-CE1 4.17Å; L462-F528 HydrophobicContact CD1-CZ 3.71Å; L462-F528 HydrophobicContact CD2-CE1 4.24Å; L462-F541 HydrophobicContact CB-CD1 4.45Å; L462-F541 HydrophobicContact CD1-CB 4.26Å; L462-F541 HydrophobicContact CD1-CD1 4.12Å; L462-F541 HydrophobicContact CD1-CG 4.39Å; L462-A543 HydrophobicContact CD2-CB 3.8Å; L462-W552 HydrophobicContact CD1-CD2 3.67Å; L462-W552 VanDerWaalsContact CD1-CE2 3.49Å; L462-W552 HydrophobicContact CD1-CE3 4.16Å; L462-W552 HydrophobicContact CD1-CG 4.04Å; L462-W552 HydrophobicContact CD1-CH2 4.35Å; L462-W552 HydrophobicContact CD1-CZ2 3.85Å; L462-W552 HydrophobicContact CD1-CZ3 4.47Å; L462-W552 HydrophobicContact CD2-CG 4.29Å; L462-W552 HydrophobicContact CG-CD2 4.35Å; L462-W552 HydrophobicContact CG-CZ2 4.14Å
463	T	95.7	Very high	90.1	Very high	33 Å²	33	49 Å²	49	20%	0.202	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	113.2	168.5	-61.7	0	0	0	0	108.6	I465 S471 F541 C542	T463-I465 HydrophobicContact CG2-CG1 4.49Å; T463-S471 WeakPolarHBondContact CG2-OG 3.35Å; T463-F541 CarbonylContact O-C 3.51Å; T463-F541 WeakPolarHBondContact O-CA 3.25Å; T463-C542 PolarHBondContact N-O 3.26Å; T463-C542 PolarHBondContact O-N 3.48Å
464	K	94	Very high	90.2	Very high	40 Å²	40	50.8 Å²	50.8	17%	0.174	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	130.1	171.7	177.4	177.6	-179.8	170	0	109.4	Q472 F476 L540 F541	K464-Q472 PolarHBondContact N-O 2.97Å; K464-Q472 PolarHBondContact O-N 3.4Å; K464-F476 HydrophobicContact CB-CZ 4.02Å; K464-F476 HydrophobicContact CD-CZ 4.42Å; K464-L540 WeakPolarHBondContact CA-O 3.43Å; K464-F541 HydrophobicContact CB-CD1 4.38Å; K464-F541 HydrophobicContact CB-CE1 4.36Å; K464-F541 HydrophobicContact CG-CE1 4.39Å
465	I	90.7	Very high	90.4	Very high	24 Å²	24	50.9 Å²	50.9	12%	0.123	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	125.3	175	-59.7	176.6	0	0	0	108.1	T463 L522 L540	T463-I465 HydrophobicContact CG2-CG1 4.49Å; I465-L522 HydrophobicContact CG2-CD1 3.55Å; I465-L540 HydrophobicContact CB-CB 4.23Å; I465-L540 HydrophobicContact CB-CD2 3.96Å; I465-L540 HydrophobicContact CB-CG 4.2Å; I465-L540 HydrophobicContact CD1-CD2 3.81Å; I465-L540 HydrophobicContact CD1-CG 4.26Å; I465-L540 HydrophobicContact CG1-CD2 4.39Å; I465-L540 HydrophobicContact CG2-CD2 4.18Å; I465-L540 PolarHBondContact N-O 2.96Å
466	T	83.2	Confident	90.7	Very high	35 Å²	35	50.8 Å²	50.8	22%	0.215	27%	0.265	C	S	.	.			trans	-80.6	162.9	176.5	69.4	0	0	0	0	111.3	Q468 G469 K470	T466-Q468 PolarHBondContact O-N 2.95Å; T466-Q468 PolarHBondContact OG1-N 2.86Å; T466-G469 WeakPolarHBondContact O-CA 3.38Å; T466-G469 PolarHBondContact O-N 2.98Å; T466-K470 PolarHBondContact N-O 2.76Å; T466-K470 PolarHBondContact OG1-N 2.95Å
467	K	76.5	Confident	90.9	Very high	147 Å²	147	50.9 Å²	50.9	64%	0.639	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.3	-24.2	172.7	-66.8	-170.2	176.4	-170.9	0	113.4	G469 D536	K467-G469 VanDerWaalsContact C-N 3.28Å; K467-G469 PolarHBondContact O-N 3.23Å; K467-D536 PolarHBondContact NZ-O 3.35Å
468	Q	77.7	Confident	91.1	Very high	153 Å²	153	50.5 Å²	50.5	72%	0.715	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.6	5.7	175.2	-62.9	180	-8.5	0	0	113.9	T466 K470	T466-Q468 PolarHBondContact O-N 2.95Å; T466-Q468 PolarHBondContact OG1-N 2.86Å; Q468-K470 VanDerWaalsContact C-N 3.26Å; Q468-K470 PolarHBondContact O-N 3.41Å
469	G	78	Confident	91.2	Very high	39 Å²	39	48.9 Å²	48.9	40%	0.402	26%	0.256	S	S	.	.			trans	74.6	7.2	-176.4	0	0	0	0	0	115	T466 K467 S471	T466-G469 WeakPolarHBondContact O-CA 3.38Å; T466-G469 PolarHBondContact O-N 2.98Å; K467-G469 VanDerWaalsContact C-N 3.28Å; K467-G469 PolarHBondContact O-N 3.23Å; G469-S471 PolarHBondContact O-N 3.5Å
470	K	86	Confident	91.2	Very high	123 Å²	123	48 Å²	48	54%	0.535	25%	0.249	S	C	.	.			trans	-76.3	121.3	178.7	-67	179.4	-179.8	163.7	0	110	T466 Q468	T466-K470 PolarHBondContact N-O 2.76Å; T466-K470 PolarHBondContact OG1-N 2.95Å; Q468-K470 VanDerWaalsContact C-N 3.26Å; Q468-K470 PolarHBondContact O-N 3.41Å
471	S	90.4	Very high	91.3	Very high	87 Å²	87	49.1 Å²	49.1	61%	0.608	25%	0.249	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-80.5	129.6	174.4	176	0	0	0	0	111.1	T463 G469	T463-S471 WeakPolarHBondContact CG2-OG 3.35Å; G469-S471 PolarHBondContact O-N 3.5Å
472	Q	92.9	Very high	91.4	Very high	60 Å²	60	46.4 Å²	46.4	28%	0.28	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	108	179.8	-62	-171.8	7.4	0	0	110.1	K464 R474	K464-Q472 PolarHBondContact N-O 2.97Å; K464-Q472 PolarHBondContact O-N 3.4Å; Q472-R474 HydrophobicContact CB-CG 4.46Å; Q472-R474 VanDerWaalsContact CD-NH2 3.34Å; Q472-R474 PolarHBondContact O-N 3.04Å
473	Q	94.3	Very high	91.4	Very high	108 Å²	108	46.6 Å²	46.6	51%	0.505	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	125.2	169.7	-165.2	178.4	-2.8	0	0	109.6	E461	E461-Q473 PolarHBondContact OE2-NE2 3.29Å; E461-Q473 VanDerWaalsContact OE2-NE2 3.16Å
474	R	95.3	Very high	91.5	Very high	39 Å²	39	45 Å²	45	15%	0.147	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	157.2	-179.1	-63.8	-67.3	179.8	-93.2	-3.3	109.8	E461 L462 Q472 F476 C486	E461-R474 WeakPolarHBondContact CA-O 3.33Å; L462-R474 PolarHBondContact N-O 3.49Å; L462-R474 PolarHBondContact O-N 3.34Å; L462-R474 VanDerWaalsContact O-O 3.09Å; Q472-R474 HydrophobicContact CB-CG 4.46Å; Q472-R474 VanDerWaalsContact CD-NH2 3.34Å; Q472-R474 PolarHBondContact O-N 3.04Å; R474-F476 HydrophobicContact CB-CD2 4.13Å; R474-F476 HydrophobicContact CB-CE2 3.49Å; R474-F476 VanDerWaalsContact CB-CE2 3.49Å; R474-F476 HydrophobicContact CB-CZ 3.75Å; R474-F476 HydrophobicContact CG-CE2 4.44Å; R474-F476 HydrophobicContact CG-CZ 4.32Å; R474-C486 WeakPolarHBondContact CA-O 3.29Å; R474-C486 WeakPolarHBondContact CD-O 3.45Å
475	T	95.5	Very high	91.6	Very high	13 Å²	13	43.7 Å²	43.7	8%	0.08	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	126.4	165.7	-54.9	0	0	0	0	107.5	G460 F477 C486 K488	G460-T475 CarbonylContact O-C 3.57Å; G460-T475 WeakPolarHBondContact O-CA 3.41Å; T475-F477 HydrophobicContact CG2-CD2 4.44Å; T475-F477 HydrophobicContact CG2-CE1 4.48Å; T475-F477 HydrophobicContact CG2-CE2 3.6Å; T475-F477 HydrophobicContact CG2-CZ 3.63Å; T475-C486 PolarHBondContact N-O 3.11Å; T475-C486 PolarHBondContact O-N 3.24Å; T475-K488 WeakPolarHBondContact OG1-CE 3.39Å
476	F	96.4	Very high	91.9	Very high	3 Å²	3	42.6 Å²	42.6	1%	0.013	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	146	-178.8	-70.7	-87.9	0	0	0	110.2	S459 G460 L462 K464 R474 L483 V484 S485 F541 W552	S459-F476 WeakPolarHBondContact CA-O 3.43Å; G460-F476 PolarHBondContact N-O 3.45Å; G460-F476 PolarHBondContact O-N 3Å; L462-F476 HydrophobicContact CB-CD2 3.65Å; L462-F476 HydrophobicContact CB-CE2 3.7Å; L462-F476 HydrophobicContact CD1-CD2 4.07Å; L462-F476 HydrophobicContact CD1-CG 4.49Å; L462-F476 HydrophobicContact CG-CD2 4.2Å; K464-F476 HydrophobicContact CB-CZ 4.02Å; K464-F476 HydrophobicContact CD-CZ 4.42Å; R474-F476 HydrophobicContact CB-CD2 4.13Å; R474-F476 HydrophobicContact CB-CE2 3.49Å; R474-F476 VanDerWaalsContact CB-CE2 3.49Å; R474-F476 HydrophobicContact CB-CZ 3.75Å; R474-F476 HydrophobicContact CG-CE2 4.44Å; R474-F476 HydrophobicContact CG-CZ 4.32Å; F476-L483 HydrophobicContact CB-CD1 4.02Å; F476-L483 HydrophobicContact CD1-CD1 4.23Å; F476-L483 HydrophobicContact CD1-CD2 4.06Å; F476-L483 HydrophobicContact CD1-CG 4.03Å; F476-V484 CarbonylContact C-O 3.47Å; F476-V484 VanDerWaalsContact CA-O 3.32Å; F476-V484 WeakPolarHBondContact CA-O 3.31Å; F476-S485 VanDerWaalsContact CE1-CB 3.49Å; F476-F541 HydrophobicContact CD1-CE1 4.34Å; F476-F541 HydrophobicContact CE1-CD1 4.44Å; F476-F541 AromaticContact CE1-CE1 3.62Å; F476-F541 HydrophobicContact CE1-CE1 3.62Å; F476-F541 HydrophobicContact CE1-CZ 4.46Å; F476-F541 HydrophobicContact CE2-CD1 4.22Å; F476-F541 HydrophobicContact CE2-CE1 4.17Å; F476-F541 HydrophobicContact CZ-CD1 4.01Å; F476-F541 AromaticContact CZ-CE1 3.53Å; F476-F541 HydrophobicContact CZ-CE1 3.53Å; F476-W552 HydrophobicContact CB-CH2 3.42Å; F476-W552 VanDerWaalsContact CB-CH2 3.42Å; F476-W552 HydrophobicContact CB-CZ2 3.88Å; F476-W552 HydrophobicContact CB-CZ3 4.28Å
477	F	97.1	Very high	92.5	Very high	11 Å²	11	45 Å²	45	5%	0.048	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	108.1	178.4	-60.2	-93.9	0	0	0	107.5	W437 L456 T475 F479 V484 C486 L496	W437-F477 HydrophobicContact CH2-CD2 4.36Å; W437-F477 HydrophobicContact CH2-CG 4.35Å; W437-F477 HydrophobicContact CZ2-CB 4.16Å; W437-F477 AromaticContact CZ2-CD1 3.83Å; W437-F477 HydrophobicContact CZ2-CD1 3.83Å; W437-F477 AromaticContact CZ2-CD2 3.56Å; W437-F477 HydrophobicContact CZ2-CD2 3.56Å; W437-F477 HydrophobicContact CZ2-CE1 4.08Å; W437-F477 AromaticContact CZ2-CE2 3.81Å; W437-F477 HydrophobicContact CZ2-CE2 3.81Å; W437-F477 AromaticContact CZ2-CG 3.57Å; W437-F477 HydrophobicContact CZ2-CG 3.57Å; W437-F477 HydrophobicContact CZ2-CZ 4.07Å; W437-F477 AromaticContact NE1-CD1 3.98Å; W437-F477 AromaticContact NE1-CE1 3.55Å; W437-F477 AromaticContact NE1-CZ 3.78Å; L456-F477 HydrophobicContact CD1-CB 4.04Å; L456-F477 HydrophobicContact CD1-CD1 4.36Å; T475-F477 HydrophobicContact CG2-CD2 4.44Å; T475-F477 HydrophobicContact CG2-CE1 4.48Å; T475-F477 HydrophobicContact CG2-CE2 3.6Å; T475-F477 HydrophobicContact CG2-CZ 3.63Å; F477-F479 HydrophobicContact CB-CD2 4.34Å; F477-F479 HydrophobicContact CB-CE2 3.51Å; F477-F479 HydrophobicContact CB-CZ 3.96Å; F477-F479 WeakPolarHBondContact O-CD2 3.38Å; F477-V484 HydrophobicContact CB-CB 4.5Å; F477-V484 PolarHBondContact N-O 2.65Å; F477-V484 PolarHBondContact O-N 3.26Å; F477-C486 HydrophobicContact CE2-CB 4.11Å; F477-L496 HydrophobicContact CE2-CD1 3.99Å; F477-L496 HydrophobicContact CZ-CD1 3.59Å
478	L	96.5	Very high	93.3	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	113	179.1	-179.9	65.9	0	0	0	109.1	L456 I457 H458 L483 M504 W552 A555 E559	L456-L478 WeakPolarHBondContact CD1-O 3.33Å; I457-L478 HydrophobicContact CB-CG 4.48Å; I457-L478 HydrophobicContact CG2-CD2 4.35Å; I457-L478 PolarHBondContact N-O 2.77Å; H458-L478 HydrophobicContact CB-CB 4.38Å; H458-L478 PolarHBondContact N-O 2.71Å; H458-L478 PolarHBondContact O-N 3.29Å; L478-L483 HydrophobicContact CB-CD1 3.86Å; L478-L483 HydrophobicContact CD1-CB 4.26Å; L478-L483 HydrophobicContact CD1-CD1 4.09Å; L478-M504 HydrophobicContact CD1-CE 3.99Å; L478-M504 HydrophobicContact CD1-CG 3.87Å; L478-M504 HydrophobicContact CD1-SD 4.01Å; L478-W552 HydrophobicContact CB-CZ3 4.1Å; L478-A555 HydrophobicContact CD2-CB 3.91Å; L478-A555 WeakPolarHBondContact CD2-O 3.39Å; L478-E559 HydrophobicContact CD1-CG 4.11Å; L478-E559 HydrophobicContact CD2-CB 4.04Å; L478-E559 HydrophobicContact CD2-CG 4.41Å; L478-E559 HydrophobicContact CG-CB 4.36Å; L478-E559 HydrophobicContact CG-CG 4.2Å
479	F	96.1	Very high	94	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	166.7	170.3	-56.5	-90.2	0	0	0	109.4	I434 W437 I449 E455 L456 F477 H481 Q482 V484 E559	I434-F479 HydrophobicContact CD1-CD1 4.08Å; I434-F479 HydrophobicContact CD1-CE1 4.16Å; I434-F479 HydrophobicContact CG1-CD1 4.47Å; I434-F479 HydrophobicContact CG1-CE1 4.04Å; I434-F479 HydrophobicContact CG2-CE1 4.26Å; W437-F479 HydrophobicContact CE3-CZ 4.15Å; W437-F479 HydrophobicContact CH2-CE2 4.14Å; W437-F479 HydrophobicContact CH2-CZ 4.05Å; W437-F479 HydrophobicContact CZ2-CZ 4.44Å; W437-F479 HydrophobicContact CZ3-CE2 4.34Å; W437-F479 AromaticContact CZ3-CZ 3.97Å; W437-F479 HydrophobicContact CZ3-CZ 3.97Å; I449-F479 HydrophobicContact CD1-CD2 4.08Å; I449-F479 HydrophobicContact CD1-CE1 4.08Å; I449-F479 HydrophobicContact CD1-CE2 3.49Å; I449-F479 VanDerWaalsContact CD1-CE2 3.49Å; I449-F479 HydrophobicContact CD1-CZ 3.49Å; I449-F479 VanDerWaalsContact CD1-CZ 3.49Å; I449-F479 HydrophobicContact CG2-CD1 4.03Å; I449-F479 HydrophobicContact CG2-CE1 4.26Å; I449-F479 HydrophobicContact CG2-CG 4.16Å; E455-F479 WeakPolarHBondContact O-CA 3.35Å; E455-F479 WeakPolarHBondContact O-CB 3.4Å; E455-F479 WeakPolarHBondContact O-CD1 3.45Å; L456-F479 HydrophobicContact CB-CD1 4Å; L456-F479 HydrophobicContact CB-CE1 3.83Å; L456-F479 HydrophobicContact CD1-CD1 4.03Å; L456-F479 HydrophobicContact CD1-CE1 3.7Å; L456-F479 HydrophobicContact CD1-CE2 4.26Å; L456-F479 HydrophobicContact CD1-CG 4.45Å; L456-F479 HydrophobicContact CD1-CZ 3.83Å; L456-F479 HydrophobicContact CG-CE1 4.32Å; F477-F479 HydrophobicContact CB-CD2 4.34Å; F477-F479 HydrophobicContact CB-CE2 3.51Å; F477-F479 HydrophobicContact CB-CZ 3.96Å; F477-F479 WeakPolarHBondContact O-CD2 3.38Å; F479-H481 PolarHBondContact O-N 3.41Å; F479-Q482 HydrophobicContact CB-CG 4.22Å; F479-Q482 PolarHBondContact N-O 2.89Å; F479-Q482 PolarHBondContact O-N 3.47Å; F479-Q482 VanDerWaalsContact O-O 3.12Å; F479-V484 HydrophobicContact CD2-CG2 4.13Å; F479-V484 HydrophobicContact CE2-CB 4.22Å; F479-V484 HydrophobicContact CE2-CG2 3.99Å; F479-E559 WeakPolarHBondContact O-CG 3.44Å
