A0A077Z155_TRITR Loading...

Neurabin-1

AlphaFold DB , UniProt , Accession A0A077Z155, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 692 aa.

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(Predicted Aligned Error values between residue pairs)

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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	37.3	Very low	38.4	Very low	228 Å²	228	153.6 Å²	153.6	100%	1.123	80%	0.796	S	S	*	*				0	152.9	0	-78.6	160.8	164.7	0	0	107
2	D	39.3	Very low	38.2	Very low	158 Å²	158	148.7 Å²	148.7	85%	0.845	79%	0.794	S	S	*	*			trans	65.6	100.6	166.2	-44.8	-37	0	0	0	117.8
3	E	34	Very low	37.9	Very low	156 Å²	156	147.8 Å²	147.8	73%	0.729	80%	0.798	S	S	*	*			trans	-81.9	161.4	158	-46.6	176.1	141.2	0	0	110.3	K5	E3-K5 IonicContact OE2-NZ 3.47Å
4	H	44	Very low	37.6	Very low	155 Å²	155	149.8 Å²	149.8	72%	0.718	81%	0.808	S	S	*	*			trans	179.7	108.2	131.5	-108	-125.5	0	0	0	108
5	K	40.9	Very low	37.3	Very low	137 Å²	137	145.1 Å²	145.1	60%	0.596	81%	0.809	S	S	*	*				81.4	117.3	77	-78.4	176.8	-165.2	151.3	0	114.5	E3	E3-K5 IonicContact OE2-NZ 3.47Å
6	N	40.6	Very low	36.9	Very low	151 Å²	151	150.8 Å²	150.8	81%	0.807	81%	0.814	S	S	*	*			trans	160.1	93.6	136	-79.3	-7.1	0	0	0	108.5
7	S	38.1	Very low	36.8	Very low	102 Å²	102	152.2 Å²	152.2	71%	0.713	81%	0.814	S	S	*	*				84.8	109.6	65.2	71.3	0	0	0	0	114.7
8	W	34.6	Very low	36.5	Very low	237 Å²	237	149 Å²	149	90%	0.898	81%	0.806	S	S	*	*			trans	-86.6	154.9	171.8	-70.7	21.1	0	0	0	113.6
9	P	42.8	Very low	36.5	Very low	127 Å²	127	151.1 Å²	151.1	83%	0.825	81%	0.81	S	S	*	*			trans	-70.3	130.5	139.9	43.4	-22.5	0	0	0	123.6
10	P	36.8	Very low	36.1	Very low	100 Å²	100	153.2 Å²	153.2	65%	0.649	81%	0.814	S	S	*	*			trans	-132.7	158.4	153.7	39.3	-29.2	0	0	0	116
11	T	34.3	Very low	36.1	Very low	139 Å²	139	152 Å²	152	85%	0.853	82%	0.818	S	S	*	*			trans	58.9	117.9	155.8	51.8	0	0	0	0	121.9
12	A	35.2	Very low	35.8	Very low	94 Å²	94	146.4 Å²	146.4	78%	0.777	80%	0.801	S	S	*	*			trans	177.5	157.3	142.4	0	0	0	0	0	110.5
13	T	34.5	Very low	35.5	Very low	138 Å²	138	147 Å²	147	85%	0.847	80%	0.803	S	S	*	*			cis	-163.3	161.7	-31.7	30	0	0	0	0	108.3
14	N	34.2	Very low	35.4	Very low	175 Å²	175	144.6 Å²	144.6	94%	0.936	80%	0.803	S	S	*	*			trans	-61.7	149.6	174.3	-71	-37.7	0	0	0	114.1
15	G	33.7	Very low	35	Very low	80 Å²	80	141.7 Å²	141.7	83%	0.825	80%	0.801	S	S	*	*			trans	-159.2	144.5	169.4	0	0	0	0	0	112.9
16	R	29.8	Very low	34.8	Very low	235 Å²	235	142.7 Å²	142.7	89%	0.887	81%	0.812	S	S	*	*			trans	-105.4	171.4	178.3	-81.3	-178.9	171.3	176.2	-3.3	111.5
17	H	36.2	Very low	34.5	Very low	175 Å²	175	143.4 Å²	143.4	81%	0.81	82%	0.816	S	S	*	*			trans	109.9	129.7	162.1	-64.8	-74.6	0	0	0	114.4
18	S	31.3	Very low	34.1	Very low	95 Å²	95	147 Å²	147	66%	0.664	82%	0.819	S	S	*	*			cis	124.4	82.9	-3.4	74.4	0	0	0	0	113.6
19	E	35.4	Very low	34	Very low	189 Å²	189	143.8 Å²	143.8	88%	0.883	82%	0.819	S	S	*	*			trans	-153.9	112.5	161	-101.8	160.5	-173.4	0	0	104.9
20	Q	29.3	Very low	33.8	Very low	192 Å²	192	143.7 Å²	143.7	90%	0.897	81%	0.811	S	S	*	*				64.1	83.8	62.3	-66.8	-159	-2.6	0	0	115.1
21	S	36	Very low	33.4	Very low	128 Å²	128	147.9 Å²	147.9	90%	0.895	82%	0.822	S	S	*	*				-146.7	149.2	128.2	54.8	0	0	0	0	109.5
22	S	30.4	Very low	33.5	Very low	111 Å²	111	147.1 Å²	147.1	78%	0.776	82%	0.819	S	S	*	*			trans	-127.7	150.2	-170.6	54.4	0	0	0	0	111.6
23	I	34.1	Very low	33.4	Very low	171 Å²	171	147.4 Å²	147.4	88%	0.877	82%	0.816	S	S	*	*			trans	-160.9	139.4	145.2	-100.2	145.2	0	0	0	108.5
24	S	31.9	Very low	33.3	Very low	105 Å²	105	147.7 Å²	147.7	73%	0.734	82%	0.817	S	S	*	*			trans	-80.5	173.3	-178.9	-49	0	0	0	0	111.1
25	S	35.3	Very low	33.3	Very low	95 Å²	95	145 Å²	145	66%	0.664	81%	0.807	S	S	*	*			cis	-162.5	165.8	21.9	-29.7	0	0	0	0	112.8
26	N	37.3	Very low	33.2	Very low	157 Å²	157	148.1 Å²	148.1	84%	0.84	81%	0.805	S	S	*	*			trans	69.8	88.2	150.9	-58.1	-8.3	0	0	0	119.1
27	N	32.2	Very low	33.5	Very low	167 Å²	167	146 Å²	146	89%	0.893	80%	0.802	S	S	*	*			trans	-71.4	142.5	158.8	-62	-14.4	0	0	0	111.5
28	K	30.6	Very low	33.4	Very low	177 Å²	177	143.1 Å²	143.1	77%	0.77	80%	0.801	S	S	*	*			trans	-160	104.5	131.3	-162.4	175	-177.4	-175	0	111.1
29	L	33.7	Very low	33.9	Very low	170 Å²	170	143.2 Å²	143.2	89%	0.89	80%	0.797	S	S	*	*			trans	-140.4	145.8	163.5	-79.8	173.7	0	0	0	107
30	D	36.7	Very low	34.2	Very low	124 Å²	124	139.2 Å²	139.2	66%	0.663	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-98.8	150.7	-153.1	-51	-84.8	0	0	0	114.2
31	E	29.6	Very low	34.8	Very low	188 Å²	188	136.6 Å²	136.6	88%	0.879	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-70.6	130.9	170.3	-69.4	-178.8	115.9	0	0	110.7	S33	E31-S33 PolarHBondContact O-N 3.4Å
32	P	36.3	Very low	35.2	Very low	123 Å²	123	134.3 Å²	134.3	80%	0.799	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-71.9	118.8	162.4	29.8	-30.8	0	0	0	108.8	V34	P32-V34 PolarHBondContact O-N 3.12Å
