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Integrin beta

Integrin alpha-V:beta-8 (ITGAV:ITGB8) is a receptor for fibronectin. It recognizes the sequence R-G-D in its ligands. Integrin alpha-V:beta-6 (ITGAV:ITGB6) mediates R-G-D-dependent release of transforming growth factor beta-1 (TGF-beta-1) from regulatory Latency-associated peptide (LAP), thereby playing a key role in TGF-beta-1 activation on the surface of activated regulatory T-cells (Tregs). Required during vasculogenesis.

AlphaFold DB , UniProt , Accession A0A096NA97, Species PAPAN (Papio anubis, Olive baboon), Gene ITGB8, Length 788 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.5	Very low	35.7	Very low	248 Å²	248	133.6 Å²	133.6	100%	1.222	81%	0.814	S	S	*	*				0	116.5	0	-68.6	155.5	68.2	0	0	107.7
2	C	37.5	Very low	35.7	Very low	145 Å²	145	128.8 Å²	128.8	98%	0.98	80%	0.798	S	S	*	*			trans	-143.2	121.8	179.7	-171	0	0	0	0	108.5
3	G	34	Very low	35.6	Very low	71 Å²	71	133.8 Å²	133.8	73%	0.732	80%	0.802	S	S	*	*			trans	135	67.9	-173.5	0	0	0	0	0	114
4	S	39.5	Very low	35.6	Very low	115 Å²	115	133.4 Å²	133.4	80%	0.804	80%	0.8	S	S	*	*	S	Bend	trans	-159.2	-14.9	167.3	-72.9	0	0	0	0	114.1
5	A	33.8	Very low	35.3	Very low	86 Å²	86	132.4 Å²	132.4	71%	0.711	80%	0.8	S	S	*	*	G	3₁₀ helix	trans	-80.3	-16.3	-170.7	0	0	0	0	0	116.2	A7	A5-A7 PolarHBondContact O-N 3.42Å
6	L	34.7	Very low	35.2	Very low	161 Å²	161	134 Å²	134	84%	0.843	80%	0.802	S	S	*	*	G	3₁₀ helix	trans	-81.1	-10.3	-172.6	-100.7	78.9	0	0	0	115.3	F8	L6-F8 PolarHBondContact O-N 3.27Å
7	A	35.1	Very low	35.5	Very low	79 Å²	79	137.2 Å²	137.2	65%	0.653	81%	0.806	S	S	*	*	G	3₁₀ helix	trans	-77.2	-16.8	-170.5	0	0	0	0	0	115.3	A5	A5-A7 PolarHBondContact O-N 3.42Å
8	F	33.8	Very low	35.5	Very low	183 Å²	183	137.9 Å²	137.9	80%	0.803	81%	0.806	S	S	*	*	G	3₁₀ helix	trans	-95.3	-15.3	-172.3	-91.4	-84.7	0	0	0	115.4	L6 T10	L6-F8 PolarHBondContact O-N 3.27Å; F8-T10 PolarHBondContact O-N 3.35Å
9	F	35.9	Very low	35.3	Very low	181 Å²	181	138.2 Å²	138.2	79%	0.794	80%	0.804	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.3	-11.5	-170.6	-99.5	-81.7	0	0	0	115.6
10	T	36.9	Very low	35.4	Very low	118 Å²	118	142.5 Å²	142.5	72%	0.724	81%	0.806	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.4	-11	-174.1	47.4	0	0	0	0	114.9	F8	F8-T10 PolarHBondContact O-N 3.35Å
11	A	34.8	Very low	35.8	Very low	83 Å²	83	147.8 Å²	147.8	69%	0.686	81%	0.814	S	S	*	*	S	Bend	trans	-87	-21.8	-174.8	0	0	0	0	0	114.8
12	A	35.8	Very low	35.8	Very low	76 Å²	76	138.3 Å²	138.3	63%	0.628	78%	0.779	S	S	*	*	G	3₁₀ helix	trans	-84	-17	-168.2	0	0	0	0	0	115.4	V14	A12-V14 PolarHBondContact O-N 3.16Å
13	F	34.2	Very low	36	Very low	193 Å²	193	137.5 Å²	137.5	85%	0.846	77%	0.772	S	S	*	*	G	3₁₀ helix	trans	-86.9	-1.5	-164.6	-113.4	-80.5	0	0	0	116.1
14	V	35.8	Very low	36.4	Very low	129 Å²	129	137.4 Å²	137.4	78%	0.782	77%	0.765	S	S	*	*	G	3₁₀ helix	trans	-101.9	-9.7	-170	-175.3	0	0	0	0	113.5	A12	A12-V14 PolarHBondContact O-N 3.16Å
15	C	30.7	Very low	36.6	Very low	118 Å²	118	136.1 Å²	136.1	80%	0.797	76%	0.755	S	S	*	*	S	Bend	trans	-110.4	20.2	-174.9	-65.7	0	0	0	0	115.4
16	L	33.8	Very low	37	Very low	158 Å²	158	140.5 Å²	140.5	83%	0.827	76%	0.759	S	S	*	*			trans	-120.8	50.2	175.9	-82.5	168.6	0	0	0	113
17	Q	39.9	Very low	37.5	Very low	188 Å²	188	138.9 Å²	138.9	88%	0.879	75%	0.75	S	S	*	*			trans	-125.8	58.4	161.2	-86.2	-162.2	-26	0	0	111.9
18	N	37	Very low	37.9	Very low	150 Å²	150	144.9 Å²	144.9	80%	0.802	76%	0.756	S	S	*	*			trans	-162.5	165.2	140.5	-112.9	-28.3	0	0	0	114.2
19	D	31.5	Very low	38.4	Very low	144 Å²	144	138.8 Å²	138.8	77%	0.77	74%	0.739	S	S	*	*			trans	70.7	168	166.5	-78.5	-56.6	0	0	0	120.7
20	R	37	Very low	38.9	Very low	224 Å²	224	132.7 Å²	132.7	85%	0.845	72%	0.723	S	S	*	*			trans	-119.5	141.5	-138.8	-70.8	169.8	161.9	179.6	-4	114.7
21	R	44.1	Very low	39.4	Very low	254 Å²	254	136.2 Å²	136.2	96%	0.958	72%	0.723	S	S	*	*			trans	36.1	104.9	144.5	-63.6	-177.3	178.4	177.7	-1	117.8
22	G	36.1	Very low	40	Very low	49 Å²	49	136.2 Å²	136.2	51%	0.505	71%	0.714	S	S	.	*			trans	-148.9	145.4	155.6	0	0	0	0	0	110.9	A24	G22-A24 VanDerWaalsContact C-N 3.25Å; G22-A24 PolarHBondContact O-N 2.68Å
23	P	41.7	Very low	40.3	Very low	128 Å²	128	138.1 Å²	138.1	83%	0.831	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.1	-5.6	-175.4	30.2	-35.4	0	0	0	114.6	S25	P23-S25 VanDerWaalsContact C-N 3.34Å; P23-S25 PolarHBondContact O-N 3.48Å
24	A	42.3	Very low	40.7	Very low	69 Å²	69	132.8 Å²	132.8	57%	0.57	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67	-28.8	-175.9	0	0	0	0	0	114.2	G22 F26 L27	G22-A24 VanDerWaalsContact C-N 3.25Å; G22-A24 PolarHBondContact O-N 2.68Å; A24-F26 VanDerWaalsContact C-N 3.29Å; A24-F26 PolarHBondContact O-N 3.16Å; A24-L27 PolarHBondContact O-N 3Å
25	S	42.7	Very low	40.7	Very low	87 Å²	87	131.8 Å²	131.8	61%	0.608	69%	0.69	S	S	*	*	H	α-helix	trans	-63.6	-28.9	-169.7	-45.8	0	0	0	0	114.3	P23 A29	P23-S25 VanDerWaalsContact C-N 3.34Å; P23-S25 PolarHBondContact O-N 3.48Å; S25-A29 PolarHBondContact O-N 2.72Å
26	F	43.4	Very low	41.1	Very low	178 Å²	178	131.5 Å²	131.5	78%	0.781	68%	0.684	S	S	*	*	H	α-helix	trans	-70.3	-33.3	178.9	-92.3	-87.3	0	0	0	113.2	A24 A30	A24-F26 VanDerWaalsContact C-N 3.29Å; A24-F26 PolarHBondContact O-N 3.16Å; F26-A30 PolarHBondContact O-N 3.13Å; F26-A30 VanDerWaalsContact O-N 3.14Å
27	L	44.9	Very low	41.3	Very low	127 Å²	127	130.9 Å²	130.9	67%	0.665	68%	0.681	S	S	*	*	H	α-helix	trans	-73.5	-35.1	-179.5	-67.8	172.5	0	0	0	111.9	A24 W31	A24-L27 PolarHBondContact O-N 3Å; L27-W31 PolarHBondContact O-N 2.7Å; L27-W31 VanDerWaalsContact O-N 3.14Å
28	W	43.2	Very low	41	Very low	206 Å²	206	124.4 Å²	124.4	78%	0.78	66%	0.664	S	S	*	*	H	α-helix	trans	-68.8	-41.5	172.9	-97.6	51.1	0	0	0	112.5	A30 W31 V32	W28-A30 VanDerWaalsContact C-N 3.32Å; W28-A30 PolarHBondContact O-N 3.13Å; W28-W31 PolarHBondContact O-N 2.04Å; W28-V32 WeakPolarHBondContact O-CG2 3.39Å; W28-V32 PolarHBondContact O-N 3.19Å
29	A	43.6	Very low	40.8	Very low	54 Å²	54	125.3 Å²	125.3	45%	0.446	67%	0.668	S	S	.	*	H	α-helix	trans	-60.5	-41.5	175.8	0	0	0	0	0	112.2	S25 V32 L33	S25-A29 PolarHBondContact O-N 2.72Å; A29-V32 PolarHBondContact O-N 2.99Å; A29-L33 PolarHBondContact O-N 2.03Å
30	A	48.1	Very low	40.8	Very low	54 Å²	54	121.6 Å²	121.6	45%	0.446	66%	0.664	S	S	.	*	H	α-helix	trans	-63	-43.1	175.1	0	0	0	0	0	112.4	F26 W28 L33 S34	F26-A30 PolarHBondContact O-N 3.13Å; F26-A30 VanDerWaalsContact O-N 3.14Å; W28-A30 VanDerWaalsContact C-N 3.32Å; W28-A30 PolarHBondContact O-N 3.13Å; A30-L33 PolarHBondContact O-N 3.05Å; A30-S34 PolarHBondContact O-N 3.15Å; A30-S34 PolarHBondContact O-OG 3.2Å
31	W	46.8	Very low	40.5	Very low	192 Å²	192	120.1 Å²	120.1	73%	0.727	67%	0.666	S	S	*	*	H	α-helix	trans	-61.8	-42.6	175.9	-105	75.3	0	0	0	113	L27 W28 S34 L35	L27-W31 PolarHBondContact O-N 2.7Å; L27-W31 VanDerWaalsContact O-N 3.14Å; W28-W31 PolarHBondContact O-N 2.04Å; W31-S34 PolarHBondContact O-N 2.88Å; W31-L35 HydrophobicContact CE3-CD1 3.81Å; W31-L35 HydrophobicContact CZ3-CD1 4.18Å; W31-L35 WeakPolarHBondContact O-CD1 3.48Å; W31-L35 PolarHBondContact O-N 3.14Å
32	V	46.8	Very low	40.2	Very low	82 Å²	82	111 Å²	111	50%	0.497	65%	0.652	S	S	.	*	H	α-helix	trans	-67.5	-39.9	178.5	174.9	0	0	0	0	111.4	W28 A29 S34 L35 V36	W28-V32 WeakPolarHBondContact O-CG2 3.39Å; W28-V32 PolarHBondContact O-N 3.19Å; A29-V32 PolarHBondContact O-N 2.99Å; V32-S34 VanDerWaalsContact C-N 3.34Å; V32-S34 PolarHBondContact O-N 3.38Å; V32-L35 PolarHBondContact O-N 3.3Å; V32-V36 WeakPolarHBondContact O-CG2 3.44Å; V32-V36 PolarHBondContact O-N 3.04Å; V32-V36 VanDerWaalsContact O-N 3.08Å
33	L	41.7	Very low	40.5	Very low	116 Å²	116	118 Å²	118	61%	0.607	67%	0.672	S	S	*	*	H	α-helix	trans	-63	-39.3	172.6	-99.7	72.5	0	0	0	112.2	A29 A30 V36 L37	A29-L33 PolarHBondContact O-N 2.03Å; A30-L33 PolarHBondContact O-N 3.05Å; L33-V36 PolarHBondContact O-N 2.92Å; L33-L37 PolarHBondContact O-N 3.11Å
34	S	43.1	Very low	41.3	Very low	81 Å²	81	119.4 Å²	119.4	57%	0.566	67%	0.672	S	S	*	*	H	α-helix	trans	-64.8	-36.2	175.1	-64.2	0	0	0	0	113	A30 W31 V32 G38	A30-S34 PolarHBondContact O-N 3.15Å; A30-S34 PolarHBondContact O-OG 3.2Å; W31-S34 PolarHBondContact O-N 2.88Å; V32-S34 VanDerWaalsContact C-N 3.34Å; V32-S34 PolarHBondContact O-N 3.38Å; S34-G38 PolarHBondContact O-N 3.38Å
35	L	37.2	Very low	42.9	Very low	109 Å²	109	117.9 Å²	117.9	57%	0.571	65%	0.654	S	S	*	*	H	α-helix	trans	-66.9	-39.1	173.1	-99.2	83.9	0	0	0	112.6	W31 V32 G38	W31-L35 HydrophobicContact CE3-CD1 3.81Å; W31-L35 HydrophobicContact CZ3-CD1 4.18Å; W31-L35 WeakPolarHBondContact O-CD1 3.48Å; W31-L35 PolarHBondContact O-N 3.14Å; V32-L35 PolarHBondContact O-N 3.3Å; L35-G38 PolarHBondContact O-N 2.83Å
36	V	38.7	Very low	44.5	Very low	111 Å²	111	118.4 Å²	118.4	67%	0.673	65%	0.649	S	S	*	*	H	α-helix	trans	-70.2	-33.1	179.9	173.2	0	0	0	0	112	V32 L33	V32-V36 WeakPolarHBondContact O-CG2 3.44Å; V32-V36 PolarHBondContact O-N 3.04Å; V32-V36 VanDerWaalsContact O-N 3.08Å; L33-V36 PolarHBondContact O-N 2.92Å
37	L	37.6	Very low	46.2	Very low	146 Å²	146	110 Å²	110	76%	0.764	61%	0.612	S	S	*	*	H	α-helix	trans	-83.1	-12.4	174.3	-67.5	170.8	0	0	0	113.7	L33	L33-L37 PolarHBondContact O-N 3.11Å
38	G	33.4	Very low	47.7	Very low	52 Å²	52	105.6 Å²	105.6	54%	0.536	59%	0.594	S	S	.	*	S	Bend	trans	-81	-14.8	-178	0	0	0	0	0	115.6	S34 L35 G40	S34-G38 PolarHBondContact O-N 3.38Å; L35-G38 PolarHBondContact O-N 2.83Å; G38-G40 VanDerWaalsContact C-N 3.32Å; G38-G40 PolarHBondContact O-N 2.03Å
39	L	32.5	Very low	48.7	Very low	169 Å²	169	99.6 Å²	99.6	89%	0.885	58%	0.584	S	S	*	*	S	Bend	trans	-97.2	36.4	-177.7	-69.4	168.1	0	0	0	112.5
40	G	32	Very low	49.5	Very low	65 Å²	65	99.2 Å²	99.2	67%	0.67	58%	0.578	S	S	*	*			trans	-125.7	9.2	-173.2	0	0	0	0	0	115.6	G38 G42	G38-G40 VanDerWaalsContact C-N 3.32Å; G38-G40 PolarHBondContact O-N 2.03Å; G40-G42 PolarHBondContact O-N 2.94Å
41	Q	31	Very low	50.2	Low	193 Å²	193	101.9 Å²	101.9	90%	0.902	59%	0.585	S	S	*	*			trans	-79.9	98.5	165.8	-72.4	-172	-46.8	0	0	108.7
42	G	37.8	Very low	51.2	Low	64 Å²	64	93.4 Å²	93.4	66%	0.66	55%	0.554	S	S	*	*			trans	-65.2	150.9	163.1	0	0	0	0	0	110.2	G40 D44	G40-G42 PolarHBondContact O-N 2.94Å; G42-D44 PolarHBondContact O-N 2.83Å
43	E	42.9	Very low	52.2	Low	196 Å²	196	91.8 Å²	91.8	92%	0.916	55%	0.549	S	S	*	.			trans	-60	127.5	176.3	-65.4	174.5	119.9	0	0	110.1	N45	E43-N45 PolarHBondContact O-N 2.85Å
44	D	58.1	Low	53.8	Low	156 Å²	156	87.7 Å²	87.7	83%	0.834	53%	0.53	S	S	*	.			trans	-61.8	111	178.7	-97.1	-40	0	0	0	109.6	G42 I46	G42-D44 PolarHBondContact O-N 2.83Å; D44-I46 PolarHBondContact O-N 3.49Å
45	N	75.1	Confident	55.4	Low	37 Å²	37	84 Å²	84	20%	0.198	50%	0.504	C	S	.	.			trans	-71.4	95	-173.8	-179.5	-12.5	0	0	0	111	E43 C47 A48 S49 D84 N88	E43-N45 PolarHBondContact O-N 2.85Å; N45-C47 VanDerWaalsContact C-N 3.28Å; N45-C47 PolarHBondContact O-N 3.37Å; N45-C47 WeakPolarHBondContact OD1-CB 3.31Å; N45-C47 PolarHBondContact OD1-N 3.45Å; N45-C47 VanDerWaalsContact OD1-N 3.15Å; N45-A48 HydrophobicContact CB-CB 4.46Å; N45-A48 WeakPolarHBondContact ND2-CB 3.33Å; N45-A48 PolarHBondContact O-N 3.32Å; N45-A48 PolarHBondContact OD1-N 2.04Å; N45-S49 VanDerWaalsContact O-CB 3.27Å; N45-S49 WeakPolarHBondContact O-CB 3.48Å; N45-S49 PolarHBondContact O-N 3.45Å; N45-S49 PolarHBondContact O-OG 3.32Å; N45-D84 PolarHBondContact ND2-OD1 3.32Å; N45-N88 PolarHBondContact ND2-ND2 2.98Å
46	I	76.9	Confident	57.2	Low	99 Å²	99	80.7 Å²	80.7	51%	0.508	49%	0.493	S	S	.	.	H	α-helix	trans	-60.6	-36.6	179.4	-64.4	173.8	0	0	0	111.3	D44 S49 S50 L61	D44-I46 PolarHBondContact O-N 3.49Å; I46-S49 WeakPolarHBondContact CA-OG 3.5Å; I46-S50 VanDerWaalsContact O-CB 3.26Å; I46-S50 WeakPolarHBondContact O-CB 3.49Å; I46-S50 PolarHBondContact O-N 3.24Å; I46-S50 PolarHBondContact O-OG 3.49Å; I46-L61 HydrophobicContact CG2-CB 4.4Å
47	C	79.1	Confident	59	Low	1 Å²	1	83.3 Å²	83.3	1%	0.007	49%	0.491	C	S	.	.	H	α-helix	trans	-58.9	-55.5	178.4	-47.5	0	0	0	0	111	N45 S50 C65	N45-C47 VanDerWaalsContact C-N 3.28Å; N45-C47 PolarHBondContact O-N 3.37Å; N45-C47 WeakPolarHBondContact OD1-CB 3.31Å; N45-C47 PolarHBondContact OD1-N 3.45Å; N45-C47 VanDerWaalsContact OD1-N 3.15Å; C47-S50 PolarHBondContact O-OG 2.9Å; C47-C65 VanDerWaalsContact CA-SG 3.57Å; C47-C65 HydrophobicContact CB-CB 3.85Å; C47-C65 WeakPolarHBondContact CB-SG 3.05Å; C47-C65 WeakPolarHBondContact SG-CA 3.03Å; C47-C65 WeakPolarHBondContact SG-CB 3Å; C47-C65 CovalentContact SG-SG 2.04Å; C47-C65 PolarHBondContact SG-SG 2.86Å
48	A	75	Confident	61	Low	35 Å²	35	76.4 Å²	76.4	29%	0.289	45%	0.454	S	S	.	.	H	α-helix	trans	-77	-35.9	-175.4	0	0	0	0	0	114	N45 S50	N45-A48 HydrophobicContact CB-CB 4.46Å; N45-A48 WeakPolarHBondContact ND2-CB 3.33Å; N45-A48 PolarHBondContact O-N 3.32Å; N45-A48 PolarHBondContact OD1-N 2.04Å; A48-S50 VanDerWaalsContact C-N 3.32Å; A48-S50 PolarHBondContact O-N 3.4Å
49	S	64.7	Low	63.2	Low	80 Å²	80	74.4 Å²	74.4	56%	0.559	43%	0.432	S	S	*	.	H	α-helix	trans	-70.9	-25.2	-176.5	58.1	0	0	0	0	113.9	N45 I46 N51	N45-S49 VanDerWaalsContact O-CB 3.27Å; N45-S49 WeakPolarHBondContact O-CB 3.48Å; N45-S49 PolarHBondContact O-N 3.45Å; N45-S49 PolarHBondContact O-OG 3.32Å; I46-S49 WeakPolarHBondContact CA-OG 3.5Å; S49-N51 VanDerWaalsContact C-N 3.28Å; S49-N51 PolarHBondContact O-N 2.04Å; S49-N51 PolarHBondContact O-ND2 3.48Å
50	S	60.2	Low	65.2	Low	45 Å²	45	69 Å²	69	32%	0.315	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-13.8	-173.8	67.8	0	0	0	0	115.8	I46 C47 A48 V52 L61	I46-S50 VanDerWaalsContact O-CB 3.26Å; I46-S50 WeakPolarHBondContact O-CB 3.49Å; I46-S50 PolarHBondContact O-N 3.24Å; I46-S50 PolarHBondContact O-OG 3.49Å; C47-S50 PolarHBondContact O-OG 2.9Å; A48-S50 VanDerWaalsContact C-N 3.32Å; A48-S50 PolarHBondContact O-N 3.4Å; S50-V52 VanDerWaalsContact C-N 3.32Å; S50-V52 PolarHBondContact O-N 3.39Å; S50-V52 WeakPolarHBondContact OG-CG2 3Å; S50-L61 WeakPolarHBondContact OG-CD1 3.03Å
51	N	64.4	Low	67.4	Low	111 Å²	111	68.7 Å²	68.7	59%	0.594	39%	0.394	S	S	*	.			trans	52.3	41.3	-177.7	-76.7	-75.3	0	0	0	115	S49 S80	S49-N51 VanDerWaalsContact C-N 3.28Å; S49-N51 PolarHBondContact O-N 2.04Å; S49-N51 PolarHBondContact O-ND2 3.48Å; N51-S80 WeakPolarHBondContact OD1-CB 3.04Å; N51-S80 PolarHBondContact OD1-OG 2.71Å
52	V	66.6	Low	69.4	Low	13 Å²	13	59.9 Å²	59.9	8%	0.079	35%	0.354	C	S	.	.			trans	-79.9	134.3	178.1	172.5	0	0	0	0	111.8	S50 S54 R57 C58 L61	S50-V52 VanDerWaalsContact C-N 3.32Å; S50-V52 PolarHBondContact O-N 3.39Å; S50-V52 WeakPolarHBondContact OG-CG2 3Å; V52-S54 WeakPolarHBondContact CG1-O 3.1Å; V52-R57 HydrophobicContact CG1-CB 3.76Å; V52-R57 HydrophobicContact CG1-CG 3.96Å; V52-R57 HydrophobicContact CG2-CG 4.34Å; V52-C58 HydrophobicContact CG1-CB 4.18Å; V52-L61 HydrophobicContact CG2-CD1 4.15Å; V52-L61 HydrophobicContact CG2-CD2 4.3Å
53	A	67.8	Low	71.2	Confident	49 Å²	49	59 Å²	59	41%	0.405	34%	0.337	S	S	.	.			trans	-110.9	12.9	-177.6	0	0	0	0	0	114.5
54	S	74.7	Confident	73	Confident	29 Å²	29	53.4 Å²	53.4	20%	0.203	31%	0.311	C	S	.	.	S	Bend	trans	-138.4	133.8	-173.2	44	0	0	0	0	111.7	V52 R57 C58 D483	V52-S54 WeakPolarHBondContact CG1-O 3.1Å; S54-R57 PolarHBondContact O-N 2.68Å; S54-R57 VanDerWaalsContact OG-CB 3.25Å; S54-R57 WeakPolarHBondContact OG-CB 2.98Å; S54-C58 PolarHBondContact O-N 2.94Å; S54-D483 WeakPolarHBondContact CA-OD1 3.44Å; S54-D483 WeakPolarHBondContact CB-OD1 3.47Å
55	C	77.7	Confident	74.3	Confident	4 Å²	4	46 Å²	46	3%	0.027	27%	0.271	C	S	.	.	H	α-helix	trans	-59.7	-55.5	-170.8	-177.3	0	0	0	0	112.9	R57 C58 L59 W67 C469	C55-R57 PolarHBondContact O-N 2.98Å; C55-R57 VanDerWaalsContact O-N 3.13Å; C55-C58 WeakPolarHBondContact O-CB 3.02Å; C55-C58 PolarHBondContact O-N 2.92Å; C55-L59 PolarHBondContact O-N 3.33Å; C55-L59 VanDerWaalsContact O-N 3.1Å; C55-W67 HydrophobicContact CB-CB 4.44Å; C55-W67 HydrophobicContact CB-CD2 4.08Å; C55-W67 HydrophobicContact CB-CG 3.83Å; C55-W67 VanDerWaalsContact SG-CD1 3.52Å; C55-C469 VanDerWaalsContact C-SG 3.5Å; C55-C469 HydrophobicContact CB-CB 3.98Å; C55-C469 WeakPolarHBondContact CB-SG 3.43Å; C55-C469 WeakPolarHBondContact SG-CB 3.43Å; C55-C469 CovalentContact SG-SG 2.04Å; C55-C469 PolarHBondContact SG-SG 2.87Å
56	A	74.6	Confident	74.8	Confident	40 Å²	40	44.2 Å²	44.2	33%	0.331	26%	0.262	S	S	.	.	H	α-helix	trans	-57.5	-32.5	-178.8	0	0	0	0	0	113	A60	A56-A60 WeakPolarHBondContact O-CB 3.37Å; A56-A60 PolarHBondContact O-N 2.74Å
57	R	76.8	Confident	75.3	Confident	166 Å²	166	39.7 Å²	39.7	63%	0.626	24%	0.238	S	C	*	.	H	α-helix	trans	-78.9	-29.7	178.3	-166.1	177	-170.1	138.3	3.2	112.9	V52 S54 C55 A60	V52-R57 HydrophobicContact CG1-CB 3.76Å; V52-R57 HydrophobicContact CG1-CG 3.96Å; V52-R57 HydrophobicContact CG2-CG 4.34Å; S54-R57 PolarHBondContact O-N 2.68Å; S54-R57 VanDerWaalsContact OG-CB 3.25Å; S54-R57 WeakPolarHBondContact OG-CB 2.98Å; C55-R57 PolarHBondContact O-N 2.98Å; C55-R57 VanDerWaalsContact O-N 3.13Å; R57-A60 PolarHBondContact O-N 3.15Å
58	C	80.6	Confident	75.6	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-66	-47.6	172.3	176.4	0	0	0	0	110.4	V52 S54 C55 A60 L61 G66 W67 C83	V52-C58 HydrophobicContact CG1-CB 4.18Å; S54-C58 PolarHBondContact O-N 2.94Å; C55-C58 WeakPolarHBondContact O-CB 3.02Å; C55-C58 PolarHBondContact O-N 2.92Å; C58-A60 PolarHBondContact O-N 2.61Å; C58-A60 VanDerWaalsContact O-N 3.14Å; C58-L61 WeakPolarHBondContact O-CB 3.17Å; C58-L61 WeakPolarHBondContact O-CG 3.41Å; C58-L61 PolarHBondContact O-N 3.34Å; C58-L61 VanDerWaalsContact O-N 3.11Å; C58-G66 PolarHBondContact SG-O 3.39Å; C58-W67 HydrophobicContact CB-CE3 3.83Å; C58-W67 HydrophobicContact CB-CZ3 4.48Å; C58-C83 VanDerWaalsContact CA-SG 3.59Å; C58-C83 HydrophobicContact CB-CB 3.82Å; C58-C83 WeakPolarHBondContact CB-SG 3.44Å; C58-C83 WeakPolarHBondContact SG-CA 3.02Å; C58-C83 WeakPolarHBondContact SG-CB 3.49Å; C58-C83 CovalentContact SG-SG 2.03Å; C58-C83 PolarHBondContact SG-SG 3.3Å
59	L	79.1	Confident	76	Confident	11 Å²	11	38.5 Å²	38.5	6%	0.058	23%	0.228	C	C	.	.	H	α-helix	trans	-64.3	-18.9	178.5	-61	-178.5	0	0	0	113.7	C55 P102 R128 C469	C55-L59 PolarHBondContact O-N 3.33Å; C55-L59 VanDerWaalsContact O-N 3.1Å; L59-P102 HydrophobicContact CD1-CG 3.78Å; L59-R128 PolarHBondContact O-NH2 3.11Å; L59-C469 WeakPolarHBondContact CD1-SG 3.49Å
60	A	74.3	Confident	76.6	Confident	54 Å²	54	36.8 Å²	36.8	45%	0.446	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.6	-3.6	177.1	0	0	0	0	0	115.1	A56 R57 C58 P129	A56-A60 WeakPolarHBondContact O-CB 3.37Å; A56-A60 PolarHBondContact O-N 2.74Å; R57-A60 PolarHBondContact O-N 3.15Å; C58-A60 PolarHBondContact O-N 2.61Å; C58-A60 VanDerWaalsContact O-N 3.14Å; A60-P129 HydrophobicContact CB-CB 4.39Å
61	L	77.1	Confident	77.1	Confident	60 Å²	60	41.6 Å²	41.6	31%	0.314	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-45.1	176.7	-66	169.4	0	0	0	112.1	I46 S50 V52 C58	I46-L61 HydrophobicContact CG2-CB 4.4Å; S50-L61 WeakPolarHBondContact OG-CD1 3.03Å; V52-L61 HydrophobicContact CG2-CD1 4.15Å; V52-L61 HydrophobicContact CG2-CD2 4.3Å; C58-L61 WeakPolarHBondContact O-CB 3.17Å; C58-L61 WeakPolarHBondContact O-CG 3.41Å; C58-L61 PolarHBondContact O-N 3.34Å; C58-L61 VanDerWaalsContact O-N 3.11Å
62	G	72.9	Confident	77.3	Confident	7 Å²	7	41.1 Å²	41.1	7%	0.072	23%	0.225	C	C	.	.			trans	-171.2	158.8	-178.5	0	0	0	0	0	110.8	E64 C65 R128	G62-E64 PolarHBondContact O-N 2.96Å; G62-C65 PolarHBondContact O-N 3.38Å; G62-R128 PolarHBondContact O-NH2 2.92Å
63	P	77.2	Confident	77.5	Confident	47 Å²	47	42 Å²	42	31%	0.305	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-30.3	179.9	25.3	-34.4	0	0	0	113.3	Y101 R128 A131	P63-Y101 WeakPolarHBondContact O-CE2 3.49Å; P63-Y101 PolarHBondContact O-OH 3.36Å; P63-R128 VanDerWaalsContact O-CZ 3.3Å; P63-R128 PolarHBondContact O-NH1 3.42Å; P63-R128 VanDerWaalsContact O-NH1 3.08Å; P63-R128 PolarHBondContact O-NH2 3.19Å; P63-A131 HydrophobicContact CB-CB 4.01Å
64	E	81	Confident	77.3	Confident	77 Å²	77	42.1 Å²	42.1	36%	0.36	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-20	-179.5	67.9	-68.6	156.4	0	0	114.7	G62 I85 V86	G62-E64 PolarHBondContact O-N 2.96Å; E64-I85 HydrophobicContact CG-CG1 4.44Å; E64-V86 PolarHBondContact O-N 2.65Å
65	C	84.5	Confident	76.2	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	136.7	178.5	-52.4	0	0	0	0	111.5	C47 G62 R128	C47-C65 VanDerWaalsContact CA-SG 3.57Å; C47-C65 HydrophobicContact CB-CB 3.85Å; C47-C65 WeakPolarHBondContact CB-SG 3.05Å; C47-C65 WeakPolarHBondContact SG-CA 3.03Å; C47-C65 WeakPolarHBondContact SG-CB 3Å; C47-C65 CovalentContact SG-SG 2.04Å; C47-C65 PolarHBondContact SG-SG 2.86Å; G62-C65 PolarHBondContact O-N 3.38Å; C65-R128 PolarHBondContact O-NH1 2.03Å; C65-R128 VanDerWaalsContact O-NH1 3.14Å; C65-R128 PolarHBondContact O-NH2 2.96Å
66	G	86.2	Confident	74.9	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	171.6	167.3	0	0	0	0	0	111.2	C58 D84	C58-G66 PolarHBondContact SG-O 3.39Å; G66-D84 PolarHBondContact N-O 2.99Å; G66-D84 PolarHBondContact O-N 2.92Å
67	W	86.2	Confident	74	Confident	5 Å²	5	49.5 Å²	49.5	2%	0.019	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	125.2	179.7	176.6	-93.3	0	0	0	111.9	C55 C58 R82 C83 I99 E100	C55-W67 HydrophobicContact CB-CB 4.44Å; C55-W67 HydrophobicContact CB-CD2 4.08Å; C55-W67 HydrophobicContact CB-CG 3.83Å; C55-W67 VanDerWaalsContact SG-CD1 3.52Å; C58-W67 HydrophobicContact CB-CE3 3.83Å; C58-W67 HydrophobicContact CB-CZ3 4.48Å; W67-R82 WeakPolarHBondContact CA-O 3.33Å; W67-R82 HydrophobicContact CD2-CB 4.04Å; W67-R82 HydrophobicContact CE3-CB 3.84Å; W67-R82 HydrophobicContact CH2-CB 3.66Å; W67-R82 HydrophobicContact CH2-CG 4.49Å; W67-R82 HydrophobicContact CZ2-CB 3.86Å; W67-R82 HydrophobicContact CZ2-CG 4.43Å; W67-R82 HydrophobicContact CZ3-CB 3.65Å; W67-C83 HydrophobicContact CE3-CB 3.91Å; W67-C83 HydrophobicContact CZ3-CB 4.04Å; W67-I99 WeakPolarHBondContact O-CA 3.46Å; W67-E100 HydrophobicContact CB-CB 4.31Å; W67-E100 PolarHBondContact N-O 2.75Å; W67-E100 PolarHBondContact O-N 2.76Å
68	C	86.1	Confident	73	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	118.6	176.7	-173.7	0	0	0	0	111.4	F73 R82 L89 C94	C68-F73 HydrophobicContact CB-CD1 3.99Å; C68-F73 HydrophobicContact CB-CE1 4Å; C68-F73 HydrophobicContact CB-CG 4.33Å; C68-F73 HydrophobicContact CB-CZ 4.36Å; C68-F73 VanDerWaalsContact SG-CG 3.54Å; C68-R82 PolarHBondContact N-O 3.37Å; C68-R82 PolarHBondContact O-NH1 2.92Å; C68-L89 HydrophobicContact CB-CD1 4.29Å; C68-L89 HydrophobicContact CB-CD2 4.14Å; C68-C94 HydrophobicContact CB-CB 3.92Å; C68-C94 WeakPolarHBondContact CB-SG 3.38Å; C68-C94 WeakPolarHBondContact SG-CB 3.18Å; C68-C94 CovalentContact SG-SG 2.04Å; C68-C94 PolarHBondContact SG-SG 3.19Å
69	V	82.3	Confident	72	Confident	11 Å²	11	51 Å²	51	7%	0.067	30%	0.303	C	S	.	.			trans	-87.3	-20.7	178.1	-178.1	0	0	0	0	112.6	E71 S98 E100 C471 G479	V69-E71 PolarHBondContact O-N 3.44Å; V69-S98 PolarHBondContact N-O 3.29Å; V69-E100 HydrophobicContact CG2-CB 4.43Å; V69-E100 HydrophobicContact CG2-CG 3.51Å; V69-C471 HydrophobicContact CG2-CB 4.4Å; V69-G479 WeakPolarHBondContact CG1-O 3.4Å
70	Q	78.6	Confident	71	Confident	43 Å²	43	51.2 Å²	51.2	20%	0.201	31%	0.306	C	S	.	.			trans	-55.8	127.3	-173.7	-149.9	-172	-65.4	0	0	112.6	D72 F73 R82	Q70-D72 VanDerWaalsContact CG-OD1 3.3Å; Q70-D72 WeakPolarHBondContact CG-OD1 3.47Å; Q70-D72 PolarHBondContact NE2-OD1 3.17Å; Q70-D72 PolarHBondContact NE2-OD2 2.73Å; Q70-F73 HydrophobicContact CB-CB 4.37Å; Q70-F73 WeakPolarHBondContact O-CB 3.25Å; Q70-R82 PolarHBondContact O-NH1 3.09Å; Q70-R82 PolarHBondContact O-NH2 2.66Å
71	E	69.9	Low	70.8	Confident	146 Å²	146	52.4 Å²	52.4	68%	0.682	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	-67.2	-46.6	-166.8	-64.9	-172.1	166.8	0	0	113.2	V69 F73 R82	V69-E71 PolarHBondContact O-N 3.44Å; E71-F73 VanDerWaalsContact C-N 3.26Å; E71-F73 PolarHBondContact O-N 3.11Å; E71-R82 PolarHBondContact O-NH2 3.14Å
72	D	69.4	Low	70.9	Confident	101 Å²	101	50.3 Å²	50.3	54%	0.54	29%	0.29	S	S	.	.	G	3₁₀ helix	trans	-71.5	-10.4	-177.3	63.3	-35.2	0	0	0	115	Q70 I74 S75	Q70-D72 VanDerWaalsContact CG-OD1 3.3Å; Q70-D72 WeakPolarHBondContact CG-OD1 3.47Å; Q70-D72 PolarHBondContact NE2-OD1 3.17Å; Q70-D72 PolarHBondContact NE2-OD2 2.73Å; D72-I74 PolarHBondContact O-N 2.87Å; D72-I74 VanDerWaalsContact O-N 3.14Å; D72-S75 PolarHBondContact O-N 2.79Å; D72-S75 PolarHBondContact O-OG 3.49Å
73	F	71.1	Confident	71.4	Confident	33 Å²	33	50 Å²	50	15%	0.145	29%	0.287	C	S	.	.	G	3₁₀ helix	trans	-55.6	-30.6	179.5	-173.5	-108.4	0	0	0	113.5	C68 Q70 E71 S75 R82 L89 K92 C94	C68-F73 HydrophobicContact CB-CD1 3.99Å; C68-F73 HydrophobicContact CB-CE1 4Å; C68-F73 HydrophobicContact CB-CG 4.33Å; C68-F73 HydrophobicContact CB-CZ 4.36Å; C68-F73 VanDerWaalsContact SG-CG 3.54Å; Q70-F73 HydrophobicContact CB-CB 4.37Å; Q70-F73 WeakPolarHBondContact O-CB 3.25Å; E71-F73 VanDerWaalsContact C-N 3.26Å; E71-F73 PolarHBondContact O-N 3.11Å; F73-S75 VanDerWaalsContact C-N 3.31Å; F73-S75 PolarHBondContact O-N 2.8Å; F73-R82 HydrophobicContact CD1-CG 4.31Å; F73-L89 HydrophobicContact CE1-CD2 4.24Å; F73-L89 HydrophobicContact CZ-CD2 3.95Å; F73-K92 HydrophobicContact CE2-CB 3.63Å; F73-K92 HydrophobicContact CZ-CB 3.71Å; F73-K92 HydrophobicContact CZ-CD 4.04Å; F73-C94 HydrophobicContact CD2-CB 3.84Å; F73-C94 HydrophobicContact CE2-CB 3.64Å; F73-C94 HydrophobicContact CZ-CB 4.33Å
74	I	63.5	Low	71.9	Confident	51 Å²	51	48 Å²	48	26%	0.262	27%	0.273	S	S	.	.			trans	-91.1	65.3	172.9	-50.3	171.7	0	0	0	110	D72 G76 G77 R79 R82	D72-I74 PolarHBondContact O-N 2.87Å; D72-I74 VanDerWaalsContact O-N 3.14Å; I74-G76 PolarHBondContact O-N 3.35Å; I74-G76 VanDerWaalsContact O-N 3.11Å; I74-G77 WeakPolarHBondContact CG2-O 3.03Å; I74-R79 HydrophobicContact CD1-CG 4.19Å; I74-R82 HydrophobicContact CD1-CG 4.04Å; I74-R82 VanDerWaalsContact CD1-NE 3.27Å; I74-R82 HydrophobicContact CG1-CG 4.28Å
75	S	50.8	Low	72.2	Confident	114 Å²	114	46.8 Å²	46.8	80%	0.797	27%	0.269	S	S	*	.	S	Bend	trans	-84.2	49.5	170.8	-72.1	0	0	0	0	112	D72 F73	D72-S75 PolarHBondContact O-N 2.79Å; D72-S75 PolarHBondContact O-OG 3.49Å; F73-S75 VanDerWaalsContact C-N 3.31Å; F73-S75 PolarHBondContact O-N 2.8Å
76	G	51.4	Low	72.2	Confident	79 Å²	79	48.5 Å²	48.5	81%	0.814	28%	0.28	S	S	*	.	S	Bend	trans	124.5	-3.9	174.2	0	0	0	0	0	117.1	I74	I74-G76 PolarHBondContact O-N 3.35Å; I74-G76 VanDerWaalsContact O-N 3.11Å
77	G	54.2	Low	72.3	Confident	34 Å²	34	52 Å²	52	35%	0.351	30%	0.304	S	S	.	.	S	Bend	trans	-87.8	180	-178.6	0	0	0	0	0	115.8	I74 E81	I74-G77 WeakPolarHBondContact CG2-O 3.03Å; G77-E81 WeakPolarHBondContact CA-OE1 3.42Å
78	S	56.8	Low	72.3	Confident	60 Å²	60	54.2 Å²	54.2	42%	0.42	32%	0.316	S	S	.	.			trans	-73.9	145	169	178.7	0	0	0	0	111.6	S80 E81	S78-S80 PolarHBondContact O-N 2.75Å; S78-S80 VanDerWaalsContact O-N 3.1Å; S78-S80 PolarHBondContact OG-N 3.1Å; S78-S80 PolarHBondContact OG-OG 3.1Å; S78-E81 PolarHBondContact N-OE1 3.24Å; S78-E81 WeakPolarHBondContact O-CB 3.38Å; S78-E81 WeakPolarHBondContact O-CG 3.46Å; S78-E81 PolarHBondContact O-N 2.99Å
79	R	58.5	Low	72.3	Confident	137 Å²	137	54.2 Å²	54.2	52%	0.517	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-58.8	-24.3	177	-70.9	175.7	172.9	164.1	-12.2	113.9	I74 E81 E484	I74-R79 HydrophobicContact CD1-CG 4.19Å; R79-E81 PolarHBondContact O-N 2.77Å; R79-E484 VanDerWaalsContact CD-OE2 3.24Å; R79-E484 WeakPolarHBondContact CD-OE2 3.44Å; R79-E484 IonicContact CZ-OE1 3.22Å; R79-E484 IonicContact CZ-OE2 3.17Å; R79-E484 IonicContact NE-OE1 2.83Å; R79-E484 IonicContact NE-OE2 3.78Å; R79-E484 PolarHBondContact NE-OE2 2.81Å; R79-E484 IonicContact NH1-OE1 3.57Å; R79-E484 PolarHBondContact NH1-OE1 3.07Å; R79-E484 IonicContact NH1-OE2 3.27Å; R79-E484 PolarHBondContact NH1-OE2 2.75Å; R79-E484 IonicContact NH2-OE1 2.79Å; R79-E484 PolarHBondContact NH2-OE1 3.46Å; R79-E484 IonicContact NH2-OE2 2.65Å
80	S	59.7	Low	72.5	Confident	16 Å²	16	57.5 Å²	57.5	11%	0.112	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-67.3	-18.9	174.7	39.3	0	0	0	0	114.3	N51 S78 R82 C83	N51-S80 WeakPolarHBondContact OD1-CB 3.04Å; N51-S80 PolarHBondContact OD1-OG 2.71Å; S78-S80 PolarHBondContact O-N 2.75Å; S78-S80 VanDerWaalsContact O-N 3.1Å; S78-S80 PolarHBondContact OG-N 3.1Å; S78-S80 PolarHBondContact OG-OG 3.1Å; S80-R82 PolarHBondContact O-N 3.49Å; S80-R82 VanDerWaalsContact O-N 3.16Å; S80-C83 PolarHBondContact O-N 3.42Å; S80-C83 VanDerWaalsContact O-N 3.14Å
81	E	69.4	Low	72.8	Confident	80 Å²	80	60 Å²	60	37%	0.374	36%	0.355	S	S	.	.	G	3₁₀ helix	trans	-68.9	-12.4	-178.3	-66.8	169.4	-144	0	0	113.8	G77 S78 R79 C83	G77-E81 WeakPolarHBondContact CA-OE1 3.42Å; S78-E81 PolarHBondContact N-OE1 3.24Å; S78-E81 WeakPolarHBondContact O-CB 3.38Å; S78-E81 WeakPolarHBondContact O-CG 3.46Å; S78-E81 PolarHBondContact O-N 2.99Å; R79-E81 PolarHBondContact O-N 2.77Å; E81-C83 PolarHBondContact O-N 3.48Å
82	R	79	Confident	73.4	Confident	16 Å²	16	57.5 Å²	57.5	6%	0.06	34%	0.342	C	S	.	.	G	3₁₀ helix	trans	-66.5	-21.9	171.3	-72	-173.7	176.5	-72.1	-8	113.4	W67 C68 Q70 E71 F73 I74 S80	W67-R82 WeakPolarHBondContact CA-O 3.33Å; W67-R82 HydrophobicContact CD2-CB 4.04Å; W67-R82 HydrophobicContact CE3-CB 3.84Å; W67-R82 HydrophobicContact CH2-CB 3.66Å; W67-R82 HydrophobicContact CH2-CG 4.49Å; W67-R82 HydrophobicContact CZ2-CB 3.86Å; W67-R82 HydrophobicContact CZ2-CG 4.43Å; W67-R82 HydrophobicContact CZ3-CB 3.65Å; C68-R82 PolarHBondContact N-O 3.37Å; C68-R82 PolarHBondContact O-NH1 2.92Å; Q70-R82 PolarHBondContact O-NH1 3.09Å; Q70-R82 PolarHBondContact O-NH2 2.66Å; E71-R82 PolarHBondContact O-NH2 3.14Å; F73-R82 HydrophobicContact CD1-CG 4.31Å; I74-R82 HydrophobicContact CD1-CG 4.04Å; I74-R82 VanDerWaalsContact CD1-NE 3.27Å; I74-R82 HydrophobicContact CG1-CG 4.28Å; S80-R82 PolarHBondContact O-N 3.49Å; S80-R82 VanDerWaalsContact O-N 3.16Å
83	C	84.4	Confident	74.1	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	114.8	174.6	-170.7	0	0	0	0	110.2	C58 W67 S80 E81	C58-C83 VanDerWaalsContact CA-SG 3.59Å; C58-C83 HydrophobicContact CB-CB 3.82Å; C58-C83 WeakPolarHBondContact CB-SG 3.44Å; C58-C83 WeakPolarHBondContact SG-CA 3.02Å; C58-C83 WeakPolarHBondContact SG-CB 3.49Å; C58-C83 CovalentContact SG-SG 2.03Å; C58-C83 PolarHBondContact SG-SG 3.3Å; W67-C83 HydrophobicContact CE3-CB 3.91Å; W67-C83 HydrophobicContact CZ3-CB 4.04Å; S80-C83 PolarHBondContact O-N 3.42Å; S80-C83 VanDerWaalsContact O-N 3.14Å; E81-C83 PolarHBondContact O-N 3.48Å
84	D	86.8	Confident	74.8	Confident	4 Å²	4	53.8 Å²	53.8	2%	0.021	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.4	173.8	177.8	-147.1	-35.7	0	0	0	110.3	N45 G66 N88 L89 K92	N45-D84 PolarHBondContact ND2-OD1 3.32Å; G66-D84 PolarHBondContact N-O 2.99Å; G66-D84 PolarHBondContact O-N 2.92Å; D84-N88 HydrophobicContact CB-CB 4.15Å; D84-N88 WeakPolarHBondContact OD1-CB 3.37Å; D84-N88 PolarHBondContact OD1-ND2 3.25Å; D84-N88 WeakPolarHBondContact OD2-CB 3.13Å; D84-L89 HydrophobicContact CB-CD2 3.55Å; D84-L89 HydrophobicContact CB-CG 3.89Å; D84-K92 IonicContact OD2-NZ 3.39Å; D84-K92 PolarHBondContact OD2-NZ 3.14Å
85	I	86.9	Confident	75.8	Confident	53 Å²	53	53.9 Å²	53.9	27%	0.272	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62	139.4	166.9	-54.4	171.6	0	0	0	108.1	E64 S87 N88 L89	E64-I85 HydrophobicContact CG-CG1 4.44Å; I85-S87 WeakPolarHBondContact CG2-OG 3.32Å; I85-S87 PolarHBondContact O-N 3.14Å; I85-S87 VanDerWaalsContact O-N 3.12Å; I85-N88 WeakPolarHBondContact O-CA 3.24Å; I85-N88 WeakPolarHBondContact O-CB 3.21Å; I85-N88 PolarHBondContact O-N 3.42Å; I85-L89 PolarHBondContact O-N 3.22Å; I85-L89 VanDerWaalsContact O-N 3.1Å
86	V	85.8	Confident	77.3	Confident	36 Å²	36	53.1 Å²	53.1	22%	0.218	33%	0.331	C	S	.	.	H	α-helix	trans	-52.9	-39.5	-174.4	178.5	0	0	0	0	113.3	E64 N88 L89 I90 I99 Y101	E64-V86 PolarHBondContact O-N 2.65Å; V86-N88 VanDerWaalsContact C-N 3.29Å; V86-N88 PolarHBondContact O-N 3.14Å; V86-L89 PolarHBondContact O-N 3.3Å; V86-I90 HydrophobicContact CG1-CD1 3.97Å; V86-I90 WeakPolarHBondContact O-CG1 3.43Å; V86-I90 PolarHBondContact O-N 3.43Å; V86-I90 VanDerWaalsContact O-N 3.09Å; V86-I99 HydrophobicContact CG1-CD1 4.34Å; V86-Y101 HydrophobicContact CG2-CD2 3.27Å; V86-Y101 HydrophobicContact CG2-CE2 3.58Å; V86-Y101 HydrophobicContact CG2-CG 3.86Å
87	S	86.6	Confident	78.7	Confident	73 Å²	73	55.2 Å²	55.2	51%	0.51	32%	0.324	S	S	.	.	H	α-helix	trans	-61.3	-34.8	175.6	48.3	0	0	0	0	113.5	I85 S91	I85-S87 WeakPolarHBondContact CG2-OG 3.32Å; I85-S87 PolarHBondContact O-N 3.14Å; I85-S87 VanDerWaalsContact O-N 3.12Å; S87-S91 WeakPolarHBondContact O-CB 3.29Å; S87-S91 PolarHBondContact O-N 2.94Å; S87-S91 PolarHBondContact O-OG 2.87Å
88	N	87.4	Confident	80	Confident	51 Å²	51	55.3 Å²	55.3	27%	0.273	32%	0.319	S	S	.	.	H	α-helix	trans	-76.4	-36.1	177.5	-64.9	-17.4	0	0	0	111.7	N45 D84 I85 V86 I90 S91 K92	N45-N88 PolarHBondContact ND2-ND2 2.98Å; D84-N88 HydrophobicContact CB-CB 4.15Å; D84-N88 WeakPolarHBondContact OD1-CB 3.37Å; D84-N88 PolarHBondContact OD1-ND2 3.25Å; D84-N88 WeakPolarHBondContact OD2-CB 3.13Å; I85-N88 WeakPolarHBondContact O-CA 3.24Å; I85-N88 WeakPolarHBondContact O-CB 3.21Å; I85-N88 PolarHBondContact O-N 3.42Å; V86-N88 VanDerWaalsContact C-N 3.29Å; V86-N88 PolarHBondContact O-N 3.14Å; N88-I90 VanDerWaalsContact C-N 3.33Å; N88-S91 WeakPolarHBondContact CA-OG 3.42Å; N88-S91 PolarHBondContact O-N 3.22Å; N88-S91 PolarHBondContact O-OG 3.2Å; N88-K92 VanDerWaalsContact O-CB 3.26Å; N88-K92 WeakPolarHBondContact O-CB 3.33Å; N88-K92 WeakPolarHBondContact O-CD 3.33Å; N88-K92 WeakPolarHBondContact O-CG 3.37Å; N88-K92 PolarHBondContact O-N 3Å
89	L	86.3	Confident	81.3	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-62.2	-42.6	172.7	-65.1	-177.7	0	0	0	111.3	C68 F73 D84 I85 V86 K92 G93 C94 I99	C68-L89 HydrophobicContact CB-CD1 4.29Å; C68-L89 HydrophobicContact CB-CD2 4.14Å; F73-L89 HydrophobicContact CE1-CD2 4.24Å; F73-L89 HydrophobicContact CZ-CD2 3.95Å; D84-L89 HydrophobicContact CB-CD2 3.55Å; D84-L89 HydrophobicContact CB-CG 3.89Å; I85-L89 PolarHBondContact O-N 3.22Å; I85-L89 VanDerWaalsContact O-N 3.1Å; V86-L89 PolarHBondContact O-N 3.3Å; L89-K92 PolarHBondContact O-N 3.1Å; L89-G93 PolarHBondContact O-N 3.27Å; L89-C94 HydrophobicContact CB-CB 4.17Å; L89-C94 VanDerWaalsContact O-CB 3.27Å; L89-C94 WeakPolarHBondContact O-CB 3.45Å; L89-C94 PolarHBondContact O-N 3.37Å; L89-I99 HydrophobicContact CB-CD1 3.85Å; L89-I99 HydrophobicContact CB-CG1 4.35Å; L89-I99 HydrophobicContact CD1-CD1 4.48Å; L89-I99 HydrophobicContact CD1-CG1 4.33Å; L89-I99 HydrophobicContact CD1-CG2 4.02Å
90	I	85.8	Confident	82.4	Confident	80 Å²	80	46.9 Å²	46.9	41%	0.41	28%	0.279	S	S	.	.	H	α-helix	trans	-65.8	-44.5	176.8	-64.9	167.9	0	0	0	111	V86 N88 K92 G93 V96 I99	V86-I90 HydrophobicContact CG1-CD1 3.97Å; V86-I90 WeakPolarHBondContact O-CG1 3.43Å; V86-I90 PolarHBondContact O-N 3.43Å; V86-I90 VanDerWaalsContact O-N 3.09Å; N88-I90 VanDerWaalsContact C-N 3.33Å; I90-K92 VanDerWaalsContact C-N 3.31Å; I90-K92 PolarHBondContact O-N 2.86Å; I90-G93 PolarHBondContact O-N 3.36Å; I90-V96 HydrophobicContact CD1-CG2 4.18Å; I90-V96 HydrophobicContact CG1-CG2 4.28Å; I90-I99 HydrophobicContact CD1-CD1 4.37Å; I90-I99 HydrophobicContact CG1-CD1 3.63Å
91	S	84.9	Confident	83.4	Confident	96 Å²	96	50.8 Å²	50.8	67%	0.671	29%	0.292	S	S	*	.	H	α-helix	trans	-70.3	-25.7	179.3	68.9	0	0	0	0	113.6	S87 N88 G93	S87-S91 WeakPolarHBondContact O-CB 3.29Å; S87-S91 PolarHBondContact O-N 2.94Å; S87-S91 PolarHBondContact O-OG 2.87Å; N88-S91 WeakPolarHBondContact CA-OG 3.42Å; N88-S91 PolarHBondContact O-N 3.22Å; N88-S91 PolarHBondContact O-OG 3.2Å; S91-G93 PolarHBondContact O-N 3.3Å
92	K	83	Confident	83.7	Confident	94 Å²	94	47.8 Å²	47.8	41%	0.409	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-4.4	167.5	-72.6	170.3	171.8	178.3	0	113.9	F73 D84 N88 L89 I90	F73-K92 HydrophobicContact CE2-CB 3.63Å; F73-K92 HydrophobicContact CZ-CB 3.71Å; F73-K92 HydrophobicContact CZ-CD 4.04Å; D84-K92 IonicContact OD2-NZ 3.39Å; D84-K92 PolarHBondContact OD2-NZ 3.14Å; N88-K92 VanDerWaalsContact O-CB 3.26Å; N88-K92 WeakPolarHBondContact O-CB 3.33Å; N88-K92 WeakPolarHBondContact O-CD 3.33Å; N88-K92 WeakPolarHBondContact O-CG 3.37Å; N88-K92 PolarHBondContact O-N 3Å; L89-K92 PolarHBondContact O-N 3.1Å; I90-K92 VanDerWaalsContact C-N 3.31Å; I90-K92 PolarHBondContact O-N 2.86Å
93	G	83.8	Confident	83.3	Confident	51 Å²	51	49.6 Å²	49.6	53%	0.526	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	93.9	13.9	175	0	0	0	0	0	116.3	L89 I90 S91 S95	L89-G93 PolarHBondContact O-N 3.27Å; I90-G93 PolarHBondContact O-N 3.36Å; S91-G93 PolarHBondContact O-N 3.3Å; G93-S95 PolarHBondContact O-N 3.36Å
94	C	85.5	Confident	83	Confident	5 Å²	5	52 Å²	52	3%	0.034	31%	0.309	C	S	.	.			trans	-71.4	127.4	170	-166	0	0	0	0	110.4	C68 F73 L89 I99	C68-C94 HydrophobicContact CB-CB 3.92Å; C68-C94 WeakPolarHBondContact CB-SG 3.38Å; C68-C94 WeakPolarHBondContact SG-CB 3.18Å; C68-C94 CovalentContact SG-SG 2.04Å; C68-C94 PolarHBondContact SG-SG 3.19Å; F73-C94 HydrophobicContact CD2-CB 3.84Å; F73-C94 HydrophobicContact CE2-CB 3.64Å; F73-C94 HydrophobicContact CZ-CB 4.33Å; L89-C94 HydrophobicContact CB-CB 4.17Å; L89-C94 VanDerWaalsContact O-CB 3.27Å; L89-C94 WeakPolarHBondContact O-CB 3.45Å; L89-C94 PolarHBondContact O-N 3.37Å; C94-I99 HydrophobicContact CB-CD1 4.34Å; C94-I99 HydrophobicContact CB-CG1 4.16Å; C94-I99 VanDerWaalsContact SG-CG1 3.59Å
95	S	84.8	Confident	82.8	Confident	53 Å²	53	56.2 Å²	56.2	37%	0.371	33%	0.329	S	S	.	.			trans	-62.5	135.4	173.8	-180	0	0	0	0	111	G93 D97 S98 I99	G93-S95 PolarHBondContact O-N 3.36Å; S95-D97 VanDerWaalsContact C-N 3.26Å; S95-D97 PolarHBondContact O-N 2.98Å; S95-S98 CarbonylContact O-C 3.57Å; S95-S98 WeakPolarHBondContact O-CA 3.45Å; S95-S98 WeakPolarHBondContact O-CB 3.16Å; S95-S98 PolarHBondContact O-N 3.06Å; S95-I99 PolarHBondContact O-N 3.14Å
96	V	82.9	Confident	82.7	Confident	98 Å²	98	56.3 Å²	56.3	59%	0.594	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-56.6	-39.1	-176.2	-178.2	0	0	0	0	111.9	I90 S98 I99	I90-V96 HydrophobicContact CD1-CG2 4.18Å; I90-V96 HydrophobicContact CG1-CG2 4.28Å; V96-S98 PolarHBondContact O-N 3.2Å; V96-I99 PolarHBondContact O-N 3.29Å
97	D	80.1	Confident	82.7	Confident	122 Å²	122	58.9 Å²	58.9	65%	0.652	34%	0.343	S	S	*	.	G	3₁₀ helix	trans	-66.7	-20.1	177.4	-65.8	-56.7	0	0	0	113.4	S95 K478	S95-D97 VanDerWaalsContact C-N 3.26Å; S95-D97 PolarHBondContact O-N 2.98Å; D97-K478 VanDerWaalsContact O-CE 3.26Å; D97-K478 WeakPolarHBondContact O-CE 3.19Å; D97-K478 PolarHBondContact O-NZ 3Å
98	S	81.7	Confident	82.5	Confident	36 Å²	36	59.3 Å²	59.3	25%	0.252	34%	0.339	S	S	.	.	G	3₁₀ helix	trans	-99.5	5.3	179.4	-60.6	0	0	0	0	113.6	V69 S95 V96	V69-S98 PolarHBondContact N-O 3.29Å; S95-S98 CarbonylContact O-C 3.57Å; S95-S98 WeakPolarHBondContact O-CA 3.45Å; S95-S98 WeakPolarHBondContact O-CB 3.16Å; S95-S98 PolarHBondContact O-N 3.06Å; V96-S98 PolarHBondContact O-N 3.2Å
99	I	84.9	Confident	82.1	Confident	14 Å²	14	59.4 Å²	59.4	7%	0.072	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	116.4	170	-61.3	173.1	0	0	0	108.7	W67 V86 L89 I90 C94 S95 V96 Y101	W67-I99 WeakPolarHBondContact O-CA 3.46Å; V86-I99 HydrophobicContact CG1-CD1 4.34Å; L89-I99 HydrophobicContact CB-CD1 3.85Å; L89-I99 HydrophobicContact CB-CG1 4.35Å; L89-I99 HydrophobicContact CD1-CD1 4.48Å; L89-I99 HydrophobicContact CD1-CG1 4.33Å; L89-I99 HydrophobicContact CD1-CG2 4.02Å; I90-I99 HydrophobicContact CD1-CD1 4.37Å; I90-I99 HydrophobicContact CG1-CD1 3.63Å; C94-I99 HydrophobicContact CB-CD1 4.34Å; C94-I99 HydrophobicContact CB-CG1 4.16Å; C94-I99 VanDerWaalsContact SG-CG1 3.59Å; S95-I99 PolarHBondContact O-N 3.14Å; V96-I99 PolarHBondContact O-N 3.29Å; I99-Y101 PolarHBondContact O-N 3.34Å
100	E	81.7	Confident	80.9	Confident	6 Å²	6	65.7 Å²	65.7	3%	0.028	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	107.2	164.7	-73.5	-71.1	141	0	0	108.4	W67 V69 C469 Q470	W67-E100 HydrophobicContact CB-CB 4.31Å; W67-E100 PolarHBondContact N-O 2.75Å; W67-E100 PolarHBondContact O-N 2.76Å; V69-E100 HydrophobicContact CG2-CB 4.43Å; V69-E100 HydrophobicContact CG2-CG 3.51Å; E100-C469 HydrophobicContact CG-CB 4.27Å; E100-Q470 PolarHBondContact OE2-N 3.14Å
101	Y	80.8	Confident	79.4	Confident	98 Å²	98	70.6 Å²	70.6	38%	0.384	40%	0.402	S	S	.	.			trans	-143.3	95.2	173.9	-178.4	-94.9	0	0	0	109	P63 V86 I99 S103 R128	P63-Y101 WeakPolarHBondContact O-CE2 3.49Å; P63-Y101 PolarHBondContact O-OH 3.36Å; V86-Y101 HydrophobicContact CG2-CD2 3.27Å; V86-Y101 HydrophobicContact CG2-CE2 3.58Å; V86-Y101 HydrophobicContact CG2-CG 3.86Å; I99-Y101 PolarHBondContact O-N 3.34Å; Y101-S103 PolarHBondContact O-N 3.14Å; Y101-R128 VanDerWaalsContact CD2-NH1 3.33Å
102	P	74.3	Confident	77.7	Confident	17 Å²	17	70.4 Å²	70.4	11%	0.11	39%	0.394	C	S	.	.			trans	-68.6	106.1	177.1	-21.7	34.8	0	0	0	110.7	L59 R128 N466	L59-P102 HydrophobicContact CD1-CG 3.78Å; P102-R128 WeakPolarHBondContact O-CD 3Å; P102-N466 HydrophobicContact CB-CB 4.21Å
103	S	70.4	Confident	76.4	Confident	54 Å²	54	74.3 Å²	74.3	38%	0.378	41%	0.413	S	S	.	.			trans	-64.8	141.1	174.5	-71.4	0	0	0	0	111.7	Y101 H105	Y101-S103 PolarHBondContact O-N 3.14Å; S103-H105 WeakPolarHBondContact CB-NE2 3.32Å
104	V	79.7	Confident	75.2	Confident	51 Å²	51	78.1 Å²	78.1	31%	0.309	42%	0.42	S	S	.	.			trans	-73.1	126.7	165.7	172.3	0	0	0	0	108.4	Q126 L127 A131 A133	V104-Q126 WeakPolarHBondContact CA-O 3.33Å; V104-L127 HydrophobicContact CG1-CD2 4.48Å; V104-A131 HydrophobicContact CG2-CB 3.56Å; V104-A133 HydrophobicContact CG1-CB 3.82Å
105	H	81	Confident	74.1	Confident	92 Å²	92	79.8 Å²	79.8	43%	0.426	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	133.8	177.4	-68.7	-58.2	0	0	0	110.5	S103 I125 Q126	S103-H105 WeakPolarHBondContact CB-NE2 3.32Å; H105-I125 CarbonylContact O-C 3.57Å; H105-I125 WeakPolarHBondContact O-CA 3.44Å; H105-Q126 HydrophobicContact CB-CB 4.34Å; H105-Q126 HydrophobicContact CB-CG 4.41Å; H105-Q126 PolarHBondContact N-O 2.67Å; H105-Q126 PolarHBondContact O-N 2.98Å
106	V	85.6	Confident	73.5	Confident	56 Å²	56	82.2 Å²	82.2	34%	0.339	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	110.3	171	177.7	0	0	0	0	106.8	I108 V123 I125 A133 F135	V106-I108 HydrophobicContact CG1-CG1 4.4Å; V106-V123 HydrophobicContact CG1-CG1 3.95Å; V106-I125 HydrophobicContact CG1-CG2 4.36Å; V106-I125 HydrophobicContact CG2-CG2 4.12Å; V106-A133 HydrophobicContact CG2-CB 3.88Å; V106-F135 HydrophobicContact CG1-CB 4.1Å
107	I	85.9	Confident	73.4	Confident	89 Å²	89	78 Å²	78	46%	0.456	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	115.4	-179	-59	171.5	0	0	0	107.3	S124	I107-S124 PolarHBondContact N-O 3.42Å; I107-S124 PolarHBondContact O-N 3.38Å
108	I	83.1	Confident	73.7	Confident	82 Å²	82	72.1 Å²	72.1	42%	0.421	38%	0.384	S	S	.	.			trans	-103.2	115.4	172.7	-63.2	172.1	0	0	0	106.8	V106 T110 P120 V123	V106-I108 HydrophobicContact CG1-CG1 4.4Å; I108-T110 PolarHBondContact O-N 3.16Å; I108-P120 HydrophobicContact CD1-CG 4.25Å; I108-P120 HydrophobicContact CG1-CG 4.35Å; I108-P120 HydrophobicContact CG2-CB 3.57Å; I108-P120 HydrophobicContact CG2-CG 4.05Å; I108-V123 HydrophobicContact CG1-CG1 4.39Å
109	P	77.1	Confident	74	Confident	53 Å²	53	73.3 Å²	73.3	34%	0.344	39%	0.39	S	S	.	.			trans	-65.6	124	178.5	-20.3	33.5	0	0	0	111.3	E111 E122	P109-E111 VanDerWaalsContact C-N 3.34Å; P109-E122 VanDerWaalsContact CD-O 3.25Å; P109-E122 WeakPolarHBondContact CD-O 3.49Å
110	T	63	Low	74.3	Confident	133 Å²	133	73.3 Å²	73.3	82%	0.816	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-13.5	-180	32.1	0	0	0	0	114.7	I108	I108-T110 PolarHBondContact O-N 3.16Å
111	E	53.3	Low	74.5	Confident	182 Å²	182	74 Å²	74	85%	0.85	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.7	8.5	-167.6	-61.4	-169.2	139.5	0	0	115.2	P109	P109-E111 VanDerWaalsContact C-N 3.34Å
112	N	49.4	Very low	74.9	Confident	93 Å²	93	72 Å²	72	50%	0.497	39%	0.393	S	S	.	.			trans	-127.4	57.2	-179.1	-85.3	-43.2	0	0	0	113.4	I114	N112-I114 PolarHBondContact O-N 2.02Å; N112-I114 WeakPolarHBondContact OD1-CD1 3.18Å
113	E	55.5	Low	75.8	Confident	176 Å²	176	71.2 Å²	71.2	82%	0.822	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	42.9	163.2	-65.6	-163.2	147.2	0	0	112.6	N115	E113-N115 VanDerWaalsContact C-N 3.35Å
114	I	58.3	Low	76.8	Confident	130 Å²	130	70 Å²	70	67%	0.667	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.2	-28	171.8	-57.5	175.8	0	0	0	110	N112	N112-I114 PolarHBondContact O-N 2.02Å; N112-I114 WeakPolarHBondContact OD1-CD1 3.18Å
115	N	62.6	Low	77.3	Confident	41 Å²	41	67.6 Å²	67.6	22%	0.219	37%	0.365	C	S	.	.			trans	-83	120.4	177.9	-81.5	20.4	0	0	0	111.7	E113 V118 G121 E457 T458	E113-N115 VanDerWaalsContact C-N 3.35Å; N115-V118 VanDerWaalsContact CB-O 3.24Å; N115-V118 WeakPolarHBondContact CB-O 3.04Å; N115-V118 PolarHBondContact ND2-O 3.25Å; N115-G121 WeakPolarHBondContact ND2-CA 3.26Å; N115-E457 VanDerWaalsContact CA-OE2 3.24Å; N115-E457 WeakPolarHBondContact CA-OE2 3.33Å; N115-E457 HydrophobicContact CB-CG 4.48Å; N115-E457 WeakPolarHBondContact CB-OE2 3.46Å; N115-T458 PolarHBondContact ND2-O 2.74Å
116	T	71.8	Confident	77.7	Confident	103 Å²	103	66 Å²	66	63%	0.632	36%	0.358	S	S	*	.	S	Bend	trans	-99.7	-15.3	-179.5	61.8	0	0	0	0	114	E457	T116-E457 VanDerWaalsContact N-CD 3.26Å; T116-E457 PolarHBondContact N-OE1 3.37Å; T116-E457 PolarHBondContact N-OE2 3.32Å; T116-E457 PolarHBondContact OG1-OE1 2.65Å
117	Q	80.4	Confident	77.6	Confident	9 Å²	9	63.3 Å²	63.3	4%	0.042	34%	0.341	C	S	.	.	S	Bend	trans	-117.5	-26	-174.4	-61	179.3	-124.9	0	0	113.1	I139 H140 L142 F455 N456 E457	Q117-I139 CarbonylContact O-C 3.59Å; Q117-I139 VanDerWaalsContact O-CA 3.29Å; Q117-I139 WeakPolarHBondContact O-CA 3.27Å; Q117-H140 PolarHBondContact O-N 3.05Å; Q117-L142 HydrophobicContact CG-CD2 4.04Å; Q117-L142 HydrophobicContact CG-CG 4.13Å; Q117-F455 HydrophobicContact CB-CD1 4.14Å; Q117-F455 HydrophobicContact CB-CE1 4.42Å; Q117-F455 VanDerWaalsContact NE2-CD1 3.29Å; Q117-N456 PolarHBondContact OE1-OD1 3.46Å; Q117-E457 WeakPolarHBondContact CA-OE2 3.2Å; Q117-E457 WeakPolarHBondContact CB-OE2 3.03Å; Q117-E457 VanDerWaalsContact N-CD 3.34Å; Q117-E457 PolarHBondContact N-OE1 2.89Å; Q117-E457 PolarHBondContact N-OE2 3.42Å
118	V	87.6	Confident	77.4	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	101	-173.4	-176.5	0	0	0	0	110.8	N115 P120 L137 K138 P452 F455 E457 A459	N115-V118 VanDerWaalsContact CB-O 3.24Å; N115-V118 WeakPolarHBondContact CB-O 3.04Å; N115-V118 PolarHBondContact ND2-O 3.25Å; V118-P120 CarbonylContact O-C 3.56Å; V118-L137 HydrophobicContact CG1-CD1 3.83Å; V118-K138 WeakPolarHBondContact CA-O 3.18Å; V118-P452 HydrophobicContact CG1-CG 4.4Å; V118-P452 HydrophobicContact CG2-CG 3.47Å; V118-P452 VanDerWaalsContact CG2-CG 3.47Å; V118-F455 HydrophobicContact CG2-CD1 4.34Å; V118-E457 HydrophobicContact CB-CB 3.88Å; V118-E457 HydrophobicContact CG2-CB 3.72Å; V118-E457 PolarHBondContact N-OE2 3.2Å; V118-A459 HydrophobicContact CG1-CB 4.12Å
119	T	88.3	Confident	77.1	Confident	60 Å²	60	55.9 Å²	55.9	37%	0.368	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	125.7	-170.9	-42.1	0	0	0	0	110.9	K138	T119-K138 PolarHBondContact N-O 3.33Å; T119-K138 WeakPolarHBondContact O-CB 2.98Å; T119-K138 PolarHBondContact O-N 3.4Å
120	P	89.9	Confident	77	Confident	15 Å²	15	55.3 Å²	55.3	10%	0.097	31%	0.308	C	S	.	.			cis	-76.4	150.7	-2.9	32.9	-37.2	0	0	0	113.3	I108 V118 V123 A459	I108-P120 HydrophobicContact CD1-CG 4.25Å; I108-P120 HydrophobicContact CG1-CG 4.35Å; I108-P120 HydrophobicContact CG2-CB 3.57Å; I108-P120 HydrophobicContact CG2-CG 4.05Å; V118-P120 CarbonylContact O-C 3.56Å; P120-V123 HydrophobicContact CB-CG2 4.25Å; P120-V123 HydrophobicContact CG-CG2 3.46Å; P120-V123 VanDerWaalsContact CG-CG2 3.46Å; P120-A459 WeakPolarHBondContact O-CB 3.1Å
121	G	86	Confident	77.8	Confident	19 Å²	19	49.3 Å²	49.3	20%	0.196	27%	0.271	C	S	.	.	S	Bend	trans	-78.2	-23.3	174.7	0	0	0	0	0	114.5	N115 A459 K460	N115-G121 WeakPolarHBondContact ND2-CA 3.26Å; G121-A459 WeakPolarHBondContact O-CA 3.48Å; G121-K460 PolarHBondContact O-N 3.28Å
122	E	90.6	Very high	79.5	Confident	58 Å²	58	46.5 Å²	46.5	27%	0.271	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	140.9	176.5	-165.4	156.8	-126.2	0	0	110.2	P109 K460 H462	P109-E122 VanDerWaalsContact CD-O 3.25Å; P109-E122 WeakPolarHBondContact CD-O 3.49Å; E122-K460 CarbonylContact C-O 3.53Å; E122-K460 WeakPolarHBondContact CA-O 3.42Å; E122-K460 WeakPolarHBondContact OE1-CE 3.36Å; E122-K460 IonicContact OE1-NZ 3.67Å; E122-K460 PolarHBondContact OE1-NZ 3.05Å; E122-H462 WeakPolarHBondContact CG-NE2 3.48Å; E122-H462 IonicContact OE1-CD2 2.69Å; E122-H462 PolarHBondContact OE1-CD2 3.09Å; E122-H462 CovalentContact OE1-NE2 1.78Å; E122-H462 IonicContact OE1-NE2 3.43Å; E122-H462 PolarHBondContact OE1-NE2 2.7Å; E122-H462 IonicContact OE2-NE2 2.92Å