480	D	93.9	Very high	94.5	Very high	4 Å²	4	41.4 Å²	41.4	2%	0.021	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.4	129.7	161.9	51.1	-34.5	0	0	0	109.8	S453 S454 E455 I457 Q482 V563	S453-D480 WeakPolarHBondContact CA-OD1 3.37Å; S453-D480 VanDerWaalsContact CB-O 3.31Å; S453-D480 WeakPolarHBondContact CB-O 3.26Å; S453-D480 WeakPolarHBondContact CB-OD1 3.29Å; S453-D480 PolarHBondContact OG-O 3.02Å; S454-D480 VanDerWaalsContact N-CG 3.25Å; S454-D480 PolarHBondContact N-OD1 2.94Å; S454-D480 PolarHBondContact N-OD2 3.49Å; S454-D480 PolarHBondContact OG-OD2 3.35Å; E455-D480 PolarHBondContact N-OD1 2.99Å; E455-D480 PolarHBondContact O-N 3.46Å; E455-D480 VanDerWaalsContact O-OD1 3.1Å; I457-D480 HydrophobicContact CD1-CB 4.48Å; D480-Q482 VanDerWaalsContact C-N 3.26Å; D480-Q482 PolarHBondContact O-N 3.09Å; D480-Q482 VanDerWaalsContact O-N 3.15Å; D480-V563 HydrophobicContact CB-CG2 4.13Å
481	H	96.4	Very high	94.7	Very high	43 Å²	43	43.2 Å²	43.2	20%	0.199	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.6	-14.5	-177.7	-53.1	-81.4	0	0	0	117.7	R452 F479 M504 D505 E559 V563	R452-H481 PolarHBondContact O-CD2 3.09Å; F479-H481 PolarHBondContact O-N 3.41Å; H481-M504 PolarHBondContact O-N 3.03Å; H481-D505 IonicContact CE1-OD2 3.42Å; H481-D505 IonicContact CG-OD2 3.13Å; H481-D505 IonicContact ND1-OD1 3.12Å; H481-D505 PolarHBondContact ND1-OD1 3.33Å; H481-D505 IonicContact ND1-OD2 2.82Å; H481-D505 PolarHBondContact ND1-OD2 3.42Å; H481-E559 PolarHBondContact N-OE1 2.97Å; H481-V563 WeakPolarHBondContact CE1-CG1 3.49Å
482	Q	96.7	Very high	94.6	Very high	9 Å²	9	45.9 Å²	45.9	4%	0.042	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	147	-175.5	63.8	-172.3	-32.6	0	0	115.4	I449 S453 F479 D480 L502	I449-Q482 PolarHBondContact O-NE2 2.8Å; S453-Q482 WeakPolarHBondContact OG-CG 3.48Å; S453-Q482 PolarHBondContact OG-NE2 2.7Å; F479-Q482 HydrophobicContact CB-CG 4.22Å; F479-Q482 PolarHBondContact N-O 2.89Å; F479-Q482 PolarHBondContact O-N 3.47Å; F479-Q482 VanDerWaalsContact O-O 3.12Å; D480-Q482 VanDerWaalsContact C-N 3.26Å; D480-Q482 PolarHBondContact O-N 3.09Å; D480-Q482 VanDerWaalsContact O-N 3.15Å; Q482-L502 CarbonylContact C-O 3.55Å; Q482-L502 VanDerWaalsContact CA-O 3.26Å; Q482-L502 WeakPolarHBondContact CA-O 3.29Å
483	L	97.1	Very high	94	Very high	7 Å²	7	53.3 Å²	53.3	4%	0.037	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	113.9	175	179.9	65.5	0	0	0	110.3	F476 L478 R501 L502 M504 L530 F541 W552	F476-L483 HydrophobicContact CB-CD1 4.02Å; F476-L483 HydrophobicContact CD1-CD1 4.23Å; F476-L483 HydrophobicContact CD1-CD2 4.06Å; F476-L483 HydrophobicContact CD1-CG 4.03Å; L478-L483 HydrophobicContact CB-CD1 3.86Å; L478-L483 HydrophobicContact CD1-CB 4.26Å; L478-L483 HydrophobicContact CD1-CD1 4.09Å; L483-R501 CarbonylContact O-C 3.45Å; L483-R501 WeakPolarHBondContact O-CA 3.28Å; L483-L502 HydrophobicContact CB-CB 4.36Å; L483-L502 HydrophobicContact CD2-CD1 4.39Å; L483-L502 PolarHBondContact N-O 3.47Å; L483-L502 PolarHBondContact O-N 2.72Å; L483-M504 HydrophobicContact CB-CG 4.17Å; L483-M504 HydrophobicContact CB-SD 3.83Å; L483-L530 HydrophobicContact CD2-CD1 3.9Å; L483-F541 HydrophobicContact CD2-CZ 4.35Å; L483-W552 HydrophobicContact CD1-CH2 4.38Å; L483-W552 HydrophobicContact CD1-CZ3 4.03Å
484	V	97	Very high	93.6	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	138.1	179.1	-179.3	0	0	0	0	110.8	W437 W444 I449 F476 F477 F479 Y498 R501	W437-V484 HydrophobicContact CH2-CB 4.41Å; W437-V484 HydrophobicContact CH2-CG1 4.04Å; W444-V484 HydrophobicContact CH2-CG1 4.28Å; W444-V484 HydrophobicContact CH2-CG2 4.36Å; W444-V484 HydrophobicContact CZ3-CG1 4.17Å; I449-V484 HydrophobicContact CD1-CG2 4.24Å; F476-V484 CarbonylContact C-O 3.47Å; F476-V484 VanDerWaalsContact CA-O 3.32Å; F476-V484 WeakPolarHBondContact CA-O 3.31Å; F477-V484 HydrophobicContact CB-CB 4.5Å; F477-V484 PolarHBondContact N-O 2.65Å; F477-V484 PolarHBondContact O-N 3.26Å; F479-V484 HydrophobicContact CD2-CG2 4.13Å; F479-V484 HydrophobicContact CE2-CB 4.22Å; F479-V484 HydrophobicContact CE2-CG2 3.99Å; V484-Y498 HydrophobicContact CG1-CD2 4.01Å; V484-Y498 HydrophobicContact CG1-CE2 3.96Å; V484-R501 HydrophobicContact CG2-CB 4.21Å
485	S	96.5	Very high	93.4	Very high	13 Å²	13	52.2 Å²	52.2	9%	0.091	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	134.3	177.6	71.6	0	0	0	0	112	F476 K499 G500	F476-S485 VanDerWaalsContact CE1-CB 3.49Å; S485-K499 PolarHBondContact O-N 3.01Å; S485-G500 PolarHBondContact N-O 2.84Å; S485-G500 PolarHBondContact OG-N 2.92Å; S485-G500 PolarHBondContact OG-O 3.17Å
486	C	96.2	Very high	93.4	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	153.2	178.3	-59.6	0	0	0	0	111.9	R474 T475 F477 L496 Y497	R474-C486 WeakPolarHBondContact CA-O 3.29Å; R474-C486 WeakPolarHBondContact CD-O 3.45Å; T475-C486 PolarHBondContact N-O 3.11Å; T475-C486 PolarHBondContact O-N 3.24Å; F477-C486 HydrophobicContact CE2-CB 4.11Å; C486-L496 HydrophobicContact CB-CB 4.09Å; C486-L496 HydrophobicContact CB-CD2 4.11Å; C486-Y497 CarbonylContact C-O 3.56Å; C486-Y497 WeakPolarHBondContact CA-O 3.13Å
487	K	95.6	Very high	93.4	Very high	85 Å²	85	56.1 Å²	56.1	37%	0.37	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	126.2	169.6	-177.3	-175.7	176.5	-171.9	0	108.9	Y497 K499	K487-Y497 PolarHBondContact N-O 3.44Å; K487-Y497 PolarHBondContact O-N 3Å; K487-K499 HydrophobicContact CB-CD 4.35Å; K487-K499 HydrophobicContact CB-CG 3.84Å
488	K	93.8	Very high	93.4	Very high	86 Å²	86	56.6 Å²	56.6	37%	0.374	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	139.2	170.5	-73	178.8	175.3	177.7	0	110.8	E461 T475 L496	E461-K488 IonicContact OE1-NZ 3.89Å; E461-K488 PolarHBondContact OE1-NZ 3.23Å; T475-K488 WeakPolarHBondContact OG1-CE 3.39Å; K488-L496 HydrophobicContact CB-CD2 4.39Å; K488-L496 HydrophobicContact CG-CD2 3.51Å
489	D	92.8	Very high	93.4	Very high	32 Å²	32	61.9 Å²	61.9	17%	0.171	28%	0.281	C	S	.	.			trans	-63.8	146.9	169.9	-171.2	-105.8	0	0	0	110.8	L491 R492 M495 Y497	D489-L491 VanDerWaalsContact C-N 3.34Å; D489-L491 WeakPolarHBondContact OD1-CA 3.21Å; D489-L491 PolarHBondContact OD1-N 3.49Å; D489-R492 HydrophobicContact CB-CB 4.29Å; D489-R492 WeakPolarHBondContact CB-O 3.36Å; D489-R492 PolarHBondContact OD1-N 3.3Å; D489-M495 HydrophobicContact CB-CB 4.04Å; D489-M495 HydrophobicContact CB-CE 3.47Å; D489-M495 VanDerWaalsContact CB-CE 3.47Å; D489-M495 PolarHBondContact N-O 3.24Å; D489-M495 WeakPolarHBondContact OD2-CE 3.46Å; D489-Y497 HydrophobicContact CB-CD2 4.47Å; D489-Y497 HydrophobicContact CB-CE2 3.79Å; D489-Y497 WeakPolarHBondContact OD2-CE2 3.17Å; D489-Y497 PolarHBondContact OD2-OH 2.96Å
490	L	88.7	Confident	93.3	Very high	146 Å²	146	62.9 Å²	62.9	76%	0.764	29%	0.292	S	S	*	.	S	Bend	trans	-71.6	-30.9	-177.9	-75.6	96.7	0	0	0	112.3
491	L	88.8	Confident	93.4	Very high	161 Å²	161	65.7 Å²	65.7	84%	0.843	30%	0.302	S	S	*	.	S	Bend	trans	-101.4	-43.5	-175.8	-62	172.4	0	0	0	111.2	D489	D489-L491 VanDerWaalsContact C-N 3.34Å; D489-L491 WeakPolarHBondContact OD1-CA 3.21Å; D489-L491 PolarHBondContact OD1-N 3.49Å
492	R	88.8	Confident	93.3	Very high	144 Å²	144	64.5 Å²	64.5	54%	0.543	30%	0.297	S	S	.	.			trans	-104.7	88.3	-177.9	-68.6	-166.5	-68.3	-179.6	-4.2	111.3	D489 D494 M495	D489-R492 HydrophobicContact CB-CB 4.29Å; D489-R492 WeakPolarHBondContact CB-O 3.36Å; D489-R492 PolarHBondContact OD1-N 3.3Å; R492-D494 VanDerWaalsContact C-OD1 3.32Å; R492-D494 WeakPolarHBondContact CB-OD1 3.44Å; R492-D494 PolarHBondContact O-N 3.07Å; R492-M495 HydrophobicContact CB-CB 4.01Å; R492-M495 HydrophobicContact CB-CE 4.4Å; R492-M495 VanDerWaalsContact CZ-SD 3.57Å; R492-M495 VanDerWaalsContact NH2-CE 3.3Å; R492-M495 PolarHBondContact NH2-SD 3.16Å; R492-M495 WeakPolarHBondContact O-CB 3.49Å; R492-M495 PolarHBondContact O-N 3.42Å
493	R	81.2	Confident	93.2	Very high	216 Å²	216	65.9 Å²	65.9	82%	0.815	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-19.7	-175.5	-66.8	-176.2	179	173.3	0.4	114.6
494	D	84.6	Confident	93.2	Very high	104 Å²	104	65.9 Å²	65.9	56%	0.556	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-17.6	174.7	59.7	-47	0	0	0	113.6	R492	R492-D494 VanDerWaalsContact C-OD1 3.32Å; R492-D494 WeakPolarHBondContact CB-OD1 3.44Å; R492-D494 PolarHBondContact O-N 3.07Å
495	M	91.9	Very high	93.1	Very high	20 Å²	20	68.5 Å²	68.5	10%	0.099	32%	0.319	C	S	.	.			trans	-93.2	131	180	-170.2	172.8	59.7	0	0	111.6	V442 D489 R492 Y497	V442-M495 HydrophobicContact CG2-CG 3.79Å; V442-M495 HydrophobicContact CG2-SD 3.86Å; D489-M495 HydrophobicContact CB-CB 4.04Å; D489-M495 HydrophobicContact CB-CE 3.47Å; D489-M495 VanDerWaalsContact CB-CE 3.47Å; D489-M495 PolarHBondContact N-O 3.24Å; D489-M495 WeakPolarHBondContact OD2-CE 3.46Å; R492-M495 HydrophobicContact CB-CB 4.01Å; R492-M495 HydrophobicContact CB-CE 4.4Å; R492-M495 VanDerWaalsContact CZ-SD 3.57Å; R492-M495 VanDerWaalsContact NH2-CE 3.3Å; R492-M495 PolarHBondContact NH2-SD 3.16Å; R492-M495 WeakPolarHBondContact O-CB 3.49Å; R492-M495 PolarHBondContact O-N 3.42Å; M495-Y497 HydrophobicContact CE-CE2 3.62Å; M495-Y497 WeakPolarHBondContact CE-OH 3.44Å; M495-Y497 HydrophobicContact CG-CE2 4.49Å; M495-Y497 HydrophobicContact SD-CE2 4.49Å
496	L	94.9	Very high	92.9	Very high	24 Å²	24	71.8 Å²	71.8	13%	0.126	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	132.9	-179.5	-68.7	171.7	0	0	0	110.2	I441 V442 F477 C486 K488	I441-L496 HydrophobicContact CD1-CB 3.59Å; I441-L496 HydrophobicContact CD1-CD1 3.86Å; I441-L496 HydrophobicContact CD1-CG 4.38Å; V442-L496 PolarHBondContact N-O 3.29Å; F477-L496 HydrophobicContact CE2-CD1 3.99Å; F477-L496 HydrophobicContact CZ-CD1 3.59Å; C486-L496 HydrophobicContact CB-CB 4.09Å; C486-L496 HydrophobicContact CB-CD2 4.11Å; K488-L496 HydrophobicContact CB-CD2 4.39Å; K488-L496 HydrophobicContact CG-CD2 3.51Å
497	Y	96.7	Very high	92.8	Very high	74 Å²	74	72.5 Å²	72.5	29%	0.29	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	129.9	174	-67	-86.7	0	0	0	110.5	V442 C486 K487 D489 M495	V442-Y497 HydrophobicContact CB-CD1 3.74Å; V442-Y497 HydrophobicContact CB-CE1 3.87Å; V442-Y497 HydrophobicContact CB-CG 4.49Å; V442-Y497 HydrophobicContact CG1-CD1 3.71Å; V442-Y497 HydrophobicContact CG1-CE1 3.52Å; V442-Y497 WeakPolarHBondContact O-CA 3.47Å; C486-Y497 CarbonylContact C-O 3.56Å; C486-Y497 WeakPolarHBondContact CA-O 3.13Å; K487-Y497 PolarHBondContact N-O 3.44Å; K487-Y497 PolarHBondContact O-N 3Å; D489-Y497 HydrophobicContact CB-CD2 4.47Å; D489-Y497 HydrophobicContact CB-CE2 3.79Å; D489-Y497 WeakPolarHBondContact OD2-CE2 3.17Å; D489-Y497 PolarHBondContact OD2-OH 2.96Å; M495-Y497 HydrophobicContact CE-CE2 3.62Å; M495-Y497 WeakPolarHBondContact CE-OH 3.44Å; M495-Y497 HydrophobicContact CG-CE2 4.49Å; M495-Y497 HydrophobicContact SD-CE2 4.49Å