33	S	33	Very low	36	Very low	101 Å²	101	133 Å²	133	71%	0.706	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-62.4	135.8	-178	45.1	0	0	0	0	112.2	E31 V35	E31-S33 PolarHBondContact O-N 3.4Å; S33-V35 PolarHBondContact O-N 2.69Å
34	V	31.6	Very low	36.6	Very low	143 Å²	143	127.3 Å²	127.3	87%	0.867	72%	0.721	S	S	*	*			trans	-66.4	104.1	171.5	178.7	0	0	0	0	108.2	P32	P32-V34 PolarHBondContact O-N 3.12Å
35	V	35	Very low	37.7	Very low	119 Å²	119	128.1 Å²	128.1	72%	0.721	71%	0.712	S	S	*	*			trans	-77.8	123.9	175.8	-179.1	0	0	0	0	109	S33 K37	S33-V35 PolarHBondContact O-N 2.69Å; V35-K37 PolarHBondContact O-N 2.79Å
36	D	30.6	Very low	38.7	Very low	146 Å²	146	126.5 Å²	126.5	78%	0.781	70%	0.704	S	S	*	*			trans	-53.9	108	175.5	-91.3	-51.9	0	0	0	111.5	S38	D36-S38 VanDerWaalsContact C-N 3.26Å; D36-S38 PolarHBondContact O-N 3.45Å
37	K	37	Very low	39.6	Very low	191 Å²	191	123.2 Å²	123.2	83%	0.83	69%	0.69	S	S	*	*			trans	-72.6	89.8	158.3	-73.9	-171.1	178.8	-176.8	0	107.6	V35 V39	V35-K37 PolarHBondContact O-N 2.79Å; K37-V39 PolarHBondContact O-N 3.35Å
38	S	34.1	Very low	40.5	Very low	113 Å²	113	119.5 Å²	119.5	79%	0.79	67%	0.665	S	S	*	*			trans	-60.6	85.5	165.4	173.3	0	0	0	0	109.7	D36 D40	D36-S38 VanDerWaalsContact C-N 3.26Å; D36-S38 PolarHBondContact O-N 3.45Å; S38-D40 PolarHBondContact O-N 2.79Å; S38-D40 VanDerWaalsContact O-N 3.11Å
39	V	41.3	Very low	42.1	Very low	97 Å²	97	114.4 Å²	114.4	59%	0.588	65%	0.645	S	S	*	*			trans	-65.6	108.6	173.9	178.4	0	0	0	0	107.9	K37 F41	K37-V39 PolarHBondContact O-N 3.35Å; V39-F41 VanDerWaalsContact C-N 3.31Å; V39-F41 HydrophobicContact CB-CD2 4.17Å; V39-F41 HydrophobicContact CB-CE2 3.96Å; V39-F41 HydrophobicContact CG1-CD2 3.89Å; V39-F41 HydrophobicContact CG1-CE2 3.71Å; V39-F41 HydrophobicContact CG1-CZ 4.2Å; V39-F41 VanDerWaalsContact O-CD2 3.32Å; V39-F41 WeakPolarHBondContact O-CD2 3.43Å; V39-F41 PolarHBondContact O-N 2.9Å
40	D	41.8	Very low	43.3	Very low	106 Å²	106	109.8 Å²	109.8	57%	0.567	63%	0.626	S	S	*	*			trans	-77.2	85.1	-179.8	-161.4	-20.1	0	0	0	111.2	S38 S42 S43	S38-D40 PolarHBondContact O-N 2.79Å; S38-D40 VanDerWaalsContact O-N 3.11Å; D40-S42 PolarHBondContact O-N 3.2Å; D40-S42 WeakPolarHBondContact OD1-CB 3.34Å; D40-S42 PolarHBondContact OD1-N 3.42Å; D40-S42 PolarHBondContact OD1-OG 2.82Å; D40-S43 PolarHBondContact O-OG 3.34Å
41	F	42.2	Very low	44.1	Very low	136 Å²	136	108.3 Å²	108.3	60%	0.596	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.1	-5.6	175.8	-84.2	-84.2	0	0	0	114	V39 S43 A44 K45	V39-F41 VanDerWaalsContact C-N 3.31Å; V39-F41 HydrophobicContact CB-CD2 4.17Å; V39-F41 HydrophobicContact CB-CE2 3.96Å; V39-F41 HydrophobicContact CG1-CD2 3.89Å; V39-F41 HydrophobicContact CG1-CE2 3.71Å; V39-F41 HydrophobicContact CG1-CZ 4.2Å; V39-F41 VanDerWaalsContact O-CD2 3.32Å; V39-F41 WeakPolarHBondContact O-CD2 3.43Å; V39-F41 PolarHBondContact O-N 2.9Å; F41-S43 VanDerWaalsContact C-N 3.27Å; F41-S43 PolarHBondContact O-N 2.9Å; F41-A44 HydrophobicContact CD1-CB 4.32Å; F41-A44 PolarHBondContact O-N 3.3Å; F41-K45 WeakPolarHBondContact O-CB 3.44Å; F41-K45 PolarHBondContact O-N 3.25Å
42	S	43.5	Very low	45.6	Very low	80 Å²	80	103.1 Å²	103.1	56%	0.559	59%	0.594	S	S	*	*	H	α-helix	trans	-58.1	-40.1	178.1	-54.8	0	0	0	0	112	D40 A46	D40-S42 PolarHBondContact O-N 3.2Å; D40-S42 WeakPolarHBondContact OD1-CB 3.34Å; D40-S42 PolarHBondContact OD1-N 3.42Å; D40-S42 PolarHBondContact OD1-OG 2.82Å; S42-A46 WeakPolarHBondContact O-CB 3.42Å; S42-A46 PolarHBondContact O-N 3.31Å
43	S	48.1	Very low	46.8	Very low	84 Å²	84	103.5 Å²	103.5	59%	0.587	58%	0.583	S	S	*	*	H	α-helix	trans	-64.7	-53.1	175.9	58.4	0	0	0	0	112.2	D40 F41 K45 A46 V47	D40-S43 PolarHBondContact O-OG 3.34Å; F41-S43 VanDerWaalsContact C-N 3.27Å; F41-S43 PolarHBondContact O-N 2.9Å; S43-K45 VanDerWaalsContact C-N 3.32Å; S43-K45 PolarHBondContact O-N 2.99Å; S43-A46 PolarHBondContact O-N 3.02Å; S43-V47 PolarHBondContact O-N 2.99Å
44	A	46.1	Very low	47.7	Very low	51 Å²	51	106 Å²	106	42%	0.421	58%	0.581	S	S	.	*	H	α-helix	trans	-60.9	-39.2	177.7	0	0	0	0	0	112.4	F41 V47 F48	F41-A44 HydrophobicContact CD1-CB 4.32Å; F41-A44 PolarHBondContact O-N 3.3Å; A44-V47 PolarHBondContact O-N 3.15Å; A44-F48 WeakPolarHBondContact O-CB 3.33Å; A44-F48 PolarHBondContact O-N 3.43Å
45	K	55.7	Low	48.6	Very low	122 Å²	122	104.1 Å²	104.1	53%	0.53	57%	0.566	S	S	.	*	H	α-helix	trans	-67.6	-38.1	176.1	-174.3	171.6	-177.5	-72.7	0	112	F41 S43 F48 E49	F41-K45 WeakPolarHBondContact O-CB 3.44Å; F41-K45 PolarHBondContact O-N 3.25Å; S43-K45 VanDerWaalsContact C-N 3.32Å; S43-K45 PolarHBondContact O-N 2.99Å; K45-F48 PolarHBondContact O-N 3.44Å; K45-E49 IonicContact NZ-OE1 2.75Å; K45-E49 PolarHBondContact NZ-OE1 2.89Å; K45-E49 WeakPolarHBondContact O-CB 3.47Å; K45-E49 PolarHBondContact O-N 3.45Å
46	A	55.6	Low	49.3	Very low	61 Å²	61	105.6 Å²	105.6	50%	0.504	56%	0.558	S	S	.	*	H	α-helix	trans	-63.4	-44	174.2	0	0	0	0	0	111.6	S42 S43 S50	S42-A46 WeakPolarHBondContact O-CB 3.42Å; S42-A46 PolarHBondContact O-N 3.31Å; S43-A46 PolarHBondContact O-N 3.02Å; A46-S50 VanDerWaalsContact O-CB 3.23Å; A46-S50 WeakPolarHBondContact O-CB 3.45Å; A46-S50 PolarHBondContact O-N 3Å