123	V	91.6	Very high	81.4	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	130.3	179.8	-174.2	0	0	0	0	108.6	V106 I108 P120 I125 F135 K460 I461 H462	V106-V123 HydrophobicContact CG1-CG1 3.95Å; I108-V123 HydrophobicContact CG1-CG1 4.39Å; P120-V123 HydrophobicContact CB-CG2 4.25Å; P120-V123 HydrophobicContact CG-CG2 3.46Å; P120-V123 VanDerWaalsContact CG-CG2 3.46Å; V123-I125 HydrophobicContact CG1-CG2 3.88Å; V123-F135 HydrophobicContact CG1-CD1 4.31Å; V123-F135 HydrophobicContact CG1-CG 4.34Å; V123-F135 HydrophobicContact CG2-CD2 4.09Å; V123-F135 HydrophobicContact CG2-CE2 4.02Å; V123-F135 HydrophobicContact CG2-CZ 4.46Å; V123-K460 PolarHBondContact N-O 3.23Å; V123-I461 CarbonylContact O-C 3.58Å; V123-I461 VanDerWaalsContact O-CA 3.31Å; V123-I461 WeakPolarHBondContact O-CA 3.5Å; V123-H462 PolarHBondContact O-N 2.93Å
124	S	91.9	Very high	83.2	Confident	28 Å²	28	38.8 Å²	38.8	20%	0.196	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	115.2	174.2	-67.3	0	0	0	0	109.9	I107	I107-S124 PolarHBondContact N-O 3.42Å; I107-S124 PolarHBondContact O-N 3.38Å
125	I	91.2	Very high	84.8	Confident	0 Å²	0	33 Å²	33	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	137.8	178.6	68.5	177.4	0	0	0	111.3	H105 V106 V123 L127 A133 V434 I461 H462 I463 H464	H105-I125 CarbonylContact O-C 3.57Å; H105-I125 WeakPolarHBondContact O-CA 3.44Å; V106-I125 HydrophobicContact CG1-CG2 4.36Å; V106-I125 HydrophobicContact CG2-CG2 4.12Å; V123-I125 HydrophobicContact CG1-CG2 3.88Å; I125-L127 HydrophobicContact CD1-CD1 3.79Å; I125-L127 HydrophobicContact CD1-CG 4.19Å; I125-L127 HydrophobicContact CG1-CD1 4.45Å; I125-L127 HydrophobicContact CG1-CG 4.45Å; I125-A133 HydrophobicContact CB-CB 4.35Å; I125-A133 HydrophobicContact CD1-CB 4.49Å; I125-A133 HydrophobicContact CG2-CB 4.38Å; I125-V434 HydrophobicContact CD1-CB 3.74Å; I125-V434 HydrophobicContact CD1-CG1 3.66Å; I125-V434 HydrophobicContact CD1-CG2 4.01Å; I125-I461 HydrophobicContact CD1-CG2 3.94Å; I125-I461 HydrophobicContact CG1-CG2 4.09Å; I125-I461 HydrophobicContact CG2-CG2 4.3Å; I125-H462 WeakPolarHBondContact CG1-O 3.47Å; I125-H462 PolarHBondContact N-O 2.03Å; I125-I463 HydrophobicContact CD1-CG1 4.18Å; I125-I463 HydrophobicContact CD1-CG2 4.22Å; I125-I463 HydrophobicContact CG1-CB 4.35Å; I125-I463 HydrophobicContact CG1-CG1 4.21Å; I125-I463 HydrophobicContact CG1-CG2 4.15Å; I125-H464 PolarHBondContact O-N 3.43Å
126	Q	88	Confident	86.2	Confident	59 Å²	59	34.8 Å²	34.8	28%	0.276	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	119.1	169.3	-58.5	-172.6	6	0	0	108.6	V104 H105 H464 N466	V104-Q126 WeakPolarHBondContact CA-O 3.33Å; H105-Q126 HydrophobicContact CB-CB 4.34Å; H105-Q126 HydrophobicContact CB-CG 4.41Å; H105-Q126 PolarHBondContact N-O 2.67Å; H105-Q126 PolarHBondContact O-N 2.98Å; Q126-H464 WeakPolarHBondContact CA-O 3.4Å; Q126-H464 HydrophobicContact CG-CB 4.16Å; Q126-N466 PolarHBondContact OE1-ND2 3.27Å
127	L	84.6	Confident	87.2	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	138.9	-177	-74.9	174.8	0	0	0	111.5	V104 I125 A133 V434 M436 I463 H464 N466	V104-L127 HydrophobicContact CG1-CD2 4.48Å; I125-L127 HydrophobicContact CD1-CD1 3.79Å; I125-L127 HydrophobicContact CD1-CG 4.19Å; I125-L127 HydrophobicContact CG1-CD1 4.45Å; I125-L127 HydrophobicContact CG1-CG 4.45Å; L127-A133 HydrophobicContact CD2-CB 3.63Å; L127-A133 HydrophobicContact CG-CB 4.44Å; L127-V434 HydrophobicContact CD1-CB 4.48Å; L127-V434 HydrophobicContact CD1-CG1 4.04Å; L127-M436 HydrophobicContact CB-CB 4.4Å; L127-M436 HydrophobicContact CB-CE 4.2Å; L127-M436 HydrophobicContact CD1-CB 4.29Å; L127-M436 WeakPolarHBondContact O-CE 3.49Å; L127-I463 HydrophobicContact CD1-CG2 4.18Å; L127-H464 PolarHBondContact N-O 2.83Å; L127-N466 PolarHBondContact O-N 2.99Å
128	R	80.5	Confident	87.7	Confident	5 Å²	5	33.6 Å²	33.6	2%	0.019	19%	0.187	C	C	.	.			trans	-108.3	163	165.1	64.9	175.7	-85.2	-172.7	-2.8	110.3	L59 G62 P63 C65 Y101 P102 A131 M436	L59-R128 PolarHBondContact O-NH2 3.11Å; G62-R128 PolarHBondContact O-NH2 2.92Å; P63-R128 VanDerWaalsContact O-CZ 3.3Å; P63-R128 PolarHBondContact O-NH1 3.42Å; P63-R128 VanDerWaalsContact O-NH1 3.08Å; P63-R128 PolarHBondContact O-NH2 3.19Å; C65-R128 PolarHBondContact O-NH1 2.03Å; C65-R128 VanDerWaalsContact O-NH1 3.14Å; C65-R128 PolarHBondContact O-NH2 2.96Å; Y101-R128 VanDerWaalsContact CD2-NH1 3.33Å; P102-R128 WeakPolarHBondContact O-CD 3Å; R128-A131 HydrophobicContact CG-CB 3.62Å; R128-A131 PolarHBondContact O-N 2.83Å; R128-M436 VanDerWaalsContact C-CE 3.48Å
129	P	77.8	Confident	87.8	Confident	9 Å²	9	33.6 Å²	33.6	6%	0.058	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.9	143.4	172.8	-27.6	36.5	0	0	0	112.9	A60 A131 M436 C439	A60-P129 HydrophobicContact CB-CB 4.39Å; P129-A131 PolarHBondContact O-N 2.72Å; P129-A131 VanDerWaalsContact O-N 3.1Å; P129-M436 HydrophobicContact CG-CE 4.47Å; P129-C439 HydrophobicContact CG-CB 4.23Å; P129-C439 WeakPolarHBondContact CG-SG 3.37Å
130	G	74.3	Confident	87.7	Confident	42 Å²	42	34.4 Å²	34.4	43%	0.433	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.9	-10.2	177.8	0	0	0	0	0	115.1	M436	G130-M436 PolarHBondContact N-O 3.41Å
131	A	80.4	Confident	87.3	Confident	6 Å²	6	33.9 Å²	33.9	5%	0.05	18%	0.182	C	C	.	.			trans	-96.5	156.3	-176	0	0	0	0	0	113.5	P63 V104 R128 P129	P63-A131 HydrophobicContact CB-CB 4.01Å; V104-A131 HydrophobicContact CG2-CB 3.56Å; R128-A131 HydrophobicContact CG-CB 3.62Å; R128-A131 PolarHBondContact O-N 2.83Å; P129-A131 PolarHBondContact O-N 2.72Å; P129-A131 VanDerWaalsContact O-N 3.1Å
132	E	87.6	Confident	86.8	Confident	124 Å²	124	35.7 Å²	35.7	58%	0.579	19%	0.188	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-118	137.3	177.2	-49.5	-159.6	148.6	0	0	110.8	T433 V434 T435	E132-T433 HydrophobicContact CB-CG2 3.95Å; E132-T433 HydrophobicContact CG-CG2 4.44Å; E132-T433 WeakPolarHBondContact OE2-CG2 3.44Å; E132-V434 WeakPolarHBondContact CA-O 3.37Å; E132-T435 HydrophobicContact CB-CG2 4.04Å; E132-T435 HydrophobicContact CG-CG2 3.6Å; E132-T435 VanDerWaalsContact OE1-CG2 3.32Å; E132-T435 WeakPolarHBondContact OE1-CG2 3.43Å
133	A	90.4	Very high	85.8	Confident	1 Å²	1	39.5 Å²	39.5	1%	0.008	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	136.9	166.9	0	0	0	0	0	109.1	V104 V106 I125 L127 T433 V434	V104-A133 HydrophobicContact CG1-CB 3.82Å; V106-A133 HydrophobicContact CG2-CB 3.88Å; I125-A133 HydrophobicContact CB-CB 4.35Å; I125-A133 HydrophobicContact CD1-CB 4.49Å; I125-A133 HydrophobicContact CG2-CB 4.38Å; L127-A133 HydrophobicContact CD2-CB 3.63Å; L127-A133 HydrophobicContact CG-CB 4.44Å; A133-T433 CarbonylContact O-C 3.56Å; A133-T433 WeakPolarHBondContact O-CA 3.41Å; A133-V434 PolarHBondContact N-O 3.38Å; A133-V434 PolarHBondContact O-N 3.4Å
134	N	92.8	Very high	85	Confident	106 Å²	106	43 Å²	43	57%	0.567	22%	0.218	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-121.3	146.6	174.4	57.7	67.1	0	0	0	111.6	V432	N134-V432 WeakPolarHBondContact CA-O 3.4Å
135	F	92.9	Very high	84.3	Confident	9 Å²	9	41.8 Å²	41.8	4%	0.039	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	154.6	170	68.3	-86.8	0	0	0	111.4	V106 V123 L137 V432 V434 I450 I461	V106-F135 HydrophobicContact CG1-CB 4.1Å; V123-F135 HydrophobicContact CG1-CD1 4.31Å; V123-F135 HydrophobicContact CG1-CG 4.34Å; V123-F135 HydrophobicContact CG2-CD2 4.09Å; V123-F135 HydrophobicContact CG2-CE2 4.02Å; V123-F135 HydrophobicContact CG2-CZ 4.46Å; F135-L137 HydrophobicContact CE2-CB 4.26Å; F135-V432 HydrophobicContact CD1-CB 4.09Å; F135-V432 HydrophobicContact CD1-CG1 4.28Å; F135-V432 HydrophobicContact CD2-CB 4.38Å; F135-V432 HydrophobicContact CE1-CB 3.71Å; F135-V432 HydrophobicContact CE1-CG1 3.5Å; F135-V432 HydrophobicContact CE2-CB 4.01Å; F135-V432 HydrophobicContact CE2-CG1 4.41Å; F135-V432 HydrophobicContact CE2-CG2 4.06Å; F135-V432 HydrophobicContact CG-CB 4.41Å; F135-V432 HydrophobicContact CZ-CB 3.66Å; F135-V432 HydrophobicContact CZ-CG1 3.58Å; F135-V432 HydrophobicContact CZ-CG2 4.01Å; F135-V432 PolarHBondContact N-O 3.45Å; F135-V432 PolarHBondContact O-N 2.99Å; F135-V434 HydrophobicContact CE1-CG2 4.09Å; F135-I450 HydrophobicContact CZ-CD1 4.19Å; F135-I461 HydrophobicContact CE1-CG1 4.13Å; F135-I461 HydrophobicContact CZ-CD1 4.28Å; F135-I461 HydrophobicContact CZ-CG1 3.67Å
136	M	91.9	Very high	84	Confident	78 Å²	78	43.1 Å²	43.1	38%	0.384	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	122.2	175.3	-66.1	-55.8	-52.5	0	0	110.2	I406 L429 N431	M136-I406 HydrophobicContact CE-CD1 4.19Å; M136-L429 HydrophobicContact CE-CB 3.75Å; M136-N431 HydrophobicContact CE-CB 4.19Å; M136-N431 HydrophobicContact SD-CB 3.72Å
137	L	92.1	Very high	84	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	121.1	170.4	179.2	63.9	0	0	0	109.6	V118 F135 I139 F430 V432 I450 A459	V118-L137 HydrophobicContact CG1-CD1 3.83Å; F135-L137 HydrophobicContact CE2-CB 4.26Å; L137-I139 HydrophobicContact CD2-CD1 4.29Å; L137-I139 HydrophobicContact CG-CG1 4.3Å; L137-F430 HydrophobicContact CB-CB 4.27Å; L137-F430 PolarHBondContact N-O 3.33Å; L137-F430 PolarHBondContact O-N 3.27Å; L137-V432 HydrophobicContact CB-CG2 4.36Å; L137-I450 HydrophobicContact CD2-CB 4.27Å; L137-I450 HydrophobicContact CD2-CG2 3.57Å; L137-A459 HydrophobicContact CD1-CB 3.61Å; L137-A459 HydrophobicContact CD2-CB 4.11Å
138	K	91.1	Very high	84.3	Confident	87 Å²	87	40.3 Å²	40.3	38%	0.378	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	137.2	174.9	-57.3	-169.6	152.4	-135.1	0	110.4	V118 T119 E427 L429	V118-K138 WeakPolarHBondContact CA-O 3.18Å; T119-K138 PolarHBondContact N-O 3.33Å; T119-K138 WeakPolarHBondContact O-CB 2.98Å; T119-K138 PolarHBondContact O-N 3.4Å; K138-E427 WeakPolarHBondContact CD-OE2 3.5Å; K138-E427 IonicContact NZ-OE1 3.94Å; K138-E427 PolarHBondContact NZ-OE1 2.92Å; K138-E427 IonicContact NZ-OE2 2.69Å; K138-E427 PolarHBondContact NZ-OE2 3.31Å; K138-L429 HydrophobicContact CB-CD2 4.3Å; K138-L429 HydrophobicContact CD-CD2 4.36Å; K138-L429 HydrophobicContact CG-CD2 3.69Å
139	I	89.9	Confident	85	Confident	0 Å²	0	40 Å²	40	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	120.5	175.3	-56.5	-178.9	0	0	0	109.9	Q117 L137 V388 V390 V428 F430 P452 F455	Q117-I139 CarbonylContact O-C 3.59Å; Q117-I139 VanDerWaalsContact O-CA 3.29Å; Q117-I139 WeakPolarHBondContact O-CA 3.27Å; L137-I139 HydrophobicContact CD2-CD1 4.29Å; L137-I139 HydrophobicContact CG-CG1 4.3Å; I139-V388 HydrophobicContact CB-CG1 4.2Å; I139-V388 HydrophobicContact CG2-CG1 3.77Å; I139-V390 HydrophobicContact CD1-CG1 3.43Å; I139-V390 VanDerWaalsContact CD1-CG1 3.43Å; I139-V428 PolarHBondContact N-O 3.06Å; I139-V428 PolarHBondContact O-N 2.88Å; I139-F430 HydrophobicContact CD1-CD2 3.72Å; I139-F430 HydrophobicContact CD1-CE2 3.63Å; I139-F430 HydrophobicContact CG1-CD2 4.19Å; I139-F430 HydrophobicContact CG1-CE2 4.29Å; I139-P452 HydrophobicContact CD1-CB 3.98Å; I139-P452 HydrophobicContact CD1-CG 3.94Å; I139-P452 HydrophobicContact CG2-CB 4.41Å; I139-F455 HydrophobicContact CG2-CD1 4.21Å; I139-F455 HydrophobicContact CG2-CE1 3.43Å; I139-F455 VanDerWaalsContact CG2-CE1 3.43Å; I139-F455 HydrophobicContact CG2-CE2 4.49Å; I139-F455 HydrophobicContact CG2-CZ 3.59Å
140	H	86.6	Confident	85.8	Confident	77 Å²	77	39.6 Å²	39.6	36%	0.356	20%	0.201	S	C	.	.			trans	-108.3	115.5	180	-171.2	73.2	0	0	0	111	Q117	Q117-H140 PolarHBondContact O-N 3.05Å
141	P	81.3	Confident	86.8	Confident	3 Å²	3	37.6 Å²	37.6	2%	0.019	18%	0.18	C	C	.	.			trans	-83.4	128.7	-177	26.5	-24.8	0	0	0	113	Y145 V388 V422 S424 H426 F455	P141-Y145 WeakPolarHBondContact CA-OH 2.87Å; P141-V388 HydrophobicContact CB-CG2 4.38Å; P141-V388 HydrophobicContact CG-CG2 4.39Å; P141-V422 HydrophobicContact CG-CG1 3.87Å; P141-S424 WeakPolarHBondContact O-CA 3.19Å; P141-S424 WeakPolarHBondContact O-CB 3.35Å; P141-H426 VanDerWaalsContact CD-O 3.25Å; P141-H426 WeakPolarHBondContact CD-O 3.38Å; P141-F455 HydrophobicContact CB-CZ 4.39Å
142	L	74.3	Confident	87.6	Confident	58 Å²	58	37.3 Å²	37.3	30%	0.304	18%	0.178	S	C	.	.			trans	-66.6	150.7	-178.2	-67	179.2	0	0	0	113.5	Q117 K144 Y145	Q117-L142 HydrophobicContact CG-CD2 4.04Å; Q117-L142 HydrophobicContact CG-CG 4.13Å; L142-K144 VanDerWaalsContact C-N 3.31Å; L142-K144 PolarHBondContact O-N 3.3Å; L142-Y145 HydrophobicContact CB-CD2 4.07Å; L142-Y145 HydrophobicContact CB-CE1 4.42Å; L142-Y145 HydrophobicContact CB-CE2 3.74Å; L142-Y145 HydrophobicContact CD1-CE1 4.41Å; L142-Y145 PolarHBondContact N-OH 2.99Å; L142-Y145 VanDerWaalsContact N-OH 3.15Å; L142-Y145 WeakPolarHBondContact O-CE2 3.44Å
143	K	69.9	Low	87.9	Confident	138 Å²	138	31.5 Å²	31.5	60%	0.6	15%	0.151	S	C	*	.	S	Bend	trans	-68.2	-25.5	173.5	-80.6	169.8	-178.5	168.5	0	114.4	S424 N425	K143-S424 WeakPolarHBondContact CE-O 3.3Å; K143-S424 WeakPolarHBondContact CG-OG 3.38Å; K143-N425 WeakPolarHBondContact CE-OD1 3.42Å; K143-N425 PolarHBondContact NZ-OD1 3.08Å
144	K	74.9	Confident	88.1	Confident	72 Å²	72	31.4 Å²	31.4	31%	0.313	15%	0.15	S	C	.	.	S	Bend	trans	-149.9	100.5	-179.9	-69.3	-161.3	160.6	-148.9	0	109.3	L142 A178 F179 S181 R182	L142-K144 VanDerWaalsContact C-N 3.31Å; L142-K144 PolarHBondContact O-N 3.3Å; K144-A178 PolarHBondContact NZ-O 3.44Å; K144-F179 WeakPolarHBondContact CE-O 3.02Å; K144-F179 PolarHBondContact NZ-O 2.83Å; K144-S181 PolarHBondContact NZ-O 2.93Å; K144-R182 HydrophobicContact CD-CB 4.42Å; K144-R182 HydrophobicContact CD-CG 3.83Å
145	Y	76.8	Confident	88.2	Confident	4 Å²	4	26.4 Å²	26.4	2%	0.016	12%	0.123	C	C	.	.			trans	-77	150.6	171.3	-77.4	-93.4	0	0	0	110.9	P141 L142 S181 K277 I385 F455	P141-Y145 WeakPolarHBondContact CA-OH 2.87Å; L142-Y145 HydrophobicContact CB-CD2 4.07Å; L142-Y145 HydrophobicContact CB-CE1 4.42Å; L142-Y145 HydrophobicContact CB-CE2 3.74Å; L142-Y145 HydrophobicContact CD1-CE1 4.41Å; L142-Y145 PolarHBondContact N-OH 2.99Å; L142-Y145 VanDerWaalsContact N-OH 3.15Å; L142-Y145 WeakPolarHBondContact O-CE2 3.44Å; Y145-S181 WeakPolarHBondContact O-CB 3.38Å; Y145-S181 PolarHBondContact O-OG 3.04Å; Y145-K277 HydrophobicContact CD1-CD 4.49Å; Y145-K277 HydrophobicContact CD1-CG 4.17Å; Y145-K277 HydrophobicContact CG-CG 4Å; Y145-I385 HydrophobicContact CD2-CG2 4.06Å; Y145-F455 HydrophobicContact CE1-CD1 4.5Å; Y145-F455 HydrophobicContact CE1-CD2 4.44Å; Y145-F455 HydrophobicContact CE1-CG 4.42Å; Y145-F455 WeakPolarHBondContact OH-CE1 3.04Å; Y145-F455 WeakPolarHBondContact OH-CZ 3.42Å
146	P	85.8	Confident	88.1	Confident	27 Å²	27	26 Å²	26	18%	0.175	12%	0.122	C	C	.	.			trans	-59.1	140.9	157.9	-18.1	32.1	0	0	0	109.7	D183 A276 K277	P146-D183 WeakPolarHBondContact CA-O 3.06Å; P146-D183 HydrophobicContact CB-CB 4.24Å; P146-A276 HydrophobicContact CB-CB 3.97Å; P146-A276 CarbonylContact O-C 3.59Å; P146-A276 WeakPolarHBondContact O-CA 3.28Å; P146-K277 PolarHBondContact O-N 3.39Å
147	V	87.9	Confident	88	Confident	0 Å²	0	24.6 Å²	24.6	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	128.2	-177.6	-178.8	0	0	0	0	110.1	M177 D183 F184 R185 L279 Y381	V147-M177 HydrophobicContact CG1-CE 4.02Å; V147-M177 HydrophobicContact CG2-CE 4.47Å; V147-D183 PolarHBondContact N-O 3.31Å; V147-F184 HydrophobicContact CB-CD2 4Å; V147-F184 HydrophobicContact CG1-CD2 4.04Å; V147-F184 HydrophobicContact CG1-CE2 4.15Å; V147-F184 WeakPolarHBondContact O-CA 3.16Å; V147-R185 PolarHBondContact O-N 3.27Å; V147-L279 HydrophobicContact CG1-CD1 3.92Å; V147-L279 HydrophobicContact CG1-CG 4.48Å; V147-Y381 HydrophobicContact CG1-CE2 4.47Å; V147-Y381 HydrophobicContact CG2-CD2 4.04Å; V147-Y381 HydrophobicContact CG2-CE1 4.34Å; V147-Y381 HydrophobicContact CG2-CE2 3.25Å; V147-Y381 VanDerWaalsContact CG2-CZ 3.43Å; V147-Y381 WeakPolarHBondContact CG2-OH 3.48Å
148	D	92.1	Very high	87.8	Confident	0 Å²	0	27 Å²	27	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	120.6	170.6	-69.7	-6.9	0	0	0	107.4	L230 W272 R273 A276 K277 L279	D148-L230 HydrophobicContact CB-CD1 3.89Å; D148-L230 HydrophobicContact CB-CD2 3.92Å; D148-W272 HydrophobicContact CB-CE3 3.66Å; D148-W272 HydrophobicContact CB-CZ3 3.67Å; D148-R273 IonicContact OD1-CZ 2.9Å; D148-R273 VanDerWaalsContact OD1-CZ 3.22Å; D148-R273 IonicContact OD1-NE 3.8Å; D148-R273 PolarHBondContact OD1-NE 3.06Å; D148-R273 IonicContact OD1-NH2 2.6Å; D148-R273 PolarHBondContact OD1-NH2 3Å; D148-R273 WeakPolarHBondContact OD2-CB 3.25Å; D148-R273 PolarHBondContact OD2-N 3.35Å; D148-R273 IonicContact OD2-NE 2.69Å; D148-A276 HydrophobicContact CB-CB 4.38Å; D148-K277 PolarHBondContact N-O 3.41Å; D148-K277 VanDerWaalsContact N-O 3.07Å; D148-L279 PolarHBondContact O-N 2.92Å
149	L	93.7	Very high	87.6	Confident	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	112.5	177.9	178.4	67.8	0	0	0	110.1	Y151 L173 F184 R185 L186 G187 L279 L281 V377	L149-Y151 HydrophobicContact CD2-CD2 4.34Å; L149-Y151 HydrophobicContact CD2-CE2 3.73Å; L149-Y151 HydrophobicContact CG-CD2 4.35Å; L149-Y151 HydrophobicContact CG-CE2 4.23Å; L149-L173 HydrophobicContact CD2-CD2 3.43Å; L149-L173 VanDerWaalsContact CD2-CD2 3.43Å; L149-F184 HydrophobicContact CB-CE2 3.72Å; L149-F184 HydrophobicContact CB-CZ 4.05Å; L149-F184 HydrophobicContact CD2-CE2 4.17Å; L149-F184 HydrophobicContact CD2-CZ 3.85Å; L149-R185 PolarHBondContact N-O 2.91Å; L149-L186 HydrophobicContact CB-CD2 4.32Å; L149-L186 HydrophobicContact CD2-CD2 4.03Å; L149-L186 HydrophobicContact CG-CD2 4.42Å; L149-L186 WeakPolarHBondContact O-CA 3.04Å; L149-G187 PolarHBondContact O-N 3.37Å; L149-G187 VanDerWaalsContact O-N 3.08Å; L149-L279 WeakPolarHBondContact CA-O 3.32Å; L149-L279 HydrophobicContact CD1-CB 3.57Å; L149-L279 HydrophobicContact CD1-CD1 4.25Å; L149-L281 HydrophobicContact CD1-CB 3.91Å; L149-V377 HydrophobicContact CD1-CG1 4.35Å; L149-V377 HydrophobicContact CD2-CG1 4.14Å
150	Y	96.1	Very high	87.4	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	116.7	175.1	-166	-102.8	0	0	0	110.3	L152 F188 G189 Y224 H226 A263 I270 W272 L279 L280 L281	Y150-L152 HydrophobicContact CD1-CB 4.39Å; Y150-L152 HydrophobicContact CE1-CB 4.49Å; Y150-L152 HydrophobicContact CE1-CD1 3.97Å; Y150-F188 VanDerWaalsContact CZ-C 3.41Å; Y150-F188 PolarHBondContact OH-O 3.22Å; Y150-G189 WeakPolarHBondContact OH-CA 3.34Å; Y150-G189 PolarHBondContact OH-N 3.34Å; Y150-Y224 PolarHBondContact OH-OH 3.22Å; Y150-H226 AromaticContact CE2-CE1 3.85Å; Y150-H226 AromaticContact CE2-ND1 3.76Å; Y150-H226 AromaticContact CZ-ND1 3.63Å; Y150-H226 PolarHBondContact OH-ND1 2.69Å; Y150-A263 HydrophobicContact CD1-CB 4.17Å; Y150-A263 HydrophobicContact CE1-CB 4.02Å; Y150-I270 HydrophobicContact CD2-CG2 3.56Å; Y150-I270 HydrophobicContact CE2-CD1 4.31Å; Y150-I270 HydrophobicContact CE2-CG2 3.85Å; Y150-I270 HydrophobicContact CG-CG2 4Å; Y150-W272 VanDerWaalsContact CB-CH2 3.44Å; Y150-W272 HydrophobicContact CG-CZ2 4.39Å; Y150-L279 PolarHBondContact N-O 2.89Å; Y150-L280 HydrophobicContact CD1-CD1 3.73Å; Y150-L280 HydrophobicContact CG-CD1 4.49Å; Y150-L281 PolarHBondContact O-N 2.99Å
151	Y	94.5	Very high	87.2	Confident	0 Å²	0	26.9 Å²	26.9	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	118	170.5	-83.1	-100.4	0	0	0	109.3	L149 V153 L166 L173 L186 G187 F188 G189 F237 L281 M283 L373	L149-Y151 HydrophobicContact CD2-CD2 4.34Å; L149-Y151 HydrophobicContact CD2-CE2 3.73Å; L149-Y151 HydrophobicContact CG-CD2 4.35Å; L149-Y151 HydrophobicContact CG-CE2 4.23Å; Y151-V153 HydrophobicContact CD1-CG2 4.28Å; Y151-L166 HydrophobicContact CD1-CD1 4.13Å; Y151-L166 HydrophobicContact CD1-CD2 4.49Å; Y151-L166 HydrophobicContact CE1-CD1 3.68Å; Y151-L173 HydrophobicContact CE2-CD2 4.35Å; Y151-L173 WeakPolarHBondContact OH-CD2 3.39Å; Y151-L186 HydrophobicContact CD2-CD2 4.19Å; Y151-L186 HydrophobicContact CE2-CD2 3.79Å; Y151-G187 PolarHBondContact N-O 3.38Å; Y151-F188 CarbonylContact O-C 3.41Å; Y151-F188 WeakPolarHBondContact O-CA 2.99Å; Y151-G189 PolarHBondContact O-N 3.44Å; Y151-F237 HydrophobicContact CD1-CZ 4.41Å; Y151-F237 AromaticContact CD2-CE2 3.6Å; Y151-F237 HydrophobicContact CD2-CE2 3.6Å; Y151-F237 AromaticContact CD2-CZ 3.49Å; Y151-F237 HydrophobicContact CD2-CZ 3.49Å; Y151-F237 VanDerWaalsContact CD2-CZ 3.49Å; Y151-F237 HydrophobicContact CE2-CE2 4.15Å; Y151-F237 AromaticContact CE2-CZ 3.68Å; Y151-F237 HydrophobicContact CE2-CZ 3.68Å; Y151-F237 HydrophobicContact CG-CE2 4.07Å; Y151-F237 AromaticContact CG-CZ 3.87Å; Y151-F237 HydrophobicContact CG-CZ 3.87Å; Y151-L281 HydrophobicContact CD1-CD2 3.71Å; Y151-L281 HydrophobicContact CD1-CG 4.41Å; Y151-L281 HydrophobicContact CE1-CD2 3.41Å; Y151-L281 VanDerWaalsContact CE1-CD2 3.41Å; Y151-L281 HydrophobicContact CE2-CD2 4.31Å; Y151-L281 HydrophobicContact CG-CD2 4.29Å; Y151-M283 HydrophobicContact CD1-SD 3.99Å; Y151-M283 HydrophobicContact CE1-SD 4.07Å; Y151-L373 HydrophobicContact CE1-CD2 4.24Å
152	L	96.7	Very high	87.3	Confident	0 Å²	0	27 Å²	27	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	105	172.9	-170.2	75	0	0	0	108.2	Y150 Y191 Y224 A259 M260 A263 L280 L281 V282 M283	Y150-L152 HydrophobicContact CD1-CB 4.39Å; Y150-L152 HydrophobicContact CE1-CB 4.49Å; Y150-L152 HydrophobicContact CE1-CD1 3.97Å; L152-Y191 HydrophobicContact CD1-CD1 4.3Å; L152-Y191 HydrophobicContact CD2-CD1 4.35Å; L152-Y191 HydrophobicContact CD2-CE1 4.25Å; L152-Y191 HydrophobicContact CG-CD1 3.81Å; L152-Y191 HydrophobicContact CG-CE1 3.88Å; L152-Y224 HydrophobicContact CD1-CD2 3.95Å; L152-Y224 HydrophobicContact CD1-CE2 3.43Å; L152-Y224 VanDerWaalsContact CD1-CE2 3.43Å; L152-A259 HydrophobicContact CD1-CB 4.06Å; L152-A259 HydrophobicContact CD2-CB 3.99Å; L152-A259 HydrophobicContact CG-CB 4.36Å; L152-M260 HydrophobicContact CD2-CB 4.23Å; L152-M260 HydrophobicContact CD2-CG 3.58Å; L152-A263 HydrophobicContact CD1-CB 4.39Å; L152-L280 HydrophobicContact CB-CD1 3.85Å; L152-L280 HydrophobicContact CD2-CD1 4.3Å; L152-L281 PolarHBondContact N-O 3.02Å; L152-V282 HydrophobicContact CD2-CG2 4.26Å; L152-V282 WeakPolarHBondContact O-CA 3.48Å; L152-M283 PolarHBondContact O-N 3.01Å
153	V	94.4	Very high	87.8	Confident	1 Å²	1	24.7 Å²	24.7	1%	0.006	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	125.8	-164.7	-178.4	0	0	0	0	110.7	Y151 V155 M159 I163 L166 F188 G189 S190 Y191 M283	Y151-V153 HydrophobicContact CD1-CG2 4.28Å; V153-V155 PolarHBondContact O-N 3.45Å; V153-M159 HydrophobicContact CG1-CE 4.42Å; V153-I163 HydrophobicContact CG1-CG1 4.39Å; V153-L166 HydrophobicContact CG1-CD2 4.49Å; V153-L166 HydrophobicContact CG2-CD2 4.04Å; V153-F188 HydrophobicContact CB-CE2 4.03Å; V153-F188 HydrophobicContact CB-CZ 3.86Å; V153-F188 HydrophobicContact CG1-CZ 4.49Å; V153-F188 HydrophobicContact CG2-CD2 4.47Å; V153-F188 HydrophobicContact CG2-CE2 3.6Å; V153-F188 HydrophobicContact CG2-CZ 3.98Å; V153-G189 PolarHBondContact N-O 3.45Å; V153-S190 WeakPolarHBondContact O-CA 3.47Å; V153-Y191 PolarHBondContact O-N 2.66Å; V153-M283 HydrophobicContact CG1-CB 4.41Å; V153-M283 HydrophobicContact CG2-CB 4.27Å; V153-M283 HydrophobicContact CG2-CG 4.45Å; V153-M283 HydrophobicContact CG2-SD 4.08Å
154	D	94.8	Very high	88.3	Confident	0 Å²	0	24 Å²	24	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.7	121.8	163.5	176.8	-9.3	0	0	0	109.9	S156 M159 Y191 M283 T284	D154-S156 WeakPolarHBondContact OD1-CB 3.46Å; D154-S156 PolarHBondContact OD1-N 3.28Å; D154-S156 PolarHBondContact OD1-OG 2.77Å; D154-M159 HydrophobicContact CB-CE 4.34Å; D154-M159 HydrophobicContact CB-CG 4.04Å; D154-M159 WeakPolarHBondContact O-CB 3.04Å; D154-Y191 HydrophobicContact CB-CD2 4.48Å; D154-Y191 HydrophobicContact CB-CE1 4.32Å; D154-Y191 HydrophobicContact CB-CE2 3.81Å; D154-M283 WeakPolarHBondContact CB-O 3.35Å; D154-M283 PolarHBondContact N-O 3.3Å; D154-T284 WeakPolarHBondContact OD2-CA 3.3Å; D154-T284 VanDerWaalsContact OD2-CB 3.25Å; D154-T284 WeakPolarHBondContact OD2-CB 3.02Å; D154-T284 PolarHBondContact OD2-OG1 3.35Å
155	V	94.1	Very high	88.6	Confident	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.134	C	C	.	.			trans	-112.8	25.1	177.9	-57.8	0	0	0	0	113.3	V153 I163 Y191 V192 I246 S247	V153-V155 PolarHBondContact O-N 3.45Å; V155-I163 HydrophobicContact CB-CD1 4.15Å; V155-I163 HydrophobicContact CG1-CD1 4.01Å; V155-Y191 PolarHBondContact N-O 2.02Å; V155-V192 HydrophobicContact CG2-CG2 3.79Å; V155-I246 CarbonylContact O-C 3.54Å; V155-I246 WeakPolarHBondContact O-CA 3.02Å; V155-S247 PolarHBondContact O-N 3.06Å
156	S	91.8	Very high	88.7	Confident	1 Å²	1	24.7 Å²	24.7	1%	0.007	13%	0.133	C	C	.	.	S	Bend	trans	-55.9	165.6	164.1	63.8	0	0	0	0	112.4	D154 S158 M159	D154-S156 WeakPolarHBondContact OD1-CB 3.46Å; D154-S156 PolarHBondContact OD1-N 3.28Å; D154-S156 PolarHBondContact OD1-OG 2.77Å; S156-S158 VanDerWaalsContact C-N 3.3Å; S156-S158 PolarHBondContact O-N 3.44Å; S156-S158 PolarHBondContact OG-OG 2.74Å; S156-S158 VanDerWaalsContact OG-OG 3.09Å; S156-M159 PolarHBondContact O-N 3.03Å
157	A	88.6	Confident	88	Confident	48 Å²	48	25 Å²	25	40%	0.397	13%	0.133	S	C	.	.	S	Bend	trans	-66.6	-26.9	-175.2	0	0	0	0	0	113.9	H160 I246 S247	A157-H160 WeakPolarHBondContact O-CB 3.47Å; A157-I246 HydrophobicContact CB-CD1 4.36Å; A157-S247 PolarHBondContact N-O 2.04Å
158	S	88	Confident	87.4	Confident	51 Å²	51	27 Å²	27	36%	0.357	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-37.7	175.8	50.4	0	0	0	0	112.1	S156 H160 D285	S156-S158 VanDerWaalsContact C-N 3.3Å; S156-S158 PolarHBondContact O-N 3.44Å; S156-S158 PolarHBondContact OG-OG 2.74Å; S156-S158 VanDerWaalsContact OG-OG 3.09Å; S158-H160 PolarHBondContact O-N 3.35Å; S158-H160 VanDerWaalsContact O-N 3.17Å; S158-D285 WeakPolarHBondContact CB-OD1 3.36Å; S158-D285 WeakPolarHBondContact CB-OD2 3.44Å; S158-D285 PolarHBondContact OG-OD1 2.77Å
159	M	88.3	Confident	86.6	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-3.5	-176.4	-75.1	-69.3	-76.5	0	0	114.7	V153 D154 S156 N161 N162 I163 M283 D285	V153-M159 HydrophobicContact CG1-CE 4.42Å; D154-M159 HydrophobicContact CB-CE 4.34Å; D154-M159 HydrophobicContact CB-CG 4.04Å; D154-M159 WeakPolarHBondContact O-CB 3.04Å; S156-M159 PolarHBondContact O-N 3.03Å; M159-N161 PolarHBondContact O-N 3.16Å; M159-N162 HydrophobicContact CE-CB 4.23Å; M159-N162 WeakPolarHBondContact O-CB 3.04Å; M159-N162 PolarHBondContact O-N 3.17Å; M159-N162 HydrophobicContact SD-CB 4.37Å; M159-I163 HydrophobicContact CB-CD1 4.08Å; M159-I163 HydrophobicContact CB-CG1 4.49Å; M159-I163 WeakPolarHBondContact O-CG1 3.37Å; M159-I163 PolarHBondContact O-N 3.27Å; M159-M283 HydrophobicContact CE-CB 4.07Å; M159-D285 HydrophobicContact SD-CB 4.23Å
160	H	85.1	Confident	85.6	Confident	79 Å²	79	27.4 Å²	27.4	37%	0.366	15%	0.15	S	C	.	.	H	α-helix	trans	-43.6	-54.4	-179.7	-178.2	37.1	0	0	0	114	A157 S158 N162 I163 E164 I246	A157-H160 WeakPolarHBondContact O-CB 3.47Å; S158-H160 PolarHBondContact O-N 3.35Å; S158-H160 VanDerWaalsContact O-N 3.17Å; H160-N162 PolarHBondContact O-N 3.21Å; H160-I163 PolarHBondContact O-N 2.94Å; H160-E164 IonicContact CE1-OE1 3.38Å; H160-E164 PolarHBondContact O-N 2.04Å; H160-E164 VanDerWaalsContact O-N 3.15Å; H160-I246 HydrophobicContact CB-CG2 3.8Å
161	N	82.9	Confident	84.7	Confident	83 Å²	83	29 Å²	29	44%	0.444	16%	0.158	S	C	.	.	H	α-helix	trans	-61.4	-28	-178.6	-69.8	-79	0	0	0	113.6	M159	M159-N161 PolarHBondContact O-N 3.16Å
162	N	83.3	Confident	84.1	Confident	4 Å²	4	32.7 Å²	32.7	2%	0.021	18%	0.178	C	C	.	.	H	α-helix	trans	-84.1	-38.4	-178	-67.9	-1.8	0	0	0	110.2	M159 H160 K165 L166 Q344 K369	M159-N162 HydrophobicContact CE-CB 4.23Å; M159-N162 WeakPolarHBondContact O-CB 3.04Å; M159-N162 PolarHBondContact O-N 3.17Å; M159-N162 HydrophobicContact SD-CB 4.37Å; H160-N162 PolarHBondContact O-N 3.21Å; N162-K165 PolarHBondContact O-N 3.06Å; N162-L166 WeakPolarHBondContact O-CB 3.08Å; N162-L166 PolarHBondContact O-N 3.2Å; N162-Q344 PolarHBondContact ND2-OE1 3.46Å; N162-Q344 PolarHBondContact OD1-OE1 2.03Å; N162-K369 WeakPolarHBondContact OD1-CA 3.07Å; N162-K369 PolarHBondContact OD1-N 3.42Å
163	I	83.6	Confident	83.5	Confident	10 Å²	10	32.7 Å²	32.7	5%	0.051	18%	0.178	C	C	.	.	H	α-helix	trans	-63.9	-44.3	176.6	-62.5	159.6	0	0	0	111.4	V153 V155 M159 H160 K165 L166 Q244 I246	V153-I163 HydrophobicContact CG1-CG1 4.39Å; V155-I163 HydrophobicContact CB-CD1 4.15Å; V155-I163 HydrophobicContact CG1-CD1 4.01Å; M159-I163 HydrophobicContact CB-CD1 4.08Å; M159-I163 HydrophobicContact CB-CG1 4.49Å; M159-I163 WeakPolarHBondContact O-CG1 3.37Å; M159-I163 PolarHBondContact O-N 3.27Å; H160-I163 PolarHBondContact O-N 2.94Å; I163-K165 VanDerWaalsContact C-N 3.31Å; I163-K165 PolarHBondContact O-N 2.9Å; I163-L166 VanDerWaalsContact O-CB 3.31Å; I163-L166 WeakPolarHBondContact O-CB 3.47Å; I163-L166 PolarHBondContact O-N 3.43Å; I163-Q244 HydrophobicContact CG2-CB 4.4Å; I163-I246 HydrophobicContact CD1-CG2 3.86Å
164	E	81.7	Confident	82.6	Confident	125 Å²	125	33.3 Å²	33.3	58%	0.584	18%	0.182	S	C	*	.	H	α-helix	trans	-54.8	-48.7	176.2	-71.6	-163	139.1	0	0	111.6	H160 L166 N167	H160-E164 IonicContact CE1-OE1 3.38Å; H160-E164 PolarHBondContact O-N 2.04Å; H160-E164 VanDerWaalsContact O-N 3.15Å; E164-L166 VanDerWaalsContact C-N 3.34Å; E164-L166 PolarHBondContact O-N 3.1Å; E164-N167 PolarHBondContact O-ND2 3.49Å
165	K	80	Confident	82	Confident	90 Å²	90	40.4 Å²	40.4	39%	0.391	21%	0.209	S	C	.	.	H	α-helix	trans	-73.2	-26.8	-175.6	-172.1	55.2	-175.2	154.6	0	112.5	N162 I163 N167 S168 V169 K369	N162-K165 PolarHBondContact O-N 3.06Å; I163-K165 VanDerWaalsContact C-N 3.31Å; I163-K165 PolarHBondContact O-N 2.9Å; K165-N167 PolarHBondContact O-N 3.08Å; K165-N167 VanDerWaalsContact O-N 3.14Å; K165-S168 WeakPolarHBondContact CD-OG 3.48Å; K165-S168 WeakPolarHBondContact CE-OG 3.19Å; K165-S168 PolarHBondContact NZ-OG 3.15Å; K165-S168 PolarHBondContact O-N 2.04Å; K165-S168 PolarHBondContact O-OG 3.33Å; K165-V169 HydrophobicContact CG-CG2 3.95Å; K165-V169 WeakPolarHBondContact O-CG2 3.33Å; K165-V169 PolarHBondContact O-N 3.3Å; K165-K369 HydrophobicContact CB-CB 4.26Å; K165-K369 HydrophobicContact CG-CB 4.16Å; K165-K369 WeakPolarHBondContact CG-O 3.33Å
166	L	79.7	Confident	81.6	Confident	0 Å²	0	44 Å²	44	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-52.7	-36.4	-176.2	-167.4	60.8	0	0	0	113.7	Y151 V153 N162 I163 E164 S168 V169 G170 F188 V241 M283 L373	Y151-L166 HydrophobicContact CD1-CD1 4.13Å; Y151-L166 HydrophobicContact CD1-CD2 4.49Å; Y151-L166 HydrophobicContact CE1-CD1 3.68Å; V153-L166 HydrophobicContact CG1-CD2 4.49Å; V153-L166 HydrophobicContact CG2-CD2 4.04Å; N162-L166 WeakPolarHBondContact O-CB 3.08Å; N162-L166 PolarHBondContact O-N 3.2Å; I163-L166 VanDerWaalsContact O-CB 3.31Å; I163-L166 WeakPolarHBondContact O-CB 3.47Å; I163-L166 PolarHBondContact O-N 3.43Å; E164-L166 VanDerWaalsContact C-N 3.34Å; E164-L166 PolarHBondContact O-N 3.1Å; L166-S168 VanDerWaalsContact C-N 3.35Å; L166-S168 PolarHBondContact O-N 2.96Å; L166-V169 PolarHBondContact O-N 2.9Å; L166-V169 VanDerWaalsContact O-N 3.15Å; L166-G170 PolarHBondContact O-N 3.3Å; L166-F188 HydrophobicContact CD2-CE2 3.81Å; L166-V241 HydrophobicContact CB-CG1 4Å; L166-V241 HydrophobicContact CD2-CG1 4Å; L166-V241 HydrophobicContact CG-CG1 4.1Å; L166-M283 HydrophobicContact CD1-CE 4.05Å; L166-M283 HydrophobicContact CD1-SD 3.89Å; L166-L373 HydrophobicContact CD1-CD2 4.25Å
167	N	70.6	Confident	81.1	Confident	33 Å²	33	43.9 Å²	43.9	18%	0.176	22%	0.224	C	C	.	.	H	α-helix	trans	-51.3	-51.2	175.8	-64.7	-73.2	0	0	0	112.2	E164 K165 E238 V241 H242	E164-N167 PolarHBondContact O-ND2 3.49Å; K165-N167 PolarHBondContact O-N 3.08Å; K165-N167 VanDerWaalsContact O-N 3.14Å; N167-E238 PolarHBondContact OD1-O 3.14Å; N167-V241 WeakPolarHBondContact OD1-CB 3.49Å; N167-V241 WeakPolarHBondContact OD1-CG1 3.03Å; N167-H242 WeakPolarHBondContact OD1-CA 3.45Å; N167-H242 PolarHBondContact OD1-N 2.88Å; N167-H242 VanDerWaalsContact OD1-N 3.13Å
168	S	75.9	Confident	80.6	Confident	43 Å²	43	44.5 Å²	44.5	30%	0.301	23%	0.229	S	C	.	.	H	α-helix	trans	-71.6	-36.6	178.3	62.4	0	0	0	0	112.8	K165 L166 N171 D172	K165-S168 WeakPolarHBondContact CD-OG 3.48Å; K165-S168 WeakPolarHBondContact CE-OG 3.19Å; K165-S168 PolarHBondContact NZ-OG 3.15Å; K165-S168 PolarHBondContact O-N 2.04Å; K165-S168 PolarHBondContact O-OG 3.33Å; L166-S168 VanDerWaalsContact C-N 3.35Å; L166-S168 PolarHBondContact O-N 2.96Å; S168-N171 PolarHBondContact O-N 3.28Å; S168-D172 PolarHBondContact O-N 3.38Å; S168-D172 VanDerWaalsContact O-N 3.1Å
169	V	74.3	Confident	80.3	Confident	7 Å²	7	49.7 Å²	49.7	4%	0.042	25%	0.246	C	C	.	.	H	α-helix	trans	-66.3	-39.9	-177.5	176.9	0	0	0	0	110.6	K165 L166 D172 L173 L373 N374	K165-V169 HydrophobicContact CG-CG2 3.95Å; K165-V169 WeakPolarHBondContact O-CG2 3.33Å; K165-V169 PolarHBondContact O-N 3.3Å; L166-V169 PolarHBondContact O-N 2.9Å; L166-V169 VanDerWaalsContact O-N 3.15Å; V169-D172 PolarHBondContact O-N 2.74Å; V169-L173 WeakPolarHBondContact O-CB 3.26Å; V169-L173 PolarHBondContact O-N 2.83Å; V169-L373 HydrophobicContact CG1-CB 4.16Å; V169-L373 HydrophobicContact CG1-CD2 3.89Å; V169-L373 HydrophobicContact CG1-CG 4.38Å; V169-N374 WeakPolarHBondContact CG1-OD1 3.33Å; V169-N374 PolarHBondContact O-ND2 3Å; V169-N374 PolarHBondContact O-OD1 3.43Å
170	G	74	Confident	79.8	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-65.1	-40.1	176.4	0	0	0	0	0	114.2	L166 L173 S174	L166-G170 PolarHBondContact O-N 3.3Å; G170-L173 PolarHBondContact O-N 3.1Å; G170-S174 PolarHBondContact O-N 3.43Å
171	N	76.8	Confident	79.6	Confident	34 Å²	34	49.1 Å²	49.1	18%	0.182	24%	0.242	C	C	.	.	H	α-helix	trans	-65.2	-46.6	175.3	-165.1	-38.5	0	0	0	110.8	S168 L173 S174 R175 E238	S168-N171 PolarHBondContact O-N 3.28Å; N171-L173 VanDerWaalsContact C-N 3.32Å; N171-L173 PolarHBondContact O-N 2.99Å; N171-S174 PolarHBondContact O-N 3.17Å; N171-R175 WeakPolarHBondContact O-CG 3.47Å; N171-R175 PolarHBondContact O-N 3.49Å; N171-R175 VanDerWaalsContact OD1-CZ 3.23Å; N171-R175 PolarHBondContact OD1-NE 3.46Å; N171-R175 PolarHBondContact OD1-NH2 2.92Å; N171-E238 PolarHBondContact ND2-OE1 3.25Å
172	D	82.5	Confident	79.3	Confident	78 Å²	78	56.1 Å²	56.1	42%	0.417	26%	0.263	S	S	.	.	H	α-helix	trans	-62.2	-36.2	174.9	-77.3	-20	0	0	0	112.6	S168 V169 K176 N374	S168-D172 PolarHBondContact O-N 3.38Å; S168-D172 VanDerWaalsContact O-N 3.1Å; V169-D172 PolarHBondContact O-N 2.74Å; D172-K176 PolarHBondContact O-N 3.43Å; D172-N374 VanDerWaalsContact CB-ND2 3.27Å; D172-N374 WeakPolarHBondContact CB-ND2 3.47Å
173	L	82.7	Confident	79.4	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-65.5	-46.7	173.6	-175.2	58.6	0	0	0	111	L149 Y151 V169 G170 N171 R175 K176 M177 N374 V377 V378	L149-L173 HydrophobicContact CD2-CD2 3.43Å; L149-L173 VanDerWaalsContact CD2-CD2 3.43Å; Y151-L173 HydrophobicContact CE2-CD2 4.35Å; Y151-L173 WeakPolarHBondContact OH-CD2 3.39Å; V169-L173 WeakPolarHBondContact O-CB 3.26Å; V169-L173 PolarHBondContact O-N 2.83Å; G170-L173 PolarHBondContact O-N 3.1Å; N171-L173 VanDerWaalsContact C-N 3.32Å; N171-L173 PolarHBondContact O-N 2.99Å; L173-R175 PolarHBondContact O-N 3.12Å; L173-K176 CarbonylContact O-C 3.56Å; L173-K176 WeakPolarHBondContact O-CA 3.44Å; L173-K176 WeakPolarHBondContact O-CB 3.5Å; L173-K176 PolarHBondContact O-N 2.85Å; L173-M177 HydrophobicContact CD1-CG 3.84Å; L173-M177 HydrophobicContact CD1-SD 4.33Å; L173-M177 HydrophobicContact CG-CG 3.95Å; L173-M177 WeakPolarHBondContact O-CB 3.49Å; L173-M177 WeakPolarHBondContact O-CG 3.39Å; L173-M177 PolarHBondContact O-N 3.46Å; L173-N374 WeakPolarHBondContact CB-OD1 3.46Å; L173-N374 PolarHBondContact N-ND2 2.87Å; L173-V377 HydrophobicContact CD1-CB 4.07Å; L173-V377 HydrophobicContact CD1-CG1 4.18Å; L173-V377 HydrophobicContact CD2-CB 4.19Å; L173-V377 HydrophobicContact CD2-CG1 3.95Å; L173-V377 HydrophobicContact CD2-CG2 4.35Å; L173-V378 HydrophobicContact CD1-CG2 4.25Å
174	S	77.1	Confident	79.5	Confident	13 Å²	13	59.3 Å²	59.3	9%	0.091	28%	0.278	C	S	.	.	H	α-helix	trans	-59.9	-36.9	-179.9	-161.8	0	0	0	0	111.8	G170 N171 A178 I234	G170-S174 PolarHBondContact O-N 3.43Å; N171-S174 PolarHBondContact O-N 3.17Å; S174-A178 PolarHBondContact O-N 3.34Å; S174-A178 VanDerWaalsContact O-N 3.16Å; S174-I234 VanDerWaalsContact OG-CD1 3.25Å; S174-I234 WeakPolarHBondContact OG-CD1 3.35Å
175	R	81.9	Confident	80	Confident	150 Å²	150	56.5 Å²	56.5	57%	0.566	26%	0.262	S	S	*	.	H	α-helix	trans	-65.4	-43.6	172	-65.6	174	-160.4	-164	5.9	112.2	N171 L173 F179	N171-R175 WeakPolarHBondContact O-CG 3.47Å; N171-R175 PolarHBondContact O-N 3.49Å; N171-R175 VanDerWaalsContact OD1-CZ 3.23Å; N171-R175 PolarHBondContact OD1-NE 3.46Å; N171-R175 PolarHBondContact OD1-NH2 2.92Å; L173-R175 PolarHBondContact O-N 3.12Å; R175-F179 VanDerWaalsContact O-CD2 3.23Å; R175-F179 WeakPolarHBondContact O-CD2 3.45Å; R175-F179 WeakPolarHBondContact O-CE2 3.09Å
176	K	84.7	Confident	80.6	Confident	74 Å²	74	52.4 Å²	52.4	32%	0.322	25%	0.245	S	C	.	.	H	α-helix	trans	-63.4	-42.5	174.8	-78.1	-179.7	175.7	-177.4	0	112.2	D172 L173 A178 F179 F180 N374 N375 V378	D172-K176 PolarHBondContact O-N 3.43Å; L173-K176 CarbonylContact O-C 3.56Å; L173-K176 WeakPolarHBondContact O-CA 3.44Å; L173-K176 WeakPolarHBondContact O-CB 3.5Å; L173-K176 PolarHBondContact O-N 2.85Å; K176-A178 VanDerWaalsContact C-N 3.33Å; K176-A178 PolarHBondContact O-N 2.85Å; K176-F179 WeakPolarHBondContact O-CB 3.04Å; K176-F179 PolarHBondContact O-N 3.37Å; K176-F179 VanDerWaalsContact O-N 3.16Å; K176-F180 VanDerWaalsContact O-CD2 3.28Å; K176-F180 WeakPolarHBondContact O-CD2 3.21Å; K176-N374 HydrophobicContact CD-CB 4.1Å; K176-N375 PolarHBondContact NZ-OD1 2.9Å; K176-V378 HydrophobicContact CB-CG2 4.11Å; K176-V378 HydrophobicContact CD-CG2 4.42Å
177	M	82.5	Confident	81.3	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-67.6	-29.9	-178.6	-69.6	-59.7	-71.1	0	0	112.7	V147 L173 F179 F180 S181 F184 V378 Y381	V147-M177 HydrophobicContact CG1-CE 4.02Å; V147-M177 HydrophobicContact CG2-CE 4.47Å; L173-M177 HydrophobicContact CD1-CG 3.84Å; L173-M177 HydrophobicContact CD1-SD 4.33Å; L173-M177 HydrophobicContact CG-CG 3.95Å; L173-M177 WeakPolarHBondContact O-CB 3.49Å; L173-M177 WeakPolarHBondContact O-CG 3.39Å; L173-M177 PolarHBondContact O-N 3.46Å; M177-F179 PolarHBondContact O-N 2.9Å; M177-F179 VanDerWaalsContact O-N 3.16Å; M177-F180 PolarHBondContact O-N 3.26Å; M177-S181 PolarHBondContact O-N 3Å; M177-F184 HydrophobicContact CB-CD1 4.06Å; M177-F184 HydrophobicContact CB-CD2 4.09Å; M177-F184 HydrophobicContact CB-CE1 4.01Å; M177-F184 HydrophobicContact CB-CE2 4.03Å; M177-F184 HydrophobicContact CB-CG 4.09Å; M177-F184 HydrophobicContact CB-CZ 3.98Å; M177-F184 HydrophobicContact CE-CD2 4.29Å; M177-F184 HydrophobicContact CE-CE2 4Å; M177-F184 HydrophobicContact CG-CD2 4.41Å; M177-F184 HydrophobicContact CG-CE1 4.23Å; M177-F184 HydrophobicContact CG-CE2 3.88Å; M177-F184 HydrophobicContact CG-CZ 3.76Å; M177-V378 HydrophobicContact SD-CG2 4.19Å; M177-Y381 HydrophobicContact CE-CD1 3.87Å; M177-Y381 HydrophobicContact CE-CD2 4.4Å; M177-Y381 HydrophobicContact CE-CE1 4.34Å; M177-Y381 HydrophobicContact CE-CG 3.89Å
178	A	76.8	Confident	82.5	Confident	61 Å²	61	50.9 Å²	50.9	50%	0.504	24%	0.237	S	C	.	.	H	α-helix	trans	-61	-19.9	172.6	0	0	0	0	0	114.2	K144 S174 K176 S181	K144-A178 PolarHBondContact NZ-O 3.44Å; S174-A178 PolarHBondContact O-N 3.34Å; S174-A178 VanDerWaalsContact O-N 3.16Å; K176-A178 VanDerWaalsContact C-N 3.33Å; K176-A178 PolarHBondContact O-N 2.85Å; A178-S181 CarbonylContact C-O 3.5Å
179	F	81.4	Confident	83.4	Confident	159 Å²	159	48.8 Å²	48.8	70%	0.697	22%	0.222	S	C	*	.	H	α-helix	trans	-73.1	-35.5	170.3	-68.3	-87	0	0	0	112	K144 R175 K176 M177	K144-F179 WeakPolarHBondContact CE-O 3.02Å; K144-F179 PolarHBondContact NZ-O 2.83Å; R175-F179 VanDerWaalsContact O-CD2 3.23Å; R175-F179 WeakPolarHBondContact O-CD2 3.45Å; R175-F179 WeakPolarHBondContact O-CE2 3.09Å; K176-F179 WeakPolarHBondContact O-CB 3.04Å; K176-F179 PolarHBondContact O-N 3.37Å; K176-F179 VanDerWaalsContact O-N 3.16Å; M177-F179 PolarHBondContact O-N 2.9Å; M177-F179 VanDerWaalsContact O-N 3.16Å
180	F	77.9	Confident	84.4	Confident	67 Å²	67	48.5 Å²	48.5	29%	0.294	22%	0.22	S	C	.	.	H	α-helix	trans	-102.5	-17.9	-172.9	-52.2	-78.4	0	0	0	114.9	K176 M177 V378 Y381 Q382	K176-F180 VanDerWaalsContact O-CD2 3.28Å; K176-F180 WeakPolarHBondContact O-CD2 3.21Å; M177-F180 PolarHBondContact O-N 3.26Å; F180-V378 HydrophobicContact CD2-CG1 4.14Å; F180-V378 HydrophobicContact CE2-CG1 3.46Å; F180-V378 VanDerWaalsContact CE2-CG1 3.46Å; F180-V378 HydrophobicContact CE2-CG2 4.23Å; F180-V378 HydrophobicContact CZ-CG1 3.76Å; F180-Y381 HydrophobicContact CB-CD1 4Å; F180-Y381 HydrophobicContact CB-CE1 3.66Å; F180-Q382 HydrophobicContact CE1-CG 4.46Å; F180-Q382 VanDerWaalsContact CZ-NE2 3.29Å
181	S	81.3	Confident	85.5	Confident	1 Å²	1	48.5 Å²	48.5	1%	0.007	22%	0.22	C	C	.	.			trans	-126.6	169.6	168.5	-173.8	0	0	0	0	110.6	K144 Y145 M177 A178 D183	K144-S181 PolarHBondContact NZ-O 2.93Å; Y145-S181 WeakPolarHBondContact O-CB 3.38Å; Y145-S181 PolarHBondContact O-OG 3.04Å; M177-S181 PolarHBondContact O-N 3Å; A178-S181 CarbonylContact C-O 3.5Å; S181-D183 PolarHBondContact OG-N 3.29Å; S181-D183 PolarHBondContact OG-O 2.84Å
182	R	77	Confident	86.4	Confident	230 Å²	230	46.9 Å²	46.9	87%	0.868	21%	0.212	S	C	*	.	S	Bend	trans	-112.7	-6.3	165.9	-89.5	176.8	176.9	170.8	-1.2	111.9	K144	K144-R182 HydrophobicContact CD-CB 4.42Å; K144-R182 HydrophobicContact CD-CG 3.83Å
183	D	84.1	Confident	87.1	Confident	53 Å²	53	43.2 Å²	43.2	28%	0.283	19%	0.192	S	C	.	.	S	Bend	trans	-145.2	100.7	-168	175.9	-10.6	0	0	0	107	P146 V147 S181 R273	P146-D183 WeakPolarHBondContact CA-O 3.06Å; P146-D183 HydrophobicContact CB-CB 4.24Å; V147-D183 PolarHBondContact N-O 3.31Å; S181-D183 PolarHBondContact OG-N 3.29Å; S181-D183 PolarHBondContact OG-O 2.84Å; D183-R273 IonicContact OD1-CZ 2.81Å; D183-R273 IonicContact OD1-NH1 2.72Å; D183-R273 PolarHBondContact OD1-NH1 2.72Å; D183-R273 IonicContact OD1-NH2 3.64Å; D183-R273 PolarHBondContact OD1-NH2 2.94Å; D183-R273 IonicContact OD2-CZ 2.83Å; D183-R273 IonicContact OD2-NH1 2.79Å; D183-R273 PolarHBondContact OD2-NH1 3.02Å; D183-R273 IonicContact OD2-NH2 2.61Å
184	F	87.6	Confident	87.7	Confident	27 Å²	27	43.2 Å²	43.2	12%	0.118	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	126.6	-169.2	179.1	-119.1	0	0	0	110	V147 L149 M177 L186	V147-F184 HydrophobicContact CB-CD2 4Å; V147-F184 HydrophobicContact CG1-CD2 4.04Å; V147-F184 HydrophobicContact CG1-CE2 4.15Å; V147-F184 WeakPolarHBondContact O-CA 3.16Å; L149-F184 HydrophobicContact CB-CE2 3.72Å; L149-F184 HydrophobicContact CB-CZ 4.05Å; L149-F184 HydrophobicContact CD2-CE2 4.17Å; L149-F184 HydrophobicContact CD2-CZ 3.85Å; M177-F184 HydrophobicContact CB-CD1 4.06Å; M177-F184 HydrophobicContact CB-CD2 4.09Å; M177-F184 HydrophobicContact CB-CE1 4.01Å; M177-F184 HydrophobicContact CB-CE2 4.03Å; M177-F184 HydrophobicContact CB-CG 4.09Å; M177-F184 HydrophobicContact CB-CZ 3.98Å; M177-F184 HydrophobicContact CE-CD2 4.29Å; M177-F184 HydrophobicContact CE-CE2 4Å; M177-F184 HydrophobicContact CG-CD2 4.41Å; M177-F184 HydrophobicContact CG-CE1 4.23Å; M177-F184 HydrophobicContact CG-CE2 3.88Å; M177-F184 HydrophobicContact CG-CZ 3.76Å; F184-L186 HydrophobicContact CD1-CG 4.39Å; F184-L186 HydrophobicContact CE1-CD1 4.02Å; F184-L186 HydrophobicContact CE1-CD2 3.71Å; F184-L186 HydrophobicContact CE1-CG 3.67Å; F184-L186 HydrophobicContact CZ-CD2 3.58Å; F184-L186 HydrophobicContact CZ-CG 4.02Å
185	R	91.9	Very high	88.5	Confident	66 Å²	66	45 Å²	45	25%	0.249	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	140.7	178.3	-67.4	-173.6	177.6	-176.8	-0.5	111.6	V147 L149 L230 T231 E232	V147-R185 PolarHBondContact O-N 3.27Å; L149-R185 PolarHBondContact N-O 2.91Å; R185-L230 HydrophobicContact CB-CB 4.12Å; R185-L230 HydrophobicContact CB-CD2 4.11Å; R185-T231 WeakPolarHBondContact CA-O 3.43Å; R185-E232 HydrophobicContact CG-CG 3.69Å; R185-E232 IonicContact CZ-OE1 3.18Å; R185-E232 IonicContact NE-OE1 2.71Å; R185-E232 PolarHBondContact NE-OE1 3.48Å; R185-E232 IonicContact NH2-OE1 2.73Å; R185-E232 PolarHBondContact NH2-OE1 2.04Å
186	L	91.5	Very high	89.1	Confident	4 Å²	4	39.4 Å²	39.4	2%	0.021	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	135.2	178.4	-73.9	171.4	0	0	0	110.1	L149 Y151 F184 L230 T231 F237	L149-L186 HydrophobicContact CB-CD2 4.32Å; L149-L186 HydrophobicContact CD2-CD2 4.03Å; L149-L186 HydrophobicContact CG-CD2 4.42Å; L149-L186 WeakPolarHBondContact O-CA 3.04Å; Y151-L186 HydrophobicContact CD2-CD2 4.19Å; Y151-L186 HydrophobicContact CE2-CD2 3.79Å; F184-L186 HydrophobicContact CD1-CG 4.39Å; F184-L186 HydrophobicContact CE1-CD1 4.02Å; F184-L186 HydrophobicContact CE1-CD2 3.71Å; F184-L186 HydrophobicContact CE1-CG 3.67Å; F184-L186 HydrophobicContact CZ-CD2 3.58Å; F184-L186 HydrophobicContact CZ-CG 4.02Å; L186-L230 WeakPolarHBondContact O-CA 3.13Å; L186-T231 PolarHBondContact N-O 2.81Å; L186-T231 PolarHBondContact O-N 3.03Å; L186-F237 HydrophobicContact CB-CB 4.31Å; L186-F237 HydrophobicContact CB-CD2 3.77Å; L186-F237 HydrophobicContact CB-CE2 4.34Å; L186-F237 HydrophobicContact CB-CG 4.1Å; L186-F237 HydrophobicContact CD1-CB 4.41Å; L186-F237 HydrophobicContact CD1-CD1 4.25Å; L186-F237 HydrophobicContact CD1-CD2 4.47Å; L186-F237 HydrophobicContact CD1-CG 4.12Å
187	G	94.4	Very high	89.6	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	163.4	169.7	0	0	0	0	0	110.8	L149 Y151 L228	L149-G187 PolarHBondContact O-N 3.37Å; L149-G187 VanDerWaalsContact O-N 3.08Å; Y151-G187 PolarHBondContact N-O 3.38Å; G187-L228 CarbonylContact C-O 3.57Å; G187-L228 VanDerWaalsContact CA-O 3.3Å; G187-L228 WeakPolarHBondContact CA-O 3.41Å
188	F	95.1	Very high	90.1	Very high	1 Å²	1	41.4 Å²	41.4	0%	0.004	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	144.5	-175.9	-168.3	-87.7	0	0	0	112.6	Y150 Y151 V153 L166 V227 L228 F237 V241 Q244	Y150-F188 VanDerWaalsContact CZ-C 3.41Å; Y150-F188 PolarHBondContact OH-O 3.22Å; Y151-F188 CarbonylContact O-C 3.41Å; Y151-F188 WeakPolarHBondContact O-CA 2.99Å; V153-F188 HydrophobicContact CB-CE2 4.03Å; V153-F188 HydrophobicContact CB-CZ 3.86Å; V153-F188 HydrophobicContact CG1-CZ 4.49Å; V153-F188 HydrophobicContact CG2-CD2 4.47Å; V153-F188 HydrophobicContact CG2-CE2 3.6Å; V153-F188 HydrophobicContact CG2-CZ 3.98Å; L166-F188 HydrophobicContact CD2-CE2 3.81Å; F188-V227 HydrophobicContact CD1-CB 3.85Å; F188-V227 HydrophobicContact CD1-CG1 4.29Å; F188-V227 HydrophobicContact CD1-CG2 3.85Å; F188-V227 HydrophobicContact CE1-CG2 4.27Å; F188-V227 PolarHBondContact O-N 3.45Å; F188-L228 HydrophobicContact CB-CB 4.21Å; F188-L228 PolarHBondContact N-O 3.19Å; F188-L228 PolarHBondContact O-N 3.16Å; F188-F237 HydrophobicContact CB-CD2 4.35Å; F188-F237 HydrophobicContact CB-CE2 4.1Å; F188-F237 HydrophobicContact CD2-CE2 4.06Å; F188-F237 HydrophobicContact CD2-CZ 4.31Å; F188-V241 HydrophobicContact CD2-CG2 3.65Å; F188-V241 HydrophobicContact CE2-CG2 3.82Å; F188-V241 HydrophobicContact CG-CG2 4.29Å; F188-Q244 HydrophobicContact CD1-CG 4.45Å; F188-Q244 HydrophobicContact CE1-CG 3.6Å; F188-Q244 HydrophobicContact CZ-CG 3.99Å
189	G	96.4	Very high	91	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	148.3	170.4	0	0	0	0	0	111.8	Y150 Y151 V153 I225	Y150-G189 WeakPolarHBondContact OH-CA 3.34Å; Y150-G189 PolarHBondContact OH-N 3.34Å; Y151-G189 PolarHBondContact O-N 3.44Å; V153-G189 PolarHBondContact N-O 3.45Å; G189-I225 CarbonylContact C-O 3.59Å; G189-I225 VanDerWaalsContact CA-O 3.23Å; G189-I225 WeakPolarHBondContact CA-O 3.44Å
190	S	95.7	Very high	91.5	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	147.8	-179.6	65.1	0	0	0	0	111.8	V153 H222 Y224 I225	V153-S190 WeakPolarHBondContact O-CA 3.47Å; S190-H222 PolarHBondContact OG-NE2 2.98Å; S190-Y224 WeakPolarHBondContact O-CD2 3.5Å; S190-I225 PolarHBondContact N-O 3.48Å; S190-I225 PolarHBondContact O-N 2.95Å
191	Y	97	Very high	92.2	Very high	1 Å²	1	29.4 Å²	29.4	0%	0.004	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	156.1	170.3	67.6	-93.2	0	0	0	112.1	L152 V153 D154 V155 G223 E254 G256 A259 V282 M283 T284	L152-Y191 HydrophobicContact CD1-CD1 4.3Å; L152-Y191 HydrophobicContact CD2-CD1 4.35Å; L152-Y191 HydrophobicContact CD2-CE1 4.25Å; L152-Y191 HydrophobicContact CG-CD1 3.81Å; L152-Y191 HydrophobicContact CG-CE1 3.88Å; V153-Y191 PolarHBondContact O-N 2.66Å; D154-Y191 HydrophobicContact CB-CD2 4.48Å; D154-Y191 HydrophobicContact CB-CE1 4.32Å; D154-Y191 HydrophobicContact CB-CE2 3.81Å; V155-Y191 PolarHBondContact N-O 2.02Å; Y191-G223 WeakPolarHBondContact CA-O 3.37Å; Y191-G223 WeakPolarHBondContact CB-O 3.44Å; Y191-E254 HydrophobicContact CD2-CB 4.45Å; Y191-E254 HydrophobicContact CE2-CB 4.09Å; Y191-G256 VanDerWaalsContact CE2-CA 3.47Å; Y191-A259 HydrophobicContact CD1-CB 3.94Å; Y191-A259 HydrophobicContact CG-CB 3.88Å; Y191-V282 HydrophobicContact CE1-CG1 4.49Å; Y191-M283 PolarHBondContact OH-O 3.44Å; Y191-T284 WeakPolarHBondContact OH-CB 3.49Å