498	Y	97.6	Very high	92.8	Very high	21 Å²	21	72.8 Å²	72.8	8%	0.082	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.2	141.9	173.4	179.6	-99	0	0	0	111.4	V442 G443 W444 E445 V484 R501	V442-Y498 PolarHBondContact O-N 3.09Å; G443-Y498 WeakPolarHBondContact O-CB 3.33Å; W444-Y498 HydrophobicContact CD2-CD2 4.49Å; W444-Y498 AromaticContact CE3-CD2 3.84Å; W444-Y498 HydrophobicContact CE3-CD2 3.84Å; W444-Y498 HydrophobicContact CE3-CE2 4.45Å; W444-Y498 HydrophobicContact CE3-CG 4.42Å; W444-Y498 HydrophobicContact CH2-CD2 4.42Å; W444-Y498 HydrophobicContact CH2-CE2 4.36Å; W444-Y498 AromaticContact CZ3-CD2 3.81Å; W444-Y498 HydrophobicContact CZ3-CD2 3.81Å; W444-Y498 HydrophobicContact CZ3-CE2 4.21Å; E445-Y498 HydrophobicContact CB-CD1 4Å; E445-Y498 HydrophobicContact CB-CE1 3.72Å; E445-Y498 HydrophobicContact CG-CD1 4.28Å; E445-Y498 HydrophobicContact CG-CE1 4.41Å; E445-Y498 PolarHBondContact O-OH 3.24Å; V484-Y498 HydrophobicContact CG1-CD2 4.01Å; V484-Y498 HydrophobicContact CG1-CE2 3.96Å; Y498-R501 PolarHBondContact OH-N 2.86Å; Y498-R501 PolarHBondContact OH-NE 3.07Å
499	K	95.9	Very high	92.8	Very high	111 Å²	111	71.6 Å²	71.6	48%	0.483	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	-6.4	179.2	-68.6	-66.7	154.7	-138.7	0	114.9	S485 K487	S485-K499 PolarHBondContact O-N 3.01Å; K487-K499 HydrophobicContact CB-CD 4.35Å; K487-K499 HydrophobicContact CB-CG 3.84Å
500	G	94.8	Very high	92.9	Very high	21 Å²	21	72.6 Å²	72.6	22%	0.216	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	138.4	168.4	-179.9	0	0	0	0	0	111.9	S485	S485-G500 PolarHBondContact N-O 2.84Å; S485-G500 PolarHBondContact OG-N 2.92Å; S485-G500 PolarHBondContact OG-O 3.17Å
501	R	95.4	Very high	93.2	Very high	62 Å²	62	70.2 Å²	70.2	23%	0.234	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	157.3	177.6	67	-176.5	75.9	-172.1	9.5	110.2	W444 E445 L447 L483 V484 Y498	W444-R501 VanDerWaalsContact CZ2-NH2 3.26Å; E445-R501 PolarHBondContact O-NH2 3.34Å; L447-R501 PolarHBondContact O-NH1 3.11Å; L447-R501 PolarHBondContact O-NH2 2.87Å; L483-R501 CarbonylContact O-C 3.45Å; L483-R501 WeakPolarHBondContact O-CA 3.28Å; V484-R501 HydrophobicContact CG2-CB 4.21Å; Y498-R501 PolarHBondContact OH-N 2.86Å; Y498-R501 PolarHBondContact OH-NE 3.07Å
502	L	94.6	Very high	93.4	Very high	18 Å²	18	63.7 Å²	63.7	9%	0.094	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	138.1	171.8	-61.2	176.2	0	0	0	108.6	Q482 L483 M504 L530 Y539 F541	Q482-L502 CarbonylContact C-O 3.55Å; Q482-L502 VanDerWaalsContact CA-O 3.26Å; Q482-L502 WeakPolarHBondContact CA-O 3.29Å; L483-L502 HydrophobicContact CB-CB 4.36Å; L483-L502 HydrophobicContact CD2-CD1 4.39Å; L483-L502 PolarHBondContact N-O 3.47Å; L483-L502 PolarHBondContact O-N 2.72Å; L502-M504 PolarHBondContact O-N 3.43Å; L502-L530 HydrophobicContact CD1-CD1 4.33Å; L502-Y539 HydrophobicContact CD1-CD1 4.38Å; L502-Y539 HydrophobicContact CD1-CD2 3.89Å; L502-Y539 HydrophobicContact CD1-CE2 4.21Å; L502-Y539 HydrophobicContact CD1-CG 3.96Å; L502-Y539 HydrophobicContact CD2-CD1 4.48Å; L502-Y539 HydrophobicContact CD2-CD2 4.04Å; L502-Y539 HydrophobicContact CD2-CE1 3.95Å; L502-Y539 HydrophobicContact CD2-CE2 3.48Å; L502-Y539 VanDerWaalsContact CD2-CE2 3.48Å; L502-Y539 HydrophobicContact CD2-CG 4.49Å; L502-Y539 VanDerWaalsContact CD2-CZ 3.4Å; L502-F541 HydrophobicContact CD1-CZ 4.18Å
503	D	95.2	Very high	93.4	Very high	38 Å²	38	59.8 Å²	59.8	20%	0.203	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	115.5	170.8	-170.7	-17.4	0	0	0	108.7	R452 D505 M507	R452-D503 IonicContact CZ-OD1 3.63Å; R452-D503 IonicContact CZ-OD2 3.11Å; R452-D503 VanDerWaalsContact CZ-OD2 3.3Å; R452-D503 IonicContact NH1-OD1 3.7Å; R452-D503 IonicContact NH1-OD2 2.77Å; R452-D503 PolarHBondContact NH1-OD2 2.97Å; R452-D503 VanDerWaalsContact NH2-CG 3.34Å; R452-D503 IonicContact NH2-OD1 3.57Å; R452-D503 PolarHBondContact NH2-OD1 3.17Å; R452-D503 IonicContact NH2-OD2 2.75Å; R452-D503 PolarHBondContact NH2-OD2 3.31Å; D503-D505 PolarHBondContact O-N 3.11Å; D503-D505 VanDerWaalsContact OD1-CB 3.28Å; D503-D505 WeakPolarHBondContact OD1-CB 3.39Å; D503-D505 PolarHBondContact OD1-N 3.29Å; D503-M507 WeakPolarHBondContact O-CG 3.45Å
504	M	95.8	Very high	93.8	Very high	7 Å²	7	53.8 Å²	53.8	3%	0.034	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-74.7	-18.5	-178.7	-68.5	-64.8	-62.1	0	0	112.1	L478 H481 L483 L502 E506 M507 L530 C556 R560	L478-M504 HydrophobicContact CD1-CE 3.99Å; L478-M504 HydrophobicContact CD1-CG 3.87Å; L478-M504 HydrophobicContact CD1-SD 4.01Å; H481-M504 PolarHBondContact O-N 3.03Å; L483-M504 HydrophobicContact CB-CG 4.17Å; L483-M504 HydrophobicContact CB-SD 3.83Å; L502-M504 PolarHBondContact O-N 3.43Å; M504-E506 VanDerWaalsContact C-N 3.26Å; M504-E506 PolarHBondContact O-N 2.87Å; M504-M507 PolarHBondContact O-N 3.07Å; M504-L530 HydrophobicContact CE-CD1 4.47Å; M504-L530 HydrophobicContact CE-CD2 4.29Å; M504-L530 HydrophobicContact SD-CD1 4Å; M504-C556 HydrophobicContact CE-CB 4.5Å; M504-R560 VanDerWaalsContact CB-NH2 3.27Å; M504-R560 VanDerWaalsContact O-CZ 3.3Å; M504-R560 PolarHBondContact O-NH1 3.02Å
505	D	94.6	Very high	94	Very high	56 Å²	56	50.4 Å²	50.4	30%	0.299	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-67.2	-28.8	178.3	-61	-27.5	0	0	0	113.1	R452 H481 D503 R560	R452-D505 IonicContact NH2-OD2 3.51Å; R452-D505 PolarHBondContact NH2-OD2 3.43Å; H481-D505 IonicContact CE1-OD2 3.42Å; H481-D505 IonicContact CG-OD2 3.13Å; H481-D505 IonicContact ND1-OD1 3.12Å; H481-D505 PolarHBondContact ND1-OD1 3.33Å; H481-D505 IonicContact ND1-OD2 2.82Å; H481-D505 PolarHBondContact ND1-OD2 3.42Å; D503-D505 PolarHBondContact O-N 3.11Å; D503-D505 VanDerWaalsContact OD1-CB 3.28Å; D503-D505 WeakPolarHBondContact OD1-CB 3.39Å; D503-D505 PolarHBondContact OD1-N 3.29Å; D505-R560 VanDerWaalsContact CA-NH1 3.27Å; D505-R560 IonicContact OD1-CZ 3.81Å; D505-R560 VanDerWaalsContact OD1-CZ 3.32Å; D505-R560 IonicContact OD1-NH1 3.85Å; D505-R560 PolarHBondContact OD1-NH1 2.98Å; D505-R560 IonicContact OD1-NH2 3.45Å; D505-R560 PolarHBondContact OD1-NH2 2.92Å
506	E	94	Very high	93.6	Very high	82 Å²	82	59.4 Å²	59.4	38%	0.383	31%	0.308	S	S	.	.	G	3₁₀ helix	trans	-96.6	7.3	178	-58	-168.5	177.1	0	0	113.1	M504 S532 R533 T534	M504-E506 VanDerWaalsContact C-N 3.26Å; M504-E506 PolarHBondContact O-N 2.87Å; E506-S532 CarbonylContact O-C 3.57Å; E506-S532 WeakPolarHBondContact O-CA 3.3Å; E506-R533 PolarHBondContact O-N 3.24Å; E506-T534 HydrophobicContact CG-CG2 4.37Å; E506-T534 PolarHBondContact OE2-OG1 3.44Å
507	M	93.8	Very high	92.9	Very high	15 Å²	15	58.8 Å²	58.8	7%	0.074	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	147.1	-172.8	-61.1	-73.2	155	0	0	112.2	D503 M504 L530 V531 Y539	D503-M507 WeakPolarHBondContact O-CG 3.45Å; M504-M507 PolarHBondContact O-N 3.07Å; M507-L530 HydrophobicContact CB-CB 4.44Å; M507-L530 HydrophobicContact CB-CD2 4.48Å; M507-L530 HydrophobicContact SD-CB 4.28Å; M507-V531 CarbonylContact C-O 3.58Å; M507-V531 WeakPolarHBondContact CA-O 3.3Å; M507-Y539 HydrophobicContact CE-CE2 4.16Å; M507-Y539 HydrophobicContact SD-CD2 4.28Å; M507-Y539 HydrophobicContact SD-CE2 4.42Å
508	E	94	Very high	91.9	Very high	90 Å²	90	64.5 Å²	64.5	42%	0.421	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	131.5	170.1	-171.8	166.8	152	0	0	109.9	L530 V531 R533	E508-L530 WeakPolarHBondContact O-CA 3.45Å; E508-V531 PolarHBondContact N-O 3.31Å; E508-V531 PolarHBondContact O-N 3.28Å; E508-R533 HydrophobicContact CB-CG 4.4Å; E508-R533 IonicContact OE2-CZ 2.65Å; E508-R533 IonicContact OE2-NH1 2.64Å; E508-R533 PolarHBondContact OE2-NH1 3.43Å; E508-R533 IonicContact OE2-NH2 3.99Å
509	L	95.1	Very high	90.7	Very high	62 Å²	62	69.1 Å²	69.1	33%	0.325	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	122.3	-179.9	-176.7	70.9	0	0	0	110.3	F528 L530 L553 C556	L509-F528 HydrophobicContact CD1-CD2 3.77Å; L509-F528 HydrophobicContact CD1-CE2 4.31Å; L509-L530 HydrophobicContact CB-CD2 4.34Å; L509-L530 HydrophobicContact CD1-CD2 3.69Å; L509-L553 HydrophobicContact CD1-CD2 3.95Å; L509-L553 HydrophobicContact CD2-CD2 3.77Å; L509-L553 HydrophobicContact CG-CD2 3.98Å; L509-C556 HydrophobicContact CD1-CB 4.21Å; L509-C556 HydrophobicContact CD2-CB 3.71Å; L509-C556 HydrophobicContact CG-CB 4.46Å
510	V	94.5	Very high	89.4	Confident	52 Å²	52	65.9 Å²	65.9	32%	0.315	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	114.5	177.2	-178.6	0	0	0	0	109.3	L512 F528 K529 V531	V510-L512 HydrophobicContact CG1-CD2 4.19Å; V510-F528 CarbonylContact O-C 3.6Å; V510-F528 WeakPolarHBondContact O-CA 3.5Å; V510-K529 HydrophobicContact CB-CB 4.16Å; V510-K529 PolarHBondContact N-O 3.33Å; V510-K529 PolarHBondContact O-N 3.01Å; V510-V531 HydrophobicContact CG2-CG2 3.96Å
511	D	94.5	Very high	88.5	Confident	97 Å²	97	71.3 Å²	71.3	52%	0.519	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	130.5	173.8	-172.7	8.9	0	0	0	110.7	K549 L553	D511-K549 WeakPolarHBondContact OD1-CE 3.29Å; D511-K549 IonicContact OD1-NZ 2.69Å; D511-K549 PolarHBondContact OD1-NZ 2.98Å; D511-L553 HydrophobicContact CB-CD1 4.23Å; D511-L553 HydrophobicContact CB-CD2 4.31Å
512	L	92.6	Very high	87.8	Confident	24 Å²	24	71 Å²	71	13%	0.126	38%	0.375	C	S	.	.			trans	-111.8	127.1	179.4	-62.1	-179.1	0	0	0	111.6	V510 A527 K529 L540 K549	V510-L512 HydrophobicContact CG1-CD2 4.19Å; L512-A527 HydrophobicContact CB-CB 4.43Å; L512-A527 HydrophobicContact CD1-CB 4.4Å; L512-A527 PolarHBondContact N-O 2.96Å; L512-A527 VanDerWaalsContact O-O 3.09Å; L512-K529 HydrophobicContact CD1-CD 3.81Å; L512-K529 HydrophobicContact CD1-CG 3.76Å; L512-K529 HydrophobicContact CD2-CD 4.27Å; L512-K529 HydrophobicContact CG-CD 4.39Å; L512-K529 HydrophobicContact CG-CG 4.41Å; L512-L540 HydrophobicContact CD1-CD1 3.55Å; L512-K549 PolarHBondContact O-NZ 3.47Å
513	G	90	Very high	87.3	Confident	62 Å²	62	75.1 Å²	75.1	64%	0.639	41%	0.405	S	S	*	.			trans	-63.2	156.6	167.5	0	0	0	0	0	112.4	G515	G513-G515 PolarHBondContact O-N 3.25Å
514	D	90.3	Very high	87.1	Confident	90 Å²	90	73.6 Å²	73.6	48%	0.481	40%	0.397	S	S	.	.	S	Bend	trans	-64.4	133.5	171.6	-76.6	-1.9	0	0	0	109.8	K525 N526	D514-K525 WeakPolarHBondContact OD1-CA 3.34Å; D514-K525 WeakPolarHBondContact OD2-CG 3.41Å; D514-N526 PolarHBondContact OD1-N 3.26Å
515	G	88.3	Confident	86.9	Confident	33 Å²	33	79.8 Å²	79.8	34%	0.34	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	148.4	-156.6	-177.8	0	0	0	0	0	113	G513 S523 V524	G513-G515 PolarHBondContact O-N 3.25Å; G515-S523 CarbonylContact O-C 3.57Å; G515-S523 WeakPolarHBondContact O-CA 3.43Å; G515-V524 PolarHBondContact N-O 2.94Å; G515-V524 VanDerWaalsContact N-O 3.12Å; G515-V524 PolarHBondContact O-N 3.25Å
516	R	83.3	Confident	86.8	Confident	209 Å²	209	77.8 Å²	77.8	79%	0.789	41%	0.413	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.6	125	172.9	-72.3	-167.1	-169.4	-164	4.6	110.2	L522	R516-L522 WeakPolarHBondContact CA-O 3.29Å
517	D	81	Confident	86.9	Confident	10 Å²	10	73.9 Å²	73.9	5%	0.053	40%	0.395	C	S	.	.			trans	-71.1	129.8	170.7	-175.8	57.2	0	0	0	110.5	D519 C520 N521 L522 V524 K529	D517-D519 VanDerWaalsContact C-N 3.29Å; D517-D519 PolarHBondContact O-N 2.95Å; D517-D519 PolarHBondContact OD2-N 3.38Å; D517-C520 WeakPolarHBondContact OD2-CB 3.35Å; D517-C520 PolarHBondContact OD2-N 2.99Å; D517-C520 PolarHBondContact OD2-SG 3.48Å; D517-C520 VanDerWaalsContact OD2-SG 3.38Å; D517-N521 WeakPolarHBondContact O-CA 3.42Å; D517-N521 PolarHBondContact O-N 3.39Å; D517-N521 VanDerWaalsContact O-N 3.08Å; D517-L522 PolarHBondContact N-O 3.23Å; D517-V524 HydrophobicContact CB-CG1 4.29Å; D517-V524 HydrophobicContact CB-CG2 4.2Å; D517-K529 WeakPolarHBondContact OD1-CE 3.35Å; D517-K529 IonicContact OD1-NZ 2.77Å; D517-K529 PolarHBondContact OD1-NZ 3.42Å; D517-K529 WeakPolarHBondContact OD2-CE 3.34Å; D517-K529 IonicContact OD2-NZ 2.63Å; D517-K529 PolarHBondContact OD2-NZ 2.97Å
518	K	74.9	Confident	87	Confident	194 Å²	194	73.3 Å²	73.3	84%	0.843	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-32.3	-176.8	-66.6	-178.5	-178.8	177.4	0	112.6