47	V	57	Low	50	Low	89 Å²	89	102.8 Å²	102.8	54%	0.539	55%	0.55	S	S	.	*	H	α-helix	trans	-61.3	-48.1	173.8	174.3	0	0	0	0	110.9	S43 A44 S50 L51	S43-V47 PolarHBondContact O-N 2.99Å; A44-V47 PolarHBondContact O-N 3.15Å; V47-S50 WeakPolarHBondContact O-CB 3.24Å; V47-S50 PolarHBondContact O-N 3.37Å; V47-L51 HydrophobicContact CG1-CD1 3.77Å; V47-L51 WeakPolarHBondContact O-CD1 3.44Å; V47-L51 PolarHBondContact O-N 3.26Å
48	F	51.2	Low	50.4	Low	88 Å²	88	98.6 Å²	98.6	39%	0.386	54%	0.541	S	S	.	.	H	α-helix	trans	-66.9	-42.9	-177.3	-158.7	-88.2	0	0	0	112.9	A44 K45 S50 L51 E52 L479	A44-F48 WeakPolarHBondContact O-CB 3.33Å; A44-F48 PolarHBondContact O-N 3.43Å; K45-F48 PolarHBondContact O-N 3.44Å; F48-S50 VanDerWaalsContact C-N 3.28Å; F48-S50 PolarHBondContact O-N 2.93Å; F48-L51 PolarHBondContact O-N 2.91Å; F48-E52 HydrophobicContact CD1-CG 4.2Å; F48-E52 HydrophobicContact CE1-CG 4Å; F48-E52 PolarHBondContact O-N 3.23Å; F48-L479 HydrophobicContact CE1-CD2 4.34Å; F48-L479 HydrophobicContact CE2-CD2 3.86Å; F48-L479 HydrophobicContact CZ-CD1 4.33Å; F48-L479 HydrophobicContact CZ-CD2 3.59Å
49	E	64.4	Low	50.8	Low	71 Å²	71	96.4 Å²	96.4	33%	0.332	53%	0.53	S	S	.	.	H	α-helix	trans	-62.9	-34.8	172.2	-84.4	-167.3	-142.1	0	0	112.5	K45 K53	K45-E49 IonicContact NZ-OE1 2.75Å; K45-E49 PolarHBondContact NZ-OE1 2.89Å; K45-E49 WeakPolarHBondContact O-CB 3.47Å; K45-E49 PolarHBondContact O-N 3.45Å; E49-K53 WeakPolarHBondContact O-CB 3.4Å; E49-K53 VanDerWaalsContact O-CD 3.29Å; E49-K53 WeakPolarHBondContact O-CD 3.37Å; E49-K53 WeakPolarHBondContact O-CG 3.36Å; E49-K53 PolarHBondContact O-N 2.85Å; E49-K53 IonicContact OE2-NZ 3.82Å; E49-K53 PolarHBondContact OE2-NZ 2.78Å
50	S	58.6	Low	50.8	Low	72 Å²	72	98.4 Å²	98.4	50%	0.503	54%	0.537	S	S	.	.	H	α-helix	trans	-67.3	-43	176.3	-165.5	0	0	0	0	111	A46 V47 F48 K53 K54	A46-S50 VanDerWaalsContact O-CB 3.23Å; A46-S50 WeakPolarHBondContact O-CB 3.45Å; A46-S50 PolarHBondContact O-N 3Å; V47-S50 WeakPolarHBondContact O-CB 3.24Å; V47-S50 PolarHBondContact O-N 3.37Å; F48-S50 VanDerWaalsContact C-N 3.28Å; F48-S50 PolarHBondContact O-N 2.93Å; S50-K53 PolarHBondContact O-N 2.84Å; S50-K54 WeakPolarHBondContact O-CB 3.4Å; S50-K54 PolarHBondContact O-N 2.88Å
51	L	52.7	Low	50.5	Low	93 Å²	93	96.8 Å²	96.8	49%	0.487	54%	0.544	S	S	.	.	H	α-helix	trans	-63	-43.8	171.6	-94.5	104.4	0	0	0	112.7	V47 F48 K53 K54 N55	V47-L51 HydrophobicContact CG1-CD1 3.77Å; V47-L51 WeakPolarHBondContact O-CD1 3.44Å; V47-L51 PolarHBondContact O-N 3.26Å; F48-L51 PolarHBondContact O-N 2.91Å; L51-K53 PolarHBondContact O-N 2.73Å; L51-K54 PolarHBondContact O-N 2.86Å; L51-N55 WeakPolarHBondContact O-CB 3.32Å; L51-N55 PolarHBondContact O-N 3.48Å
52	E	61.9	Low	50.2	Low	79 Å²	79	94 Å²	94	37%	0.369	55%	0.547	S	S	.	.	H	α-helix	trans	-58.5	-45.8	174.4	-86	-135.2	111.2	0	0	111.8	F48 N55 R56	F48-E52 HydrophobicContact CD1-CG 4.2Å; F48-E52 HydrophobicContact CE1-CG 4Å; F48-E52 PolarHBondContact O-N 3.23Å; E52-N55 PolarHBondContact O-N 2.9Å; E52-R56 VanDerWaalsContact CD-NH2 3.29Å; E52-R56 WeakPolarHBondContact O-CB 3.47Å; E52-R56 VanDerWaalsContact O-CG 3.31Å; E52-R56 WeakPolarHBondContact O-CG 3.28Å; E52-R56 PolarHBondContact O-N 2.85Å; E52-R56 IonicContact OE1-CZ 3.77Å; E52-R56 IonicContact OE1-NE 3.17Å; E52-R56 IonicContact OE1-NH2 2.75Å; E52-R56 PolarHBondContact OE1-NH2 2.84Å; E52-R56 IonicContact OE2-CZ 3.83Å; E52-R56 IonicContact OE2-NH2 3.23Å; E52-R56 PolarHBondContact OE2-NH2 3.08Å; E52-R56 VanDerWaalsContact OE2-NH2 3.12Å
53	K	60.5	Low	49.7	Very low	131 Å²	131	97.2 Å²	97.2	57%	0.57	56%	0.557	S	S	*	*	H	α-helix	trans	-63.6	-41.3	178.2	-72	160.8	-165.4	163.4	0	111.2	E49 S50 L51 S57	E49-K53 WeakPolarHBondContact O-CB 3.4Å; E49-K53 VanDerWaalsContact O-CD 3.29Å; E49-K53 WeakPolarHBondContact O-CD 3.37Å; E49-K53 WeakPolarHBondContact O-CG 3.36Å; E49-K53 PolarHBondContact O-N 2.85Å; E49-K53 IonicContact OE2-NZ 3.82Å; E49-K53 PolarHBondContact OE2-NZ 2.78Å; S50-K53 PolarHBondContact O-N 2.84Å; L51-K53 PolarHBondContact O-N 2.73Å; K53-S57 VanDerWaalsContact O-CB 3.25Å; K53-S57 WeakPolarHBondContact O-CB 3.36Å; K53-S57 PolarHBondContact O-N 3.12Å
54	K	53.7	Low	48.9	Very low	155 Å²	155	98.4 Å²	98.4	67%	0.674	57%	0.565	S	S	*	*	H	α-helix	trans	-65.8	-45.6	177.2	-145.4	168.6	-172.1	177	0	111.5	S50 L51 S57 T58	S50-K54 WeakPolarHBondContact O-CB 3.4Å; S50-K54 PolarHBondContact O-N 2.88Å; L51-K54 PolarHBondContact O-N 2.86Å; K54-S57 PolarHBondContact O-N 2.87Å; K54-T58 PolarHBondContact O-N 2.71Å; K54-T58 PolarHBondContact O-OG1 2.68Å
55	N	49.5	Very low	48.2	Very low	102 Å²	102	104.5 Å²	104.5	55%	0.545	59%	0.59	S	S	.	*	H	α-helix	trans	-70.2	-39.4	179.8	-72.5	-15.9	0	0	0	112.9	L51 E52 T58 A59	L51-N55 WeakPolarHBondContact O-CB 3.32Å; L51-N55 PolarHBondContact O-N 3.48Å; E52-N55 PolarHBondContact O-N 2.9Å; N55-T58 PolarHBondContact O-N 2.87Å; N55-A59 VanDerWaalsContact O-CB 3.3Å; N55-A59 WeakPolarHBondContact O-CB 3.36Å; N55-A59 PolarHBondContact O-N 3.07Å