192	V	95.6	Very high	92.6	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.172	C	C	.	.			trans	-131.2	-111	163.8	-166.3	0	0	0	0	104.7	V155 H222 G223 N249 G255	V155-V192 HydrophobicContact CG2-CG2 3.79Å; V192-H222 WeakPolarHBondContact CB-O 3.48Å; V192-H222 PolarHBondContact N-O 2.91Å; V192-H222 VanDerWaalsContact N-O 3.09Å; V192-G223 PolarHBondContact N-O 2.92Å; V192-N249 HydrophobicContact CG1-CB 4.09Å; V192-G255 WeakPolarHBondContact O-CA 3.31Å; V192-G255 PolarHBondContact O-N 2.97Å
193	D	96.2	Very high	93.3	Very high	1 Å²	1	28.1 Å²	28.1	1%	0.005	15%	0.152	C	C	.	.			trans	-143.6	-179.5	170.6	-165.3	29.8	0	0	0	113.6	T195 Y199 H222 G223 G255 H289 H322	D193-T195 PolarHBondContact O-N 3.1Å; D193-Y199 WeakPolarHBondContact OD2-CB 3.03Å; D193-Y199 WeakPolarHBondContact OD2-CD1 3.48Å; D193-H222 CarbonylContact O-C 3.45Å; D193-G223 WeakPolarHBondContact O-CA 3.43Å; D193-G223 PolarHBondContact O-N 3.13Å; D193-G255 WeakPolarHBondContact OD1-CA 3.46Å; D193-G255 PolarHBondContact OD1-N 3Å; D193-G255 VanDerWaalsContact OD1-N 3.16Å; D193-H289 IonicContact OD2-CD2 3.01Å; D193-H289 PolarHBondContact OD2-CD2 2.97Å; D193-H289 IonicContact OD2-NE2 3.51Å; D193-H322 IonicContact OD1-CE1 2.79Å; D193-H322 PolarHBondContact OD1-CE1 3.25Å
194	K	96.1	Very high	93.4	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	17%	0.17	C	C	.	.			trans	-52.5	129.3	-178.5	-63.6	-175.1	174.9	-56	0	112.1	V196 Y199 D258 I299 S317 M320 H322	K194-V196 HydrophobicContact CB-CG2 4.13Å; K194-V196 PolarHBondContact O-N 3.01Å; K194-Y199 HydrophobicContact CB-CD2 3.81Å; K194-Y199 HydrophobicContact CB-CE2 4.14Å; K194-Y199 HydrophobicContact CD-CE2 4.26Å; K194-D258 IonicContact NZ-OD1 3.37Å; K194-D258 IonicContact NZ-OD2 3.61Å; K194-D258 PolarHBondContact NZ-OD2 3.35Å; K194-I299 HydrophobicContact CD-CD1 4.06Å; K194-S317 WeakPolarHBondContact CA-OG 3.4Å; K194-S317 WeakPolarHBondContact CD-O 3.49Å; K194-S317 WeakPolarHBondContact CG-O 3.27Å; K194-S317 PolarHBondContact NZ-O 3.37Å; K194-M320 WeakPolarHBondContact CE-O 3.33Å; K194-M320 PolarHBondContact NZ-O 3.47Å; K194-H322 WeakPolarHBondContact CE-CE1 3.49Å; K194-H322 WeakPolarHBondContact CE-NE2 3.37Å
195	T	93.9	Very high	93.3	Very high	50 Å²	50	36.2 Å²	36.2	31%	0.307	20%	0.198	S	C	.	.	S	Bend	trans	-81.2	49.5	-173.4	50.7	0	0	0	0	114	D193 I200 P221 T318	D193-T195 PolarHBondContact O-N 3.1Å; T195-I200 VanDerWaalsContact C-CD1 3.5Å; T195-P221 VanDerWaalsContact CG2-C 3.44Å; T195-P221 HydrophobicContact CG2-CB 4.16Å; T195-P221 HydrophobicContact CG2-CG 4.34Å; T195-P221 WeakPolarHBondContact CG2-O 3.06Å; T195-T318 WeakPolarHBondContact OG1-CG2 3.48Å
196	V	94.5	Very high	93	Very high	33 Å²	33	35.2 Å²	35.2	20%	0.2	19%	0.194	C	C	.	.	S	Bend	trans	-137.9	158.6	178.6	-71	0	0	0	0	110.9	K194 Y199 I200 A297 I299 T318	K194-V196 HydrophobicContact CB-CG2 4.13Å; K194-V196 PolarHBondContact O-N 3.01Å; V196-Y199 HydrophobicContact CG2-CD2 3.88Å; V196-Y199 HydrophobicContact CG2-CE2 4.06Å; V196-Y199 PolarHBondContact O-N 2.04Å; V196-Y199 VanDerWaalsContact O-N 3.08Å; V196-I200 PolarHBondContact O-N 2.93Å; V196-A297 HydrophobicContact CB-CB 4.38Å; V196-A297 HydrophobicContact CG2-CB 3.54Å; V196-I299 HydrophobicContact CG2-CD1 3.94Å; V196-T318 HydrophobicContact CG1-CG2 3.83Å
197	S	94.2	Very high	92.8	Very high	63 Å²	63	38.3 Å²	38.3	44%	0.441	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	137.4	168.3	-176.5	0	0	0	0	109.5	A297	S197-A297 WeakPolarHBondContact O-CA 3.27Å; S197-A297 WeakPolarHBondContact O-CB 3.45Å
198	P	94.3	Very high	92.4	Very high	53 Å²	53	44.7 Å²	44.7	34%	0.344	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	cis	-88.1	-13	13.3	34.5	-35.9	0	0	0	116.4	I200 L296	P198-I200 VanDerWaalsContact C-N 3.27Å; P198-I200 PolarHBondContact O-N 2.92Å; P198-L296 HydrophobicContact CG-CB 4.33Å
199	Y	94.3	Very high	92.1	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-30.5	-169.2	-44.3	-66.8	0	0	0	114.4	D193 K194 V196 N249 I250 D251 H289 D293 S294 A297	D193-Y199 WeakPolarHBondContact OD2-CB 3.03Å; D193-Y199 WeakPolarHBondContact OD2-CD1 3.48Å; K194-Y199 HydrophobicContact CB-CD2 3.81Å; K194-Y199 HydrophobicContact CB-CE2 4.14Å; K194-Y199 HydrophobicContact CD-CE2 4.26Å; V196-Y199 HydrophobicContact CG2-CD2 3.88Å; V196-Y199 HydrophobicContact CG2-CE2 4.06Å; V196-Y199 PolarHBondContact O-N 2.04Å; V196-Y199 VanDerWaalsContact O-N 3.08Å; Y199-N249 CarbonylContact O-C 3.5Å; Y199-N249 WeakPolarHBondContact O-CA 3.42Å; Y199-N249 WeakPolarHBondContact O-CB 3.38Å; Y199-I250 PolarHBondContact O-N 2.87Å; Y199-D251 WeakPolarHBondContact CA-OD1 3.08Å; Y199-D251 WeakPolarHBondContact CD1-OD2 2.97Å; Y199-H289 AromaticContact CD1-NE2 3.58Å; Y199-H289 AromaticContact CE1-CD2 3.95Å; Y199-H289 AromaticContact CE1-CE1 3.91Å; Y199-H289 AromaticContact CE1-NE2 3.39Å; Y199-H289 WeakPolarHBondContact CE1-NE2 3.28Å; Y199-D293 PolarHBondContact OH-O 2.89Å; Y199-S294 VanDerWaalsContact OH-CA 3.22Å; Y199-S294 WeakPolarHBondContact OH-CA 3.41Å; Y199-S294 PolarHBondContact OH-N 2.89Å; Y199-A297 HydrophobicContact CD2-CB 4.31Å; Y199-A297 HydrophobicContact CE2-CB 3.52Å
200	I	93.3	Very high	91.7	Very high	8 Å²	8	46.4 Å²	46.4	4%	0.041	25%	0.249	C	C	.	.	S	Bend	trans	-124.1	152.4	177.6	67.5	158.7	0	0	0	112	T195 V196 P198 I202 P221	T195-I200 VanDerWaalsContact C-CD1 3.5Å; V196-I200 PolarHBondContact O-N 2.93Å; P198-I200 VanDerWaalsContact C-N 3.27Å; P198-I200 PolarHBondContact O-N 2.92Å; I200-I202 HydrophobicContact CG1-CG2 4.48Å; I200-I202 PolarHBondContact O-N 3.14Å; I200-P221 HydrophobicContact CB-CG 4.27Å; I200-P221 HydrophobicContact CD1-CG 3.73Å; I200-P221 HydrophobicContact CG2-CB 3.68Å; I200-P221 HydrophobicContact CG2-CG 3.92Å
201	S	91.1	Very high	91.3	Very high	27 Å²	27	46.7 Å²	46.7	19%	0.189	25%	0.25	C	S	.	.			trans	-74.9	115.6	170.7	-167.6	0	0	0	0	110	H203 Q210 I250	S201-H203 PolarHBondContact O-N 2.96Å; S201-H203 PolarHBondContact OG-N 3.01Å; S201-Q210 PolarHBondContact O-NE2 3.11Å; S201-I250 VanDerWaalsContact N-CG1 3.34Å
202	I	90.8	Very high	90.7	Very high	106 Å²	106	48.5 Å²	48.5	54%	0.544	26%	0.263	S	S	.	.			trans	-81.5	11.3	172.6	62.4	170.5	0	0	0	112.9	I200	I200-I202 HydrophobicContact CG1-CG2 4.48Å; I200-I202 PolarHBondContact O-N 3.14Å
203	H	90.5	Very high	89.9	Confident	97 Å²	97	53.1 Å²	53.1	45%	0.449	29%	0.288	S	S	.	.			trans	-66.2	135.3	174.4	-163.1	-112.7	0	0	0	110.1	S201 E205 R206 I207	S201-H203 PolarHBondContact O-N 2.96Å; S201-H203 PolarHBondContact OG-N 3.01Å; H203-E205 IonicContact CE1-OE2 3.89Å; H203-E205 PolarHBondContact CE1-OE2 3.22Å; H203-E205 IonicContact ND1-OE2 2.68Å; H203-E205 PolarHBondContact ND1-OE2 3.33Å; H203-E205 PolarHBondContact O-N 2.97Å; H203-E205 VanDerWaalsContact O-N 3.07Å; H203-R206 HydrophobicContact CB-CB 4.34Å; H203-R206 HydrophobicContact CB-CG 4.37Å; H203-R206 PolarHBondContact O-N 3.37Å; H203-I207 PolarHBondContact O-N 3.22Å
204	P	87.7	Confident	89.1	Confident	101 Å²	101	61.2 Å²	61.2	66%	0.656	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-30.2	-174.2	-29	36.5	0	0	0	115
205	E	84.7	Confident	88.3	Confident	150 Å²	150	68.6 Å²	68.6	70%	0.701	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-23.7	177.5	-61.6	171.9	149.2	0	0	112.9	H203	H203-E205 IonicContact CE1-OE2 3.89Å; H203-E205 PolarHBondContact CE1-OE2 3.22Å; H203-E205 IonicContact ND1-OE2 2.68Å; H203-E205 PolarHBondContact ND1-OE2 3.33Å; H203-E205 PolarHBondContact O-N 2.97Å; H203-E205 VanDerWaalsContact O-N 3.07Å
206	R	86.6	Confident	87.8	Confident	44 Å²	44	70.1 Å²	70.1	17%	0.166	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.5	-23.9	-175.3	-62.1	-169.9	67.2	152.2	8.4	114	H203 H208 N209 Q210 D213	H203-R206 HydrophobicContact CB-CB 4.34Å; H203-R206 HydrophobicContact CB-CG 4.37Å; H203-R206 PolarHBondContact O-N 3.37Å; R206-H208 PolarHBondContact O-N 3.39Å; R206-H208 VanDerWaalsContact O-N 3.08Å; R206-N209 WeakPolarHBondContact CA-O 3.41Å; R206-N209 CarbonylContact O-C 3.52Å; R206-N209 PolarHBondContact O-N 3.09Å; R206-Q210 PolarHBondContact NH2-O 2.91Å; R206-Q210 VanDerWaalsContact O-CD 3.3Å; R206-Q210 PolarHBondContact O-N 3.35Å; R206-Q210 PolarHBondContact O-NE2 3.35Å; R206-Q210 VanDerWaalsContact O-NE2 3.09Å; R206-D213 IonicContact CZ-OD1 2.82Å; R206-D213 IonicContact CZ-OD2 3.57Å; R206-D213 VanDerWaalsContact CZ-OD2 3.23Å; R206-D213 IonicContact NE-OD1 3.86Å; R206-D213 IonicContact NH1-OD1 3.4Å; R206-D213 PolarHBondContact NH1-OD1 3.36Å; R206-D213 VanDerWaalsContact NH1-OD1 3.17Å; R206-D213 IonicContact NH1-OD2 3.66Å; R206-D213 PolarHBondContact NH1-OD2 3.35Å; R206-D213 IonicContact NH2-OD1 3.98Å; R206-D213 IonicContact NH2-OD2 3.45Å; R206-D213 PolarHBondContact NH2-OD2 3.49Å
207	I	86.2	Confident	87.3	Confident	69 Å²	69	73.8 Å²	73.8	35%	0.354	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-27.9	-175.7	-161.3	170.3	0	0	0	113.4	H203	H203-I207 PolarHBondContact O-N 3.22Å
208	H	86.1	Confident	87.1	Confident	135 Å²	135	71 Å²	71	63%	0.625	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.9	-19.2	175.4	-62.8	-53.1	0	0	0	114.3	R206	R206-H208 PolarHBondContact O-N 3.39Å; R206-H208 VanDerWaalsContact O-N 3.08Å
209	N	89	Confident	86.9	Confident	33 Å²	33	71 Å²	71	18%	0.176	36%	0.36	C	S	.	.			trans	-151.3	98.2	176.8	176.7	0.8	0	0	0	109	R206 C211 S212 L216 C218	R206-N209 WeakPolarHBondContact CA-O 3.41Å; R206-N209 CarbonylContact O-C 3.52Å; R206-N209 PolarHBondContact O-N 3.09Å; N209-C211 PolarHBondContact O-N 2.86Å; N209-C211 WeakPolarHBondContact OD1-CA 3.35Å; N209-C211 WeakPolarHBondContact OD1-CB 3.48Å; N209-C211 PolarHBondContact OD1-N 3.18Å; N209-S212 PolarHBondContact O-N 3.12Å; N209-S212 PolarHBondContact O-OG 3.04Å; N209-S212 PolarHBondContact OD1-N 3.49Å; N209-L216 PolarHBondContact ND2-O 2.89Å; N209-L216 PolarHBondContact OD1-O 3.1Å; N209-C218 PolarHBondContact OD1-SG 3.37Å
210	Q	87.1	Confident	86.7	Confident	4 Å²	4	74.3 Å²	74.3	2%	0.019	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-17.5	-177.8	-64.2	-69.3	-23.5	0	0	112.5	S201 R206 P221 G248	S201-Q210 PolarHBondContact O-NE2 3.11Å; R206-Q210 PolarHBondContact NH2-O 2.91Å; R206-Q210 VanDerWaalsContact O-CD 3.3Å; R206-Q210 PolarHBondContact O-N 3.35Å; R206-Q210 PolarHBondContact O-NE2 3.35Å; R206-Q210 VanDerWaalsContact O-NE2 3.09Å; Q210-P221 HydrophobicContact CG-CB 4.41Å; Q210-P221 HydrophobicContact CG-CG 4.04Å; Q210-G248 WeakPolarHBondContact CG-O 3.27Å
211	C	87.5	Confident	86.6	Confident	5 Å²	5	74.6 Å²	74.6	3%	0.034	38%	0.384	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94	7.7	-175	-40	0	0	0	0	113.3	N209 D213 Y214 L216 C218	N209-C211 PolarHBondContact O-N 2.86Å; N209-C211 WeakPolarHBondContact OD1-CA 3.35Å; N209-C211 WeakPolarHBondContact OD1-CB 3.48Å; N209-C211 PolarHBondContact OD1-N 3.18Å; C211-D213 VanDerWaalsContact C-N 3.28Å; C211-D213 PolarHBondContact O-N 2.04Å; C211-Y214 PolarHBondContact O-N 3.15Å; C211-L216 HydrophobicContact CB-CB 4Å; C211-L216 PolarHBondContact O-N 3.47Å; C211-C218 HydrophobicContact CB-CB 3.77Å; C211-C218 WeakPolarHBondContact CB-SG 3.26Å; C211-C218 PolarHBondContact N-SG 2.78Å; C211-C218 VanDerWaalsContact N-SG 3.42Å; C211-C218 WeakPolarHBondContact SG-CB 3.37Å; C211-C218 CovalentContact SG-SG 2.04Å; C211-C218 PolarHBondContact SG-SG 3.34Å
212	S	84.4	Confident	86.8	Confident	40 Å²	40	74 Å²	74	28%	0.28	38%	0.378	S	S	.	.	G	3₁₀ helix	trans	-54.4	-37.7	-178.5	53.4	0	0	0	0	113.9	N209 Y214 N215	N209-S212 PolarHBondContact O-N 3.12Å; N209-S212 PolarHBondContact O-OG 3.04Å; N209-S212 PolarHBondContact OD1-N 3.49Å; S212-Y214 PolarHBondContact O-N 2.91Å; S212-Y214 VanDerWaalsContact O-N 3.1Å; S212-N215 PolarHBondContact O-N 3.27Å
213	D	79.4	Confident	87	Confident	97 Å²	97	69.1 Å²	69.1	52%	0.519	35%	0.354	S	S	.	.	G	3₁₀ helix	trans	-55.4	-27.9	176.4	-65.8	8.9	0	0	0	112.9	R206 C211	R206-D213 IonicContact CZ-OD1 2.82Å; R206-D213 IonicContact CZ-OD2 3.57Å; R206-D213 VanDerWaalsContact CZ-OD2 3.23Å; R206-D213 IonicContact NE-OD1 3.86Å; R206-D213 IonicContact NH1-OD1 3.4Å; R206-D213 PolarHBondContact NH1-OD1 3.36Å; R206-D213 VanDerWaalsContact NH1-OD1 3.17Å; R206-D213 IonicContact NH1-OD2 3.66Å; R206-D213 PolarHBondContact NH1-OD2 3.35Å; R206-D213 IonicContact NH2-OD1 3.98Å; R206-D213 IonicContact NH2-OD2 3.45Å; R206-D213 PolarHBondContact NH2-OD2 3.49Å; C211-D213 VanDerWaalsContact C-N 3.28Å; C211-D213 PolarHBondContact O-N 2.04Å
214	Y	79.3	Confident	87.3	Confident	171 Å²	171	64.6 Å²	64.6	67%	0.671	33%	0.333	S	S	*	.	G	3₁₀ helix	trans	-99	4.9	-177.4	-57.9	-76.8	0	0	0	113.2	C211 S212 L216	C211-Y214 PolarHBondContact O-N 3.15Å; S212-Y214 PolarHBondContact O-N 2.91Å; S212-Y214 VanDerWaalsContact O-N 3.1Å; Y214-L216 PolarHBondContact O-N 3.01Å
215	N	80.3	Confident	87.8	Confident	155 Å²	155	61.7 Å²	61.7	83%	0.829	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.2	28.3	-171.4	-56.9	-84.2	0	0	0	113.9	S212	S212-N215 PolarHBondContact O-N 3.27Å
216	L	82.2	Confident	88.4	Confident	82 Å²	82	54.7 Å²	54.7	43%	0.429	28%	0.279	S	S	.	.			trans	-99	141.1	176.6	-64.9	173.7	0	0	0	110.8	N209 C211 Y214 I246	N209-L216 PolarHBondContact ND2-O 2.89Å; N209-L216 PolarHBondContact OD1-O 3.1Å; C211-L216 HydrophobicContact CB-CB 4Å; C211-L216 PolarHBondContact O-N 3.47Å; Y214-L216 PolarHBondContact O-N 3.01Å; L216-I246 HydrophobicContact CD1-CD1 4.42Å
217	D	84.6	Confident	88.9	Confident	110 Å²	110	54.7 Å²	54.7	59%	0.588	28%	0.284	S	S	*	.			trans	-91.7	102.9	171.7	173.6	48	0	0	0	109.8	K245	D217-K245 IonicContact OD2-NZ 3.14Å; D217-K245 PolarHBondContact OD2-NZ 3.14Å
218	C	88.8	Confident	89.3	Confident	4 Å²	4	52.7 Å²	52.7	3%	0.027	27%	0.274	C	S	.	.			trans	-122.5	154.9	-177.9	82.2	0	0	0	0	111.5	N209 C211 I246	N209-C218 PolarHBondContact OD1-SG 3.37Å; C211-C218 HydrophobicContact CB-CB 3.77Å; C211-C218 WeakPolarHBondContact CB-SG 3.26Å; C211-C218 PolarHBondContact N-SG 2.78Å; C211-C218 VanDerWaalsContact N-SG 3.42Å; C211-C218 WeakPolarHBondContact SG-CB 3.37Å; C211-C218 CovalentContact SG-SG 2.04Å; C211-C218 PolarHBondContact SG-SG 3.34Å; C218-I246 CarbonylContact C-O 3.51Å; C218-I246 WeakPolarHBondContact CA-O 3.44Å; C218-I246 HydrophobicContact CB-CD1 4.4Å; C218-I246 HydrophobicContact CB-CG1 3.99Å; C218-I246 VanDerWaalsContact CB-O 3.28Å; C218-I246 WeakPolarHBondContact CB-O 3.36Å
219	M	90.2	Very high	89.8	Confident	52 Å²	52	49 Å²	49	26%	0.256	26%	0.263	S	S	.	.	P	Polyproline II helix	trans	-64.2	152.5	-178	-57.4	-141.9	-69.1	0	0	111.3	K245 I246 S247	M219-K245 HydrophobicContact CG-CB 3.76Å; M219-I246 PolarHBondContact N-O 2.84Å; M219-S247 WeakPolarHBondContact O-CB 3.39Å; M219-S247 PolarHBondContact O-OG 2.86Å
220	P	90.8	Very high	90.2	Very high	70 Å²	70	48.1 Å²	48.1	46%	0.455	26%	0.258	S	S	.	.	P	Polyproline II helix	trans	-50.7	143.5	165.1	-25.1	33.5	0	0	0	111.4	H222 S247	P220-H222 PolarHBondContact O-ND1 2.87Å; P220-S247 PolarHBondContact O-OG 2.03Å
221	P	91.4	Very high	90.4	Very high	15 Å²	15	49.3 Å²	49.3	10%	0.097	27%	0.266	C	S	.	.	P	Polyproline II helix	trans	-62	150.2	-178.7	26.8	-34.7	0	0	0	111.3	T195 I200 Q210 S247	T195-P221 VanDerWaalsContact CG2-C 3.44Å; T195-P221 HydrophobicContact CG2-CB 4.16Å; T195-P221 HydrophobicContact CG2-CG 4.34Å; T195-P221 WeakPolarHBondContact CG2-O 3.06Å; I200-P221 HydrophobicContact CB-CG 4.27Å; I200-P221 HydrophobicContact CD1-CG 3.73Å; I200-P221 HydrophobicContact CG2-CB 3.68Å; I200-P221 HydrophobicContact CG2-CG 3.92Å; Q210-P221 HydrophobicContact CG-CB 4.41Å; Q210-P221 HydrophobicContact CG-CG 4.04Å; P221-S247 WeakPolarHBondContact CA-OG 3.49Å
222	H	94.3	Very high	90.5	Very high	13 Å²	13	54.6 Å²	54.6	6%	0.06	29%	0.29	C	S	.	.			trans	-154.4	139.1	-179.5	57.7	-85.7	0	0	0	111.3	S190 V192 D193 P220 I225	S190-H222 PolarHBondContact OG-NE2 2.98Å; V192-H222 WeakPolarHBondContact CB-O 3.48Å; V192-H222 PolarHBondContact N-O 2.91Å; V192-H222 VanDerWaalsContact N-O 3.09Å; D193-H222 CarbonylContact O-C 3.45Å; P220-H222 PolarHBondContact O-ND1 2.87Å; H222-I225 HydrophobicContact CB-CD1 3.8Å; H222-I225 HydrophobicContact CB-CG1 4.07Å
223	G	95.6	Very high	90.8	Very high	5 Å²	5	55.4 Å²	55.4	5%	0.052	29%	0.292	C	S	.	.	S	Bend	trans	-65.8	-63.1	176.4	0	0	0	0	0	112.3	Y191 V192 D193	Y191-G223 WeakPolarHBondContact CA-O 3.37Å; Y191-G223 WeakPolarHBondContact CB-O 3.44Å; V192-G223 PolarHBondContact N-O 2.92Å; D193-G223 WeakPolarHBondContact O-CA 3.43Å; D193-G223 PolarHBondContact O-N 3.13Å
224	Y	97.9	Very high	91	Very high	1 Å²	1	53.4 Å²	53.4	0%	0.004	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	134.9	174.7	171.3	-125.5	0	0	0	111.3	Y150 L152 S190 H226 A259 Q262 I270 L309 Y314	Y150-Y224 PolarHBondContact OH-OH 3.22Å; L152-Y224 HydrophobicContact CD1-CD2 3.95Å; L152-Y224 HydrophobicContact CD1-CE2 3.43Å; L152-Y224 VanDerWaalsContact CD1-CE2 3.43Å; S190-Y224 WeakPolarHBondContact O-CD2 3.5Å; Y224-H226 HydrophobicContact CE1-CB 4.49Å; Y224-A259 HydrophobicContact CD2-CB 3.7Å; Y224-A259 HydrophobicContact CG-CB 3.84Å; Y224-Q262 HydrophobicContact CD1-CB 3.52Å; Y224-Q262 HydrophobicContact CD1-CG 4.19Å; Y224-Q262 HydrophobicContact CE1-CB 3.62Å; Y224-I270 WeakPolarHBondContact OH-CD1 3.32Å; Y224-L309 HydrophobicContact CD1-CD2 3.89Å; Y224-L309 HydrophobicContact CE1-CD1 4.25Å; Y224-L309 HydrophobicContact CE1-CD2 3.82Å; Y224-L309 HydrophobicContact CE1-CG 4.47Å; Y224-Y314 PolarHBondContact O-N 3.3Å
225	I	97.3	Very high	91.4	Very high	41 Å²	41	48.5 Å²	48.5	21%	0.21	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	122.7	171.9	-61.6	176.8	0	0	0	109	G189 S190 H222 V227 V313	G189-I225 CarbonylContact C-O 3.59Å; G189-I225 VanDerWaalsContact CA-O 3.23Å; G189-I225 WeakPolarHBondContact CA-O 3.44Å; S190-I225 PolarHBondContact N-O 3.48Å; S190-I225 PolarHBondContact O-N 2.95Å; H222-I225 HydrophobicContact CB-CD1 3.8Å; H222-I225 HydrophobicContact CB-CG1 4.07Å; I225-V227 HydrophobicContact CG2-CG2 4.18Å; I225-V313 HydrophobicContact CG1-CG1 4.35Å; I225-V313 HydrophobicContact CG1-CG2 4.26Å
226	H	97.8	Very high	91.9	Very high	3 Å²	3	45.2 Å²	45.2	1%	0.014	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	124.1	164.2	175.9	71.2	0	0	0	109.3	Y150 Y224 L228 S229 H269 I270 L309 N312	Y150-H226 AromaticContact CE2-CE1 3.85Å; Y150-H226 AromaticContact CE2-ND1 3.76Å; Y150-H226 AromaticContact CZ-ND1 3.63Å; Y150-H226 PolarHBondContact OH-ND1 2.69Å; Y224-H226 HydrophobicContact CE1-CB 4.49Å; H226-L228 PolarHBondContact CE1-O 3.37Å; H226-L228 VanDerWaalsContact CE1-O 3.29Å; H226-S229 PolarHBondContact CE1-N 2.88Å; H226-S229 PolarHBondContact NE2-N 3.43Å; H226-S229 PolarHBondContact NE2-OG 3.44Å; H226-S229 VanDerWaalsContact NE2-OG 3.13Å; H226-H269 PolarHBondContact NE2-O 2.73Å; H226-I270 WeakPolarHBondContact ND1-CD1 3.29Å; H226-L309 HydrophobicContact CB-CD1 4Å; H226-N312 HydrophobicContact CB-CB 4.07Å; H226-N312 PolarHBondContact N-O 3.45Å; H226-N312 WeakPolarHBondContact O-CB 3.4Å
227	V	95.8	Very high	92.1	Very high	44 Å²	44	41.3 Å²	41.3	27%	0.267	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	-43.3	-175	-179	0	0	0	0	111.6	F188 I225 A240	F188-V227 HydrophobicContact CD1-CB 3.85Å; F188-V227 HydrophobicContact CD1-CG1 4.29Å; F188-V227 HydrophobicContact CD1-CG2 3.85Å; F188-V227 HydrophobicContact CE1-CG2 4.27Å; F188-V227 PolarHBondContact O-N 3.45Å; I225-V227 HydrophobicContact CG2-CG2 4.18Å; V227-A240 HydrophobicContact CG1-CB 3.97Å
228	L	95.6	Very high	92.2	Very high	27 Å²	27	38.8 Å²	38.8	14%	0.141	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	121.1	-174.3	179.1	62.9	0	0	0	110.9	G187 F188 H226 T231 E236 F237 A240	G187-L228 CarbonylContact C-O 3.57Å; G187-L228 VanDerWaalsContact CA-O 3.3Å; G187-L228 WeakPolarHBondContact CA-O 3.41Å; F188-L228 HydrophobicContact CB-CB 4.21Å; F188-L228 PolarHBondContact N-O 3.19Å; F188-L228 PolarHBondContact O-N 3.16Å; H226-L228 PolarHBondContact CE1-O 3.37Å; H226-L228 VanDerWaalsContact CE1-O 3.29Å; L228-T231 HydrophobicContact CD1-CG2 4.08Å; L228-T231 HydrophobicContact CD2-CG2 3.93Å; L228-T231 HydrophobicContact CG-CG2 4.14Å; L228-E236 HydrophobicContact CD1-CB 4.36Å; L228-E236 HydrophobicContact CD2-CB 4.38Å; L228-F237 VanDerWaalsContact CD2-CA 3.43Å; L228-F237 HydrophobicContact CD2-CB 3.97Å; L228-F237 HydrophobicContact CD2-CD2 4.32Å; L228-A240 HydrophobicContact CB-CB 4.03Å; L228-A240 HydrophobicContact CD2-CB 3.89Å
229	S	97.3	Very high	92.2	Very high	57 Å²	57	43.8 Å²	43.8	40%	0.399	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	153.8	169.8	-47.1	0	0	0	0	111.2	H226 T231 H269 I270	H226-S229 PolarHBondContact CE1-N 2.88Å; H226-S229 PolarHBondContact NE2-N 3.43Å; H226-S229 PolarHBondContact NE2-OG 3.44Å; H226-S229 VanDerWaalsContact NE2-OG 3.13Å; S229-T231 PolarHBondContact O-N 3.2Å; S229-H269 PolarHBondContact OG-O 2.68Å; S229-I270 WeakPolarHBondContact CA-O 3.46Å
230	L	95.9	Very high	92.2	Very high	14 Å²	14	41.9 Å²	41.9	7%	0.073	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.1	106	-177.4	-77.1	158	0	0	0	112.2	D148 R185 L186 I270 W272	D148-L230 HydrophobicContact CB-CD1 3.89Å; D148-L230 HydrophobicContact CB-CD2 3.92Å; R185-L230 HydrophobicContact CB-CB 4.12Å; R185-L230 HydrophobicContact CB-CD2 4.11Å; L186-L230 WeakPolarHBondContact O-CA 3.13Å; L230-I270 HydrophobicContact CD1-CG2 3.98Å; L230-I270 HydrophobicContact CG-CG2 4.4Å; L230-I270 WeakPolarHBondContact CG-O 3.49Å; L230-I270 PolarHBondContact N-O 2.97Å; L230-W272 HydrophobicContact CD1-CD2 3.77Å; L230-W272 HydrophobicContact CD1-CE3 3.42Å; L230-W272 VanDerWaalsContact CD1-CE3 3.42Å; L230-W272 HydrophobicContact CD1-CG 4.27Å; L230-W272 HydrophobicContact CD1-CZ3 3.92Å
231	T	93.1	Very high	92	Very high	30 Å²	30	38.6 Å²	38.6	18%	0.184	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	153.6	-176.3	-175.4	0	0	0	0	111.2	R185 L186 L228 S229 N233 E236	R185-T231 WeakPolarHBondContact CA-O 3.43Å; L186-T231 PolarHBondContact N-O 2.81Å; L186-T231 PolarHBondContact O-N 3.03Å; L228-T231 HydrophobicContact CD1-CG2 4.08Å; L228-T231 HydrophobicContact CD2-CG2 3.93Å; L228-T231 HydrophobicContact CG-CG2 4.14Å; S229-T231 PolarHBondContact O-N 3.2Å; T231-N233 VanDerWaalsContact C-N 3.32Å; T231-N233 PolarHBondContact OG1-N 2.87Å; T231-N233 VanDerWaalsContact OG1-N 3.14Å; T231-E236 HydrophobicContact CG2-CB 4.3Å; T231-E236 PolarHBondContact OG1-OE2 3.49Å
232	E	89.5	Confident	91.7	Very high	116 Å²	116	44.9 Å²	44.9	54%	0.542	23%	0.232	S	C	.	.	S	Bend	trans	-84.8	-12.5	171	-63.9	168.1	-154.7	0	0	110.9	R185 I234	R185-E232 HydrophobicContact CG-CG 3.69Å; R185-E232 IonicContact CZ-OE1 3.18Å; R185-E232 IonicContact NE-OE1 2.71Å; R185-E232 PolarHBondContact NE-OE1 3.48Å; R185-E232 IonicContact NH2-OE1 2.73Å; R185-E232 PolarHBondContact NH2-OE1 2.04Å; E232-I234 PolarHBondContact O-N 2.03Å; E232-I234 VanDerWaalsContact O-N 3.13Å
233	N	89.3	Confident	91.4	Very high	57 Å²	57	53.5 Å²	53.5	31%	0.305	26%	0.264	S	S	.	.			trans	-82.3	90.8	-178.4	-169	-3.5	0	0	0	111.7	T231 T235 E236 F237	T231-N233 VanDerWaalsContact C-N 3.32Å; T231-N233 PolarHBondContact OG1-N 2.87Å; T231-N233 VanDerWaalsContact OG1-N 3.14Å; N233-T235 PolarHBondContact O-N 3.29Å; N233-T235 VanDerWaalsContact O-N 3.08Å; N233-T235 WeakPolarHBondContact OD1-CB 3.12Å; N233-T235 PolarHBondContact OD1-N 2.76Å; N233-T235 PolarHBondContact OD1-OG1 2.82Å; N233-E236 HydrophobicContact CB-CB 4.24Å; N233-E236 HydrophobicContact CB-CG 4.22Å; N233-E236 WeakPolarHBondContact ND2-CG 3.04Å; N233-E236 PolarHBondContact ND2-OE1 2.87Å; N233-E236 WeakPolarHBondContact O-CB 3.46Å; N233-E236 PolarHBondContact O-N 3.24Å; N233-F237 PolarHBondContact O-N 2.88Å
234	I	84.3	Confident	91	Very high	55 Å²	55	54.6 Å²	54.6	28%	0.282	27%	0.268	S	S	.	.	H	α-helix	trans	-50.5	-35.5	174.9	-54.5	166.9	0	0	0	111.4	S174 E232 E236 F237 E238	S174-I234 VanDerWaalsContact OG-CD1 3.25Å; S174-I234 WeakPolarHBondContact OG-CD1 3.35Å; E232-I234 PolarHBondContact O-N 2.03Å; E232-I234 VanDerWaalsContact O-N 3.13Å; I234-E236 VanDerWaalsContact C-N 3.27Å; I234-E236 PolarHBondContact O-N 2.86Å; I234-F237 WeakPolarHBondContact O-CB 3.32Å; I234-F237 PolarHBondContact O-N 2.84Å; I234-F237 VanDerWaalsContact O-N 3.12Å; I234-E238 HydrophobicContact CG2-CG 4.41Å; I234-E238 PolarHBondContact O-N 3.08Å
235	T	87.2	Confident	90.4	Very high	68 Å²	68	59.3 Å²	59.3	42%	0.417	29%	0.288	S	S	.	.	H	α-helix	trans	-65.1	-26.8	178.5	-21.3	0	0	0	0	113.7	N233 K239	N233-T235 PolarHBondContact O-N 3.29Å; N233-T235 VanDerWaalsContact O-N 3.08Å; N233-T235 WeakPolarHBondContact OD1-CB 3.12Å; N233-T235 PolarHBondContact OD1-N 2.76Å; N233-T235 PolarHBondContact OD1-OG1 2.82Å; T235-K239 WeakPolarHBondContact O-CB 3.4Å; T235-K239 WeakPolarHBondContact O-CD 3.29Å; T235-K239 WeakPolarHBondContact O-CG 3.05Å; T235-K239 PolarHBondContact O-N 2.9Å
236	E	90.3	Very high	90.1	Very high	85 Å²	85	58 Å²	58	40%	0.397	28%	0.282	S	S	.	.	H	α-helix	trans	-77.4	-38	172.4	-80.1	159.2	-161	0	0	111	L228 T231 N233 I234 K239 A240	L228-E236 HydrophobicContact CD1-CB 4.36Å; L228-E236 HydrophobicContact CD2-CB 4.38Å; T231-E236 HydrophobicContact CG2-CB 4.3Å; T231-E236 PolarHBondContact OG1-OE2 3.49Å; N233-E236 HydrophobicContact CB-CB 4.24Å; N233-E236 HydrophobicContact CB-CG 4.22Å; N233-E236 WeakPolarHBondContact ND2-CG 3.04Å; N233-E236 PolarHBondContact ND2-OE1 2.87Å; N233-E236 WeakPolarHBondContact O-CB 3.46Å; N233-E236 PolarHBondContact O-N 3.24Å; I234-E236 VanDerWaalsContact C-N 3.27Å; I234-E236 PolarHBondContact O-N 2.86Å; E236-K239 PolarHBondContact O-N 3.19Å; E236-A240 VanDerWaalsContact O-CB 3.32Å; E236-A240 WeakPolarHBondContact O-CB 3.43Å; E236-A240 PolarHBondContact O-N 3.49Å
237	F	88.3	Confident	89.8	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-61.3	-49	172.8	-178.4	-90.8	0	0	0	111.9	Y151 L186 F188 L228 N233 I234 K239 A240 V241	Y151-F237 HydrophobicContact CD1-CZ 4.41Å; Y151-F237 AromaticContact CD2-CE2 3.6Å; Y151-F237 HydrophobicContact CD2-CE2 3.6Å; Y151-F237 AromaticContact CD2-CZ 3.49Å; Y151-F237 HydrophobicContact CD2-CZ 3.49Å; Y151-F237 VanDerWaalsContact CD2-CZ 3.49Å; Y151-F237 HydrophobicContact CE2-CE2 4.15Å; Y151-F237 AromaticContact CE2-CZ 3.68Å; Y151-F237 HydrophobicContact CE2-CZ 3.68Å; Y151-F237 HydrophobicContact CG-CE2 4.07Å; Y151-F237 AromaticContact CG-CZ 3.87Å; Y151-F237 HydrophobicContact CG-CZ 3.87Å; L186-F237 HydrophobicContact CB-CB 4.31Å; L186-F237 HydrophobicContact CB-CD2 3.77Å; L186-F237 HydrophobicContact CB-CE2 4.34Å; L186-F237 HydrophobicContact CB-CG 4.1Å; L186-F237 HydrophobicContact CD1-CB 4.41Å; L186-F237 HydrophobicContact CD1-CD1 4.25Å; L186-F237 HydrophobicContact CD1-CD2 4.47Å; L186-F237 HydrophobicContact CD1-CG 4.12Å; F188-F237 HydrophobicContact CB-CD2 4.35Å; F188-F237 HydrophobicContact CB-CE2 4.1Å; F188-F237 HydrophobicContact CD2-CE2 4.06Å; F188-F237 HydrophobicContact CD2-CZ 4.31Å; L228-F237 VanDerWaalsContact CD2-CA 3.43Å; L228-F237 HydrophobicContact CD2-CB 3.97Å; L228-F237 HydrophobicContact CD2-CD2 4.32Å; N233-F237 PolarHBondContact O-N 2.88Å; I234-F237 WeakPolarHBondContact O-CB 3.32Å; I234-F237 PolarHBondContact O-N 2.84Å; I234-F237 VanDerWaalsContact O-N 3.12Å; F237-K239 VanDerWaalsContact C-N 3.32Å; F237-K239 PolarHBondContact O-N 3.1Å; F237-A240 PolarHBondContact O-N 3.22Å; F237-A240 VanDerWaalsContact O-N 3.09Å; F237-V241 HydrophobicContact CD1-CG2 4.12Å; F237-V241 HydrophobicContact CE1-CG2 3.69Å; F237-V241 HydrophobicContact CE2-CG2 4.2Å; F237-V241 HydrophobicContact CZ-CG2 3.74Å; F237-V241 WeakPolarHBondContact O-CG2 3Å; F237-V241 PolarHBondContact O-N 3.48Å
238	E	85.9	Confident	89.3	Confident	57 Å²	57	55.9 Å²	55.9	27%	0.266	27%	0.27	S	S	.	.	H	α-helix	trans	-58	-42.6	174.9	-70.3	-179.9	149.1	0	0	111.9	N167 N171 I234 A240 H242	N167-E238 PolarHBondContact OD1-O 3.14Å; N171-E238 PolarHBondContact ND2-OE1 3.25Å; I234-E238 HydrophobicContact CG2-CG 4.41Å; I234-E238 PolarHBondContact O-N 3.08Å; E238-A240 PolarHBondContact O-N 2.81Å; E238-H242 WeakPolarHBondContact O-CB 3.26Å; E238-H242 PolarHBondContact O-N 3.45Å
239	K	89	Confident	88.9	Confident	110 Å²	110	56 Å²	56	48%	0.478	27%	0.271	S	S	.	.	H	α-helix	trans	-67.2	-33.2	175.4	-73.5	166.3	-170.3	161.5	0	112.9	T235 E236 F237 R243	T235-K239 WeakPolarHBondContact O-CB 3.4Å; T235-K239 WeakPolarHBondContact O-CD 3.29Å; T235-K239 WeakPolarHBondContact O-CG 3.05Å; T235-K239 PolarHBondContact O-N 2.9Å; E236-K239 PolarHBondContact O-N 3.19Å; F237-K239 VanDerWaalsContact C-N 3.32Å; F237-K239 PolarHBondContact O-N 3.1Å; K239-R243 WeakPolarHBondContact O-CB 3.14Å; K239-R243 VanDerWaalsContact O-CD 3.25Å; K239-R243 WeakPolarHBondContact O-CD 3.25Å; K239-R243 WeakPolarHBondContact O-CG 3.17Å; K239-R243 PolarHBondContact O-N 3.22Å
240	A	90.3	Very high	88.5	Confident	12 Å²	12	57.3 Å²	57.3	10%	0.099	27%	0.273	C	S	.	.	H	α-helix	trans	-70.7	-45.9	177.6	0	0	0	0	0	111.2	V227 L228 E236 F237 E238 R243 Q244	V227-A240 HydrophobicContact CG1-CB 3.97Å; L228-A240 HydrophobicContact CB-CB 4.03Å; L228-A240 HydrophobicContact CD2-CB 3.89Å; E236-A240 VanDerWaalsContact O-CB 3.32Å; E236-A240 WeakPolarHBondContact O-CB 3.43Å; E236-A240 PolarHBondContact O-N 3.49Å; F237-A240 PolarHBondContact O-N 3.22Å; F237-A240 VanDerWaalsContact O-N 3.09Å; E238-A240 PolarHBondContact O-N 2.81Å; A240-R243 PolarHBondContact O-N 2.03Å; A240-Q244 PolarHBondContact O-NE2 2.94Å
241	V	87	Confident	88.2	Confident	1 Å²	1	59.3 Å²	59.3	1%	0.006	28%	0.283	C	S	.	.	H	α-helix	trans	-66.3	-47.6	177	178.8	0	0	0	0	111.1	L166 N167 F188 F237 R243 Q244	L166-V241 HydrophobicContact CB-CG1 4Å; L166-V241 HydrophobicContact CD2-CG1 4Å; L166-V241 HydrophobicContact CG-CG1 4.1Å; N167-V241 WeakPolarHBondContact OD1-CB 3.49Å; N167-V241 WeakPolarHBondContact OD1-CG1 3.03Å; F188-V241 HydrophobicContact CD2-CG2 3.65Å; F188-V241 HydrophobicContact CE2-CG2 3.82Å; F188-V241 HydrophobicContact CG-CG2 4.29Å; F237-V241 HydrophobicContact CD1-CG2 4.12Å; F237-V241 HydrophobicContact CE1-CG2 3.69Å; F237-V241 HydrophobicContact CE2-CG2 4.2Å; F237-V241 HydrophobicContact CZ-CG2 3.74Å; F237-V241 WeakPolarHBondContact O-CG2 3Å; F237-V241 PolarHBondContact O-N 3.48Å; V241-R243 PolarHBondContact O-N 3.41Å; V241-R243 VanDerWaalsContact O-N 3.13Å; V241-Q244 WeakPolarHBondContact O-CB 2.93Å; V241-Q244 PolarHBondContact O-N 3.25Å
242	H	85.3	Confident	88	Confident	147 Å²	147	62 Å²	62	68%	0.681	30%	0.3	S	S	*	.	H	α-helix	trans	-64.7	-18.4	-179.5	-171.9	73.7	0	0	0	113.9	N167 E238	N167-H242 WeakPolarHBondContact OD1-CA 3.45Å; N167-H242 PolarHBondContact OD1-N 2.88Å; N167-H242 VanDerWaalsContact OD1-N 3.13Å; E238-H242 WeakPolarHBondContact O-CB 3.26Å; E238-H242 PolarHBondContact O-N 3.45Å
243	R	87.4	Confident	88.3	Confident	193 Å²	193	58 Å²	58	73%	0.728	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-9.5	173.8	-76.5	172.1	179.5	178.8	-2.6	114	K239 A240 V241	K239-R243 WeakPolarHBondContact O-CB 3.14Å; K239-R243 VanDerWaalsContact O-CD 3.25Å; K239-R243 WeakPolarHBondContact O-CD 3.25Å; K239-R243 WeakPolarHBondContact O-CG 3.17Å; K239-R243 PolarHBondContact O-N 3.22Å; A240-R243 PolarHBondContact O-N 2.03Å; V241-R243 PolarHBondContact O-N 3.41Å; V241-R243 VanDerWaalsContact O-N 3.13Å
244	Q	86.4	Confident	88.6	Confident	28 Å²	28	55.5 Å²	55.5	13%	0.131	27%	0.27	C	S	.	.	P	Polyproline II helix	trans	-73.7	129.9	175.7	-57	-45.9	-61	0	0	110.4	I163 F188 A240 V241	I163-Q244 HydrophobicContact CG2-CB 4.4Å; F188-Q244 HydrophobicContact CD1-CG 4.45Å; F188-Q244 HydrophobicContact CE1-CG 3.6Å; F188-Q244 HydrophobicContact CZ-CG 3.99Å; A240-Q244 PolarHBondContact O-NE2 2.94Å; V241-Q244 WeakPolarHBondContact O-CB 2.93Å; V241-Q244 PolarHBondContact O-N 3.25Å
245	K	86.1	Confident	89.2	Confident	100 Å²	100	52.9 Å²	52.9	44%	0.435	26%	0.257	S	S	.	.	P	Polyproline II helix	trans	-99.9	158.1	156.9	-61.9	-179.3	179.6	-179	0	108.5	D217 M219	D217-K245 IonicContact OD2-NZ 3.14Å; D217-K245 PolarHBondContact OD2-NZ 3.14Å; M219-K245 HydrophobicContact CG-CB 3.76Å
246	I	90.7	Very high	89.6	Confident	13 Å²	13	49.7 Å²	49.7	7%	0.067	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-58.4	164.5	162.4	53.2	167.2	0	0	0	111.4	V155 A157 H160 I163 L216 C218 M219	V155-I246 CarbonylContact O-C 3.54Å; V155-I246 WeakPolarHBondContact O-CA 3.02Å; A157-I246 HydrophobicContact CB-CD1 4.36Å; H160-I246 HydrophobicContact CB-CG2 3.8Å; I163-I246 HydrophobicContact CD1-CG2 3.86Å; L216-I246 HydrophobicContact CD1-CD1 4.42Å; C218-I246 CarbonylContact C-O 3.51Å; C218-I246 WeakPolarHBondContact CA-O 3.44Å; C218-I246 HydrophobicContact CB-CD1 4.4Å; C218-I246 HydrophobicContact CB-CG1 3.99Å; C218-I246 VanDerWaalsContact CB-O 3.28Å; C218-I246 WeakPolarHBondContact CB-O 3.36Å; M219-I246 PolarHBondContact N-O 2.84Å
247	S	91.6	Very high	90	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	22%	0.219	C	C	.	.			trans	-137.3	-159.2	170.5	-172	0	0	0	0	107.9	V155 A157 M219 P220 P221	V155-S247 PolarHBondContact O-N 3.06Å; A157-S247 PolarHBondContact N-O 2.04Å; M219-S247 WeakPolarHBondContact O-CB 3.39Å; M219-S247 PolarHBondContact O-OG 2.86Å; P220-S247 PolarHBondContact O-OG 2.03Å; P221-S247 WeakPolarHBondContact CA-OG 3.49Å
248	G	86	Confident	90.5	Very high	4 Å²	4	45.8 Å²	45.8	4%	0.041	22%	0.219	C	C	.	.			trans	-170	164	176.9	0	0	0	0	0	115.2	Q210	Q210-G248 WeakPolarHBondContact CG-O 3.27Å
249	N	86.9	Confident	91	Very high	29 Å²	29	43 Å²	43	16%	0.155	21%	0.207	C	C	.	.			trans	-128.6	-170	179.5	53.7	-25.5	0	0	0	109.1	V192 Y199 E254	V192-N249 HydrophobicContact CG1-CB 4.09Å; Y199-N249 CarbonylContact O-C 3.5Å; Y199-N249 WeakPolarHBondContact O-CA 3.42Å; Y199-N249 WeakPolarHBondContact O-CB 3.38Å; N249-E254 VanDerWaalsContact ND2-CD 3.26Å; N249-E254 PolarHBondContact ND2-OE1 2.78Å; N249-E254 PolarHBondContact ND2-OE2 3.36Å; N249-E254 PolarHBondContact OD1-OE1 2.85Å
250	I	88.3	Confident	91.5	Very high	85 Å²	85	37.8 Å²	37.8	44%	0.436	18%	0.184	S	C	.	.	S	Bend	trans	-122.1	-35.5	-175.9	-65.9	-63.3	0	0	0	113.2	Y199 S201	Y199-I250 PolarHBondContact O-N 2.87Å; S201-I250 VanDerWaalsContact N-CG1 3.34Å
251	D	89.3	Confident	91.9	Very high	56 Å²	56	37.2 Å²	37.2	30%	0.299	18%	0.179	S	C	.	.	S	Bend	trans	-89.5	-148.8	171.8	51.7	-14.7	0	0	0	111.6	Y199 H289	Y199-D251 WeakPolarHBondContact CA-OD1 3.08Å; Y199-D251 WeakPolarHBondContact CD1-OD2 2.97Å; D251-H289 IonicContact OD2-NE2 2.75Å
252	T	89.9	Confident	92.4	Very high	86 Å²	86	37.2 Å²	37.2	53%	0.528	18%	0.179	S	C	.	.	S	Bend	trans	-131.3	-31.6	-165.5	-50.3	0	0	0	0	113.9	Q286	T252-Q286 VanDerWaalsContact O-CB 3.27Å; T252-Q286 WeakPolarHBondContact O-CB 3.02Å; T252-Q286 WeakPolarHBondContact O-CG 3.44Å
253	P	94.7	Very high	93	Very high	33 Å²	33	30.2 Å²	30.2	21%	0.214	15%	0.146	C	C	.	.			trans	-77	154.6	167.5	-9.7	27.9	0	0	0	111.4	T287	P253-T287 CarbonylContact C-O 3.56Å; P253-T287 WeakPolarHBondContact CA-O 3.04Å
254	E	95.4	Very high	93.4	Very high	4 Å²	4	21 Å²	21	2%	0.019	11%	0.112	C	C	.	.	B	Isolated β-bridge	trans	-115.7	163.5	-176.8	-61.6	-63.8	158.8	0	0	112	Y191 N249 G256 Q286 T287 S288 H289	Y191-E254 HydrophobicContact CD2-CB 4.45Å; Y191-E254 HydrophobicContact CE2-CB 4.09Å; N249-E254 VanDerWaalsContact ND2-CD 3.26Å; N249-E254 PolarHBondContact ND2-OE1 2.78Å; N249-E254 PolarHBondContact ND2-OE2 3.36Å; N249-E254 PolarHBondContact OD1-OE1 2.85Å; E254-G256 PolarHBondContact O-N 2.87Å; E254-Q286 HydrophobicContact CG-CB 4Å; E254-Q286 HydrophobicContact CG-CG 4.48Å; E254-T287 PolarHBondContact N-O 3.25Å; E254-S288 CarbonylContact O-C 3.49Å; E254-S288 VanDerWaalsContact O-CA 3.3Å; E254-S288 WeakPolarHBondContact O-CA 2.99Å; E254-S288 PolarHBondContact O-OG 3.27Å; E254-H289 PolarHBondContact O-N 3.45Å
255	G	96.6	Very high	94	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	11%	0.113	C	C	.	.	S	Bend	trans	-75.2	19.9	178.1	0	0	0	0	0	115.2	V192 D193 F257 D258 A259	V192-G255 WeakPolarHBondContact O-CA 3.31Å; V192-G255 PolarHBondContact O-N 2.97Å; D193-G255 WeakPolarHBondContact OD1-CA 3.46Å; D193-G255 PolarHBondContact OD1-N 3Å; D193-G255 VanDerWaalsContact OD1-N 3.16Å; G255-F257 VanDerWaalsContact C-N 3.28Å; G255-F257 PolarHBondContact O-N 3.21Å; G255-F257 VanDerWaalsContact O-N 3.11Å; G255-D258 WeakPolarHBondContact O-CB 3.24Å; G255-D258 PolarHBondContact O-N 3.29Å; G255-A259 PolarHBondContact O-N 3.27Å
256	G	96.8	Very high	94.5	Very high	1 Å²	1	16.2 Å²	16.2	1%	0.01	9%	0.093	C	C	.	.	H	α-helix	trans	-54.2	-36.6	-169.1	0	0	0	0	0	114.6	Y191 E254 A259 M260	Y191-G256 VanDerWaalsContact CE2-CA 3.47Å; E254-G256 PolarHBondContact O-N 2.87Å; G256-A259 WeakPolarHBondContact O-CB 2.96Å; G256-A259 PolarHBondContact O-N 3.22Å; G256-M260 WeakPolarHBondContact O-CG 3.45Å; G256-M260 PolarHBondContact O-N 3.01Å
257	F	97.9	Very high	94.6	Very high	1 Å²	1	18.7 Å²	18.7	0%	0.004	10%	0.104	C	C	.	.	H	α-helix	trans	-73.9	-27.7	178.6	-65.9	-16.1	0	0	0	114.5	G255 A259 M260 L261 S288 H289 L290 P323 L325 L328 F341 W350 Y351 L354	G255-F257 VanDerWaalsContact C-N 3.28Å; G255-F257 PolarHBondContact O-N 3.21Å; G255-F257 VanDerWaalsContact O-N 3.11Å; F257-A259 VanDerWaalsContact C-N 3.34Å; F257-M260 HydrophobicContact CD1-SD 3.61Å; F257-M260 HydrophobicContact CE1-SD 3.92Å; F257-L261 WeakPolarHBondContact O-CB 3.49Å; F257-L261 PolarHBondContact O-N 3.2Å; F257-L261 VanDerWaalsContact O-N 3.07Å; F257-S288 WeakPolarHBondContact CB-OG 3.41Å; F257-S288 WeakPolarHBondContact CD2-OG 3.47Å; F257-S288 WeakPolarHBondContact CG-OG 3.39Å; F257-S288 PolarHBondContact N-OG 2.99Å; F257-H289 WeakPolarHBondContact CD2-O 3.43Å; F257-L290 HydrophobicContact CD2-CD2 4.04Å; F257-L290 HydrophobicContact CE2-CD2 3.68Å; F257-P323 HydrophobicContact CB-CG 4.05Å; F257-P323 VanDerWaalsContact O-CG 3.3Å; F257-P323 WeakPolarHBondContact O-CG 3.29Å; F257-L325 HydrophobicContact CD2-CD2 4.33Å; F257-L325 HydrophobicContact CE2-CD2 3.68Å; F257-L325 HydrophobicContact CZ-CD2 4.13Å; F257-L328 HydrophobicContact CB-CD2 4.2Å; F257-L328 HydrophobicContact CD1-CD2 3.84Å; F257-L328 HydrophobicContact CD2-CD2 4.5Å; F257-L328 HydrophobicContact CE1-CD2 4.34Å; F257-L328 HydrophobicContact CG-CD2 3.93Å; F257-F341 HydrophobicContact CE1-CE1 4.29Å; F257-F341 HydrophobicContact CE1-CZ 4.49Å; F257-W350 AromaticContact CE2-CH2 3.78Å; F257-W350 HydrophobicContact CE2-CH2 3.78Å; F257-W350 HydrophobicContact CE2-CZ3 4.34Å; F257-W350 AromaticContact CZ-CH2 3.76Å; F257-W350 HydrophobicContact CZ-CH2 3.76Å; F257-W350 AromaticContact CZ-CZ3 3.85Å; F257-W350 HydrophobicContact CZ-CZ3 3.85Å; F257-Y351 HydrophobicContact CE1-CE1 4.15Å; F257-Y351 HydrophobicContact CZ-CE1 4.39Å; F257-L354 HydrophobicContact CE2-CD1 4.29Å; F257-L354 HydrophobicContact CZ-CD1 3.71Å
258	D	98.2	Very high	94.7	Very high	1 Å²	1	23.8 Å²	23.8	1%	0.005	14%	0.14	C	C	.	.	H	α-helix	trans	-62.6	-47.2	167.2	-92	-10.4	0	0	0	109.6	K194 G255 L261 Q262 Y314 H322 P323	K194-D258 IonicContact NZ-OD1 3.37Å; K194-D258 IonicContact NZ-OD2 3.61Å; K194-D258 PolarHBondContact NZ-OD2 3.35Å; G255-D258 WeakPolarHBondContact O-CB 3.24Å; G255-D258 PolarHBondContact O-N 3.29Å; D258-L261 PolarHBondContact O-N 3.16Å; D258-Q262 WeakPolarHBondContact O-CG 3.37Å; D258-Q262 PolarHBondContact O-N 2.03Å; D258-Y314 HydrophobicContact CB-CD1 4.39Å; D258-Y314 HydrophobicContact CB-CE1 3.97Å; D258-Y314 WeakPolarHBondContact OD2-CE1 3.36Å; D258-H322 WeakPolarHBondContact OD1-CA 3.45Å; D258-P323 VanDerWaalsContact OD1-CD 3.27Å; D258-P323 WeakPolarHBondContact OD1-CD 3.23Å
259	A	98.3	Very high	95.1	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-64.2	-42.5	-178.3	0	0	0	0	0	112	L152 Y191 Y224 G255 G256 F257 A263	L152-A259 HydrophobicContact CD1-CB 4.06Å; L152-A259 HydrophobicContact CD2-CB 3.99Å; L152-A259 HydrophobicContact CG-CB 4.36Å; Y191-A259 HydrophobicContact CD1-CB 3.94Å; Y191-A259 HydrophobicContact CG-CB 3.88Å; Y224-A259 HydrophobicContact CD2-CB 3.7Å; Y224-A259 HydrophobicContact CG-CB 3.84Å; G255-A259 PolarHBondContact O-N 3.27Å; G256-A259 WeakPolarHBondContact O-CB 2.96Å; G256-A259 PolarHBondContact O-N 3.22Å; F257-A259 VanDerWaalsContact C-N 3.34Å; A259-A263 VanDerWaalsContact O-CB 3.27Å; A259-A263 WeakPolarHBondContact O-CB 3.45Å; A259-A263 PolarHBondContact O-N 3.49Å
260	M	98.2	Very high	95.7	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-62.1	-44.4	174	-74.6	179.2	62.4	0	0	112.5	L152 G256 F257 A263 A264 L280 V282 L328 L332 V339 F341	L152-M260 HydrophobicContact CD2-CB 4.23Å; L152-M260 HydrophobicContact CD2-CG 3.58Å; G256-M260 WeakPolarHBondContact O-CG 3.45Å; G256-M260 PolarHBondContact O-N 3.01Å; F257-M260 HydrophobicContact CD1-SD 3.61Å; F257-M260 HydrophobicContact CE1-SD 3.92Å; M260-A263 PolarHBondContact O-N 3.13Å; M260-A264 WeakPolarHBondContact O-CB 3.37Å; M260-A264 PolarHBondContact O-N 3.42Å; M260-L280 HydrophobicContact CB-CD2 4.22Å; M260-L280 HydrophobicContact CE-CD2 4.39Å; M260-L280 HydrophobicContact CG-CD2 4.13Å; M260-V282 HydrophobicContact CE-CG2 4.3Å; M260-V282 HydrophobicContact CG-CG2 3.79Å; M260-V282 HydrophobicContact SD-CG1 4.41Å; M260-V282 HydrophobicContact SD-CG2 3.82Å; M260-L328 HydrophobicContact CB-CD1 4.04Å; M260-L328 HydrophobicContact CE-CD1 4.43Å; M260-L328 HydrophobicContact CE-CD2 4.06Å; M260-L328 HydrophobicContact SD-CD2 4.41Å; M260-L332 HydrophobicContact CE-CD1 4.24Å; M260-V339 HydrophobicContact CE-CB 4.33Å; M260-V339 HydrophobicContact CE-CG1 3.69Å; M260-V339 HydrophobicContact CE-CG2 3.79Å; M260-F341 HydrophobicContact CE-CE1 3.88Å; M260-F341 HydrophobicContact CE-CZ 3.86Å; M260-F341 HydrophobicContact SD-CE1 3.65Å; M260-F341 HydrophobicContact SD-CZ 4.17Å
261	L	98.1	Very high	96	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-62.9	-48.3	179.3	-176.4	84.4	0	0	0	110.8	F257 D258 A263 A264 V265 N303 P323 L328 K331	F257-L261 WeakPolarHBondContact O-CB 3.49Å; F257-L261 PolarHBondContact O-N 3.2Å; F257-L261 VanDerWaalsContact O-N 3.07Å; D258-L261 PolarHBondContact O-N 3.16Å; L261-A263 PolarHBondContact O-N 2.8Å; L261-A264 WeakPolarHBondContact O-CA 3.03Å; L261-A264 WeakPolarHBondContact O-CB 3.02Å; L261-A264 PolarHBondContact O-N 3.3Å; L261-V265 WeakPolarHBondContact O-CG2 3.34Å; L261-V265 PolarHBondContact O-N 3.47Å; L261-N303 WeakPolarHBondContact CD2-OD1 3.49Å; L261-P323 HydrophobicContact CB-CG 4.05Å; L261-P323 HydrophobicContact CD1-CB 4.25Å; L261-P323 HydrophobicContact CD2-CB 4.05Å; L261-P323 HydrophobicContact CD2-CG 4.2Å; L261-L328 HydrophobicContact CB-CD1 4.27Å; L261-L328 HydrophobicContact CD1-CD1 4.39Å; L261-K331 HydrophobicContact CD1-CB 4.11Å; L261-K331 HydrophobicContact CD1-CG 4.09Å
262	Q	98.3	Very high	96.3	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-63.6	-41.7	178.6	-67.2	-58.9	-72.9	0	0	111.9	Y224 D258 A264 V265 C266 N306 Y314	Y224-Q262 HydrophobicContact CD1-CB 3.52Å; Y224-Q262 HydrophobicContact CD1-CG 4.19Å; Y224-Q262 HydrophobicContact CE1-CB 3.62Å; D258-Q262 WeakPolarHBondContact O-CG 3.37Å; D258-Q262 PolarHBondContact O-N 2.03Å; Q262-A264 PolarHBondContact O-N 2.82Å; Q262-V265 PolarHBondContact O-N 3.34Å; Q262-C266 WeakPolarHBondContact O-CB 3.37Å; Q262-C266 PolarHBondContact O-N 3.01Å; Q262-C266 PolarHBondContact O-SG 2.94Å; Q262-C266 VanDerWaalsContact O-SG 3.39Å; Q262-N306 PolarHBondContact NE2-O 3.45Å; Q262-Y314 HydrophobicContact CG-CD1 4.36Å; Q262-Y314 HydrophobicContact CG-CD2 3.44Å; Q262-Y314 VanDerWaalsContact CG-CD2 3.44Å; Q262-Y314 HydrophobicContact CG-CE2 3.67Å; Q262-Y314 HydrophobicContact CG-CG 3.83Å
263	A	98.1	Very high	96.2	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-62.2	-26	172.3	0	0	0	0	0	112.9	Y150 L152 A259 M260 L261 W272 L280	Y150-A263 HydrophobicContact CD1-CB 4.17Å; Y150-A263 HydrophobicContact CE1-CB 4.02Å; L152-A263 HydrophobicContact CD1-CB 4.39Å; A259-A263 VanDerWaalsContact O-CB 3.27Å; A259-A263 WeakPolarHBondContact O-CB 3.45Å; A259-A263 PolarHBondContact O-N 3.49Å; M260-A263 PolarHBondContact O-N 3.13Å; L261-A263 PolarHBondContact O-N 2.8Å; A263-W272 PolarHBondContact O-NE1 2.86Å; A263-L280 HydrophobicContact CB-CD1 4.13Å
264	A	96.6	Very high	95.5	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-80	-47.5	175.6	0	0	0	0	0	113.5	M260 L261 Q262 L332 N335 I337	M260-A264 WeakPolarHBondContact O-CB 3.37Å; M260-A264 PolarHBondContact O-N 3.42Å; L261-A264 WeakPolarHBondContact O-CA 3.03Å; L261-A264 WeakPolarHBondContact O-CB 3.02Å; L261-A264 PolarHBondContact O-N 3.3Å; Q262-A264 PolarHBondContact O-N 2.82Å; A264-L332 HydrophobicContact CB-CD2 4.26Å; A264-N335 VanDerWaalsContact O-CG 3.29Å; A264-I337 VanDerWaalsContact CA-CD1 3.49Å; A264-I337 HydrophobicContact CB-CD1 3.83Å
265	V	97.3	Very high	94.6	Very high	26 Å²	26	27.2 Å²	27.2	16%	0.158	15%	0.145	C	C	.	.	H	α-helix	trans	-91.5	-16.6	-169.7	-54.1	0	0	0	0	114.4	L261 Q262 E267 N306 C307 K331	L261-V265 WeakPolarHBondContact O-CG2 3.34Å; L261-V265 PolarHBondContact O-N 3.47Å; Q262-V265 PolarHBondContact O-N 3.34Å; V265-E267 PolarHBondContact O-N 3.06Å; V265-E267 VanDerWaalsContact O-N 3.14Å; V265-N306 VanDerWaalsContact CG2-C 3.49Å; V265-C307 HydrophobicContact CG2-CB 4.11Å; V265-K331 HydrophobicContact CG1-CB 3.81Å; V265-K331 HydrophobicContact CG1-CD 3.98Å; V265-K331 HydrophobicContact CG1-CG 3.93Å
266	C	97.5	Very high	93.9	Very high	2 Å²	2	27.4 Å²	27.4	1%	0.014	15%	0.146	C	C	.	.			trans	-86.2	46.6	177.9	-65.9	0	0	0	0	113.2	Q262 S268 H269 I270 C307 L309	Q262-C266 WeakPolarHBondContact O-CB 3.37Å; Q262-C266 PolarHBondContact O-N 3.01Å; Q262-C266 PolarHBondContact O-SG 2.94Å; Q262-C266 VanDerWaalsContact O-SG 3.39Å; C266-S268 PolarHBondContact O-N 3.15Å; C266-H269 HydrophobicContact CB-CB 4.23Å; C266-H269 PolarHBondContact O-N 3.16Å; C266-I270 HydrophobicContact CB-CG1 4.41Å; C266-I270 PolarHBondContact O-N 2.9Å; C266-I270 VanDerWaalsContact O-N 3.11Å; C266-C307 WeakPolarHBondContact CA-SG 3.45Å; C266-C307 HydrophobicContact CB-CB 4.01Å; C266-C307 WeakPolarHBondContact CB-SG 3.47Å; C266-C307 WeakPolarHBondContact SG-CA 3.42Å; C266-C307 WeakPolarHBondContact SG-CB 3.5Å; C266-C307 CovalentContact SG-SG 2.03Å; C266-C307 PolarHBondContact SG-SG 2.97Å; C266-L309 HydrophobicContact CB-CD1 3.81Å; C266-L309 HydrophobicContact CB-CG 4.38Å
267	E	93.7	Very high	93.3	Very high	65 Å²	65	27.6 Å²	27.6	30%	0.304	15%	0.147	S	C	.	.	H	α-helix	trans	-43.8	-45.6	-172	-68.1	-165.4	-71.8	0	0	114.5	V265 H269 G271 W272 R278	V265-E267 PolarHBondContact O-N 3.06Å; V265-E267 VanDerWaalsContact O-N 3.14Å; E267-H269 PolarHBondContact O-N 3Å; E267-G271 WeakPolarHBondContact O-CA 3.35Å; E267-G271 PolarHBondContact O-N 3.37Å; E267-W272 PolarHBondContact O-N 3.09Å; E267-R278 IonicContact OE2-CZ 2.77Å; E267-R278 IonicContact OE2-NH1 2.79Å; E267-R278 PolarHBondContact OE2-NH1 3.24Å; E267-R278 IonicContact OE2-NH2 3.2Å; E267-R278 PolarHBondContact OE2-NH2 3.2Å
268	S	92.6	Very high	93	Very high	107 Å²	107	28 Å²	28	75%	0.748	15%	0.148	S	C	*	.	H	α-helix	trans	-71	-23.5	-177.5	56.7	0	0	0	0	115	C266	C266-S268 PolarHBondContact O-N 3.15Å
269	H	95.6	Very high	92.7	Very high	63 Å²	63	28.1 Å²	28.1	29%	0.292	15%	0.149	S	C	.	.	H	α-helix	trans	-87.8	-41.7	177.5	-63.8	68.1	0	0	0	110.5	H226 S229 C266 E267 L309	H226-H269 PolarHBondContact NE2-O 2.73Å; S229-H269 PolarHBondContact OG-O 2.68Å; C266-H269 HydrophobicContact CB-CB 4.23Å; C266-H269 PolarHBondContact O-N 3.16Å; E267-H269 PolarHBondContact O-N 3Å; H269-L309 HydrophobicContact CB-CD1 3.97Å
270	I	97.8	Very high	92.6	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-71.3	-34.7	177.9	-50.5	-53.2	0	0	0	111.1	Y150 Y224 H226 S229 L230 C266 W272	Y150-I270 HydrophobicContact CD2-CG2 3.56Å; Y150-I270 HydrophobicContact CE2-CD1 4.31Å; Y150-I270 HydrophobicContact CE2-CG2 3.85Å; Y150-I270 HydrophobicContact CG-CG2 4Å; Y224-I270 WeakPolarHBondContact OH-CD1 3.32Å; H226-I270 WeakPolarHBondContact ND1-CD1 3.29Å; S229-I270 WeakPolarHBondContact CA-O 3.46Å; L230-I270 HydrophobicContact CD1-CG2 3.98Å; L230-I270 HydrophobicContact CG-CG2 4.4Å; L230-I270 WeakPolarHBondContact CG-O 3.49Å; L230-I270 PolarHBondContact N-O 2.97Å; C266-I270 HydrophobicContact CB-CG1 4.41Å; C266-I270 PolarHBondContact O-N 2.9Å; C266-I270 VanDerWaalsContact O-N 3.11Å; I270-W272 HydrophobicContact CB-CG 4.44Å; I270-W272 HydrophobicContact CG2-CD2 4.12Å; I270-W272 HydrophobicContact CG2-CG 4.29Å; I270-W272 HydrophobicContact CG2-CZ2 4.15Å
271	G	96.3	Very high	92.4	Very high	28 Å²	28	28.1 Å²	28.1	29%	0.289	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	91	24.5	-179.8	0	0	0	0	0	114.2	E267 R273	E267-G271 WeakPolarHBondContact O-CA 3.35Å; E267-G271 PolarHBondContact O-N 3.37Å; G271-R273 PolarHBondContact O-N 3.16Å