519	D	72.3	Confident	87	Confident	119 Å²	119	69.2 Å²	69.2	64%	0.636	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	-38.9	-172.2	-51.6	-32	0	0	0	111.7	D517 K529	D517-D519 VanDerWaalsContact C-N 3.29Å; D517-D519 PolarHBondContact O-N 2.95Å; D517-D519 PolarHBondContact OD2-N 3.38Å; D519-K529 IonicContact OD2-NZ 3.7Å; D519-K529 PolarHBondContact OD2-NZ 2.96Å
520	C	68.3	Low	86.9	Confident	43 Å²	43	66.3 Å²	66.3	29%	0.291	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96	-10.2	-176.2	-58.9	0	0	0	0	113.8	D517 L522 L540	D517-C520 WeakPolarHBondContact OD2-CB 3.35Å; D517-C520 PolarHBondContact OD2-N 2.99Å; D517-C520 PolarHBondContact OD2-SG 3.48Å; D517-C520 VanDerWaalsContact OD2-SG 3.38Å; C520-L522 HydrophobicContact CB-CB 4.22Å; C520-L522 HydrophobicContact CB-CD1 3.94Å; C520-L522 HydrophobicContact CB-CG 4.04Å; C520-L522 WeakPolarHBondContact O-CG 3.39Å; C520-L522 PolarHBondContact O-N 3.04Å; C520-L522 VanDerWaalsContact O-N 3.12Å; C520-L540 HydrophobicContact CB-CD2 4.48Å
521	N	75.3	Confident	86.9	Confident	134 Å²	134	66 Å²	66	72%	0.717	36%	0.356	S	S	*	.			trans	52.9	26.3	-169.7	-78.5	-40.6	0	0	0	113.7	D517	D517-N521 WeakPolarHBondContact O-CA 3.42Å; D517-N521 PolarHBondContact O-N 3.39Å; D517-N521 VanDerWaalsContact O-N 3.08Å
522	L	80.5	Confident	86.8	Confident	55 Å²	55	61.8 Å²	61.8	29%	0.288	33%	0.334	S	S	.	.			trans	-105.1	141.1	-179.7	-67.7	172	0	0	0	110.4	I465 R516 D517 C520 V524	I465-L522 HydrophobicContact CG2-CD1 3.55Å; R516-L522 WeakPolarHBondContact CA-O 3.29Å; D517-L522 PolarHBondContact N-O 3.23Å; C520-L522 HydrophobicContact CB-CB 4.22Å; C520-L522 HydrophobicContact CB-CD1 3.94Å; C520-L522 HydrophobicContact CB-CG 4.04Å; C520-L522 WeakPolarHBondContact O-CG 3.39Å; C520-L522 PolarHBondContact O-N 3.04Å; C520-L522 VanDerWaalsContact O-N 3.12Å; L522-V524 HydrophobicContact CB-CG1 4.41Å; L522-V524 PolarHBondContact O-N 3.47Å
523	S	85.6	Confident	86.7	Confident	105 Å²	105	68.2 Å²	68.2	73%	0.734	36%	0.357	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.9	115.8	168	-167.9	0	0	0	0	108.6	G515	G515-S523 CarbonylContact O-C 3.57Å; G515-S523 WeakPolarHBondContact O-CA 3.43Å
524	V	89.5	Confident	86.6	Confident	6 Å²	6	69.5 Å²	69.5	4%	0.036	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	145.6	-178	-64.1	0	0	0	0	110.4	G515 D517 L522 A527 L540	G515-V524 PolarHBondContact N-O 2.94Å; G515-V524 VanDerWaalsContact N-O 3.12Å; G515-V524 PolarHBondContact O-N 3.25Å; D517-V524 HydrophobicContact CB-CG1 4.29Å; D517-V524 HydrophobicContact CB-CG2 4.2Å; L522-V524 HydrophobicContact CB-CG1 4.41Å; L522-V524 PolarHBondContact O-N 3.47Å; V524-A527 HydrophobicContact CB-CB 3.71Å; V524-A527 HydrophobicContact CG1-CB 4.44Å; V524-A527 HydrophobicContact CG2-CB 3.98Å; V524-L540 HydrophobicContact CG1-CD1 4.36Å; V524-L540 HydrophobicContact CG1-CD2 3.84Å
525	K	92.2	Very high	86.6	Confident	137 Å²	137	68.3 Å²	68.3	60%	0.596	35%	0.348	S	S	*	.	S	Bend	trans	-134.6	137.8	175.6	-168	176.1	-175.8	172.5	0	109.5	D514 A527	D514-K525 WeakPolarHBondContact OD1-CA 3.34Å; D514-K525 WeakPolarHBondContact OD2-CG 3.41Å; K525-A527 VanDerWaalsContact C-N 3.27Å; K525-A527 PolarHBondContact O-N 2.95Å
526	N	93.9	Very high	86.4	Confident	14 Å²	14	73.2 Å²	73.2	8%	0.075	37%	0.367	C	S	.	.	S	Bend	trans	48.4	48.6	-174.8	-44.6	-55.1	0	0	0	111.7	D514 A543 K544 Q546 K549	D514-N526 PolarHBondContact OD1-N 3.26Å; N526-A543 HydrophobicContact CB-CB 4.24Å; N526-A543 WeakPolarHBondContact CB-O 3.36Å; N526-A543 PolarHBondContact ND2-O 3.01Å; N526-A543 PolarHBondContact O-N 3.34Å; N526-K544 PolarHBondContact ND2-O 3.36Å; N526-Q546 WeakPolarHBondContact OD1-CA 3.41Å; N526-Q546 PolarHBondContact OD1-N 2.89Å; N526-Q546 PolarHBondContact OD1-OE1 3.49Å; N526-K549 HydrophobicContact CB-CB 4.19Å; N526-K549 HydrophobicContact CB-CD 4.36Å
527	A	94.7	Very high	86.6	Confident	0 Å²	0	67.6 Å²	67.6	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	158.7	-172	0	0	0	0	0	114	L512 V524 K525 L540 F541 K549	L512-A527 HydrophobicContact CB-CB 4.43Å; L512-A527 HydrophobicContact CD1-CB 4.4Å; L512-A527 PolarHBondContact N-O 2.96Å; L512-A527 VanDerWaalsContact O-O 3.09Å; V524-A527 HydrophobicContact CB-CB 3.71Å; V524-A527 HydrophobicContact CG1-CB 4.44Å; V524-A527 HydrophobicContact CG2-CB 3.98Å; K525-A527 VanDerWaalsContact C-N 3.27Å; K525-A527 PolarHBondContact O-N 2.95Å; A527-L540 HydrophobicContact CB-CD1 4.23Å; A527-F541 CarbonylContact C-O 3.57Å; A527-F541 WeakPolarHBondContact CA-O 3.2Å; A527-F541 WeakPolarHBondContact CB-O 3.3Å; A527-K549 WeakPolarHBondContact O-CE 3.29Å; A527-K549 PolarHBondContact O-NZ 3.43Å; A527-K549 VanDerWaalsContact O-NZ 3.15Å
528	F	95.6	Very high	87	Confident	3 Å²	3	68.8 Å²	68.8	1%	0.013	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	162.6	170.4	64.2	-88.8	0	0	0	109.5	L462 L509 V510 F541 K549 W552 L553	L462-F528 HydrophobicContact CD1-CE1 4.17Å; L462-F528 HydrophobicContact CD1-CZ 3.71Å; L462-F528 HydrophobicContact CD2-CE1 4.24Å; L509-F528 HydrophobicContact CD1-CD2 3.77Å; L509-F528 HydrophobicContact CD1-CE2 4.31Å; V510-F528 CarbonylContact O-C 3.6Å; V510-F528 WeakPolarHBondContact O-CA 3.5Å; F528-F541 HydrophobicContact CD1-CB 4.25Å; F528-F541 HydrophobicContact CD2-CB 4.25Å; F528-F541 HydrophobicContact CD2-CD2 4.08Å; F528-F541 HydrophobicContact CE1-CB 3.84Å; F528-F541 HydrophobicContact CE2-CB 3.84Å; F528-F541 AromaticContact CE2-CD2 3.64Å; F528-F541 HydrophobicContact CE2-CD2 3.64Å; F528-F541 HydrophobicContact CE2-CE2 4.47Å; F528-F541 AromaticContact CE2-CG 3.92Å; F528-F541 HydrophobicContact CE2-CG 3.92Å; F528-F541 HydrophobicContact CG-CB 4.45Å; F528-F541 HydrophobicContact CZ-CB 3.63Å; F528-F541 HydrophobicContact CZ-CD2 4.21Å; F528-F541 HydrophobicContact CZ-CG 4.01Å; F528-F541 PolarHBondContact N-O 3.46Å; F528-F541 PolarHBondContact O-N 3.3Å; F528-K549 HydrophobicContact CD1-CG 4.38Å; F528-W552 HydrophobicContact CE1-CB 3.78Å; F528-W552 HydrophobicContact CE1-CG 4.24Å; F528-W552 HydrophobicContact CZ-CB 3.85Å; F528-W552 HydrophobicContact CZ-CG 4.19Å; F528-L553 HydrophobicContact CB-CD2 3.83Å; F528-L553 HydrophobicContact CG-CD2 4.13Å
529	K	93.9	Very high	87.8	Confident	4 Å²	4	61.2 Å²	61.2	2%	0.017	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	147.3	178.5	-81.6	169.3	176.2	169.5	0	111.6	V510 L512 D517 D519 V531 V538 Y539 L540	V510-K529 HydrophobicContact CB-CB 4.16Å; V510-K529 PolarHBondContact N-O 3.33Å; V510-K529 PolarHBondContact O-N 3.01Å; L512-K529 HydrophobicContact CD1-CD 3.81Å; L512-K529 HydrophobicContact CD1-CG 3.76Å; L512-K529 HydrophobicContact CD2-CD 4.27Å; L512-K529 HydrophobicContact CG-CD 4.39Å; L512-K529 HydrophobicContact CG-CG 4.41Å; D517-K529 WeakPolarHBondContact OD1-CE 3.35Å; D517-K529 IonicContact OD1-NZ 2.77Å; D517-K529 PolarHBondContact OD1-NZ 3.42Å; D517-K529 WeakPolarHBondContact OD2-CE 3.34Å; D517-K529 IonicContact OD2-NZ 2.63Å; D517-K529 PolarHBondContact OD2-NZ 2.97Å; D519-K529 IonicContact OD2-NZ 3.7Å; D519-K529 PolarHBondContact OD2-NZ 2.96Å; K529-V531 HydrophobicContact CB-CG2 4.3Å; K529-V538 HydrophobicContact CB-CG1 4.41Å; K529-V538 HydrophobicContact CD-CG1 3.71Å; K529-V538 HydrophobicContact CG-CG1 3.94Å; K529-Y539 CarbonylContact C-O 3.56Å; K529-Y539 VanDerWaalsContact CA-O 3.28Å; K529-Y539 WeakPolarHBondContact CA-O 3.2Å; K529-L540 HydrophobicContact CG-CB 4.38Å; K529-L540 HydrophobicContact CG-CD1 3.86Å
530	L	94.4	Very high	88.8	Confident	2 Å²	2	55.7 Å²	55.7	1%	0.01	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	118.9	157.6	-64	175.7	0	0	0	107.7	L483 L502 M504 M507 E508 L509 Y539 F541	L483-L530 HydrophobicContact CD2-CD1 3.9Å; L502-L530 HydrophobicContact CD1-CD1 4.33Å; M504-L530 HydrophobicContact CE-CD1 4.47Å; M504-L530 HydrophobicContact CE-CD2 4.29Å; M504-L530 HydrophobicContact SD-CD1 4Å; M507-L530 HydrophobicContact CB-CB 4.44Å; M507-L530 HydrophobicContact CB-CD2 4.48Å; M507-L530 HydrophobicContact SD-CB 4.28Å; E508-L530 WeakPolarHBondContact O-CA 3.45Å; L509-L530 HydrophobicContact CB-CD2 4.34Å; L509-L530 HydrophobicContact CD1-CD2 3.69Å; L530-Y539 PolarHBondContact N-O 3.29Å; L530-Y539 PolarHBondContact O-N 3.33Å; L530-F541 HydrophobicContact CB-CE2 4.1Å; L530-F541 HydrophobicContact CD1-CE2 3.72Å; L530-F541 HydrophobicContact CD1-CZ 4.17Å; L530-F541 HydrophobicContact CG-CD2 4.43Å; L530-F541 HydrophobicContact CG-CE2 3.81Å
531	V	93.2	Very high	90.1	Very high	45 Å²	45	53.6 Å²	53.6	27%	0.273	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	126.8	179.9	-178.1	0	0	0	0	107.8	M507 E508 V510 K529 V538	M507-V531 CarbonylContact C-O 3.58Å; M507-V531 WeakPolarHBondContact CA-O 3.3Å; E508-V531 PolarHBondContact N-O 3.31Å; E508-V531 PolarHBondContact O-N 3.28Å; V510-V531 HydrophobicContact CG2-CG2 3.96Å; K529-V531 HydrophobicContact CB-CG2 4.3Å; V531-V538 HydrophobicContact CG1-CG2 4.26Å; V531-V538 HydrophobicContact CG2-CG1 4.28Å; V531-V538 HydrophobicContact CG2-CG2 4.31Å
532	S	92.9	Very high	91	Very high	9 Å²	9	48.1 Å²	48.1	6%	0.063	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	137.1	175.2	174.7	0	0	0	0	110.4	E506 T534 T535 E537	E506-S532 CarbonylContact O-C 3.57Å; E506-S532 WeakPolarHBondContact O-CA 3.3Å; S532-T534 PolarHBondContact OG-N 3.41Å; S532-T534 PolarHBondContact OG-OG1 3.04Å; S532-T534 VanDerWaalsContact OG-OG1 3.08Å; S532-T535 CarbonylContact C-O 3.58Å; S532-T535 WeakPolarHBondContact CB-O 3.5Å; S532-T535 WeakPolarHBondContact CB-OG1 3.4Å; S532-T535 PolarHBondContact OG-N 2.88Å; S532-T535 PolarHBondContact OG-OG1 2.61Å; S532-E537 PolarHBondContact N-O 2.88Å
533	R	90.8	Very high	91.8	Very high	158 Å²	158	45.9 Å²	45.9	60%	0.596	24%	0.241	S	C	*	.	S	Bend	trans	-77.6	-26.1	175.5	-62.8	178.7	-177.2	-78.2	-3.2	112	E506 E508	E506-R533 PolarHBondContact O-N 3.24Å; E508-R533 HydrophobicContact CB-CG 4.4Å; E508-R533 IonicContact OE2-CZ 2.65Å; E508-R533 IonicContact OE2-NH1 2.64Å; E508-R533 PolarHBondContact OE2-NH1 3.43Å; E508-R533 IonicContact OE2-NH2 3.99Å
534	T	88.8	Confident	92.2	Very high	89 Å²	89	47 Å²	47	55%	0.546	23%	0.233	S	C	.	.	S	Bend	trans	-101.1	-28.9	-173	49.6	0	0	0	0	112	E506 S532	E506-T534 HydrophobicContact CG-CG2 4.37Å; E506-T534 PolarHBondContact OE2-OG1 3.44Å; S532-T534 PolarHBondContact OG-N 3.41Å; S532-T534 PolarHBondContact OG-OG1 3.04Å; S532-T534 VanDerWaalsContact OG-OG1 3.08Å
535	T	88.4	Confident	92.4	Very high	65 Å²	65	52.7 Å²	52.7	40%	0.399	26%	0.257	S	S	.	.	S	Bend	trans	-126.1	159.2	-176.7	69.9	0	0	0	0	111	S532 E537	S532-T535 CarbonylContact C-O 3.58Å; S532-T535 WeakPolarHBondContact CB-O 3.5Å; S532-T535 WeakPolarHBondContact CB-OG1 3.4Å; S532-T535 PolarHBondContact OG-N 2.88Å; S532-T535 PolarHBondContact OG-OG1 2.61Å; T535-E537 PolarHBondContact O-N 2.75Å; T535-E537 WeakPolarHBondContact OG1-CB 3.35Å; T535-E537 WeakPolarHBondContact OG1-CG 3.41Å; T535-E537 PolarHBondContact OG1-N 3Å
536	D	84.5	Confident	92.5	Very high	137 Å²	137	51.1 Å²	51.1	73%	0.733	25%	0.252	S	S	*	.	S	Bend	trans	-78.1	27.5	173.3	-171.1	46.9	0	0	0	112.4	K467	K467-D536 PolarHBondContact NZ-O 3.35Å
537	E	88.3	Confident	92.6	Very high	90 Å²	90	56.3 Å²	56.3	42%	0.421	28%	0.276	S	S	.	.			trans	-84.8	127	178.3	-66.5	-163.5	149.1	0	0	111.4	S532 T535 Y539	S532-E537 PolarHBondContact N-O 2.88Å; T535-E537 PolarHBondContact O-N 2.75Å; T535-E537 WeakPolarHBondContact OG1-CB 3.35Å; T535-E537 WeakPolarHBondContact OG1-CG 3.41Å; T535-E537 PolarHBondContact OG1-N 3Å; E537-Y539 HydrophobicContact CB-CE2 3.95Å; E537-Y539 PolarHBondContact OE2-OH 3.45Å
538	V	89.5	Confident	92.6	Very high	35 Å²	35	58.4 Å²	58.4	21%	0.212	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	125.8	178.1	-179.4	0	0	0	0	109	K529 V531	K529-V538 HydrophobicContact CB-CG1 4.41Å; K529-V538 HydrophobicContact CD-CG1 3.71Å; K529-V538 HydrophobicContact CG-CG1 3.94Å; V531-V538 HydrophobicContact CG1-CG2 4.26Å; V531-V538 HydrophobicContact CG2-CG1 4.28Å; V531-V538 HydrophobicContact CG2-CG2 4.31Å