56	R	49.6	Very low	47.3	Very low	150 Å²	150	108.1 Å²	108.1	57%	0.566	61%	0.606	S	S	*	*	H	α-helix	trans	-66.9	-36	173.6	-69.9	-178.7	-168.3	-172.6	9	112.1	E52 A59 L60	E52-R56 VanDerWaalsContact CD-NH2 3.29Å; E52-R56 WeakPolarHBondContact O-CB 3.47Å; E52-R56 VanDerWaalsContact O-CG 3.31Å; E52-R56 WeakPolarHBondContact O-CG 3.28Å; E52-R56 PolarHBondContact O-N 2.85Å; E52-R56 IonicContact OE1-CZ 3.77Å; E52-R56 IonicContact OE1-NE 3.17Å; E52-R56 IonicContact OE1-NH2 2.75Å; E52-R56 PolarHBondContact OE1-NH2 2.84Å; E52-R56 IonicContact OE2-CZ 3.83Å; E52-R56 IonicContact OE2-NH2 3.23Å; E52-R56 PolarHBondContact OE2-NH2 3.08Å; E52-R56 VanDerWaalsContact OE2-NH2 3.12Å; R56-A59 PolarHBondContact O-N 2.82Å; R56-L60 WeakPolarHBondContact O-CB 3.43Å; R56-L60 WeakPolarHBondContact O-CG 3.3Å; R56-L60 PolarHBondContact O-N 3.3Å
57	S	46.5	Very low	46.3	Very low	87 Å²	87	111.3 Å²	111.3	61%	0.608	62%	0.621	S	S	*	*	H	α-helix	trans	-62.2	-48.1	173.3	-170.2	0	0	0	0	111.6	K53 K54 A59 L60 G61	K53-S57 VanDerWaalsContact O-CB 3.25Å; K53-S57 WeakPolarHBondContact O-CB 3.36Å; K53-S57 PolarHBondContact O-N 3.12Å; K54-S57 PolarHBondContact O-N 2.87Å; S57-A59 PolarHBondContact O-N 2.95Å; S57-L60 PolarHBondContact O-N 3.03Å; S57-G61 PolarHBondContact O-N 3.25Å
58	T	44.9	Very low	45	Very low	103 Å²	103	112.6 Å²	112.6	63%	0.632	63%	0.631	S	S	*	*	H	α-helix	trans	-63.7	-39.8	176.5	-54.2	0	0	0	0	112.5	K54 N55	K54-T58 PolarHBondContact O-N 2.71Å; K54-T58 PolarHBondContact O-OG1 2.68Å; N55-T58 PolarHBondContact O-N 2.87Å
59	A	42.7	Very low	44.3	Very low	68 Å²	68	114.8 Å²	114.8	56%	0.562	65%	0.652	S	S	*	*	H	α-helix	trans	-70.9	-30.8	-179.9	0	0	0	0	0	113.9	N55 R56 S57	N55-A59 VanDerWaalsContact O-CB 3.3Å; N55-A59 WeakPolarHBondContact O-CB 3.36Å; N55-A59 PolarHBondContact O-N 3.07Å; R56-A59 PolarHBondContact O-N 2.82Å; S57-A59 PolarHBondContact O-N 2.95Å
60	L	40.7	Very low	42.9	Very low	139 Å²	139	122.7 Å²	122.7	73%	0.728	68%	0.679	S	S	*	*	H	α-helix	trans	-87.6	-12.5	179.6	-69.7	171.1	0	0	0	113.7	R56 S57 A62	R56-L60 WeakPolarHBondContact O-CB 3.43Å; R56-L60 WeakPolarHBondContact O-CG 3.3Å; R56-L60 PolarHBondContact O-N 3.3Å; S57-L60 PolarHBondContact O-N 3.03Å; L60-A62 VanDerWaalsContact C-N 3.34Å
61	G	35.4	Very low	41.6	Very low	71 Å²	71	124.6 Å²	124.6	73%	0.732	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79	-9.4	173	0	0	0	0	0	115.2	S57	S57-G61 PolarHBondContact O-N 3.25Å
62	A	36.8	Very low	40.8	Very low	79 Å²	79	127.3 Å²	127.3	65%	0.653	71%	0.71	S	S	*	*			trans	-109.5	47.2	-166.8	0	0	0	0	0	114.3	L60	L60-A62 VanDerWaalsContact C-N 3.34Å
63	L	32.4	Very low	39.4	Very low	147 Å²	147	128.8 Å²	128.8	77%	0.77	72%	0.724	S	S	*	*			trans	-127.6	132.4	178.8	-76.9	173.6	0	0	0	114.8
64	S	31.3	Very low	38.1	Very low	109 Å²	109	133.2 Å²	133.2	76%	0.762	74%	0.737	S	S	*	*			trans	69.3	86.1	157.3	-172.2	0	0	0	0	119.4
65	L	30.3	Very low	37.2	Very low	179 Å²	179	135.2 Å²	135.2	94%	0.937	75%	0.746	S	S	*	*			trans	-125	109.6	139.7	-72	177	0	0	0	109.9
66	K	38	Very low	36.5	Very low	197 Å²	197	135.1 Å²	135.1	86%	0.857	75%	0.753	S	S	*	*			trans	-135.7	129.2	168.2	-79.6	-172.6	175.4	178.6	0	109.8
67	P	33.6	Very low	35.9	Very low	128 Å²	128	138.1 Å²	138.1	83%	0.831	77%	0.765	S	S	*	*			trans	-77.3	155.8	175	31.8	-34.2	0	0	0	112.2
68	P	30.8	Very low	35.2	Very low	116 Å²	116	141.9 Å²	141.9	75%	0.753	77%	0.77	S	S	*	*			trans	-105.6	160.8	-171.2	39.4	-35.7	0	0	0	115.4
69	T	36.4	Very low	34.9	Very low	135 Å²	135	143.8 Å²	143.8	83%	0.828	77%	0.772	S	S	*	*			trans	139.9	150.8	157.9	47.1	0	0	0	0	109.8
70	R	33.8	Very low	34.6	Very low	236 Å²	236	147.2 Å²	147.2	89%	0.891	78%	0.776	S	S	*	*			cis	-144.6	160.1	-15.9	-124	-179.8	177.8	-132.3	1.3	107.8
71	P	32.5	Very low	34.4	Very low	112 Å²	112	145.3 Å²	145.3	73%	0.727	77%	0.774	S	S	*	*			trans	-100.4	158	-159.2	37.6	-35.8	0	0	0	116.5
72	V	35.5	Very low	34.4	Very low	150 Å²	150	149 Å²	149	91%	0.909	78%	0.776	S	S	*	*			trans	-126.8	137.6	159.7	179.6	0	0	0	0	110.3
73	V	32.2	Very low	34.4	Very low	111 Å²	111	148.7 Å²	148.7	67%	0.673	78%	0.781	S	S	*	*			trans	-89	137.6	-156.9	177.6	0	0	0	0	114.6
74	R	33.5	Very low	34.6	Very low	223 Å²	223	147.1 Å²	147.1	84%	0.842	78%	0.782	S	S	*	*				-177.8	118.4	123.3	-97.7	165.1	-169.8	91.3	-6.3	114.8
75	K	34.5	Very low	34.9	Very low	197 Å²	197	146 Å²	146	86%	0.857	78%	0.779	S	S	*	*			trans	32.4	140.8	144.4	-58.5	-177.4	179.3	-175.8	0	119.8
76	S	36	Very low	35.3	Very low	101 Å²	101	144.8 Å²	144.8	71%	0.706	77%	0.774	S	S	*	*			cis	-175.6	168	-5.1	55.8	0	0	0	0	107.2
77	R	35.8	Very low	35.3	Very low	213 Å²	213	143.5 Å²	143.5	80%	0.804	78%	0.775	S	S	*	*			cis	-173.5	124.7	34	177.5	-169.8	-68.1	-144.1	0.1	110.6
78	F	33	Very low	35.2	Very low	165 Å²	165	148.3 Å²	148.3	72%	0.724	78%	0.777	S	S	*	*			trans	43.1	164.1	151.8	-70.3	-95.2	0	0	0	122.3
79	H	38.5	Very low	35.6	Very low	143 Å²	143	149.7 Å²	149.7	66%	0.662	78%	0.778	S	S	*	*			cis	-135.8	144.4	2.9	-97.5	-76.6	0	0	0	107.8