272	W	94.3	Very high	92.3	Very high	13 Å²	13	28.2 Å²	28.2	5%	0.049	15%	0.149	C	C	.	.			trans	-62.3	120.8	-176.5	-69.6	125.6	0	0	0	112.2	D148 Y150 L230 A263 E267 I270 R278 L279 I337	D148-W272 HydrophobicContact CB-CE3 3.66Å; D148-W272 HydrophobicContact CB-CZ3 3.67Å; Y150-W272 VanDerWaalsContact CB-CH2 3.44Å; Y150-W272 HydrophobicContact CG-CZ2 4.39Å; L230-W272 HydrophobicContact CD1-CD2 3.77Å; L230-W272 HydrophobicContact CD1-CE3 3.42Å; L230-W272 VanDerWaalsContact CD1-CE3 3.42Å; L230-W272 HydrophobicContact CD1-CG 4.27Å; L230-W272 HydrophobicContact CD1-CZ3 3.92Å; A263-W272 PolarHBondContact O-NE1 2.86Å; E267-W272 PolarHBondContact O-N 3.09Å; I270-W272 HydrophobicContact CB-CG 4.44Å; I270-W272 HydrophobicContact CG2-CD2 4.12Å; I270-W272 HydrophobicContact CG2-CG 4.29Å; I270-W272 HydrophobicContact CG2-CZ2 4.15Å; W272-R278 HydrophobicContact CD2-CB 4.47Å; W272-R278 HydrophobicContact CD2-CG 4.27Å; W272-R278 HydrophobicContact CE3-CB 3.79Å; W272-R278 HydrophobicContact CE3-CG 3.69Å; W272-R278 HydrophobicContact CH2-CB 4.41Å; W272-R278 HydrophobicContact CZ3-CB 3.77Å; W272-R278 HydrophobicContact CZ3-CG 4.19Å; W272-R278 PolarHBondContact O-NH2 2.94Å; W272-L279 WeakPolarHBondContact CH2-O 3.22Å; W272-I337 HydrophobicContact CZ2-CD1 4.07Å; W272-I337 HydrophobicContact CZ2-CG1 4.41Å
273	R	88.3	Confident	92.1	Very high	22 Å²	22	28.3 Å²	28.3	8%	0.083	15%	0.15	C	C	.	.			trans	-73.8	156.3	172.9	-68.3	-175.3	-70.7	175.9	-6.5	111.8	D148 D183 G271 E275 A276 R278	D148-R273 IonicContact OD1-CZ 2.9Å; D148-R273 VanDerWaalsContact OD1-CZ 3.22Å; D148-R273 IonicContact OD1-NE 3.8Å; D148-R273 PolarHBondContact OD1-NE 3.06Å; D148-R273 IonicContact OD1-NH2 2.6Å; D148-R273 PolarHBondContact OD1-NH2 3Å; D148-R273 WeakPolarHBondContact OD2-CB 3.25Å; D148-R273 PolarHBondContact OD2-N 3.35Å; D148-R273 IonicContact OD2-NE 2.69Å; D183-R273 IonicContact OD1-CZ 2.81Å; D183-R273 IonicContact OD1-NH1 2.72Å; D183-R273 PolarHBondContact OD1-NH1 2.72Å; D183-R273 IonicContact OD1-NH2 3.64Å; D183-R273 PolarHBondContact OD1-NH2 2.94Å; D183-R273 IonicContact OD2-CZ 2.83Å; D183-R273 IonicContact OD2-NH1 2.79Å; D183-R273 PolarHBondContact OD2-NH1 3.02Å; D183-R273 IonicContact OD2-NH2 2.61Å; G271-R273 PolarHBondContact O-N 3.16Å; R273-E275 HydrophobicContact CB-CG 4.47Å; R273-E275 WeakPolarHBondContact CD-OE1 3.44Å; R273-A276 HydrophobicContact CB-CB 3.87Å; R273-R278 VanDerWaalsContact O-CZ 3.24Å; R273-R278 PolarHBondContact O-NE 3Å; R273-R278 PolarHBondContact O-NH2 3.37Å
274	K	80	Confident	92	Very high	161 Å²	161	28.3 Å²	28.3	70%	0.7	15%	0.15	S	C	*	.	S	Bend	trans	-90.8	-24.4	-176.8	-63.6	-174	177.7	-174	0	112.1
275	E	75.7	Confident	91.8	Very high	82 Å²	82	29.4 Å²	29.4	38%	0.383	16%	0.155	S	C	.	.	S	Bend	trans	-91.1	-13.6	-178.8	65.1	-82.6	-165.7	0	0	113.9	R273 N456	R273-E275 HydrophobicContact CB-CG 4.47Å; R273-E275 WeakPolarHBondContact CD-OE1 3.44Å; E275-N456 HydrophobicContact CB-CB 3.81Å
276	A	83.5	Confident	91.7	Very high	3 Å²	3	29.5 Å²	29.5	3%	0.025	15%	0.154	C	C	.	.	S	Bend	trans	-91.4	152.7	-176.5	0	0	0	0	0	113.2	P146 D148 R273 R278	P146-A276 HydrophobicContact CB-CB 3.97Å; P146-A276 CarbonylContact O-C 3.59Å; P146-A276 WeakPolarHBondContact O-CA 3.28Å; D148-A276 HydrophobicContact CB-CB 4.38Å; R273-A276 HydrophobicContact CB-CB 3.87Å; A276-R278 PolarHBondContact O-N 3.04Å
277	K	84.3	Confident	91.6	Very high	6 Å²	6	31 Å²	31	3%	0.026	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	110.5	163.3	-65.9	-64.5	-171.7	-176.2	0	108.3	Y145 P146 D148 Y381 L384 I453 G454	Y145-K277 HydrophobicContact CD1-CD 4.49Å; Y145-K277 HydrophobicContact CD1-CG 4.17Å; Y145-K277 HydrophobicContact CG-CG 4Å; P146-K277 PolarHBondContact O-N 3.39Å; D148-K277 PolarHBondContact N-O 3.41Å; D148-K277 VanDerWaalsContact N-O 3.07Å; K277-Y381 HydrophobicContact CB-CE2 4.39Å; K277-Y381 HydrophobicContact CG-CE2 4.46Å; K277-L384 HydrophobicContact CB-CD2 4.05Å; K277-L384 HydrophobicContact CD-CD2 4.23Å; K277-L384 HydrophobicContact CG-CD2 4.39Å; K277-I453 PolarHBondContact NZ-O 3.24Å; K277-G454 WeakPolarHBondContact CD-O 3.35Å; K277-G454 WeakPolarHBondContact CE-O 3.35Å; K277-G454 PolarHBondContact NZ-O 3.24Å
278	R	89.9	Confident	91.7	Very high	10 Å²	10	28.1 Å²	28.1	4%	0.038	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	117.2	-179.6	-58.5	171.5	175.4	-161.2	-13.4	110.5	E267 W272 R273 A276 N335 I337 N338	E267-R278 IonicContact OE2-CZ 2.77Å; E267-R278 IonicContact OE2-NH1 2.79Å; E267-R278 PolarHBondContact OE2-NH1 3.24Å; E267-R278 IonicContact OE2-NH2 3.2Å; E267-R278 PolarHBondContact OE2-NH2 3.2Å; W272-R278 HydrophobicContact CD2-CB 4.47Å; W272-R278 HydrophobicContact CD2-CG 4.27Å; W272-R278 HydrophobicContact CE3-CB 3.79Å; W272-R278 HydrophobicContact CE3-CG 3.69Å; W272-R278 HydrophobicContact CH2-CB 4.41Å; W272-R278 HydrophobicContact CZ3-CB 3.77Å; W272-R278 HydrophobicContact CZ3-CG 4.19Å; W272-R278 PolarHBondContact O-NH2 2.94Å; R273-R278 VanDerWaalsContact O-CZ 3.24Å; R273-R278 PolarHBondContact O-NE 3Å; R273-R278 PolarHBondContact O-NH2 3.37Å; A276-R278 PolarHBondContact O-N 3.04Å; R278-N335 WeakPolarHBondContact CD-O 3.01Å; R278-N335 PolarHBondContact NH1-O 3.43Å; R278-I337 HydrophobicContact CB-CG1 3.87Å; R278-N338 PolarHBondContact O-N 3.17Å; R278-N338 PolarHBondContact O-ND2 3.44Å
279	L	92.4	Very high	92	Very high	3 Å²	3	23.5 Å²	23.5	2%	0.016	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	120.2	177.2	-71	177.1	0	0	0	110.6	V147 D148 L149 Y150 W272 N338 I340 Y381 L384	V147-L279 HydrophobicContact CG1-CD1 3.92Å; V147-L279 HydrophobicContact CG1-CG 4.48Å; D148-L279 PolarHBondContact O-N 2.92Å; L149-L279 WeakPolarHBondContact CA-O 3.32Å; L149-L279 HydrophobicContact CD1-CB 3.57Å; L149-L279 HydrophobicContact CD1-CD1 4.25Å; Y150-L279 PolarHBondContact N-O 2.89Å; W272-L279 WeakPolarHBondContact CH2-O 3.22Å; L279-N338 WeakPolarHBondContact CA-O 3.15Å; L279-N338 HydrophobicContact CD2-CB 4.32Å; L279-I340 HydrophobicContact CD1-CD1 4.5Å; L279-I340 HydrophobicContact CD2-CD1 4.16Å; L279-Y381 HydrophobicContact CD1-CD2 4.23Å; L279-L384 HydrophobicContact CD2-CD2 3.76Å; L279-L384 HydrophobicContact CG-CD2 4.46Å
280	L	95.7	Very high	92	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	109.3	172.1	179.4	61.3	0	0	0	109	Y150 L152 M260 A263 V282 L332 I337 N338 V339 I340	Y150-L280 HydrophobicContact CD1-CD1 3.73Å; Y150-L280 HydrophobicContact CG-CD1 4.49Å; L152-L280 HydrophobicContact CB-CD1 3.85Å; L152-L280 HydrophobicContact CD2-CD1 4.3Å; M260-L280 HydrophobicContact CB-CD2 4.22Å; M260-L280 HydrophobicContact CE-CD2 4.39Å; M260-L280 HydrophobicContact CG-CD2 4.13Å; A263-L280 HydrophobicContact CB-CD1 4.13Å; L280-V282 HydrophobicContact CD2-CG2 4.5Å; L280-V282 HydrophobicContact CG-CG2 4.12Å; L280-L332 HydrophobicContact CD2-CD2 4.45Å; L280-I337 HydrophobicContact CB-CG2 3.56Å; L280-I337 HydrophobicContact CD2-CG2 4.29Å; L280-N338 PolarHBondContact N-O 2.9Å; L280-V339 HydrophobicContact CB-CG2 4.45Å; L280-V339 HydrophobicContact CD2-CG2 4.36Å; L280-V339 CarbonylContact O-C 3.5Å; L280-V339 WeakPolarHBondContact O-CA 3.35Å; L280-I340 PolarHBondContact O-N 3.02Å
281	L	95.4	Very high	91.9	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	109.8	-179.6	172.9	59.4	0	0	0	109.8	L149 Y150 Y151 L152 M283 I340 A342 L373 V377	L149-L281 HydrophobicContact CD1-CB 3.91Å; Y150-L281 PolarHBondContact O-N 2.99Å; Y151-L281 HydrophobicContact CD1-CD2 3.71Å; Y151-L281 HydrophobicContact CD1-CG 4.41Å; Y151-L281 HydrophobicContact CE1-CD2 3.41Å; Y151-L281 VanDerWaalsContact CE1-CD2 3.41Å; Y151-L281 HydrophobicContact CE2-CD2 4.31Å; Y151-L281 HydrophobicContact CG-CD2 4.29Å; L152-L281 PolarHBondContact N-O 3.02Å; L281-M283 HydrophobicContact CD1-CG 4.42Å; L281-M283 HydrophobicContact CG-CG 4.21Å; L281-I340 HydrophobicContact CD1-CB 3.86Å; L281-I340 HydrophobicContact CD1-CG2 3.72Å; L281-A342 HydrophobicContact CD1-CB 3.69Å; L281-L373 HydrophobicContact CD1-CD1 4.07Å; L281-L373 HydrophobicContact CD2-CD1 4.24Å; L281-L373 HydrophobicContact CD2-CD2 4.47Å; L281-V377 HydrophobicContact CD1-CG2 4.12Å; L281-V377 HydrophobicContact CD2-CG2 3.78Å
282	V	96.1	Very high	91.9	Very high	2 Å²	2	29.1 Å²	29.1	1%	0.012	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	116.8	-177.6	-175.8	0	0	0	0	108.7	L152 Y191 M260 L280 V339 I340 F341 A342	L152-V282 HydrophobicContact CD2-CG2 4.26Å; L152-V282 WeakPolarHBondContact O-CA 3.48Å; Y191-V282 HydrophobicContact CE1-CG1 4.49Å; M260-V282 HydrophobicContact CE-CG2 4.3Å; M260-V282 HydrophobicContact CG-CG2 3.79Å; M260-V282 HydrophobicContact SD-CG1 4.41Å; M260-V282 HydrophobicContact SD-CG2 3.82Å; L280-V282 HydrophobicContact CD2-CG2 4.5Å; L280-V282 HydrophobicContact CG-CG2 4.12Å; V282-V339 HydrophobicContact CG2-CG1 3.61Å; V282-I340 PolarHBondContact N-O 3.4Å; V282-F341 HydrophobicContact CB-CD1 3.97Å; V282-F341 HydrophobicContact CB-CE1 4.42Å; V282-F341 HydrophobicContact CG1-CD1 4.18Å; V282-F341 HydrophobicContact CG1-CE1 4.47Å; V282-F341 HydrophobicContact CG2-CD1 4.35Å; V282-F341 HydrophobicContact CG2-CE1 4.38Å; V282-A342 PolarHBondContact O-N 3.2Å
283	M	93.9	Very high	92.1	Very high	1 Å²	1	31.2 Å²	31.2	1%	0.005	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	128	-179.5	-64.6	-179.2	61.7	0	0	111	Y151 L152 V153 D154 M159 L166 Y191 L281 A342 I366 A370 L373	Y151-M283 HydrophobicContact CD1-SD 3.99Å; Y151-M283 HydrophobicContact CE1-SD 4.07Å; L152-M283 PolarHBondContact O-N 3.01Å; V153-M283 HydrophobicContact CG1-CB 4.41Å; V153-M283 HydrophobicContact CG2-CB 4.27Å; V153-M283 HydrophobicContact CG2-CG 4.45Å; V153-M283 HydrophobicContact CG2-SD 4.08Å; D154-M283 WeakPolarHBondContact CB-O 3.35Å; D154-M283 PolarHBondContact N-O 3.3Å; M159-M283 HydrophobicContact CE-CB 4.07Å; L166-M283 HydrophobicContact CD1-CE 4.05Å; L166-M283 HydrophobicContact CD1-SD 3.89Å; Y191-M283 PolarHBondContact OH-O 3.44Å; L281-M283 HydrophobicContact CD1-CG 4.42Å; L281-M283 HydrophobicContact CG-CG 4.21Å; M283-A342 WeakPolarHBondContact CA-O 3.37Å; M283-A342 HydrophobicContact CG-CB 4.1Å; M283-I366 HydrophobicContact CE-CD1 4.42Å; M283-A370 HydrophobicContact CE-CB 4.08Å; M283-L373 HydrophobicContact CE-CD2 3.72Å; M283-L373 HydrophobicContact SD-CD2 3.65Å
284	T	94.6	Very high	92.5	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.5	162	179.1	-179.9	0	0	0	0	111.3	D154 Y191 Q286 A342 V343 Q344 Y351	D154-T284 WeakPolarHBondContact OD2-CA 3.3Å; D154-T284 VanDerWaalsContact OD2-CB 3.25Å; D154-T284 WeakPolarHBondContact OD2-CB 3.02Å; D154-T284 PolarHBondContact OD2-OG1 3.35Å; Y191-T284 WeakPolarHBondContact OH-CB 3.49Å; T284-Q286 WeakPolarHBondContact CG2-O 3.44Å; T284-Q286 PolarHBondContact OG1-N 3.48Å; T284-Q286 PolarHBondContact OG1-O 3.08Å; T284-A342 PolarHBondContact N-O 2.05Å; T284-V343 HydrophobicContact CG2-CG1 4.48Å; T284-V343 HydrophobicContact CG2-CG2 4.48Å; T284-V343 WeakPolarHBondContact O-CA 3.43Å; T284-Q344 PolarHBondContact O-N 3.04Å; T284-Y351 HydrophobicContact CG2-CE2 4.19Å
285	D	93	Very high	93.2	Very high	23 Å²	23	29.1 Å²	29.1	12%	0.123	15%	0.15	C	C	.	.	S	Bend	trans	-109.3	2.9	163.8	84.3	-31.9	0	0	0	114	S158 M159 Q344 Q347	S158-D285 WeakPolarHBondContact CB-OD1 3.36Å; S158-D285 WeakPolarHBondContact CB-OD2 3.44Å; S158-D285 PolarHBondContact OG-OD1 2.77Å; M159-D285 HydrophobicContact SD-CB 4.23Å; D285-Q344 HydrophobicContact CB-CB 3.73Å; D285-Q347 WeakPolarHBondContact O-CG 3.47Å; D285-Q347 PolarHBondContact O-NE2 3.2Å; D285-Q347 VanDerWaalsContact O-NE2 3.07Å
286	Q	94.6	Very high	94.2	Very high	29 Å²	29	31.8 Å²	31.8	14%	0.136	17%	0.166	C	C	.	.	S	Bend	trans	-118.5	178.4	179.8	-57.9	-44.7	-36.9	0	0	113.5	T252 E254 T284 Y351	T252-Q286 VanDerWaalsContact O-CB 3.27Å; T252-Q286 WeakPolarHBondContact O-CB 3.02Å; T252-Q286 WeakPolarHBondContact O-CG 3.44Å; E254-Q286 HydrophobicContact CG-CB 4Å; E254-Q286 HydrophobicContact CG-CG 4.48Å; T284-Q286 WeakPolarHBondContact CG2-O 3.44Å; T284-Q286 PolarHBondContact OG1-N 3.48Å; T284-Q286 PolarHBondContact OG1-O 3.08Å; Q286-Y351 VanDerWaalsContact O-CE2 3.32Å; Q286-Y351 WeakPolarHBondContact O-CE2 3.11Å; Q286-Y351 PolarHBondContact O-OH 2.93Å
287	T	95.7	Very high	94.7	Very high	34 Å²	34	32.9 Å²	32.9	21%	0.209	18%	0.175	C	C	.	.	P	Polyproline II helix	trans	-88.4	154.4	172.7	50.2	0	0	0	0	111.4	P253 E254 Q347 W350	P253-T287 CarbonylContact C-O 3.56Å; P253-T287 WeakPolarHBondContact CA-O 3.04Å; E254-T287 PolarHBondContact N-O 3.25Å; T287-Q347 HydrophobicContact CG2-CB 4.5Å; T287-Q347 HydrophobicContact CG2-CG 4.16Å; T287-W350 HydrophobicContact CG2-CB 4.11Å; T287-W350 HydrophobicContact CG2-CD2 3.72Å; T287-W350 HydrophobicContact CG2-CE3 3.99Å; T287-W350 HydrophobicContact CG2-CG 3.79Å
288	S	96.8	Very high	95.3	Very high	3 Å²	3	35.3 Å²	35.3	2%	0.021	20%	0.201	C	C	.	.	B	Isolated β-bridge	trans	-85.7	145.5	170.9	-176.4	0	0	0	0	112	E254 F257 W350 Y351	E254-S288 CarbonylContact O-C 3.49Å; E254-S288 VanDerWaalsContact O-CA 3.3Å; E254-S288 WeakPolarHBondContact O-CA 2.99Å; E254-S288 PolarHBondContact O-OG 3.27Å; F257-S288 WeakPolarHBondContact CB-OG 3.41Å; F257-S288 WeakPolarHBondContact CD2-OG 3.47Å; F257-S288 WeakPolarHBondContact CG-OG 3.39Å; F257-S288 PolarHBondContact N-OG 2.99Å; S288-W350 WeakPolarHBondContact O-CH2 3.2Å; S288-W350 WeakPolarHBondContact O-CZ2 3.39Å; S288-Y351 PolarHBondContact N-OH 3.44Å; S288-Y351 VanDerWaalsContact N-OH 3.17Å
289	H	97.5	Very high	95.7	Very high	11 Å²	11	35.4 Å²	35.4	5%	0.051	20%	0.202	C	C	.	.	P	Polyproline II helix	trans	-59.5	154.9	161.7	-91	-54.2	0	0	0	112.6	D193 Y199 D251 E254 F257 D293 H322	D193-H289 IonicContact OD2-CD2 3.01Å; D193-H289 PolarHBondContact OD2-CD2 2.97Å; D193-H289 IonicContact OD2-NE2 3.51Å; Y199-H289 AromaticContact CD1-NE2 3.58Å; Y199-H289 AromaticContact CE1-CD2 3.95Å; Y199-H289 AromaticContact CE1-CE1 3.91Å; Y199-H289 AromaticContact CE1-NE2 3.39Å; Y199-H289 WeakPolarHBondContact CE1-NE2 3.28Å; D251-H289 IonicContact OD2-NE2 2.75Å; E254-H289 PolarHBondContact O-N 3.45Å; F257-H289 WeakPolarHBondContact CD2-O 3.43Å; H289-D293 HydrophobicContact CB-CB 4.48Å; H289-D293 IonicContact CE1-OD2 3.82Å; H289-D293 IonicContact CG-OD2 3.27Å; H289-D293 WeakPolarHBondContact ND1-CB 3.5Å; H289-D293 IonicContact ND1-OD2 3.56Å; H289-D293 PolarHBondContact ND1-OD2 2.91Å; H289-H322 WeakPolarHBondContact CB-CE1 3.35Å; H289-H322 AromaticContact CG-CE1 3.94Å; H289-H322 AromaticContact CG-NE2 3.9Å
290	L	96.2	Very high	95.8	Very high	60 Å²	60	39.7 Å²	39.7	31%	0.314	23%	0.228	S	C	.	.			trans	-114.5	164.4	-179.8	-60.6	179.6	0	0	0	111.7	F257 D293 H322 L325 W350	F257-L290 HydrophobicContact CD2-CD2 4.04Å; F257-L290 HydrophobicContact CE2-CD2 3.68Å; L290-D293 PolarHBondContact N-OD2 3.13Å; L290-D293 WeakPolarHBondContact O-CB 3.31Å; L290-D293 PolarHBondContact O-N 3.45Å; L290-H322 PolarHBondContact O-CD2 2.88Å; L290-L325 HydrophobicContact CD2-CG 4.39Å; L290-W350 HydrophobicContact CD2-CH2 4.33Å; L290-W350 HydrophobicContact CD2-CZ2 4.21Å
291	A	95.9	Very high	95.9	Very high	31 Å²	31	43.6 Å²	43.6	26%	0.256	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.8	145.6	167.6	0	0	0	0	0	111.2	D293 H322	A291-D293 VanDerWaalsContact C-N 3.28Å; A291-D293 PolarHBondContact O-N 2.86Å; A291-H322 WeakPolarHBondContact CA-O 3.26Å; A291-H322 WeakPolarHBondContact CB-O 3.4Å
292	L	96.4	Very high	95.9	Very high	118 Å²	118	47.9 Å²	47.9	62%	0.618	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.4	-15.9	-170.4	-48.7	173	0	0	0	116.8	S294 K295	L292-S294 VanDerWaalsContact C-N 3.28Å; L292-S294 PolarHBondContact O-N 2.79Å; L292-K295 WeakPolarHBondContact O-CB 3.33Å; L292-K295 PolarHBondContact O-N 2.85Å
293	D	97.1	Very high	96	Very high	56 Å²	56	48.3 Å²	48.3	30%	0.299	28%	0.282	S	S	.	.	G	3₁₀ helix	trans	-63.6	-38.8	174.8	-69.5	-14.3	0	0	0	111.3	Y199 H289 L290 A291 K295 L296	Y199-D293 PolarHBondContact OH-O 2.89Å; H289-D293 HydrophobicContact CB-CB 4.48Å; H289-D293 IonicContact CE1-OD2 3.82Å; H289-D293 IonicContact CG-OD2 3.27Å; H289-D293 WeakPolarHBondContact ND1-CB 3.5Å; H289-D293 IonicContact ND1-OD2 3.56Å; H289-D293 PolarHBondContact ND1-OD2 2.91Å; L290-D293 PolarHBondContact N-OD2 3.13Å; L290-D293 WeakPolarHBondContact O-CB 3.31Å; L290-D293 PolarHBondContact O-N 3.45Å; A291-D293 VanDerWaalsContact C-N 3.28Å; A291-D293 PolarHBondContact O-N 2.86Å; D293-K295 PolarHBondContact O-N 2.85Å; D293-L296 WeakPolarHBondContact O-CB 3.13Å; D293-L296 WeakPolarHBondContact O-CG 3.26Å; D293-L296 PolarHBondContact O-N 2.96Å
294	S	96.6	Very high	96.2	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-49.8	-22.3	173.5	44.2	0	0	0	0	114.9	Y199 L292 L296 A297 I299 E321	Y199-S294 VanDerWaalsContact OH-CA 3.22Å; Y199-S294 WeakPolarHBondContact OH-CA 3.41Å; Y199-S294 PolarHBondContact OH-N 2.89Å; L292-S294 VanDerWaalsContact C-N 3.28Å; L292-S294 PolarHBondContact O-N 2.79Å; S294-L296 PolarHBondContact O-N 2.93Å; S294-A297 PolarHBondContact O-N 3.35Å; S294-A297 VanDerWaalsContact O-N 3.08Å; S294-I299 CarbonylContact C-O 3.5Å; S294-I299 VanDerWaalsContact C-O 3.26Å; S294-I299 WeakPolarHBondContact O-CB 3.17Å; S294-I299 PolarHBondContact O-N 3.44Å; S294-I299 VanDerWaalsContact O-N 3.11Å; S294-E321 VanDerWaalsContact OG-CA 3.29Å; S294-E321 WeakPolarHBondContact OG-CA 3.48Å; S294-E321 WeakPolarHBondContact OG-CB 3.42Å; S294-E321 WeakPolarHBondContact OG-CG 3.3Å; S294-E321 PolarHBondContact OG-OE1 3.45Å
295	K	96.3	Very high	96.2	Very high	140 Å²	140	51.5 Å²	51.5	61%	0.609	30%	0.3	S	S	*	.	G	3₁₀ helix	trans	-61.2	-26.7	175.2	-174.3	173.8	178.6	178.1	0	112.8	L292 D293 A297 G298 I299 V300	L292-K295 WeakPolarHBondContact O-CB 3.33Å; L292-K295 PolarHBondContact O-N 2.85Å; D293-K295 PolarHBondContact O-N 2.85Å; K295-A297 VanDerWaalsContact C-N 3.27Å; K295-A297 PolarHBondContact O-N 3.38Å; K295-G298 PolarHBondContact O-N 3.42Å; K295-I299 WeakPolarHBondContact CA-O 3.39Å; K295-I299 PolarHBondContact N-O 3.45Å; K295-V300 HydrophobicContact CG-CG1 4.1Å
296	L	95.6	Very high	96.4	Very high	138 Å²	138	54.7 Å²	54.7	72%	0.723	32%	0.318	S	S	*	.	G	3₁₀ helix	trans	-64.8	-32.2	175	-64.3	177.3	0	0	0	112.2	P198 D293 S294 G298	P198-L296 HydrophobicContact CG-CB 4.33Å; D293-L296 WeakPolarHBondContact O-CB 3.13Å; D293-L296 WeakPolarHBondContact O-CG 3.26Å; D293-L296 PolarHBondContact O-N 2.96Å; S294-L296 PolarHBondContact O-N 2.93Å; L296-G298 VanDerWaalsContact C-N 3.28Å
297	A	95.1	Very high	96.6	Very high	26 Å²	26	55.6 Å²	55.6	22%	0.215	33%	0.327	C	S	.	.	G	3₁₀ helix	trans	-86.3	8.7	171.7	0	0	0	0	0	114	V196 S197 Y199 S294 K295 I299	V196-A297 HydrophobicContact CB-CB 4.38Å; V196-A297 HydrophobicContact CG2-CB 3.54Å; S197-A297 WeakPolarHBondContact O-CA 3.27Å; S197-A297 WeakPolarHBondContact O-CB 3.45Å; Y199-A297 HydrophobicContact CD2-CB 4.31Å; Y199-A297 HydrophobicContact CE2-CB 3.52Å; S294-A297 PolarHBondContact O-N 3.35Å; S294-A297 VanDerWaalsContact O-N 3.08Å; K295-A297 VanDerWaalsContact C-N 3.27Å; K295-A297 PolarHBondContact O-N 3.38Å; A297-I299 HydrophobicContact CB-CD1 4.37Å; A297-I299 HydrophobicContact CB-CG1 4.48Å; A297-I299 PolarHBondContact O-N 3.06Å
298	G	96.6	Very high	96.7	Very high	57 Å²	57	55.7 Å²	55.7	59%	0.588	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.3	6.2	-175.4	0	0	0	0	0	114.8	K295 L296 V300	K295-G298 PolarHBondContact O-N 3.42Å; L296-G298 VanDerWaalsContact C-N 3.28Å; G298-V300 PolarHBondContact O-N 3.39Å
299	I	97.6	Very high	96.7	Very high	11 Å²	11	56.2 Å²	56.2	6%	0.056	33%	0.327	C	S	.	.			trans	-83.1	113.2	176	-62	168	0	0	0	108.4	K194 V196 S294 K295 A297 T318 M320 E321	K194-I299 HydrophobicContact CD-CD1 4.06Å; V196-I299 HydrophobicContact CG2-CD1 3.94Å; S294-I299 CarbonylContact C-O 3.5Å; S294-I299 VanDerWaalsContact C-O 3.26Å; S294-I299 WeakPolarHBondContact O-CB 3.17Å; S294-I299 PolarHBondContact O-N 3.44Å; S294-I299 VanDerWaalsContact O-N 3.11Å; K295-I299 WeakPolarHBondContact CA-O 3.39Å; K295-I299 PolarHBondContact N-O 3.45Å; A297-I299 HydrophobicContact CB-CD1 4.37Å; A297-I299 HydrophobicContact CB-CG1 4.48Å; A297-I299 PolarHBondContact O-N 3.06Å; I299-T318 VanDerWaalsContact CD1-C 3.45Å; I299-T318 WeakPolarHBondContact CD1-O 3.26Å; I299-M320 WeakPolarHBondContact CG2-O 3.12Å; I299-E321 HydrophobicContact CG2-CG 4.43Å
300	V	95.6	Very high	96.6	Very high	93 Å²	93	62.3 Å²	62.3	56%	0.564	35%	0.354	S	S	*	.			trans	-129.8	15.6	-173.9	-61.6	0	0	0	0	113.4	K295 G298 P302	K295-V300 HydrophobicContact CG-CG1 4.1Å; G298-V300 PolarHBondContact O-N 3.39Å; V300-P302 WeakPolarHBondContact O-CD 3.49Å
301	V	96.9	Very high	96.5	Very high	83 Å²	83	66.5 Å²	66.5	50%	0.503	38%	0.376	S	S	.	.	S	Bend	trans	-95.7	111	175.2	-179.1	0	0	0	0	107.7	T319 M320 E321	V301-T319 WeakPolarHBondContact CB-O 3.35Å; V301-M320 CarbonylContact O-C 2.98Å; V301-M320 WeakPolarHBondContact O-CA 3.44Å; V301-E321 WeakPolarHBondContact O-CG 3.47Å; V301-E321 PolarHBondContact O-N 3.17Å
302	P	96.7	Very high	96.5	Very high	90 Å²	90	68.2 Å²	68.2	58%	0.584	38%	0.381	S	S	*	.			trans	-55.4	148.3	-177.7	-27.1	36	0	0	0	112.2	V300 D304	V300-P302 WeakPolarHBondContact O-CD 3.49Å; P302-D304 PolarHBondContact O-N 3.1Å
303	N	97.8	Very high	96.5	Very high	11 Å²	11	65.5 Å²	65.5	6%	0.059	37%	0.369	C	S	.	.			trans	-60.1	135.5	174.8	-157.3	-62.8	0	0	0	110.2	L261 G305 E321 P323 Q327	L261-N303 WeakPolarHBondContact CD2-OD1 3.49Å; N303-G305 PolarHBondContact OD1-N 3.3Å; N303-G305 VanDerWaalsContact OD1-N 3.15Å; N303-E321 WeakPolarHBondContact CB-O 3.25Å; N303-E321 PolarHBondContact ND2-O 2.95Å; N303-P323 HydrophobicContact CB-CB 4.41Å; N303-Q327 PolarHBondContact O-NE2 3.35Å
304	D	96.7	Very high	96.6	Very high	62 Å²	62	63.1 Å²	63.1	33%	0.332	36%	0.356	S	S	.	.			trans	-92.5	-7.2	-175.1	73.8	-13.7	0	0	0	113.9	P302 N306 H308 M320	P302-D304 PolarHBondContact O-N 3.1Å; D304-N306 VanDerWaalsContact C-N 3.29Å; D304-N306 PolarHBondContact O-N 2.84Å; D304-N306 PolarHBondContact OD1-N 2.94Å; D304-N306 PolarHBondContact OD2-ND2 3.38Å; D304-H308 VanDerWaalsContact CG-NE2 3.26Å; D304-H308 IonicContact OD1-CD2 2.67Å; D304-H308 IonicContact OD1-CE1 2.67Å; D304-H308 IonicContact OD1-NE2 3.67Å; D304-H308 PolarHBondContact OD1-NE2 3.39Å; D304-H308 IonicContact OD2-CE1 2.66Å; D304-H308 PolarHBondContact OD2-CE1 2.94Å; D304-H308 VanDerWaalsContact OD2-CE1 3.27Å; D304-H308 IonicContact OD2-NE2 2.75Å; D304-H308 PolarHBondContact OD2-NE2 2.87Å; D304-M320 HydrophobicContact CB-CE 4.1Å
305	G	96.4	Very high	96.6	Very high	5 Å²	5	66.9 Å²	66.9	5%	0.052	38%	0.379	C	S	.	.	S	Bend	trans	75.1	12.5	-179.1	0	0	0	0	0	114.8	N303	N303-G305 PolarHBondContact OD1-N 3.3Å; N303-G305 VanDerWaalsContact OD1-N 3.15Å
306	N	97.3	Very high	96.6	Very high	90 Å²	90	63.8 Å²	63.8	48%	0.481	37%	0.365	S	S	.	.	S	Bend	trans	-103.1	166.3	-178.1	-62.3	-55.4	0	0	0	112.9	Q262 V265 D304 H308	Q262-N306 PolarHBondContact NE2-O 3.45Å; V265-N306 VanDerWaalsContact CG2-C 3.49Å; D304-N306 VanDerWaalsContact C-N 3.29Å; D304-N306 PolarHBondContact O-N 2.84Å; D304-N306 PolarHBondContact OD1-N 2.94Å; D304-N306 PolarHBondContact OD2-ND2 3.38Å; N306-H308 PolarHBondContact O-CD2 3.42Å
307	C	97.8	Very high	96.6	Very high	48 Å²	48	57.4 Å²	57.4	32%	0.324	33%	0.332	S	S	.	.			trans	-78.3	124.6	173.7	-178.6	0	0	0	0	111.4	V265 C266	V265-C307 HydrophobicContact CG2-CB 4.11Å; C266-C307 WeakPolarHBondContact CA-SG 3.45Å; C266-C307 HydrophobicContact CB-CB 4.01Å; C266-C307 WeakPolarHBondContact CB-SG 3.47Å; C266-C307 WeakPolarHBondContact SG-CA 3.42Å; C266-C307 WeakPolarHBondContact SG-CB 3.5Å; C266-C307 CovalentContact SG-SG 2.03Å; C266-C307 PolarHBondContact SG-SG 2.97Å
308	H	97.7	Very high	96.6	Very high	36 Å²	36	58.7 Å²	58.7	17%	0.167	34%	0.338	C	S	.	.			trans	-130.7	38	175.3	-53.7	-91.6	0	0	0	112.1	D304 N306 Y314 V315 K316	D304-H308 VanDerWaalsContact CG-NE2 3.26Å; D304-H308 IonicContact OD1-CD2 2.67Å; D304-H308 IonicContact OD1-CE1 2.67Å; D304-H308 IonicContact OD1-NE2 3.67Å; D304-H308 PolarHBondContact OD1-NE2 3.39Å; D304-H308 IonicContact OD2-CE1 2.66Å; D304-H308 PolarHBondContact OD2-CE1 2.94Å; D304-H308 VanDerWaalsContact OD2-CE1 3.27Å; D304-H308 IonicContact OD2-NE2 2.75Å; D304-H308 PolarHBondContact OD2-NE2 2.87Å; N306-H308 PolarHBondContact O-CD2 3.42Å; H308-Y314 HydrophobicContact CB-CD2 4.07Å; H308-Y314 HydrophobicContact CB-CE2 3.97Å; H308-V315 WeakPolarHBondContact O-CG2 3.29Å; H308-V315 PolarHBondContact O-N 3.44Å; H308-V315 VanDerWaalsContact O-N 3.09Å; H308-K316 HydrophobicContact CB-CB 4.13Å; H308-K316 HydrophobicContact CB-CG 3.56Å; H308-K316 VanDerWaalsContact CG-CG 3.41Å
309	L	97.2	Very high	96.6	Very high	15 Å²	15	59 Å²	59	8%	0.079	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	133.9	164.8	-71.1	-179	0	0	0	110.2	Y224 H226 C266 H269 V313	Y224-L309 HydrophobicContact CD1-CD2 3.89Å; Y224-L309 HydrophobicContact CE1-CD1 4.25Å; Y224-L309 HydrophobicContact CE1-CD2 3.82Å; Y224-L309 HydrophobicContact CE1-CG 4.47Å; H226-L309 HydrophobicContact CB-CD1 4Å; C266-L309 HydrophobicContact CB-CD1 3.81Å; C266-L309 HydrophobicContact CB-CG 4.38Å; H269-L309 HydrophobicContact CB-CD1 3.97Å; L309-V313 WeakPolarHBondContact CA-O 3.39Å
310	K	95.8	Very high	96.6	Very high	139 Å²	139	59.2 Å²	59.2	60%	0.604	33%	0.329	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-141.6	129.9	168.2	-177.2	-179.5	179	-178.9	0	108.8	N312 V313 V315	K310-N312 PolarHBondContact O-N 3.2Å; K310-V313 PolarHBondContact N-O 2.87Å; K310-V313 PolarHBondContact O-N 3.43Å; K310-V315 HydrophobicContact CB-CG1 3.86Å; K310-V315 HydrophobicContact CB-CG2 4.36Å
311	N	93.9	Very high	96.7	Very high	148 Å²	148	55.4 Å²	55.4	79%	0.791	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.9	39.8	-169.3	-56.4	0.9	0	0	0	111.2	V313	N311-V313 PolarHBondContact O-N 2.85Å
312	N	95.8	Very high	96.7	Very high	67 Å²	67	51.5 Å²	51.5	36%	0.358	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.1	6	-175.4	-56.5	0.2	0	0	0	117.4	H226 K310	H226-N312 HydrophobicContact CB-CB 4.07Å; H226-N312 PolarHBondContact N-O 3.45Å; H226-N312 WeakPolarHBondContact O-CB 3.4Å; K310-N312 PolarHBondContact O-N 3.2Å
313	V	96.7	Very high	96.8	Very high	61 Å²	61	47.3 Å²	47.3	37%	0.37	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	141.3	176.5	-173	0	0	0	0	110.7	I225 L309 K310 N311 V315	I225-V313 HydrophobicContact CG1-CG1 4.35Å; I225-V313 HydrophobicContact CG1-CG2 4.26Å; L309-V313 WeakPolarHBondContact CA-O 3.39Å; K310-V313 PolarHBondContact N-O 2.87Å; K310-V313 PolarHBondContact O-N 3.43Å; N311-V313 PolarHBondContact O-N 2.85Å; V313-V315 PolarHBondContact O-N 2.93Å; V313-V315 VanDerWaalsContact O-N 3.14Å
314	Y	97.8	Very high	96.7	Very high	6 Å²	6	49.3 Å²	49.3	2%	0.024	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	96.2	174.7	175.9	-132.8	0	0	0	111.8	Y224 D258 Q262 H308 K316 S317	Y224-Y314 PolarHBondContact O-N 3.3Å; D258-Y314 HydrophobicContact CB-CD1 4.39Å; D258-Y314 HydrophobicContact CB-CE1 3.97Å; D258-Y314 WeakPolarHBondContact OD2-CE1 3.36Å; Q262-Y314 HydrophobicContact CG-CD1 4.36Å; Q262-Y314 HydrophobicContact CG-CD2 3.44Å; Q262-Y314 VanDerWaalsContact CG-CD2 3.44Å; Q262-Y314 HydrophobicContact CG-CE2 3.67Å; Q262-Y314 HydrophobicContact CG-CG 3.83Å; H308-Y314 HydrophobicContact CB-CD2 4.07Å; H308-Y314 HydrophobicContact CB-CE2 3.97Å; Y314-K316 VanDerWaalsContact C-N 3.27Å; Y314-K316 HydrophobicContact CD2-CB 4.36Å; Y314-K316 HydrophobicContact CE2-CB 3.62Å; Y314-K316 PolarHBondContact O-N 2.93Å; Y314-S317 VanDerWaalsContact CE1-CA 3.44Å
315	V	96.8	Very high	96.7	Very high	78 Å²	78	48.1 Å²	48.1	47%	0.473	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-6.1	-171.1	-62.2	0	0	0	0	114.9	H308 K310 V313	H308-V315 WeakPolarHBondContact O-CG2 3.29Å; H308-V315 PolarHBondContact O-N 3.44Å; H308-V315 VanDerWaalsContact O-N 3.09Å; K310-V315 HydrophobicContact CB-CG1 3.86Å; K310-V315 HydrophobicContact CB-CG2 4.36Å; V313-V315 PolarHBondContact O-N 2.93Å; V313-V315 VanDerWaalsContact O-N 3.14Å
316	K	96.8	Very high	96.4	Very high	75 Å²	75	50.3 Å²	50.3	33%	0.326	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.9	-6.1	178.1	-71.1	-67.1	-171.5	173.3	0	114.7	H308 Y314 T318 T319 M320	H308-K316 HydrophobicContact CB-CB 4.13Å; H308-K316 HydrophobicContact CB-CG 3.56Å; H308-K316 VanDerWaalsContact CG-CG 3.41Å; Y314-K316 VanDerWaalsContact C-N 3.27Å; Y314-K316 HydrophobicContact CD2-CB 4.36Å; Y314-K316 HydrophobicContact CE2-CB 3.62Å; Y314-K316 PolarHBondContact O-N 2.93Å; K316-T318 PolarHBondContact O-N 3.39Å; K316-T319 WeakPolarHBondContact CA-OG1 3.48Å; K316-T319 VanDerWaalsContact CD-OG1 3.24Å; K316-T319 WeakPolarHBondContact CD-OG1 3.35Å; K316-T319 WeakPolarHBondContact O-CA 3.39Å; K316-T319 PolarHBondContact O-N 2.84Å; K316-T319 PolarHBondContact O-OG1 3.24Å; K316-M320 HydrophobicContact CB-CB 4.37Å; K316-M320 HydrophobicContact CB-CG 4.13Å; K316-M320 HydrophobicContact CB-SD 3.64Å; K316-M320 HydrophobicContact CD-CE 4.07Å; K316-M320 HydrophobicContact CD-CG 4.37Å; K316-M320 HydrophobicContact CD-SD 3.99Å; K316-M320 HydrophobicContact CG-CE 4.23Å; K316-M320 HydrophobicContact CG-SD 3.7Å; K316-M320 PolarHBondContact O-N 3.25Å
317	S	95.5	Very high	96.2	Very high	4 Å²	4	47.8 Å²	47.8	3%	0.028	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-44.7	-42.7	-177.6	-176	0	0	0	0	114.1	K194 Y314 T319	K194-S317 WeakPolarHBondContact CA-OG 3.4Å; K194-S317 WeakPolarHBondContact CD-O 3.49Å; K194-S317 WeakPolarHBondContact CG-O 3.27Å; K194-S317 PolarHBondContact NZ-O 3.37Å; Y314-S317 VanDerWaalsContact CE1-CA 3.44Å; S317-T319 PolarHBondContact O-N 2.95Å
318	T	95.9	Very high	96.1	Very high	54 Å²	54	45.5 Å²	45.5	33%	0.331	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	6.4	-178.8	59.7	0	0	0	0	115	T195 V196 I299 K316	T195-T318 WeakPolarHBondContact OG1-CG2 3.48Å; V196-T318 HydrophobicContact CG1-CG2 3.83Å; I299-T318 VanDerWaalsContact CD1-C 3.45Å; I299-T318 WeakPolarHBondContact CD1-O 3.26Å; K316-T318 PolarHBondContact O-N 3.39Å
319	T	96.6	Very high	95.8	Very high	64 Å²	64	44.5 Å²	44.5	39%	0.393	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-138.5	-14.2	-170.7	62.9	0	0	0	0	115.4	V301 K316 S317	V301-T319 WeakPolarHBondContact CB-O 3.35Å; K316-T319 WeakPolarHBondContact CA-OG1 3.48Å; K316-T319 VanDerWaalsContact CD-OG1 3.24Å; K316-T319 WeakPolarHBondContact CD-OG1 3.35Å; K316-T319 WeakPolarHBondContact O-CA 3.39Å; K316-T319 PolarHBondContact O-N 2.84Å; K316-T319 PolarHBondContact O-OG1 3.24Å; S317-T319 PolarHBondContact O-N 2.95Å
320	M	97.4	Very high	95.3	Very high	15 Å²	15	48.5 Å²	48.5	7%	0.074	27%	0.271	C	S	.	.	S	Bend	trans	-122.8	146.3	177	-75.9	174.6	167.1	0	0	110.6	K194 I299 V301 D304 K316	K194-M320 WeakPolarHBondContact CE-O 3.33Å; K194-M320 PolarHBondContact NZ-O 3.47Å; I299-M320 WeakPolarHBondContact CG2-O 3.12Å; V301-M320 CarbonylContact O-C 2.98Å; V301-M320 WeakPolarHBondContact O-CA 3.44Å; D304-M320 HydrophobicContact CB-CE 4.1Å; K316-M320 HydrophobicContact CB-CB 4.37Å; K316-M320 HydrophobicContact CB-CG 4.13Å; K316-M320 HydrophobicContact CB-SD 3.64Å; K316-M320 HydrophobicContact CD-CE 4.07Å; K316-M320 HydrophobicContact CD-CG 4.37Å; K316-M320 HydrophobicContact CD-SD 3.99Å; K316-M320 HydrophobicContact CG-CE 4.23Å; K316-M320 HydrophobicContact CG-SD 3.7Å; K316-M320 PolarHBondContact O-N 3.25Å
321	E	97.3	Very high	95.1	Very high	13 Å²	13	43.9 Å²	43.9	6%	0.061	25%	0.25	C	S	.	.	P	Polyproline II helix	trans	-61.5	161.7	173.6	-60.6	-154.3	127	0	0	112.2	S294 I299 V301 N303	S294-E321 VanDerWaalsContact OG-CA 3.29Å; S294-E321 WeakPolarHBondContact OG-CA 3.48Å; S294-E321 WeakPolarHBondContact OG-CB 3.42Å; S294-E321 WeakPolarHBondContact OG-CG 3.3Å; S294-E321 PolarHBondContact OG-OE1 3.45Å; I299-E321 HydrophobicContact CG2-CG 4.43Å; V301-E321 WeakPolarHBondContact O-CG 3.47Å; V301-E321 PolarHBondContact O-N 3.17Å; N303-E321 WeakPolarHBondContact CB-O 3.25Å; N303-E321 PolarHBondContact ND2-O 2.95Å
322	H	97.8	Very high	94.9	Very high	1 Å²	1	37 Å²	37	1%	0.005	21%	0.214	C	C	.	.	P	Polyproline II helix	trans	-62.1	149.1	164.9	-48.8	-94.6	0	0	0	109.2	D193 K194 D258 H289 L290 A291	D193-H322 IonicContact OD1-CE1 2.79Å; D193-H322 PolarHBondContact OD1-CE1 3.25Å; K194-H322 WeakPolarHBondContact CE-CE1 3.49Å; K194-H322 WeakPolarHBondContact CE-NE2 3.37Å; D258-H322 WeakPolarHBondContact OD1-CA 3.45Å; H289-H322 WeakPolarHBondContact CB-CE1 3.35Å; H289-H322 AromaticContact CG-CE1 3.94Å; H289-H322 AromaticContact CG-NE2 3.9Å; L290-H322 PolarHBondContact O-CD2 2.88Å; A291-H322 WeakPolarHBondContact CA-O 3.26Å; A291-H322 WeakPolarHBondContact CB-O 3.4Å
323	P	97.8	Very high	94.3	Very high	1 Å²	1	37.1 Å²	37.1	1%	0.006	21%	0.214	C	C	.	.	P	Polyproline II helix	trans	-65.9	151.2	178.2	26.8	-34.4	0	0	0	112.1	F257 D258 L261 N303	F257-P323 HydrophobicContact CB-CG 4.05Å; F257-P323 VanDerWaalsContact O-CG 3.3Å; F257-P323 WeakPolarHBondContact O-CG 3.29Å; D258-P323 VanDerWaalsContact OD1-CD 3.27Å; D258-P323 WeakPolarHBondContact OD1-CD 3.23Å; L261-P323 HydrophobicContact CB-CG 4.05Å; L261-P323 HydrophobicContact CD1-CB 4.25Å; L261-P323 HydrophobicContact CD2-CB 4.05Å; L261-P323 HydrophobicContact CD2-CG 4.2Å; N303-P323 HydrophobicContact CB-CB 4.41Å
324	S	96.8	Very high	93.7	Very high	54 Å²	54	38.4 Å²	38.4	38%	0.378	22%	0.219	S	C	.	.	P	Polyproline II helix	trans	-73.6	151.6	168.5	71.2	0	0	0	0	110.7	G326 Q327 L328	S324-G326 PolarHBondContact O-N 3.1Å; S324-Q327 PolarHBondContact O-N 2.89Å; S324-Q327 VanDerWaalsContact OG-CB 3.31Å; S324-Q327 WeakPolarHBondContact OG-CB 3.1Å; S324-Q327 PolarHBondContact OG-N 3.4Å; S324-L328 PolarHBondContact O-N 2.91Å
325	L	95	Very high	93.2	Very high	36 Å²	36	39.2 Å²	39.2	19%	0.188	22%	0.223	C	C	.	.	H	α-helix	trans	-55.6	-35.3	176	-69.3	169.4	0	0	0	112.4	F257 L290 S329 L354 L357 L358	F257-L325 HydrophobicContact CD2-CD2 4.33Å; F257-L325 HydrophobicContact CE2-CD2 3.68Å; F257-L325 HydrophobicContact CZ-CD2 4.13Å; L290-L325 HydrophobicContact CD2-CG 4.39Å; L325-S329 WeakPolarHBondContact O-CB 3.3Å; L325-S329 PolarHBondContact O-N 3.36Å; L325-L354 HydrophobicContact CD1-CD2 3.68Å; L325-L354 HydrophobicContact CD2-CD1 4.32Å; L325-L354 HydrophobicContact CD2-CD2 4.25Å; L325-L357 HydrophobicContact CD1-CD1 3.93Å; L325-L358 HydrophobicContact CD2-CD1 4.39Å; L325-L358 HydrophobicContact CD2-CD2 4.46Å
326	G	91.2	Very high	92.6	Very high	52 Å²	52	37 Å²	37	54%	0.536	21%	0.209	S	C	.	.	H	α-helix	trans	-67.6	-40.4	176.1	0	0	0	0	0	113.3	S324 S329 E330	S324-G326 PolarHBondContact O-N 3.1Å; G326-S329 WeakPolarHBondContact O-CB 3.37Å; G326-S329 PolarHBondContact O-N 2.74Å; G326-E330 WeakPolarHBondContact O-CB 3.43Å; G326-E330 PolarHBondContact O-N 3.41Å
327	Q	93.9	Very high	92.3	Very high	36 Å²	36	33.6 Å²	33.6	17%	0.168	19%	0.194	C	C	.	.	H	α-helix	trans	-69.4	-39.5	175.9	-178.8	178.1	31.2	0	0	112.1	N303 S324 E330 K331	N303-Q327 PolarHBondContact O-NE2 3.35Å; S324-Q327 PolarHBondContact O-N 2.89Å; S324-Q327 VanDerWaalsContact OG-CB 3.31Å; S324-Q327 WeakPolarHBondContact OG-CB 3.1Å; S324-Q327 PolarHBondContact OG-N 3.4Å; Q327-E330 PolarHBondContact O-N 2.96Å; Q327-K331 WeakPolarHBondContact O-CG 3.43Å; Q327-K331 PolarHBondContact O-N 3.38Å
328	L	95.4	Very high	92.1	Very high	1 Å²	1	34.3 Å²	34.3	1%	0.005	20%	0.198	C	C	.	.	H	α-helix	trans	-64.5	-43.7	173.1	-177.8	60.2	0	0	0	110.9	F257 M260 L261 S324 K331 L332 L358	F257-L328 HydrophobicContact CB-CD2 4.2Å; F257-L328 HydrophobicContact CD1-CD2 3.84Å; F257-L328 HydrophobicContact CD2-CD2 4.5Å; F257-L328 HydrophobicContact CE1-CD2 4.34Å; F257-L328 HydrophobicContact CG-CD2 3.93Å; M260-L328 HydrophobicContact CB-CD1 4.04Å; M260-L328 HydrophobicContact CE-CD1 4.43Å; M260-L328 HydrophobicContact CE-CD2 4.06Å; M260-L328 HydrophobicContact SD-CD2 4.41Å; L261-L328 HydrophobicContact CB-CD1 4.27Å; L261-L328 HydrophobicContact CD1-CD1 4.39Å; S324-L328 PolarHBondContact O-N 2.91Å; L328-K331 PolarHBondContact O-N 2.88Å; L328-L332 HydrophobicContact CD1-CD1 4.16Å; L328-L332 HydrophobicContact CD1-CG 4.25Å; L328-L332 HydrophobicContact CG-CD1 3.96Å; L328-L332 HydrophobicContact CG-CG 4.49Å; L328-L332 WeakPolarHBondContact O-CB 3.49Å; L328-L332 WeakPolarHBondContact O-CG 3.3Å; L328-L332 PolarHBondContact O-N 2.91Å; L328-L358 HydrophobicContact CG-CD2 4.47Å
329	S	90.9	Very high	91.9	Very high	14 Å²	14	31.9 Å²	31.9	10%	0.098	18%	0.182	C	C	.	.	H	α-helix	trans	-56.6	-50.7	173.8	-165.9	0	0	0	0	111.5	L325 G326 K331 L332 I333 L357 P359	L325-S329 WeakPolarHBondContact O-CB 3.3Å; L325-S329 PolarHBondContact O-N 3.36Å; G326-S329 WeakPolarHBondContact O-CB 3.37Å; G326-S329 PolarHBondContact O-N 2.74Å; S329-K331 PolarHBondContact O-N 3.42Å; S329-L332 PolarHBondContact O-N 2.92Å; S329-I333 WeakPolarHBondContact O-CD1 3.3Å; S329-I333 VanDerWaalsContact O-CG1 3.24Å; S329-I333 WeakPolarHBondContact O-CG1 3.22Å; S329-I333 PolarHBondContact O-N 2.86Å; S329-L357 PolarHBondContact OG-O 3Å; S329-P359 WeakPolarHBondContact OG-CD 3.48Å
330	E	85.6	Confident	91.9	Very high	100 Å²	100	29 Å²	29	47%	0.467	16%	0.164	S	C	.	.	H	α-helix	trans	-54.9	-52.7	175.6	-172.9	-170	-127.1	0	0	111.6	G326 Q327 L332 I333 D334	G326-E330 WeakPolarHBondContact O-CB 3.43Å; G326-E330 PolarHBondContact O-N 3.41Å; Q327-E330 PolarHBondContact O-N 2.96Å; E330-L332 PolarHBondContact O-N 3.45Å; E330-I333 PolarHBondContact O-N 3.36Å; E330-D334 WeakPolarHBondContact O-CB 3.48Å; E330-D334 VanDerWaalsContact O-CG 3.27Å; E330-D334 PolarHBondContact O-N 2.83Å
331	K	91.8	Very high	91.8	Very high	41 Å²	41	28.2 Å²	28.2	18%	0.178	16%	0.161	C	C	.	.	H	α-helix	trans	-72.6	-25.1	-175.7	-61	-65.7	155.2	-119.9	0	113.9	L261 V265 Q327 L328 S329 D334 N335	L261-K331 HydrophobicContact CD1-CB 4.11Å; L261-K331 HydrophobicContact CD1-CG 4.09Å; V265-K331 HydrophobicContact CG1-CB 3.81Å; V265-K331 HydrophobicContact CG1-CD 3.98Å; V265-K331 HydrophobicContact CG1-CG 3.93Å; Q327-K331 WeakPolarHBondContact O-CG 3.43Å; Q327-K331 PolarHBondContact O-N 3.38Å; L328-K331 PolarHBondContact O-N 2.88Å; S329-K331 PolarHBondContact O-N 3.42Å; K331-D334 IonicContact NZ-OD2 2.88Å; K331-D334 PolarHBondContact NZ-OD2 2.9Å; K331-N335 WeakPolarHBondContact O-CB 3.07Å; K331-N335 PolarHBondContact O-N 3.31Å; K331-N335 PolarHBondContact O-ND2 2.85Å
332	L	90.3	Very high	91.6	Very high	4 Å²	4	27.6 Å²	27.6	2%	0.021	16%	0.158	C	C	.	.	H	α-helix	trans	-69.7	-41.1	169	-71.6	169.1	0	0	0	111.4	M260 A264 L280 L328 S329 E330 N336 I337 V339	M260-L332 HydrophobicContact CE-CD1 4.24Å; A264-L332 HydrophobicContact CB-CD2 4.26Å; L280-L332 HydrophobicContact CD2-CD2 4.45Å; L328-L332 HydrophobicContact CD1-CD1 4.16Å; L328-L332 HydrophobicContact CD1-CG 4.25Å; L328-L332 HydrophobicContact CG-CD1 3.96Å; L328-L332 HydrophobicContact CG-CG 4.49Å; L328-L332 WeakPolarHBondContact O-CB 3.49Å; L328-L332 WeakPolarHBondContact O-CG 3.3Å; L328-L332 PolarHBondContact O-N 2.91Å; S329-L332 PolarHBondContact O-N 2.92Å; E330-L332 PolarHBondContact O-N 3.45Å; L332-N336 PolarHBondContact O-N 3.28Å; L332-N336 VanDerWaalsContact O-N 3.07Å; L332-I337 HydrophobicContact CD2-CB 3.96Å; L332-I337 HydrophobicContact CD2-CG2 3.73Å; L332-I337 PolarHBondContact O-N 2.79Å; L332-V339 HydrophobicContact CD1-CG2 3.68Å; L332-V339 HydrophobicContact CD2-CG2 3.63Å; L332-V339 HydrophobicContact CG-CG2 4.3Å
333	I	83.6	Confident	91.5	Very high	70 Å²	70	27.6 Å²	27.6	36%	0.359	16%	0.158	S	C	.	.	H	α-helix	trans	-65	-52.3	175.4	-65	161.5	0	0	0	110.6	S329 E330 N335 N336 P359	S329-I333 WeakPolarHBondContact O-CD1 3.3Å; S329-I333 VanDerWaalsContact O-CG1 3.24Å; S329-I333 WeakPolarHBondContact O-CG1 3.22Å; S329-I333 PolarHBondContact O-N 2.86Å; E330-I333 PolarHBondContact O-N 3.36Å; I333-N335 VanDerWaalsContact C-N 3.33Å; I333-N335 PolarHBondContact O-N 2.95Å; I333-N336 WeakPolarHBondContact O-CA 3.12Å; I333-N336 PolarHBondContact O-N 3.38Å; I333-N336 PolarHBondContact O-ND2 2.87Å; I333-P359 HydrophobicContact CD1-CG 3.76Å; I333-P359 HydrophobicContact CG1-CG 4.08Å
334	D	84.6	Confident	91.1	Very high	88 Å²	88	29.8 Å²	29.8	47%	0.471	17%	0.168	S	C	.	.	H	α-helix	trans	-52.2	-49.9	-179.6	-74.1	-20	0	0	0	111.5	E330 K331 N336	E330-D334 WeakPolarHBondContact O-CB 3.48Å; E330-D334 VanDerWaalsContact O-CG 3.27Å; E330-D334 PolarHBondContact O-N 2.83Å; K331-D334 IonicContact NZ-OD2 2.88Å; K331-D334 PolarHBondContact NZ-OD2 2.9Å; D334-N336 VanDerWaalsContact C-N 3.25Å; D334-N336 PolarHBondContact O-N 3.48Å
335	N	87.1	Confident	90.7	Very high	22 Å²	22	28.5 Å²	28.5	12%	0.118	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.6	4.3	-178.9	-64.3	-76.1	0	0	0	112.9	A264 R278 K331 I333 I337	A264-N335 VanDerWaalsContact O-CG 3.29Å; R278-N335 WeakPolarHBondContact CD-O 3.01Å; R278-N335 PolarHBondContact NH1-O 3.43Å; K331-N335 WeakPolarHBondContact O-CB 3.07Å; K331-N335 PolarHBondContact O-N 3.31Å; K331-N335 PolarHBondContact O-ND2 2.85Å; I333-N335 VanDerWaalsContact C-N 3.33Å; I333-N335 PolarHBondContact O-N 2.95Å; N335-I337 VanDerWaalsContact C-N 3.26Å; N335-I337 HydrophobicContact CB-CD1 3.83Å; N335-I337 HydrophobicContact CB-CG1 4.19Å; N335-I337 PolarHBondContact O-N 3.48Å
336	N	84	Confident	90.3	Very high	32 Å²	32	35.6 Å²	35.6	17%	0.171	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.8	37	179.3	-54.1	146.8	0	0	0	114.4	L332 I333 D334 N338 K451	L332-N336 PolarHBondContact O-N 3.28Å; L332-N336 VanDerWaalsContact O-N 3.07Å; I333-N336 WeakPolarHBondContact O-CA 3.12Å; I333-N336 PolarHBondContact O-N 3.38Å; I333-N336 PolarHBondContact O-ND2 2.87Å; D334-N336 VanDerWaalsContact C-N 3.25Å; D334-N336 PolarHBondContact O-N 3.48Å; N336-N338 PolarHBondContact O-ND2 2.86Å; N336-K451 WeakPolarHBondContact OD1-CE 3.47Å; N336-K451 PolarHBondContact OD1-NZ 2.86Å
337	I	90.1	Very high	90.4	Very high	4 Å²	4	35.7 Å²	35.7	2%	0.021	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	134.8	-178.2	-68.6	166.2	0	0	0	110.5	A264 W272 R278 L280 L332 N335	A264-I337 VanDerWaalsContact CA-CD1 3.49Å; A264-I337 HydrophobicContact CB-CD1 3.83Å; W272-I337 HydrophobicContact CZ2-CD1 4.07Å; W272-I337 HydrophobicContact CZ2-CG1 4.41Å; R278-I337 HydrophobicContact CB-CG1 3.87Å; L280-I337 HydrophobicContact CB-CG2 3.56Å; L280-I337 HydrophobicContact CD2-CG2 4.29Å; L332-I337 HydrophobicContact CD2-CB 3.96Å; L332-I337 HydrophobicContact CD2-CG2 3.73Å; L332-I337 PolarHBondContact O-N 2.79Å; N335-I337 VanDerWaalsContact C-N 3.26Å; N335-I337 HydrophobicContact CB-CD1 3.83Å; N335-I337 HydrophobicContact CB-CG1 4.19Å; N335-I337 PolarHBondContact O-N 3.48Å
338	N	90.4	Very high	90.4	Very high	19 Å²	19	35.4 Å²	35.4	10%	0.102	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	126.9	-179.2	-54.2	-93.5	0	0	0	108.3	R278 L279 L280 N336 G360 L384	R278-N338 PolarHBondContact O-N 3.17Å; R278-N338 PolarHBondContact O-ND2 3.44Å; L279-N338 WeakPolarHBondContact CA-O 3.15Å; L279-N338 HydrophobicContact CD2-CB 4.32Å; L280-N338 PolarHBondContact N-O 2.9Å; N336-N338 PolarHBondContact O-ND2 2.86Å; N338-G360 VanDerWaalsContact CA-O 3.3Å; N338-G360 WeakPolarHBondContact CA-O 3.31Å; N338-G360 WeakPolarHBondContact CB-O 3.31Å; N338-L384 HydrophobicContact CB-CD1 3.95Å; N338-L384 HydrophobicContact CB-CD2 4.36Å; N338-L384 VanDerWaalsContact CG-CD1 3.43Å; N338-L384 VanDerWaalsContact OD1-CD1 3.29Å; N338-L384 WeakPolarHBondContact OD1-CD1 3Å
339	V	93.6	Very high	90.3	Very high	2 Å²	2	40.7 Å²	40.7	1%	0.012	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	134.3	-170.1	-168.6	0	0	0	0	111.2	M260 L280 V282 L332 F341 G360 T361 I362	M260-V339 HydrophobicContact CE-CB 4.33Å; M260-V339 HydrophobicContact CE-CG1 3.69Å; M260-V339 HydrophobicContact CE-CG2 3.79Å; L280-V339 HydrophobicContact CB-CG2 4.45Å; L280-V339 HydrophobicContact CD2-CG2 4.36Å; L280-V339 CarbonylContact O-C 3.5Å; L280-V339 WeakPolarHBondContact O-CA 3.35Å; V282-V339 HydrophobicContact CG2-CG1 3.61Å; L332-V339 HydrophobicContact CD1-CG2 3.68Å; L332-V339 HydrophobicContact CD2-CG2 3.63Å; L332-V339 HydrophobicContact CG-CG2 4.3Å; V339-F341 HydrophobicContact CG1-CD1 4.16Å; V339-F341 HydrophobicContact CG1-CD2 4.42Å; V339-F341 HydrophobicContact CG1-CE1 3.94Å; V339-F341 HydrophobicContact CG1-CE2 4.2Å; V339-F341 HydrophobicContact CG1-CG 4.41Å; V339-F341 HydrophobicContact CG1-CZ 3.96Å; V339-G360 PolarHBondContact N-O 3.47Å; V339-T361 HydrophobicContact CB-CG2 3.56Å; V339-T361 HydrophobicContact CG2-CG2 3.7Å; V339-T361 CarbonylContact O-C 3.01Å; V339-T361 VanDerWaalsContact O-CA 3.29Å; V339-T361 WeakPolarHBondContact O-CA 3.45Å; V339-I362 PolarHBondContact O-N 3Å
340	I	94.9	Very high	90.5	Very high	3 Å²	3	43.7 Å²	43.7	2%	0.015	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	106	169	-55	169.8	0	0	0	107.1	L279 L280 L281 V282 A342 I362 L376 V377 A380	L279-I340 HydrophobicContact CD1-CD1 4.5Å; L279-I340 HydrophobicContact CD2-CD1 4.16Å; L280-I340 PolarHBondContact O-N 3.02Å; L281-I340 HydrophobicContact CD1-CB 3.86Å; L281-I340 HydrophobicContact CD1-CG2 3.72Å; V282-I340 PolarHBondContact N-O 3.4Å; I340-A342 PolarHBondContact O-N 3.13Å; I340-I362 HydrophobicContact CB-CG1 4.36Å; I340-I362 HydrophobicContact CG1-CD1 4.24Å; I340-I362 HydrophobicContact CG1-CG1 4.17Å; I340-I362 HydrophobicContact CG2-CD1 4.25Å; I340-I362 HydrophobicContact CG2-CG1 4.26Å; I340-L376 HydrophobicContact CG2-CD2 4.37Å; I340-L376 HydrophobicContact CG2-CG 4.24Å; I340-V377 HydrophobicContact CD1-CB 4.43Å; I340-V377 HydrophobicContact CD1-CG1 4.05Å; I340-V377 HydrophobicContact CD1-CG2 4.31Å; I340-A380 HydrophobicContact CD1-CB 3.46Å; I340-A380 VanDerWaalsContact CD1-CB 3.46Å; I340-A380 HydrophobicContact CG1-CB 3.82Å
341	F	95.6	Very high	90.9	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	109.6	168.4	-63	-68.7	0	0	0	108.9	F257 M260 V282 V339 V343 Y351 L355 L358 T361 I362 A363 G364	F257-F341 HydrophobicContact CE1-CE1 4.29Å; F257-F341 HydrophobicContact CE1-CZ 4.49Å; M260-F341 HydrophobicContact CE-CE1 3.88Å; M260-F341 HydrophobicContact CE-CZ 3.86Å; M260-F341 HydrophobicContact SD-CE1 3.65Å; M260-F341 HydrophobicContact SD-CZ 4.17Å; V282-F341 HydrophobicContact CB-CD1 3.97Å; V282-F341 HydrophobicContact CB-CE1 4.42Å; V282-F341 HydrophobicContact CG1-CD1 4.18Å; V282-F341 HydrophobicContact CG1-CE1 4.47Å; V282-F341 HydrophobicContact CG2-CD1 4.35Å; V282-F341 HydrophobicContact CG2-CE1 4.38Å; V339-F341 HydrophobicContact CG1-CD1 4.16Å; V339-F341 HydrophobicContact CG1-CD2 4.42Å; V339-F341 HydrophobicContact CG1-CE1 3.94Å; V339-F341 HydrophobicContact CG1-CE2 4.2Å; V339-F341 HydrophobicContact CG1-CG 4.41Å; V339-F341 HydrophobicContact CG1-CZ 3.96Å; F341-V343 HydrophobicContact CB-CG2 3.91Å; F341-Y351 HydrophobicContact CB-CD1 4.1Å; F341-Y351 HydrophobicContact CB-CG 4.32Å; F341-Y351 AromaticContact CD1-CD1 3.3Å; F341-Y351 HydrophobicContact CD1-CD1 3.3Å; F341-Y351 AromaticContact CD1-CE1 3.58Å; F341-Y351 HydrophobicContact CD1-CE1 3.58Å; F341-Y351 HydrophobicContact CD1-CG 4.29Å; F341-Y351 HydrophobicContact CD2-CD1 4.13Å; F341-Y351 AromaticContact CE1-CD1 3.58Å; F341-Y351 HydrophobicContact CE1-CD1 3.58Å; F341-Y351 AromaticContact CE1-CE1 3.68Å; F341-Y351 HydrophobicContact CE1-CE1 3.68Å; F341-Y351 HydrophobicContact CE2-CD1 4.36Å; F341-Y351 AromaticContact CG-CD1 3.59Å; F341-Y351 HydrophobicContact CG-CD1 3.59Å; F341-Y351 HydrophobicContact CG-CE1 4.33Å; F341-Y351 HydrophobicContact CG-CG 4.25Å; F341-Y351 HydrophobicContact CZ-CD1 4.1Å; F341-Y351 HydrophobicContact CZ-CE1 4.49Å; F341-L355 HydrophobicContact CD2-CD2 4.14Å; F341-L355 HydrophobicContact CE2-CD2 4.42Å; F341-L358 HydrophobicContact CE2-CD1 4.04Å; F341-L358 HydrophobicContact CZ-CD1 3.84Å; F341-T361 HydrophobicContact CE2-CG2 4.32Å; F341-I362 WeakPolarHBondContact CD2-O 3.36Å; F341-I362 PolarHBondContact N-O 3.44Å; F341-A363 HydrophobicContact CB-CB 4.03Å; F341-A363 CarbonylContact O-C 3.51Å; F341-A363 WeakPolarHBondContact O-CA 3.5Å; F341-G364 PolarHBondContact O-N 3.06Å
342	A	94.1	Very high	91	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	86.9	178.6	0	0	0	0	0	108.7	L281 V282 M283 T284 I340 I366 L373 L376	L281-A342 HydrophobicContact CD1-CB 3.69Å; V282-A342 PolarHBondContact O-N 3.2Å; M283-A342 WeakPolarHBondContact CA-O 3.37Å; M283-A342 HydrophobicContact CG-CB 4.1Å; T284-A342 PolarHBondContact N-O 2.05Å; I340-A342 PolarHBondContact O-N 3.13Å; A342-I366 HydrophobicContact CB-CG2 3.76Å; A342-I366 WeakPolarHBondContact O-CD1 3.16Å; A342-L373 HydrophobicContact CB-CD1 3.74Å; A342-L376 HydrophobicContact CB-CD2 4.01Å
343	V	94.1	Very high	91.2	Very high	1 Å²	1	47.8 Å²	47.8	1%	0.006	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	131.2	-162.2	-172.5	0	0	0	0	110.6	T284 F341 Q347 F348 Y351 G364 E365 I366	T284-V343 HydrophobicContact CG2-CG1 4.48Å; T284-V343 HydrophobicContact CG2-CG2 4.48Å; T284-V343 WeakPolarHBondContact O-CA 3.43Å; F341-V343 HydrophobicContact CB-CG2 3.91Å; V343-Q347 HydrophobicContact CG1-CB 3.96Å; V343-F348 HydrophobicContact CB-CB 4.33Å; V343-F348 HydrophobicContact CG1-CB 4.48Å; V343-Y351 HydrophobicContact CB-CD2 4.28Å; V343-Y351 HydrophobicContact CG1-CD2 3.85Å; V343-Y351 HydrophobicContact CG1-CE2 4.06Å; V343-Y351 HydrophobicContact CG2-CD1 4.41Å; V343-Y351 HydrophobicContact CG2-CD2 3.51Å; V343-Y351 HydrophobicContact CG2-CE2 3.99Å; V343-Y351 HydrophobicContact CG2-CG 3.75Å; V343-G364 PolarHBondContact N-O 3.45Å; V343-E365 CarbonylContact O-C 2.89Å; V343-E365 VanDerWaalsContact O-CA 3.28Å; V343-E365 WeakPolarHBondContact O-CA 3.48Å; V343-I366 PolarHBondContact O-N 3.06Å