539	Y	91.4	Very high	92.7	Very high	36 Å²	36	58.6 Å²	58.6	14%	0.141	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	110.8	179.4	-62.4	-74.1	0	0	0	110.2	L502 M507 K529 L530 E537 F541	L502-Y539 HydrophobicContact CD1-CD1 4.38Å; L502-Y539 HydrophobicContact CD1-CD2 3.89Å; L502-Y539 HydrophobicContact CD1-CE2 4.21Å; L502-Y539 HydrophobicContact CD1-CG 3.96Å; L502-Y539 HydrophobicContact CD2-CD1 4.48Å; L502-Y539 HydrophobicContact CD2-CD2 4.04Å; L502-Y539 HydrophobicContact CD2-CE1 3.95Å; L502-Y539 HydrophobicContact CD2-CE2 3.48Å; L502-Y539 VanDerWaalsContact CD2-CE2 3.48Å; L502-Y539 HydrophobicContact CD2-CG 4.49Å; L502-Y539 VanDerWaalsContact CD2-CZ 3.4Å; M507-Y539 HydrophobicContact CE-CE2 4.16Å; M507-Y539 HydrophobicContact SD-CD2 4.28Å; M507-Y539 HydrophobicContact SD-CE2 4.42Å; K529-Y539 CarbonylContact C-O 3.56Å; K529-Y539 VanDerWaalsContact CA-O 3.28Å; K529-Y539 WeakPolarHBondContact CA-O 3.2Å; L530-Y539 PolarHBondContact N-O 3.29Å; L530-Y539 PolarHBondContact O-N 3.33Å; E537-Y539 HydrophobicContact CB-CE2 3.95Å; E537-Y539 PolarHBondContact OE2-OH 3.45Å; Y539-F541 WeakPolarHBondContact O-CD2 3.29Å; Y539-F541 WeakPolarHBondContact O-CE2 3.44Å
540	L	93.4	Very high	92.8	Very high	2 Å²	2	60.8 Å²	60.8	1%	0.01	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	126.9	179.3	177.7	64.2	0	0	0	110.7	K464 I465 L512 C520 V524 A527 K529	K464-L540 WeakPolarHBondContact CA-O 3.43Å; I465-L540 HydrophobicContact CB-CB 4.23Å; I465-L540 HydrophobicContact CB-CD2 3.96Å; I465-L540 HydrophobicContact CB-CG 4.2Å; I465-L540 HydrophobicContact CD1-CD2 3.81Å; I465-L540 HydrophobicContact CD1-CG 4.26Å; I465-L540 HydrophobicContact CG1-CD2 4.39Å; I465-L540 HydrophobicContact CG2-CD2 4.18Å; I465-L540 PolarHBondContact N-O 2.96Å; L512-L540 HydrophobicContact CD1-CD1 3.55Å; C520-L540 HydrophobicContact CB-CD2 4.48Å; V524-L540 HydrophobicContact CG1-CD1 4.36Å; V524-L540 HydrophobicContact CG1-CD2 3.84Å; A527-L540 HydrophobicContact CB-CD1 4.23Å; K529-L540 HydrophobicContact CG-CB 4.38Å; K529-L540 HydrophobicContact CG-CD1 3.86Å
541	F	95.7	Very high	92.9	Very high	0 Å²	0	67.1 Å²	67.1	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	140.5	178.6	-58.1	-85.1	0	0	0	110.8	L462 T463 K464 F476 L483 L502 A527 F528 L530 Y539	L462-F541 HydrophobicContact CB-CD1 4.45Å; L462-F541 HydrophobicContact CD1-CB 4.26Å; L462-F541 HydrophobicContact CD1-CD1 4.12Å; L462-F541 HydrophobicContact CD1-CG 4.39Å; T463-F541 CarbonylContact O-C 3.51Å; T463-F541 WeakPolarHBondContact O-CA 3.25Å; K464-F541 HydrophobicContact CB-CD1 4.38Å; K464-F541 HydrophobicContact CB-CE1 4.36Å; K464-F541 HydrophobicContact CG-CE1 4.39Å; F476-F541 HydrophobicContact CD1-CE1 4.34Å; F476-F541 HydrophobicContact CE1-CD1 4.44Å; F476-F541 AromaticContact CE1-CE1 3.62Å; F476-F541 HydrophobicContact CE1-CE1 3.62Å; F476-F541 HydrophobicContact CE1-CZ 4.46Å; F476-F541 HydrophobicContact CE2-CD1 4.22Å; F476-F541 HydrophobicContact CE2-CE1 4.17Å; F476-F541 HydrophobicContact CZ-CD1 4.01Å; F476-F541 AromaticContact CZ-CE1 3.53Å; F476-F541 HydrophobicContact CZ-CE1 3.53Å; L483-F541 HydrophobicContact CD2-CZ 4.35Å; L502-F541 HydrophobicContact CD1-CZ 4.18Å; A527-F541 CarbonylContact C-O 3.57Å; A527-F541 WeakPolarHBondContact CA-O 3.2Å; A527-F541 WeakPolarHBondContact CB-O 3.3Å; F528-F541 HydrophobicContact CD1-CB 4.25Å; F528-F541 HydrophobicContact CD2-CB 4.25Å; F528-F541 HydrophobicContact CD2-CD2 4.08Å; F528-F541 HydrophobicContact CE1-CB 3.84Å; F528-F541 HydrophobicContact CE2-CB 3.84Å; F528-F541 AromaticContact CE2-CD2 3.64Å; F528-F541 HydrophobicContact CE2-CD2 3.64Å; F528-F541 HydrophobicContact CE2-CE2 4.47Å; F528-F541 AromaticContact CE2-CG 3.92Å; F528-F541 HydrophobicContact CE2-CG 3.92Å; F528-F541 HydrophobicContact CG-CB 4.45Å; F528-F541 HydrophobicContact CZ-CB 3.63Å; F528-F541 HydrophobicContact CZ-CD2 4.21Å; F528-F541 HydrophobicContact CZ-CG 4.01Å; F528-F541 PolarHBondContact N-O 3.46Å; F528-F541 PolarHBondContact O-N 3.3Å; L530-F541 HydrophobicContact CB-CE2 4.1Å; L530-F541 HydrophobicContact CD1-CE2 3.72Å; L530-F541 HydrophobicContact CD1-CZ 4.17Å; L530-F541 HydrophobicContact CG-CD2 4.43Å; L530-F541 HydrophobicContact CG-CE2 3.81Å; Y539-F541 WeakPolarHBondContact O-CD2 3.29Å; Y539-F541 WeakPolarHBondContact O-CE2 3.44Å
542	C	94.7	Very high	93	Very high	18 Å²	18	65.2 Å²	65.2	12%	0.122	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	128	173.2	-54.1	0	0	0	0	110.3	T463	T463-C542 PolarHBondContact N-O 3.26Å; T463-C542 PolarHBondContact O-N 3.48Å
543	A	96.1	Very high	93.2	Very high	8 Å²	8	66.2 Å²	66.2	7%	0.066	32%	0.323	C	S	.	.			trans	-90.5	156.1	174.4	0	0	0	0	0	111.4	L462 N526 D548 K549	L462-A543 HydrophobicContact CD2-CB 3.8Å; N526-A543 HydrophobicContact CB-CB 4.24Å; N526-A543 WeakPolarHBondContact CB-O 3.36Å; N526-A543 PolarHBondContact ND2-O 3.01Å; N526-A543 PolarHBondContact O-N 3.34Å; A543-D548 HydrophobicContact CB-CB 3.93Å; A543-K549 HydrophobicContact CB-CB 3.99Å
544	K	93.6	Very high	93.5	Very high	129 Å²	129	63.2 Å²	63.2	56%	0.561	32%	0.316	S	S	*	.	S	Bend	trans	-71.1	-37.1	177.5	-71.4	175.4	178.7	166.5	0	111.8	E461 N526	E461-K544 IonicContact OE2-NZ 2.85Å; E461-K544 PolarHBondContact OE2-NZ 2.99Å; N526-K544 PolarHBondContact ND2-O 3.36Å
545	K	94.7	Very high	93.9	Very high	126 Å²	126	59.2 Å²	59.2	55%	0.548	29%	0.292	S	S	.	.	S	Bend	trans	-125.2	154.2	-178.9	-59.3	179.5	177.6	-175.5	0	110.9	E547 D548 K549	K545-E547 VanDerWaalsContact C-N 3.27Å; K545-E547 PolarHBondContact O-N 3.37Å; K545-D548 HydrophobicContact CB-CB 4.46Å; K545-D548 WeakPolarHBondContact O-CB 3.47Å; K545-D548 PolarHBondContact O-N 3.44Å; K545-K549 PolarHBondContact O-N 3.43Å; K545-K549 VanDerWaalsContact O-N 3.13Å
546	Q	94.8	Very high	94.2	Very high	103 Å²	103	56.3 Å²	56.3	48%	0.481	27%	0.274	S	S	.	.	H	α-helix	trans	-61.7	-36.2	173.8	-179.1	61.9	15.3	0	0	111.9	N526 D548 K549 A550	N526-Q546 WeakPolarHBondContact OD1-CA 3.41Å; N526-Q546 PolarHBondContact OD1-N 2.89Å; N526-Q546 PolarHBondContact OD1-OE1 3.49Å; Q546-D548 VanDerWaalsContact C-N 3.33Å; Q546-D548 PolarHBondContact O-N 2.82Å; Q546-K549 WeakPolarHBondContact O-CB 3.33Å; Q546-K549 PolarHBondContact O-N 3.35Å; Q546-A550 PolarHBondContact O-N 2.96Å
547	E	95.4	Very high	94.8	Very high	123 Å²	123	52.1 Å²	52.1	58%	0.575	26%	0.259	S	S	*	.	H	α-helix	trans	-61	-41	174.4	-66.4	171.5	-166.3	0	0	112.2	K545 A550 R551	K545-E547 VanDerWaalsContact C-N 3.27Å; K545-E547 PolarHBondContact O-N 3.37Å; E547-A550 PolarHBondContact O-N 3.23Å; E547-R551 WeakPolarHBondContact O-CG 3.32Å; E547-R551 PolarHBondContact O-N 3.12Å
548	D	94.6	Very high	95.1	Very high	44 Å²	44	48.8 Å²	48.8	24%	0.235	24%	0.243	C	C	.	.	H	α-helix	trans	-66.2	-42.8	177.8	-64.2	-31.9	0	0	0	110	A543 K545 Q546 A550 R551 W552	A543-D548 HydrophobicContact CB-CB 3.93Å; K545-D548 HydrophobicContact CB-CB 4.46Å; K545-D548 WeakPolarHBondContact O-CB 3.47Å; K545-D548 PolarHBondContact O-N 3.44Å; Q546-D548 VanDerWaalsContact C-N 3.33Å; Q546-D548 PolarHBondContact O-N 2.82Å; D548-A550 PolarHBondContact O-N 3.35Å; D548-R551 PolarHBondContact O-N 2.93Å; D548-R551 IonicContact OD1-NH1 3.35Å; D548-W552 PolarHBondContact O-N 3.33Å
549	K	96.5	Very high	95.4	Very high	7 Å²	7	47.1 Å²	47.1	3%	0.03	23%	0.233	C	C	.	.	H	α-helix	trans	-56.4	-50	172.6	173.6	-172.5	172.2	178.1	0	111	D511 L512 N526 A527 F528 A543 K545 Q546 R551 W552 L553	D511-K549 WeakPolarHBondContact OD1-CE 3.29Å; D511-K549 IonicContact OD1-NZ 2.69Å; D511-K549 PolarHBondContact OD1-NZ 2.98Å; L512-K549 PolarHBondContact O-NZ 3.47Å; N526-K549 HydrophobicContact CB-CB 4.19Å; N526-K549 HydrophobicContact CB-CD 4.36Å; A527-K549 WeakPolarHBondContact O-CE 3.29Å; A527-K549 PolarHBondContact O-NZ 3.43Å; A527-K549 VanDerWaalsContact O-NZ 3.15Å; F528-K549 HydrophobicContact CD1-CG 4.38Å; A543-K549 HydrophobicContact CB-CB 3.99Å; K545-K549 PolarHBondContact O-N 3.43Å; K545-K549 VanDerWaalsContact O-N 3.13Å; Q546-K549 WeakPolarHBondContact O-CB 3.33Å; Q546-K549 PolarHBondContact O-N 3.35Å; K549-R551 VanDerWaalsContact C-N 3.3Å; K549-R551 PolarHBondContact O-N 3.47Å; K549-W552 PolarHBondContact O-N 3.13Å; K549-W552 VanDerWaalsContact O-N 3.14Å; K549-L553 HydrophobicContact CG-CD1 4.14Å; K549-L553 HydrophobicContact CG-CG 4.39Å; K549-L553 WeakPolarHBondContact O-CG 3.38Å; K549-L553 PolarHBondContact O-N 3.18Å
550	A	96.2	Very high	95.6	Very high	51 Å²	51	49.2 Å²	49.2	42%	0.421	24%	0.241	S	C	.	.	H	α-helix	trans	-59.4	-41.9	-179.8	0	0	0	0	0	111.8	Q546 E547 D548 W552 L553 Q554	Q546-A550 PolarHBondContact O-N 2.96Å; E547-A550 PolarHBondContact O-N 3.23Å; D548-A550 PolarHBondContact O-N 3.35Å; A550-W552 PolarHBondContact O-N 3.19Å; A550-L553 PolarHBondContact O-N 3.01Å; A550-Q554 WeakPolarHBondContact O-CB 3.43Å; A550-Q554 PolarHBondContact O-N 3.24Å
551	R	96.5	Very high	95.6	Very high	135 Å²	135	53 Å²	53	51%	0.509	26%	0.255	S	S	.	.	H	α-helix	trans	-61.8	-41.5	174.5	-73.8	174.4	179.8	162.8	1.8	112.7	E547 D548 K549 A555	E547-R551 WeakPolarHBondContact O-CG 3.32Å; E547-R551 PolarHBondContact O-N 3.12Å; D548-R551 PolarHBondContact O-N 2.93Å; D548-R551 IonicContact OD1-NH1 3.35Å; K549-R551 VanDerWaalsContact C-N 3.3Å; K549-R551 PolarHBondContact O-N 3.47Å; R551-A555 WeakPolarHBondContact O-CB 3.47Å; R551-A555 PolarHBondContact O-N 3.3Å
552	W	96.9	Very high	95.3	Very high	4 Å²	4	53.3 Å²	53.3	2%	0.015	26%	0.256	C	S	.	.	H	α-helix	trans	-66.6	-42.3	176.6	-84.5	104.2	0	0	0	112.7	H458 L462 F476 L478 L483 F528 D548 K549 A550 A555 C556	H458-W552 AromaticContact CD2-CD2 3.69Å; H458-W552 AromaticContact CD2-CE2 3.64Å; H458-W552 AromaticContact CD2-CE3 3.92Å; H458-W552 AromaticContact CD2-CZ2 3.86Å; L462-W552 HydrophobicContact CD1-CD2 3.67Å; L462-W552 VanDerWaalsContact CD1-CE2 3.49Å; L462-W552 HydrophobicContact CD1-CE3 4.16Å; L462-W552 HydrophobicContact CD1-CG 4.04Å; L462-W552 HydrophobicContact CD1-CH2 4.35Å; L462-W552 HydrophobicContact CD1-CZ2 3.85Å; L462-W552 HydrophobicContact CD1-CZ3 4.47Å; L462-W552 HydrophobicContact CD2-CG 4.29Å; L462-W552 HydrophobicContact CG-CD2 4.35Å; L462-W552 HydrophobicContact CG-CZ2 4.14Å; F476-W552 HydrophobicContact CB-CH2 3.42Å; F476-W552 VanDerWaalsContact CB-CH2 3.42Å; F476-W552 HydrophobicContact CB-CZ2 3.88Å; F476-W552 HydrophobicContact CB-CZ3 4.28Å; L478-W552 HydrophobicContact CB-CZ3 4.1Å; L483-W552 HydrophobicContact CD1-CH2 4.38Å; L483-W552 HydrophobicContact CD1-CZ3 4.03Å; F528-W552 HydrophobicContact CE1-CB 3.78Å; F528-W552 HydrophobicContact CE1-CG 4.24Å; F528-W552 HydrophobicContact CZ-CB 3.85Å; F528-W552 HydrophobicContact CZ-CG 4.19Å; D548-W552 PolarHBondContact O-N 3.33Å; K549-W552 PolarHBondContact O-N 3.13Å; K549-W552 VanDerWaalsContact O-N 3.14Å; A550-W552 PolarHBondContact O-N 3.19Å; W552-A555 PolarHBondContact O-N 3.45Å; W552-C556 PolarHBondContact O-N 2.96Å; W552-C556 PolarHBondContact O-SG 3.2Å; W552-C556 VanDerWaalsContact O-SG 3.35Å
553	L	96.7	Very high	95.1	Very high	30 Å²	30	53.4 Å²	53.4	16%	0.157	26%	0.256	C	S	.	.	H	α-helix	trans	-61.2	-46.9	175.8	-68.3	175.7	0	0	0	111.2	L509 D511 F528 K549 A550 C556 A557	L509-L553 HydrophobicContact CD1-CD2 3.95Å; L509-L553 HydrophobicContact CD2-CD2 3.77Å; L509-L553 HydrophobicContact CG-CD2 3.98Å; D511-L553 HydrophobicContact CB-CD1 4.23Å; D511-L553 HydrophobicContact CB-CD2 4.31Å; F528-L553 HydrophobicContact CB-CD2 3.83Å; F528-L553 HydrophobicContact CG-CD2 4.13Å; K549-L553 HydrophobicContact CG-CD1 4.14Å; K549-L553 HydrophobicContact CG-CG 4.39Å; K549-L553 WeakPolarHBondContact O-CG 3.38Å; K549-L553 PolarHBondContact O-N 3.18Å; A550-L553 PolarHBondContact O-N 3.01Å; L553-C556 PolarHBondContact O-N 3.17Å; L553-A557 PolarHBondContact O-N 2.93Å; L553-A557 VanDerWaalsContact O-N 3.13Å