80	E	36.4	Very low	35.7	Very low	141 Å²	141	149.7 Å²	149.7	66%	0.659	77%	0.773	S	S	*	*				64.5	142.2	83.7	-89	169	-166.3	0	0	115.5
81	C	36.5	Very low	35.5	Very low	99 Å²	99	147.8 Å²	147.8	67%	0.669	77%	0.771	S	S	*	*			cis	-145.6	152.2	16.4	-99.2	0	0	0	0	111
82	N	35.8	Very low	35.7	Very low	148 Å²	148	148.6 Å²	148.6	79%	0.791	78%	0.78	S	S	*	*				60.5	138	76.5	-54.9	-40	0	0	0	115.6
83	G	36.1	Very low	35.5	Very low	72 Å²	72	147.2 Å²	147.2	74%	0.742	78%	0.777	S	S	*	*			cis	-138.4	-145.2	-4.5	0	0	0	0	0	110.4
84	S	36.6	Very low	35.6	Very low	115 Å²	115	147.9 Å²	147.9	80%	0.804	79%	0.787	S	S	*	*			cis	-162.7	150.3	-2.3	-71.4	0	0	0	0	107.9
85	A	37.8	Very low	35.5	Very low	85 Å²	85	143 Å²	143	70%	0.702	79%	0.787	S	S	*	*				59	134.4	78.7	0	0	0	0	0	115.4
86	D	37.6	Very low	35.4	Very low	153 Å²	153	139.2 Å²	139.2	82%	0.818	79%	0.785	S	S	*	*			cis	-160.7	160	5.1	-108.8	-35.3	0	0	0	112
87	L	39	Very low	35.3	Very low	170 Å²	170	141.1 Å²	141.1	89%	0.89	79%	0.792	S	S	*	*			trans	174.2	150.5	132.6	-97.7	163.2	0	0	0	113.9
88	R	32	Very low	35.4	Very low	229 Å²	229	139.5 Å²	139.5	86%	0.864	79%	0.794	S	S	*	*			trans	-141.5	149.4	175.6	-82.2	-179.8	166.9	-174.4	-3.1	110
89	D	37.6	Very low	35.4	Very low	146 Å²	146	141.1 Å²	141.1	78%	0.781	80%	0.8	S	S	*	*			trans	169.9	155.5	148.2	-96.2	-2.1	0	0	0	108.9
90	N	38.4	Very low	35.3	Very low	135 Å²	135	140 Å²	140	72%	0.722	81%	0.806	S	S	*	*			cis	-147.5	170	-2.2	-135.3	-50.2	0	0	0	111.3
91	F	31	Very low	35.4	Very low	195 Å²	195	139 Å²	139	86%	0.855	81%	0.814	S	S	*	*			trans	-89.1	147.9	179.9	-95.7	-107.8	0	0	0	113.8
92	S	35.9	Very low	35.5	Very low	129 Å²	129	138.2 Å²	138.2	90%	0.902	82%	0.815	S	S	*	*			trans	-172.4	159.8	131.1	-85.8	0	0	0	0	112.6
93	S	31.5	Very low	35.6	Very low	122 Å²	122	136 Å²	136	85%	0.853	81%	0.809	S	S	*	*			trans	-118.1	146.5	-165.3	53.3	0	0	0	0	114.7
94	S	35.2	Very low	35.9	Very low	125 Å²	125	138.6 Å²	138.6	87%	0.874	81%	0.813	S	S	*	*			trans	-151.2	150.6	145.5	73.1	0	0	0	0	109.2
95	S	29.9	Very low	36.1	Very low	121 Å²	121	138.6 Å²	138.6	85%	0.846	81%	0.808	S	S	*	*			trans	-110	121.7	-167.5	56.2	0	0	0	0	113.2
96	S	33	Very low	36.1	Very low	116 Å²	116	139.1 Å²	139.1	81%	0.811	80%	0.803	S	S	*	*			trans	-144.7	124.5	153.8	-162	0	0	0	0	108.4	E98	S96-E98 PolarHBondContact O-N 3.1Å
97	V	33.5	Very low	36.4	Very low	142 Å²	142	137.4 Å²	137.4	86%	0.861	80%	0.801	S	S	*	*			trans	-91	98.2	-177.9	178.7	0	0	0	0	108.3
98	E	38	Very low	36.4	Very low	179 Å²	179	137.6 Å²	137.6	84%	0.836	79%	0.794	S	S	*	*			trans	-65.2	144.1	169.4	-67.3	-160.4	136.5	0	0	110.9	S96	S96-E98 PolarHBondContact O-N 3.1Å
99	K	33.3	Very low	36.6	Very low	199 Å²	199	131.2 Å²	131.2	87%	0.865	78%	0.783	S	S	*	*			trans	-94.2	115.8	-168	-171.3	178.4	-176.9	-179.4	0	108.7
100	P	36.2	Very low	36.9	Very low	120 Å²	120	133.8 Å²	133.8	78%	0.779	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-60.2	142.8	-179.2	24.5	-33.4	0	0	0	110.8
101	S	37.8	Very low	36.8	Very low	118 Å²	118	134.6 Å²	134.6	83%	0.825	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-63.9	147.3	-178.9	45.3	0	0	0	0	111.8
102	A	39.9	Very low	37	Very low	84 Å²	84	132.8 Å²	132.8	69%	0.694	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-69.1	143.4	175.2	0	0	0	0	0	110.6
103	P	37.7	Very low	37.1	Very low	102 Å²	102	133 Å²	133	66%	0.662	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-64.1	155.9	175.6	28	-35.2	0	0	0	111.6
104	P	42.7	Very low	37	Very low	126 Å²	126	132.1 Å²	132.1	82%	0.818	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-60.1	142.9	179.5	25.3	-34.4	0	0	0	112
105	V	40.7	Very low	37	Very low	115 Å²	115	133.8 Å²	133.8	70%	0.697	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-74	131.4	179.5	-177.4	0	0	0	0	109.2
106	P	36.8	Very low	37.1	Very low	95 Å²	95	133.5 Å²	133.5	62%	0.617	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-63.3	149.8	177.9	26	-34.6	0	0	0	111.8
107	P	43.6	Very low	37.1	Very low	118 Å²	118	138 Å²	138	77%	0.766	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-63.6	159.7	178.2	27.6	-35	0	0	0	111.9
108	K	39.3	Very low	37.1	Very low	173 Å²	173	140.2 Å²	140.2	75%	0.752	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-58.2	135.4	173.5	-68.2	-178	178.1	-177.9	0	109.7	R110	K108-R110 PolarHBondContact O-N 2.77Å
109	P	36.1	Very low	36.6	Very low	96 Å²	96	139.8 Å²	139.8	62%	0.623	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-60.9	130.3	167.9	26.5	-33.1	0	0	0	109.4	L111	P109-L111 PolarHBondContact O-N 2.77Å
110	R	43.8	Very low	36.6	Very low	199 Å²	199	137.8 Å²	137.8	75%	0.751	77%	0.768	S	S	*	*			trans	-75.7	99.9	172	-69.7	-177.8	-178.9	160.6	3.3	108.2	K108 I112 D259	K108-R110 PolarHBondContact O-N 2.77Å; R110-I112 PolarHBondContact O-N 2.91Å; R110-D259 IonicContact CZ-OD2 2.65Å; R110-D259 IonicContact NH1-OD1 3.98Å; R110-D259 IonicContact NH1-OD2 2.59Å; R110-D259 PolarHBondContact NH1-OD2 3.34Å; R110-D259 IonicContact NH2-OD2 2.8Å; R110-D259 PolarHBondContact NH2-OD2 2.85Å