344	Q	90.9	Very high	91.6	Very high	47 Å²	47	45.3 Å²	45.3	22%	0.22	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	134.3	179.8	-166.1	175	-88.5	0	0	111.5	N162 T284 D285 I366	N162-Q344 PolarHBondContact ND2-OE1 3.46Å; N162-Q344 PolarHBondContact OD1-OE1 2.03Å; T284-Q344 PolarHBondContact O-N 3.04Å; D285-Q344 HydrophobicContact CB-CB 3.73Å; Q344-I366 HydrophobicContact CB-CD1 4.18Å; Q344-I366 HydrophobicContact CB-CG1 3.81Å; Q344-I366 HydrophobicContact CG-CG1 4.46Å
345	G	87.5	Confident	91.8	Very high	27 Å²	27	43.4 Å²	43.4	28%	0.278	21%	0.21	S	C	.	.	G	3₁₀ helix	trans	67	-153.2	169.7	0	0	0	0	0	115.2	Q347 F348	G345-Q347 PolarHBondContact O-N 3.28Å; G345-Q347 VanDerWaalsContact O-N 3.07Å; G345-F348 WeakPolarHBondContact O-CB 3.47Å; G345-F348 PolarHBondContact O-N 3.4Å
346	K	87.6	Confident	91.8	Very high	184 Å²	184	47.6 Å²	47.6	80%	0.8	24%	0.239	S	C	*	.	G	3₁₀ helix	trans	-60.4	-28.5	-164.4	-62.5	-175.9	-179.6	-178.8	0	113.7	F348 H349	K346-F348 PolarHBondContact O-N 3.18Å; K346-H349 PolarHBondContact O-N 2.03Å
347	Q	92.1	Very high	92	Very high	55 Å²	55	50.7 Å²	50.7	26%	0.257	25%	0.254	S	S	.	.	G	3₁₀ helix	trans	-62.4	-20.6	178.6	-70.8	84.5	-38.2	0	0	112.5	D285 T287 V343 G345 H349 W350	D285-Q347 WeakPolarHBondContact O-CG 3.47Å; D285-Q347 PolarHBondContact O-NE2 3.2Å; D285-Q347 VanDerWaalsContact O-NE2 3.07Å; T287-Q347 HydrophobicContact CG2-CB 4.5Å; T287-Q347 HydrophobicContact CG2-CG 4.16Å; V343-Q347 HydrophobicContact CG1-CB 3.96Å; G345-Q347 PolarHBondContact O-N 3.28Å; G345-Q347 VanDerWaalsContact O-N 3.07Å; Q347-H349 PolarHBondContact O-N 3.49Å; Q347-H349 VanDerWaalsContact O-N 3.17Å; Q347-W350 WeakPolarHBondContact O-CB 3.43Å; Q347-W350 PolarHBondContact O-N 3.11Å
348	F	93.3	Very high	91.8	Very high	29 Å²	29	50.5 Å²	50.5	13%	0.127	25%	0.254	C	S	.	.	H	α-helix	trans	-49.3	-39.7	171.4	165.2	-115.4	0	0	0	113.3	V343 G345 K346 W350 Y351 K352 A363 E365	V343-F348 HydrophobicContact CB-CB 4.33Å; V343-F348 HydrophobicContact CG1-CB 4.48Å; G345-F348 WeakPolarHBondContact O-CB 3.47Å; G345-F348 PolarHBondContact O-N 3.4Å; K346-F348 PolarHBondContact O-N 3.18Å; F348-W350 VanDerWaalsContact C-N 3.32Å; F348-W350 PolarHBondContact O-N 3.34Å; F348-Y351 PolarHBondContact O-N 3.47Å; F348-K352 HydrophobicContact CE1-CD 4.24Å; F348-K352 HydrophobicContact CZ-CD 4.11Å; F348-K352 WeakPolarHBondContact O-CB 3.38Å; F348-K352 PolarHBondContact O-N 3.44Å; F348-A363 HydrophobicContact CD2-CB 4.16Å; F348-A363 HydrophobicContact CE2-CB 3.77Å; F348-E365 HydrophobicContact CB-CB 4.28Å; F348-E365 HydrophobicContact CB-CG 4.29Å; F348-E365 HydrophobicContact CD1-CB 4.04Å; F348-E365 HydrophobicContact CD2-CB 4.14Å; F348-E365 HydrophobicContact CE1-CB 4.43Å; F348-E365 HydrophobicContact CG-CB 3.88Å; F348-E365 HydrophobicContact CG-CG 4.39Å
349	H	93.4	Very high	91	Very high	113 Å²	113	53 Å²	53	52%	0.523	27%	0.271	S	S	.	.	H	α-helix	trans	-62.9	-37	179.7	-74.5	-88.5	0	0	0	112.8	K346 Q347 K352 D353	K346-H349 PolarHBondContact O-N 2.03Å; Q347-H349 PolarHBondContact O-N 3.49Å; Q347-H349 VanDerWaalsContact O-N 3.17Å; H349-K352 WeakPolarHBondContact O-CB 3.09Å; H349-K352 PolarHBondContact O-N 2.7Å; H349-D353 PolarHBondContact O-N 3.44Å
350	W	94.9	Very high	90.2	Very high	77 Å²	77	54.5 Å²	54.5	29%	0.292	29%	0.287	S	S	.	.	H	α-helix	trans	-62.9	-46.7	178.2	-175.3	86.3	0	0	0	111.2	F257 T287 S288 L290 Q347 F348 K352 D353 L354	F257-W350 AromaticContact CE2-CH2 3.78Å; F257-W350 HydrophobicContact CE2-CH2 3.78Å; F257-W350 HydrophobicContact CE2-CZ3 4.34Å; F257-W350 AromaticContact CZ-CH2 3.76Å; F257-W350 HydrophobicContact CZ-CH2 3.76Å; F257-W350 AromaticContact CZ-CZ3 3.85Å; F257-W350 HydrophobicContact CZ-CZ3 3.85Å; T287-W350 HydrophobicContact CG2-CB 4.11Å; T287-W350 HydrophobicContact CG2-CD2 3.72Å; T287-W350 HydrophobicContact CG2-CE3 3.99Å; T287-W350 HydrophobicContact CG2-CG 3.79Å; S288-W350 WeakPolarHBondContact O-CH2 3.2Å; S288-W350 WeakPolarHBondContact O-CZ2 3.39Å; L290-W350 HydrophobicContact CD2-CH2 4.33Å; L290-W350 HydrophobicContact CD2-CZ2 4.21Å; Q347-W350 WeakPolarHBondContact O-CB 3.43Å; Q347-W350 PolarHBondContact O-N 3.11Å; F348-W350 VanDerWaalsContact C-N 3.32Å; F348-W350 PolarHBondContact O-N 3.34Å; W350-K352 VanDerWaalsContact C-N 3.32Å; W350-K352 PolarHBondContact O-N 2.87Å; W350-D353 PolarHBondContact O-N 3.46Å; W350-L354 HydrophobicContact CD2-CD1 4.3Å; W350-L354 HydrophobicContact CE3-CD1 3.86Å; W350-L354 HydrophobicContact CH2-CD1 3.79Å; W350-L354 HydrophobicContact CZ2-CD1 4.22Å; W350-L354 HydrophobicContact CZ3-CD1 3.58Å; W350-L354 WeakPolarHBondContact O-CG 3.17Å; W350-L354 PolarHBondContact O-N 3.37Å
351	Y	95.4	Very high	89.9	Confident	2 Å²	2	55.1 Å²	55.1	1%	0.008	29%	0.291	C	S	.	.	H	α-helix	trans	-66.2	-33.2	175.1	-73	-88.8	0	0	0	113.1	F257 T284 Q286 S288 F341 V343 F348 D353 L354 L355	F257-Y351 HydrophobicContact CE1-CE1 4.15Å; F257-Y351 HydrophobicContact CZ-CE1 4.39Å; T284-Y351 HydrophobicContact CG2-CE2 4.19Å; Q286-Y351 VanDerWaalsContact O-CE2 3.32Å; Q286-Y351 WeakPolarHBondContact O-CE2 3.11Å; Q286-Y351 PolarHBondContact O-OH 2.93Å; S288-Y351 PolarHBondContact N-OH 3.44Å; S288-Y351 VanDerWaalsContact N-OH 3.17Å; F341-Y351 HydrophobicContact CB-CD1 4.1Å; F341-Y351 HydrophobicContact CB-CG 4.32Å; F341-Y351 AromaticContact CD1-CD1 3.3Å; F341-Y351 HydrophobicContact CD1-CD1 3.3Å; F341-Y351 AromaticContact CD1-CE1 3.58Å; F341-Y351 HydrophobicContact CD1-CE1 3.58Å; F341-Y351 HydrophobicContact CD1-CG 4.29Å; F341-Y351 HydrophobicContact CD2-CD1 4.13Å; F341-Y351 AromaticContact CE1-CD1 3.58Å; F341-Y351 HydrophobicContact CE1-CD1 3.58Å; F341-Y351 AromaticContact CE1-CE1 3.68Å; F341-Y351 HydrophobicContact CE1-CE1 3.68Å; F341-Y351 HydrophobicContact CE2-CD1 4.36Å; F341-Y351 AromaticContact CG-CD1 3.59Å; F341-Y351 HydrophobicContact CG-CD1 3.59Å; F341-Y351 HydrophobicContact CG-CE1 4.33Å; F341-Y351 HydrophobicContact CG-CG 4.25Å; F341-Y351 HydrophobicContact CZ-CD1 4.1Å; F341-Y351 HydrophobicContact CZ-CE1 4.49Å; V343-Y351 HydrophobicContact CB-CD2 4.28Å; V343-Y351 HydrophobicContact CG1-CD2 3.85Å; V343-Y351 HydrophobicContact CG1-CE2 4.06Å; V343-Y351 HydrophobicContact CG2-CD1 4.41Å; V343-Y351 HydrophobicContact CG2-CD2 3.51Å; V343-Y351 HydrophobicContact CG2-CE2 3.99Å; V343-Y351 HydrophobicContact CG2-CG 3.75Å; F348-Y351 PolarHBondContact O-N 3.47Å; Y351-D353 VanDerWaalsContact C-N 3.32Å; Y351-D353 PolarHBondContact O-N 2.81Å; Y351-L354 PolarHBondContact O-N 2.84Å; Y351-L355 PolarHBondContact O-N 3.46Å
352	K	92.8	Very high	89.6	Confident	105 Å²	105	56.8 Å²	56.8	46%	0.457	30%	0.299	S	S	.	.	H	α-helix	trans	-63	-37.8	175.1	-173	179.6	178.6	179.4	0	112.2	F348 H349 W350 L354 L355	F348-K352 HydrophobicContact CE1-CD 4.24Å; F348-K352 HydrophobicContact CZ-CD 4.11Å; F348-K352 WeakPolarHBondContact O-CB 3.38Å; F348-K352 PolarHBondContact O-N 3.44Å; H349-K352 WeakPolarHBondContact O-CB 3.09Å; H349-K352 PolarHBondContact O-N 2.7Å; W350-K352 VanDerWaalsContact C-N 3.32Å; W350-K352 PolarHBondContact O-N 2.87Å; K352-L354 VanDerWaalsContact C-N 3.28Å; K352-L354 PolarHBondContact O-N 2.8Å; K352-L355 HydrophobicContact CG-CD1 4.41Å; K352-L355 WeakPolarHBondContact O-CG 3.22Å; K352-L355 PolarHBondContact O-N 3.08Å
353	D	93.9	Very high	89.4	Confident	123 Å²	123	57.8 Å²	57.8	66%	0.658	31%	0.308	S	S	*	.	H	α-helix	trans	-74.5	-17.2	177.9	-68	-17.7	0	0	0	113	H349 W350 Y351 P356	H349-D353 PolarHBondContact O-N 3.44Å; W350-D353 PolarHBondContact O-N 3.46Å; Y351-D353 VanDerWaalsContact C-N 3.32Å; Y351-D353 PolarHBondContact O-N 2.81Å; D353-P356 WeakPolarHBondContact O-CD 3.13Å
354	L	92.9	Very high	89.3	Confident	18 Å²	18	58.2 Å²	58.2	9%	0.094	31%	0.313	C	S	.	.	H	α-helix	trans	-82.6	-18.8	173.6	-64.4	-179.7	0	0	0	114.2	F257 L325 W350 Y351 K352 P356 L357 L358	F257-L354 HydrophobicContact CE2-CD1 4.29Å; F257-L354 HydrophobicContact CZ-CD1 3.71Å; L325-L354 HydrophobicContact CD1-CD2 3.68Å; L325-L354 HydrophobicContact CD2-CD1 4.32Å; L325-L354 HydrophobicContact CD2-CD2 4.25Å; W350-L354 HydrophobicContact CD2-CD1 4.3Å; W350-L354 HydrophobicContact CE3-CD1 3.86Å; W350-L354 HydrophobicContact CH2-CD1 3.79Å; W350-L354 HydrophobicContact CZ2-CD1 4.22Å; W350-L354 HydrophobicContact CZ3-CD1 3.58Å; W350-L354 WeakPolarHBondContact O-CG 3.17Å; W350-L354 PolarHBondContact O-N 3.37Å; Y351-L354 PolarHBondContact O-N 2.84Å; K352-L354 VanDerWaalsContact C-N 3.28Å; K352-L354 PolarHBondContact O-N 2.8Å; L354-P356 VanDerWaalsContact C-N 3.33Å; L354-L357 HydrophobicContact CD2-CD1 4.32Å; L354-L357 WeakPolarHBondContact O-CB 3.29Å; L354-L357 PolarHBondContact O-N 3.3Å; L354-L358 HydrophobicContact CB-CD1 4.44Å; L354-L358 PolarHBondContact O-N 3.05Å
355	L	89.1	Confident	89.3	Confident	48 Å²	48	60.8 Å²	60.8	25%	0.251	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-35.4	-177.1	-57.6	179.3	0	0	0	114.9	F341 Y351 K352 L357 L358 T361 A363	F341-L355 HydrophobicContact CD2-CD2 4.14Å; F341-L355 HydrophobicContact CE2-CD2 4.42Å; Y351-L355 PolarHBondContact O-N 3.46Å; K352-L355 HydrophobicContact CG-CD1 4.41Å; K352-L355 WeakPolarHBondContact O-CG 3.22Å; K352-L355 PolarHBondContact O-N 3.08Å; L355-L357 PolarHBondContact O-N 3.27Å; L355-L358 CarbonylContact O-C 3.34Å; L355-L358 PolarHBondContact O-N 2.98Å; L355-T361 VanDerWaalsContact CD2-OG1 3.26Å; L355-T361 WeakPolarHBondContact CD2-OG1 3.34Å; L355-A363 HydrophobicContact CD1-CB 4.15Å; L355-A363 HydrophobicContact CD2-CB 4.17Å; L355-A363 HydrophobicContact CG-CB 4.49Å
356	P	87.1	Confident	89.3	Confident	111 Å²	111	59.7 Å²	59.7	72%	0.721	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-17.8	174.9	-21.2	34.9	0	0	0	114.6	D353 L354	D353-P356 WeakPolarHBondContact O-CD 3.13Å; L354-P356 VanDerWaalsContact C-N 3.33Å
357	L	87.7	Confident	89.1	Confident	96 Å²	96	56.2 Å²	56.2	50%	0.503	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.6	-21.5	-179.6	-53.8	177.7	0	0	0	112.2	L325 S329 L354 L355 P359	L325-L357 HydrophobicContact CD1-CD1 3.93Å; S329-L357 PolarHBondContact OG-O 3Å; L354-L357 HydrophobicContact CD2-CD1 4.32Å; L354-L357 WeakPolarHBondContact O-CB 3.29Å; L354-L357 PolarHBondContact O-N 3.3Å; L355-L357 PolarHBondContact O-N 3.27Å; L357-P359 WeakPolarHBondContact O-CD 3.33Å
358	L	85.3	Confident	88.2	Confident	1 Å²	1	57.9 Å²	57.9	1%	0.005	32%	0.317	C	S	.	.	S	Bend	trans	-117.5	85.2	-178.1	-58.8	178.1	0	0	0	109.5	L325 L328 F341 L354 L355 T361	L325-L358 HydrophobicContact CD2-CD1 4.39Å; L325-L358 HydrophobicContact CD2-CD2 4.46Å; L328-L358 HydrophobicContact CG-CD2 4.47Å; F341-L358 HydrophobicContact CE2-CD1 4.04Å; F341-L358 HydrophobicContact CZ-CD1 3.84Å; L354-L358 HydrophobicContact CB-CD1 4.44Å; L354-L358 PolarHBondContact O-N 3.05Å; L355-L358 CarbonylContact O-C 3.34Å; L355-L358 PolarHBondContact O-N 2.98Å; L358-T361 HydrophobicContact CB-CG2 3.6Å; L358-T361 WeakPolarHBondContact O-CB 3.37Å; L358-T361 VanDerWaalsContact O-CG2 3.32Å; L358-T361 WeakPolarHBondContact O-CG2 3.44Å; L358-T361 PolarHBondContact O-N 3.23Å; L358-T361 PolarHBondContact O-OG1 3.26Å
359	P	74.6	Confident	87	Confident	70 Å²	70	62.1 Å²	62.1	46%	0.455	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	146.1	-178.8	31.2	-34.1	0	0	0	110.9	S329 I333 L357 T361	S329-P359 WeakPolarHBondContact OG-CD 3.48Å; I333-P359 HydrophobicContact CD1-CG 3.76Å; I333-P359 HydrophobicContact CG1-CG 4.08Å; L357-P359 WeakPolarHBondContact O-CD 3.33Å; P359-T361 VanDerWaalsContact C-N 3.25Å
360	G	77.1	Confident	86.2	Confident	35 Å²	35	56.8 Å²	56.8	36%	0.361	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.5	7.1	-172.9	0	0	0	0	0	114	N338 V339	N338-G360 VanDerWaalsContact CA-O 3.3Å; N338-G360 WeakPolarHBondContact CA-O 3.31Å; N338-G360 WeakPolarHBondContact CB-O 3.31Å; V339-G360 PolarHBondContact N-O 3.47Å
361	T	87.3	Confident	85.3	Confident	15 Å²	15	56.3 Å²	56.3	9%	0.092	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	157.2	173.9	74	0	0	0	0	112.6	V339 F341 L355 L358 P359	V339-T361 HydrophobicContact CB-CG2 3.56Å; V339-T361 HydrophobicContact CG2-CG2 3.7Å; V339-T361 CarbonylContact O-C 3.01Å; V339-T361 VanDerWaalsContact O-CA 3.29Å; V339-T361 WeakPolarHBondContact O-CA 3.45Å; F341-T361 HydrophobicContact CE2-CG2 4.32Å; L355-T361 VanDerWaalsContact CD2-OG1 3.26Å; L355-T361 WeakPolarHBondContact CD2-OG1 3.34Å; L358-T361 HydrophobicContact CB-CG2 3.6Å; L358-T361 WeakPolarHBondContact O-CB 3.37Å; L358-T361 VanDerWaalsContact O-CG2 3.32Å; L358-T361 WeakPolarHBondContact O-CG2 3.44Å; L358-T361 PolarHBondContact O-N 3.23Å; L358-T361 PolarHBondContact O-OG1 3.26Å; P359-T361 VanDerWaalsContact C-N 3.25Å
362	I	89.4	Confident	84.7	Confident	35 Å²	35	58 Å²	58	18%	0.179	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	160.4	167.9	65.9	165.8	0	0	0	109.7	V339 I340 F341 A380	V339-I362 PolarHBondContact O-N 3Å; I340-I362 HydrophobicContact CB-CG1 4.36Å; I340-I362 HydrophobicContact CG1-CD1 4.24Å; I340-I362 HydrophobicContact CG1-CG1 4.17Å; I340-I362 HydrophobicContact CG2-CD1 4.25Å; I340-I362 HydrophobicContact CG2-CG1 4.26Å; F341-I362 WeakPolarHBondContact CD2-O 3.36Å; F341-I362 PolarHBondContact N-O 3.44Å; I362-A380 HydrophobicContact CD1-CB 3.31Å; I362-A380 HydrophobicContact CG1-CB 4.47Å
363	A	91.3	Very high	84.4	Confident	22 Å²	22	53 Å²	53	18%	0.182	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	143.9	167.1	0	0	0	0	0	110.2	F341 F348 L355	F341-A363 HydrophobicContact CB-CB 4.03Å; F341-A363 CarbonylContact O-C 3.51Å; F341-A363 WeakPolarHBondContact O-CA 3.5Å; F348-A363 HydrophobicContact CD2-CB 4.16Å; F348-A363 HydrophobicContact CE2-CB 3.77Å; L355-A363 HydrophobicContact CD1-CB 4.15Å; L355-A363 HydrophobicContact CD2-CB 4.17Å; L355-A363 HydrophobicContact CG-CB 4.49Å
364	G	90.9	Very high	84	Confident	10 Å²	10	47.6 Å²	47.6	10%	0.103	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	143.6	167.3	0	0	0	0	0	110.5	F341 V343	F341-G364 PolarHBondContact O-N 3.06Å; V343-G364 PolarHBondContact N-O 3.45Å
365	E	91.4	Very high	83.6	Confident	101 Å²	101	50.6 Å²	50.6	47%	0.472	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	128.9	174.4	-169.9	173.2	-177.3	0	0	109.4	V343 F348 N372	V343-E365 CarbonylContact O-C 2.89Å; V343-E365 VanDerWaalsContact O-CA 3.28Å; V343-E365 WeakPolarHBondContact O-CA 3.48Å; F348-E365 HydrophobicContact CB-CB 4.28Å; F348-E365 HydrophobicContact CB-CG 4.29Å; F348-E365 HydrophobicContact CD1-CB 4.04Å; F348-E365 HydrophobicContact CD2-CB 4.14Å; F348-E365 HydrophobicContact CE1-CB 4.43Å; F348-E365 HydrophobicContact CG-CB 3.88Å; F348-E365 HydrophobicContact CG-CG 4.39Å; E365-N372 PolarHBondContact O-ND2 2.85Å
366	I	88.1	Confident	83.5	Confident	3 Å²	3	49.4 Å²	49.4	2%	0.015	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	134.3	171.9	54.6	168.7	0	0	0	111.6	M283 A342 V343 Q344 N372 L373 L376	M283-I366 HydrophobicContact CE-CD1 4.42Å; A342-I366 HydrophobicContact CB-CG2 3.76Å; A342-I366 WeakPolarHBondContact O-CD1 3.16Å; V343-I366 PolarHBondContact O-N 3.06Å; Q344-I366 HydrophobicContact CB-CD1 4.18Å; Q344-I366 HydrophobicContact CB-CG1 3.81Å; Q344-I366 HydrophobicContact CG-CG1 4.46Å; I366-N372 WeakPolarHBondContact CA-OD1 3.45Å; I366-L373 HydrophobicContact CG2-CD1 4.1Å; I366-L376 HydrophobicContact CG2-CD2 4.23Å
367	E	83.1	Confident	83.6	Confident	112 Å²	112	44.1 Å²	44.1	52%	0.523	26%	0.257	S	S	.	.	P	Polyproline II helix	trans	-67.4	154.7	168.8	-70	170.2	-154.7	0	0	110.5	K369 A370 A371 N372	E367-K369 PolarHBondContact O-N 2.83Å; E367-A370 VanDerWaalsContact O-CA 3.3Å; E367-A370 WeakPolarHBondContact O-CA 3.46Å; E367-A370 PolarHBondContact O-N 2.96Å; E367-A371 HydrophobicContact CB-CB 4.45Å; E367-N372 HydrophobicContact CG-CB 4.26Å; E367-N372 PolarHBondContact N-OD1 2.86Å
368	S	72.7	Confident	83.5	Confident	90 Å²	90	40.2 Å²	40.2	63%	0.629	24%	0.237	S	C	*	.	G	3₁₀ helix	trans	-49.4	136	174.7	63.7	0	0	0	0	112	A370	S368-A370 PolarHBondContact O-N 3.43Å
369	K	68.3	Low	83.5	Confident	118 Å²	118	45.8 Å²	45.8	51%	0.513	26%	0.263	S	S	.	.	G	3₁₀ helix	trans	64.7	19.6	-172.9	-44.3	-173.2	-178.4	-169.4	0	114.1	N162 K165 E367 A371	N162-K369 WeakPolarHBondContact OD1-CA 3.07Å; N162-K369 PolarHBondContact OD1-N 3.42Å; K165-K369 HydrophobicContact CB-CB 4.26Å; K165-K369 HydrophobicContact CG-CB 4.16Å; K165-K369 WeakPolarHBondContact CG-O 3.33Å; E367-K369 PolarHBondContact O-N 2.83Å; K369-A371 VanDerWaalsContact C-N 3.27Å; K369-A371 PolarHBondContact O-N 3.45Å
370	A	75.8	Confident	84	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	55.5	33	175.9	0	0	0	0	0	114.9	M283 E367 S368 N372 L373	M283-A370 HydrophobicContact CE-CB 4.08Å; E367-A370 VanDerWaalsContact O-CA 3.3Å; E367-A370 WeakPolarHBondContact O-CA 3.46Å; E367-A370 PolarHBondContact O-N 2.96Å; S368-A370 PolarHBondContact O-N 3.43Å; A370-N372 VanDerWaalsContact C-N 3.32Å; A370-N372 PolarHBondContact O-N 3.02Å; A370-L373 HydrophobicContact CB-CB 4.11Å; A370-L373 HydrophobicContact CB-CD2 4.23Å; A370-L373 VanDerWaalsContact O-CB 3.23Å; A370-L373 WeakPolarHBondContact O-CB 3.43Å; A370-L373 PolarHBondContact O-N 3.22Å; A370-L373 VanDerWaalsContact O-N 3.17Å
371	A	76.4	Confident	84.3	Confident	68 Å²	68	41.2 Å²	41.2	56%	0.562	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60	-37.8	-172.4	0	0	0	0	0	113.9	E367 K369	E367-A371 HydrophobicContact CB-CB 4.45Å; K369-A371 VanDerWaalsContact C-N 3.27Å; K369-A371 PolarHBondContact O-N 3.45Å
372	N	84.6	Confident	84.1	Confident	36 Å²	36	44.4 Å²	44.4	19%	0.193	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-8.3	-179.9	67.9	-22.4	0	0	0	114.5	E365 I366 E367 A370 N374 N375 L376	E365-N372 PolarHBondContact O-ND2 2.85Å; I366-N372 WeakPolarHBondContact CA-OD1 3.45Å; E367-N372 HydrophobicContact CG-CB 4.26Å; E367-N372 PolarHBondContact N-OD1 2.86Å; A370-N372 VanDerWaalsContact C-N 3.32Å; A370-N372 PolarHBondContact O-N 3.02Å; N372-N374 PolarHBondContact O-N 3.41Å; N372-N374 VanDerWaalsContact O-N 3.08Å; N372-N375 PolarHBondContact O-N 3.17Å; N372-L376 PolarHBondContact O-N 3.4Å
373	L	85.6	Confident	83.6	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-52.8	-38.5	-173.2	-178.3	64.1	0	0	0	112.9	Y151 L166 V169 L281 M283 A342 I366 A370 N375 L376 V377	Y151-L373 HydrophobicContact CE1-CD2 4.24Å; L166-L373 HydrophobicContact CD1-CD2 4.25Å; V169-L373 HydrophobicContact CG1-CB 4.16Å; V169-L373 HydrophobicContact CG1-CD2 3.89Å; V169-L373 HydrophobicContact CG1-CG 4.38Å; L281-L373 HydrophobicContact CD1-CD1 4.07Å; L281-L373 HydrophobicContact CD2-CD1 4.24Å; L281-L373 HydrophobicContact CD2-CD2 4.47Å; M283-L373 HydrophobicContact CE-CD2 3.72Å; M283-L373 HydrophobicContact SD-CD2 3.65Å; A342-L373 HydrophobicContact CB-CD1 3.74Å; I366-L373 HydrophobicContact CG2-CD1 4.1Å; A370-L373 HydrophobicContact CB-CB 4.11Å; A370-L373 HydrophobicContact CB-CD2 4.23Å; A370-L373 VanDerWaalsContact O-CB 3.23Å; A370-L373 WeakPolarHBondContact O-CB 3.43Å; A370-L373 PolarHBondContact O-N 3.22Å; A370-L373 VanDerWaalsContact O-N 3.17Å; L373-N375 VanDerWaalsContact C-N 3.25Å; L373-N375 PolarHBondContact O-N 3.07Å; L373-L376 PolarHBondContact O-N 3.19Å; L373-V377 HydrophobicContact CD1-CG2 4.13Å; L373-V377 HydrophobicContact CG-CG2 4.41Å; L373-V377 WeakPolarHBondContact O-CG2 3.33Å; L373-V377 PolarHBondContact O-N 3.44Å
374	N	85.1	Confident	83	Confident	10 Å²	10	47.8 Å²	47.8	5%	0.053	25%	0.252	C	S	.	.	H	α-helix	trans	-70.6	-17.6	-178.3	-76.5	-3	0	0	0	114.5	V169 D172 L173 K176 N372 V378	V169-N374 WeakPolarHBondContact CG1-OD1 3.33Å; V169-N374 PolarHBondContact O-ND2 3Å; V169-N374 PolarHBondContact O-OD1 3.43Å; D172-N374 VanDerWaalsContact CB-ND2 3.27Å; D172-N374 WeakPolarHBondContact CB-ND2 3.47Å; L173-N374 WeakPolarHBondContact CB-OD1 3.46Å; L173-N374 PolarHBondContact N-ND2 2.87Å; K176-N374 HydrophobicContact CD-CB 4.1Å; N372-N374 PolarHBondContact O-N 3.41Å; N372-N374 VanDerWaalsContact O-N 3.08Å; N374-V378 VanDerWaalsContact O-CG2 3.3Å; N374-V378 WeakPolarHBondContact O-CG2 3.33Å
375	N	85.4	Confident	82.4	Confident	81 Å²	81	49.3 Å²	49.3	43%	0.433	26%	0.257	S	S	.	.	H	α-helix	trans	-89	-44.7	170.8	-64.5	-6.2	0	0	0	109.3	K176 N372 L373 V377 V378 E379	K176-N375 PolarHBondContact NZ-OD1 2.9Å; N372-N375 PolarHBondContact O-N 3.17Å; L373-N375 VanDerWaalsContact C-N 3.25Å; L373-N375 PolarHBondContact O-N 3.07Å; N375-V377 VanDerWaalsContact C-N 3.33Å; N375-V377 PolarHBondContact O-N 2.97Å; N375-V378 PolarHBondContact O-N 3.01Å; N375-E379 WeakPolarHBondContact O-CG 3.39Å; N375-E379 PolarHBondContact O-N 2.91Å
376	L	87.1	Confident	81.9	Confident	24 Å²	24	45.3 Å²	45.3	13%	0.126	24%	0.24	C	C	.	.	H	α-helix	trans	-51.5	-47.6	176.4	177.6	59.3	0	0	0	112.5	I340 A342 I366 N372 L373 A380	I340-L376 HydrophobicContact CG2-CD2 4.37Å; I340-L376 HydrophobicContact CG2-CG 4.24Å; A342-L376 HydrophobicContact CB-CD2 4.01Å; I366-L376 HydrophobicContact CG2-CD2 4.23Å; N372-L376 PolarHBondContact O-N 3.4Å; L373-L376 PolarHBondContact O-N 3.19Å; L376-A380 WeakPolarHBondContact O-CB 3.45Å; L376-A380 PolarHBondContact O-N 2.91Å
377	V	87.6	Confident	81.6	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-70.5	-32	179.8	-178.6	0	0	0	0	112.7	L149 L173 L281 I340 L373 N375 A380 Y381	L149-V377 HydrophobicContact CD1-CG1 4.35Å; L149-V377 HydrophobicContact CD2-CG1 4.14Å; L173-V377 HydrophobicContact CD1-CB 4.07Å; L173-V377 HydrophobicContact CD1-CG1 4.18Å; L173-V377 HydrophobicContact CD2-CB 4.19Å; L173-V377 HydrophobicContact CD2-CG1 3.95Å; L173-V377 HydrophobicContact CD2-CG2 4.35Å; L281-V377 HydrophobicContact CD1-CG2 4.12Å; L281-V377 HydrophobicContact CD2-CG2 3.78Å; I340-V377 HydrophobicContact CD1-CB 4.43Å; I340-V377 HydrophobicContact CD1-CG1 4.05Å; I340-V377 HydrophobicContact CD1-CG2 4.31Å; L373-V377 HydrophobicContact CD1-CG2 4.13Å; L373-V377 HydrophobicContact CG-CG2 4.41Å; L373-V377 WeakPolarHBondContact O-CG2 3.33Å; L373-V377 PolarHBondContact O-N 3.44Å; N375-V377 VanDerWaalsContact C-N 3.33Å; N375-V377 PolarHBondContact O-N 2.97Å; V377-A380 WeakPolarHBondContact O-CB 3.44Å; V377-Y381 WeakPolarHBondContact O-CB 3.47Å; V377-Y381 PolarHBondContact O-N 2.92Å
378	V	86.9	Confident	81.7	Confident	14 Å²	14	41.5 Å²	41.5	9%	0.085	22%	0.223	C	C	.	.	H	α-helix	trans	-71.4	-44.7	176.2	167.5	0	0	0	0	110.9	L173 K176 M177 F180 N374 N375 A380 Y381 Q382	L173-V378 HydrophobicContact CD1-CG2 4.25Å; K176-V378 HydrophobicContact CB-CG2 4.11Å; K176-V378 HydrophobicContact CD-CG2 4.42Å; M177-V378 HydrophobicContact SD-CG2 4.19Å; F180-V378 HydrophobicContact CD2-CG1 4.14Å; F180-V378 HydrophobicContact CE2-CG1 3.46Å; F180-V378 VanDerWaalsContact CE2-CG1 3.46Å; F180-V378 HydrophobicContact CE2-CG2 4.23Å; F180-V378 HydrophobicContact CZ-CG1 3.76Å; N374-V378 VanDerWaalsContact O-CG2 3.3Å; N374-V378 WeakPolarHBondContact O-CG2 3.33Å; N375-V378 PolarHBondContact O-N 3.01Å; V378-A380 VanDerWaalsContact C-N 3.35Å; V378-Y381 PolarHBondContact O-N 2.8Å; V378-Q382 HydrophobicContact CG1-CG 4.46Å; V378-Q382 WeakPolarHBondContact O-CB 3.43Å; V378-Q382 VanDerWaalsContact O-CG 3.3Å; V378-Q382 WeakPolarHBondContact O-CG 3.39Å; V378-Q382 PolarHBondContact O-N 2.86Å
379	E	85.8	Confident	82.2	Confident	118 Å²	118	39.4 Å²	39.4	55%	0.551	20%	0.202	S	C	*	.	H	α-helix	trans	-63.8	-40.6	175.4	-70.7	167.8	-145.5	0	0	111.3	N375 Y381 Q382 K383	N375-E379 WeakPolarHBondContact O-CG 3.39Å; N375-E379 PolarHBondContact O-N 2.91Å; E379-Y381 PolarHBondContact O-N 2.9Å; E379-Q382 PolarHBondContact O-N 3.29Å; E379-K383 WeakPolarHBondContact O-CB 3.36Å; E379-K383 PolarHBondContact O-N 2.91Å
380	A	83.8	Confident	82.9	Confident	8 Å²	8	33.9 Å²	33.9	7%	0.066	18%	0.179	C	C	.	.	H	α-helix	trans	-55.8	-50.2	171.8	0	0	0	0	0	112.2	I340 I362 L376 V377 V378 K383 L384	I340-A380 HydrophobicContact CD1-CB 3.46Å; I340-A380 VanDerWaalsContact CD1-CB 3.46Å; I340-A380 HydrophobicContact CG1-CB 3.82Å; I362-A380 HydrophobicContact CD1-CB 3.31Å; I362-A380 HydrophobicContact CG1-CB 4.47Å; L376-A380 WeakPolarHBondContact O-CB 3.45Å; L376-A380 PolarHBondContact O-N 2.91Å; V377-A380 WeakPolarHBondContact O-CB 3.44Å; V378-A380 VanDerWaalsContact C-N 3.35Å; A380-K383 PolarHBondContact O-N 3.3Å; A380-L384 WeakPolarHBondContact O-CB 3.24Å; A380-L384 PolarHBondContact O-N 3.35Å
381	Y	83.9	Confident	83.3	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-67.4	-42	-179.6	176.8	-113.4	0	0	0	112.2	V147 M177 F180 K277 L279 V377 V378 E379 K383 L384 I385	V147-Y381 HydrophobicContact CG1-CE2 4.47Å; V147-Y381 HydrophobicContact CG2-CD2 4.04Å; V147-Y381 HydrophobicContact CG2-CE1 4.34Å; V147-Y381 HydrophobicContact CG2-CE2 3.25Å; V147-Y381 VanDerWaalsContact CG2-CZ 3.43Å; V147-Y381 WeakPolarHBondContact CG2-OH 3.48Å; M177-Y381 HydrophobicContact CE-CD1 3.87Å; M177-Y381 HydrophobicContact CE-CD2 4.4Å; M177-Y381 HydrophobicContact CE-CE1 4.34Å; M177-Y381 HydrophobicContact CE-CG 3.89Å; F180-Y381 HydrophobicContact CB-CD1 4Å; F180-Y381 HydrophobicContact CB-CE1 3.66Å; K277-Y381 HydrophobicContact CB-CE2 4.39Å; K277-Y381 HydrophobicContact CG-CE2 4.46Å; L279-Y381 HydrophobicContact CD1-CD2 4.23Å; V377-Y381 WeakPolarHBondContact O-CB 3.47Å; V377-Y381 PolarHBondContact O-N 2.92Å; V378-Y381 PolarHBondContact O-N 2.8Å; E379-Y381 PolarHBondContact O-N 2.9Å; Y381-K383 VanDerWaalsContact C-N 3.34Å; Y381-K383 PolarHBondContact O-N 2.89Å; Y381-L384 WeakPolarHBondContact O-CB 3.43Å; Y381-L384 PolarHBondContact O-N 2.88Å; Y381-I385 HydrophobicContact CD2-CG2 4.03Å; Y381-I385 HydrophobicContact CE1-CD1 4.14Å; Y381-I385 HydrophobicContact CE1-CG2 4.18Å; Y381-I385 HydrophobicContact CE2-CG2 3.38Å; Y381-I385 VanDerWaalsContact CZ-CG2 3.48Å; Y381-I385 WeakPolarHBondContact O-CG1 3.44Å; Y381-I385 PolarHBondContact O-N 3.23Å
382	Q	82.2	Confident	83.7	Confident	82 Å²	82	34.2 Å²	34.2	38%	0.383	17%	0.169	S	C	.	.	H	α-helix	trans	-59.7	-43.4	174.9	-75.3	177.5	12.5	0	0	111.8	F180 V378 E379 I385 S386	F180-Q382 HydrophobicContact CE1-CG 4.46Å; F180-Q382 VanDerWaalsContact CZ-NE2 3.29Å; V378-Q382 HydrophobicContact CG1-CG 4.46Å; V378-Q382 WeakPolarHBondContact O-CB 3.43Å; V378-Q382 VanDerWaalsContact O-CG 3.3Å; V378-Q382 WeakPolarHBondContact O-CG 3.39Å; V378-Q382 PolarHBondContact O-N 2.86Å; E379-Q382 PolarHBondContact O-N 3.29Å; Q382-I385 WeakPolarHBondContact O-CG1 3.44Å; Q382-S386 PolarHBondContact O-N 3.03Å
383	K	80.6	Confident	83.5	Confident	102 Å²	102	35.4 Å²	35.4	44%	0.443	17%	0.173	S	C	.	.	H	α-helix	trans	-61.8	-47.1	173.2	-173.8	-176.7	176.6	-170.8	0	111	E379 A380 Y381 I385 S386 E387	E379-K383 WeakPolarHBondContact O-CB 3.36Å; E379-K383 PolarHBondContact O-N 2.91Å; A380-K383 PolarHBondContact O-N 3.3Å; Y381-K383 VanDerWaalsContact C-N 3.34Å; Y381-K383 PolarHBondContact O-N 2.89Å; K383-I385 PolarHBondContact O-N 3.43Å; K383-S386 WeakPolarHBondContact O-CB 3.35Å; K383-S386 PolarHBondContact O-N 3.08Å; K383-S386 PolarHBondContact O-OG 2.98Å; K383-E387 WeakPolarHBondContact CE-OE1 3.47Å; K383-E387 PolarHBondContact O-N 3.04Å
384	L	77.8	Confident	83.3	Confident	26 Å²	26	37.7 Å²	37.7	14%	0.136	19%	0.185	C	C	.	.	H	α-helix	trans	-58.1	-47	-179.2	-176.3	71.3	0	0	0	112.8	K277 L279 N338 A380 Y381 S386 E387	K277-L384 HydrophobicContact CB-CD2 4.05Å; K277-L384 HydrophobicContact CD-CD2 4.23Å; K277-L384 HydrophobicContact CG-CD2 4.39Å; L279-L384 HydrophobicContact CD2-CD2 3.76Å; L279-L384 HydrophobicContact CG-CD2 4.46Å; N338-L384 HydrophobicContact CB-CD1 3.95Å; N338-L384 HydrophobicContact CB-CD2 4.36Å; N338-L384 VanDerWaalsContact CG-CD1 3.43Å; N338-L384 VanDerWaalsContact OD1-CD1 3.29Å; N338-L384 WeakPolarHBondContact OD1-CD1 3Å; A380-L384 WeakPolarHBondContact O-CB 3.24Å; A380-L384 PolarHBondContact O-N 3.35Å; Y381-L384 WeakPolarHBondContact O-CB 3.43Å; Y381-L384 PolarHBondContact O-N 2.88Å; L384-S386 PolarHBondContact O-N 3.37Å; L384-E387 PolarHBondContact O-N 2.93Å
385	I	78.4	Confident	82.8	Confident	42 Å²	42	43.9 Å²	43.9	22%	0.215	21%	0.214	C	C	.	.	H	α-helix	trans	-70.9	-15.4	178.6	65.3	179.8	0	0	0	113.3	Y145 Y381 Q382 K383	Y145-I385 HydrophobicContact CD2-CG2 4.06Å; Y381-I385 HydrophobicContact CD2-CG2 4.03Å; Y381-I385 HydrophobicContact CE1-CD1 4.14Å; Y381-I385 HydrophobicContact CE1-CG2 4.18Å; Y381-I385 HydrophobicContact CE2-CG2 3.38Å; Y381-I385 VanDerWaalsContact CZ-CG2 3.48Å; Y381-I385 WeakPolarHBondContact O-CG1 3.44Å; Y381-I385 PolarHBondContact O-N 3.23Å; Q382-I385 WeakPolarHBondContact O-CG1 3.44Å; K383-I385 PolarHBondContact O-N 3.43Å
386	S	81	Confident	82.6	Confident	17 Å²	17	40.4 Å²	40.4	12%	0.119	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-9.3	174.4	86.9	0	0	0	0	114.2	Q382 K383 L384 R420 N421 V422	Q382-S386 PolarHBondContact O-N 3.03Å; K383-S386 WeakPolarHBondContact O-CB 3.35Å; K383-S386 PolarHBondContact O-N 3.08Å; K383-S386 PolarHBondContact O-OG 2.98Å; L384-S386 PolarHBondContact O-N 3.37Å; S386-R420 CarbonylContact O-C 3.52Å; S386-R420 WeakPolarHBondContact O-CA 3.44Å; S386-N421 PolarHBondContact O-N 3.47Å; S386-N421 VanDerWaalsContact O-N 3.08Å; S386-N421 PolarHBondContact OG-N 2.8Å; S386-V422 WeakPolarHBondContact CA-O 3.39Å; S386-V422 WeakPolarHBondContact O-CB 3.49Å; S386-V422 PolarHBondContact O-N 3.37Å
387	E	82	Confident	82.2	Confident	34 Å²	34	48.5 Å²	48.5	16%	0.159	22%	0.224	C	C	.	.			trans	-100	116.4	177.7	-64.8	-165.9	-173.4	0	0	111	K383 L384 K389 C419 R420	K383-E387 WeakPolarHBondContact CE-OE1 3.47Å; K383-E387 PolarHBondContact O-N 3.04Å; L384-E387 PolarHBondContact O-N 2.93Å; E387-K389 WeakPolarHBondContact OE2-CE 3.05Å; E387-K389 IonicContact OE2-NZ 3.45Å; E387-K389 PolarHBondContact OE2-NZ 3.23Å; E387-C419 CarbonylContact C-O 3.43Å; E387-C419 WeakPolarHBondContact CA-O 3.44Å; E387-R420 HydrophobicContact CG-CB 4.11Å; E387-R420 HydrophobicContact CG-CG 3.99Å
388	V	84.5	Confident	81.8	Confident	1 Å²	1	49.7 Å²	49.7	1%	0.006	24%	0.236	C	C	.	.	B	Isolated β-bridge	trans	-110.5	110.3	177.2	-176.8	0	0	0	0	108.7	I139 P141 G418 C419 V422 V428 F430	I139-V388 HydrophobicContact CB-CG1 4.2Å; I139-V388 HydrophobicContact CG2-CG1 3.77Å; P141-V388 HydrophobicContact CB-CG2 4.38Å; P141-V388 HydrophobicContact CG-CG2 4.39Å; V388-G418 CarbonylContact O-C 3.57Å; V388-G418 VanDerWaalsContact O-CA 3.26Å; V388-G418 WeakPolarHBondContact O-CA 3.49Å; V388-C419 PolarHBondContact N-O 2.9Å; V388-C419 PolarHBondContact O-N 2.69Å; V388-V422 HydrophobicContact CG2-CB 4.11Å; V388-V422 HydrophobicContact CG2-CG1 4.16Å; V388-V422 HydrophobicContact CG2-CG2 4.12Å; V388-V428 HydrophobicContact CB-CB 4.49Å; V388-V428 HydrophobicContact CB-CG2 3.98Å; V388-V428 HydrophobicContact CG1-CB 4.13Å; V388-V428 HydrophobicContact CG1-CG1 4.42Å; V388-V428 HydrophobicContact CG1-CG2 4.11Å; V388-V428 HydrophobicContact CG2-CG2 3.99Å; V388-F430 HydrophobicContact CG1-CE2 4Å; V388-F430 HydrophobicContact CG1-CZ 4.22Å
389	K	82.8	Confident	81.7	Confident	46 Å²	46	49.6 Å²	49.6	20%	0.2	24%	0.236	C	C	.	.			trans	-130.5	154.7	-176.6	-67	175.9	-174.5	162.5	0	110.2	E387 E417 P452 I453	E387-K389 WeakPolarHBondContact OE2-CE 3.05Å; E387-K389 IonicContact OE2-NZ 3.45Å; E387-K389 PolarHBondContact OE2-NZ 3.23Å; K389-E417 WeakPolarHBondContact CE-O 3.48Å; K389-E417 WeakPolarHBondContact CG-O 2.95Å; K389-P452 CarbonylContact O-C 3.55Å; K389-P452 VanDerWaalsContact O-CA 3.28Å; K389-P452 WeakPolarHBondContact O-CA 3.4Å; K389-I453 HydrophobicContact CB-CB 4.45Å; K389-I453 HydrophobicContact CB-CD1 3.8Å; K389-I453 HydrophobicContact CB-CG1 4.12Å; K389-I453 PolarHBondContact O-N 3.42Å
390	V	84.1	Confident	81.8	Confident	3 Å²	3	50 Å²	50	2%	0.018	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	148.7	177.3	-62.5	0	0	0	0	111.5	I139 I403 F430 I450 K451	I139-V390 HydrophobicContact CD1-CG1 3.43Å; I139-V390 VanDerWaalsContact CD1-CG1 3.43Å; V390-I403 HydrophobicContact CG2-CD1 4.22Å; V390-I403 HydrophobicContact CG2-CG2 4.08Å; V390-F430 HydrophobicContact CB-CE1 4.39Å; V390-F430 HydrophobicContact CG1-CD1 4.18Å; V390-F430 HydrophobicContact CG1-CD2 4.29Å; V390-F430 HydrophobicContact CG1-CE1 3.95Å; V390-F430 HydrophobicContact CG1-CE2 4.09Å; V390-F430 HydrophobicContact CG1-CG 4.34Å; V390-F430 HydrophobicContact CG1-CZ 3.91Å; V390-F430 HydrophobicContact CG2-CD1 3.7Å; V390-F430 HydrophobicContact CG2-CE1 3.66Å; V390-F430 HydrophobicContact CG2-CG 4.48Å; V390-F430 HydrophobicContact CG2-CZ 4.43Å; V390-I450 HydrophobicContact CB-CG2 3.9Å; V390-I450 HydrophobicContact CG1-CG2 4.14Å; V390-I450 HydrophobicContact CG2-CG2 4.38Å; V390-K451 CarbonylContact C-O 3.6Å; V390-K451 WeakPolarHBondContact CA-O 3.45Å
391	H	83	Confident	82.1	Confident	72 Å²	72	51.6 Å²	51.6	33%	0.333	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	153.7	173	-177.7	71.1	0	0	0	110.2	I450 K451	H391-I450 WeakPolarHBondContact O-CA 3.42Å; H391-K451 PolarHBondContact N-O 3.1Å; H391-K451 PolarHBondContact O-N 3.29Å
392	V	85.3	Confident	82.4	Confident	3 Å²	3	56 Å²	56	2%	0.018	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	94	-178	-170.2	0	0	0	0	109.9	Q395 F401 I403 M416 I449 I450	V392-Q395 HydrophobicContact CG1-CG 4.31Å; V392-F401 HydrophobicContact CG1-CD1 4.46Å; V392-F401 HydrophobicContact CG1-CD2 4.12Å; V392-F401 HydrophobicContact CG1-CE2 4.39Å; V392-F401 HydrophobicContact CG1-CG 4.16Å; V392-I403 HydrophobicContact CG2-CD1 3.59Å; V392-M416 HydrophobicContact CG2-CE 3.98Å; V392-I449 CarbonylContact C-O 3.54Å; V392-I449 WeakPolarHBondContact CA-O 3.38Å; V392-I450 HydrophobicContact CG2-CG1 4.34Å
393	E	80.9	Confident	82.8	Confident	60 Å²	60	52.4 Å²	52.4	28%	0.28	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	158.7	173	-61.2	-175.2	-179.6	0	0	111	Q395 I449 K451	E393-Q395 PolarHBondContact O-N 3.03Å; E393-I449 HydrophobicContact CB-CB 4.36Å; E393-I449 PolarHBondContact N-O 3.13Å; E393-I449 PolarHBondContact O-N 3.31Å; E393-K451 WeakPolarHBondContact OE1-CD 3.38Å; E393-K451 WeakPolarHBondContact OE1-CE 3.36Å; E393-K451 IonicContact OE1-NZ 3.78Å; E393-K451 PolarHBondContact OE1-NZ 2.92Å
394	N	80.8	Confident	83.3	Confident	48 Å²	48	49 Å²	49	26%	0.257	23%	0.234	S	C	.	.	S	Bend	trans	58.3	43.6	175.9	-60.5	-76.1	0	0	0	114.4	V396 K445 Y447	N394-V396 PolarHBondContact O-N 3.49Å; N394-K445 HydrophobicContact CB-CD 4.22Å; N394-K445 PolarHBondContact OD1-NZ 2.85Å; N394-Y447 HydrophobicContact CB-CE2 4.35Å
395	Q	73.9	Confident	84	Confident	141 Å²	141	47.8 Å²	47.8	66%	0.659	23%	0.227	S	C	*	.	P	Polyproline II helix	trans	-52.8	132.5	179.5	-66.4	-172.1	5.4	0	0	112.9	V392 E393	V392-Q395 HydrophobicContact CG1-CG 4.31Å; E393-Q395 PolarHBondContact O-N 3.03Å
396	V	81.7	Confident	84.7	Confident	7 Å²	7	47.3 Å²	47.3	4%	0.042	23%	0.225	C	C	.	.	P	Polyproline II helix	trans	-97	123.2	-172.1	175.3	0	0	0	0	109.9	N394 G398 V399 K445 Y447 A448 I463	N394-V396 PolarHBondContact O-N 3.49Å; V396-G398 PolarHBondContact O-N 3.31Å; V396-V399 HydrophobicContact CB-CB 4.26Å; V396-V399 HydrophobicContact CB-CG2 4.36Å; V396-V399 HydrophobicContact CG1-CB 4.29Å; V396-V399 HydrophobicContact CG1-CG2 3.86Å; V396-V399 PolarHBondContact O-N 3Å; V396-V399 VanDerWaalsContact O-N 3.13Å; V396-K445 WeakPolarHBondContact CG1-O 3.48Å; V396-Y447 WeakPolarHBondContact CG2-O 3.18Å; V396-A448 HydrophobicContact CG2-CB 4.36Å; V396-I463 HydrophobicContact CB-CD1 4.15Å; V396-I463 HydrophobicContact CG1-CD1 4.46Å; V396-I463 HydrophobicContact CG2-CD1 3.89Å
397	R	79.6	Confident	85.1	Confident	194 Å²	194	47.1 Å²	47.1	73%	0.732	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.1	135.4	-179.8	-64	-177.6	-177.7	173.9	0.2	111.2	V399 V441 R465	R397-V399 VanDerWaalsContact C-N 3.28Å; R397-V441 HydrophobicContact CB-CG1 3.81Å; R397-R465 PolarHBondContact O-NH2 3.02Å
398	G	78.8	Confident	85.4	Confident	25 Å²	25	48.4 Å²	48.4	26%	0.258	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.7	-4.9	-177.8	0	0	0	0	0	115.1	V396	V396-G398 PolarHBondContact O-N 3.31Å
399	V	85.2	Confident	85.5	Confident	13 Å²	13	54.1 Å²	54.1	8%	0.079	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	137.1	-176.6	-176.2	0	0	0	0	110	V396 R397 F401 V434 T435 M436 I463	V396-V399 HydrophobicContact CB-CB 4.26Å; V396-V399 HydrophobicContact CB-CG2 4.36Å; V396-V399 HydrophobicContact CG1-CB 4.29Å; V396-V399 HydrophobicContact CG1-CG2 3.86Å; V396-V399 PolarHBondContact O-N 3Å; V396-V399 VanDerWaalsContact O-N 3.13Å; R397-V399 VanDerWaalsContact C-N 3.28Å; V399-F401 HydrophobicContact CG1-CE2 4.18Å; V399-V434 HydrophobicContact CG1-CG1 3.38Å; V399-T435 WeakPolarHBondContact CA-O 3.22Å; V399-M436 HydrophobicContact CG2-CG 4.48Å; V399-I463 HydrophobicContact CG1-CD1 4.14Å; V399-I463 HydrophobicContact CG2-CG2 4.37Å
400	Y	88.1	Confident	85.5	Confident	127 Å²	127	54.5 Å²	54.5	50%	0.498	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	143.3	-178.9	-54.7	-87	0	0	0	110.7	V434 T435 K437	Y400-V434 WeakPolarHBondContact O-CA 3.42Å; Y400-T435 PolarHBondContact N-O 3.16Å; Y400-T435 PolarHBondContact O-N 2.93Å; Y400-K437 HydrophobicContact CD2-CG 4.4Å; Y400-K437 HydrophobicContact CE2-CB 4.47Å; Y400-K437 HydrophobicContact CE2-CD 4.07Å; Y400-K437 HydrophobicContact CE2-CG 3.99Å
401	F	89.1	Confident	85.7	Confident	40 Å²	40	55.8 Å²	55.8	18%	0.175	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	119.3	176.9	-72	-98.3	0	0	0	109.4	V392 V399 V432 V434 A448 I450 I463	V392-F401 HydrophobicContact CG1-CD1 4.46Å; V392-F401 HydrophobicContact CG1-CD2 4.12Å; V392-F401 HydrophobicContact CG1-CE2 4.39Å; V392-F401 HydrophobicContact CG1-CG 4.16Å; V399-F401 HydrophobicContact CG1-CE2 4.18Å; F401-V432 HydrophobicContact CD1-CG1 4.14Å; F401-V434 HydrophobicContact CD1-CG1 4.27Å; F401-V434 HydrophobicContact CD1-CG2 3.76Å; F401-V434 HydrophobicContact CE1-CB 4.41Å; F401-V434 HydrophobicContact CE1-CG1 3.91Å; F401-V434 HydrophobicContact CE1-CG2 3.59Å; F401-V434 HydrophobicContact CE2-CG1 4.29Å; F401-V434 HydrophobicContact CZ-CG1 3.91Å; F401-V434 HydrophobicContact CZ-CG2 4.4Å; F401-A448 HydrophobicContact CE1-CB 4.33Å; F401-A448 HydrophobicContact CE2-CB 3.93Å; F401-A448 HydrophobicContact CZ-CB 3.49Å; F401-A448 VanDerWaalsContact CZ-CB 3.49Å; F401-I450 HydrophobicContact CD1-CD1 4.49Å; F401-I463 HydrophobicContact CE2-CD1 4.37Å; F401-I463 HydrophobicContact CZ-CD1 3.88Å
402	N	90.8	Very high	86	Confident	94 Å²	94	60.5 Å²	60.5	50%	0.503	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	117.2	167.3	-176.4	9.2	0	0	0	108.1	T433	N402-T433 PolarHBondContact N-O 2.96Å; N402-T433 PolarHBondContact O-N 3.01Å
403	I	91.4	Very high	86	Confident	5 Å²	5	64.4 Å²	64.4	3%	0.026	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	135.5	-177.4	-60.8	-179.4	0	0	0	108.2	V390 V392 G415 F430 N431 V432 I450	V390-I403 HydrophobicContact CG2-CD1 4.22Å; V390-I403 HydrophobicContact CG2-CG2 4.08Å; V392-I403 HydrophobicContact CG2-CD1 3.59Å; I403-G415 WeakPolarHBondContact O-CA 3.48Å; I403-G415 PolarHBondContact O-N 2.67Å; I403-F430 HydrophobicContact CG2-CB 4.36Å; I403-F430 HydrophobicContact CG2-CD1 3.82Å; I403-N431 WeakPolarHBondContact CA-O 3.31Å; I403-V432 HydrophobicContact CG1-CG1 4.28Å; I403-V432 HydrophobicContact CG1-CG2 4.32Å; I403-I450 HydrophobicContact CD1-CD1 4.03Å
404	T	91.2	Very high	86	Confident	31 Å²	31	66.3 Å²	66.3	19%	0.19	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	118	171.1	-62.9	0	0	0	0	109.2	R412 N431	T404-R412 HydrophobicContact CG2-CB 4.18Å; T404-N431 PolarHBondContact N-O 3.18Å; T404-N431 PolarHBondContact O-N 2.79Å
405	A	92.4	Very high	85.8	Confident	0 Å²	0	65.4 Å²	65.4	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	138.6	170.9	0	0	0	0	0	110.2	R412 K413 F430	A405-R412 CarbonylContact O-C 3.37Å; A405-R412 WeakPolarHBondContact O-CA 3.49Å; A405-K413 HydrophobicContact CB-CB 4.32Å; A405-K413 PolarHBondContact N-O 1.78Å; A405-K413 PolarHBondContact O-N 2.67Å; A405-F430 HydrophobicContact CB-CD1 3.8Å; A405-F430 HydrophobicContact CB-CE1 3.54Å; A405-F430 HydrophobicContact CB-CZ 4.15Å
406	I	92	Very high	85.7	Confident	33 Å²	33	62.7 Å²	62.7	17%	0.169	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	109.5	173.4	-50.7	178.2	0	0	0	105.8	M136 R412 L429	M136-I406 HydrophobicContact CE-CD1 4.19Å; I406-R412 HydrophobicContact CG1-CG 4.39Å; I406-L429 WeakPolarHBondContact CA-O 3.24Å; I406-L429 HydrophobicContact CB-CB 4.24Å; I406-L429 WeakPolarHBondContact CB-O 3.22Å; I406-L429 PolarHBondContact N-O 3.35Å; I406-L429 PolarHBondContact O-N 2.86Å
407	C	90.7	Very high	85.1	Confident	12 Å²	12	67.7 Å²	67.7	8%	0.081	35%	0.353	C	S	.	.			trans	-89.3	163	-171	-56.5	0	0	0	0	111.6	D409 G410 S411 C419	C407-D409 WeakPolarHBondContact CB-OD1 3.27Å; C407-D409 PolarHBondContact O-N 3.27Å; C407-D409 VanDerWaalsContact O-N 3.1Å; C407-G410 WeakPolarHBondContact O-CA 3.45Å; C407-G410 PolarHBondContact O-N 2.83Å; C407-S411 PolarHBondContact N-O 3.05Å; C407-C419 WeakPolarHBondContact CA-SG 3.34Å; C407-C419 HydrophobicContact CB-CB 3.85Å; C407-C419 WeakPolarHBondContact CB-SG 3.25Å; C407-C419 VanDerWaalsContact SG-CA 3.56Å; C407-C419 WeakPolarHBondContact SG-CB 3.37Å; C407-C419 CovalentContact SG-SG 2.03Å; C407-C419 PolarHBondContact SG-SG 2.74Å
408	P	87.1	Confident	85.3	Confident	61 Å²	61	58.6 Å²	58.6	40%	0.396	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-17.6	-178	-25	35.5	0	0	0	115.2	G410 V422 H426	P408-G410 PolarHBondContact O-N 2.98Å; P408-V422 HydrophobicContact CG-CG1 4.34Å; P408-H426 HydrophobicContact CB-CB 3.95Å; P408-H426 HydrophobicContact CG-CB 3.71Å
409	D	86	Confident	85.7	Confident	122 Å²	122	57.5 Å²	57.5	65%	0.652	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	2.4	172	68.7	-17.2	0	0	0	113.3	C407 S411	C407-D409 WeakPolarHBondContact CB-OD1 3.27Å; C407-D409 PolarHBondContact O-N 3.27Å; C407-D409 VanDerWaalsContact O-N 3.1Å; D409-S411 VanDerWaalsContact CG-OG 3.27Å; D409-S411 PolarHBondContact O-N 2.82Å; D409-S411 WeakPolarHBondContact OD1-CB 3.09Å; D409-S411 PolarHBondContact OD1-N 3.49Å; D409-S411 PolarHBondContact OD1-OG 2.99Å; D409-S411 WeakPolarHBondContact OD2-CB 3.4Å; D409-S411 PolarHBondContact OD2-OG 3.15Å; D409-S411 VanDerWaalsContact OD2-OG 3.09Å
410	G	84	Confident	85.7	Confident	54 Å²	54	63.4 Å²	63.4	56%	0.557	33%	0.329	S	S	*	.	S	Bend	trans	77.7	-2.2	-173.5	0	0	0	0	0	114.3	C407 P408	C407-G410 WeakPolarHBondContact O-CA 3.45Å; C407-G410 PolarHBondContact O-N 2.83Å; P408-G410 PolarHBondContact O-N 2.98Å
411	S	87.4	Confident	85.5	Confident	30 Å²	30	63.9 Å²	63.9	21%	0.21	34%	0.341	C	S	.	.			trans	-70.7	143.6	179.5	75.9	0	0	0	0	111.3	C407 D409	C407-S411 PolarHBondContact N-O 3.05Å; D409-S411 VanDerWaalsContact CG-OG 3.27Å; D409-S411 PolarHBondContact O-N 2.82Å; D409-S411 WeakPolarHBondContact OD1-CB 3.09Å; D409-S411 PolarHBondContact OD1-N 3.49Å; D409-S411 PolarHBondContact OD1-OG 2.99Å; D409-S411 WeakPolarHBondContact OD2-CB 3.4Å; D409-S411 PolarHBondContact OD2-OG 3.15Å; D409-S411 VanDerWaalsContact OD2-OG 3.09Å
412	R	88.9	Confident	85.2	Confident	171 Å²	171	62.3 Å²	62.3	65%	0.645	34%	0.335	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.2	126.7	176.9	-62.4	-172.2	178.3	-143.2	-2.3	109.5	T404 A405 I406	T404-R412 HydrophobicContact CG2-CB 4.18Å; A405-R412 CarbonylContact O-C 3.37Å; A405-R412 WeakPolarHBondContact O-CA 3.49Å; I406-R412 HydrophobicContact CG1-CG 4.39Å
413	K	85.4	Confident	84.7	Confident	85 Å²	85	61.3 Å²	61.3	37%	0.37	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	111.1	178.1	-54.7	-62.3	179.2	-177.8	0	108.8	A405	A405-K413 HydrophobicContact CB-CB 4.32Å; A405-K413 PolarHBondContact N-O 1.78Å; A405-K413 PolarHBondContact O-N 2.67Å
414	P	82.1	Confident	83.9	Confident	99 Å²	99	62.7 Å²	62.7	64%	0.643	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72	147.9	177.3	30.7	-34.2	0	0	0	110.8
415	G	76.1	Confident	83.4	Confident	29 Å²	29	66.7 Å²	66.7	30%	0.299	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	77	-156.1	-178.9	0	0	0	0	0	113.9	I403	I403-G415 WeakPolarHBondContact O-CA 3.48Å; I403-G415 PolarHBondContact O-N 2.67Å
416	M	71.7	Confident	83	Confident	85 Å²	85	71.2 Å²	71.2	42%	0.419	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.4	7.5	-168.8	-56.8	-178.2	-160.8	0	0	114.2	V392 G418	V392-M416 HydrophobicContact CG2-CE 3.98Å; M416-G418 PolarHBondContact O-N 3.45Å
417	E	69.8	Low	82.9	Confident	111 Å²	111	73.5 Å²	73.5	52%	0.519	39%	0.393	S	S	.	.			trans	-59.6	-28.1	179.3	-78.6	-143.9	110.1	0	0	113.7	K389 R420	K389-E417 WeakPolarHBondContact CE-O 3.48Å; K389-E417 WeakPolarHBondContact CG-O 2.95Å; E417-R420 IonicContact OE1-NH2 3.17Å
418	G	84.2	Confident	82.9	Confident	4 Å²	4	73 Å²	73	4%	0.041	39%	0.389	C	S	.	.			trans	67.7	-154.8	178.9	0	0	0	0	0	113.9	V388 M416	V388-G418 CarbonylContact O-C 3.57Å; V388-G418 VanDerWaalsContact O-CA 3.26Å; V388-G418 WeakPolarHBondContact O-CA 3.49Å; M416-G418 PolarHBondContact O-N 3.45Å
419	C	86.6	Confident	83.2	Confident	2 Å²	2	72.3 Å²	72.3	1%	0.014	38%	0.382	C	S	.	.	B	Isolated β-bridge	trans	-116.8	150.9	179.2	-60.5	0	0	0	0	110.7	E387 V388 C407 V422 V428	E387-C419 CarbonylContact C-O 3.43Å; E387-C419 WeakPolarHBondContact CA-O 3.44Å; V388-C419 PolarHBondContact N-O 2.9Å; V388-C419 PolarHBondContact O-N 2.69Å; C407-C419 WeakPolarHBondContact CA-SG 3.34Å; C407-C419 HydrophobicContact CB-CB 3.85Å; C407-C419 WeakPolarHBondContact CB-SG 3.25Å; C407-C419 VanDerWaalsContact SG-CA 3.56Å; C407-C419 WeakPolarHBondContact SG-CB 3.37Å; C407-C419 CovalentContact SG-SG 2.03Å; C407-C419 PolarHBondContact SG-SG 2.74Å; C419-V422 HydrophobicContact CB-CG2 3.63Å; C419-V428 HydrophobicContact CB-CG1 4.12Å; C419-V428 HydrophobicContact CB-CG2 4.42Å; C419-V428 WeakPolarHBondContact SG-CG1 3.42Å
420	R	85.5	Confident	83.5	Confident	136 Å²	136	66.5 Å²	66.5	51%	0.513	35%	0.351	S	S	.	.	S	Bend	trans	-125.7	162.3	178.1	-47.8	-171.2	-164	176.9	5.5	109.5	S386 E387 E417 V422	S386-R420 CarbonylContact O-C 3.52Å; S386-R420 WeakPolarHBondContact O-CA 3.44Å; E387-R420 HydrophobicContact CG-CB 4.11Å; E387-R420 HydrophobicContact CG-CG 3.99Å; E417-R420 IonicContact OE1-NH2 3.17Å; R420-V422 PolarHBondContact O-N 2.68Å
421	N	82.2	Confident	84	Confident	137 Å²	137	66 Å²	66	73%	0.733	34%	0.336	S	S	*	.	S	Bend	trans	58.2	24.4	-177.2	-56.2	-5.9	0	0	0	113.8	S386	S386-N421 PolarHBondContact O-N 3.47Å; S386-N421 VanDerWaalsContact O-N 3.08Å; S386-N421 PolarHBondContact OG-N 2.8Å
422	V	84.1	Confident	84.3	Confident	8 Å²	8	64.6 Å²	64.6	5%	0.048	33%	0.326	C	S	.	.			trans	-72.7	134.6	177.2	-175.4	0	0	0	0	109.2	P141 S386 V388 P408 C419 R420 V428	P141-V422 HydrophobicContact CG-CG1 3.87Å; S386-V422 WeakPolarHBondContact CA-O 3.39Å; S386-V422 WeakPolarHBondContact O-CB 3.49Å; S386-V422 PolarHBondContact O-N 3.37Å; V388-V422 HydrophobicContact CG2-CB 4.11Å; V388-V422 HydrophobicContact CG2-CG1 4.16Å; V388-V422 HydrophobicContact CG2-CG2 4.12Å; P408-V422 HydrophobicContact CG-CG1 4.34Å; C419-V422 HydrophobicContact CB-CG2 3.63Å; R420-V422 PolarHBondContact O-N 2.68Å; V422-V428 HydrophobicContact CB-CG2 4.39Å; V422-V428 HydrophobicContact CG1-CG2 3.67Å; V422-V428 HydrophobicContact CG2-CG2 3.83Å
423	T	80.9	Confident	84.5	Confident	72 Å²	72	57.4 Å²	57.4	44%	0.442	30%	0.301	S	S	.	.			trans	-105.9	151.2	173.5	67.4	0	0	0	0	110.9	N425 H426	T423-N425 PolarHBondContact O-N 3.02Å; T423-H426 PolarHBondContact O-N 2.82Å; T423-H426 PolarHBondContact OG1-CE1 2.83Å; T423-H426 PolarHBondContact OG1-ND1 2.9Å
424	S	74	Confident	84.8	Confident	35 Å²	35	53.3 Å²	53.3	25%	0.245	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	15.4	-176.6	56.3	0	0	0	0	116.7	P141 K143	P141-S424 WeakPolarHBondContact O-CA 3.19Å; P141-S424 WeakPolarHBondContact O-CB 3.35Å; K143-S424 WeakPolarHBondContact CE-O 3.3Å; K143-S424 WeakPolarHBondContact CG-OG 3.38Å
425	N	79.7	Confident	85.1	Confident	114 Å²	114	49.7 Å²	49.7	61%	0.61	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.3	-8.2	168.6	-69.4	-16	0	0	0	112.1	K143 T423	K143-N425 WeakPolarHBondContact CE-OD1 3.42Å; K143-N425 PolarHBondContact NZ-OD1 3.08Å; T423-N425 PolarHBondContact O-N 3.02Å
426	H	85.3	Confident	85.5	Confident	95 Å²	95	48.5 Å²	48.5	44%	0.44	25%	0.246	S	C	.	.	S	Bend	trans	-113.5	137.3	-177.1	-59.1	94.9	0	0	0	110.9	P141 P408 T423	P141-H426 VanDerWaalsContact CD-O 3.25Å; P141-H426 WeakPolarHBondContact CD-O 3.38Å; P408-H426 HydrophobicContact CB-CB 3.95Å; P408-H426 HydrophobicContact CG-CB 3.71Å; T423-H426 PolarHBondContact O-N 2.82Å; T423-H426 PolarHBondContact OG1-CE1 2.83Å; T423-H426 PolarHBondContact OG1-ND1 2.9Å
427	E	88.4	Confident	85.8	Confident	82 Å²	82	50 Å²	50	38%	0.383	25%	0.25	S	S	.	.			trans	-80.9	150.2	166	61.8	177.1	-161.8	0	0	111.1	K138 L429	K138-E427 WeakPolarHBondContact CD-OE2 3.5Å; K138-E427 IonicContact NZ-OE1 3.94Å; K138-E427 PolarHBondContact NZ-OE1 2.92Å; K138-E427 IonicContact NZ-OE2 2.69Å; K138-E427 PolarHBondContact NZ-OE2 3.31Å; E427-L429 HydrophobicContact CG-CD2 4.3Å