554	Q	96.9	Very high	94.9	Very high	95 Å²	95	57.6 Å²	57.6	44%	0.444	27%	0.274	S	S	.	.	H	α-helix	trans	-62	-44.2	176.4	-173.8	60.4	46.4	0	0	111.4	A550 C556 A557 D558	A550-Q554 WeakPolarHBondContact O-CB 3.43Å; A550-Q554 PolarHBondContact O-N 3.24Å; Q554-C556 VanDerWaalsContact C-N 3.35Å; Q554-C556 PolarHBondContact O-N 2.82Å; Q554-A557 PolarHBondContact O-N 3.26Å; Q554-A557 VanDerWaalsContact O-N 3.14Å; Q554-D558 PolarHBondContact NE2-OD1 3.03Å; Q554-D558 WeakPolarHBondContact O-CB 3.49Å; Q554-D558 PolarHBondContact O-N 3.07Å
555	A	96.2	Very high	94.6	Very high	6 Å²	6	54.9 Å²	54.9	5%	0.05	26%	0.264	C	S	.	.	H	α-helix	trans	-61.4	-40.7	179.4	0	0	0	0	0	112.9	I457 H458 L478 R551 W552 D558 E559	I457-A555 HydrophobicContact CG2-CB 4.42Å; H458-A555 HydrophobicContact CB-CB 3.45Å; H458-A555 VanDerWaalsContact CB-CB 3.45Å; L478-A555 HydrophobicContact CD2-CB 3.91Å; L478-A555 WeakPolarHBondContact CD2-O 3.39Å; R551-A555 WeakPolarHBondContact O-CB 3.47Å; R551-A555 PolarHBondContact O-N 3.3Å; W552-A555 PolarHBondContact O-N 3.45Å; A555-D558 PolarHBondContact O-N 3.1Å; A555-E559 VanDerWaalsContact O-CB 3.28Å; A555-E559 WeakPolarHBondContact O-CB 3.3Å; A555-E559 PolarHBondContact O-N 3.04Å
556	C	96.3	Very high	94.2	Very high	4 Å²	4	49.7 Å²	49.7	3%	0.027	24%	0.242	C	C	.	.	H	α-helix	trans	-65.1	-38.3	174.4	-70	0	0	0	0	112	M504 L509 W552 L553 Q554 E559 R560	M504-C556 HydrophobicContact CE-CB 4.5Å; L509-C556 HydrophobicContact CD1-CB 4.21Å; L509-C556 HydrophobicContact CD2-CB 3.71Å; L509-C556 HydrophobicContact CG-CB 4.46Å; W552-C556 PolarHBondContact O-N 2.96Å; W552-C556 PolarHBondContact O-SG 3.2Å; W552-C556 VanDerWaalsContact O-SG 3.35Å; L553-C556 PolarHBondContact O-N 3.17Å; Q554-C556 VanDerWaalsContact C-N 3.35Å; Q554-C556 PolarHBondContact O-N 2.82Å; C556-E559 PolarHBondContact O-N 3.06Å; C556-R560 PolarHBondContact O-N 3Å
557	A	95.8	Very high	93.8	Very high	49 Å²	49	52.7 Å²	52.7	41%	0.405	25%	0.254	S	S	.	.	H	α-helix	trans	-67.9	-41.8	174.6	0	0	0	0	0	112.2	L553 Q554 E559 R560 R561	L553-A557 PolarHBondContact O-N 2.93Å; L553-A557 VanDerWaalsContact O-N 3.13Å; Q554-A557 PolarHBondContact O-N 3.26Å; Q554-A557 VanDerWaalsContact O-N 3.14Å; A557-E559 PolarHBondContact O-N 3.32Å; A557-R560 PolarHBondContact O-N 3.23Å; A557-R561 PolarHBondContact O-N 3.45Å
558	D	94.8	Very high	93.1	Very high	19 Å²	19	53.5 Å²	53.5	10%	0.102	26%	0.257	C	S	.	.	H	α-helix	trans	-62.9	-33.8	175.7	-69.3	-21.3	0	0	0	112.1	I457 Q554 A555 R561 R562	I457-D558 HydrophobicContact CG2-CB 4.42Å; Q554-D558 PolarHBondContact NE2-OD1 3.03Å; Q554-D558 WeakPolarHBondContact O-CB 3.49Å; Q554-D558 PolarHBondContact O-N 3.07Å; A555-D558 PolarHBondContact O-N 3.1Å; D558-R561 PolarHBondContact O-N 3.18Å; D558-R561 IonicContact OD1-CZ 3.93Å; D558-R561 IonicContact OD1-NH1 3.21Å; D558-R561 PolarHBondContact OD1-NH1 3.18Å; D558-R561 IonicContact OD1-NH2 2.62Å; D558-R561 PolarHBondContact OD1-NH2 3.41Å; D558-R562 WeakPolarHBondContact O-CB 3.26Å; D558-R562 WeakPolarHBondContact O-CG 3.37Å; D558-R562 PolarHBondContact O-N 3.17Å
559	E	96	Very high	92	Very high	0 Å²	0	55 Å²	55	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-67.6	-47	176	-173.7	-82.9	152.9	0	0	112.3	I457 L478 F479 H481 A555 C556 A557 R561 R562 V563	I457-E559 HydrophobicContact CD1-CB 3.42Å; I457-E559 VanDerWaalsContact CD1-CB 3.42Å; I457-E559 HydrophobicContact CD1-CG 3.31Å; I457-E559 HydrophobicContact CG2-CB 4.48Å; L478-E559 HydrophobicContact CD1-CG 4.11Å; L478-E559 HydrophobicContact CD2-CB 4.04Å; L478-E559 HydrophobicContact CD2-CG 4.41Å; L478-E559 HydrophobicContact CG-CB 4.36Å; L478-E559 HydrophobicContact CG-CG 4.2Å; F479-E559 WeakPolarHBondContact O-CG 3.44Å; H481-E559 PolarHBondContact N-OE1 2.97Å; A555-E559 VanDerWaalsContact O-CB 3.28Å; A555-E559 WeakPolarHBondContact O-CB 3.3Å; A555-E559 PolarHBondContact O-N 3.04Å; C556-E559 PolarHBondContact O-N 3.06Å; A557-E559 PolarHBondContact O-N 3.32Å; E559-R561 VanDerWaalsContact C-N 3.28Å; E559-R561 PolarHBondContact O-N 3.47Å; E559-R562 PolarHBondContact O-N 2.85Å; E559-V563 WeakPolarHBondContact O-CG2 3.19Å; E559-V563 PolarHBondContact O-N 3.44Å; E559-V563 WeakPolarHBondContact OE1-CG2 3.4Å
560	R	95.4	Very high	90.9	Very high	81 Å²	81	56.8 Å²	56.8	31%	0.306	28%	0.284	S	S	.	.	H	α-helix	trans	-59.8	-39.5	173	-65.7	-64.7	91	-170.6	2.4	112.3	M504 D505 C556 A557 Q564	M504-R560 VanDerWaalsContact CB-NH2 3.27Å; M504-R560 VanDerWaalsContact O-CZ 3.3Å; M504-R560 PolarHBondContact O-NH1 3.02Å; D505-R560 VanDerWaalsContact CA-NH1 3.27Å; D505-R560 IonicContact OD1-CZ 3.81Å; D505-R560 VanDerWaalsContact OD1-CZ 3.32Å; D505-R560 IonicContact OD1-NH1 3.85Å; D505-R560 PolarHBondContact OD1-NH1 2.98Å; D505-R560 IonicContact OD1-NH2 3.45Å; D505-R560 PolarHBondContact OD1-NH2 2.92Å; C556-R560 PolarHBondContact O-N 3Å; A557-R560 PolarHBondContact O-N 3.23Å; R560-Q564 PolarHBondContact O-N 3.23Å
561	R	93.7	Very high	89.9	Confident	81 Å²	81	55.4 Å²	55.4	31%	0.306	27%	0.269	S	S	.	.	H	α-helix	trans	-63.4	-48.8	176.5	-174.6	-179.6	62.9	-108.5	-0.3	111.4	A557 D558 E559 V563 Q564 E565	A557-R561 PolarHBondContact O-N 3.45Å; D558-R561 PolarHBondContact O-N 3.18Å; D558-R561 IonicContact OD1-CZ 3.93Å; D558-R561 IonicContact OD1-NH1 3.21Å; D558-R561 PolarHBondContact OD1-NH1 3.18Å; D558-R561 IonicContact OD1-NH2 2.62Å; D558-R561 PolarHBondContact OD1-NH2 3.41Å; E559-R561 VanDerWaalsContact C-N 3.28Å; E559-R561 PolarHBondContact O-N 3.47Å; R561-V563 PolarHBondContact O-N 3.39Å; R561-Q564 WeakPolarHBondContact O-CB 3.27Å; R561-Q564 PolarHBondContact O-N 2.98Å; R561-E565 WeakPolarHBondContact CD-OE1 3.44Å; R561-E565 HydrophobicContact CG-CG 4.34Å; R561-E565 WeakPolarHBondContact CG-OE1 3.48Å; R561-E565 IonicContact NE-OE1 2.8Å; R561-E565 WeakPolarHBondContact O-CG 3.49Å; R561-E565 PolarHBondContact O-N 3.32Å
562	R	89.4	Confident	88.8	Confident	7 Å²	7	56.6 Å²	56.6	3%	0.026	28%	0.281	C	S	.	.	H	α-helix	trans	-60.2	-44.6	178.5	-82.2	-177	172.9	88.7	-15.8	113.2	E455 D558 E559 Q564 E565 D566 Q613	E455-R562 IonicContact OE1-CZ 3.58Å; E455-R562 VanDerWaalsContact OE1-CZ 3.29Å; E455-R562 IonicContact OE1-NE 3.7Å; E455-R562 PolarHBondContact OE1-NE 3.4Å; E455-R562 IonicContact OE1-NH2 2.78Å; E455-R562 PolarHBondContact OE1-NH2 3.47Å; E455-R562 WeakPolarHBondContact OE2-CD 3.42Å; E455-R562 IonicContact OE2-CZ 3.38Å; E455-R562 IonicContact OE2-NE 2.73Å; E455-R562 PolarHBondContact OE2-NE 2.87Å; D558-R562 WeakPolarHBondContact O-CB 3.26Å; D558-R562 WeakPolarHBondContact O-CG 3.37Å; D558-R562 PolarHBondContact O-N 3.17Å; E559-R562 PolarHBondContact O-N 2.85Å; R562-Q564 PolarHBondContact O-N 2.87Å; R562-E565 PolarHBondContact O-N 3.14Å; R562-D566 WeakPolarHBondContact O-CB 3.44Å; R562-D566 PolarHBondContact O-N 3.1Å; R562-Q613 VanDerWaalsContact CZ-NE2 3.26Å
563	V	91.7	Very high	88	Confident	20 Å²	20	57.4 Å²	57.4	12%	0.121	29%	0.285	C	S	.	.	H	α-helix	trans	-58.2	-40.1	177.5	165.5	0	0	0	0	111.1	D480 H481 E559 R561 K567	D480-V563 HydrophobicContact CB-CG2 4.13Å; H481-V563 WeakPolarHBondContact CE1-CG1 3.49Å; E559-V563 WeakPolarHBondContact O-CG2 3.19Å; E559-V563 PolarHBondContact O-N 3.44Å; E559-V563 WeakPolarHBondContact OE1-CG2 3.4Å; R561-V563 PolarHBondContact O-N 3.39Å; V563-K567 WeakPolarHBondContact O-CB 3.31Å; V563-K567 PolarHBondContact O-N 3.38Å
564	Q	91.4	Very high	87.5	Confident	95 Å²	95	58.7 Å²	58.7	44%	0.444	30%	0.297	S	S	.	.	H	α-helix	trans	-69	-47	176.5	-175.1	59.9	35	0	0	111.9	R560 R561 R562 D566 K567 E568	R560-Q564 PolarHBondContact O-N 3.23Å; R561-Q564 WeakPolarHBondContact O-CB 3.27Å; R561-Q564 PolarHBondContact O-N 2.98Å; R562-Q564 PolarHBondContact O-N 2.87Å; Q564-D566 VanDerWaalsContact C-N 3.32Å; Q564-D566 PolarHBondContact O-N 3.07Å; Q564-K567 PolarHBondContact O-N 3.48Å; Q564-E568 WeakPolarHBondContact CG-OE1 3.42Å; Q564-E568 PolarHBondContact NE2-OE1 3.08Å; Q564-E568 WeakPolarHBondContact O-CG 3.23Å; Q564-E568 PolarHBondContact O-N 3.39Å
565	E	86.5	Confident	87	Confident	73 Å²	73	60.9 Å²	60.9	34%	0.341	31%	0.307	S	S	.	.	H	α-helix	trans	-57.5	-45	176.4	-72.4	170.1	176.7	0	0	111	R561 R562 K567 E568 M569	R561-E565 WeakPolarHBondContact CD-OE1 3.44Å; R561-E565 HydrophobicContact CG-CG 4.34Å; R561-E565 WeakPolarHBondContact CG-OE1 3.48Å; R561-E565 IonicContact NE-OE1 2.8Å; R561-E565 WeakPolarHBondContact O-CG 3.49Å; R561-E565 PolarHBondContact O-N 3.32Å; R562-E565 PolarHBondContact O-N 3.14Å; E565-K567 VanDerWaalsContact C-N 3.32Å; E565-K567 PolarHBondContact O-N 3.27Å; E565-E568 PolarHBondContact O-N 2.81Å; E565-M569 HydrophobicContact CB-CE 3.95Å; E565-M569 VanDerWaalsContact O-CB 3.22Å; E565-M569 WeakPolarHBondContact O-CB 3.31Å; E565-M569 WeakPolarHBondContact O-CE 3.19Å; E565-M569 WeakPolarHBondContact O-CG 3.44Å; E565-M569 PolarHBondContact O-N 2.9Å
566	D	86.4	Confident	86.5	Confident	16 Å²	16	66.2 Å²	66.2	9%	0.086	34%	0.335	C	S	.	.	H	α-helix	trans	-62.4	-39.7	179.4	-75.3	-35.4	0	0	0	112.9	K427 R562 Q564 G570 M571	K427-D566 VanDerWaalsContact CE-OD1 3.26Å; K427-D566 WeakPolarHBondContact CE-OD1 3.42Å; K427-D566 IonicContact NZ-OD1 3.29Å; K427-D566 PolarHBondContact NZ-OD1 3.03Å; K427-D566 IonicContact NZ-OD2 2.84Å; K427-D566 PolarHBondContact NZ-OD2 3.01Å; R562-D566 WeakPolarHBondContact O-CB 3.44Å; R562-D566 PolarHBondContact O-N 3.1Å; Q564-D566 VanDerWaalsContact C-N 3.32Å; Q564-D566 PolarHBondContact O-N 3.07Å; D566-G570 PolarHBondContact O-N 2.79Å; D566-G570 VanDerWaalsContact O-N 3.1Å; D566-M571 HydrophobicContact CB-CB 4.05Å; D566-M571 PolarHBondContact O-N 3.13Å; D566-M571 WeakPolarHBondContact OD1-CB 3.35Å
567	K	85.8	Confident	86.1	Confident	167 Å²	167	69.3 Å²	69.3	73%	0.726	35%	0.349	S	S	*	.	H	α-helix	trans	-66.7	-43.1	176.2	-174.4	179.4	179	-178.7	0	111.7	V563 Q564 E565 M569 G570	V563-K567 WeakPolarHBondContact O-CB 3.31Å; V563-K567 PolarHBondContact O-N 3.38Å; Q564-K567 PolarHBondContact O-N 3.48Å; E565-K567 VanDerWaalsContact C-N 3.32Å; E565-K567 PolarHBondContact O-N 3.27Å; K567-M569 VanDerWaalsContact C-N 3.34Å; K567-G570 PolarHBondContact O-N 3.34Å
568	E	80.5	Confident	85.9	Confident	139 Å²	139	69 Å²	69	65%	0.65	34%	0.338	S	S	*	.	H	α-helix	trans	-67.4	-36.5	178	-72.6	173.2	-173.5	0	0	112.2	Q564 E565 G570	Q564-E568 WeakPolarHBondContact CG-OE1 3.42Å; Q564-E568 PolarHBondContact NE2-OE1 3.08Å; Q564-E568 WeakPolarHBondContact O-CG 3.23Å; Q564-E568 PolarHBondContact O-N 3.39Å; E565-E568 PolarHBondContact O-N 2.81Å; E568-G570 VanDerWaalsContact C-N 3.34Å
569	M	72.1	Confident	85.7	Confident	75 Å²	75	74.5 Å²	74.5	37%	0.369	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84	-5.4	-178.8	-69	-171.7	-55.8	0	0	113.8	L420 E565 K567 M571	L420-M569 HydrophobicContact CD2-CB 3.61Å; L420-M569 HydrophobicContact CD2-CE 4.4Å; L420-M569 HydrophobicContact CD2-CG 3.65Å; L420-M569 HydrophobicContact CD2-SD 3.32Å; L420-M569 WeakPolarHBondContact CD2-SD 3.34Å; L420-M569 HydrophobicContact CG-SD 4.34Å; E565-M569 HydrophobicContact CB-CE 3.95Å; E565-M569 VanDerWaalsContact O-CB 3.22Å; E565-M569 WeakPolarHBondContact O-CB 3.31Å; E565-M569 WeakPolarHBondContact O-CE 3.19Å; E565-M569 WeakPolarHBondContact O-CG 3.44Å; E565-M569 PolarHBondContact O-N 2.9Å; K567-M569 VanDerWaalsContact C-N 3.34Å; M569-M571 VanDerWaalsContact C-N 3.25Å; M569-M571 HydrophobicContact CB-CG 3.74Å; M569-M571 HydrophobicContact CE-CE 4.36Å; M569-M571 HydrophobicContact CE-CG 3.95Å; M569-M571 PolarHBondContact O-N 3.04Å
570	G	73.7	Confident	85.5	Confident	45 Å²	45	79 Å²	79	46%	0.464	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	59	38.2	-173.4	0	0	0	0	0	112.2	D566 K567 E568 E572	D566-G570 PolarHBondContact O-N 2.79Å; D566-G570 VanDerWaalsContact O-N 3.1Å; K567-G570 PolarHBondContact O-N 3.34Å; E568-G570 VanDerWaalsContact C-N 3.34Å; G570-E572 PolarHBondContact O-N 3.31Å