111	L	37.8	Very low	36.1	Very low	153 Å²	153	140.1 Å²	140.1	80%	0.801	77%	0.769	S	S	*	*			trans	-60.7	134.2	166.9	-89.2	163.8	0	0	0	109.5	P109 N113	P109-L111 PolarHBondContact O-N 2.77Å; L111-N113 VanDerWaalsContact C-N 3.28Å; L111-N113 PolarHBondContact O-N 2.95Å
112	I	35.5	Very low	35.9	Very low	156 Å²	156	140.8 Å²	140.8	80%	0.8	77%	0.768	S	S	*	*			trans	-81.1	73.8	-170.4	-52.1	172	0	0	0	110	R110	R110-I112 PolarHBondContact O-N 2.91Å
113	N	36.5	Very low	35.5	Very low	135 Å²	135	142.6 Å²	142.6	72%	0.722	78%	0.775	S	S	*	*			trans	-81.3	118.5	169.6	-73.3	15.7	0	0	0	109.2	L111 L115	L111-N113 VanDerWaalsContact C-N 3.28Å; L111-N113 PolarHBondContact O-N 2.95Å; N113-L115 PolarHBondContact O-N 2.87Å
114	A	31	Very low	35	Very low	103 Å²	103	141.4 Å²	141.4	85%	0.851	78%	0.782	S	S	*	*			trans	-66	104.6	-175.2	0	0	0	0	0	112.4
115	L	34.6	Very low	34.4	Very low	159 Å²	159	144.5 Å²	144.5	83%	0.832	79%	0.785	S	S	*	*			trans	-81.4	128.3	173.7	-81.1	164.3	0	0	0	111.1	N113	N113-L115 PolarHBondContact O-N 2.87Å
116	P	32	Very low	33.9	Very low	116 Å²	116	145.7 Å²	145.7	75%	0.753	79%	0.793	S	S	*	*			trans	-66.1	132.2	173.5	-19.1	32.1	0	0	0	111.6
117	K	32.6	Very low	33.7	Very low	210 Å²	210	147.1 Å²	147.1	91%	0.913	80%	0.799	S	S	*	*			trans	-84.3	108.4	168.9	-66.7	-175.7	178.1	-176.3	0	109.3
118	E	32.5	Very low	33.3	Very low	189 Å²	189	148.4 Å²	148.4	88%	0.883	80%	0.8	S	S	*	*			trans	-75.8	156.4	166.9	-66.7	-148.6	151.5	0	0	111.6
119	H	28.1	Very low	32.9	Very low	170 Å²	170	149.4 Å²	149.4	79%	0.787	81%	0.807	S	S	*	*			trans	-101.1	114.6	-165	-140.6	62.3	0	0	0	110.3
120	I	32.9	Very low	32.8	Very low	156 Å²	156	154 Å²	154	80%	0.8	82%	0.82	S	S	*	*			trans	-103.9	111.7	165.9	-61.8	-179.8	0	0	0	107.7
121	Q	26.6	Very low	32.4	Very low	170 Å²	170	150.8 Å²	150.8	79%	0.794	82%	0.822	S	S	*	*			trans	-84.4	126.4	171.1	-67.8	177.7	-28.2	0	0	109.3
122	T	32.6	Very low	32.3	Very low	131 Å²	131	147.6 Å²	147.6	80%	0.804	82%	0.818	S	S	*	*			trans	-131.4	125.8	165.7	-13.4	0	0	0	0	108.8
123	S	32.5	Very low	32.4	Very low	122 Å²	122	148.1 Å²	148.1	85%	0.853	82%	0.822	S	S	*	*			trans	-72.4	132.6	-168.5	-41.3	0	0	0	0	112.4
124	G	26.9	Very low	32.9	Very low	77 Å²	77	145.6 Å²	145.6	79%	0.794	81%	0.809	S	S	*	*			trans	-74.3	136.4	161.9	0	0	0	0	0	110.9
125	Q	31.3	Very low	33.6	Very low	192 Å²	192	144.9 Å²	144.9	90%	0.897	80%	0.796	S	S	*	*			trans	-123.6	125.8	163	-108	-175.4	-54.2	0	0	109.2
126	V	28.9	Very low	34.1	Very low	140 Å²	140	142.2 Å²	142.2	85%	0.848	78%	0.781	S	S	*	*			trans	-83.3	134.7	-179.3	177.2	0	0	0	0	109.4
127	V	33.8	Very low	35	Very low	124 Å²	124	140.6 Å²	140.6	75%	0.752	77%	0.769	S	S	*	*			trans	-137.9	97.3	165.8	-158.9	0	0	0	0	110.6
128	N	33.3	Very low	35.7	Very low	146 Å²	146	136.1 Å²	136.1	78%	0.781	75%	0.751	S	S	*	*			trans	53.7	125.4	150.4	-54.5	-1.2	0	0	0	121
129	E	31.4	Very low	36.5	Very low	193 Å²	193	132 Å²	132	90%	0.902	73%	0.733	S	S	*	*			trans	-79	139.7	162.3	-59.4	162.2	101.7	0	0	110.8
130	E	34.4	Very low	38.1	Very low	192 Å²	192	128.9 Å²	128.9	90%	0.897	72%	0.723	S	S	*	*			trans	-152.7	94.6	150.2	-134.7	167.4	-156.8	0	0	112.6
131	V	35.8	Very low	39.7	Very low	132 Å²	132	125.9 Å²	125.9	80%	0.8	71%	0.708	S	S	*	*			trans	26.2	120	145.3	-171.8	0	0	0	0	120.1
132	A	35.5	Very low	41.4	Very low	87 Å²	87	122.6 Å²	122.6	72%	0.719	69%	0.692	S	S	*	*				-177.7	109.5	124.2	0	0	0	0	0	114.1	N134	A132-N134 PolarHBondContact O-N 2.88Å
133	D	37.9	Very low	42.4	Very low	166 Å²	166	122.9 Å²	122.9	89%	0.888	68%	0.683	S	S	*	*			trans	20.7	75.6	148.6	-59.3	1.8	0	0	0	119.3
134	N	45.9	Very low	43.7	Very low	82 Å²	82	120.4 Å²	120.4	44%	0.439	67%	0.665	S	S	.	*			trans	-136.3	108	162.2	-170.3	-19.1	0	0	0	112.1	A132 I136 V137 E138	A132-N134 PolarHBondContact O-N 2.88Å; N134-I136 PolarHBondContact O-N 3.44Å; N134-I136 VanDerWaalsContact O-N 3.13Å; N134-I136 WeakPolarHBondContact OD1-CB 3.44Å; N134-I136 PolarHBondContact OD1-N 2.73Å; N134-I136 VanDerWaalsContact OD1-N 3.12Å; N134-V137 HydrophobicContact CB-CG2 4.08Å; N134-V137 PolarHBondContact O-N 3.27Å; N134-E138 PolarHBondContact O-N 2.95Å
135	P	45.6	Very low	45.5	Very low	89 Å²	89	124.3 Å²	124.3	58%	0.578	66%	0.656	S	S	*	*	H	α-helix	trans	-66.8	-16.9	-174.8	27.7	-35.5	0	0	0	113.8	M139	P135-M139 WeakPolarHBondContact O-CB 3.36Å; P135-M139 WeakPolarHBondContact O-CG 3.39Å; P135-M139 PolarHBondContact O-N 3.4Å
136	I	45.7	Very low	46.5	Very low	102 Å²	102	120 Å²	120	52%	0.523	64%	0.639	S	S	.	*	H	α-helix	trans	-70.2	-38.9	174.3	-57.4	175.9	0	0	0	110.3	N134 M139 N140	N134-I136 PolarHBondContact O-N 3.44Å; N134-I136 VanDerWaalsContact O-N 3.13Å; N134-I136 WeakPolarHBondContact OD1-CB 3.44Å; N134-I136 PolarHBondContact OD1-N 2.73Å; N134-I136 VanDerWaalsContact OD1-N 3.12Å; I136-M139 PolarHBondContact O-N 3.39Å; I136-N140 PolarHBondContact O-N 2.91Å