428	V	91.7	Very high	86	Confident	0 Å²	0	50 Å²	50	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	135	168.8	-175.6	0	0	0	0	108.5	I139 V388 C419 V422 F430	I139-V428 PolarHBondContact N-O 3.06Å; I139-V428 PolarHBondContact O-N 2.88Å; V388-V428 HydrophobicContact CB-CB 4.49Å; V388-V428 HydrophobicContact CB-CG2 3.98Å; V388-V428 HydrophobicContact CG1-CB 4.13Å; V388-V428 HydrophobicContact CG1-CG1 4.42Å; V388-V428 HydrophobicContact CG1-CG2 4.11Å; V388-V428 HydrophobicContact CG2-CG2 3.99Å; C419-V428 HydrophobicContact CB-CG1 4.12Å; C419-V428 HydrophobicContact CB-CG2 4.42Å; C419-V428 WeakPolarHBondContact SG-CG1 3.42Å; V422-V428 HydrophobicContact CB-CG2 4.39Å; V422-V428 HydrophobicContact CG1-CG2 3.67Å; V422-V428 HydrophobicContact CG2-CG2 3.83Å; V428-F430 HydrophobicContact CB-CE2 4.07Å; V428-F430 HydrophobicContact CG1-CD2 4.04Å; V428-F430 HydrophobicContact CG1-CE2 3.4Å; V428-F430 HydrophobicContact CG1-CZ 3.94Å
429	L	92.9	Very high	85.4	Confident	47 Å²	47	51.4 Å²	51.4	25%	0.246	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	123.8	-176.5	-60.2	179.4	0	0	0	109.6	M136 K138 I406 E427	M136-L429 HydrophobicContact CE-CB 3.75Å; K138-L429 HydrophobicContact CB-CD2 4.3Å; K138-L429 HydrophobicContact CD-CD2 4.36Å; K138-L429 HydrophobicContact CG-CD2 3.69Å; I406-L429 WeakPolarHBondContact CA-O 3.24Å; I406-L429 HydrophobicContact CB-CB 4.24Å; I406-L429 WeakPolarHBondContact CB-O 3.22Å; I406-L429 PolarHBondContact N-O 3.35Å; I406-L429 PolarHBondContact O-N 2.86Å; E427-L429 HydrophobicContact CG-CD2 4.3Å
430	F	93.5	Very high	84.4	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	116.1	173.7	-68.7	-99.8	0	0	0	108.5	L137 I139 V388 V390 I403 A405 V428	L137-F430 HydrophobicContact CB-CB 4.27Å; L137-F430 PolarHBondContact N-O 3.33Å; L137-F430 PolarHBondContact O-N 3.27Å; I139-F430 HydrophobicContact CD1-CD2 3.72Å; I139-F430 HydrophobicContact CD1-CE2 3.63Å; I139-F430 HydrophobicContact CG1-CD2 4.19Å; I139-F430 HydrophobicContact CG1-CE2 4.29Å; V388-F430 HydrophobicContact CG1-CE2 4Å; V388-F430 HydrophobicContact CG1-CZ 4.22Å; V390-F430 HydrophobicContact CB-CE1 4.39Å; V390-F430 HydrophobicContact CG1-CD1 4.18Å; V390-F430 HydrophobicContact CG1-CD2 4.29Å; V390-F430 HydrophobicContact CG1-CE1 3.95Å; V390-F430 HydrophobicContact CG1-CE2 4.09Å; V390-F430 HydrophobicContact CG1-CG 4.34Å; V390-F430 HydrophobicContact CG1-CZ 3.91Å; V390-F430 HydrophobicContact CG2-CD1 3.7Å; V390-F430 HydrophobicContact CG2-CE1 3.66Å; V390-F430 HydrophobicContact CG2-CG 4.48Å; V390-F430 HydrophobicContact CG2-CZ 4.43Å; I403-F430 HydrophobicContact CG2-CB 4.36Å; I403-F430 HydrophobicContact CG2-CD1 3.82Å; A405-F430 HydrophobicContact CB-CD1 3.8Å; A405-F430 HydrophobicContact CB-CE1 3.54Å; A405-F430 HydrophobicContact CB-CZ 4.15Å; V428-F430 HydrophobicContact CB-CE2 4.07Å; V428-F430 HydrophobicContact CG1-CD2 4.04Å; V428-F430 HydrophobicContact CG1-CE2 3.4Å; V428-F430 HydrophobicContact CG1-CZ 3.94Å
431	N	93.8	Very high	83.3	Confident	45 Å²	45	53.6 Å²	53.6	24%	0.241	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	121.2	167.2	-176.4	28	0	0	0	108.1	M136 I403 T404	M136-N431 HydrophobicContact CE-CB 4.19Å; M136-N431 HydrophobicContact SD-CB 3.72Å; I403-N431 WeakPolarHBondContact CA-O 3.31Å; T404-N431 PolarHBondContact N-O 3.18Å; T404-N431 PolarHBondContact O-N 2.79Å
432	V	94.1	Very high	82	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	110	-178.6	-177.7	0	0	0	0	108.6	N134 F135 L137 F401 I403 V434 I450	N134-V432 WeakPolarHBondContact CA-O 3.4Å; F135-V432 HydrophobicContact CD1-CB 4.09Å; F135-V432 HydrophobicContact CD1-CG1 4.28Å; F135-V432 HydrophobicContact CD2-CB 4.38Å; F135-V432 HydrophobicContact CE1-CB 3.71Å; F135-V432 HydrophobicContact CE1-CG1 3.5Å; F135-V432 HydrophobicContact CE2-CB 4.01Å; F135-V432 HydrophobicContact CE2-CG1 4.41Å; F135-V432 HydrophobicContact CE2-CG2 4.06Å; F135-V432 HydrophobicContact CG-CB 4.41Å; F135-V432 HydrophobicContact CZ-CB 3.66Å; F135-V432 HydrophobicContact CZ-CG1 3.58Å; F135-V432 HydrophobicContact CZ-CG2 4.01Å; F135-V432 PolarHBondContact N-O 3.45Å; F135-V432 PolarHBondContact O-N 2.99Å; L137-V432 HydrophobicContact CB-CG2 4.36Å; F401-V432 HydrophobicContact CD1-CG1 4.14Å; I403-V432 HydrophobicContact CG1-CG1 4.28Å; I403-V432 HydrophobicContact CG1-CG2 4.32Å; V432-V434 HydrophobicContact CG1-CG2 3.98Å; V432-I450 HydrophobicContact CB-CD1 4.39Å; V432-I450 HydrophobicContact CG1-CD1 3.68Å; V432-I450 HydrophobicContact CG2-CD1 3.82Å
433	T	92.4	Very high	80.7	Confident	19 Å²	19	56.1 Å²	56.1	12%	0.117	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	129.3	170.2	-56	0	0	0	0	109.4	E132 A133 N402 T435	E132-T433 HydrophobicContact CB-CG2 3.95Å; E132-T433 HydrophobicContact CG-CG2 4.44Å; E132-T433 WeakPolarHBondContact OE2-CG2 3.44Å; A133-T433 CarbonylContact O-C 3.56Å; A133-T433 WeakPolarHBondContact O-CA 3.41Å; N402-T433 PolarHBondContact N-O 2.96Å; N402-T433 PolarHBondContact O-N 3.01Å; T433-T435 HydrophobicContact CG2-CG2 3.88Å
434	V	91.6	Very high	79.8	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	127	179.7	-165.6	0	0	0	0	109.1	I125 L127 E132 A133 F135 V399 Y400 F401 V432	I125-V434 HydrophobicContact CD1-CB 3.74Å; I125-V434 HydrophobicContact CD1-CG1 3.66Å; I125-V434 HydrophobicContact CD1-CG2 4.01Å; L127-V434 HydrophobicContact CD1-CB 4.48Å; L127-V434 HydrophobicContact CD1-CG1 4.04Å; E132-V434 WeakPolarHBondContact CA-O 3.37Å; A133-V434 PolarHBondContact N-O 3.38Å; A133-V434 PolarHBondContact O-N 3.4Å; F135-V434 HydrophobicContact CE1-CG2 4.09Å; V399-V434 HydrophobicContact CG1-CG1 3.38Å; Y400-V434 WeakPolarHBondContact O-CA 3.42Å; F401-V434 HydrophobicContact CD1-CG1 4.27Å; F401-V434 HydrophobicContact CD1-CG2 3.76Å; F401-V434 HydrophobicContact CE1-CB 4.41Å; F401-V434 HydrophobicContact CE1-CG1 3.91Å; F401-V434 HydrophobicContact CE1-CG2 3.59Å; F401-V434 HydrophobicContact CE2-CG1 4.29Å; F401-V434 HydrophobicContact CZ-CG1 3.91Å; F401-V434 HydrophobicContact CZ-CG2 4.4Å; V432-V434 HydrophobicContact CG1-CG2 3.98Å
435	T	89.1	Confident	79.6	Confident	23 Å²	23	58.7 Å²	58.7	14%	0.141	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	147	-170.1	80.5	0	0	0	0	111.7	E132 V399 Y400 T433	E132-T435 HydrophobicContact CB-CG2 4.04Å; E132-T435 HydrophobicContact CG-CG2 3.6Å; E132-T435 VanDerWaalsContact OE1-CG2 3.32Å; E132-T435 WeakPolarHBondContact OE1-CG2 3.43Å; V399-T435 WeakPolarHBondContact CA-O 3.22Å; Y400-T435 PolarHBondContact N-O 3.16Å; Y400-T435 PolarHBondContact O-N 2.93Å; T433-T435 HydrophobicContact CG2-CG2 3.88Å
436	M	84.9	Confident	79.8	Confident	3 Å²	3	57.6 Å²	57.6	2%	0.015	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	118.9	-180	-175	174.3	70.6	0	0	110.7	L127 R128 P129 G130 V399 R465	L127-M436 HydrophobicContact CB-CB 4.4Å; L127-M436 HydrophobicContact CB-CE 4.2Å; L127-M436 HydrophobicContact CD1-CB 4.29Å; L127-M436 WeakPolarHBondContact O-CE 3.49Å; R128-M436 VanDerWaalsContact C-CE 3.48Å; P129-M436 HydrophobicContact CG-CE 4.47Å; G130-M436 PolarHBondContact N-O 3.41Å; V399-M436 HydrophobicContact CG2-CG 4.48Å; M436-R465 HydrophobicContact CE-CB 4.24Å; M436-R465 HydrophobicContact CE-CG 4.47Å; M436-R465 HydrophobicContact SD-CB 4.08Å; M436-R465 HydrophobicContact SD-CG 3.69Å
437	K	77.3	Confident	80	Confident	118 Å²	118	56.6 Å²	56.6	51%	0.513	32%	0.317	S	S	.	.			trans	-83.8	-45.3	-173.1	-71.8	-167.8	175.3	-170.5	0	114.7	Y400	Y400-K437 HydrophobicContact CD2-CG 4.4Å; Y400-K437 HydrophobicContact CE2-CB 4.47Å; Y400-K437 HydrophobicContact CE2-CD 4.07Å; Y400-K437 HydrophobicContact CE2-CG 3.99Å
438	K	74.9	Confident	80.1	Confident	109 Å²	109	52.7 Å²	52.7	47%	0.474	30%	0.299	S	S	.	.			trans	-143.4	151.7	-173.4	-60.1	-179.9	-176.9	171.5	0	109.2	D440 E566	K438-D440 WeakPolarHBondContact CB-OD2 3.16Å; K438-E566 IonicContact NZ-OE1 2.68Å; K438-E566 PolarHBondContact NZ-OE1 3.49Å
439	C	71.4	Confident	79.9	Confident	34 Å²	34	54.1 Å²	54.1	23%	0.23	31%	0.306	C	S	.	.	S	Bend	trans	-92	2.6	-178.6	-91.4	0	0	0	0	114.3	P129 V441 C467	P129-C439 HydrophobicContact CG-CB 4.23Å; P129-C439 WeakPolarHBondContact CG-SG 3.37Å; C439-V441 PolarHBondContact O-N 3.02Å; C439-C467 HydrophobicContact CB-CB 3.67Å; C439-C467 WeakPolarHBondContact CB-SG 3.15Å; C439-C467 VanDerWaalsContact SG-CA 3.5Å; C439-C467 WeakPolarHBondContact SG-CB 3.46Å; C439-C467 CovalentContact SG-SG 2.03Å; C439-C467 PolarHBondContact SG-SG 2.9Å
440	D	63.8	Low	79.7	Confident	132 Å²	132	51.9 Å²	51.9	71%	0.706	29%	0.294	S	S	*	.			trans	-65.3	1.6	-170.1	-40.6	-31.3	0	0	0	115.3	K438	K438-D440 WeakPolarHBondContact CB-OD2 3.16Å
441	V	62.7	Low	79.2	Confident	53 Å²	53	53.9 Å²	53.9	32%	0.321	30%	0.303	S	S	.	.			trans	-111	88.5	-172.2	-172.2	0	0	0	0	110.7	R397 C439	R397-V441 HydrophobicContact CB-CG1 3.81Å; C439-V441 PolarHBondContact O-N 3.02Å
442	T	55.4	Low	78.6	Confident	142 Å²	142	51.8 Å²	51.8	87%	0.871	29%	0.291	S	S	*	.			trans	-82.3	127.1	171.8	47.6	0	0	0	0	111.2
443	G	57.2	Low	77.6	Confident	55 Å²	55	54.3 Å²	54.3	57%	0.567	31%	0.305	S	S	*	.			trans	91.2	148.1	177.5	0	0	0	0	0	115.6
444	G	62.3	Low	76.4	Confident	58 Å²	58	53.7 Å²	53.7	60%	0.598	30%	0.302	S	S	*	.	S	Bend	trans	142.6	-172.8	-177.1	0	0	0	0	0	111.8
445	K	70.4	Confident	75.5	Confident	103 Å²	103	54 Å²	54	45%	0.448	30%	0.303	S	S	.	.			trans	-72.9	140.7	165.4	-62.2	-170.6	-178.3	-167	0	109	N394 V396 Y447	N394-K445 HydrophobicContact CB-CD 4.22Å; N394-K445 PolarHBondContact OD1-NZ 2.85Å; V396-K445 WeakPolarHBondContact CG1-O 3.48Å; K445-Y447 VanDerWaalsContact C-N 3.35Å; K445-Y447 HydrophobicContact CB-CD1 4.42Å; K445-Y447 HydrophobicContact CB-CE1 4.32Å; K445-Y447 HydrophobicContact CD-CE1 4.18Å; K445-Y447 HydrophobicContact CG-CE1 4.47Å
446	N	83.7	Confident	74.6	Confident	92 Å²	92	57 Å²	57	49%	0.492	32%	0.319	S	S	.	.	S	Bend	trans	-99.3	20.7	174.7	-67.3	-20.7	0	0	0	112.2	I463 R465	N446-I463 PolarHBondContact O-N 2.9Å; N446-R465 PolarHBondContact OD1-NH1 3.18Å
447	Y	89.1	Confident	74.4	Confident	74 Å²	74	57.9 Å²	57.9	29%	0.29	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	149.7	175.7	71.1	-84.5	0	0	0	111.2	N394 V396 K445 I449 I461	N394-Y447 HydrophobicContact CB-CE2 4.35Å; V396-Y447 WeakPolarHBondContact CG2-O 3.18Å; K445-Y447 VanDerWaalsContact C-N 3.35Å; K445-Y447 HydrophobicContact CB-CD1 4.42Å; K445-Y447 HydrophobicContact CB-CE1 4.32Å; K445-Y447 HydrophobicContact CD-CE1 4.18Å; K445-Y447 HydrophobicContact CG-CE1 4.47Å; Y447-I449 HydrophobicContact CD2-CD1 4.47Å; Y447-I449 HydrophobicContact CD2-CG1 4.11Å; Y447-I449 HydrophobicContact CE2-CD1 4.06Å; Y447-I449 HydrophobicContact CE2-CG1 4.17Å; Y447-I461 CarbonylContact C-O 3.47Å; Y447-I461 WeakPolarHBondContact CA-O 3.38Å; Y447-I461 WeakPolarHBondContact CB-O 3.26Å
448	A	90	Very high	74.9	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	165.4	166.1	0	0	0	0	0	109.6	V396 F401 I461 I463	V396-A448 HydrophobicContact CG2-CB 4.36Å; F401-A448 HydrophobicContact CE1-CB 4.33Å; F401-A448 HydrophobicContact CE2-CB 3.93Å; F401-A448 HydrophobicContact CZ-CB 3.49Å; F401-A448 VanDerWaalsContact CZ-CB 3.49Å; A448-I461 PolarHBondContact N-O 2.93Å; A448-I461 PolarHBondContact O-N 2.88Å; A448-I463 HydrophobicContact CB-CD1 4.45Å
449	I	87.9	Confident	75.6	Confident	30 Å²	30	49.2 Å²	49.2	15%	0.154	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	125.2	174.2	-59.1	174.8	0	0	0	109.3	V392 E393 Y447 T458 A459	V392-I449 CarbonylContact C-O 3.54Å; V392-I449 WeakPolarHBondContact CA-O 3.38Å; E393-I449 HydrophobicContact CB-CB 4.36Å; E393-I449 PolarHBondContact N-O 3.13Å; E393-I449 PolarHBondContact O-N 3.31Å; Y447-I449 HydrophobicContact CD2-CD1 4.47Å; Y447-I449 HydrophobicContact CD2-CG1 4.11Å; Y447-I449 HydrophobicContact CE2-CD1 4.06Å; Y447-I449 HydrophobicContact CE2-CG1 4.17Å; I449-T458 HydrophobicContact CG2-CG2 4.26Å; I449-A459 WeakPolarHBondContact CA-O 3.43Å
450	I	89.1	Confident	76.5	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	115.5	167.2	-65	175.5	0	0	0	107.9	F135 L137 V390 H391 V392 F401 I403 V432 A459 I461	F135-I450 HydrophobicContact CZ-CD1 4.19Å; L137-I450 HydrophobicContact CD2-CB 4.27Å; L137-I450 HydrophobicContact CD2-CG2 3.57Å; V390-I450 HydrophobicContact CB-CG2 3.9Å; V390-I450 HydrophobicContact CG1-CG2 4.14Å; V390-I450 HydrophobicContact CG2-CG2 4.38Å; H391-I450 WeakPolarHBondContact O-CA 3.42Å; V392-I450 HydrophobicContact CG2-CG1 4.34Å; F401-I450 HydrophobicContact CD1-CD1 4.49Å; I403-I450 HydrophobicContact CD1-CD1 4.03Å; V432-I450 HydrophobicContact CB-CD1 4.39Å; V432-I450 HydrophobicContact CG1-CD1 3.68Å; V432-I450 HydrophobicContact CG2-CD1 3.82Å; I450-A459 HydrophobicContact CB-CB 4.43Å; I450-A459 PolarHBondContact N-O 2.81Å; I450-A459 PolarHBondContact O-N 3.44Å; I450-I461 HydrophobicContact CB-CD1 4.13Å; I450-I461 HydrophobicContact CD1-CD1 3.79Å; I450-I461 HydrophobicContact CG1-CD1 3.62Å
451	K	83.4	Confident	77.9	Confident	42 Å²	42	44.6 Å²	44.6	18%	0.183	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	122.7	-175.4	178.9	179.6	-175.4	-169.8	0	109.6	N336 V390 H391 E393 T458	N336-K451 WeakPolarHBondContact OD1-CE 3.47Å; N336-K451 PolarHBondContact OD1-NZ 2.86Å; V390-K451 CarbonylContact C-O 3.6Å; V390-K451 WeakPolarHBondContact CA-O 3.45Å; H391-K451 PolarHBondContact N-O 3.1Å; H391-K451 PolarHBondContact O-N 3.29Å; E393-K451 WeakPolarHBondContact OE1-CD 3.38Å; E393-K451 WeakPolarHBondContact OE1-CE 3.36Å; E393-K451 IonicContact OE1-NZ 3.78Å; E393-K451 PolarHBondContact OE1-NZ 2.92Å; K451-T458 HydrophobicContact CB-CG2 3.99Å; K451-T458 HydrophobicContact CG-CG2 3.83Å
452	P	81.1	Confident	79.2	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	139.2	169	-0.1	15.3	0	0	0	110.2	V118 I139 K389 G454 F455 E457	V118-P452 HydrophobicContact CG1-CG 4.4Å; V118-P452 HydrophobicContact CG2-CG 3.47Å; V118-P452 VanDerWaalsContact CG2-CG 3.47Å; I139-P452 HydrophobicContact CD1-CB 3.98Å; I139-P452 HydrophobicContact CD1-CG 3.94Å; I139-P452 HydrophobicContact CG2-CB 4.41Å; K389-P452 CarbonylContact O-C 3.55Å; K389-P452 VanDerWaalsContact O-CA 3.28Å; K389-P452 WeakPolarHBondContact O-CA 3.4Å; P452-G454 PolarHBondContact O-N 2.86Å; P452-F455 HydrophobicContact CB-CB 3.85Å; P452-F455 HydrophobicContact CB-CD1 4.19Å; P452-F455 HydrophobicContact CB-CD2 3.59Å; P452-F455 HydrophobicContact CB-CE2 4.08Å; P452-F455 HydrophobicContact CB-CG 3.65Å; P452-F455 HydrophobicContact CG-CB 3.85Å; P452-F455 HydrophobicContact CG-CD1 4.25Å; P452-F455 HydrophobicContact CG-CD2 4.43Å; P452-F455 HydrophobicContact CG-CG 3.98Å; P452-F455 PolarHBondContact O-N 3.49Å; P452-E457 WeakPolarHBondContact CD-O 3.41Å
453	I	72.5	Confident	80.8	Confident	54 Å²	54	38.7 Å²	38.7	28%	0.277	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	116.5	-171.6	-59	-175.8	0	0	0	110.6	K277 K389	K277-I453 PolarHBondContact NZ-O 3.24Å; K389-I453 HydrophobicContact CB-CB 4.45Å; K389-I453 HydrophobicContact CB-CD1 3.8Å; K389-I453 HydrophobicContact CB-CG1 4.12Å; K389-I453 PolarHBondContact O-N 3.42Å
454	G	66.7	Low	82.2	Confident	6 Å²	6	40.5 Å²	40.5	6%	0.062	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	66.2	45.5	-174.9	0	0	0	0	0	112.8	K277 P452	K277-G454 WeakPolarHBondContact CD-O 3.35Å; K277-G454 WeakPolarHBondContact CE-O 3.35Å; K277-G454 PolarHBondContact NZ-O 3.24Å; P452-G454 PolarHBondContact O-N 2.86Å
455	F	73.4	Confident	83.1	Confident	7 Å²	7	40.3 Å²	40.3	3%	0.031	19%	0.192	C	C	.	.			trans	-122.1	150.9	164	-74.5	-126.8	0	0	0	107.9	Q117 V118 I139 P141 Y145 P452	Q117-F455 HydrophobicContact CB-CD1 4.14Å; Q117-F455 HydrophobicContact CB-CE1 4.42Å; Q117-F455 VanDerWaalsContact NE2-CD1 3.29Å; V118-F455 HydrophobicContact CG2-CD1 4.34Å; I139-F455 HydrophobicContact CG2-CD1 4.21Å; I139-F455 HydrophobicContact CG2-CE1 3.43Å; I139-F455 VanDerWaalsContact CG2-CE1 3.43Å; I139-F455 HydrophobicContact CG2-CE2 4.49Å; I139-F455 HydrophobicContact CG2-CZ 3.59Å; P141-F455 HydrophobicContact CB-CZ 4.39Å; Y145-F455 HydrophobicContact CE1-CD1 4.5Å; Y145-F455 HydrophobicContact CE1-CD2 4.44Å; Y145-F455 HydrophobicContact CE1-CG 4.42Å; Y145-F455 WeakPolarHBondContact OH-CE1 3.04Å; Y145-F455 WeakPolarHBondContact OH-CZ 3.42Å; P452-F455 HydrophobicContact CB-CB 3.85Å; P452-F455 HydrophobicContact CB-CD1 4.19Å; P452-F455 HydrophobicContact CB-CD2 3.59Å; P452-F455 HydrophobicContact CB-CE2 4.08Å; P452-F455 HydrophobicContact CB-CG 3.65Å; P452-F455 HydrophobicContact CG-CB 3.85Å; P452-F455 HydrophobicContact CG-CD1 4.25Å; P452-F455 HydrophobicContact CG-CD2 4.43Å; P452-F455 HydrophobicContact CG-CG 3.98Å; P452-F455 PolarHBondContact O-N 3.49Å
456	N	70.4	Confident	83.5	Confident	86 Å²	86	37.9 Å²	37.9	46%	0.46	18%	0.184	S	C	.	.	S	Bend	trans	-75.8	-44.6	175.1	56.2	-25.7	0	0	0	112.7	Q117 E275	Q117-N456 PolarHBondContact OE1-OD1 3.46Å; E275-N456 HydrophobicContact CB-CB 3.81Å
457	E	80.5	Confident	83	Confident	20 Å²	20	35.7 Å²	35.7	9%	0.093	18%	0.175	C	C	.	.			trans	-76.6	149.3	179.3	-64.7	176	-159.4	0	0	111.3	N115 T116 Q117 V118 P452	N115-E457 VanDerWaalsContact CA-OE2 3.24Å; N115-E457 WeakPolarHBondContact CA-OE2 3.33Å; N115-E457 HydrophobicContact CB-CG 4.48Å; N115-E457 WeakPolarHBondContact CB-OE2 3.46Å; T116-E457 VanDerWaalsContact N-CD 3.26Å; T116-E457 PolarHBondContact N-OE1 3.37Å; T116-E457 PolarHBondContact N-OE2 3.32Å; T116-E457 PolarHBondContact OG1-OE1 2.65Å; Q117-E457 WeakPolarHBondContact CA-OE2 3.2Å; Q117-E457 WeakPolarHBondContact CB-OE2 3.03Å; Q117-E457 VanDerWaalsContact N-CD 3.34Å; Q117-E457 PolarHBondContact N-OE1 2.89Å; Q117-E457 PolarHBondContact N-OE2 3.42Å; V118-E457 HydrophobicContact CB-CB 3.88Å; V118-E457 HydrophobicContact CG2-CB 3.72Å; V118-E457 PolarHBondContact N-OE2 3.2Å; P452-E457 WeakPolarHBondContact CD-O 3.41Å
458	T	86.3	Confident	82	Confident	46 Å²	46	35.8 Å²	35.8	28%	0.282	19%	0.187	S	C	.	.			trans	-140.8	160.7	178.5	62.2	0	0	0	0	110.7	N115 I449 K451	N115-T458 PolarHBondContact ND2-O 2.74Å; I449-T458 HydrophobicContact CG2-CG2 4.26Å; K451-T458 HydrophobicContact CB-CG2 3.99Å; K451-T458 HydrophobicContact CG-CG2 3.83Å
459	A	90.1	Very high	81.1	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	119	173.1	0	0	0	0	0	110.2	V118 P120 G121 L137 I449 I450 I461	V118-A459 HydrophobicContact CG1-CB 4.12Å; P120-A459 WeakPolarHBondContact O-CB 3.1Å; G121-A459 WeakPolarHBondContact O-CA 3.48Å; L137-A459 HydrophobicContact CD1-CB 3.61Å; L137-A459 HydrophobicContact CD2-CB 4.11Å; I449-A459 WeakPolarHBondContact CA-O 3.43Å; I450-A459 HydrophobicContact CB-CB 4.43Å; I450-A459 PolarHBondContact N-O 2.81Å; I450-A459 PolarHBondContact O-N 3.44Å; A459-I461 WeakPolarHBondContact O-CD1 3.01Å
460	K	90.8	Very high	80.1	Confident	69 Å²	69	40.6 Å²	40.6	30%	0.3	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	118.3	-177.9	177.6	173.1	159.4	-129.6	0	110.2	G121 E122 V123 H462	G121-K460 PolarHBondContact O-N 3.28Å; E122-K460 CarbonylContact C-O 3.53Å; E122-K460 WeakPolarHBondContact CA-O 3.42Å; E122-K460 WeakPolarHBondContact OE1-CE 3.36Å; E122-K460 IonicContact OE1-NZ 3.67Å; E122-K460 PolarHBondContact OE1-NZ 3.05Å; V123-K460 PolarHBondContact N-O 3.23Å; K460-H462 WeakPolarHBondContact CE-NE2 3.39Å; K460-H462 PolarHBondContact NZ-NE2 3.38Å
461	I	92.3	Very high	78.9	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	110.9	-176.1	-52.9	88.8	0	0	0	109	V123 I125 F135 Y447 A448 I450 A459 I463	V123-I461 CarbonylContact O-C 3.58Å; V123-I461 VanDerWaalsContact O-CA 3.31Å; V123-I461 WeakPolarHBondContact O-CA 3.5Å; I125-I461 HydrophobicContact CD1-CG2 3.94Å; I125-I461 HydrophobicContact CG1-CG2 4.09Å; I125-I461 HydrophobicContact CG2-CG2 4.3Å; F135-I461 HydrophobicContact CE1-CG1 4.13Å; F135-I461 HydrophobicContact CZ-CD1 4.28Å; F135-I461 HydrophobicContact CZ-CG1 3.67Å; Y447-I461 CarbonylContact C-O 3.47Å; Y447-I461 WeakPolarHBondContact CA-O 3.38Å; Y447-I461 WeakPolarHBondContact CB-O 3.26Å; A448-I461 PolarHBondContact N-O 2.93Å; A448-I461 PolarHBondContact O-N 2.88Å; I450-I461 HydrophobicContact CB-CD1 4.13Å; I450-I461 HydrophobicContact CD1-CD1 3.79Å; I450-I461 HydrophobicContact CG1-CD1 3.62Å; A459-I461 WeakPolarHBondContact O-CD1 3.01Å; I461-I463 HydrophobicContact CG2-CG1 4.16Å
462	H	91	Very high	77.6	Confident	69 Å²	69	43.4 Å²	43.4	32%	0.319	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	131.4	169.8	-71.1	-107.6	0	0	0	110	E122 V123 I125 K460	E122-H462 WeakPolarHBondContact CG-NE2 3.48Å; E122-H462 IonicContact OE1-CD2 2.69Å; E122-H462 PolarHBondContact OE1-CD2 3.09Å; E122-H462 CovalentContact OE1-NE2 1.78Å; E122-H462 IonicContact OE1-NE2 3.43Å; E122-H462 PolarHBondContact OE1-NE2 2.7Å; E122-H462 IonicContact OE2-NE2 2.92Å; V123-H462 PolarHBondContact O-N 2.93Å; I125-H462 WeakPolarHBondContact CG1-O 3.47Å; I125-H462 PolarHBondContact N-O 2.03Å; K460-H462 WeakPolarHBondContact CE-NE2 3.39Å; K460-H462 PolarHBondContact NZ-NE2 3.38Å
463	I	88.9	Confident	76.2	Confident	2 Å²	2	49.4 Å²	49.4	1%	0.01	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	103.6	-171.1	-45.9	-175.3	0	0	0	109.5	I125 L127 V396 V399 F401 N446 A448 I461	I125-I463 HydrophobicContact CD1-CG1 4.18Å; I125-I463 HydrophobicContact CD1-CG2 4.22Å; I125-I463 HydrophobicContact CG1-CB 4.35Å; I125-I463 HydrophobicContact CG1-CG1 4.21Å; I125-I463 HydrophobicContact CG1-CG2 4.15Å; L127-I463 HydrophobicContact CD1-CG2 4.18Å; V396-I463 HydrophobicContact CB-CD1 4.15Å; V396-I463 HydrophobicContact CG1-CD1 4.46Å; V396-I463 HydrophobicContact CG2-CD1 3.89Å; V399-I463 HydrophobicContact CG1-CD1 4.14Å; V399-I463 HydrophobicContact CG2-CG2 4.37Å; F401-I463 HydrophobicContact CE2-CD1 4.37Å; F401-I463 HydrophobicContact CZ-CD1 3.88Å; N446-I463 PolarHBondContact O-N 2.9Å; A448-I463 HydrophobicContact CB-CD1 4.45Å; I461-I463 HydrophobicContact CG2-CG1 4.16Å
464	H	86.9	Confident	75	Confident	93 Å²	93	54.6 Å²	54.6	43%	0.431	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	128.5	173.9	-59.5	-95.9	0	0	0	108.8	I125 Q126 L127	I125-H464 PolarHBondContact O-N 3.43Å; Q126-H464 WeakPolarHBondContact CA-O 3.4Å; Q126-H464 HydrophobicContact CG-CB 4.16Å; L127-H464 PolarHBondContact N-O 2.83Å
465	R	81.5	Confident	73.9	Confident	54 Å²	54	65.8 Å²	65.8	20%	0.204	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	110	-179	-56.3	-177.8	-173.4	80.8	-15.4	109.4	R397 M436 N446 C467	R397-R465 PolarHBondContact O-NH2 3.02Å; M436-R465 HydrophobicContact CE-CB 4.24Å; M436-R465 HydrophobicContact CE-CG 4.47Å; M436-R465 HydrophobicContact SD-CB 4.08Å; M436-R465 HydrophobicContact SD-CG 3.69Å; N446-R465 PolarHBondContact OD1-NH1 3.18Å; R465-C467 PolarHBondContact O-N 3.19Å
466	N	78.3	Confident	72.4	Confident	51 Å²	51	67.8 Å²	67.8	27%	0.273	35%	0.348	S	S	.	.			trans	-89.2	91.7	176.5	-66.4	2.7	0	0	0	107.9	P102 Q126 L127	P102-N466 HydrophobicContact CB-CB 4.21Å; Q126-N466 PolarHBondContact OE1-ND2 3.27Å; L127-N466 PolarHBondContact O-N 2.99Å
467	C	72.1	Confident	71.1	Confident	46 Å²	46	70.6 Å²	70.6	31%	0.311	37%	0.371	S	S	.	.			trans	-107.3	-20.1	-174.9	-65.6	0	0	0	0	114.5	C439 R465	C439-C467 HydrophobicContact CB-CB 3.67Å; C439-C467 WeakPolarHBondContact CB-SG 3.15Å; C439-C467 VanDerWaalsContact SG-CA 3.5Å; C439-C467 WeakPolarHBondContact SG-CB 3.46Å; C439-C467 CovalentContact SG-SG 2.03Å; C439-C467 PolarHBondContact SG-SG 2.9Å; R465-C467 PolarHBondContact O-N 3.19Å
468	S	69.4	Low	69.5	Low	76 Å²	76	74.1 Å²	74.1	53%	0.531	39%	0.386	S	S	.	.	S	Bend	trans	-106.2	154.4	177.8	-85.5	0	0	0	0	110.9	E472	S468-E472 WeakPolarHBondContact CB-OE2 3.4Å; S468-E472 PolarHBondContact OG-OE2 2.83Å
469	C	71.3	Confident	67.9	Low	3 Å²	3	73.7 Å²	73.7	2%	0.02	39%	0.391	C	S	.	.			trans	-84.7	146.9	170.7	-60.3	0	0	0	0	110.8	C55 L59 E100 C471 E472	C55-C469 VanDerWaalsContact C-SG 3.5Å; C55-C469 HydrophobicContact CB-CB 3.98Å; C55-C469 WeakPolarHBondContact CB-SG 3.43Å; C55-C469 WeakPolarHBondContact SG-CB 3.43Å; C55-C469 CovalentContact SG-SG 2.04Å; C55-C469 PolarHBondContact SG-SG 2.87Å; L59-C469 WeakPolarHBondContact CD1-SG 3.49Å; E100-C469 HydrophobicContact CG-CB 4.27Å; C469-C471 WeakPolarHBondContact CB-SG 3.4Å; C469-C471 PolarHBondContact O-N 3.25Å; C469-E472 WeakPolarHBondContact O-CB 3.17Å; C469-E472 PolarHBondContact O-N 3.21Å
470	Q	67.4	Low	66.3	Low	128 Å²	128	81.9 Å²	81.9	60%	0.598	43%	0.426	S	S	*	.	G	3₁₀ helix	trans	-65.7	-25.7	-174.9	-57.4	-176.3	-9.5	0	0	112.5	E100 E472 D473	E100-Q470 PolarHBondContact OE2-N 3.14Å; Q470-E472 PolarHBondContact O-N 3.08Å; Q470-D473 PolarHBondContact O-N 3.44Å; Q470-D473 VanDerWaalsContact O-N 3.16Å
471	C	63.6	Low	64.6	Low	15 Å²	15	79.7 Å²	79.7	10%	0.101	42%	0.419	C	S	.	.	G	3₁₀ helix	trans	-63.6	-6.4	171.2	62.6	0	0	0	0	115.7	V69 C469 G479 C481	V69-C471 HydrophobicContact CG2-CB 4.4Å; C469-C471 WeakPolarHBondContact CB-SG 3.4Å; C469-C471 PolarHBondContact O-N 3.25Å; C471-G479 WeakPolarHBondContact CB-O 3.38Å; C471-C481 HydrophobicContact CB-CB 3.55Å; C471-C481 WeakPolarHBondContact CB-SG 3.39Å; C471-C481 PolarHBondContact O-N 3.25Å; C471-C481 WeakPolarHBondContact SG-CB 3.21Å; C471-C481 CovalentContact SG-SG 2.02Å; C471-C481 PolarHBondContact SG-SG 3.04Å
472	E	56.1	Low	62.8	Low	87 Å²	87	83.3 Å²	83.3	41%	0.407	44%	0.441	S	S	.	.	G	3₁₀ helix	trans	-86.4	-25	172	-65.1	172.6	-173.5	0	0	112.1	S468 C469 Q470 N474	S468-E472 WeakPolarHBondContact CB-OE2 3.4Å; S468-E472 PolarHBondContact OG-OE2 2.83Å; C469-E472 WeakPolarHBondContact O-CB 3.17Å; C469-E472 PolarHBondContact O-N 3.21Å; Q470-E472 PolarHBondContact O-N 3.08Å; E472-N474 PolarHBondContact O-N 3.31Å
473	D	50	Low	60.7	Low	126 Å²	126	83.9 Å²	83.9	67%	0.674	45%	0.447	S	S	*	.	S	Bend	trans	-83.1	112.8	-179.6	-99.4	-43.3	0	0	0	111.3	Q470 R475	Q470-D473 PolarHBondContact O-N 3.44Å; Q470-D473 VanDerWaalsContact O-N 3.16Å; D473-R475 PolarHBondContact O-N 3.32Å
474	N	48.8	Very low	58.6	Low	162 Å²	162	87.4 Å²	87.4	87%	0.866	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	34.8	-177.5	-73.4	-74.8	0	0	0	115.1	E472	E472-N474 PolarHBondContact O-N 3.31Å
475	R	42.8	Very low	56.7	Low	241 Å²	241	88.6 Å²	88.6	91%	0.909	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-137.6	-4.3	-175.7	-63.5	-174	178.6	-176.3	0.2	114.8	D473	D473-R475 PolarHBondContact O-N 3.32Å
476	G	42	Very low	55	Low	50 Å²	50	95.6 Å²	95.6	52%	0.515	51%	0.509	S	S	.	.	S	Bend	trans	-90.1	160.6	176.8	0	0	0	0	0	113.7	K478	G476-K478 VanDerWaalsContact C-N 3.29Å
477	P	43.2	Very low	53.2	Low	144 Å²	144	99 Å²	99	94%	0.935	53%	0.527	S	S	*	.	S	Bend	trans	-81.9	-5.4	168.2	-3.9	22.2	0	0	0	113.4
478	K	47	Very low	51.6	Low	94 Å²	94	102.4 Å²	102.4	41%	0.409	54%	0.542	S	S	.	.	S	Bend	trans	-74.6	148	177.1	-65.3	-163.3	177	-160.1	0	110.4	D97 G476	D97-K478 VanDerWaalsContact O-CE 3.26Å; D97-K478 WeakPolarHBondContact O-CE 3.19Å; D97-K478 PolarHBondContact O-NZ 3Å; G476-K478 VanDerWaalsContact C-N 3.29Å
479	G	53.5	Low	50.3	Low	38 Å²	38	103.4 Å²	103.4	39%	0.392	55%	0.549	S	S	.	.	P	Polyproline II helix	trans	-58.2	153.3	-172.8	0	0	0	0	0	114.2	V69 C471 C481	V69-G479 WeakPolarHBondContact CG1-O 3.4Å; C471-G479 WeakPolarHBondContact CB-O 3.38Å; G479-C481 PolarHBondContact O-N 3.32Å
480	K	56.6	Low	49.1	Very low	171 Å²	171	112.8 Å²	112.8	74%	0.743	59%	0.59	S	S	*	*	P	Polyproline II helix	trans	-64.2	128.4	178.2	-169.2	178.6	-174.3	-177.4	0	109.6	V482	K480-V482 PolarHBondContact O-N 2.94Å
481	C	54.8	Low	48	Very low	23 Å²	23	108.6 Å²	108.6	16%	0.155	57%	0.574	C	S	.	*	P	Polyproline II helix	trans	-65.6	124.2	175.8	-105.3	0	0	0	0	111.2	C471 G479 D483	C471-C481 HydrophobicContact CB-CB 3.55Å; C471-C481 WeakPolarHBondContact CB-SG 3.39Å; C471-C481 PolarHBondContact O-N 3.25Å; C471-C481 WeakPolarHBondContact SG-CB 3.21Å; C471-C481 CovalentContact SG-SG 2.02Å; C471-C481 PolarHBondContact SG-SG 3.04Å; G479-C481 PolarHBondContact O-N 3.32Å; C481-D483 PolarHBondContact O-N 3.5Å
482	V	54.2	Low	47.1	Very low	77 Å²	77	115.2 Å²	115.2	47%	0.467	60%	0.601	S	S	.	*			trans	-80.1	75.1	173.7	-173.2	0	0	0	0	108.5	K480 E484	K480-V482 PolarHBondContact O-N 2.94Å; V482-E484 HydrophobicContact CG1-CG 4.48Å
483	D	47	Very low	46.2	Very low	81 Å²	81	120.5 Å²	120.5	43%	0.433	63%	0.626	S	S	.	*			trans	-94.1	108.5	173.8	-162.6	57.1	0	0	0	109.6	S54 C481 T485	S54-D483 WeakPolarHBondContact CA-OD1 3.44Å; S54-D483 WeakPolarHBondContact CB-OD1 3.47Å; C481-D483 PolarHBondContact O-N 3.5Å; D483-T485 VanDerWaalsContact C-N 3.34Å; D483-T485 PolarHBondContact O-N 3.24Å
484	E	44.1	Very low	46	Very low	75 Å²	75	117.5 Å²	117.5	35%	0.35	61%	0.614	S	S	.	*			trans	-81.6	77.2	-172	-74	-163	129.6	0	0	113.4	R79 V482 F486	R79-E484 VanDerWaalsContact CD-OE2 3.24Å; R79-E484 WeakPolarHBondContact CD-OE2 3.44Å; R79-E484 IonicContact CZ-OE1 3.22Å; R79-E484 IonicContact CZ-OE2 3.17Å; R79-E484 IonicContact NE-OE1 2.83Å; R79-E484 IonicContact NE-OE2 3.78Å; R79-E484 PolarHBondContact NE-OE2 2.81Å; R79-E484 IonicContact NH1-OE1 3.57Å; R79-E484 PolarHBondContact NH1-OE1 3.07Å; R79-E484 IonicContact NH1-OE2 3.27Å; R79-E484 PolarHBondContact NH1-OE2 2.75Å; R79-E484 IonicContact NH2-OE1 2.79Å; R79-E484 PolarHBondContact NH2-OE1 3.46Å; R79-E484 IonicContact NH2-OE2 2.65Å; V482-E484 HydrophobicContact CG1-CG 4.48Å; E484-F486 PolarHBondContact O-N 3.23Å
485	T	46.6	Very low	45.5	Very low	118 Å²	118	116.3 Å²	116.3	72%	0.724	61%	0.608	S	S	*	*	S	Bend	trans	-70.7	110.4	149.1	40.3	0	0	0	0	109.8	D483	D483-T485 VanDerWaalsContact C-N 3.34Å; D483-T485 PolarHBondContact O-N 3.24Å
486	F	46.5	Very low	45.6	Very low	201 Å²	201	113.4 Å²	113.4	88%	0.882	61%	0.605	S	S	*	*	S	Bend	trans	59.7	90.9	170.3	-77.1	-99.2	0	0	0	117.5	E484	E484-F486 PolarHBondContact O-N 3.23Å
487	L	41.3	Very low	45.9	Very low	122 Å²	122	118.7 Å²	118.7	64%	0.639	62%	0.621	S	S	*	*			trans	-157.8	74.7	150.9	-118.3	158.4	0	0	0	112.9	S489	L487-S489 WeakPolarHBondContact CD2-OG 3.01Å
488	D	36.6	Very low	45.7	Very low	119 Å²	119	120.6 Å²	120.6	64%	0.636	61%	0.614	S	S	*	*			trans	-116.7	52	168.9	-158.7	-1.3	0	0	0	110.7	K490 C491	D488-K490 PolarHBondContact O-N 3.35Å; D488-C491 PolarHBondContact O-N 2.86Å
489	S	43.2	Very low	46	Very low	97 Å²	97	119 Å²	119	68%	0.678	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.9	40.6	-171.6	-57.9	0	0	0	0	114.2	L487	L487-S489 WeakPolarHBondContact CD2-OG 3.01Å
490	K	45.8	Very low	45.2	Very low	199 Å²	199	126.2 Å²	126.2	87%	0.865	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125.6	-4.1	166.5	-78.6	-167.8	172.9	-175.1	0	114.5	D488	D488-K490 PolarHBondContact O-N 3.35Å
491	C	44.7	Very low	44.6	Very low	40 Å²	40	125.7 Å²	125.7	27%	0.27	64%	0.636	S	S	.	*	S	Bend	trans	-124.5	6.6	179.5	-82	0	0	0	0	116	D488 C528	D488-C491 PolarHBondContact O-N 2.86Å; C491-C528 HydrophobicContact CB-CB 4.24Å; C491-C528 WeakPolarHBondContact CB-SG 3.29Å; C491-C528 WeakPolarHBondContact SG-CB 3.3Å; C491-C528 CovalentContact SG-SG 2.03Å; C491-C528 PolarHBondContact SG-SG 2.88Å
492	F	43.7	Very low	44	Very low	155 Å²	155	132 Å²	132	68%	0.68	67%	0.668	S	S	*	*			trans	-135.7	105.5	176.5	-68.6	-76.2	0	0	0	113.1
493	Q	38.3	Very low	43.4	Very low	198 Å²	198	137 Å²	137	93%	0.925	69%	0.686	S	S	*	*			trans	-134.3	51	154.8	-159.5	162.2	12.1	0	0	109.5
494	C	44.9	Very low	43.3	Very low	62 Å²	62	141 Å²	141	42%	0.419	71%	0.708	S	S	.	*			trans	-96	115.6	169	-53.8	0	0	0	0	108.9	C499	C494-C499 HydrophobicContact CB-CB 4.15Å; C494-C499 WeakPolarHBondContact CB-SG 3.35Å; C494-C499 WeakPolarHBondContact SG-CB 3.3Å; C494-C499 CovalentContact SG-SG 2.04Å; C494-C499 PolarHBondContact SG-SG 3.39Å
495	D	38.4	Very low	43.7	Very low	138 Å²	138	145.4 Å²	145.4	74%	0.738	73%	0.728	S	S	*	*	B	Isolated β-bridge	trans	-86.4	164.2	162.7	-157.1	-8.5	0	0	0	109.5	N497 K498	D495-N497 PolarHBondContact O-N 2.91Å; D495-K498 PolarHBondContact O-N 3.4Å; D495-K498 VanDerWaalsContact O-N 3.13Å
496	E	45.9	Very low	43.9	Very low	180 Å²	180	146.1 Å²	146.1	84%	0.841	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.7	10.6	-139.8	-139.9	-176.1	-149.7	0	0	118.5
497	N	47.3	Very low	44.5	Very low	161 Å²	161	140.4 Å²	140.4	86%	0.861	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-154.6	8	164.5	-110.7	-76.1	0	0	0	117	D495	D495-N497 PolarHBondContact O-N 2.91Å
498	K	40.3	Very low	45.5	Very low	183 Å²	183	137.6 Å²	137.6	80%	0.796	70%	0.697	S	S	*	*	B	Isolated β-bridge	trans	-145.1	106.2	176.6	-70.7	-169.7	179.8	-178.5	0	113.4	D495	D495-K498 PolarHBondContact O-N 3.4Å; D495-K498 VanDerWaalsContact O-N 3.13Å
499	C	51.8	Low	47	Very low	62 Å²	62	135.5 Å²	135.5	42%	0.419	68%	0.684	S	S	.	*			trans	-82.3	130.9	158.5	-59.4	0	0	0	0	109.4	C494 F501	C494-C499 HydrophobicContact CB-CB 4.15Å; C494-C499 WeakPolarHBondContact CB-SG 3.35Å; C494-C499 WeakPolarHBondContact SG-CB 3.3Å; C494-C499 CovalentContact SG-SG 2.04Å; C494-C499 PolarHBondContact SG-SG 3.39Å; C499-F501 HydrophobicContact CB-CE2 3.95Å; C499-F501 HydrophobicContact CB-CZ 4.18Å
500	H	37.2	Very low	48.4	Very low	188 Å²	188	133.5 Å²	133.5	87%	0.87	67%	0.67	S	S	*	*			trans	-91.9	133.6	162.5	-122.9	-81.9	0	0	0	108.5
501	F	44.9	Very low	50.1	Low	161 Å²	161	124.1 Å²	124.1	71%	0.706	63%	0.629	S	S	*	*			trans	-109.7	128.6	174.5	-65.6	-87.1	0	0	0	109.3	C499	C499-F501 HydrophobicContact CB-CE2 3.95Å; C499-F501 HydrophobicContact CB-CZ 4.18Å
502	D	40.2	Very low	51.9	Low	156 Å²	156	124.4 Å²	124.4	83%	0.834	63%	0.625	S	S	*	*			trans	-90.2	111.1	153.3	-67.9	-36.2	0	0	0	106.4	D504	D502-D504 PolarHBondContact O-N 3.16Å
503	E	42.7	Very low	53.6	Low	181 Å²	181	119.3 Å²	119.3	85%	0.846	61%	0.609	S	S	*	*	G	3₁₀ helix	trans	-72.4	-14.1	-169.2	-64	-169.2	112.9	0	0	114	Q505	E503-Q505 PolarHBondContact O-N 2.83Å
504	D	44.8	Very low	55.5	Low	165 Å²	165	116 Å²	116	88%	0.882	59%	0.593	S	S	*	*	G	3₁₀ helix	trans	-87.6	3.1	-160.2	-78.7	-32.1	0	0	0	117.2	D502	D502-D504 PolarHBondContact O-N 3.16Å
505	Q	51.8	Low	56.8	Low	168 Å²	168	120.3 Å²	120.3	79%	0.785	61%	0.605	S	S	*	*	G	3₁₀ helix	trans	-111.3	-13.4	-174.3	-69.5	-162.3	9.1	0	0	117.7	E503	E503-Q505 PolarHBondContact O-N 2.83Å
506	F	52.4	Low	58.7	Low	133 Å²	133	121.4 Å²	121.4	58%	0.583	61%	0.611	S	S	*	*			trans	-128.4	99.6	-178.7	-77.9	-85.9	0	0	0	113.3	S508	F506-S508 PolarHBondContact O-N 2.8Å
507	S	58.1	Low	60.3	Low	80 Å²	80	116.4 Å²	116.4	56%	0.559	59%	0.587	S	S	*	*			trans	-62	125.6	176.9	177.6	0	0	0	0	112.5	E509 S510	S507-E509 PolarHBondContact O-N 3Å; S507-E509 VanDerWaalsContact O-N 3.16Å; S507-E509 PolarHBondContact OG-N 3.02Å; S507-S510 WeakPolarHBondContact O-CB 3.14Å; S507-S510 PolarHBondContact O-N 2.85Å; S507-S510 VanDerWaalsContact O-N 3.16Å; S507-S510 PolarHBondContact O-OG 3.32Å
508	S	61.7	Low	62	Low	64 Å²	64	112.5 Å²	112.5	45%	0.448	57%	0.571	S	S	.	*	G	3₁₀ helix	trans	-67	-11	179.5	59.1	0	0	0	0	114.4	F506 S510 C511	F506-S508 PolarHBondContact O-N 2.8Å; S508-S510 PolarHBondContact O-N 3.11Å; S508-C511 PolarHBondContact O-N 3Å
509	E	68.8	Low	64.1	Low	75 Å²	75	106 Å²	106	35%	0.35	55%	0.547	S	S	.	.	G	3₁₀ helix	trans	-56.6	-33.2	168.2	-70.9	-79.9	96.4	0	0	111.8	S507 C511 K512 K515	S507-E509 PolarHBondContact O-N 3Å; S507-E509 VanDerWaalsContact O-N 3.16Å; S507-E509 PolarHBondContact OG-N 3.02Å; E509-C511 PolarHBondContact O-N 2.87Å; E509-C511 VanDerWaalsContact O-N 3.14Å; E509-K512 PolarHBondContact O-N 2.92Å; E509-K512 VanDerWaalsContact O-N 3.11Å; E509-K512 WeakPolarHBondContact OE1-CD 3.47Å; E509-K512 WeakPolarHBondContact OE1-CE 3.28Å; E509-K512 IonicContact OE1-NZ 2.72Å; E509-K512 PolarHBondContact OE1-NZ 2.96Å; E509-K515 VanDerWaalsContact OE2-CE 3.31Å; E509-K515 WeakPolarHBondContact OE2-CE 3.48Å
510	S	73.6	Confident	65.8	Low	55 Å²	55	103.1 Å²	103.1	39%	0.385	53%	0.527	S	S	.	.	G	3₁₀ helix	trans	-60.2	-23.5	178.9	58.2	0	0	0	0	114.2	S507 S508 G529	S507-S510 WeakPolarHBondContact O-CB 3.14Å; S507-S510 PolarHBondContact O-N 2.85Å; S507-S510 VanDerWaalsContact O-N 3.16Å; S507-S510 PolarHBondContact O-OG 3.32Å; S508-S510 PolarHBondContact O-N 3.11Å; S510-G529 WeakPolarHBondContact OG-CA 3.29Å
511	C	80.9	Confident	68.1	Low	1 Å²	1	95.5 Å²	95.5	1%	0.007	50%	0.495	C	S	.	.	G	3₁₀ helix	trans	-102	15.1	-179.6	-75.1	0	0	0	0	113.6	S508 E509 V519 C520 C526 K530	S508-C511 PolarHBondContact O-N 3Å; E509-C511 PolarHBondContact O-N 2.87Å; E509-C511 VanDerWaalsContact O-N 3.14Å; C511-V519 HydrophobicContact CB-CG1 3.78Å; C511-C520 PolarHBondContact O-N 3.17Å; C511-C526 HydrophobicContact CB-CB 3.53Å; C511-C526 WeakPolarHBondContact CB-SG 3.36Å; C511-C526 WeakPolarHBondContact SG-CB 3.32Å; C511-C526 CovalentContact SG-SG 2.03Å; C511-C526 PolarHBondContact SG-SG 2.89Å; C511-K530 PolarHBondContact SG-N 2.9Å
512	K	82.6	Confident	70.1	Confident	46 Å²	46	90.4 Å²	90.4	20%	0.2	49%	0.488	C	S	.	.			trans	-111.9	146.5	174.3	-61.1	-179.4	-176	173.9	0	111.4	E509 H514 K515 V519 Y545	E509-K512 PolarHBondContact O-N 2.92Å; E509-K512 VanDerWaalsContact O-N 3.11Å; E509-K512 WeakPolarHBondContact OE1-CD 3.47Å; E509-K512 WeakPolarHBondContact OE1-CE 3.28Å; E509-K512 IonicContact OE1-NZ 2.72Å; E509-K512 PolarHBondContact OE1-NZ 2.96Å; K512-H514 WeakPolarHBondContact CB-O 3.48Å; K512-K515 PolarHBondContact NZ-O 3.07Å; K512-V519 HydrophobicContact CG-CG2 4.21Å; K512-Y545 WeakPolarHBondContact O-CE1 3.33Å
513	S	78.6	Confident	72.3	Confident	48 Å²	48	87.3 Å²	87.3	34%	0.336	46%	0.464	S	S	.	.	S	Bend	trans	-75	-36.8	168.4	-166.5	0	0	0	0	112.6
514	H	78.4	Confident	74.4	Confident	128 Å²	128	79.1 Å²	79.1	59%	0.593	43%	0.429	S	S	*	.	S	Bend	trans	-147	157.8	177.1	-58.6	-70.9	0	0	0	108.9	K512 D516 Q517	K512-H514 WeakPolarHBondContact CB-O 3.48Å; H514-D516 PolarHBondContact O-N 2.81Å; H514-D516 VanDerWaalsContact O-N 3.13Å; H514-Q517 PolarHBondContact O-N 3.23Å
515	K	73.4	Confident	76.4	Confident	153 Å²	153	75 Å²	75	67%	0.665	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	-36.9	-174	-69.3	-165.8	167.5	-171.9	0	114.1	E509 K512	E509-K515 VanDerWaalsContact OE2-CE 3.31Å; E509-K515 WeakPolarHBondContact OE2-CE 3.48Å; K512-K515 PolarHBondContact NZ-O 3.07Å
516	D	77.4	Confident	77.8	Confident	161 Å²	161	69.1 Å²	69.1	86%	0.861	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87	-4.1	-177.4	-44.8	-64.4	0	0	0	113.9	H514	H514-D516 PolarHBondContact O-N 2.81Å; H514-D516 VanDerWaalsContact O-N 3.13Å
517	Q	79.1	Confident	79.2	Confident	75 Å²	75	66 Å²	66	35%	0.35	38%	0.378	S	S	.	.	S	Bend	trans	-84.3	147.3	172.3	-86.1	-156.4	-1.7	0	0	112	H514 S521	H514-Q517 PolarHBondContact O-N 3.23Å; Q517-S521 PolarHBondContact OE1-OG 3.32Å
518	P	83.5	Confident	80	Confident	80 Å²	80	64.9 Å²	64.9	52%	0.519	37%	0.37	S	S	.	.	P	Polyproline II helix	trans	-62.8	147.8	169.3	27.3	-33.4	0	0	0	110.9	C520 S521	P518-C520 PolarHBondContact O-N 2.85Å; P518-S521 WeakPolarHBondContact O-CA 3.38Å; P518-S521 PolarHBondContact O-N 3.17Å
519	V	85.2	Confident	80.5	Confident	47 Å²	47	63 Å²	63	29%	0.285	36%	0.36	S	S	.	.	G	3₁₀ helix	trans	-53.3	131	174.6	175.6	0	0	0	0	109.7	C511 K512 S521 G522 C526	C511-V519 HydrophobicContact CB-CG1 3.78Å; K512-V519 HydrophobicContact CG-CG2 4.21Å; V519-S521 PolarHBondContact O-N 3Å; V519-S521 VanDerWaalsContact O-N 3.15Å; V519-G522 PolarHBondContact O-N 2.89Å; V519-C526 HydrophobicContact CG1-CB 3.57Å
520	C	86	Confident	80.9	Confident	0 Å²	0	67.1 Å²	67.1	0%	0	38%	0.377	C	S	.	.	G	3₁₀ helix	trans	48.9	39.4	-176.5	-53.7	0	0	0	0	113.6	C511 P518 G522 R523 G524 C531 Y545	C511-C520 PolarHBondContact O-N 3.17Å; P518-C520 PolarHBondContact O-N 2.85Å; C520-G522 PolarHBondContact O-N 2.79Å; C520-R523 PolarHBondContact O-N 2.82Å; C520-G524 PolarHBondContact O-N 2.89Å; C520-C531 WeakPolarHBondContact CA-SG 3.32Å; C520-C531 HydrophobicContact CB-CB 3.72Å; C520-C531 WeakPolarHBondContact CB-SG 3.42Å; C520-C531 WeakPolarHBondContact SG-CA 3.46Å; C520-C531 WeakPolarHBondContact SG-CB 3.4Å; C520-C531 CovalentContact SG-SG 2.04Å; C520-C531 PolarHBondContact SG-SG 3.28Å; C520-Y545 CarbonylContact C-O 3.58Å; C520-Y545 WeakPolarHBondContact CA-O 3.33Å; C520-Y545 VanDerWaalsContact O-O 3.12Å
521	S	87	Confident	81.3	Confident	29 Å²	29	65.4 Å²	65.4	20%	0.203	37%	0.365	C	S	.	.	G	3₁₀ helix	trans	50.1	23.1	-177.8	-60.8	0	0	0	0	114.2	Q517 P518 V519 R523 Y545	Q517-S521 PolarHBondContact OE1-OG 3.32Å; P518-S521 WeakPolarHBondContact O-CA 3.38Å; P518-S521 PolarHBondContact O-N 3.17Å; V519-S521 PolarHBondContact O-N 3Å; V519-S521 VanDerWaalsContact O-N 3.15Å; S521-R523 PolarHBondContact O-N 3.48Å; S521-Y545 WeakPolarHBondContact CB-O 3.15Å; S521-Y545 PolarHBondContact N-O 3.39Å; S521-Y545 PolarHBondContact OG-O 2.9Å
522	G	85.6	Confident	81.5	Confident	54 Å²	54	68.5 Å²	68.5	56%	0.557	39%	0.387	S	S	*	.	G	3₁₀ helix	trans	69.7	7.9	-173.8	0	0	0	0	0	115.1	V519 C520	V519-G522 PolarHBondContact O-N 2.89Å; C520-G522 PolarHBondContact O-N 2.79Å
523	R	87.6	Confident	81.7	Confident	90 Å²	90	68 Å²	68	34%	0.34	39%	0.389	S	S	.	.	S	Bend	trans	-115.5	10.9	-174.4	-63.1	176.2	166.6	-155.9	-3	113.7	C520 S521 H534 V541 C546 D549	C520-R523 PolarHBondContact O-N 2.82Å; S521-R523 PolarHBondContact O-N 3.48Å; R523-H534 PolarHBondContact O-N 3.36Å; R523-V541 HydrophobicContact CB-CG1 3.98Å; R523-C546 HydrophobicContact CB-CB 4.08Å; R523-C546 WeakPolarHBondContact CD-O 3.42Å; R523-D549 IonicContact CZ-OD2 3.37Å; R523-D549 IonicContact NH1-OD2 3.81Å; R523-D549 PolarHBondContact NH1-OD2 3.11Å; R523-D549 IonicContact NH2-OD2 3.23Å; R523-D549 PolarHBondContact NH2-OD2 2.89Å
524	G	85.8	Confident	81.9	Confident	10 Å²	10	70.1 Å²	70.1	10%	0.103	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.1	177.2	177.4	0	0	0	0	0	112.1	C520 S532	C520-G524 PolarHBondContact O-N 2.89Å; G524-S532 CarbonylContact C-O 3.26Å; G524-S532 WeakPolarHBondContact CA-O 3.27Å
525	V	86.3	Confident	81.8	Confident	77 Å²	77	74.2 Å²	74.2	47%	0.467	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	141.6	172.5	-71	0	0	0	0	110.6	V527 S532	V525-V527 HydrophobicContact CG2-CG2 4.08Å; V525-S532 PolarHBondContact N-O 2.61Å; V525-S532 PolarHBondContact O-N 3.22Å
526	C	81.8	Confident	82.1	Confident	45 Å²	45	70.4 Å²	70.4	30%	0.304	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	122.1	172.6	-175.2	0	0	0	0	109.3	C511 V519	C511-C526 HydrophobicContact CB-CB 3.53Å; C511-C526 WeakPolarHBondContact CB-SG 3.36Å; C511-C526 WeakPolarHBondContact SG-CB 3.32Å; C511-C526 CovalentContact SG-SG 2.03Å; C511-C526 PolarHBondContact SG-SG 2.89Å; V519-C526 HydrophobicContact CG1-CB 3.57Å
527	V	81.1	Confident	82.1	Confident	67 Å²	67	73.1 Å²	73.1	41%	0.406	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	122.9	177.5	-175.8	0	0	0	0	107.3	V525 G529 K530	V525-V527 HydrophobicContact CG2-CG2 4.08Å; V527-G529 VanDerWaalsContact C-N 3.26Å; V527-G529 PolarHBondContact O-N 3.24Å; V527-K530 PolarHBondContact N-O 3.07Å; V527-K530 PolarHBondContact O-N 2.72Å; V527-K530 VanDerWaalsContact O-O 3.04Å
528	C	76.3	Confident	81.8	Confident	57 Å²	57	76 Å²	76	39%	0.385	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	49	42.3	-178.6	-61.6	0	0	0	0	114.4	C491 K530	C491-C528 HydrophobicContact CB-CB 4.24Å; C491-C528 WeakPolarHBondContact CB-SG 3.29Å; C491-C528 WeakPolarHBondContact SG-CB 3.3Å; C491-C528 CovalentContact SG-SG 2.03Å; C491-C528 PolarHBondContact SG-SG 2.88Å; C528-K530 VanDerWaalsContact C-N 3.29Å; C528-K530 PolarHBondContact O-N 2.79Å
529	G	72	Confident	81.5	Confident	24 Å²	24	73.4 Å²	73.4	25%	0.247	41%	0.405	C	S	.	.	T	Hydrogen-bonded Turn	trans	73	13	-179.8	0	0	0	0	0	115.6	S510 V527	S510-G529 WeakPolarHBondContact OG-CA 3.29Å; V527-G529 VanDerWaalsContact C-N 3.26Å; V527-G529 PolarHBondContact O-N 3.24Å
530	K	76.6	Confident	81.3	Confident	162 Å²	162	77.3 Å²	77.3	70%	0.704	42%	0.418	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.2	144.7	178.4	-167.3	174.1	-177.2	177.5	0	111	C511 V527 C528	C511-K530 PolarHBondContact SG-N 2.9Å; V527-K530 PolarHBondContact N-O 3.07Å; V527-K530 PolarHBondContact O-N 2.72Å; V527-K530 VanDerWaalsContact O-O 3.04Å; C528-K530 VanDerWaalsContact C-N 3.29Å; C528-K530 PolarHBondContact O-N 2.79Å
531	C	82.5	Confident	81.2	Confident	19 Å²	19	77.7 Å²	77.7	13%	0.128	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	130.3	-179.5	-71.9	0	0	0	0	113	C520	C520-C531 WeakPolarHBondContact CA-SG 3.32Å; C520-C531 HydrophobicContact CB-CB 3.72Å; C520-C531 WeakPolarHBondContact CB-SG 3.42Å; C520-C531 WeakPolarHBondContact SG-CA 3.46Å; C520-C531 WeakPolarHBondContact SG-CB 3.4Å; C520-C531 CovalentContact SG-SG 2.04Å; C520-C531 PolarHBondContact SG-SG 3.28Å
532	S	85.1	Confident	80.9	Confident	67 Å²	67	79.4 Å²	79.4	47%	0.469	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	107.5	171.6	-173	0	0	0	0	109.3	G524 V525	G524-S532 CarbonylContact C-O 3.26Å; G524-S532 WeakPolarHBondContact CA-O 3.27Å; V525-S532 PolarHBondContact N-O 2.61Å; V525-S532 PolarHBondContact O-N 3.22Å
533	C	86.1	Confident	80.6	Confident	35 Å²	35	78.3 Å²	78.3	24%	0.236	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	141.3	-170.6	-48.7	0	0	0	0	112.7	V541 C546	C533-V541 HydrophobicContact CB-CB 4.08Å; C533-V541 HydrophobicContact CB-CG1 3.99Å; C533-C546 WeakPolarHBondContact CA-SG 3.26Å; C533-C546 HydrophobicContact CB-CB 3.83Å; C533-C546 WeakPolarHBondContact CB-SG 3.29Å; C533-C546 WeakPolarHBondContact SG-CA 3.33Å; C533-C546 WeakPolarHBondContact SG-CB 3.47Å; C533-C546 CovalentContact SG-SG 2.04Å; C533-C546 PolarHBondContact SG-SG 3.14Å
534	H	83.6	Confident	80.3	Confident	92 Å²	92	80.9 Å²	80.9	43%	0.426	43%	0.425	S	S	.	.	P	Polyproline II helix	trans	-66.9	136.8	179.5	-62.8	157.4	0	0	0	111.5	R523 I536	R523-H534 PolarHBondContact O-N 3.36Å; H534-I536 PolarHBondContact O-N 3.39Å
535	K	76.3	Confident	80.3	Confident	214 Å²	214	82.3 Å²	82.3	93%	0.93	43%	0.428	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.7	116.7	172.1	-65.6	179.3	-178.7	175.6	0	109
536	I	79.5	Confident	80.3	Confident	73 Å²	73	78.6 Å²	78.6	37%	0.374	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	147.7	-177.6	-51.6	-175.7	0	0	0	108.9	H534 L538 G539 V541 F551	H534-I536 PolarHBondContact O-N 3.39Å; I536-L538 HydrophobicContact CG2-CB 4.21Å; I536-L538 HydrophobicContact CG2-CD1 4.45Å; I536-L538 HydrophobicContact CG2-CG 4.31Å; I536-L538 PolarHBondContact O-N 3.17Å; I536-G539 PolarHBondContact O-N 3.03Å; I536-V541 HydrophobicContact CD1-CG2 3.57Å; I536-V541 HydrophobicContact CG1-CG2 4.18Å; I536-F551 HydrophobicContact CD1-CZ 4.17Å
537	K	77.9	Confident	80.5	Confident	218 Å²	218	80.5 Å²	80.5	95%	0.948	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-11.1	178	-68.7	-172.4	178.3	-177.8	0	114.6
538	L	71.3	Confident	80.7	Confident	135 Å²	135	80.3 Å²	80.3	71%	0.707	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.5	-21.2	-178.2	-64.2	172.8	0	0	0	113.2	I536 F551	I536-L538 HydrophobicContact CG2-CB 4.21Å; I536-L538 HydrophobicContact CG2-CD1 4.45Å; I536-L538 HydrophobicContact CG2-CG 4.31Å; I536-L538 PolarHBondContact O-N 3.17Å; L538-F551 HydrophobicContact CB-CD1 4.24Å; L538-F551 HydrophobicContact CB-CD2 4.46Å; L538-F551 HydrophobicContact CB-CG 4.2Å
539	G	77.2	Confident	81.1	Confident	27 Å²	27	78 Å²	78	28%	0.278	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	153.5	-165.8	-172.7	0	0	0	0	0	111.5	I536 D550	I536-G539 PolarHBondContact O-N 3.03Å; G539-D550 WeakPolarHBondContact CA-OD1 3.22Å
540	K	82.5	Confident	81.6	Confident	129 Å²	129	79.7 Å²	79.7	56%	0.561	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.2	123.9	-172.2	-174.2	-176.7	174.7	-168.2	0	111.7	D549 D550	K540-D549 WeakPolarHBondContact O-CA 3.44Å; K540-D550 VanDerWaalsContact CB-OD2 3.29Å; K540-D550 WeakPolarHBondContact CB-OD2 3.34Å; K540-D550 VanDerWaalsContact N-CG 3.3Å; K540-D550 PolarHBondContact N-OD1 2.99Å; K540-D550 PolarHBondContact N-OD2 3.01Å; K540-D550 PolarHBondContact O-N 3.21Å
541	V	82.9	Confident	82.1	Confident	8 Å²	8	73.4 Å²	73.4	5%	0.048	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	137.5	162.4	-177.2	0	0	0	0	109.2	R523 C533 I536 C546 K548 D549 F551	R523-V541 HydrophobicContact CB-CG1 3.98Å; C533-V541 HydrophobicContact CB-CB 4.08Å; C533-V541 HydrophobicContact CB-CG1 3.99Å; I536-V541 HydrophobicContact CD1-CG2 3.57Å; I536-V541 HydrophobicContact CG1-CG2 4.18Å; V541-C546 HydrophobicContact CG1-CB 3.76Å; V541-C546 WeakPolarHBondContact CG1-O 3.46Å; V541-K548 WeakPolarHBondContact CA-O 3.46Å; V541-K548 WeakPolarHBondContact CG1-O 3.45Å; V541-D549 HydrophobicContact CG2-CB 4.37Å; V541-F551 HydrophobicContact CG2-CE1 4.21Å; V541-F551 HydrophobicContact CG2-CZ 4.29Å
542	Y	81.1	Confident	82.3	Confident	64 Å²	64	75.5 Å²	75.5	25%	0.251	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	-175.8	-178.3	68.4	-77.5	0	0	0	111.4	C546 E547 K548 D550	Y542-C546 CarbonylContact O-C 3.5Å; Y542-C546 WeakPolarHBondContact O-CA 3.19Å; Y542-E547 PolarHBondContact O-N 3.09Å; Y542-K548 HydrophobicContact CD1-CB 4.02Å; Y542-K548 HydrophobicContact CD2-CB 3.98Å; Y542-K548 HydrophobicContact CD2-CD 4.15Å; Y542-K548 HydrophobicContact CE1-CB 3.8Å; Y542-K548 HydrophobicContact CE2-CB 3.78Å; Y542-K548 HydrophobicContact CE2-CD 3.51Å; Y542-K548 HydrophobicContact CE2-CG 4.29Å; Y542-K548 HydrophobicContact CG-CB 4.1Å; Y542-K548 PolarHBondContact N-O 2.88Å; Y542-K548 WeakPolarHBondContact O-CA 3.02Å; Y542-K548 PolarHBondContact O-N 3.39Å; Y542-D550 HydrophobicContact CE1-CB 4.46Å