571	M	74.6	Confident	85.3	Confident	22 Å²	22	75.3 Å²	75.3	11%	0.108	37%	0.372	C	S	.	.			trans	-75.8	87.5	-177.5	-77.1	-65.3	-128.2	0	0	111.2	L420 E423 R424 K427 D566 M569	L420-M571 HydrophobicContact CD2-CE 4.22Å; L420-M571 HydrophobicContact CD2-SD 4.32Å; E423-M571 HydrophobicContact CB-CE 3.49Å; E423-M571 VanDerWaalsContact CB-CE 3.49Å; E423-M571 HydrophobicContact CG-CE 3.62Å; R424-M571 HydrophobicContact CB-CE 4.27Å; R424-M571 HydrophobicContact CB-SD 4.38Å; K427-M571 HydrophobicContact CD-CE 4.5Å; D566-M571 HydrophobicContact CB-CB 4.05Å; D566-M571 PolarHBondContact O-N 3.13Å; D566-M571 WeakPolarHBondContact OD1-CB 3.35Å; M569-M571 VanDerWaalsContact C-N 3.25Å; M569-M571 HydrophobicContact CB-CG 3.74Å; M569-M571 HydrophobicContact CE-CE 4.36Å; M569-M571 HydrophobicContact CE-CG 3.95Å; M569-M571 PolarHBondContact O-N 3.04Å
572	E	73.4	Confident	85.3	Confident	161 Å²	161	72 Å²	72	75%	0.752	36%	0.36	S	S	*	.			trans	-110.3	134.1	174.9	-65.7	-174.8	176.5	0	0	111.8	G570	G570-E572 PolarHBondContact O-N 3.31Å
573	I	81.1	Confident	85.5	Confident	20 Å²	20	75.8 Å²	75.8	10%	0.103	38%	0.38	C	S	.	.			trans	-94.3	124.5	168.7	-59.7	-177.5	0	0	0	107.3	K427 I431 E575 Q577 K578	K427-I573 HydrophobicContact CB-CD1 4.19Å; I431-I573 HydrophobicContact CD1-CG2 3.85Å; I431-I573 HydrophobicContact CG2-CD1 3.28Å; I573-E575 PolarHBondContact O-N 3.22Å; I573-Q577 HydrophobicContact CG2-CB 3.93Å; I573-K578 HydrophobicContact CB-CG 4.44Å; I573-K578 HydrophobicContact CG2-CG 3.86Å; I573-K578 WeakPolarHBondContact O-CE 3.42Å
574	S	84.9	Confident	85.4	Confident	58 Å²	58	78.3 Å²	78.3	41%	0.406	39%	0.393	S	S	.	.			trans	-56.9	138.8	-179.6	177.2	0	0	0	0	111.1	N576 Q577 K578	S574-N576 PolarHBondContact O-N 2.99Å; S574-N576 VanDerWaalsContact O-N 3.12Å; S574-N576 PolarHBondContact OG-N 3.02Å; S574-Q577 WeakPolarHBondContact O-CA 3.41Å; S574-Q577 WeakPolarHBondContact O-CB 3.49Å; S574-Q577 PolarHBondContact O-N 3.36Å; S574-K578 PolarHBondContact O-N 3.4Å; S574-K578 VanDerWaalsContact O-N 3.1Å
575	E	87.2	Confident	85.5	Confident	140 Å²	140	74.1 Å²	74.1	65%	0.654	37%	0.374	S	S	*	.	H	α-helix	trans	-56.8	-30.2	176.8	-71.7	162.5	140	0	0	112.6	I573 Q577 K578 K579	I573-E575 PolarHBondContact O-N 3.22Å; E575-Q577 VanDerWaalsContact C-N 3.35Å; E575-K578 PolarHBondContact O-N 3.21Å; E575-K579 WeakPolarHBondContact O-CB 3.34Å; E575-K579 VanDerWaalsContact O-CG 3.28Å; E575-K579 WeakPolarHBondContact O-CG 3.38Å; E575-K579 PolarHBondContact O-N 2.98Å
576	N	86.3	Confident	85.8	Confident	119 Å²	119	75.1 Å²	75.1	64%	0.636	38%	0.379	S	S	*	.	H	α-helix	trans	-64.7	-39.4	174	-70.6	-27.3	0	0	0	111.9	S574 L580	S574-N576 PolarHBondContact O-N 2.99Å; S574-N576 VanDerWaalsContact O-N 3.12Å; S574-N576 PolarHBondContact OG-N 3.02Å; N576-L580 VanDerWaalsContact O-CB 3.26Å; N576-L580 WeakPolarHBondContact O-CB 3.41Å; N576-L580 PolarHBondContact O-N 3.41Å
577	Q	87	Confident	85.9	Confident	68 Å²	68	81.3 Å²	81.3	32%	0.318	41%	0.405	S	S	.	.	H	α-helix	trans	-68.6	-42.5	176.6	-66.4	174.4	-48	0	0	111	L428 I431 I573 S574 E575 L580 A581	L428-Q577 HydrophobicContact CD1-CB 4.21Å; L428-Q577 HydrophobicContact CD1-CG 4.22Å; I431-Q577 HydrophobicContact CD1-CB 4.21Å; I573-Q577 HydrophobicContact CG2-CB 3.93Å; S574-Q577 WeakPolarHBondContact O-CA 3.41Å; S574-Q577 WeakPolarHBondContact O-CB 3.49Å; S574-Q577 PolarHBondContact O-N 3.36Å; E575-Q577 VanDerWaalsContact C-N 3.35Å; Q577-L580 PolarHBondContact O-N 3.44Å; Q577-A581 WeakPolarHBondContact O-CB 3.42Å; Q577-A581 PolarHBondContact O-N 2.87Å
578	K	91.6	Very high	85.5	Confident	42 Å²	42	76.9 Å²	76.9	18%	0.183	40%	0.4	C	S	.	.	H	α-helix	trans	-58.9	-50.2	175.5	-63.8	175.9	172	-164.2	0	111.5	L450 D451 I573 S574 E575 L580 A581 M582	L450-K578 HydrophobicContact CB-CB 4.26Å; L450-K578 HydrophobicContact CB-CG 4.32Å; L450-K578 WeakPolarHBondContact O-CD 3.4Å; L450-K578 WeakPolarHBondContact O-CE 3.34Å; L450-K578 PolarHBondContact O-NZ 3.15Å; D451-K578 PolarHBondContact O-NZ 3.07Å; I573-K578 HydrophobicContact CB-CG 4.44Å; I573-K578 HydrophobicContact CG2-CG 3.86Å; I573-K578 WeakPolarHBondContact O-CE 3.42Å; S574-K578 PolarHBondContact O-N 3.4Å; S574-K578 VanDerWaalsContact O-N 3.1Å; E575-K578 PolarHBondContact O-N 3.21Å; K578-L580 VanDerWaalsContact C-N 3.35Å; K578-L580 PolarHBondContact O-N 3.35Å; K578-A581 PolarHBondContact O-N 3.46Å; K578-M582 PolarHBondContact O-N 3.12Å; K578-M582 VanDerWaalsContact O-N 3.14Å
579	K	91.4	Very high	84.4	Confident	135 Å²	135	72.7 Å²	72.7	59%	0.587	39%	0.394	S	S	*	.	H	α-helix	trans	-60.5	-42.7	176.9	-73.6	172.5	-177	171.2	0	111.9	E575 M582 L583	E575-K579 WeakPolarHBondContact O-CB 3.34Å; E575-K579 VanDerWaalsContact O-CG 3.28Å; E575-K579 WeakPolarHBondContact O-CG 3.38Å; E575-K579 PolarHBondContact O-N 2.98Å; K579-M582 PolarHBondContact O-N 3.4Å; K579-L583 WeakPolarHBondContact O-CB 3.35Å; K579-L583 VanDerWaalsContact O-CG 3.31Å; K579-L583 WeakPolarHBondContact O-CG 3.31Å; K579-L583 PolarHBondContact O-N 3.02Å
580	L	90.6	Very high	83.6	Confident	96 Å²	96	76.9 Å²	76.9	50%	0.503	41%	0.412	S	S	.	.	H	α-helix	trans	-64.3	-42.3	178.8	-176.7	60.4	0	0	0	112	N576 Q577 K578 M582 L583 N584	N576-L580 VanDerWaalsContact O-CB 3.26Å; N576-L580 WeakPolarHBondContact O-CB 3.41Å; N576-L580 PolarHBondContact O-N 3.41Å; Q577-L580 PolarHBondContact O-N 3.44Å; K578-L580 VanDerWaalsContact C-N 3.35Å; K578-L580 PolarHBondContact O-N 3.35Å; L580-M582 PolarHBondContact O-N 3.36Å; L580-L583 PolarHBondContact O-N 3.39Å; L580-N584 WeakPolarHBondContact O-CB 3.36Å; L580-N584 PolarHBondContact O-N 3.03Å; L580-N584 PolarHBondContact O-ND2 3.34Å
581	A	91.6	Very high	82.3	Confident	3 Å²	3	78.1 Å²	78.1	3%	0.025	43%	0.425	C	S	.	.	H	α-helix	trans	-59.3	-46.1	175.9	0	0	0	0	0	111.5	I431 A435 L450 Q577 K578 N584 A585	I431-A581 HydrophobicContact CD1-CB 4.14Å; I431-A581 HydrophobicContact CG1-CB 4.28Å; A435-A581 HydrophobicContact CB-CB 4.08Å; A435-A581 WeakPolarHBondContact CB-O 3.25Å; L450-A581 HydrophobicContact CD1-CB 3.96Å; Q577-A581 WeakPolarHBondContact O-CB 3.42Å; Q577-A581 PolarHBondContact O-N 2.87Å; K578-A581 PolarHBondContact O-N 3.46Å; A581-N584 PolarHBondContact O-N 3.25Å; A581-A585 WeakPolarHBondContact O-CB 3.42Å; A581-A585 PolarHBondContact O-N 2.93Å
582	M	93.4	Very high	80.7	Confident	12 Å²	12	85.8 Å²	85.8	6%	0.059	46%	0.457	C	S	.	.	H	α-helix	trans	-62.8	-46.2	175.9	-72.7	-57.2	-64.2	0	0	112.8	A435 V439 L450 K578 K579 L580 N584 A585 Q586	A435-M582 HydrophobicContact CB-CG 4.48Å; A435-M582 HydrophobicContact CB-SD 3.65Å; V439-M582 HydrophobicContact CG2-CE 4.37Å; L450-M582 HydrophobicContact CD1-CG 4.13Å; L450-M582 HydrophobicContact CD1-SD 4.27Å; K578-M582 PolarHBondContact O-N 3.12Å; K578-M582 VanDerWaalsContact O-N 3.14Å; K579-M582 PolarHBondContact O-N 3.4Å; L580-M582 PolarHBondContact O-N 3.36Å; M582-N584 VanDerWaalsContact C-N 3.33Å; M582-N584 PolarHBondContact O-N 3.02Å; M582-A585 PolarHBondContact O-N 3.34Å; M582-Q586 WeakPolarHBondContact O-CG 3.39Å; M582-Q586 PolarHBondContact O-N 2.97Å
583	L	93	Very high	78.8	Confident	86 Å²	86	83.3 Å²	83.3	45%	0.45	46%	0.458	S	S	.	.	H	α-helix	trans	-61.1	-41.1	176.9	-73.8	171.2	0	0	0	112	K579 L580 Q586 K587	K579-L583 WeakPolarHBondContact O-CB 3.35Å; K579-L583 VanDerWaalsContact O-CG 3.31Å; K579-L583 WeakPolarHBondContact O-CG 3.31Å; K579-L583 PolarHBondContact O-N 3.02Å; L580-L583 PolarHBondContact O-N 3.39Å; L583-Q586 PolarHBondContact O-N 3.34Å; L583-K587 WeakPolarHBondContact O-CG 3.46Å; L583-K587 PolarHBondContact O-N 2.8Å
584	N	91.6	Very high	76.5	Confident	73 Å²	73	92.5 Å²	92.5	39%	0.39	50%	0.497	S	S	.	.	H	α-helix	trans	-65.6	-40.6	177.4	-73.3	-18.7	0	0	0	111.8	L580 A581 M582 K587 A588	L580-N584 WeakPolarHBondContact O-CB 3.36Å; L580-N584 PolarHBondContact O-N 3.03Å; L580-N584 PolarHBondContact O-ND2 3.34Å; A581-N584 PolarHBondContact O-N 3.25Å; M582-N584 VanDerWaalsContact C-N 3.33Å; M582-N584 PolarHBondContact O-N 3.02Å; N584-K587 PolarHBondContact O-N 3.29Å; N584-A588 PolarHBondContact O-N 2.87Å
585	A	92.4	Very high	73.9	Confident	6 Å²	6	93.4 Å²	93.4	5%	0.05	52%	0.516	C	S	.	.	H	α-helix	trans	-62.4	-41.9	175.4	0	0	0	0	0	112.3	A435 R436 V439 A581 M582 A588	A435-A585 VanDerWaalsContact C-CB 3.5Å; A435-A585 HydrophobicContact CB-CB 3.81Å; R436-A585 HydrophobicContact CG-CB 4.05Å; V439-A585 HydrophobicContact CB-CB 4.43Å; V439-A585 HydrophobicContact CG2-CB 3.79Å; A581-A585 WeakPolarHBondContact O-CB 3.42Å; A581-A585 PolarHBondContact O-N 2.93Å; M582-A585 PolarHBondContact O-N 3.34Å; A585-A588 PolarHBondContact O-N 2.88Å
586	Q	92.6	Very high	71.2	Confident	95 Å²	95	97.3 Å²	97.3	44%	0.444	53%	0.526	S	S	.	.	H	α-helix	trans	-66.5	-42.4	177.5	-70	171.5	-3.4	0	0	112.5	V439 M582 L583 A588 G589 H590	V439-Q586 HydrophobicContact CG2-CG 4.04Å; M582-Q586 WeakPolarHBondContact O-CG 3.39Å; M582-Q586 PolarHBondContact O-N 2.97Å; L583-Q586 PolarHBondContact O-N 3.34Å; Q586-A588 VanDerWaalsContact C-N 3.3Å; Q586-A588 PolarHBondContact O-N 2.89Å; Q586-G589 PolarHBondContact O-N 2.82Å; Q586-G589 VanDerWaalsContact O-N 3.07Å; Q586-H590 PolarHBondContact O-N 3.45Å
587	K	89.5	Confident	68.4	Low	145 Å²	145	99 Å²	99	63%	0.63	54%	0.535	S	S	*	.	H	α-helix	trans	-60.3	-39	177.5	-75.5	174.4	-176.9	175.7	0	112.5	L583 N584 G589 H590	L583-K587 WeakPolarHBondContact O-CG 3.46Å; L583-K587 PolarHBondContact O-N 2.8Å; N584-K587 PolarHBondContact O-N 3.29Å; K587-G589 PolarHBondContact O-N 3.06Å; K587-H590 PolarHBondContact O-N 2.67Å
588	A	76.4	Confident	65.8	Low	75 Å²	75	106.9 Å²	106.9	62%	0.62	56%	0.562	S	S	*	*	H	α-helix	trans	-63.1	-27.9	177.1	0	0	0	0	0	112.7	N584 A585 Q586	N584-A588 PolarHBondContact O-N 2.87Å; A585-A588 PolarHBondContact O-N 2.88Å; Q586-A588 VanDerWaalsContact C-N 3.3Å; Q586-A588 PolarHBondContact O-N 2.89Å
589	G	58.6	Low	62.8	Low	50 Å²	50	111.1 Å²	111.1	52%	0.515	60%	0.595	S	S	.	*	H	α-helix	trans	-77.7	-29.2	178.3	0	0	0	0	0	114.9	Q586 K587	Q586-G589 PolarHBondContact O-N 2.82Å; Q586-G589 VanDerWaalsContact O-N 3.07Å; K587-G589 PolarHBondContact O-N 3.06Å
590	H	55.3	Low	59.7	Low	164 Å²	164	110.3 Å²	110.3	76%	0.759	60%	0.604	S	S	*	*	H	α-helix	trans	-89.8	-13.5	-174.7	-75.3	-10.9	0	0	0	115.2	Q586 K587 K592	Q586-H590 PolarHBondContact O-N 3.45Å; K587-H590 PolarHBondContact O-N 2.67Å; H590-K592 PolarHBondContact O-N 3.39Å
591	G	45.4	Very low	56.8	Low	71 Å²	71	112.6 Å²	112.6	73%	0.732	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.4	6.3	-175	0	0	0	0	0	117.4
592	K	40.5	Very low	53.8	Low	182 Å²	182	115.5 Å²	115.5	79%	0.791	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.7	5.3	-175.1	-71.9	-169.5	177.8	178.6	0	116.2	H590	H590-K592 PolarHBondContact O-N 3.39Å
593	S	33.9	Very low	50.7	Low	109 Å²	109	119.9 Å²	119.9	76%	0.762	68%	0.675	S	S	*	*			trans	-111.5	72.7	-175.3	-59.7	0	0	0	0	112.6
594	K	32.6	Very low	47.7	Very low	213 Å²	213	121.6 Å²	121.6	93%	0.926	69%	0.691	S	S	*	*	S	Bend	trans	-175.4	104.3	159	-105.5	171.1	-173.8	-176.3	0	109.9
595	G	30.7	Very low	45	Very low	77 Å²	77	125.2 Å²	125.2	79%	0.794	71%	0.706	S	S	*	*			trans	143.7	119.2	167.2	0	0	0	0	0	115.1
596	Y	31.5	Very low	42.3	Very low	222 Å²	222	134.2 Å²	134.2	87%	0.871	75%	0.746	S	S	*	*			trans	-59.5	150.1	-178.5	-78.9	-104.1	0	0	0	115.5
597	N	26.9	Very low	39.5	Very low	154 Å²	154	132 Å²	132	82%	0.824	75%	0.749	S	S	*	*			trans	47.1	94.7	150.4	-76.4	-14.3	0	0	0	119.2
598	R	32.4	Very low	37.3	Very low	234 Å²	234	126.9 Å²	126.9	88%	0.883	73%	0.728	S	S	*	*			trans	176	126.4	131	-172.8	176.5	-78.7	-158.5	-3.3	107.2	P600	R598-P600 WeakPolarHBondContact O-CD 3.35Å
599	C	27.8	Very low	35.5	Very low	131 Å²	131	130.6 Å²	130.6	89%	0.885	73%	0.733	S	S	*	*			trans	-56	132.9	170.7	-72.8	0	0	0	0	110.4
600	P	27.6	Very low	34.3	Very low	119 Å²	119	129.1 Å²	129.1	77%	0.773	71%	0.714	S	S	*	*				-138.7	144.6	129.9	22	0.1	0	0	0	113.1	R598 A602	R598-P600 WeakPolarHBondContact O-CD 3.35Å; P600-A602 PolarHBondContact O-N 2.72Å
601	V	28.3	Very low	33.4	Very low	144 Å²	144	124.4 Å²	124.4	87%	0.873	69%	0.693	S	S	*	*			trans	-44.5	127.4	176.2	177.5	0	0	0	0	112.1