137	V	51.4	Low	47.8	Very low	82 Å²	82	116.3 Å²	116.3	50%	0.497	62%	0.616	S	S	.	*	H	α-helix	trans	-69.7	-40	177.5	-177.5	0	0	0	0	110.2	N134 N140 L141	N134-V137 HydrophobicContact CB-CG2 4.08Å; N134-V137 PolarHBondContact O-N 3.27Å; V137-N140 PolarHBondContact O-N 2.81Å; V137-L141 HydrophobicContact CG1-CD1 4.1Å; V137-L141 WeakPolarHBondContact O-CB 3.45Å; V137-L141 WeakPolarHBondContact O-CG 3.45Å; V137-L141 PolarHBondContact O-N 2.85Å
138	E	47.7	Very low	48.8	Very low	116 Å²	116	114.1 Å²	114.1	54%	0.542	61%	0.606	S	S	.	*	H	α-helix	trans	-64.1	-44	174.9	-166.8	-179	172.9	0	0	112.1	N134 N140 L141 Q142	N134-E138 PolarHBondContact O-N 2.95Å; E138-N140 PolarHBondContact O-N 3.18Å; E138-L141 PolarHBondContact O-N 2.72Å; E138-Q142 WeakPolarHBondContact O-CG 3.45Å; E138-Q142 PolarHBondContact O-N 2.93Å; E138-Q142 PolarHBondContact OE1-NE2 3.21Å
139	M	48.6	Very low	49.5	Very low	102 Å²	102	113.4 Å²	113.4	50%	0.502	60%	0.599	S	S	.	*	H	α-helix	trans	-60.6	-44.4	174.8	-77.1	-172.8	-63.4	0	0	112.2	P135 I136 L141 Q142 F143	P135-M139 WeakPolarHBondContact O-CB 3.36Å; P135-M139 WeakPolarHBondContact O-CG 3.39Å; P135-M139 PolarHBondContact O-N 3.4Å; I136-M139 PolarHBondContact O-N 3.39Å; M139-L141 VanDerWaalsContact C-N 3.34Å; M139-L141 PolarHBondContact O-N 2.96Å; M139-Q142 PolarHBondContact O-N 3.21Å; M139-F143 WeakPolarHBondContact O-CB 3.31Å; M139-F143 PolarHBondContact O-N 3.05Å
140	N	62	Low	50.1	Low	106 Å²	106	111.3 Å²	111.3	57%	0.567	59%	0.591	S	S	*	*	H	α-helix	trans	-65.1	-35.3	177.2	-77.3	3.9	0	0	0	112.6	I136 V137 E138 S144	I136-N140 PolarHBondContact O-N 2.91Å; V137-N140 PolarHBondContact O-N 2.81Å; E138-N140 PolarHBondContact O-N 3.18Å; N140-S144 WeakPolarHBondContact O-CB 3.37Å; N140-S144 PolarHBondContact O-N 2.75Å; N140-S144 PolarHBondContact O-OG 3.21Å
141	L	65.2	Low	50.7	Low	92 Å²	92	109.7 Å²	109.7	48%	0.482	58%	0.583	S	S	.	*	H	α-helix	trans	-68.5	-40.6	172.4	-77.1	167.3	0	0	0	112.4	V137 E138 M139 R145	V137-L141 HydrophobicContact CG1-CD1 4.1Å; V137-L141 WeakPolarHBondContact O-CB 3.45Å; V137-L141 WeakPolarHBondContact O-CG 3.45Å; V137-L141 PolarHBondContact O-N 2.85Å; E138-L141 PolarHBondContact O-N 2.72Å; M139-L141 VanDerWaalsContact C-N 3.34Å; M139-L141 PolarHBondContact O-N 2.96Å; L141-R145 WeakPolarHBondContact O-CG 3.32Å; L141-R145 PolarHBondContact O-N 3.33Å; L141-R145 VanDerWaalsContact O-N 3.11Å
142	Q	62.9	Low	50.9	Low	102 Å²	102	107.8 Å²	107.8	48%	0.477	58%	0.576	S	S	.	*	H	α-helix	trans	-64.6	-45.2	174.7	-72.5	-174.6	19.6	0	0	111.1	E138 M139 S144 R145 L146	E138-Q142 WeakPolarHBondContact O-CG 3.45Å; E138-Q142 PolarHBondContact O-N 2.93Å; E138-Q142 PolarHBondContact OE1-NE2 3.21Å; M139-Q142 PolarHBondContact O-N 3.21Å; Q142-S144 PolarHBondContact O-N 2.7Å; Q142-R145 PolarHBondContact O-N 3.49Å; Q142-L146 WeakPolarHBondContact O-CB 3.34Å; Q142-L146 PolarHBondContact O-N 3.39Å
143	F	54.7	Low	50.8	Low	136 Å²	136	106.8 Å²	106.8	60%	0.596	57%	0.574	S	S	*	*	H	α-helix	trans	-61	-44.6	177.7	-154.8	-84.7	0	0	0	111.7	M139 R145 L146 V147	M139-F143 WeakPolarHBondContact O-CB 3.31Å; M139-F143 PolarHBondContact O-N 3.05Å; F143-R145 VanDerWaalsContact C-N 3.33Å; F143-R145 PolarHBondContact O-N 2.97Å; F143-L146 PolarHBondContact O-N 3.02Å; F143-V147 HydrophobicContact CD1-CG2 4.06Å; F143-V147 HydrophobicContact CE1-CG2 4.05Å; F143-V147 WeakPolarHBondContact O-CG2 3.23Å; F143-V147 PolarHBondContact O-N 2.96Å
144	S	60.1	Low	50.6	Low	70 Å²	70	103.2 Å²	103.2	49%	0.49	57%	0.567	S	S	.	*	H	α-helix	trans	-61.3	-38.1	176.8	-56.8	0	0	0	0	112.9	N140 Q142 S148	N140-S144 WeakPolarHBondContact O-CB 3.37Å; N140-S144 PolarHBondContact O-N 2.75Å; N140-S144 PolarHBondContact O-OG 3.21Å; Q142-S144 PolarHBondContact O-N 2.7Å; S144-S148 WeakPolarHBondContact O-CB 3.45Å; S144-S148 PolarHBondContact O-N 3.43Å; S144-S148 PolarHBondContact O-OG 2.93Å
145	R	63.2	Low	50	Low	159 Å²	159	110.9 Å²	110.9	60%	0.6	59%	0.591	S	S	*	*	H	α-helix	trans	-66.7	-45.7	173	-73.3	174.2	-176.2	163.2	2.9	111.7	L141 Q142 F143 V147 S148 E149	L141-R145 WeakPolarHBondContact O-CG 3.32Å; L141-R145 PolarHBondContact O-N 3.33Å; L141-R145 VanDerWaalsContact O-N 3.11Å; Q142-R145 PolarHBondContact O-N 3.49Å; F143-R145 VanDerWaalsContact C-N 3.33Å; F143-R145 PolarHBondContact O-N 2.97Å; R145-V147 PolarHBondContact O-N 3.37Å; R145-S148 CarbonylContact O-C 3.57Å; R145-S148 WeakPolarHBondContact O-CB 3.38Å; R145-S148 PolarHBondContact O-N 3.44Å; R145-S148 VanDerWaalsContact O-N 3.12Å; R145-E149 WeakPolarHBondContact O-CB 3.39Å; R145-E149 WeakPolarHBondContact O-CG 3.37Å; R145-E149 PolarHBondContact O-N 3.09Å
146	L	51.9	Low	49.1	Very low	102 Å²	102	112 Å²	112	53%	0.534	60%	0.601	S	S	.	*	H	α-helix	trans	-63.2	-40	-176.5	-135.2	158.5	0	0	0	112.1	Q142 F143 E149 M150	Q142-L146 WeakPolarHBondContact O-CB 3.34Å; Q142-L146 PolarHBondContact O-N 3.39Å; F143-L146 PolarHBondContact O-N 3.02Å; L146-E149 PolarHBondContact O-N 3.28Å; L146-M150 HydrophobicContact CD2-CG 4.38Å; L146-M150 HydrophobicContact CD2-SD 4.04Å; L146-M150 WeakPolarHBondContact O-CG 3.37Å; L146-M150 PolarHBondContact O-N 3.33Å