543	G	78.8	Confident	82.5	Confident	32 Å²	32	72.5 Å²	72.5	33%	0.33	36%	0.357	S	S	.	.	S	Bend	trans	105.8	172	-173.2	0	0	0	0	0	112.7	Y545 E547	G543-Y545 VanDerWaalsContact C-N 3.31Å; G543-Y545 PolarHBondContact O-N 3.1Å; G543-E547 VanDerWaalsContact C-OE2 3.24Å; G543-E547 WeakPolarHBondContact CA-OE1 3.43Å; G543-E547 WeakPolarHBondContact CA-OE2 3.1Å
544	K	81.2	Confident	82.7	Confident	143 Å²	143	73 Å²	73	62%	0.622	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-33.1	-175.9	-173.2	-174.8	173.7	-159.2	0	112	E547	K544-E547 PolarHBondContact N-OE1 2.94Å; K544-E547 VanDerWaalsContact N-OE1 3.15Å; K544-E547 PolarHBondContact N-OE2 3Å
545	Y	86.1	Confident	82.8	Confident	40 Å²	40	74.2 Å²	74.2	16%	0.157	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-121	21.7	-179.1	-47.6	-63.1	0	0	0	111.5	K512 C520 S521 G543 E547	K512-Y545 WeakPolarHBondContact O-CE1 3.33Å; C520-Y545 CarbonylContact C-O 3.58Å; C520-Y545 WeakPolarHBondContact CA-O 3.33Å; C520-Y545 VanDerWaalsContact O-O 3.12Å; S521-Y545 WeakPolarHBondContact CB-O 3.15Å; S521-Y545 PolarHBondContact N-O 3.39Å; S521-Y545 PolarHBondContact OG-O 2.9Å; G543-Y545 VanDerWaalsContact C-N 3.31Å; G543-Y545 PolarHBondContact O-N 3.1Å; Y545-E547 VanDerWaalsContact C-N 3.25Å; Y545-E547 WeakPolarHBondContact CA-OE2 3.04Å; Y545-E547 PolarHBondContact N-OE2 2.03Å; Y545-E547 PolarHBondContact O-N 3.49Å
546	C	86.8	Confident	83.2	Confident	0 Å²	0	66.9 Å²	66.9	0%	0	33%	0.331	C	S	.	.	S	Bend	trans	61.5	30.9	-175.3	-52.5	0	0	0	0	114.2	R523 C533 V541 Y542	R523-C546 HydrophobicContact CB-CB 4.08Å; R523-C546 WeakPolarHBondContact CD-O 3.42Å; C533-C546 WeakPolarHBondContact CA-SG 3.26Å; C533-C546 HydrophobicContact CB-CB 3.83Å; C533-C546 WeakPolarHBondContact CB-SG 3.29Å; C533-C546 WeakPolarHBondContact SG-CA 3.33Å; C533-C546 WeakPolarHBondContact SG-CB 3.47Å; C533-C546 CovalentContact SG-SG 2.04Å; C533-C546 PolarHBondContact SG-SG 3.14Å; V541-C546 HydrophobicContact CG1-CB 3.76Å; V541-C546 WeakPolarHBondContact CG1-O 3.46Å; Y542-C546 CarbonylContact O-C 3.5Å; Y542-C546 WeakPolarHBondContact O-CA 3.19Å
547	E	85.8	Confident	83.4	Confident	85 Å²	85	71.7 Å²	71.7	40%	0.397	35%	0.351	S	S	.	.			trans	-82.6	-16.3	-175	75.2	-70.7	169.4	0	0	114.8	Y542 G543 K544 Y545	Y542-E547 PolarHBondContact O-N 3.09Å; G543-E547 VanDerWaalsContact C-OE2 3.24Å; G543-E547 WeakPolarHBondContact CA-OE1 3.43Å; G543-E547 WeakPolarHBondContact CA-OE2 3.1Å; K544-E547 PolarHBondContact N-OE1 2.94Å; K544-E547 VanDerWaalsContact N-OE1 3.15Å; K544-E547 PolarHBondContact N-OE2 3Å; Y545-E547 VanDerWaalsContact C-N 3.25Å; Y545-E547 WeakPolarHBondContact CA-OE2 3.04Å; Y545-E547 PolarHBondContact N-OE2 2.03Å; Y545-E547 PolarHBondContact O-N 3.49Å
548	K	84.7	Confident	83.6	Confident	62 Å²	62	64.3 Å²	64.3	27%	0.27	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	154.1	178.6	-64.7	-173.1	176.4	-176.5	0	111.7	V541 Y542 E568 A569	V541-K548 WeakPolarHBondContact CA-O 3.46Å; V541-K548 WeakPolarHBondContact CG1-O 3.45Å; Y542-K548 HydrophobicContact CD1-CB 4.02Å; Y542-K548 HydrophobicContact CD2-CB 3.98Å; Y542-K548 HydrophobicContact CD2-CD 4.15Å; Y542-K548 HydrophobicContact CE1-CB 3.8Å; Y542-K548 HydrophobicContact CE2-CB 3.78Å; Y542-K548 HydrophobicContact CE2-CD 3.51Å; Y542-K548 HydrophobicContact CE2-CG 4.29Å; Y542-K548 HydrophobicContact CG-CB 4.1Å; Y542-K548 PolarHBondContact N-O 2.88Å; Y542-K548 WeakPolarHBondContact O-CA 3.02Å; Y542-K548 PolarHBondContact O-N 3.39Å; K548-E568 IonicContact NZ-OE1 3.5Å; K548-E568 PolarHBondContact NZ-OE1 3.02Å; K548-A569 HydrophobicContact CD-CB 4.31Å; K548-A569 HydrophobicContact CG-CB 4.28Å
549	D	84.9	Confident	84.4	Confident	10 Å²	10	62.2 Å²	62.2	5%	0.053	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	163.9	165.8	66.8	75	0	0	0	111.1	R523 K540 V541 F551 S552	R523-D549 IonicContact CZ-OD2 3.37Å; R523-D549 IonicContact NH1-OD2 3.81Å; R523-D549 PolarHBondContact NH1-OD2 3.11Å; R523-D549 IonicContact NH2-OD2 3.23Å; R523-D549 PolarHBondContact NH2-OD2 2.89Å; K540-D549 WeakPolarHBondContact O-CA 3.44Å; V541-D549 HydrophobicContact CG2-CB 4.37Å; D549-F551 HydrophobicContact CB-CD1 3.98Å; D549-F551 HydrophobicContact CB-CE1 3.63Å; D549-F551 HydrophobicContact CB-CE2 4.24Å; D549-F551 HydrophobicContact CB-CG 4.44Å; D549-F551 HydrophobicContact CB-CZ 3.76Å; D549-F551 WeakPolarHBondContact OD1-CD2 3.5Å; D549-F551 PolarHBondContact OD1-N 2.73Å; D549-F551 VanDerWaalsContact OD1-N 3.1Å; D549-S552 WeakPolarHBondContact OD1-CB 3.18Å; D549-S552 PolarHBondContact OD1-N 3.38Å; D549-S552 PolarHBondContact OD1-OG 2.91Å; D549-S552 PolarHBondContact OD2-OG 3.04Å
550	D	83.8	Confident	84.9	Confident	58 Å²	58	63.1 Å²	63.1	31%	0.31	33%	0.325	S	S	.	.	S	Bend	trans	-100.5	13.4	-177	62.6	2.9	0	0	0	113.5	G539 K540 Y542 L560 C567	G539-D550 WeakPolarHBondContact CA-OD1 3.22Å; K540-D550 VanDerWaalsContact CB-OD2 3.29Å; K540-D550 WeakPolarHBondContact CB-OD2 3.34Å; K540-D550 VanDerWaalsContact N-CG 3.3Å; K540-D550 PolarHBondContact N-OD1 2.99Å; K540-D550 PolarHBondContact N-OD2 3.01Å; K540-D550 PolarHBondContact O-N 3.21Å; Y542-D550 HydrophobicContact CE1-CB 4.46Å; D550-L560 WeakPolarHBondContact O-CD2 3.34Å; D550-C567 VanDerWaalsContact C-SG 3.52Å; D550-C567 WeakPolarHBondContact O-CB 3.5Å
551	F	85.4	Confident	85.3	Confident	31 Å²	31	57 Å²	57	14%	0.136	30%	0.298	C	S	.	.	S	Bend	trans	-129.5	-12.9	-172.8	56.3	-104.9	0	0	0	115.6	I536 L538 V541 D549 C553 Y555	I536-F551 HydrophobicContact CD1-CZ 4.17Å; L538-F551 HydrophobicContact CB-CD1 4.24Å; L538-F551 HydrophobicContact CB-CD2 4.46Å; L538-F551 HydrophobicContact CB-CG 4.2Å; V541-F551 HydrophobicContact CG2-CE1 4.21Å; V541-F551 HydrophobicContact CG2-CZ 4.29Å; D549-F551 HydrophobicContact CB-CD1 3.98Å; D549-F551 HydrophobicContact CB-CE1 3.63Å; D549-F551 HydrophobicContact CB-CE2 4.24Å; D549-F551 HydrophobicContact CB-CG 4.44Å; D549-F551 HydrophobicContact CB-CZ 3.76Å; D549-F551 WeakPolarHBondContact OD1-CD2 3.5Å; D549-F551 PolarHBondContact OD1-N 2.73Å; D549-F551 VanDerWaalsContact OD1-N 3.1Å; F551-C553 VanDerWaalsContact C-N 3.33Å; F551-C553 PolarHBondContact O-N 2.71Å; F551-Y555 PolarHBondContact O-OH 3.14Å
552	S	87.5	Confident	85.5	Confident	63 Å²	63	57 Å²	57	44%	0.441	30%	0.299	S	S	.	.			trans	-86.9	8	-176.4	-56.7	0	0	0	0	115	D549	D549-S552 WeakPolarHBondContact OD1-CB 3.18Å; D549-S552 PolarHBondContact OD1-N 3.38Å; D549-S552 PolarHBondContact OD1-OG 2.91Å; D549-S552 PolarHBondContact OD2-OG 3.04Å
553	C	90.1	Very high	85.8	Confident	4 Å²	4	56 Å²	56	3%	0.027	31%	0.308	C	S	.	.	S	Bend	trans	-76.1	164.4	178.8	-61.8	0	0	0	0	113.2	F551 Y555 L560 C567 G570 R571	F551-C553 VanDerWaalsContact C-N 3.33Å; F551-C553 PolarHBondContact O-N 2.71Å; C553-Y555 VanDerWaalsContact O-CD2 3.32Å; C553-Y555 WeakPolarHBondContact O-CD2 3.17Å; C553-Y555 PolarHBondContact O-N 3.48Å; C553-L560 HydrophobicContact CB-CD1 3.83Å; C553-L560 HydrophobicContact CB-CG 4.43Å; C553-L560 WeakPolarHBondContact O-CD1 3.44Å; C553-C567 HydrophobicContact CB-CB 3.78Å; C553-C567 WeakPolarHBondContact CB-SG 3.33Å; C553-C567 WeakPolarHBondContact SG-CA 3.25Å; C553-C567 WeakPolarHBondContact SG-CB 3.35Å; C553-C567 CovalentContact SG-SG 2.02Å; C553-C567 PolarHBondContact SG-SG 2.9Å; C553-G570 VanDerWaalsContact SG-CA 3.57Å; C553-R571 VanDerWaalsContact SG-C 3.56Å; C553-R571 PolarHBondContact SG-N 3.27Å; C553-R571 VanDerWaalsContact SG-N 3.37Å; C553-R571 PolarHBondContact SG-O 2.65Å
554	P	88.5	Confident	86.3	Confident	45 Å²	45	57.4 Å²	57.4	29%	0.292	31%	0.306	S	S	.	.	P	Polyproline II helix	trans	-57.3	132.1	177.3	-28.3	36.2	0	0	0	114.5	C561 R582	P554-C561 PolarHBondContact O-N 2.88Å; P554-R582 HydrophobicContact CB-CB 4.31Å; P554-R582 HydrophobicContact CB-CG 3.73Å
555	Y	87.4	Confident	86.6	Confident	118 Å²	118	51.1 Å²	51.1	46%	0.463	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	150.7	172.3	-74.1	-103.9	0	0	0	111.9	F551 C553 G558 N559 L560 R582	F551-Y555 PolarHBondContact O-OH 3.14Å; C553-Y555 VanDerWaalsContact O-CD2 3.32Å; C553-Y555 WeakPolarHBondContact O-CD2 3.17Å; C553-Y555 PolarHBondContact O-N 3.48Å; Y555-G558 WeakPolarHBondContact CD1-O 3.37Å; Y555-N559 CarbonylContact C-O 3.56Å; Y555-N559 WeakPolarHBondContact CA-O 3.4Å; Y555-L560 HydrophobicContact CD1-CB 4.26Å; Y555-L560 HydrophobicContact CD2-CD1 3.96Å; Y555-L560 HydrophobicContact CE1-CB 3.89Å; Y555-L560 HydrophobicContact CE1-CD1 4.21Å; Y555-L560 HydrophobicContact CE2-CD1 3.48Å; Y555-L560 VanDerWaalsContact CE2-CD1 3.48Å; Y555-R582 WeakPolarHBondContact O-CD 3.39Å; Y555-R582 PolarHBondContact O-NH1 3.34Å
556	H	84.6	Confident	86.7	Confident	60 Å²	60	54.5 Å²	54.5	28%	0.278	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	124.8	173.2	-176.2	-118.8	0	0	0	109.3	G558 N559 A562 R582	H556-G558 PolarHBondContact O-N 2.85Å; H556-G558 VanDerWaalsContact O-N 3.1Å; H556-N559 PolarHBondContact N-O 3.26Å; H556-N559 PolarHBondContact O-N 3.09Å; H556-A562 HydrophobicContact CB-CB 4.01Å; H556-R582 HydrophobicContact CB-CB 4.36Å
557	H	83.3	Confident	86.6	Confident	173 Å²	173	55.2 Å²	55.2	80%	0.801	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	47	34.2	-172.3	-62.3	116.5	0	0	0	115.4	N559	H557-N559 VanDerWaalsContact C-N 3.33Å
558	G	82.6	Confident	86.5	Confident	63 Å²	63	55.5 Å²	55.5	65%	0.649	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	88	-11	-179	0	0	0	0	0	115.2	Y555 H556	Y555-G558 WeakPolarHBondContact CD1-O 3.37Å; H556-G558 PolarHBondContact O-N 2.85Å; H556-G558 VanDerWaalsContact O-N 3.1Å
559	N	86.9	Confident	86.1	Confident	92 Å²	92	55.5 Å²	55.5	49%	0.492	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	134.5	175.9	-65.2	-18.1	0	0	0	111.2	Y555 H556 H557 C561 A562	Y555-N559 CarbonylContact C-O 3.56Å; Y555-N559 WeakPolarHBondContact CA-O 3.4Å; H556-N559 PolarHBondContact N-O 3.26Å; H556-N559 PolarHBondContact O-N 3.09Å; H557-N559 VanDerWaalsContact C-N 3.33Å; N559-C561 PolarHBondContact O-N 3.47Å; N559-A562 VanDerWaalsContact CB-C 3.45Å; N559-A562 PolarHBondContact ND2-O 2.93Å; N559-A562 PolarHBondContact O-N 3.09Å
560	L	88.4	Confident	85.9	Confident	46 Å²	46	56.6 Å²	56.6	24%	0.241	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	129.9	169.3	-172.8	74.8	0	0	0	109.2	D550 C553 Y555 A562 G563 C567	D550-L560 WeakPolarHBondContact O-CD2 3.34Å; C553-L560 HydrophobicContact CB-CD1 3.83Å; C553-L560 HydrophobicContact CB-CG 4.43Å; C553-L560 WeakPolarHBondContact O-CD1 3.44Å; Y555-L560 HydrophobicContact CD1-CB 4.26Å; Y555-L560 HydrophobicContact CD2-CD1 3.96Å; Y555-L560 HydrophobicContact CE1-CB 3.89Å; Y555-L560 HydrophobicContact CE1-CD1 4.21Å; Y555-L560 HydrophobicContact CE2-CD1 3.48Å; Y555-L560 VanDerWaalsContact CE2-CD1 3.48Å; L560-A562 PolarHBondContact O-N 3.45Å; L560-A562 VanDerWaalsContact O-N 3.08Å; L560-G563 PolarHBondContact O-N 3.29Å; L560-C567 HydrophobicContact CD2-CB 3.76Å; L560-C567 HydrophobicContact CG-CB 4.37Å
561	C	90.2	Very high	86.1	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	35%	0.352	C	S	.	.	G	3₁₀ helix	trans	49.2	38.1	-178.1	-58	0	0	0	0	113.5	P554 N559 G563 H564 G565 C572 R582	P554-C561 PolarHBondContact O-N 2.88Å; N559-C561 PolarHBondContact O-N 3.47Å; C561-G563 PolarHBondContact O-N 2.88Å; C561-H564 PolarHBondContact O-N 2.81Å; C561-G565 PolarHBondContact O-N 2.94Å; C561-C572 WeakPolarHBondContact CA-SG 2.99Å; C561-C572 HydrophobicContact CB-CB 3.63Å; C561-C572 WeakPolarHBondContact CB-SG 3.06Å; C561-C572 WeakPolarHBondContact SG-CA 3.44Å; C561-C572 WeakPolarHBondContact SG-CB 3.15Å; C561-C572 CovalentContact SG-SG 2.03Å; C561-C572 PolarHBondContact SG-SG 3.33Å; C561-R582 CarbonylContact C-O 3.59Å; C561-R582 WeakPolarHBondContact CA-O 3.27Å
562	A	88	Confident	86.3	Confident	8 Å²	8	62.9 Å²	62.9	7%	0.066	35%	0.352	C	S	.	.	G	3₁₀ helix	trans	57.8	-3.2	-172.2	0	0	0	0	0	116.4	H556 N559 L560 R582	H556-A562 HydrophobicContact CB-CB 4.01Å; N559-A562 VanDerWaalsContact CB-C 3.45Å; N559-A562 PolarHBondContact ND2-O 2.93Å; N559-A562 PolarHBondContact O-N 3.09Å; L560-A562 PolarHBondContact O-N 3.45Å; L560-A562 VanDerWaalsContact O-N 3.08Å; A562-R582 WeakPolarHBondContact CB-O 3.24Å; A562-R582 PolarHBondContact N-O 2.79Å
563	G	87	Confident	86.5	Confident	44 Å²	44	66.1 Å²	66.1	45%	0.454	36%	0.36	S	S	.	.	G	3₁₀ helix	trans	85.7	12.9	-164.2	0	0	0	0	0	113.6	L560 C561	L560-G563 PolarHBondContact O-N 3.29Å; C561-G563 PolarHBondContact O-N 2.88Å
564	H	89.6	Confident	86.3	Confident	60 Å²	60	68 Å²	68	28%	0.278	37%	0.373	S	S	.	.	S	Bend	trans	-128.8	18.2	-171	-57	-32.6	0	0	0	113.6	C561 F575 W578 C583	C561-H564 PolarHBondContact O-N 2.81Å; H564-F575 WeakPolarHBondContact O-CD2 3.45Å; H564-F575 WeakPolarHBondContact O-CG 3.43Å; H564-F575 PolarHBondContact O-N 2.87Å; H564-W578 HydrophobicContact CB-CB 4.26Å; H564-W578 HydrophobicContact CB-CD2 3.7Å; H564-W578 HydrophobicContact CB-CE3 4.05Å; H564-W578 HydrophobicContact CB-CG 3.77Å; H564-W578 AromaticContact CD2-CD2 3.72Å; H564-W578 AromaticContact CD2-CE2 3.81Å; H564-W578 AromaticContact CD2-CE3 3.43Å; H564-W578 VanDerWaalsContact CD2-CE3 3.43Å; H564-W578 AromaticContact CD2-CH2 3.39Å; H564-W578 WeakPolarHBondContact CD2-CH2 3.41Å; H564-W578 AromaticContact CD2-CZ2 3.67Å; H564-W578 AromaticContact CD2-CZ3 3.26Å; H564-W578 WeakPolarHBondContact CD2-CZ3 3.47Å; H564-W578 AromaticContact CE1-CZ2 3.88Å; H564-W578 AromaticContact CG-CD2 3.7Å; H564-W578 AromaticContact CG-CE2 3.71Å; H564-W578 AromaticContact CG-CE3 3.88Å; H564-W578 AromaticContact CG-CZ2 3.94Å; H564-W578 AromaticContact NE2-CH2 3.36Å; H564-W578 WeakPolarHBondContact NE2-CH2 3.36Å; H564-W578 AromaticContact NE2-CZ2 3.65Å; H564-W578 AromaticContact NE2-CZ3 3.71Å; H564-C583 HydrophobicContact CB-CB 4Å; H564-C583 WeakPolarHBondContact CB-O 3.24Å; H564-C583 WeakPolarHBondContact O-CB 3.1Å
565	G	87.9	Confident	86.2	Confident	12 Å²	12	69.5 Å²	69.5	12%	0.124	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.2	160.4	169	0	0	0	0	0	111.9	C561 Q573	C561-G565 PolarHBondContact O-N 2.94Å; G565-Q573 CarbonylContact C-O 3.55Å; G565-Q573 WeakPolarHBondContact CA-O 3.49Å
566	E	88.5	Confident	85.9	Confident	110 Å²	110	70 Å²	70	51%	0.514	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	145.6	168.2	-84.4	170.9	-179.2	0	0	109.1	K438 Q573 F575	K438-E566 IonicContact NZ-OE1 2.68Å; K438-E566 PolarHBondContact NZ-OE1 3.49Å; E566-Q573 PolarHBondContact N-O 2.96Å; E566-Q573 WeakPolarHBondContact O-CB 3.49Å; E566-Q573 PolarHBondContact O-N 3.23Å; E566-F575 HydrophobicContact CB-CE1 4.35Å; E566-F575 HydrophobicContact CG-CE1 3.86Å; E566-F575 HydrophobicContact CG-CZ 4.12Å
567	C	84.8	Confident	85.7	Confident	16 Å²	16	68.9 Å²	68.9	11%	0.108	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	119.1	180	174.1	0	0	0	0	110	D550 C553 L560	D550-C567 VanDerWaalsContact C-SG 3.52Å; D550-C567 WeakPolarHBondContact O-CB 3.5Å; C553-C567 HydrophobicContact CB-CB 3.78Å; C553-C567 WeakPolarHBondContact CB-SG 3.33Å; C553-C567 WeakPolarHBondContact SG-CA 3.25Å; C553-C567 WeakPolarHBondContact SG-CB 3.35Å; C553-C567 CovalentContact SG-SG 2.02Å; C553-C567 PolarHBondContact SG-SG 2.9Å; L560-C567 HydrophobicContact CD2-CB 3.76Å; L560-C567 HydrophobicContact CG-CB 4.37Å
568	E	82.6	Confident	85.8	Confident	91 Å²	91	64.4 Å²	64.4	43%	0.425	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	125.6	171.3	176.2	156.2	-150.6	0	0	111.3	K548 G570 R571	K548-E568 IonicContact NZ-OE1 3.5Å; K548-E568 PolarHBondContact NZ-OE1 3.02Å; E568-G570 PolarHBondContact O-N 2.82Å; E568-G570 VanDerWaalsContact O-N 3.09Å; E568-R571 PolarHBondContact N-O 3.31Å; E568-R571 PolarHBondContact O-N 3.17Å
569	A	77.1	Confident	85.8	Confident	62 Å²	62	65.1 Å²	65.1	51%	0.512	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.7	36.8	173.2	0	0	0	0	0	114	K548	K548-A569 HydrophobicContact CD-CB 4.31Å; K548-A569 HydrophobicContact CG-CB 4.28Å
570	G	80.8	Confident	85.7	Confident	32 Å²	32	62.4 Å²	62.4	33%	0.33	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.1	5.2	-179.6	0	0	0	0	0	115.5	C553 E568	C553-G570 VanDerWaalsContact SG-CA 3.57Å; E568-G570 PolarHBondContact O-N 2.82Å; E568-G570 VanDerWaalsContact O-N 3.09Å
571	R	87.8	Confident	85.6	Confident	203 Å²	203	67.1 Å²	67.1	77%	0.766	38%	0.381	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.4	151.2	173.4	-62	-171.1	-176	121.1	0.3	112.1	C553 E568	C553-R571 VanDerWaalsContact SG-C 3.56Å; C553-R571 PolarHBondContact SG-N 3.27Å; C553-R571 VanDerWaalsContact SG-N 3.37Å; C553-R571 PolarHBondContact SG-O 2.65Å; E568-R571 PolarHBondContact N-O 3.31Å; E568-R571 PolarHBondContact O-N 3.17Å
572	C	89	Confident	85.4	Confident	18 Å²	18	72.9 Å²	72.9	12%	0.122	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	113.7	178.7	-67	0	0	0	0	111.3	C561 C574 C583	C561-C572 WeakPolarHBondContact CA-SG 2.99Å; C561-C572 HydrophobicContact CB-CB 3.63Å; C561-C572 WeakPolarHBondContact CB-SG 3.06Å; C561-C572 WeakPolarHBondContact SG-CA 3.44Å; C561-C572 WeakPolarHBondContact SG-CB 3.15Å; C561-C572 CovalentContact SG-SG 2.03Å; C561-C572 PolarHBondContact SG-SG 3.33Å; C572-C574 PolarHBondContact O-N 3.02Å; C572-C583 VanDerWaalsContact CB-SG 3.6Å
573	Q	91.1	Very high	85.5	Confident	131 Å²	131	72.5 Å²	72.5	61%	0.612	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.8	96.3	173.3	-165.4	73.9	4.3	0	0	108.4	G565 E566	G565-Q573 CarbonylContact C-O 3.55Å; G565-Q573 WeakPolarHBondContact CA-O 3.49Å; E566-Q573 PolarHBondContact N-O 2.96Å; E566-Q573 WeakPolarHBondContact O-CB 3.49Å; E566-Q573 PolarHBondContact O-N 3.23Å
574	C	87.1	Confident	85.5	Confident	44 Å²	44	73.2 Å²	73.2	30%	0.297	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	142.7	-170.8	-55.9	0	0	0	0	113.6	C572 W578 G580 C583	C572-C574 PolarHBondContact O-N 3.02Å; C574-W578 HydrophobicContact CB-CB 4.37Å; C574-W578 WeakPolarHBondContact CB-O 3.34Å; C574-G580 PolarHBondContact SG-O 2.72Å; C574-C583 WeakPolarHBondContact CA-SG 3.22Å; C574-C583 HydrophobicContact CB-CB 3.77Å; C574-C583 WeakPolarHBondContact CB-SG 3.28Å; C574-C583 WeakPolarHBondContact SG-CA 3.4Å; C574-C583 WeakPolarHBondContact SG-CB 3.25Å; C574-C583 CovalentContact SG-SG 2.04Å; C574-C583 PolarHBondContact SG-SG 3.45Å
575	F	85.5	Confident	85.2	Confident	77 Å²	77	70.9 Å²	70.9	34%	0.338	38%	0.382	S	S	.	.	P	Polyproline II helix	trans	-69.3	147.5	172.3	-58.4	-34.8	0	0	0	110.5	H564 E566 G577 W578	H564-F575 WeakPolarHBondContact O-CD2 3.45Å; H564-F575 WeakPolarHBondContact O-CG 3.43Å; H564-F575 PolarHBondContact O-N 2.87Å; E566-F575 HydrophobicContact CB-CE1 4.35Å; E566-F575 HydrophobicContact CG-CE1 3.86Å; E566-F575 HydrophobicContact CG-CZ 4.12Å; F575-G577 PolarHBondContact O-N 2.84Å; F575-W578 WeakPolarHBondContact O-CB 3.38Å; F575-W578 PolarHBondContact O-N 2.75Å
576	S	82.1	Confident	85	Confident	128 Å²	128	72.6 Å²	72.6	90%	0.895	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.8	129.4	175.9	-174.6	0	0	0	0	111.3
577	G	80.1	Confident	84.2	Confident	36 Å²	36	69.8 Å²	69.8	37%	0.371	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	91	4.2	-170.9	0	0	0	0	0	115.3	F575 P586 S587	F575-G577 PolarHBondContact O-N 2.84Å; G577-P586 CarbonylContact O-C 3.36Å; G577-P586 VanDerWaalsContact O-CA 3.25Å; G577-P586 WeakPolarHBondContact O-CA 3.36Å; G577-S587 VanDerWaalsContact C-OG 3.24Å; G577-S587 PolarHBondContact O-N 3.04Å
578	W	84.6	Confident	83.5	Confident	80 Å²	80	71.6 Å²	71.6	30%	0.303	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	149.6	174.2	-63.5	85.9	0	0	0	113	H564 C574 F575 C583 C585 P586 S587	H564-W578 HydrophobicContact CB-CB 4.26Å; H564-W578 HydrophobicContact CB-CD2 3.7Å; H564-W578 HydrophobicContact CB-CE3 4.05Å; H564-W578 HydrophobicContact CB-CG 3.77Å; H564-W578 AromaticContact CD2-CD2 3.72Å; H564-W578 AromaticContact CD2-CE2 3.81Å; H564-W578 AromaticContact CD2-CE3 3.43Å; H564-W578 VanDerWaalsContact CD2-CE3 3.43Å; H564-W578 AromaticContact CD2-CH2 3.39Å; H564-W578 WeakPolarHBondContact CD2-CH2 3.41Å; H564-W578 AromaticContact CD2-CZ2 3.67Å; H564-W578 AromaticContact CD2-CZ3 3.26Å; H564-W578 WeakPolarHBondContact CD2-CZ3 3.47Å; H564-W578 AromaticContact CE1-CZ2 3.88Å; H564-W578 AromaticContact CG-CD2 3.7Å; H564-W578 AromaticContact CG-CE2 3.71Å; H564-W578 AromaticContact CG-CE3 3.88Å; H564-W578 AromaticContact CG-CZ2 3.94Å; H564-W578 AromaticContact NE2-CH2 3.36Å; H564-W578 WeakPolarHBondContact NE2-CH2 3.36Å; H564-W578 AromaticContact NE2-CZ2 3.65Å; H564-W578 AromaticContact NE2-CZ3 3.71Å; C574-W578 HydrophobicContact CB-CB 4.37Å; C574-W578 WeakPolarHBondContact CB-O 3.34Å; F575-W578 WeakPolarHBondContact O-CB 3.38Å; F575-W578 PolarHBondContact O-N 2.75Å; W578-C583 HydrophobicContact CB-CB 4.42Å; W578-C585 CarbonylContact C-O 3.51Å; W578-C585 VanDerWaalsContact CA-O 3.29Å; W578-C585 WeakPolarHBondContact CA-O 3.38Å; W578-C585 VanDerWaalsContact CE3-C 3.44Å; W578-P586 HydrophobicContact CE3-CG 4.21Å; W578-P586 HydrophobicContact CH2-CG 3.9Å; W578-P586 HydrophobicContact CZ3-CB 4.45Å; W578-P586 HydrophobicContact CZ3-CG 3.71Å; W578-S587 PolarHBondContact N-OG 3.25Å; W578-S587 PolarHBondContact O-OG 3.47Å
579	E	83.3	Confident	82.9	Confident	78 Å²	78	67.5 Å²	67.5	36%	0.364	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	169.3	-173.2	69.5	-173.5	-165.5	0	0	113.2	C583 Q584 C585 S587	E579-C583 CarbonylContact O-C 3.52Å; E579-C583 WeakPolarHBondContact O-CA 3.45Å; E579-Q584 PolarHBondContact O-N 2.82Å; E579-C585 HydrophobicContact CG-CB 3.7Å; E579-C585 PolarHBondContact N-O 2.85Å; E579-C585 PolarHBondContact O-N 2.86Å; E579-C585 VanDerWaalsContact O-N 3.15Å; E579-S587 WeakPolarHBondContact OE2-CA 3.47Å
580	G	84	Confident	82.4	Confident	34 Å²	34	66.9 Å²	66.9	35%	0.351	38%	0.376	S	S	.	.	S	Bend	trans	88.3	158.9	-176.5	0	0	0	0	0	113.7	C574 R582 C583	C574-G580 PolarHBondContact SG-O 2.72Å; G580-R582 PolarHBondContact O-N 2.56Å; G580-C583 PolarHBondContact O-N 2.99Å
581	D	85.6	Confident	82.1	Confident	145 Å²	145	72.6 Å²	72.6	78%	0.775	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-15.2	-169.4	-50.5	-25.9	0	0	0	116
582	R	87.8	Confident	81.7	Confident	122 Å²	122	68 Å²	68	46%	0.46	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123	14.2	176	-35.7	-168.3	-173.2	-168.1	4.3	112.5	P554 Y555 H556 C561 A562 G580 Q584	P554-R582 HydrophobicContact CB-CB 4.31Å; P554-R582 HydrophobicContact CB-CG 3.73Å; Y555-R582 WeakPolarHBondContact O-CD 3.39Å; Y555-R582 PolarHBondContact O-NH1 3.34Å; H556-R582 HydrophobicContact CB-CB 4.36Å; C561-R582 CarbonylContact C-O 3.59Å; C561-R582 WeakPolarHBondContact CA-O 3.27Å; A562-R582 WeakPolarHBondContact CB-O 3.24Å; A562-R582 PolarHBondContact N-O 2.79Å; G580-R582 PolarHBondContact O-N 2.56Å; R582-Q584 VanDerWaalsContact CA-OE1 3.31Å; R582-Q584 PolarHBondContact O-N 3.43Å
583	C	88.8	Confident	81.4	Confident	0 Å²	0	67.1 Å²	67.1	0%	0	38%	0.375	C	S	.	.	S	Bend	trans	54.8	33.3	-174.3	-46.2	0	0	0	0	113.7	H564 C572 C574 W578 E579 G580	H564-C583 HydrophobicContact CB-CB 4Å; H564-C583 WeakPolarHBondContact CB-O 3.24Å; H564-C583 WeakPolarHBondContact O-CB 3.1Å; C572-C583 VanDerWaalsContact CB-SG 3.6Å; C574-C583 WeakPolarHBondContact CA-SG 3.22Å; C574-C583 HydrophobicContact CB-CB 3.77Å; C574-C583 WeakPolarHBondContact CB-SG 3.28Å; C574-C583 WeakPolarHBondContact SG-CA 3.4Å; C574-C583 WeakPolarHBondContact SG-CB 3.25Å; C574-C583 CovalentContact SG-SG 2.04Å; C574-C583 PolarHBondContact SG-SG 3.45Å; W578-C583 HydrophobicContact CB-CB 4.42Å; E579-C583 CarbonylContact O-C 3.52Å; E579-C583 WeakPolarHBondContact O-CA 3.45Å; G580-C583 PolarHBondContact O-N 2.99Å
584	Q	87.8	Confident	81.2	Confident	58 Å²	58	63.6 Å²	63.6	27%	0.271	36%	0.362	S	S	.	.			trans	-84.6	-15.4	-171.1	73.1	-76.4	-5.5	0	0	114.8	E579 R582	E579-Q584 PolarHBondContact O-N 2.82Å; R582-Q584 VanDerWaalsContact CA-OE1 3.31Å; R582-Q584 PolarHBondContact O-N 3.43Å
585	C	83.9	Confident	80.9	Confident	11 Å²	11	62.5 Å²	62.5	7%	0.074	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	139.3	179.8	-58.4	0	0	0	0	110.8	W578 E579 C609	W578-C585 CarbonylContact C-O 3.51Å; W578-C585 VanDerWaalsContact CA-O 3.29Å; W578-C585 WeakPolarHBondContact CA-O 3.38Å; W578-C585 VanDerWaalsContact CE3-C 3.44Å; E579-C585 HydrophobicContact CG-CB 3.7Å; E579-C585 PolarHBondContact N-O 2.85Å; E579-C585 PolarHBondContact O-N 2.86Å; E579-C585 VanDerWaalsContact O-N 3.15Å; C585-C609 WeakPolarHBondContact CA-SG 3.46Å; C585-C609 HydrophobicContact CB-CB 3.68Å; C585-C609 WeakPolarHBondContact CB-SG 2.97Å; C585-C609 WeakPolarHBondContact SG-CA 3.32Å; C585-C609 WeakPolarHBondContact SG-CB 3.41Å; C585-C609 PolarHBondContact SG-N 3.18Å; C585-C609 CovalentContact SG-SG 2.04Å; C585-C609 PolarHBondContact SG-SG 3.41Å
586	P	82.9	Confident	80.6	Confident	49 Å²	49	65.1 Å²	65.1	32%	0.318	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	139.3	164.4	-15.7	28.8	0	0	0	111.1	G577 W578 A588 A589	G577-P586 CarbonylContact O-C 3.36Å; G577-P586 VanDerWaalsContact O-CA 3.25Å; G577-P586 WeakPolarHBondContact O-CA 3.36Å; W578-P586 HydrophobicContact CE3-CG 4.21Å; W578-P586 HydrophobicContact CH2-CG 3.9Å; W578-P586 HydrophobicContact CZ3-CB 4.45Å; W578-P586 HydrophobicContact CZ3-CG 3.71Å; P586-A588 PolarHBondContact O-N 2.91Å; P586-A589 HydrophobicContact CB-CB 4.32Å; P586-A589 HydrophobicContact CG-CB 4.48Å; P586-A589 WeakPolarHBondContact O-CA 3.18Å; P586-A589 WeakPolarHBondContact O-CB 3.24Å; P586-A589 PolarHBondContact O-N 3.07Å
587	S	72.3	Confident	80.3	Confident	50 Å²	50	67.2 Å²	67.2	35%	0.35	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-21.3	-179.3	-49.2	0	0	0	0	114.2	G577 W578 E579 A589	G577-S587 VanDerWaalsContact C-OG 3.24Å; G577-S587 PolarHBondContact O-N 3.04Å; W578-S587 PolarHBondContact N-OG 3.25Å; W578-S587 PolarHBondContact O-OG 3.47Å; E579-S587 WeakPolarHBondContact OE2-CA 3.47Å; S587-A589 PolarHBondContact O-N 3.07Å
588	A	70.1	Confident	80.4	Confident	54 Å²	54	68.3 Å²	68.3	45%	0.446	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-15.6	170.2	0	0	0	0	0	112.7	P586 A590 Q591	P586-A588 PolarHBondContact O-N 2.91Å; A588-A590 VanDerWaalsContact C-N 3.28Å; A588-A590 PolarHBondContact O-N 2.91Å; A588-Q591 WeakPolarHBondContact O-CB 3.49Å; A588-Q591 PolarHBondContact O-N 2.87Å; A588-Q591 VanDerWaalsContact O-N 3.09Å
589	A	69.1	Low	80.3	Confident	6 Å²	6	68.8 Å²	68.8	5%	0.05	39%	0.392	C	S	.	.	G	3₁₀ helix	trans	-62.3	-34	-170.2	0	0	0	0	0	112.7	P586 S587 Q591 H592 C609 G610	P586-A589 HydrophobicContact CB-CB 4.32Å; P586-A589 HydrophobicContact CG-CB 4.48Å; P586-A589 WeakPolarHBondContact O-CA 3.18Å; P586-A589 WeakPolarHBondContact O-CB 3.24Å; P586-A589 PolarHBondContact O-N 3.07Å; S587-A589 PolarHBondContact O-N 3.07Å; A589-Q591 PolarHBondContact O-N 2.98Å; A589-Q591 VanDerWaalsContact O-N 3.14Å; A589-H592 WeakPolarHBondContact O-CB 3.47Å; A589-H592 PolarHBondContact O-N 3.42Å; A589-C609 VanDerWaalsContact CB-C 3.48Å; A589-G610 WeakPolarHBondContact O-CA 3.37Å
590	A	67.4	Low	80.4	Confident	49 Å²	49	68.7 Å²	68.7	41%	0.405	40%	0.396	S	S	.	.	G	3₁₀ helix	trans	-52.7	-34.9	175.1	0	0	0	0	0	113.6	A588 H592 C593	A588-A590 VanDerWaalsContact C-N 3.28Å; A588-A590 PolarHBondContact O-N 2.91Å; A590-H592 VanDerWaalsContact C-N 3.3Å; A590-H592 PolarHBondContact O-N 2.85Å; A590-C593 PolarHBondContact O-N 2.88Å
591	Q	74.4	Confident	80.6	Confident	151 Å²	151	67 Å²	67	71%	0.706	38%	0.379	S	S	*	.	G	3₁₀ helix	trans	-65.7	-33.2	177.6	-59.1	-174.7	4.1	0	0	112.1	A588 A589 C593 V594	A588-Q591 WeakPolarHBondContact O-CB 3.49Å; A588-Q591 PolarHBondContact O-N 2.87Å; A588-Q591 VanDerWaalsContact O-N 3.09Å; A589-Q591 PolarHBondContact O-N 2.98Å; A589-Q591 VanDerWaalsContact O-N 3.14Å; Q591-C593 PolarHBondContact O-N 2.96Å; Q591-V594 PolarHBondContact O-N 3.45Å; Q591-V594 VanDerWaalsContact O-N 3.15Å
592	H	77.9	Confident	80.6	Confident	106 Å²	106	61 Å²	61	49%	0.491	35%	0.348	S	S	.	.	G	3₁₀ helix	trans	-73.9	-3.5	179.4	-63	-80.9	0	0	0	114.2	A589 A590 F623	A589-H592 WeakPolarHBondContact O-CB 3.47Å; A589-H592 PolarHBondContact O-N 3.42Å; A590-H592 VanDerWaalsContact C-N 3.3Å; A590-H592 PolarHBondContact O-N 2.85Å; H592-F623 VanDerWaalsContact O-CE1 3.28Å; H592-F623 WeakPolarHBondContact O-CE1 3.45Å
593	C	83.6	Confident	80.5	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	36%	0.359	C	S	.	.	G	3₁₀ helix	trans	-98.5	-3.6	171	-69.9	0	0	0	0	113.9	A590 Q591 V600 C601 C607 G610 F623	A590-C593 PolarHBondContact O-N 2.88Å; Q591-C593 PolarHBondContact O-N 2.96Å; C593-V600 HydrophobicContact CB-CG1 4.23Å; C593-V600 WeakPolarHBondContact O-CA 3.38Å; C593-C601 PolarHBondContact O-N 2.91Å; C593-C607 HydrophobicContact CB-CB 3.52Å; C593-C607 WeakPolarHBondContact CB-SG 3.46Å; C593-C607 VanDerWaalsContact SG-CA 3.58Å; C593-C607 WeakPolarHBondContact SG-CB 3.38Å; C593-C607 CovalentContact SG-SG 2.03Å; C593-C607 PolarHBondContact SG-SG 3.08Å; C593-G610 VanDerWaalsContact SG-CA 3.52Å; C593-F623 WeakPolarHBondContact O-CD1 3.2Å
594	V	86	Confident	80.4	Confident	57 Å²	57	62.5 Å²	62.5	35%	0.345	38%	0.375	S	S	.	.	B	Isolated β-bridge	trans	-90.7	124.8	-177.3	-175	0	0	0	0	110	Q591 V600 F623	Q591-V594 PolarHBondContact O-N 3.45Å; Q591-V594 VanDerWaalsContact O-N 3.15Å; V594-V600 HydrophobicContact CG2-CG2 4.24Å; V594-F623 WeakPolarHBondContact O-CE1 3.48Å
595	N	81.3	Confident	80.4	Confident	22 Å²	22	60.5 Å²	60.5	12%	0.118	37%	0.37	C	S	.	.			trans	-78.5	171.4	175.6	77.7	12.8	0	0	0	111.9	K597 G598 Q599 S602 F623	N595-K597 PolarHBondContact O-N 3.07Å; N595-K597 WeakPolarHBondContact OD1-CA 3.41Å; N595-K597 WeakPolarHBondContact OD1-CB 3.23Å; N595-K597 PolarHBondContact OD1-N 2.92Å; N595-G598 PolarHBondContact O-N 3.3Å; N595-G598 PolarHBondContact OD1-N 2.72Å; N595-Q599 PolarHBondContact N-O 3.23Å; N595-Q599 PolarHBondContact ND2-OE1 3.18Å; N595-Q599 VanDerWaalsContact ND2-OE1 3.17Å; N595-Q599 PolarHBondContact OD1-N 3.35Å; N595-S602 PolarHBondContact ND2-OG 3.2Å; N595-F623 HydrophobicContact CB-CB 4.25Å; N595-F623 HydrophobicContact CB-CD1 4.41Å; N595-F623 HydrophobicContact CB-CG 4.22Å
596	S	79	Confident	80.6	Confident	132 Å²	132	63.6 Å²	63.6	92%	0.923	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-6.7	-179.5	54.7	0	0	0	0	115.5
597	K	76.2	Confident	80.7	Confident	171 Å²	171	63.3 Å²	63.3	74%	0.743	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.3	10.9	174.1	-57.8	-176.9	179.6	-178.7	0	112.7	N595 Q599	N595-K597 PolarHBondContact O-N 3.07Å; N595-K597 WeakPolarHBondContact OD1-CA 3.41Å; N595-K597 WeakPolarHBondContact OD1-CB 3.23Å; N595-K597 PolarHBondContact OD1-N 2.92Å; K597-Q599 VanDerWaalsContact C-N 3.29Å; K597-Q599 HydrophobicContact CB-CG 4.38Å; K597-Q599 PolarHBondContact O-N 3.3Å
598	G	81.8	Confident	81.3	Confident	59 Å²	59	64.4 Å²	64.4	61%	0.608	39%	0.392	S	S	*	.	S	Bend	trans	77.1	9.1	-179.2	0	0	0	0	0	114.7	N595	N595-G598 PolarHBondContact O-N 3.3Å; N595-G598 PolarHBondContact OD1-N 2.72Å
599	Q	82.1	Confident	81.8	Confident	91 Å²	91	64.3 Å²	64.3	43%	0.425	39%	0.387	S	S	.	.			trans	-94.9	125.5	-176	-54.2	172.4	-53.8	0	0	110.9	N595 K597 C601	N595-Q599 PolarHBondContact N-O 3.23Å; N595-Q599 PolarHBondContact ND2-OE1 3.18Å; N595-Q599 VanDerWaalsContact ND2-OE1 3.17Å; N595-Q599 PolarHBondContact OD1-N 3.35Å; K597-Q599 VanDerWaalsContact C-N 3.29Å; K597-Q599 HydrophobicContact CB-CG 4.38Å; K597-Q599 PolarHBondContact O-N 3.3Å; Q599-C601 PolarHBondContact O-N 3.43Å
600	V	86.3	Confident	82.4	Confident	75 Å²	75	64.8 Å²	64.8	46%	0.455	39%	0.392	S	S	.	.	B	Isolated β-bridge	trans	-62.5	121.3	167.6	-178.8	0	0	0	0	108.6	C593 V594 S602 G603 C607	C593-V600 HydrophobicContact CB-CG1 4.23Å; C593-V600 WeakPolarHBondContact O-CA 3.38Å; V594-V600 HydrophobicContact CG2-CG2 4.24Å; V600-S602 PolarHBondContact O-N 3.08Å; V600-G603 PolarHBondContact O-N 3.19Å; V600-C607 HydrophobicContact CG1-CB 3.9Å
601	C	88.3	Confident	83.2	Confident	0 Å²	0	72 Å²	72	0%	0	41%	0.409	C	S	.	.	G	3₁₀ helix	trans	48.4	36.5	176.3	-53.5	0	0	0	0	114.1	C593 Q599 G603 R604 G605 C612 F623	C593-C601 PolarHBondContact O-N 2.91Å; Q599-C601 PolarHBondContact O-N 3.43Å; C601-G603 PolarHBondContact O-N 2.9Å; C601-R604 PolarHBondContact O-N 3Å; C601-G605 WeakPolarHBondContact CB-O 3.47Å; C601-C612 WeakPolarHBondContact CA-SG 3.36Å; C601-C612 HydrophobicContact CB-CB 3.63Å; C601-C612 WeakPolarHBondContact CB-SG 3.12Å; C601-C612 WeakPolarHBondContact SG-CA 3.33Å; C601-C612 WeakPolarHBondContact SG-CB 3.43Å; C601-C612 CovalentContact SG-SG 2.03Å; C601-C612 PolarHBondContact SG-SG 2.87Å; C601-F623 CarbonylContact C-O 3.6Å; C601-F623 WeakPolarHBondContact CA-O 3.17Å; C601-F623 VanDerWaalsContact O-O 3.09Å
602	S	85.6	Confident	83.9	Confident	18 Å²	18	65.4 Å²	65.4	13%	0.126	38%	0.38	C	S	.	.	G	3₁₀ helix	trans	51.2	23.4	-177.7	-48.9	0	0	0	0	114.8	N595 V600 R604 F623	N595-S602 PolarHBondContact ND2-OG 3.2Å; V600-S602 PolarHBondContact O-N 3.08Å; S602-R604 PolarHBondContact O-N 3.07Å; S602-F623 WeakPolarHBondContact CB-O 3.5Å; S602-F623 PolarHBondContact N-O 2.88Å; S602-F623 PolarHBondContact OG-O 2.94Å
603	G	85.7	Confident	84.4	Confident	67 Å²	67	66.3 Å²	66.3	69%	0.691	38%	0.384	S	S	*	.	G	3₁₀ helix	trans	69.3	12.1	-173.3	0	0	0	0	0	115	V600 C601	V600-G603 PolarHBondContact O-N 3.19Å; C601-G603 PolarHBondContact O-N 2.9Å
604	R	85.8	Confident	84.6	Confident	86 Å²	86	68 Å²	68	33%	0.325	40%	0.396	S	S	.	.	S	Bend	trans	-120.7	13.9	-172.1	-67	172	178.4	-78.9	-2.3	113.2	C601 S602 C614 T615 C624 C630	C601-R604 PolarHBondContact O-N 3Å; S602-R604 PolarHBondContact O-N 3.07Å; R604-C614 CarbonylContact O-C 3.54Å; R604-C614 WeakPolarHBondContact O-CA 3.08Å; R604-T615 PolarHBondContact O-N 3.24Å; R604-T615 PolarHBondContact O-OG1 3.27Å; R604-C624 HydrophobicContact CB-CB 3.76Å; R604-C624 VanDerWaalsContact CD-O 3.24Å; R604-C624 WeakPolarHBondContact CD-O 3.35Å; R604-C630 PolarHBondContact NH1-SG 2.99Å
605	G	88.3	Confident	84.6	Confident	16 Å²	16	70.2 Å²	70.2	17%	0.165	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-169.5	170	-177.9	0	0	0	0	0	113.1	C601 E613	C601-G605 WeakPolarHBondContact CB-O 3.47Å; G605-E613 CarbonylContact C-O 2.83Å; G605-E613 WeakPolarHBondContact CA-O 3.34Å
606	T	88.3	Confident	84.4	Confident	76 Å²	76	70.9 Å²	70.9	47%	0.466	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	140.2	173.2	40.7	0	0	0	0	110.2	E613	T606-E613 PolarHBondContact N-O 2.93Å; T606-E613 PolarHBondContact O-N 2.86Å
607	C	85.8	Confident	84.2	Confident	44 Å²	44	70.4 Å²	70.4	30%	0.297	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	124.1	172.7	-174.4	0	0	0	0	110.2	C593 V600	C593-C607 HydrophobicContact CB-CB 3.52Å; C593-C607 WeakPolarHBondContact CB-SG 3.46Å; C593-C607 VanDerWaalsContact SG-CA 3.58Å; C593-C607 WeakPolarHBondContact SG-CB 3.38Å; C593-C607 CovalentContact SG-SG 2.03Å; C593-C607 PolarHBondContact SG-SG 3.08Å; V600-C607 HydrophobicContact CG1-CB 3.9Å
608	V	85.1	Confident	84.3	Confident	73 Å²	73	69 Å²	69	44%	0.442	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	111.7	176.5	-174.6	0	0	0	0	108	G610 R611 E613	V608-G610 PolarHBondContact O-N 3.13Å; V608-G610 VanDerWaalsContact O-N 3.1Å; V608-R611 PolarHBondContact N-O 2.85Å; V608-R611 PolarHBondContact O-N 3.24Å; V608-E613 HydrophobicContact CG2-CB 4.36Å
609	C	80.2	Confident	84.3	Confident	51 Å²	51	66.5 Å²	66.5	35%	0.345	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	43.8	41.3	-174.5	-54	0	0	0	0	114.9	C585 A589 R611	C585-C609 WeakPolarHBondContact CA-SG 3.46Å; C585-C609 HydrophobicContact CB-CB 3.68Å; C585-C609 WeakPolarHBondContact CB-SG 2.97Å; C585-C609 WeakPolarHBondContact SG-CA 3.32Å; C585-C609 WeakPolarHBondContact SG-CB 3.41Å; C585-C609 PolarHBondContact SG-N 3.18Å; C585-C609 CovalentContact SG-SG 2.04Å; C585-C609 PolarHBondContact SG-SG 3.41Å; A589-C609 VanDerWaalsContact CB-C 3.48Å; C609-R611 VanDerWaalsContact C-N 3.35Å; C609-R611 PolarHBondContact O-N 3.29Å
610	G	81.1	Confident	84.2	Confident	16 Å²	16	67.5 Å²	67.5	17%	0.165	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	78.8	12.4	177.3	0	0	0	0	0	116	A589 C593 V608	A589-G610 WeakPolarHBondContact O-CA 3.37Å; C593-G610 VanDerWaalsContact SG-CA 3.52Å; V608-G610 PolarHBondContact O-N 3.13Å; V608-G610 VanDerWaalsContact O-N 3.1Å
611	R	85.2	Confident	84	Confident	200 Å²	200	65.6 Å²	65.6	76%	0.755	37%	0.373	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.8	141.1	162.7	-176.6	175	-65.8	173	0.8	109.2	V608 C609	V608-R611 PolarHBondContact N-O 2.85Å; V608-R611 PolarHBondContact O-N 3.24Å; C609-R611 VanDerWaalsContact C-N 3.35Å; C609-R611 PolarHBondContact O-N 3.29Å
612	C	87.8	Confident	83.9	Confident	13 Å²	13	73.2 Å²	73.2	9%	0.088	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	125.8	170.3	-71.2	0	0	0	0	111	C601 R622	C601-C612 WeakPolarHBondContact CA-SG 3.36Å; C601-C612 HydrophobicContact CB-CB 3.63Å; C601-C612 WeakPolarHBondContact CB-SG 3.12Å; C601-C612 WeakPolarHBondContact SG-CA 3.33Å; C601-C612 WeakPolarHBondContact SG-CB 3.43Å; C601-C612 CovalentContact SG-SG 2.03Å; C601-C612 PolarHBondContact SG-SG 2.87Å; C612-R622 WeakPolarHBondContact CB-O 3.45Å
613	E	89.6	Confident	84	Confident	125 Å²	125	74.6 Å²	74.6	58%	0.584	41%	0.406	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.5	112.9	169.3	-174.7	161.6	-140.5	0	0	108.1	G605 T606 V608	G605-E613 CarbonylContact C-O 2.83Å; G605-E613 WeakPolarHBondContact CA-O 3.34Å; T606-E613 PolarHBondContact N-O 2.93Å; T606-E613 PolarHBondContact O-N 2.86Å; V608-E613 HydrophobicContact CG2-CB 4.36Å
614	C	88	Confident	84.1	Confident	37 Å²	37	71.4 Å²	71.4	25%	0.25	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	126.6	-169.7	-52.1	0	0	0	0	111.5	R604 C624	R604-C614 CarbonylContact O-C 3.54Å; R604-C614 WeakPolarHBondContact O-CA 3.08Å; C614-C624 WeakPolarHBondContact CA-SG 3.46Å; C614-C624 HydrophobicContact CB-CB 3.92Å; C614-C624 WeakPolarHBondContact CB-SG 3.43Å; C614-C624 VanDerWaalsContact SG-CA 3.57Å; C614-C624 WeakPolarHBondContact SG-CB 3.33Å; C614-C624 CovalentContact SG-SG 2.04Å; C614-C624 PolarHBondContact SG-SG 3.46Å
615	T	84.9	Confident	84	Confident	103 Å²	103	70.8 Å²	70.8	63%	0.632	37%	0.373	S	S	*	.	S	Bend	trans	-79	-23	-176.6	47.2	0	0	0	0	112.7	R604	R604-T615 PolarHBondContact O-N 3.24Å; R604-T615 PolarHBondContact O-OG1 3.27Å
616	D	76.7	Confident	83.7	Confident	35 Å²	35	75.7 Å²	75.7	19%	0.187	39%	0.392	C	S	.	.	S	Bend	trans	-98	117.3	162.3	-172.7	-30.8	0	0	0	108.9	R618 S619	D616-R618 PolarHBondContact O-N 3.27Å; D616-R618 VanDerWaalsContact OD1-CB 3.29Å; D616-R618 WeakPolarHBondContact OD1-CB 3.35Å; D616-R618 WeakPolarHBondContact OD1-CG 3.48Å; D616-R618 IonicContact OD1-CZ 3.07Å; D616-R618 PolarHBondContact OD1-N 3.26Å; D616-R618 IonicContact OD1-NE 2.9Å; D616-R618 PolarHBondContact OD1-NE 3.19Å; D616-R618 IonicContact OD1-NH2 3.38Å; D616-R618 IonicContact OD2-CZ 2.65Å; D616-R618 IonicContact OD2-NE 2.92Å; D616-R618 PolarHBondContact OD2-NE 2.67Å; D616-R618 IonicContact OD2-NH2 3.78Å; D616-R618 PolarHBondContact OD2-NH2 3.26Å; D616-S619 WeakPolarHBondContact O-CB 3.35Å; D616-S619 PolarHBondContact O-N 3.46Å
617	P	74.9	Confident	83.1	Confident	123 Å²	123	72.6 Å²	72.6	80%	0.799	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-1.3	-178.4	28.9	-36.3	0	0	0	114.3
618	R	77.9	Confident	82.3	Confident	140 Å²	140	75.5 Å²	75.5	53%	0.528	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.7	-5.4	171.8	-54.6	165.6	-64.6	179.6	3.4	112.8	D616 C627	D616-R618 PolarHBondContact O-N 3.27Å; D616-R618 VanDerWaalsContact OD1-CB 3.29Å; D616-R618 WeakPolarHBondContact OD1-CB 3.35Å; D616-R618 WeakPolarHBondContact OD1-CG 3.48Å; D616-R618 IonicContact OD1-CZ 3.07Å; D616-R618 PolarHBondContact OD1-N 3.26Å; D616-R618 IonicContact OD1-NE 2.9Å; D616-R618 PolarHBondContact OD1-NE 3.19Å; D616-R618 IonicContact OD1-NH2 3.38Å; D616-R618 IonicContact OD2-CZ 2.65Å; D616-R618 IonicContact OD2-NE 2.92Å; D616-R618 PolarHBondContact OD2-NE 2.67Å; D616-R618 IonicContact OD2-NH2 3.78Å; D616-R618 PolarHBondContact OD2-NH2 3.26Å; R618-C627 PolarHBondContact O-SG 3Å
619	S	82.8	Confident	81.4	Confident	7 Å²	7	76.3 Å²	76.3	5%	0.049	40%	0.397	C	S	.	.			trans	-87.4	129.1	171.4	-56.5	0	0	0	0	109.8	D616 C627	D616-S619 WeakPolarHBondContact O-CB 3.35Å; D616-S619 PolarHBondContact O-N 3.46Å; S619-C627 WeakPolarHBondContact OG-CB 3.4Å
620	I	80.2	Confident	80.6	Confident	112 Å²	112	75.5 Å²	75.5	57%	0.574	39%	0.391	S	S	*	.	B	Isolated β-bridge	trans	-128.4	160.9	-173.1	-54.7	172.5	0	0	0	107.4	C624 E625 H626	I620-C624 CarbonylContact O-C 3.55Å; I620-E625 PolarHBondContact O-N 2.91Å; I620-H626 PolarHBondContact N-O 2.85Å; I620-H626 WeakPolarHBondContact O-CA 3.37Å; I620-H626 WeakPolarHBondContact O-CB 3.44Å; I620-H626 PolarHBondContact O-N 2.78Å
621	G	82.6	Confident	79.4	Confident	35 Å²	35	81.2 Å²	81.2	36%	0.361	41%	0.413	S	S	.	.	S	Bend	trans	110.6	172.2	-179.9	0	0	0	0	0	112.6	F623 E625	G621-F623 VanDerWaalsContact C-N 3.25Å; G621-F623 PolarHBondContact O-N 3.39Å; G621-E625 WeakPolarHBondContact CA-OE1 3.19Å; G621-E625 VanDerWaalsContact CA-OE2 3.32Å; G621-E625 WeakPolarHBondContact CA-OE2 3.34Å
622	R	84.9	Confident	77.9	Confident	161 Å²	161	75.5 Å²	75.5	61%	0.608	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-28	-173.4	177.7	174.1	176.8	129.8	8.1	112.7	C612 E625	C612-R622 WeakPolarHBondContact CB-O 3.45Å; R622-E625 PolarHBondContact N-OE1 2.91Å; R622-E625 PolarHBondContact N-OE2 3.2Å
623	F	87.9	Confident	76.1	Confident	47 Å²	47	76.9 Å²	76.9	21%	0.206	41%	0.413	C	S	.	.	T	Hydrogen-bonded Turn	trans	-125.2	25.1	-176.5	-51.7	-85	0	0	0	111.3	H592 C593 V594 N595 C601 S602 G621 E625	H592-F623 VanDerWaalsContact O-CE1 3.28Å; H592-F623 WeakPolarHBondContact O-CE1 3.45Å; C593-F623 WeakPolarHBondContact O-CD1 3.2Å; V594-F623 WeakPolarHBondContact O-CE1 3.48Å; N595-F623 HydrophobicContact CB-CB 4.25Å; N595-F623 HydrophobicContact CB-CD1 4.41Å; N595-F623 HydrophobicContact CB-CG 4.22Å; C601-F623 CarbonylContact C-O 3.6Å; C601-F623 WeakPolarHBondContact CA-O 3.17Å; C601-F623 VanDerWaalsContact O-O 3.09Å; S602-F623 WeakPolarHBondContact CB-O 3.5Å; S602-F623 PolarHBondContact N-O 2.88Å; S602-F623 PolarHBondContact OG-O 2.94Å; G621-F623 VanDerWaalsContact C-N 3.25Å; G621-F623 PolarHBondContact O-N 3.39Å; F623-E625 VanDerWaalsContact CA-OE2 3.22Å; F623-E625 WeakPolarHBondContact CA-OE2 3.47Å; F623-E625 PolarHBondContact N-OE2 2.88Å; F623-E625 PolarHBondContact O-N 2.91Å; F623-E625 VanDerWaalsContact O-N 3.16Å
624	C	87.6	Confident	74.4	Confident	0 Å²	0	75 Å²	75	0%	0	41%	0.413	C	S	.	.	S	Bend	trans	54.8	28.8	-175.5	-50.2	0	0	0	0	114.2	R604 C614 I620	R604-C624 HydrophobicContact CB-CB 3.76Å; R604-C624 VanDerWaalsContact CD-O 3.24Å; R604-C624 WeakPolarHBondContact CD-O 3.35Å; C614-C624 WeakPolarHBondContact CA-SG 3.46Å; C614-C624 HydrophobicContact CB-CB 3.92Å; C614-C624 WeakPolarHBondContact CB-SG 3.43Å; C614-C624 VanDerWaalsContact SG-CA 3.57Å; C614-C624 WeakPolarHBondContact SG-CB 3.33Å; C614-C624 CovalentContact SG-SG 2.04Å; C614-C624 PolarHBondContact SG-SG 3.46Å; I620-C624 CarbonylContact O-C 3.55Å
625	E	84	Confident	72.8	Confident	72 Å²	72	81 Å²	81	34%	0.336	44%	0.435	S	S	.	.			trans	-75.8	-24.5	-170.8	66.2	-84.1	-156.1	0	0	114	I620 G621 R622 F623	I620-E625 PolarHBondContact O-N 2.91Å; G621-E625 WeakPolarHBondContact CA-OE1 3.19Å; G621-E625 VanDerWaalsContact CA-OE2 3.32Å; G621-E625 WeakPolarHBondContact CA-OE2 3.34Å; R622-E625 PolarHBondContact N-OE1 2.91Å; R622-E625 PolarHBondContact N-OE2 3.2Å; F623-E625 VanDerWaalsContact CA-OE2 3.22Å; F623-E625 WeakPolarHBondContact CA-OE2 3.47Å; F623-E625 PolarHBondContact N-OE2 2.88Å; F623-E625 PolarHBondContact O-N 2.91Å; F623-E625 VanDerWaalsContact O-N 3.16Å
626	H	81.8	Confident	71.3	Confident	120 Å²	120	82.1 Å²	82.1	56%	0.556	43%	0.432	S	S	*	.	B	Isolated β-bridge	trans	-110	97.3	-177.6	-60.5	-32.2	0	0	0	110.8	I620 P628	I620-H626 PolarHBondContact N-O 2.85Å; I620-H626 WeakPolarHBondContact O-CA 3.37Å; I620-H626 WeakPolarHBondContact O-CB 3.44Å; I620-H626 PolarHBondContact O-N 2.78Å; H626-P628 WeakPolarHBondContact O-CD 3.3Å
627	C	76.7	Confident	70.3	Confident	10 Å²	10	84.5 Å²	84.5	7%	0.068	45%	0.445	C	S	.	.			trans	-115.2	89.6	163.8	-177.3	0	0	0	0	110.2	R618 S619 T629 C630	R618-C627 PolarHBondContact O-SG 3Å; S619-C627 WeakPolarHBondContact OG-CB 3.4Å; C627-T629 PolarHBondContact O-N 3.29Å; C627-T629 VanDerWaalsContact O-N 3.16Å; C627-C630 HydrophobicContact CB-CB 3.51Å; C627-C630 WeakPolarHBondContact CB-SG 3.45Å; C627-C630 PolarHBondContact O-N 2.86Å; C627-C630 WeakPolarHBondContact SG-CB 3.45Å; C627-C630 PolarHBondContact SG-N 3.26Å; C627-C630 CovalentContact SG-SG 2.03Å; C627-C630 PolarHBondContact SG-SG 3.42Å
628	P	67.8	Low	69.4	Low	105 Å²	105	86.6 Å²	86.6	68%	0.682	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-34	-177.4	-26	34.9	0	0	0	113.3	H626	H626-P628 WeakPolarHBondContact O-CD 3.3Å
629	T	66.6	Low	68.3	Low	91 Å²	91	85.3 Å²	85.3	56%	0.558	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.5	-4.3	179.7	55	0	0	0	0	114.5	C627	C627-T629 PolarHBondContact O-N 3.29Å; C627-T629 VanDerWaalsContact O-N 3.16Å
630	C	64.6	Low	67.3	Low	33 Å²	33	86.4 Å²	86.4	22%	0.223	45%	0.448	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-23.4	177.6	-63.1	0	0	0	0	112.6	R604 C627 T632	R604-C630 PolarHBondContact NH1-SG 2.99Å; C627-C630 HydrophobicContact CB-CB 3.51Å; C627-C630 WeakPolarHBondContact CB-SG 3.45Å; C627-C630 PolarHBondContact O-N 2.86Å; C627-C630 WeakPolarHBondContact SG-CB 3.45Å; C627-C630 PolarHBondContact SG-N 3.26Å; C627-C630 CovalentContact SG-SG 2.03Å; C627-C630 PolarHBondContact SG-SG 3.42Å; C630-T632 PolarHBondContact O-N 3.22Å
631	H	54.8	Low	66.3	Low	136 Å²	136	85.8 Å²	85.8	63%	0.63	45%	0.45	S	S	*	.			trans	-84.1	89.7	174	-92.5	-44.3	0	0	0	111	A633	H631-A633 PolarHBondContact O-N 2.04Å
632	T	53	Low	65.1	Low	80 Å²	80	90.7 Å²	90.7	49%	0.491	46%	0.463	S	S	.	.			trans	-76.6	62.1	152.2	56	0	0	0	0	109.5	C630 C634 K635 E636	C630-T632 PolarHBondContact O-N 3.22Å; T632-C634 PolarHBondContact O-N 2.77Å; T632-K635 WeakPolarHBondContact O-CA 3.3Å; T632-K635 WeakPolarHBondContact O-CB 3.38Å; T632-K635 PolarHBondContact O-N 2.91Å; T632-E636 PolarHBondContact O-N 3.06Å
633	A	50.8	Low	64	Low	42 Å²	42	84.4 Å²	84.4	35%	0.347	44%	0.443	S	S	.	.	H	α-helix	trans	-56.8	-35.2	-179.1	0	0	0	0	0	111.6	H631 K635 E636 N637	H631-A633 PolarHBondContact O-N 2.04Å; A633-K635 PolarHBondContact O-N 3.42Å; A633-E636 PolarHBondContact O-N 2.96Å; A633-N637 VanDerWaalsContact O-CB 3.27Å; A633-N637 WeakPolarHBondContact O-CB 3.47Å; A633-N637 PolarHBondContact O-N 2.81Å
634	C	54.2	Low	62.4	Low	86 Å²	86	87.8 Å²	87.8	58%	0.581	46%	0.463	S	S	*	.	H	α-helix	trans	-61	-21	171.5	-65.5	0	0	0	0	114.7	T632 W638	T632-C634 PolarHBondContact O-N 2.77Å; C634-W638 WeakPolarHBondContact O-CB 3.47Å; C634-W638 PolarHBondContact O-N 2.89Å
635	K	53.9	Low	61	Low	164 Å²	164	95.7 Å²	95.7	71%	0.713	50%	0.5	S	S	*	.	H	α-helix	trans	-93.6	-29.8	-178.5	-158.8	-179	-172.7	-174.7	0	112.5	T632 A633	T632-K635 WeakPolarHBondContact O-CA 3.3Å; T632-K635 WeakPolarHBondContact O-CB 3.38Å; T632-K635 PolarHBondContact O-N 2.91Å; A633-K635 PolarHBondContact O-N 3.42Å
636	E	54.2	Low	59.4	Low	125 Å²	125	95 Å²	95	58%	0.584	50%	0.502	S	S	*	.	H	α-helix	trans	-79.5	-42.1	172.4	-65.7	172.9	142.9	0	0	110.3	T632 A633	T632-E636 PolarHBondContact O-N 3.06Å; A633-E636 PolarHBondContact O-N 2.96Å
637	N	54.6	Low	58	Low	85 Å²	85	97.9 Å²	97.9	46%	0.455	52%	0.515	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-6.1	-177.5	-63.1	-1.7	0	0	0	114.6	A633 N639 C640 V641	A633-N637 VanDerWaalsContact O-CB 3.27Å; A633-N637 WeakPolarHBondContact O-CB 3.47Å; A633-N637 PolarHBondContact O-N 2.81Å; N637-N639 PolarHBondContact O-N 2.92Å; N637-N639 VanDerWaalsContact O-N 3.13Å; N637-C640 PolarHBondContact O-N 2.9Å; N637-V641 PolarHBondContact O-N 2.85Å
638	W	57.1	Low	56.9	Low	168 Å²	168	105 Å²	105	64%	0.636	55%	0.552	S	S	*	*	H	α-helix	trans	-52	-38.6	178.6	-162.6	-98.5	0	0	0	112.1	C634 C640 V641 Q642	C634-W638 WeakPolarHBondContact O-CB 3.47Å; C634-W638 PolarHBondContact O-N 2.89Å; W638-C640 PolarHBondContact O-N 3.27Å; W638-V641 PolarHBondContact O-N 3.07Å; W638-Q642 PolarHBondContact O-N 2.86Å
639	N	54.4	Low	56.4	Low	112 Å²	112	104.5 Å²	104.5	60%	0.599	54%	0.543	S	S	*	.	H	α-helix	trans	-66.2	-34.7	-177.6	-57.8	-20.7	0	0	0	112.3	N637 Q642 C643	N637-N639 PolarHBondContact O-N 2.92Å; N637-N639 VanDerWaalsContact O-N 3.13Å; N639-Q642 PolarHBondContact O-N 3Å; N639-C643 WeakPolarHBondContact O-CB 3.03Å; N639-C643 PolarHBondContact O-N 2.92Å; N639-C643 VanDerWaalsContact O-N 3.08Å