602	A	29.4	Very low	32.7	Very low	64 Å²	64	128.9 Å²	128.9	53%	0.529	70%	0.695	S	S	.	*	P	Polyproline II helix	trans	-69.5	143	171.8	0	0	0	0	0	110.6	P600	P600-A602 PolarHBondContact O-N 2.72Å
603	P	28.9	Very low	32.3	Very low	103 Å²	103	123 Å²	123	67%	0.669	67%	0.67	S	S	*	*	P	Polyproline II helix	trans	-65.5	144.6	172.4	2.8	10.2	0	0	0	109.4	H605	P603-H605 PolarHBondContact O-N 3.39Å
604	P	28.6	Very low	31.9	Very low	122 Å²	122	124.7 Å²	124.7	79%	0.792	66%	0.66	S	S	*	*	P	Polyproline II helix	trans	-62.2	129.1	-177.8	24.4	-30.9	0	0	0	110.8	Q606	P604-Q606 PolarHBondContact O-N 3.07Å
605	H	36.6	Very low	31.7	Very low	150 Å²	150	120.2 Å²	120.2	69%	0.694	64%	0.642	S	S	*	*			trans	-58.7	115.6	173.9	-68.3	-83.2	0	0	0	109.9	P603 G607	P603-H605 PolarHBondContact O-N 3.39Å; H605-G607 PolarHBondContact O-N 3.45Å
606	Q	35.6	Very low	31.5	Very low	194 Å²	194	121.1 Å²	121.1	91%	0.907	63%	0.628	S	S	*	*			trans	-69.8	112.8	169	-77.5	178.7	-17.7	0	0	108	P604	P604-Q606 PolarHBondContact O-N 3.07Å
607	G	32.8	Very low	31.2	Very low	48 Å²	48	116 Å²	116	50%	0.495	62%	0.62	S	S	.	*			trans	-57.3	144.8	170	0	0	0	0	0	110.2	H605 H609	H605-G607 PolarHBondContact O-N 3.45Å; G607-H609 VanDerWaalsContact C-N 3.28Å; G607-H609 PolarHBondContact O-CD2 3.44Å; G607-H609 PolarHBondContact O-N 3.33Å
608	L	44.5	Very low	31.2	Very low	38 Å²	38	112.8 Å²	112.8	20%	0.199	60%	0.601	C	S	.	*			trans	-62	94.7	167.2	-86.8	-172.4	0	0	0	108.5	K433 W437 L456 S459	K433-L608 HydrophobicContact CB-CD2 4.06Å; W437-L608 HydrophobicContact CB-CD1 3.32Å; W437-L608 HydrophobicContact CB-CG 3.94Å; W437-L608 HydrophobicContact CD2-CD1 3.78Å; W437-L608 HydrophobicContact CG-CD1 3.15Å; W437-L608 HydrophobicContact CG-CG 3.95Å; L456-L608 HydrophobicContact CD2-CB 3.72Å; L456-L608 HydrophobicContact CD2-CD1 3.94Å; L456-L608 HydrophobicContact CD2-CG 4.31Å; S459-L608 PolarHBondContact OG-O 3.05Å
609	H	37.4	Very low	30.8	Very low	154 Å²	154	105.6 Å²	105.6	71%	0.713	58%	0.584	S	S	*	*			trans	-78.2	137.1	168.7	-75	-74.2	0	0	0	108.8	G607 I611	G607-H609 VanDerWaalsContact C-N 3.28Å; G607-H609 PolarHBondContact O-CD2 3.44Å; G607-H609 PolarHBondContact O-N 3.33Å; H609-I611 PolarHBondContact O-N 2.96Å
610	P	34.5	Very low	30.9	Very low	19 Å²	19	107 Å²	107	12%	0.123	59%	0.589	C	S	.	*			trans	-50.9	133	168.8	-28.1	39.5	0	0	0	109.5	S459 H612	S459-P610 WeakPolarHBondContact OG-CD 3.45Å; S459-P610 WeakPolarHBondContact OG-CG 3.38Å; P610-H612 PolarHBondContact O-N 3.43Å
611	I	35.5	Very low	30.9	Very low	64 Å²	64	105.2 Å²	105.2	33%	0.328	58%	0.579	S	S	.	*			trans	-67.5	108.5	168.8	-64.9	173.9	0	0	0	104.9	H609 Q613	H609-I611 PolarHBondContact O-N 2.96Å; I611-Q613 VanDerWaalsContact C-N 3.29Å; I611-Q613 PolarHBondContact O-N 3.27Å
612	H	31.4	Very low	31.1	Very low	166 Å²	166	102.3 Å²	102.3	77%	0.769	56%	0.562	S	S	*	*			trans	-61.5	100.6	168.8	-74.6	97.7	0	0	0	106.9	P610 R614	P610-H612 PolarHBondContact O-N 3.43Å; H612-R614 VanDerWaalsContact C-N 3.34Å; H612-R614 PolarHBondContact O-N 2.97Å
613	Q	31.4	Very low	31.1	Very low	58 Å²	58	102.1 Å²	102.1	27%	0.271	56%	0.556	S	S	.	*			trans	-64	100.6	168.6	-155.1	176.8	23.1	0	0	105.4	R562 I611 H615	R562-Q613 VanDerWaalsContact CZ-NE2 3.26Å; I611-Q613 VanDerWaalsContact C-N 3.29Å; I611-Q613 PolarHBondContact O-N 3.27Å; Q613-H615 VanDerWaalsContact C-N 3.33Å; Q613-H615 PolarHBondContact O-N 3.39Å
614	R	26.7	Very low	31.3	Very low	145 Å²	145	102 Å²	102	55%	0.547	55%	0.546	S	S	.	.			trans	-59.6	106	164	-77.5	-179.5	173.2	-177.6	-4.1	105.2	H612 I616 Q625	H612-R614 VanDerWaalsContact C-N 3.34Å; H612-R614 PolarHBondContact O-N 2.97Å; R614-I616 PolarHBondContact O-N 3.21Å; R614-Q625 VanDerWaalsContact NH1-OE1 3.13Å
615	H	27	Very low	31.4	Very low	119 Å²	119	100.2 Å²	100.2	55%	0.551	53%	0.527	S	S	*	.			trans	-49.3	107	161.6	-103.8	-95.1	0	0	0	106.8	Q613 T617	Q613-H615 VanDerWaalsContact C-N 3.33Å; Q613-H615 PolarHBondContact O-N 3.39Å; H615-T617 VanDerWaalsContact C-N 3.26Å; H615-T617 PolarHBondContact O-N 3.45Å
616	I	26.4	Very low	31.1	Very low	96 Å²	96	99.3 Å²	99.3	49%	0.492	52%	0.523	S	S	.	.			trans	-93.9	75.6	159	-54.6	178.6	0	0	0	104.8	R614 M618	R614-I616 PolarHBondContact O-N 3.21Å; I616-M618 HydrophobicContact CG2-CG 3.68Å; I616-M618 HydrophobicContact CG2-SD 3.31Å; I616-M618 WeakPolarHBondContact CG2-SD 3.11Å; I616-M618 PolarHBondContact O-N 2.95Å
617	T	26.2	Very low	30.9	Very low	114 Å²	114	91 Å²	91	70%	0.699	49%	0.486	S	S	*	.			trans	-65.3	97	149.5	1.3	0	0	0	0	104.3	H615 P619	H615-T617 VanDerWaalsContact C-N 3.26Å; H615-T617 PolarHBondContact O-N 3.45Å; T617-P619 WeakPolarHBondContact O-CD 3.35Å; T617-P619 VanDerWaalsContact O-N 3.13Å
618	M	25.7	Very low	31	Very low	86 Å²	86	92.3 Å²	92.3	42%	0.424	48%	0.478	S	S	.	.			trans	-61.3	111	175.7	-72.6	-68.9	-66.8	0	0	108	I616	I616-M618 HydrophobicContact CG2-CG 3.68Å; I616-M618 HydrophobicContact CG2-SD 3.31Å; I616-M618 WeakPolarHBondContact CG2-SD 3.11Å; I616-M618 PolarHBondContact O-N 2.95Å
619	P	24.8	Very low	30.2	Very low	83 Å²	83	94.5 Å²	94.5	54%	0.539	51%	0.51	S	S	.	.			trans	-67.7	160	152	2.4	20.2	0	0	0	106.5	T617 S621	T617-P619 WeakPolarHBondContact O-CD 3.35Å; T617-P619 VanDerWaalsContact O-N 3.13Å; P619-S621 PolarHBondContact O-N 2.99Å
620	T	29.2	Very low	29.9	Very low	161 Å²	161	93 Å²	93	99%	0.988	51%	0.507	S	S	*	.	S	Bend	trans	-67.4	39.9	-174.7	-2.2	0	0	0	0	114.7
621	S	28.8	Very low	29.8	Very low	81 Å²	81	95.6 Å²	95.6	57%	0.566	53%	0.53	S	S	*	.	S	Bend	trans	-157	120.2	177.9	54	0	0	0	0	108.4	P619 P623	P619-S621 PolarHBondContact O-N 2.99Å; S621-P623 WeakPolarHBondContact O-CD 3.42Å
622	V	31.1	Very low	29.4	Very low	83 Å²	83	100.8 Å²	100.8	50%	0.503	55%	0.552	S	S	.	*			trans	-35.7	129.8	179.7	179.6	0	0	0	0	113.8
623	P	29.4	Very low	29.4	Very low	61 Å²	61	98.5 Å²	98.5	40%	0.396	55%	0.552	S	S	.	*				-149.3	114.3	126.9	29.5	-8.1	0	0	0	113.6	S621 Q625	S621-P623 WeakPolarHBondContact O-CD 3.42Å; P623-Q625 PolarHBondContact O-N 3.41Å
624	Q	34.7	Very low	29.4	Very low	100 Å²	100	105.2 Å²	105.2	47%	0.467	58%	0.581	S	S	.	*			trans	-95.3	72.4	173.9	-154.8	171.9	15	0	0	110.6
625	Q	29.4	Very low	29.6	Very low	85 Å²	85	107.5 Å²	107.5	40%	0.397	59%	0.589	S	S	.	*			trans	-81.4	131.8	163.5	-88.2	-170	-10.4	0	0	109.9	D157 R614 P623	D157-Q625 PolarHBondContact OD2-NE2 3.09Å; R614-Q625 VanDerWaalsContact NH1-OE1 3.13Å; P623-Q625 PolarHBondContact O-N 3.41Å
626	Q	30.3	Very low	29.7	Very low	130 Å²	130	111.5 Å²	111.5	61%	0.607	61%	0.605	S	S	*	*	S	Bend	trans	87.7	56.2	167.9	-56.7	-178.5	-18.7	0	0	117.4
627	V	30.9	Very low	29.9	Very low	21 Å²	21	112.3 Å²	112.3	13%	0.127	62%	0.619	C	S	.	*	S	Bend	trans	-142.5	125	148.5	-167.3	0	0	0	0	109.5	N422	N422-V627 HydrophobicContact CB-CG1 3.77Å; N422-V627 HydrophobicContact CB-CG2 4.08Å; N422-V627 WeakPolarHBondContact ND2-CG2 3.5Å; N422-V627 WeakPolarHBondContact OD1-CG1 3.42Å; N422-V627 VanDerWaalsContact OD1-CG2 3.27Å; N422-V627 WeakPolarHBondContact OD1-CG2 3.46Å
628	F	35.1	Very low	30.1	Very low	74 Å²	74	111.3 Å²	111.3	33%	0.325	62%	0.617	S	S	.	*			trans	84.1	73.4	-179	-57.6	-79.2	0	0	0	117.1	K425 L630	K425-F628 HydrophobicContact CD-CE1 4.04Å; K425-F628 HydrophobicContact CD-CZ 4.43Å; K425-F628 VanDerWaalsContact NZ-CE1 3.29Å; F628-L630 PolarHBondContact O-N 3.21Å
629	G	28.8	Very low	30.5	Very low	85 Å²	85	115 Å²	115	88%	0.876	64%	0.638	S	S	*	*			trans	-72.3	63.1	152.7	0	0	0	0	0	112
630	L	31.7	Very low	30.9	Very low	123 Å²	123	118.5 Å²	118.5	64%	0.644	65%	0.645	S	S	*	*			trans	-138.3	57.4	175.8	-75.3	175.2	0	0	0	110.7	F628	F628-L630 PolarHBondContact O-N 3.21Å
631	A	31.3	Very low	30.8	Very low	73 Å²	73	120.6 Å²	120.6	60%	0.603	63%	0.634	S	S	*	*			trans	-179.2	45.8	154.3	0	0	0	0	0	111.3	P633	A631-P633 WeakPolarHBondContact O-CD 3.36Å
632	E	27	Very low	31	Very low	173 Å²	173	124.9 Å²	124.9	81%	0.808	65%	0.645	S	S	*	*			trans	-88.4	118.4	160.9	-87.7	-173.7	166.3	0	0	108.6	K634	E632-K634 PolarHBondContact O-N 3.08Å
633	P	30.8	Very low	31	Very low	118 Å²	118	127 Å²	127	77%	0.766	66%	0.658	S	S	*	*			trans	-65.6	106.3	165.7	27.1	-29.3	0	0	0	106.9	A631 R635	A631-P633 WeakPolarHBondContact O-CD 3.36Å; P633-R635 PolarHBondContact O-N 3.4Å
634	K	32.3	Very low	31	Very low	199 Å²	199	132.3 Å²	132.3	87%	0.865	68%	0.676	S	S	*	*			trans	-51	106.1	168.8	-75.1	-172.7	174.7	179.1	0	108.2	E632 K636	E632-K634 PolarHBondContact O-N 3.08Å; K634-K636 PolarHBondContact O-N 3.34Å
635	R	30.7	Very low	30.9	Very low	192 Å²	192	135.1 Å²	135.1	73%	0.725	69%	0.694	S	S	*	*			trans	-50.9	115.5	171.4	-80.3	-177.2	173.7	156.6	-2.9	107	E165 P633 S637	E165-R635 IonicContact OE1-NH2 2.81Å; E165-R635 PolarHBondContact OE1-NH2 2.87Å; E165-R635 IonicContact OE2-NH2 3.88Å; E165-R635 PolarHBondContact OE2-NH2 2.9Å; P633-R635 PolarHBondContact O-N 3.4Å; R635-S637 PolarHBondContact O-N 3.47Å
636	K	29.5	Very low	31.1	Very low	203 Å²	203	142.3 Å²	142.3	88%	0.883	72%	0.717	S	S	*	*			trans	-62.4	117.9	167.2	-72.6	-179.9	178.8	176.5	0	106.1	K634 S638	K634-K636 PolarHBondContact O-N 3.34Å; K636-S638 PolarHBondContact O-N 3.39Å
637	S	31.2	Very low	31.1	Very low	113 Å²	113	143.8 Å²	143.8	79%	0.79	73%	0.728	S	S	*	*			trans	-53.9	115.5	168.6	48	0	0	0	0	108.1	R635 L639	R635-S637 PolarHBondContact O-N 3.47Å; S637-L639 PolarHBondContact O-N 2.82Å
638	S	30.3	Very low	31.3	Very low	93 Å²	93	149 Å²	149	65%	0.65	76%	0.761	S	S	*	*			trans	-51.9	124.9	168.1	168.5	0	0	0	0	108.9	K636 F640	K636-S638 PolarHBondContact O-N 3.39Å; S638-F640 PolarHBondContact O-N 3.24Å
639	L	33.3	Very low	31.3	Very low	165 Å²	165	150.2 Å²	150.2	86%	0.864	78%	0.776	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.8	76.4	166.8	-78.9	150.5	0	0	0	108.9	S637	S637-L639 PolarHBondContact O-N 2.82Å
640	F	32.7	Very low	31.6	Very low	156 Å²	156	155 Å²	155	68%	0.684	77%	0.772	S	S	*	*	T	Hydrogen-bonded Turn	trans	-144.8	-10.8	174.7	-164.8	-107.8	0	0	0	115.2	S638	S638-F640 PolarHBondContact O-N 3.24Å
641	W	28	Very low	31.6	Very low	204 Å²	204	160.2 Å²	160.2	77%	0.773	78%	0.784	S	S	*	*			trans	-111.8	12.9	-177.2	-77.3	111.2	0	0	0	116.7	T643	W641-T643 VanDerWaalsContact C-N 3.3Å; W641-T643 PolarHBondContact O-N 3.32Å; W641-T643 VanDerWaalsContact O-N 3.08Å
642	H	33.3	Very low	31.8	Very low	172 Å²	172	170.4 Å²	170.4	80%	0.796	81%	0.814	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84	61.4	172.5	-72.6	-60.5	0	0	0	112.6
643	T	30	Very low	32	Very low	126 Å²	126	170.3 Å²	170.3	77%	0.773	82%	0.815	S	S	*	*	T	Hydrogen-bonded Turn	trans	-152.9	1.5	167.1	-33.8	0	0	0	0	117	W641	W641-T643 VanDerWaalsContact C-N 3.3Å; W641-T643 PolarHBondContact O-N 3.32Å; W641-T643 VanDerWaalsContact O-N 3.08Å
644	F	30	Very low	32.1	Very low	174 Å²	174	173 Å²	173	76%	0.763	82%	0.817	S	S	*	*	S	Bend	trans	-120.2	119.3	176.1	-96.1	-93.9	0	0	0	111.9
645	N	31.8	Very low	32.1	Very low	158 Å²	158	171.6 Å²	171.6	85%	0.845	82%	0.815	S	S	*	*			trans	133	30	167.8	-64.9	-21.1	0	0	0	115.1
646	R	33.9	Very low	32.2	Very low	237 Å²	237	170.4 Å²	170.4	89%	0.894	82%	0.82	S	S	*	*			trans	-92.9	139.1	143.7	-102.4	-177.4	176	-179.6	-0.9	107.1
647	L	31.2	Very low	32.4	Very low	161 Å²	161	168.3 Å²	168.3	84%	0.843	82%	0.816	S	S	*	*	S	Bend	trans	81.9	109	-171.8	-46.3	171.1	0	0	0	109.8
648	T	34.6	Very low	32.4	Very low	131 Å²	131	172 Å²	172	80%	0.804	82%	0.818	S	S	*	*			cis	-165	157.1	33.4	26.9	0	0	0	0	109.9
649	P	34.8	Very low	32.6	Very low	98 Å²	98	177.6 Å²	177.6	64%	0.636	83%	0.83	S	S	*	*			trans	-91.9	161.2	-177.7	33	-22.5	0	0	0	112.5
650	F	34.7	Very low	32.5	Very low	185 Å²	185	178.6 Å²	178.6	81%	0.811	83%	0.827	S	S	*	*			trans	150.3	116.1	135.7	-82.2	-69.7	0	0	0	114.5
651	R	33.2	Very low	32.5	Very low	234 Å²	234	180.5 Å²	180.5	88%	0.883	84%	0.839	S	S	*	*			trans	25.1	119	140.7	-75.3	-178.5	169.4	-178.9	-3.4	119.5
652	K	34.8	Very low	32.9	Very low	286 Å²	286	178.4 Å²	178.4	100%	1.243	85%	0.845	S	S	*	*				-154.9	0	89.2	-127	179.3	-173.7	178.2	0	110.4

Retrieved 652 of 652 residues in 752.5 ms (Link to these results)

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