640	C	62.2	Low	56.3	Low	30 Å²	30	103.5 Å²	103.5	20%	0.203	54%	0.54	C	S	.	.	H	α-helix	trans	-68.7	-38.2	175.2	-74.7	0	0	0	0	111.8	N637 W638 Q642 C643 L644 C661	N637-C640 PolarHBondContact O-N 2.9Å; W638-C640 PolarHBondContact O-N 3.27Å; C640-Q642 VanDerWaalsContact C-N 3.32Å; C640-Q642 PolarHBondContact O-N 2.91Å; C640-C643 WeakPolarHBondContact O-CB 3.34Å; C640-C643 PolarHBondContact O-N 2.79Å; C640-L644 PolarHBondContact O-N 3.33Å; C640-C661 HydrophobicContact CB-CB 3.99Å; C640-C661 WeakPolarHBondContact CB-SG 3.28Å; C640-C661 WeakPolarHBondContact SG-CB 3.42Å; C640-C661 CovalentContact SG-SG 2.05Å; C640-C661 PolarHBondContact SG-SG 3.09Å
641	V	59.5	Low	56.1	Low	100 Å²	100	107.7 Å²	107.7	61%	0.606	56%	0.556	S	S	*	*	H	α-helix	trans	-61.5	-43.1	176.2	-176.7	0	0	0	0	110.6	N637 W638 C643 L644	N637-V641 PolarHBondContact O-N 2.85Å; W638-V641 PolarHBondContact O-N 3.07Å; V641-C643 VanDerWaalsContact C-N 3.29Å; V641-C643 PolarHBondContact O-N 2.62Å; V641-L644 PolarHBondContact O-N 3.27Å
642	Q	56	Low	56.3	Low	137 Å²	137	104.8 Å²	104.8	64%	0.64	56%	0.556	S	S	*	*	H	α-helix	trans	-70.9	-24.5	178.5	-160.1	164.6	1.7	0	0	112.9	W638 N639 C640	W638-Q642 PolarHBondContact O-N 2.86Å; N639-Q642 PolarHBondContact O-N 3Å; C640-Q642 VanDerWaalsContact C-N 3.32Å; C640-Q642 PolarHBondContact O-N 2.91Å
643	C	62	Low	56.7	Low	29 Å²	29	104.5 Å²	104.5	20%	0.196	55%	0.551	C	S	.	*	H	α-helix	trans	-78.4	-29.6	175.1	-159	0	0	0	0	113.7	N639 C640 V641 H645 P646 C657	N639-C643 WeakPolarHBondContact O-CB 3.03Å; N639-C643 PolarHBondContact O-N 2.92Å; N639-C643 VanDerWaalsContact O-N 3.08Å; C640-C643 WeakPolarHBondContact O-CB 3.34Å; C640-C643 PolarHBondContact O-N 2.79Å; V641-C643 VanDerWaalsContact C-N 3.29Å; V641-C643 PolarHBondContact O-N 2.62Å; C643-H645 VanDerWaalsContact C-N 3.31Å; C643-H645 PolarHBondContact O-N 2.94Å; C643-P646 WeakPolarHBondContact O-CD 3.44Å; C643-C657 HydrophobicContact CB-CB 4.4Å; C643-C657 WeakPolarHBondContact CB-SG 3.48Å; C643-C657 WeakPolarHBondContact SG-CB 3.49Å; C643-C657 CovalentContact SG-SG 2.03Å; C643-C657 PolarHBondContact SG-SG 2.97Å
644	L	55.6	Low	57.2	Low	118 Å²	118	105.7 Å²	105.7	62%	0.618	55%	0.551	S	S	*	*	S	Bend	trans	-79.6	-7.8	178.6	-78.1	164.3	0	0	0	114	C640 V641	C640-L644 PolarHBondContact O-N 3.33Å; V641-L644 PolarHBondContact O-N 3.27Å
645	H	57.7	Low	57.7	Low	167 Å²	167	104.5 Å²	104.5	77%	0.773	54%	0.539	S	S	*	.	S	Bend	trans	-138.2	35.9	-175.4	-120.5	-88.8	0	0	0	118.7	C643	C643-H645 VanDerWaalsContact C-N 3.31Å; C643-H645 PolarHBondContact O-N 2.94Å
646	P	50.3	Low	58.2	Low	58 Å²	58	103.1 Å²	103.1	38%	0.377	54%	0.535	S	S	.	.			trans	-91.8	130.9	164.4	35.3	-29.7	0	0	0	112.1	C643 L649	C643-P646 WeakPolarHBondContact O-CD 3.44Å; P646-L649 HydrophobicContact CG-CB 4.48Å; P646-L649 HydrophobicContact CG-CD2 4.25Å
647	H	52.6	Low	58.7	Low	180 Å²	180	98.5 Å²	98.5	83%	0.833	52%	0.516	S	S	*	.	S	Bend	trans	-68.8	141.2	163.4	-79.9	-96.6	0	0	0	110.2
648	N	53.9	Low	59.1	Low	159 Å²	159	100.1 Å²	100.1	85%	0.85	52%	0.519	S	S	*	.	S	Bend	trans	60.9	66.9	177.5	-63.7	-7	0	0	0	115.9
649	L	56.4	Low	59.5	Low	95 Å²	95	97.5 Å²	97.5	50%	0.497	52%	0.521	S	S	.	.			trans	-118.2	155.9	161.1	-128.6	69.2	0	0	0	110.8	P646 I653	P646-L649 HydrophobicContact CG-CB 4.48Å; P646-L649 HydrophobicContact CG-CD2 4.25Å; L649-I653 HydrophobicContact CD2-CB 4.09Å; L649-I653 HydrophobicContact CD2-CD1 4.48Å; L649-I653 HydrophobicContact CD2-CG2 3.6Å; L649-I653 HydrophobicContact CG-CB 4.49Å; L649-I653 HydrophobicContact CG-CD1 4.27Å; L649-I653 HydrophobicContact CG-CG2 4.43Å
650	S	63.9	Low	59.8	Low	70 Å²	70	96.6 Å²	96.6	49%	0.49	52%	0.524	S	S	.	.			trans	-84.3	150	-177.7	62.6	0	0	0	0	112.7	A652 I653 L654	S650-A652 VanDerWaalsContact C-N 3.29Å; S650-A652 PolarHBondContact O-N 2.97Å; S650-A652 VanDerWaalsContact O-N 3.16Å; S650-I653 PolarHBondContact O-N 3.15Å; S650-L654 PolarHBondContact O-N 3.49Å
651	Q	61	Low	59.8	Low	120 Å²	120	96.6 Å²	96.6	56%	0.561	52%	0.524	S	S	*	.	H	α-helix	trans	-53	-41.2	-171.6	-168.8	61.8	40.9	0	0	113.8	I653 L654 D655	Q651-I653 VanDerWaalsContact C-N 3.29Å; Q651-I653 PolarHBondContact O-N 2.65Å; Q651-L654 WeakPolarHBondContact O-CB 3.35Å; Q651-L654 PolarHBondContact O-N 3Å; Q651-L654 VanDerWaalsContact O-N 3.13Å; Q651-D655 PolarHBondContact NE2-OD2 3.49Å; Q651-D655 PolarHBondContact O-N 3.02Å
652	A	59	Low	59.5	Low	75 Å²	75	94.7 Å²	94.7	62%	0.62	52%	0.519	S	S	*	.	H	α-helix	trans	-61.3	-34.2	179.7	0	0	0	0	0	113.4	S650 Q656	S650-A652 VanDerWaalsContact C-N 3.29Å; S650-A652 PolarHBondContact O-N 2.97Å; S650-A652 VanDerWaalsContact O-N 3.16Å; A652-Q656 WeakPolarHBondContact O-CB 3.39Å; A652-Q656 PolarHBondContact O-N 3.3Å
653	I	61.3	Low	59.4	Low	75 Å²	75	95.9 Å²	95.9	39%	0.385	53%	0.529	S	S	.	.	H	α-helix	trans	-75.2	-36.1	177.7	-53.6	173.5	0	0	0	109.9	L649 S650 Q651 Q656 C657	L649-I653 HydrophobicContact CD2-CB 4.09Å; L649-I653 HydrophobicContact CD2-CD1 4.48Å; L649-I653 HydrophobicContact CD2-CG2 3.6Å; L649-I653 HydrophobicContact CG-CB 4.49Å; L649-I653 HydrophobicContact CG-CD1 4.27Å; L649-I653 HydrophobicContact CG-CG2 4.43Å; S650-I653 PolarHBondContact O-N 3.15Å; Q651-I653 VanDerWaalsContact C-N 3.29Å; Q651-I653 PolarHBondContact O-N 2.65Å; I653-Q656 PolarHBondContact O-N 3.43Å; I653-C657 WeakPolarHBondContact O-CB 3.42Å; I653-C657 PolarHBondContact O-N 3.43Å
654	L	62.4	Low	58.7	Low	67 Å²	67	101.2 Å²	101.2	35%	0.351	55%	0.552	S	S	.	*	H	α-helix	trans	-61.7	-46.1	175.4	-162.9	78	0	0	0	111.4	S650 Q651 C657 K658	S650-L654 PolarHBondContact O-N 3.49Å; Q651-L654 WeakPolarHBondContact O-CB 3.35Å; Q651-L654 PolarHBondContact O-N 3Å; Q651-L654 VanDerWaalsContact O-N 3.13Å; L654-C657 PolarHBondContact O-N 3.28Å; L654-K658 PolarHBondContact O-N 2.86Å
655	D	64.4	Low	57.9	Low	61 Å²	61	104.2 Å²	104.2	33%	0.326	56%	0.563	S	S	.	*	H	α-helix	trans	-75.5	-31.1	-179.2	-64.2	-41.9	0	0	0	112.5	Q651 C657 K658 T659	Q651-D655 PolarHBondContact NE2-OD2 3.49Å; Q651-D655 PolarHBondContact O-N 3.02Å; D655-C657 VanDerWaalsContact C-N 3.34Å; D655-K658 IonicContact OD1-NZ 1.78Å; D655-K658 PolarHBondContact OD1-NZ 2.93Å; D655-T659 PolarHBondContact O-N 2.85Å; D655-T659 VanDerWaalsContact O-N 3.1Å; D655-T659 PolarHBondContact O-OG1 2.94Å
656	Q	64.5	Low	56.8	Low	135 Å²	135	105.4 Å²	105.4	63%	0.631	57%	0.569	S	S	*	*	H	α-helix	trans	-61.7	-42.8	166.9	-173.7	173.3	2.8	0	0	111.1	A652 I653 T659 S660	A652-Q656 WeakPolarHBondContact O-CB 3.39Å; A652-Q656 PolarHBondContact O-N 3.3Å; I653-Q656 PolarHBondContact O-N 3.43Å; Q656-T659 WeakPolarHBondContact O-CB 3.16Å; Q656-T659 PolarHBondContact O-N 3.4Å; Q656-S660 PolarHBondContact O-N 2.83Å; Q656-S660 PolarHBondContact O-OG 2.81Å
657	C	63.8	Low	56	Low	27 Å²	27	110.8 Å²	110.8	18%	0.182	59%	0.589	C	S	.	*	H	α-helix	trans	-70.6	-37.3	-179.7	-149.5	0	0	0	0	113.1	C643 I653 L654 D655 T659 S660 C661	C643-C657 HydrophobicContact CB-CB 4.4Å; C643-C657 WeakPolarHBondContact CB-SG 3.48Å; C643-C657 WeakPolarHBondContact SG-CB 3.49Å; C643-C657 CovalentContact SG-SG 2.03Å; C643-C657 PolarHBondContact SG-SG 2.97Å; I653-C657 WeakPolarHBondContact O-CB 3.42Å; I653-C657 PolarHBondContact O-N 3.43Å; L654-C657 PolarHBondContact O-N 3.28Å; D655-C657 VanDerWaalsContact C-N 3.34Å; C657-T659 VanDerWaalsContact C-N 3.3Å; C657-T659 PolarHBondContact O-N 2.87Å; C657-S660 PolarHBondContact O-N 3.46Å; C657-C661 WeakPolarHBondContact O-CB 3.35Å; C657-C661 PolarHBondContact O-N 2.81Å
658	K	63.9	Low	55.1	Low	120 Å²	120	111 Å²	111	52%	0.522	59%	0.59	S	S	.	*	H	α-helix	trans	-54.2	-47.9	167.3	-76.7	177.4	-173.5	158.1	0	111.2	L654 D655 S660 C661 A662	L654-K658 PolarHBondContact O-N 2.86Å; D655-K658 IonicContact OD1-NZ 1.78Å; D655-K658 PolarHBondContact OD1-NZ 2.93Å; K658-S660 VanDerWaalsContact C-N 3.29Å; K658-S660 PolarHBondContact O-N 2.9Å; K658-C661 PolarHBondContact O-N 2.86Å; K658-A662 WeakPolarHBondContact O-CA 3.45Å; K658-A662 WeakPolarHBondContact O-CB 3.38Å; K658-A662 PolarHBondContact O-N 2.98Å
659	T	65	Low	54.1	Low	112 Å²	112	113.8 Å²	113.8	69%	0.687	59%	0.59	S	S	*	*	H	α-helix	trans	-63.1	-35.3	-179.3	-49.1	0	0	0	0	112	D655 Q656 C657	D655-T659 PolarHBondContact O-N 2.85Å; D655-T659 VanDerWaalsContact O-N 3.1Å; D655-T659 PolarHBondContact O-OG1 2.94Å; Q656-T659 WeakPolarHBondContact O-CB 3.16Å; Q656-T659 PolarHBondContact O-N 3.4Å; C657-T659 VanDerWaalsContact C-N 3.3Å; C657-T659 PolarHBondContact O-N 2.87Å
660	S	60.3	Low	52.7	Low	93 Å²	93	115.2 Å²	115.2	65%	0.65	60%	0.603	S	S	*	*	H	α-helix	trans	-78.7	-32.9	176.9	-60.2	0	0	0	0	114.7	Q656 C657 K658	Q656-S660 PolarHBondContact O-N 2.83Å; Q656-S660 PolarHBondContact O-OG 2.81Å; C657-S660 PolarHBondContact O-N 3.46Å; K658-S660 VanDerWaalsContact C-N 3.29Å; K658-S660 PolarHBondContact O-N 2.9Å
661	C	61.3	Low	51	Low	30 Å²	30	119.6 Å²	119.6	20%	0.203	62%	0.621	C	S	.	*	H	α-helix	trans	-97.8	10.7	-178.8	-59.8	0	0	0	0	113.5	C640 C657 K658 L663	C640-C661 HydrophobicContact CB-CB 3.99Å; C640-C661 WeakPolarHBondContact CB-SG 3.28Å; C640-C661 WeakPolarHBondContact SG-CB 3.42Å; C640-C661 CovalentContact SG-SG 2.05Å; C640-C661 PolarHBondContact SG-SG 3.09Å; C657-C661 WeakPolarHBondContact O-CB 3.35Å; C657-C661 PolarHBondContact O-N 2.81Å; K658-C661 PolarHBondContact O-N 2.86Å; C661-L663 PolarHBondContact O-N 2.97Å
662	A	54.5	Low	49.7	Very low	61 Å²	61	121.6 Å²	121.6	50%	0.504	63%	0.63	S	S	.	*	G	3₁₀ helix	trans	-59	-15.5	-171.3	0	0	0	0	0	116.2	K658 M664 E665	K658-A662 WeakPolarHBondContact O-CA 3.45Å; K658-A662 WeakPolarHBondContact O-CB 3.38Å; K658-A662 PolarHBondContact O-N 2.98Å; A662-M664 PolarHBondContact O-N 2.99Å; A662-M664 VanDerWaalsContact O-N 3.08Å; A662-E665 PolarHBondContact O-N 2.99Å
663	L	53.1	Low	48.6	Very low	162 Å²	162	123.6 Å²	123.6	85%	0.848	64%	0.635	S	S	*	*	G	3₁₀ helix	trans	-65.2	-8	-178.8	-89.3	164.2	0	0	0	115	C661	C661-L663 PolarHBondContact O-N 2.97Å
664	M	47.8	Very low	47.2	Very low	141 Å²	141	125.6 Å²	125.6	70%	0.695	66%	0.656	S	S	*	*	G	3₁₀ helix	trans	-82.5	-17.5	178.4	-71.3	-164.2	66.2	0	0	115.1	A662	A662-M664 PolarHBondContact O-N 2.99Å; A662-M664 VanDerWaalsContact O-N 3.08Å
665	E	38.5	Very low	45.7	Very low	181 Å²	181	128.3 Å²	128.3	85%	0.846	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.2	-12.2	-166.5	-156.6	163.4	-135.8	0	0	114.5	A662	A662-E665 PolarHBondContact O-N 2.99Å
666	Q	35.4	Very low	44.1	Very low	192 Å²	192	130.8 Å²	130.8	90%	0.897	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96	7.9	-174.1	-81.1	-165.3	-29.9	0	0	116.2
667	Q	33.2	Very low	42.5	Very low	170 Å²	170	131.2 Å²	131.2	79%	0.794	69%	0.687	S	S	*	*			trans	-122.4	35.2	-168.4	-142.3	160.6	-15.4	0	0	115.1
668	H	33.5	Very low	41.5	Very low	185 Å²	185	135 Å²	135	86%	0.856	71%	0.714	S	S	*	*			trans	-113.5	52.5	176	-96.2	-55.1	0	0	0	114.3
669	Y	32.1	Very low	40.3	Very low	218 Å²	218	133.8 Å²	133.8	86%	0.855	72%	0.721	S	S	*	*	S	Bend	trans	-150.2	151.5	148.9	-151.1	-110.7	0	0	0	111.1
670	V	28.3	Very low	39.5	Very low	125 Å²	125	133.5 Å²	133.5	76%	0.758	72%	0.721	S	S	*	*	S	Bend	trans	75.8	101.4	-176.1	-168.1	0	0	0	0	116.3
671	D	27.1	Very low	39.4	Very low	162 Å²	162	132.2 Å²	132.2	87%	0.866	71%	0.712	S	S	*	*			trans	77.8	161.3	152.6	-137.7	-3.6	0	0	0	120.7
672	Q	34.9	Very low	39.1	Very low	161 Å²	161	137.6 Å²	137.6	75%	0.752	73%	0.729	S	S	*	*			trans	-116	155.1	-146.9	-141.2	175.9	-18.6	0	0	113.4
673	T	36.1	Very low	39.4	Very low	118 Å²	118	140.1 Å²	140.1	72%	0.724	73%	0.733	S	S	*	*			trans	62	80.3	166.1	57	0	0	0	0	118.4
674	S	30.8	Very low	40	Very low	117 Å²	117	141.4 Å²	141.4	82%	0.818	73%	0.727	S	S	*	*			trans	-129.2	69.5	139.6	56.7	0	0	0	0	110.2	C676	S674-C676 PolarHBondContact O-N 2.91Å
675	E	30.8	Very low	41.1	Very low	123 Å²	123	138.3 Å²	138.3	58%	0.575	71%	0.713	S	S	*	*			trans	-61.8	124.9	178.5	-67.1	-167.4	145.1	0	0	111.2	F677	E675-F677 VanDerWaalsContact C-N 3.28Å; E675-F677 HydrophobicContact CB-CD2 4.09Å; E675-F677 HydrophobicContact CB-CE2 3.74Å; E675-F677 HydrophobicContact CB-CZ 4Å; E675-F677 VanDerWaalsContact O-CD2 3.25Å; E675-F677 WeakPolarHBondContact O-CD2 3.18Å; E675-F677 PolarHBondContact O-N 2.83Å; E675-F677 WeakPolarHBondContact OE2-CE1 3.23Å; E675-F677 WeakPolarHBondContact OE2-CZ 3.44Å
676	C	30.2	Very low	42.8	Very low	114 Å²	114	135.7 Å²	135.7	77%	0.77	70%	0.699	S	S	*	*			trans	-70.8	81.7	171.9	-73.5	0	0	0	0	110.5	S674 S678	S674-C676 PolarHBondContact O-N 2.91Å; C676-S678 VanDerWaalsContact C-N 3.34Å; C676-S678 PolarHBondContact O-N 2.79Å
677	F	31.2	Very low	44.7	Very low	143 Å²	143	132 Å²	132	63%	0.627	68%	0.68	S	S	*	*			trans	-64.5	82.9	-177.9	-78.4	-74.3	0	0	0	113.9	E675 Y682	E675-F677 VanDerWaalsContact C-N 3.28Å; E675-F677 HydrophobicContact CB-CD2 4.09Å; E675-F677 HydrophobicContact CB-CE2 3.74Å; E675-F677 HydrophobicContact CB-CZ 4Å; E675-F677 VanDerWaalsContact O-CD2 3.25Å; E675-F677 WeakPolarHBondContact O-CD2 3.18Å; E675-F677 PolarHBondContact O-N 2.83Å; E675-F677 WeakPolarHBondContact OE2-CE1 3.23Å; E675-F677 WeakPolarHBondContact OE2-CZ 3.44Å; F677-Y682 HydrophobicContact CD1-CD2 4.21Å; F677-Y682 HydrophobicContact CD1-CE2 4.08Å; F677-Y682 HydrophobicContact CE1-CD2 4.06Å; F677-Y682 AromaticContact CE1-CE2 3.62Å; F677-Y682 HydrophobicContact CE1-CE2 3.62Å
678	S	42.8	Very low	47	Very low	107 Å²	107	129 Å²	129	75%	0.748	67%	0.668	S	S	*	*			trans	-118.4	75.3	169.2	-73.1	0	0	0	0	110.9	C676	C676-S678 VanDerWaalsContact C-N 3.34Å; C676-S678 PolarHBondContact O-N 2.79Å
679	S	39.8	Very low	49.3	Very low	95 Å²	95	124.9 Å²	124.9	66%	0.664	65%	0.651	S	S	*	*			trans	-164.6	144.1	162.2	-92.9	0	0	0	0	114.6	S681	S679-S681 PolarHBondContact O-N 2.75Å
680	P	48.2	Very low	51.8	Low	106 Å²	106	120 Å²	120	69%	0.688	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.6	4.4	-178.2	-18.1	32.7	0	0	0	116.4
681	S	57.9	Low	54.6	Low	66 Å²	66	118.4 Å²	118.4	46%	0.462	62%	0.621	S	S	.	*	H	α-helix	trans	-70	-43	-167	-160.9	0	0	0	0	113.3	S679 L683 R684 I685	S679-S681 PolarHBondContact O-N 2.75Å; S681-L683 VanDerWaalsContact C-N 3.32Å; S681-L683 PolarHBondContact O-N 2.79Å; S681-R684 WeakPolarHBondContact O-CB 3.3Å; S681-R684 PolarHBondContact O-N 2.69Å; S681-I685 PolarHBondContact O-N 2.9Å
682	Y	54.3	Low	57.6	Low	142 Å²	142	114.2 Å²	114.2	56%	0.557	60%	0.601	S	S	*	*	H	α-helix	trans	-64.8	-31.3	-175.8	-74.9	-74.2	0	0	0	113.9	F677 I685 F686	F677-Y682 HydrophobicContact CD1-CD2 4.21Å; F677-Y682 HydrophobicContact CD1-CE2 4.08Å; F677-Y682 HydrophobicContact CE1-CD2 4.06Å; F677-Y682 AromaticContact CE1-CE2 3.62Å; F677-Y682 HydrophobicContact CE1-CE2 3.62Å; Y682-I685 HydrophobicContact CD1-CD1 4.4Å; Y682-I685 PolarHBondContact O-N 2.77Å; Y682-F686 VanDerWaalsContact O-CB 3.3Å; Y682-F686 WeakPolarHBondContact O-CB 3.16Å; Y682-F686 PolarHBondContact O-N 3.1Å
683	L	60.5	Low	60	Low	114 Å²	114	110.4 Å²	110.4	60%	0.597	59%	0.589	S	S	*	*	H	α-helix	trans	-63.8	-40.8	171.1	-83.2	169	0	0	0	111.7	S681 F686 F687	S681-L683 VanDerWaalsContact C-N 3.32Å; S681-L683 PolarHBondContact O-N 2.79Å; L683-F686 PolarHBondContact O-N 3.27Å; L683-F687 HydrophobicContact CD2-CE2 4.29Å; L683-F687 WeakPolarHBondContact O-CB 3.09Å; L683-F687 WeakPolarHBondContact O-CD2 3.3Å; L683-F687 PolarHBondContact O-N 3.33Å
684	R	65.8	Low	62.5	Low	189 Å²	189	110.5 Å²	110.5	71%	0.713	58%	0.58	S	S	*	*	H	α-helix	trans	-64.5	-44.1	174.9	-69.7	-171.8	172.4	-156.3	-1.6	111.6	S681 F687 I688	S681-R684 WeakPolarHBondContact O-CB 3.3Å; S681-R684 PolarHBondContact O-N 2.69Å; R684-F687 PolarHBondContact O-N 3.35Å; R684-I688 WeakPolarHBondContact O-CB 3.39Å; R684-I688 WeakPolarHBondContact O-CD1 3.42Å; R684-I688 VanDerWaalsContact O-CG1 3.22Å; R684-I688 WeakPolarHBondContact O-CG1 3.38Å; R684-I688 PolarHBondContact O-N 3Å
685	I	72	Confident	65.2	Low	77 Å²	77	109.8 Å²	109.8	40%	0.395	57%	0.566	S	S	.	*	H	α-helix	trans	-62.4	-45.1	177.8	-64.3	166.7	0	0	0	110.6	S681 Y682 I688 I689	S681-I685 PolarHBondContact O-N 2.9Å; Y682-I685 HydrophobicContact CD1-CD1 4.4Å; Y682-I685 PolarHBondContact O-N 2.77Å; I685-I688 PolarHBondContact O-N 3.01Å; I685-I689 HydrophobicContact CG2-CD1 3.84Å; I685-I689 WeakPolarHBondContact O-CG1 3.28Å; I685-I689 PolarHBondContact O-N 3.15Å
686	F	74.8	Confident	68	Low	126 Å²	126	108.4 Å²	108.4	55%	0.553	56%	0.562	S	S	*	*	H	α-helix	trans	-59.9	-48.1	175.3	-179.9	-95.7	0	0	0	111.9	Y682 L683 I688 I689 F690	Y682-F686 VanDerWaalsContact O-CB 3.3Å; Y682-F686 WeakPolarHBondContact O-CB 3.16Å; Y682-F686 PolarHBondContact O-N 3.1Å; L683-F686 PolarHBondContact O-N 3.27Å; F686-I688 VanDerWaalsContact C-N 3.34Å; F686-I688 PolarHBondContact O-N 3.48Å; F686-I689 PolarHBondContact O-N 3.08Å; F686-F690 VanDerWaalsContact O-CB 3.26Å; F686-F690 WeakPolarHBondContact O-CB 3.33Å; F686-F690 PolarHBondContact O-N 2.87Å
687	F	75.4	Confident	70.7	Confident	114 Å²	114	104.6 Å²	104.6	50%	0.5	54%	0.542	S	S	.	.	H	α-helix	trans	-63.6	-36.2	176.7	-79.9	-59.8	0	0	0	112.8	L683 R684 I691	L683-F687 HydrophobicContact CD2-CE2 4.29Å; L683-F687 WeakPolarHBondContact O-CB 3.09Å; L683-F687 WeakPolarHBondContact O-CD2 3.3Å; L683-F687 PolarHBondContact O-N 3.33Å; R684-F687 PolarHBondContact O-N 3.35Å; F687-I691 VanDerWaalsContact O-CB 3.3Å; F687-I691 WeakPolarHBondContact O-CB 3.47Å; F687-I691 WeakPolarHBondContact O-CD1 3.42Å; F687-I691 WeakPolarHBondContact O-CG1 3.31Å; F687-I691 PolarHBondContact O-N 2.91Å
688	I	79.6	Confident	73.4	Confident	106 Å²	106	101.5 Å²	101.5	54%	0.544	53%	0.531	S	S	.	.	H	α-helix	trans	-63.5	-48.9	174.3	-71.2	162.4	0	0	0	110.7	R684 I685 F686 F690 I691 V692	R684-I688 WeakPolarHBondContact O-CB 3.39Å; R684-I688 WeakPolarHBondContact O-CD1 3.42Å; R684-I688 VanDerWaalsContact O-CG1 3.22Å; R684-I688 WeakPolarHBondContact O-CG1 3.38Å; R684-I688 PolarHBondContact O-N 3Å; I685-I688 PolarHBondContact O-N 3.01Å; F686-I688 VanDerWaalsContact C-N 3.34Å; F686-I688 PolarHBondContact O-N 3.48Å; I688-F690 PolarHBondContact O-N 2.93Å; I688-I691 PolarHBondContact O-N 2.93Å; I688-V692 WeakPolarHBondContact O-CB 3.48Å; I688-V692 VanDerWaalsContact O-CG2 3.3Å; I688-V692 WeakPolarHBondContact O-CG2 3.32Å; I688-V692 PolarHBondContact O-N 3.17Å
689	I	83.7	Confident	75.5	Confident	100 Å²	100	101.3 Å²	101.3	51%	0.513	52%	0.521	S	S	.	.	H	α-helix	trans	-63.6	-42.3	178.7	-66.7	168.8	0	0	0	110.9	I685 F686 V692 T693	I685-I689 HydrophobicContact CG2-CD1 3.84Å; I685-I689 WeakPolarHBondContact O-CG1 3.28Å; I685-I689 PolarHBondContact O-N 3.15Å; F686-I689 PolarHBondContact O-N 3.08Å; I689-V692 PolarHBondContact O-N 3.05Å; I689-T693 HydrophobicContact CG2-CG2 4.43Å; I689-T693 WeakPolarHBondContact O-CB 3.46Å; I689-T693 WeakPolarHBondContact O-CG2 3.09Å; I689-T693 PolarHBondContact O-N 3.26Å; I689-T693 PolarHBondContact O-OG1 3.22Å
690	F	83.6	Confident	77.7	Confident	114 Å²	114	103.3 Å²	103.3	50%	0.5	52%	0.518	S	S	.	.	H	α-helix	trans	-62	-45.6	175.9	-173.8	-96.9	0	0	0	112.2	F686 I688 T693 F694	F686-F690 VanDerWaalsContact O-CB 3.26Å; F686-F690 WeakPolarHBondContact O-CB 3.33Å; F686-F690 PolarHBondContact O-N 2.87Å; I688-F690 PolarHBondContact O-N 2.93Å; F690-T693 WeakPolarHBondContact CA-OG1 3.44Å; F690-T693 PolarHBondContact O-OG1 2.64Å; F690-T693 VanDerWaalsContact O-OG1 3.1Å; F690-F694 WeakPolarHBondContact O-CB 3.41Å; F690-F694 PolarHBondContact O-N 3.45Å
691	I	87.3	Confident	79.5	Confident	92 Å²	92	102.5 Å²	102.5	47%	0.472	51%	0.511	S	S	.	.	H	α-helix	trans	-64.3	-45.1	176.8	-71.8	164.7	0	0	0	110.9	F687 I688 F694 L695	F687-I691 VanDerWaalsContact O-CB 3.3Å; F687-I691 WeakPolarHBondContact O-CB 3.47Å; F687-I691 WeakPolarHBondContact O-CD1 3.42Å; F687-I691 WeakPolarHBondContact O-CG1 3.31Å; F687-I691 PolarHBondContact O-N 2.91Å; I688-I691 PolarHBondContact O-N 2.93Å; I691-F694 PolarHBondContact O-N 2.94Å; I691-L695 HydrophobicContact CG2-CD1 3.73Å; I691-L695 HydrophobicContact CG2-CG 4.32Å; I691-L695 WeakPolarHBondContact O-CB 3.27Å; I691-L695 VanDerWaalsContact O-CG 3.23Å; I691-L695 WeakPolarHBondContact O-CG 3.42Å; I691-L695 PolarHBondContact O-N 3.45Å
692	V	89.4	Confident	80.7	Confident	75 Å²	75	103.9 Å²	103.9	46%	0.455	51%	0.512	S	S	.	.	H	α-helix	trans	-62.8	-47.8	178.8	168.5	0	0	0	0	111.1	I688 I689 L695 I696	I688-V692 WeakPolarHBondContact O-CB 3.48Å; I688-V692 VanDerWaalsContact O-CG2 3.3Å; I688-V692 WeakPolarHBondContact O-CG2 3.32Å; I688-V692 PolarHBondContact O-N 3.17Å; I689-V692 PolarHBondContact O-N 3.05Å; V692-L695 PolarHBondContact O-N 2.88Å; V692-I696 HydrophobicContact CG1-CD1 3.84Å; V692-I696 VanDerWaalsContact O-CG1 3.29Å; V692-I696 WeakPolarHBondContact O-CG1 3.2Å; V692-I696 PolarHBondContact O-N 3.28Å
693	T	86.1	Confident	82.1	Confident	80 Å²	80	101.2 Å²	101.2	49%	0.491	51%	0.507	S	S	.	.	H	α-helix	trans	-64.9	-39.5	177.9	49.1	0	0	0	0	112.5	I689 F690 I696 G697	I689-T693 HydrophobicContact CG2-CG2 4.43Å; I689-T693 WeakPolarHBondContact O-CB 3.46Å; I689-T693 WeakPolarHBondContact O-CG2 3.09Å; I689-T693 PolarHBondContact O-N 3.26Å; I689-T693 PolarHBondContact O-OG1 3.22Å; F690-T693 WeakPolarHBondContact CA-OG1 3.44Å; F690-T693 PolarHBondContact O-OG1 2.64Å; F690-T693 VanDerWaalsContact O-OG1 3.1Å; T693-I696 PolarHBondContact O-N 2.93Å; T693-G697 PolarHBondContact O-N 3.04Å
694	F	88.7	Confident	83.2	Confident	121 Å²	121	100.5 Å²	100.5	53%	0.531	50%	0.503	S	S	.	.	H	α-helix	trans	-65.3	-41.4	175.4	-174.3	-105.6	0	0	0	112.5	F690 I691 G697 L698	F690-F694 WeakPolarHBondContact O-CB 3.41Å; F690-F694 PolarHBondContact O-N 3.45Å; I691-F694 PolarHBondContact O-N 2.94Å; F694-G697 PolarHBondContact O-N 2.77Å; F694-L698 HydrophobicContact CD1-CD1 3.88Å; F694-L698 HydrophobicContact CD1-CG 4.48Å; F694-L698 HydrophobicContact CE1-CD1 3.5Å; F694-L698 HydrophobicContact CE1-CG 4.18Å; F694-L698 HydrophobicContact CZ-CD1 4.12Å; F694-L698 HydrophobicContact CZ-CG 4.41Å; F694-L698 PolarHBondContact O-N 3.23Å
695	L	87.7	Confident	83.8	Confident	101 Å²	101	99.3 Å²	99.3	53%	0.529	50%	0.498	S	S	.	.	H	α-helix	trans	-65.9	-39.5	175.2	-73.3	171	0	0	0	112.3	I691 V692 G697 L698 L699	I691-L695 HydrophobicContact CG2-CD1 3.73Å; I691-L695 HydrophobicContact CG2-CG 4.32Å; I691-L695 WeakPolarHBondContact O-CB 3.27Å; I691-L695 VanDerWaalsContact O-CG 3.23Å; I691-L695 WeakPolarHBondContact O-CG 3.42Å; I691-L695 PolarHBondContact O-N 3.45Å; V692-L695 PolarHBondContact O-N 2.88Å; L695-G697 VanDerWaalsContact C-N 3.33Å; L695-L698 PolarHBondContact O-N 3.39Å; L695-L699 WeakPolarHBondContact O-CB 3.49Å; L695-L699 PolarHBondContact O-N 2.85Å
696	I	89.3	Confident	83.9	Confident	95 Å²	95	101.7 Å²	101.7	49%	0.487	51%	0.508	S	S	.	.	H	α-helix	trans	-63.5	-40.8	172.4	-68.4	165.7	0	0	0	110.5	V692 T693 L699 K700	V692-I696 HydrophobicContact CG1-CD1 3.84Å; V692-I696 VanDerWaalsContact O-CG1 3.29Å; V692-I696 WeakPolarHBondContact O-CG1 3.2Å; V692-I696 PolarHBondContact O-N 3.28Å; T693-I696 PolarHBondContact O-N 2.93Å; I696-L699 PolarHBondContact O-N 3.31Å; I696-K700 WeakPolarHBondContact O-CG 3.45Å; I696-K700 PolarHBondContact O-N 3.17Å
697	G	87.3	Confident	84	Confident	34 Å²	34	99.4 Å²	99.4	35%	0.351	50%	0.504	S	S	.	.	H	α-helix	trans	-59.5	-49.2	173.4	0	0	0	0	0	112.7	T693 F694 L695 L699 K700 V701	T693-G697 PolarHBondContact O-N 3.04Å; F694-G697 PolarHBondContact O-N 2.77Å; L695-G697 VanDerWaalsContact C-N 3.33Å; G697-L699 PolarHBondContact O-N 3.41Å; G697-K700 PolarHBondContact O-N 3.18Å; G697-V701 WeakPolarHBondContact O-CG2 3.05Å; G697-V701 PolarHBondContact O-N 3.08Å
698	L	87.3	Confident	83.8	Confident	77 Å²	77	98.3 Å²	98.3	40%	0.403	50%	0.502	S	S	.	.	H	α-helix	trans	-59.9	-42.7	174.8	-78.6	173.4	0	0	0	112.2	F694 L695 K700 V701 L702	F694-L698 HydrophobicContact CD1-CD1 3.88Å; F694-L698 HydrophobicContact CD1-CG 4.48Å; F694-L698 HydrophobicContact CE1-CD1 3.5Å; F694-L698 HydrophobicContact CE1-CG 4.18Å; F694-L698 HydrophobicContact CZ-CD1 4.12Å; F694-L698 HydrophobicContact CZ-CG 4.41Å; F694-L698 PolarHBondContact O-N 3.23Å; L695-L698 PolarHBondContact O-N 3.39Å; L698-K700 PolarHBondContact O-N 2.93Å; L698-V701 PolarHBondContact O-N 3.3Å; L698-L702 WeakPolarHBondContact O-CB 3.14Å; L698-L702 WeakPolarHBondContact O-CG 3.25Å; L698-L702 PolarHBondContact O-N 3.25Å
699	L	87.4	Confident	83.2	Confident	104 Å²	104	98.4 Å²	98.4	55%	0.545	50%	0.504	S	S	.	.	H	α-helix	trans	-62.1	-42.2	176.6	-176	63.5	0	0	0	111.6	L695 I696 G697 L702 I703	L695-L699 WeakPolarHBondContact O-CB 3.49Å; L695-L699 PolarHBondContact O-N 2.85Å; I696-L699 PolarHBondContact O-N 3.31Å; G697-L699 PolarHBondContact O-N 3.41Å; L699-L702 PolarHBondContact O-N 2.6Å; L699-I703 HydrophobicContact CD1-CD1 4.35Å; L699-I703 HydrophobicContact CG-CD1 4.04Å; L699-I703 VanDerWaalsContact O-CG1 3.26Å; L699-I703 WeakPolarHBondContact O-CG1 3.49Å; L699-I703 PolarHBondContact O-N 2.98Å
700	K	85.7	Confident	82.1	Confident	136 Å²	136	99.6 Å²	99.6	59%	0.591	51%	0.507	S	S	*	.	H	α-helix	trans	-61.5	-44.4	173.5	-70.1	-73.8	-176.3	177.4	0	111.7	I696 G697 L698 I703 I704	I696-K700 WeakPolarHBondContact O-CG 3.45Å; I696-K700 PolarHBondContact O-N 3.17Å; G697-K700 PolarHBondContact O-N 3.18Å; L698-K700 PolarHBondContact O-N 2.93Å; K700-I703 PolarHBondContact O-N 3.33Å; K700-I704 WeakPolarHBondContact O-CB 3.22Å; K700-I704 WeakPolarHBondContact O-CD1 3.43Å; K700-I704 VanDerWaalsContact O-CG1 3.26Å; K700-I704 WeakPolarHBondContact O-CG1 3.17Å; K700-I704 PolarHBondContact O-N 3.13Å
701	V	85.5	Confident	80.7	Confident	90 Å²	90	103 Å²	103	55%	0.545	52%	0.517	S	S	.	.	H	α-helix	trans	-64.2	-39.9	177.1	171.2	0	0	0	0	111.7	G697 L698 I704 R705	G697-V701 WeakPolarHBondContact O-CG2 3.05Å; G697-V701 PolarHBondContact O-N 3.08Å; L698-V701 PolarHBondContact O-N 3.3Å; V701-I704 PolarHBondContact O-N 3.46Å; V701-R705 VanDerWaalsContact O-CB 3.31Å; V701-R705 WeakPolarHBondContact O-CB 3.48Å; V701-R705 PolarHBondContact O-N 3.49Å
702	L	83.2	Confident	79	Confident	94 Å²	94	104.2 Å²	104.2	49%	0.492	52%	0.524	S	S	.	.	H	α-helix	trans	-65.4	-44.2	175.6	-73.1	172.2	0	0	0	111.9	L698 L699 R705 Q706	L698-L702 WeakPolarHBondContact O-CB 3.14Å; L698-L702 WeakPolarHBondContact O-CG 3.25Å; L698-L702 PolarHBondContact O-N 3.25Å; L699-L702 PolarHBondContact O-N 2.6Å; L702-R705 PolarHBondContact O-N 3.09Å; L702-Q706 VanDerWaalsContact O-CB 3.3Å; L702-Q706 WeakPolarHBondContact O-CB 3.2Å; L702-Q706 PolarHBondContact O-N 3.35Å
703	I	84.5	Confident	77.3	Confident	86 Å²	86	105 Å²	105	44%	0.441	53%	0.532	S	S	.	.	H	α-helix	trans	-59.8	-47.2	174.2	-69.4	164.4	0	0	0	110.5	L699 K700 R705 Q706 V707	L699-I703 HydrophobicContact CD1-CD1 4.35Å; L699-I703 HydrophobicContact CG-CD1 4.04Å; L699-I703 VanDerWaalsContact O-CG1 3.26Å; L699-I703 WeakPolarHBondContact O-CG1 3.49Å; L699-I703 PolarHBondContact O-N 2.98Å; K700-I703 PolarHBondContact O-N 3.33Å; I703-R705 PolarHBondContact O-N 2.82Å; I703-Q706 PolarHBondContact O-N 3.12Å; I703-V707 HydrophobicContact CG2-CG2 4.46Å; I703-V707 WeakPolarHBondContact O-CG2 3.46Å; I703-V707 PolarHBondContact O-N 3.14Å
704	I	82.4	Confident	75.7	Confident	100 Å²	100	107.9 Å²	107.9	51%	0.513	55%	0.545	S	S	.	.	H	α-helix	trans	-60.8	-44.5	177.5	-69.8	164.5	0	0	0	110.9	K700 V701 Q706 V707 I708	K700-I704 WeakPolarHBondContact O-CB 3.22Å; K700-I704 WeakPolarHBondContact O-CD1 3.43Å; K700-I704 VanDerWaalsContact O-CG1 3.26Å; K700-I704 WeakPolarHBondContact O-CG1 3.17Å; K700-I704 PolarHBondContact O-N 3.13Å; V701-I704 PolarHBondContact O-N 3.46Å; I704-Q706 VanDerWaalsContact C-N 3.32Å; I704-Q706 PolarHBondContact O-N 3.33Å; I704-V707 PolarHBondContact O-N 2.9Å; I704-I708 HydrophobicContact CG2-CD1 3.81Å; I704-I708 VanDerWaalsContact O-CG1 3.27Å; I704-I708 WeakPolarHBondContact O-CG1 3.16Å; I704-I708 PolarHBondContact O-N 2.92Å
705	R	79.1	Confident	73.6	Confident	164 Å²	164	110.3 Å²	110.3	62%	0.619	56%	0.555	S	S	*	*	H	α-helix	trans	-61.2	-40.1	175.6	-174.7	179.9	-179.4	-170.3	0.3	112	V701 L702 I703 I708 L709	V701-R705 VanDerWaalsContact O-CB 3.31Å; V701-R705 WeakPolarHBondContact O-CB 3.48Å; V701-R705 PolarHBondContact O-N 3.49Å; L702-R705 PolarHBondContact O-N 3.09Å; I703-R705 PolarHBondContact O-N 2.82Å; R705-I708 PolarHBondContact O-N 3.13Å; R705-L709 HydrophobicContact CG-CD1 4.19Å; R705-L709 WeakPolarHBondContact O-CB 3.48Å; R705-L709 VanDerWaalsContact O-CG 3.28Å; R705-L709 WeakPolarHBondContact O-CG 3.25Å; R705-L709 PolarHBondContact O-N 3.05Å
706	Q	74.2	Confident	71.9	Confident	126 Å²	126	112.6 Å²	112.6	59%	0.589	57%	0.567	S	S	*	*	H	α-helix	trans	-72	-37.5	-179.6	-162.8	164.5	10.5	0	0	111.9	L702 I703 I704 L709 Q710	L702-Q706 VanDerWaalsContact O-CB 3.3Å; L702-Q706 WeakPolarHBondContact O-CB 3.2Å; L702-Q706 PolarHBondContact O-N 3.35Å; I703-Q706 PolarHBondContact O-N 3.12Å; I704-Q706 VanDerWaalsContact C-N 3.32Å; I704-Q706 PolarHBondContact O-N 3.33Å; Q706-L709 PolarHBondContact O-N 3.15Å; Q706-Q710 WeakPolarHBondContact O-CG 3.4Å; Q706-Q710 PolarHBondContact O-N 3.14Å
707	V	77.2	Confident	69.3	Low	78 Å²	78	117.8 Å²	117.8	47%	0.473	59%	0.586	S	S	.	*	H	α-helix	trans	-62.1	-44.9	169.6	169	0	0	0	0	111.1	I703 I704 L709 Q710 W711	I703-V707 HydrophobicContact CG2-CG2 4.46Å; I703-V707 WeakPolarHBondContact O-CG2 3.46Å; I703-V707 PolarHBondContact O-N 3.14Å; I704-V707 PolarHBondContact O-N 2.9Å; V707-L709 VanDerWaalsContact C-N 3.34Å; V707-L709 PolarHBondContact O-N 3.21Å; V707-Q710 PolarHBondContact O-N 3.49Å; V707-W711 VanDerWaalsContact O-CB 3.29Å; V707-W711 WeakPolarHBondContact O-CB 3.36Å; V707-W711 PolarHBondContact O-N 3.27Å
708	I	71.6	Confident	66.7	Low	91 Å²	91	121.4 Å²	121.4	47%	0.467	61%	0.606	S	S	.	*	H	α-helix	trans	-62.6	-40	176.8	-70.1	165.4	0	0	0	111.5	I704 R705 W711 N712	I704-I708 HydrophobicContact CG2-CD1 3.81Å; I704-I708 VanDerWaalsContact O-CG1 3.27Å; I704-I708 WeakPolarHBondContact O-CG1 3.16Å; I704-I708 PolarHBondContact O-N 2.92Å; R705-I708 PolarHBondContact O-N 3.13Å; I708-W711 PolarHBondContact O-N 2.91Å; I708-N712 PolarHBondContact O-N 3.35Å
709	L	66.3	Low	64.2	Low	109 Å²	109	122.7 Å²	122.7	57%	0.571	62%	0.621	S	S	*	*	H	α-helix	trans	-67.2	-39.7	176.2	-72.8	167.4	0	0	0	112.4	R705 Q706 V707 S713	R705-L709 HydrophobicContact CG-CD1 4.19Å; R705-L709 WeakPolarHBondContact O-CB 3.48Å; R705-L709 VanDerWaalsContact O-CG 3.28Å; R705-L709 WeakPolarHBondContact O-CG 3.25Å; R705-L709 PolarHBondContact O-N 3.05Å; Q706-L709 PolarHBondContact O-N 3.15Å; V707-L709 VanDerWaalsContact C-N 3.34Å; V707-L709 PolarHBondContact O-N 3.21Å; L709-S713 PolarHBondContact O-N 3.15Å
710	Q	61.2	Low	61.6	Low	125 Å²	125	122.8 Å²	122.8	58%	0.584	63%	0.631	S	S	*	*	H	α-helix	trans	-66.5	-40	172.3	-75.5	-178.1	-34.8	0	0	112.2	Q706 V707 N712 S713 N714	Q706-Q710 WeakPolarHBondContact O-CG 3.4Å; Q706-Q710 PolarHBondContact O-N 3.14Å; V707-Q710 PolarHBondContact O-N 3.49Å; Q710-N712 PolarHBondContact O-N 2.87Å; Q710-S713 WeakPolarHBondContact O-CB 3.34Å; Q710-S713 PolarHBondContact O-N 3.36Å; Q710-S713 VanDerWaalsContact O-N 3.1Å; Q710-N714 PolarHBondContact O-N 2.93Å
711	W	52.5	Low	59.2	Low	186 Å²	186	123.2 Å²	123.2	71%	0.705	64%	0.639	S	S	*	*	H	α-helix	trans	-62.5	-40.5	179.4	-166.9	-95.3	0	0	0	112.5	V707 I708 S713 N714	V707-W711 VanDerWaalsContact O-CB 3.29Å; V707-W711 WeakPolarHBondContact O-CB 3.36Å; V707-W711 PolarHBondContact O-N 3.27Å; I708-W711 PolarHBondContact O-N 2.91Å; W711-S713 VanDerWaalsContact C-N 3.28Å; W711-S713 PolarHBondContact O-N 2.99Å; W711-N714 PolarHBondContact O-N 3.07Å
712	N	53.3	Low	56.4	Low	116 Å²	116	128 Å²	128	62%	0.62	65%	0.649	S	S	*	*	H	α-helix	trans	-70.8	-21.3	175	-76.9	-9.8	0	0	0	113.5	I708 Q710	I708-N712 PolarHBondContact O-N 3.35Å; Q710-N712 PolarHBondContact O-N 2.87Å
713	S	53.3	Low	53.9	Low	91 Å²	91	133.7 Å²	133.7	64%	0.636	66%	0.664	S	S	*	*	H	α-helix	trans	-76.6	-37.2	173.8	-160	0	0	0	0	112.3	L709 Q710 W711 K715	L709-S713 PolarHBondContact O-N 3.15Å; Q710-S713 WeakPolarHBondContact O-CB 3.34Å; Q710-S713 PolarHBondContact O-N 3.36Å; Q710-S713 VanDerWaalsContact O-N 3.1Å; W711-S713 VanDerWaalsContact C-N 3.28Å; W711-S713 PolarHBondContact O-N 2.99Å; S713-K715 VanDerWaalsContact C-N 3.34Å; S713-K715 PolarHBondContact O-N 3.23Å
714	N	51.8	Low	51.4	Low	142 Å²	142	136.2 Å²	136.2	76%	0.759	68%	0.683	S	S	*	*	S	Bend	trans	-83	0.6	-174.4	-78.1	-6.2	0	0	0	115.1	Q710 W711 I716	Q710-N714 PolarHBondContact O-N 2.93Å; W711-N714 PolarHBondContact O-N 3.07Å; N714-I716 PolarHBondContact O-N 3.37Å
715	K	45	Very low	48.9	Very low	171 Å²	171	136.7 Å²	136.7	74%	0.743	70%	0.695	S	S	*	*			trans	-93.8	33.7	-175	-149.5	176.4	180	-178.3	0	115	S713	S713-K715 VanDerWaalsContact C-N 3.34Å; S713-K715 PolarHBondContact O-N 3.23Å
716	I	51.2	Low	46.6	Very low	149 Å²	149	133.3 Å²	133.3	76%	0.764	70%	0.703	S	S	*	*			trans	-134.8	80.9	170.9	-50.4	-179.7	0	0	0	111.1	N714	N714-I716 PolarHBondContact O-N 3.37Å
717	K	36.3	Very low	44.4	Very low	204 Å²	204	133 Å²	133	89%	0.887	71%	0.714	S	S	*	*			trans	178	134.4	149.4	-102.2	157.8	-174.8	178.4	0	112.6
718	S	32.5	Very low	42.4	Very low	110 Å²	110	138 Å²	138	77%	0.769	73%	0.73	S	S	*	*			trans	51.9	132.5	168.8	-124.8	0	0	0	0	118.9
719	S	34.8	Very low	40.4	Very low	105 Å²	105	141.6 Å²	141.6	73%	0.734	74%	0.742	S	S	*	*			cis	80.8	133.1	16.9	-154.7	0	0	0	0	116.9
720	S	32.9	Very low	38.6	Very low	106 Å²	106	143.4 Å²	143.4	74%	0.741	75%	0.752	S	S	*	*			trans	62.1	141.2	179.9	65.4	0	0	0	0	116.2
721	D	34.4	Very low	37.1	Very low	145 Å²	145	144.8 Å²	144.8	78%	0.775	76%	0.756	S	S	*	*			cis	-154.8	-159.4	-11.4	-134.5	-18.6	0	0	0	108.6
722	Y	27.5	Very low	36	Very low	191 Å²	191	144 Å²	144	75%	0.749	77%	0.765	S	S	*	*			cis	-143.3	-121.3	10	-165.2	-112.2	0	0	0	112.4
723	R	29	Very low	34.9	Very low	212 Å²	212	144.1 Å²	144.1	80%	0.8	76%	0.764	S	S	*	*			trans	-159.7	167.9	-162.8	-108.8	-178.2	-173.4	178	4.2	115.3
724	V	32.9	Very low	33.7	Very low	139 Å²	139	147.8 Å²	147.8	84%	0.842	78%	0.776	S	S	*	*			trans	75.6	140.2	158.8	160	0	0	0	0	116.3
725	S	30	Very low	32.6	Very low	111 Å²	111	148.5 Å²	148.5	78%	0.776	78%	0.775	S	S	*	*			cis	-154.2	159.4	-10.4	168.8	0	0	0	0	112.9
726	A	30	Very low	31.9	Very low	93 Å²	93	145.5 Å²	145.5	77%	0.769	78%	0.775	S	S	*	*			trans	-74.7	163.7	-173.1	0	0	0	0	0	117.2
727	S	29.8	Very low	30.9	Very low	119 Å²	119	144.6 Å²	144.6	83%	0.832	78%	0.776	S	S	*	*			trans	-135	153.2	151.9	-173.6	0	0	0	0	110.5
728	K	33.9	Very low	30.6	Very low	184 Å²	184	139.9 Å²	139.9	80%	0.8	77%	0.768	S	S	*	*			trans	-119.4	155.1	173.9	-75.1	172.5	179	166.6	0	106.8
729	K	29.8	Very low	30.6	Very low	166 Å²	166	141.3 Å²	141.3	72%	0.722	77%	0.772	S	S	*	*			cis	-152.2	166.5	-0.3	-126.7	179.2	-179.1	-176.2	0	105
730	D	28.2	Very low	30.3	Very low	147 Å²	147	147.6 Å²	147.6	79%	0.786	78%	0.78	S	S	*	*				-161.7	177.8	71.6	-128	-32.1	0	0	0	115
731	K	30.7	Very low	30.1	Very low	154 Å²	154	146.4 Å²	146.4	67%	0.67	78%	0.776	S	S	*	*			trans	-73.6	127.1	-173.8	-72.3	174.9	167.2	-178.5	0	113.8	I733	K731-I733 HydrophobicContact CD-CD1 4.08Å; K731-I733 HydrophobicContact CG-CD1 4.48Å
732	L	28.1	Very low	29.8	Very low	168 Å²	168	145.3 Å²	145.3	88%	0.88	78%	0.775	S	S	*	*			trans	-116.5	112.2	133.5	-131.7	89	0	0	0	108.3
733	I	30.7	Very low	29.8	Very low	119 Å²	119	142.2 Å²	142.2	61%	0.61	78%	0.776	S	S	*	*			trans	-96	102.8	170.5	-65.2	174.6	0	0	0	106.4	K731 Q735	K731-I733 HydrophobicContact CD-CD1 4.08Å; K731-I733 HydrophobicContact CG-CD1 4.48Å; I733-Q735 VanDerWaalsContact C-N 3.33Å; I733-Q735 PolarHBondContact O-N 3.16Å
734	L	28.1	Very low	29.8	Very low	169 Å²	169	142.7 Å²	142.7	89%	0.885	78%	0.779	S	S	*	*			trans	-72.1	92.9	168.8	-172.4	71.5	0	0	0	107.9	S736	L734-S736 PolarHBondContact O-N 2.81Å
735	Q	29.3	Very low	29.6	Very low	157 Å²	157	146.2 Å²	146.2	73%	0.734	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-74.1	118.1	-177.4	-173	167	-10	0	0	110	I733 V737	I733-Q735 VanDerWaalsContact C-N 3.33Å; I733-Q735 PolarHBondContact O-N 3.16Å; Q735-V737 PolarHBondContact O-N 2.96Å
736	S	29.1	Very low	29.5	Very low	107 Å²	107	152.7 Å²	152.7	75%	0.748	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-59.2	117.4	171.7	-179.1	0	0	0	0	110	L734	L734-S736 PolarHBondContact O-N 2.81Å
737	V	30.8	Very low	29.6	Very low	131 Å²	131	156 Å²	156	79%	0.794	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-100.4	116.7	170.9	178.1	0	0	0	0	107.7	Q735	Q735-V737 PolarHBondContact O-N 2.96Å
738	C	29.7	Very low	29.7	Very low	104 Å²	104	159.6 Å²	159.6	70%	0.703	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-65.2	135.5	-175.7	-57.1	0	0	0	0	112.2	R740	C738-R740 PolarHBondContact O-N 2.95Å
739	T	33.3	Very low	29.6	Very low	141 Å²	141	156.7 Å²	156.7	87%	0.865	79%	0.785	S	S	*	*			trans	-62.7	97.4	159.8	34.5	0	0	0	0	109.7	A741	T739-A741 PolarHBondContact O-N 3.41Å
740	R	29	Very low	29.7	Very low	237 Å²	237	157.4 Å²	157.4	89%	0.894	79%	0.791	S	S	*	*			trans	-71	81.6	167.9	-93.8	-173.3	165.9	-176.9	-3.6	110	C738 V742	C738-R740 PolarHBondContact O-N 2.95Å; R740-V742 PolarHBondContact O-N 3.16Å; R740-V742 VanDerWaalsContact O-N 3.13Å
741	A	27.6	Very low	29.7	Very low	81 Å²	81	158.1 Å²	158.1	67%	0.669	79%	0.789	S	S	*	*			trans	-62.7	109.2	158.9	0	0	0	0	0	108.2	T739 T743	T739-A741 PolarHBondContact O-N 3.41Å; A741-T743 PolarHBondContact O-N 3.39Å
742	V	28.2	Very low	29.7	Very low	122 Å²	122	158.3 Å²	158.3	74%	0.739	80%	0.796	S	S	*	*			trans	-76	91.5	175.9	179.6	0	0	0	0	108.3	R740 Y744	R740-V742 PolarHBondContact O-N 3.16Å; R740-V742 VanDerWaalsContact O-N 3.13Å; V742-Y744 PolarHBondContact O-N 2.79Å; V742-Y744 VanDerWaalsContact O-N 3.16Å
743	T	28.5	Very low	29.7	Very low	126 Å²	126	158.7 Å²	158.7	77%	0.773	79%	0.791	S	S	*	*			trans	-71.2	104.5	172.1	39.1	0	0	0	0	109.8	A741 R745	A741-T743 PolarHBondContact O-N 3.39Å; T743-R745 VanDerWaalsContact C-N 3.33Å; T743-R745 PolarHBondContact O-N 3.27Å
744	Y	27.7	Very low	29.8	Very low	221 Å²	221	160 Å²	160	87%	0.867	80%	0.796	S	S	*	*			trans	-64.1	96	166.6	-103.5	-83.3	0	0	0	109.5	V742 R746	V742-Y744 PolarHBondContact O-N 2.79Å; V742-Y744 VanDerWaalsContact O-N 3.16Å; Y744-R746 PolarHBondContact O-N 3.45Å
745	R	28.2	Very low	29.9	Very low	214 Å²	214	157.9 Å²	157.9	81%	0.808	79%	0.785	S	S	*	*			trans	-66.6	112	169.7	-167.9	179.2	-160.6	160.7	4.1	107.4	T743 E747	T743-R745 VanDerWaalsContact C-N 3.33Å; T743-R745 PolarHBondContact O-N 3.27Å; R745-E747 VanDerWaalsContact C-N 3.32Å; R745-E747 PolarHBondContact O-N 3.16Å
746	R	28.8	Very low	30.4	Very low	246 Å²	246	157.2 Å²	157.2	93%	0.928	79%	0.785	S	S	*	*			trans	-64.8	97.7	163.8	-86.7	-174.6	174.7	166.3	-1.4	108.1	Y744	Y744-R746 PolarHBondContact O-N 3.45Å
747	E	31	Very low	30.7	Very low	163 Å²	163	156.3 Å²	156.3	76%	0.762	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-65.9	147.8	155.7	-61	-169.8	147.1	0	0	108.2	R745	R745-E747 VanDerWaalsContact C-N 3.32Å; R745-E747 PolarHBondContact O-N 3.16Å
748	K	32.5	Very low	31.2	Very low	195 Å²	195	159.3 Å²	159.3	85%	0.848	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-67.5	135.9	172.9	-74.5	-178.2	172.7	-175.3	0	107.8
749	P	31.6	Very low	31.6	Very low	122 Å²	122	159 Å²	159	79%	0.792	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-61	139.5	160.1	29.1	-33.2	0	0	0	108.6
750	E	31.5	Very low	32	Very low	182 Å²	182	158.5 Å²	158.5	85%	0.85	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-67.5	149	172.3	-63.5	-171.3	127.8	0	0	110.6	I752	E750-I752 PolarHBondContact O-N 2.9Å
751	E	28.7	Very low	32.5	Very low	162 Å²	162	151 Å²	151	76%	0.757	75%	0.753	S	S	*	*			trans	-71.4	98.6	177.2	-70.1	-176.2	171.2	0	0	110.5	K753	E751-K753 VanDerWaalsContact C-N 3.3Å; E751-K753 PolarHBondContact O-N 2.84Å
752	I	31.1	Very low	33.1	Very low	157 Å²	157	155.5 Å²	155.5	81%	0.805	76%	0.76	S	S	*	*			trans	-67.9	91.3	168.2	-55.4	178.3	0	0	0	108.5	E750 M754	E750-I752 PolarHBondContact O-N 2.9Å; I752-M754 HydrophobicContact CG2-CG 4.27Å; I752-M754 PolarHBondContact O-N 3.42Å
753	K	28	Very low	33.7	Very low	177 Å²	177	155.2 Å²	155.2	77%	0.77	75%	0.75	S	S	*	*			trans	-72.3	90.9	173.4	-72.1	-178.1	178.2	176.1	0	110.1	E751	E751-K753 VanDerWaalsContact C-N 3.3Å; E751-K753 PolarHBondContact O-N 2.84Å
754	M	32.7	Very low	34.1	Very low	146 Å²	146	152.9 Å²	152.9	72%	0.719	74%	0.736	S	S	*	*			trans	-71.8	123.6	166.1	-69.3	-177.9	65	0	0	109.9	I752	I752-M754 HydrophobicContact CG2-CG 4.27Å; I752-M754 PolarHBondContact O-N 3.42Å
755	D	30.1	Very low	34.5	Very low	125 Å²	125	149.8 Å²	149.8	67%	0.668	73%	0.728	S	S	*	*			trans	-77.4	119.2	171.5	-172.3	-28.9	0	0	0	109.4	S757	D755-S757 VanDerWaalsContact CG-OG 3.26Å; D755-S757 PolarHBondContact O-N 2.77Å; D755-S757 WeakPolarHBondContact OD1-CB 3.42Å; D755-S757 PolarHBondContact OD1-N 3.03Å; D755-S757 PolarHBondContact OD1-OG 3.16Å
756	I	39.9	Very low	34.8	Very low	143 Å²	143	149.3 Å²	149.3	73%	0.733	73%	0.726	S	S	*	*	G	3₁₀ helix	trans	-82.8	-0.1	-171.8	-57.9	176.6	0	0	0	111.6	K758	I756-K758 PolarHBondContact O-N 3.03Å; I756-K758 VanDerWaalsContact O-N 3.11Å
757	S	36.1	Very low	35.2	Very low	87 Å²	87	142.9 Å²	142.9	61%	0.608	71%	0.709	S	S	*	*	G	3₁₀ helix	trans	-69.5	-2.5	-178.1	61.5	0	0	0	0	116.5	D755	D755-S757 VanDerWaalsContact CG-OG 3.26Å; D755-S757 PolarHBondContact O-N 2.77Å; D755-S757 WeakPolarHBondContact OD1-CB 3.42Å; D755-S757 PolarHBondContact OD1-N 3.03Å; D755-S757 PolarHBondContact OD1-OG 3.16Å
758	K	41.9	Very low	35.2	Very low	194 Å²	194	138.7 Å²	138.7	84%	0.843	70%	0.697	S	S	*	*	G	3₁₀ helix	trans	-136.3	26.4	-172.4	-66.6	-171.2	179.2	177.7	0	116.5	I756	I756-K758 PolarHBondContact O-N 3.03Å; I756-K758 VanDerWaalsContact O-N 3.11Å
759	L	36.5	Very low	35.4	Very low	97 Å²	97	134.2 Å²	134.2	51%	0.508	68%	0.682	S	S	.	*			trans	-106.3	136.7	175.2	-83.3	160.1	0	0	0	112.4
760	N	42.5	Very low	35.5	Very low	131 Å²	131	137.2 Å²	137.2	70%	0.701	68%	0.679	S	S	*	*			trans	-87.4	142.6	-171.4	-134.1	-18	0	0	0	110.9	H762 E763	N760-H762 PolarHBondContact O-N 3.02Å; N760-E763 PolarHBondContact O-N 2.77Å; N760-E763 VanDerWaalsContact O-N 3.1Å
761	A	38.6	Very low	35.5	Very low	81 Å²	81	134.8 Å²	134.8	67%	0.669	67%	0.669	S	S	*	*	H	α-helix	trans	-59.1	-17.2	-164.2	0	0	0	0	0	115.9
762	H	41.5	Very low	35.6	Very low	174 Å²	174	131 Å²	131	81%	0.806	66%	0.661	S	S	*	*	H	α-helix	trans	-79.9	-16	-178.3	-145.2	-55.1	0	0	0	114.2	N760	N760-H762 PolarHBondContact O-N 3.02Å
763	E	39.8	Very low	35.9	Very low	116 Å²	116	130.4 Å²	130.4	54%	0.542	66%	0.655	S	S	.	*	H	α-helix	trans	-92.8	-36.8	-179.8	-63.2	-172.4	124.1	0	0	112.3	N760 F765 R766	N760-E763 PolarHBondContact O-N 2.77Å; N760-E763 VanDerWaalsContact O-N 3.1Å; E763-F765 PolarHBondContact O-N 3.32Å; E763-F765 VanDerWaalsContact O-N 3.14Å; E763-R766 PolarHBondContact O-N 2.9Å
764	T	37.3	Very low	36.2	Very low	78 Å²	78	125.6 Å²	125.6	48%	0.479	64%	0.64	S	S	.	*	H	α-helix	trans	-51.8	-39	177.2	-41.3	0	0	0	0	112.1	R766 I767 S768	T764-R766 VanDerWaalsContact C-N 3.33Å; T764-R766 PolarHBondContact O-N 2.73Å; T764-I767 PolarHBondContact O-N 2.78Å; T764-S768 PolarHBondContact O-N 3.28Å; T764-S768 PolarHBondContact O-OG 3.36Å
765	F	35.6	Very low	36.2	Very low	156 Å²	156	123.4 Å²	123.4	68%	0.684	64%	0.635	S	S	*	*	H	α-helix	trans	-66.4	-29.1	-177.3	-139.9	-88.2	0	0	0	113.7	E763 L769	E763-F765 PolarHBondContact O-N 3.32Å; E763-F765 VanDerWaalsContact O-N 3.14Å; F765-L769 HydrophobicContact CD1-CD1 4.26Å; F765-L769 HydrophobicContact CE1-CD1 4.48Å
766	R	36.1	Very low	36.6	Very low	204 Å²	204	119.9 Å²	119.9	77%	0.77	63%	0.628	S	S	*	*	H	α-helix	trans	-72.9	-35.8	175.9	-86.1	-175.4	164.1	-176.8	-4.5	112.3	E763 T764 Y770	E763-R766 PolarHBondContact O-N 2.9Å; T764-R766 VanDerWaalsContact C-N 3.33Å; T764-R766 PolarHBondContact O-N 2.73Å; R766-Y770 PolarHBondContact O-N 2.81Å
767	I	35.4	Very low	36.3	Very low	110 Å²	110	119.6 Å²	119.6	56%	0.564	63%	0.627	S	S	*	*	H	α-helix	trans	-72.1	-41.8	-177.3	-60.5	175.5	0	0	0	110.7	T764 L769 Y770 M771	T764-I767 PolarHBondContact O-N 2.78Å; I767-L769 VanDerWaalsContact C-N 3.31Å; I767-L769 PolarHBondContact O-N 3.17Å; I767-Y770 PolarHBondContact O-N 3.08Å; I767-M771 PolarHBondContact O-N 3.5Å; I767-M771 VanDerWaalsContact O-N 3.16Å
768	S	32.2	Very low	36.1	Very low	75 Å²	75	121 Å²	121	52%	0.524	63%	0.627	S	S	.	*	H	α-helix	trans	-60.9	-36.6	177.4	-56.9	0	0	0	0	113.3	T764 S772	T764-S768 PolarHBondContact O-N 3.28Å; T764-S768 PolarHBondContact O-OG 3.36Å; S768-S772 PolarHBondContact O-N 3.13Å
769	L	36.3	Very low	35.4	Very low	101 Å²	101	120.3 Å²	120.3	53%	0.529	62%	0.624	S	S	.	*	H	α-helix	trans	-64.6	-39.4	175.3	-100	150.7	0	0	0	112.5	F765 I767	F765-L769 HydrophobicContact CD1-CD1 4.26Å; F765-L769 HydrophobicContact CE1-CD1 4.48Å; I767-L769 VanDerWaalsContact C-N 3.31Å; I767-L769 PolarHBondContact O-N 3.17Å
770	Y	33.3	Very low	35.2	Very low	185 Å²	185	120.5 Å²	120.5	73%	0.725	63%	0.632	S	S	*	*	H	α-helix	trans	-70.3	-37.1	178.8	-112.6	-89.3	0	0	0	113.6	R766 I767 T774	R766-Y770 PolarHBondContact O-N 2.81Å; I767-Y770 PolarHBondContact O-N 3.08Å; Y770-T774 PolarHBondContact O-OG1 2.78Å
771	M	31.4	Very low	34.7	Very low	131 Å²	131	122 Å²	122	65%	0.645	64%	0.635	S	S	*	*	H	α-helix	trans	-71.8	-35.6	176.8	-78.6	-165.3	164.9	0	0	113	I767 Q773 T774 T775	I767-M771 PolarHBondContact O-N 3.5Å; I767-M771 VanDerWaalsContact O-N 3.16Å; M771-Q773 PolarHBondContact O-N 2.9Å; M771-T774 WeakPolarHBondContact CA-OG1 3.23Å; M771-T774 PolarHBondContact O-N 3.07Å; M771-T774 PolarHBondContact O-OG1 2.7Å; M771-T774 VanDerWaalsContact O-OG1 3.06Å; M771-T775 PolarHBondContact O-N 3.42Å; M771-T775 PolarHBondContact O-OG1 2.87Å
772	S	32.3	Very low	34.4	Very low	84 Å²	84	123.4 Å²	123.4	59%	0.587	64%	0.635	S	S	*	*	H	α-helix	trans	-62.5	-41.1	-179.3	-171	0	0	0	0	112.9	S768 T775	S768-S772 PolarHBondContact O-N 3.13Å; S772-T775 PolarHBondContact O-OG1 3.41Å; S772-T775 VanDerWaalsContact O-OG1 3.12Å
773	Q	35.9	Very low	33.9	Very low	144 Å²	144	121 Å²	121	67%	0.673	63%	0.633	S	S	*	*	H	α-helix	trans	-71.1	-32.5	179	-69.6	-172.3	-18.4	0	0	113.1	M771	M771-Q773 PolarHBondContact O-N 2.9Å
774	T	35.6	Very low	33.5	Very low	76 Å²	76	121.5 Å²	121.5	47%	0.466	64%	0.644	S	S	.	*	H	α-helix	trans	-76	-31.6	-179.7	38.1	0	0	0	0	112.9	Y770 M771 G776	Y770-T774 PolarHBondContact O-OG1 2.78Å; M771-T774 WeakPolarHBondContact CA-OG1 3.23Å; M771-T774 PolarHBondContact O-N 3.07Å; M771-T774 PolarHBondContact O-OG1 2.7Å; M771-T774 VanDerWaalsContact O-OG1 3.06Å; T774-G776 VanDerWaalsContact C-N 3.27Å; T774-G776 PolarHBondContact O-N 3.06Å
775	T	33.1	Very low	33.3	Very low	100 Å²	100	121.9 Å²	121.9	61%	0.613	66%	0.655	S	S	*	*	H	α-helix	trans	-70.1	-18.8	175.5	48.3	0	0	0	0	114.5	M771 S772	M771-T775 PolarHBondContact O-N 3.42Å; M771-T775 PolarHBondContact O-OG1 2.87Å; S772-T775 PolarHBondContact O-OG1 3.41Å; S772-T775 VanDerWaalsContact O-OG1 3.12Å
776	G	36.8	Very low	33.3	Very low	51 Å²	51	121.8 Å²	121.8	53%	0.526	66%	0.66	S	S	.	*	H	α-helix	trans	-73.2	-41.4	178.2	0	0	0	0	0	114.2	T774	T774-G776 VanDerWaalsContact C-N 3.27Å; T774-G776 PolarHBondContact O-N 3.06Å
777	L	34.1	Very low	33.3	Very low	136 Å²	136	121.6 Å²	121.6	71%	0.712	67%	0.665	S	S	*	*	H	α-helix	trans	-78.5	-35.2	-173.5	-84.3	146.8	0	0	0	113.7	K779 C780	L777-K779 PolarHBondContact O-N 2.82Å; L777-C780 PolarHBondContact O-N 3.1Å
778	I	31.8	Very low	33.3	Very low	118 Å²	118	128.1 Å²	128.1	61%	0.605	70%	0.701	S	S	*	*	G	3₁₀ helix	trans	-64.8	-24.3	-174.9	-65	169.9	0	0	0	112.1	C780	I778-C780 VanDerWaalsContact C-N 3.32Å; I778-C780 PolarHBondContact O-N 3.28Å
779	K	28.6	Very low	33.3	Very low	179 Å²	179	130.8 Å²	130.8	78%	0.778	71%	0.71	S	S	*	*	G	3₁₀ helix	trans	-77.5	-9.9	-176.1	-133.1	175.6	-174.4	179.4	0	114.9	L777	L777-K779 PolarHBondContact O-N 2.82Å
780	C	30.4	Very low	33.1	Very low	101 Å²	101	132.4 Å²	132.4	68%	0.682	72%	0.719	S	S	*	*	G	3₁₀ helix	trans	-103.9	-5.3	-177.4	-68.9	0	0	0	0	115.4	L777 I778	L777-C780 PolarHBondContact O-N 3.1Å; I778-C780 VanDerWaalsContact C-N 3.32Å; I778-C780 PolarHBondContact O-N 3.28Å
781	Q	33.2	Very low	33.1	Very low	163 Å²	163	129.4 Å²	129.4	76%	0.762	72%	0.719	S	S	*	*	S	Bend	trans	-103.6	-2.5	-179.1	-77	-171.1	-46	0	0	115.1
782	V	31.2	Very low	33.2	Very low	109 Å²	109	129.4 Å²	129.4	66%	0.661	72%	0.723	S	S	*	*	S	Bend	trans	-96.3	-19	-174	-175.6	0	0	0	0	113
783	T	30.8	Very low	33.3	Very low	124 Å²	124	132.2 Å²	132.2	76%	0.761	73%	0.732	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.4	-6.6	-173.6	14.7	0	0	0	0	115.7
784	T	32.8	Very low	33.1	Very low	126 Å²	126	131.4 Å²	131.4	77%	0.773	74%	0.736	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106	4.2	-177.2	28.9	0	0	0	0	114.7
785	A	32.5	Very low	33	Very low	86 Å²	86	135.4 Å²	135.4	71%	0.711	76%	0.755	S	S	*	*	S	Bend	trans	-103.7	11	-178.2	0	0	0	0	0	114.8
786	I	36.7	Very low	33	Very low	155 Å²	155	138.1 Å²	138.1	80%	0.795	77%	0.766	S	S	*	*	S	Bend	trans	-134.4	67.6	178.1	-46.9	-179.8	0	0	0	110.6
787	K	36.1	Very low	32.6	Very low	199 Å²	199	145.3 Å²	145.3	87%	0.865	79%	0.786	S	S	*	*			trans	-172.6	84.5	154.2	-110.7	174.4	-176.3	-178.3	0	111.8
788	N	33.4	Very low	32.5	Very low	248 Å²	248	146.2 Å²	146.2	100%	1.326	79%	0.793	S	S	*	*			trans	-162.8	0	147.4	-93	-21.6	0	0	0	107

Retrieved 788 of 788 residues in 497.5 ms (Link to these results)

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