147	V	56.5	Low	48.5	Very low	63 Å²	63	113.5 Å²	113.5	38%	0.382	62%	0.615	S	S	.	*	H	α-helix	trans	-61.9	-49	171	174.3	0	0	0	0	111	F143 R145 E149 M150 E151	F143-V147 HydrophobicContact CD1-CG2 4.06Å; F143-V147 HydrophobicContact CE1-CG2 4.05Å; F143-V147 WeakPolarHBondContact O-CG2 3.23Å; F143-V147 PolarHBondContact O-N 2.96Å; R145-V147 PolarHBondContact O-N 3.37Å; V147-E149 VanDerWaalsContact C-N 3.29Å; V147-E149 PolarHBondContact O-N 3.04Å; V147-M150 PolarHBondContact O-N 3.13Å; V147-E151 PolarHBondContact O-N 3.3Å; V147-E151 VanDerWaalsContact O-N 3.14Å
148	S	54.4	Low	47.6	Very low	77 Å²	77	115.1 Å²	115.1	54%	0.538	63%	0.627	S	S	.	*	H	α-helix	trans	-61.4	-35.6	179.3	-55.7	0	0	0	0	113.1	S144 R145	S144-S148 WeakPolarHBondContact O-CB 3.45Å; S144-S148 PolarHBondContact O-N 3.43Å; S144-S148 PolarHBondContact O-OG 2.93Å; R145-S148 CarbonylContact O-C 3.57Å; R145-S148 WeakPolarHBondContact O-CB 3.38Å; R145-S148 PolarHBondContact O-N 3.44Å; R145-S148 VanDerWaalsContact O-N 3.12Å
149	E	48.7	Very low	46.7	Very low	132 Å²	132	115.7 Å²	115.7	62%	0.617	64%	0.644	S	S	*	*	H	α-helix	trans	-70.7	-41.5	176.8	-75.5	174	-173.3	0	0	111.3	R145 L146 V147 E151 S152	R145-E149 WeakPolarHBondContact O-CB 3.39Å; R145-E149 WeakPolarHBondContact O-CG 3.37Å; R145-E149 PolarHBondContact O-N 3.09Å; L146-E149 PolarHBondContact O-N 3.28Å; V147-E149 VanDerWaalsContact C-N 3.29Å; V147-E149 PolarHBondContact O-N 3.04Å; E149-E151 VanDerWaalsContact C-N 3.33Å; E149-E151 PolarHBondContact O-N 3.19Å; E149-S152 PolarHBondContact O-N 3.17Å; E149-S152 PolarHBondContact O-OG 2.98Å
150	M	43.9	Very low	46	Very low	149 Å²	149	120.8 Å²	120.8	73%	0.734	66%	0.663	S	S	*	*	H	α-helix	trans	-63.3	-34.1	176.2	-75.2	179	64.5	0	0	113.3	L146 V147 S152	L146-M150 HydrophobicContact CD2-CG 4.38Å; L146-M150 HydrophobicContact CD2-SD 4.04Å; L146-M150 WeakPolarHBondContact O-CG 3.37Å; L146-M150 PolarHBondContact O-N 3.33Å; V147-M150 PolarHBondContact O-N 3.13Å; M150-S152 VanDerWaalsContact C-N 3.28Å; M150-S152 PolarHBondContact O-N 3.45Å
151	E	46.4	Very low	44.7	Very low	158 Å²	158	120.3 Å²	120.3	74%	0.738	67%	0.668	S	S	*	*	H	α-helix	trans	-73.7	-15.6	177.5	-69.6	-176.8	169.3	0	0	113.9	V147 E149	V147-E151 PolarHBondContact O-N 3.3Å; V147-E151 VanDerWaalsContact O-N 3.14Å; E149-E151 VanDerWaalsContact C-N 3.33Å; E149-E151 PolarHBondContact O-N 3.19Å
152	S	40.6	Very low	43.2	Very low	92 Å²	92	123.3 Å²	123.3	64%	0.643	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.4	-6.9	-172.7	74.3	0	0	0	0	115.7	E149 M150 A154	E149-S152 PolarHBondContact O-N 3.17Å; E149-S152 PolarHBondContact O-OG 2.98Å; M150-S152 VanDerWaalsContact C-N 3.28Å; M150-S152 PolarHBondContact O-N 3.45Å; S152-A154 VanDerWaalsContact C-N 3.34Å; S152-A154 PolarHBondContact O-N 3.07Å; S152-A154 VanDerWaalsContact O-N 3.09Å
153	G	32.7	Very low	41.7	Very low	66 Å²	66	128.5 Å²	128.5	68%	0.68	70%	0.695	S	S	*	*			trans	-78.6	17.5	-162.4	0	0	0	0	0	118.8
154	A	34.7	Very low	40.7	Very low	90 Å²	90	127.4 Å²	127.4	74%	0.744	70%	0.702	S	S	*	*			trans	-105.5	126.9	-172.1	0	0	0	0	0	114.3	S152	S152-A154 VanDerWaalsContact C-N 3.34Å; S152-A154 PolarHBondContact O-N 3.07Å; S152-A154 VanDerWaalsContact O-N 3.09Å
155	Y	32.4	Very low	39.7	Very low	243 Å²	243	129.7 Å²	129.7	95%	0.953	72%	0.715	S	S	*	*			trans	-73.3	157.2	-177.5	-82.7	-104.3	0	0	0	114.2
156	S	28	Very low	38.3	Very low	113 Å²	113	128.6 Å²	128.6	79%	0.79	73%	0.726	S	S	*	*			trans	-131.5	142.1	-175.3	-178.7	0	0	0	0	113.2
157	V	33.3	Very low	37.3	Very low	133 Å²	133	127.5 Å²	127.5	81%	0.806	73%	0.732	S	S	*	*			trans	-144.1	135.2	175.8	-174.4	0	0	0	0	109.4
158	P	32	Very low	36.3	Very low	117 Å²	117	130.3 Å²	130.3	76%	0.76	75%	0.749	S	S	*	*			trans	-95.4	168.9	-168.3	36.9	-37.3	0	0	0	115.8
159	S	29.1	Very low	35.2	Very low	127 Å²	127	132.6 Å²	132.6	89%	0.888	76%	0.755	S	S	*	*			trans	-153.1	162.5	172.4	-85.8	0	0	0	0	114.5
160	K	34.3	Very low	34.5	Very low	210 Å²	210	132 Å²	132	91%	0.913	75%	0.752	S	S	*	*			trans	-154.1	149.9	179	-85.4	-179.9	175.9	178.1	0	107.8
161	S	34.6	Very low	33.9	Very low	95 Å²	95	132.6 Å²	132.6	66%	0.664	75%	0.753	S	S	*	*			cis	-168.2	137.6	-2.9	170.1	0	0	0	0	111.7
162	Q	33	Very low	33.3	Very low	155 Å²	155	131.4 Å²	131.4	72%	0.724	75%	0.747	S	S	*	*			trans	22	150.7	143.4	-58.6	-166.9	90.8	0	0	122.2
163	R	31.9	Very low	33.1	Very low	211 Å²	211	130.7 Å²	130.7	80%	0.796	74%	0.74	S	S	*	*			cis	176.8	-171.2	-1.7	-108.7	-170.9	175.3	-178.2	-3.1	107.9
164	P	33.2	Very low	33.1	Very low	114 Å²	114	137.2 Å²	137.2	74%	0.74	75%	0.745	S	S	*	*			cis	-130.6	-162.9	-45	41.2	-21	0	0	0	112.3
165	P	38.2	Very low	33.3	Very low	118 Å²	118	139.9 Å²	139.9	77%	0.766	74%	0.742	S	S	*	*			trans	-129.1	-174.4	-156.1	46.5	-35.1	0	0	0	118.9
166	T	33.9	Very low	33.5	Very low	136 Å²	136	134.2 Å²	134.2	83%	0.834	73%	0.728	S	S	*	*			trans	-167	123.9	155.1	23.1	0	0	0	0	110.4
167	A	32	Very low	33.8	Very low	79 Å²	79	134.7 Å²	134.7	65%	0.653	73%	0.726	S	S	*	*				74.5	143.5	96	0	0	0	0	0	115.8
168	V	35.3	Very low	33.9	Very low	122 Å²	122	133.7 Å²	133.7	74%	0.739	72%	0.722	S	S	*	*			cis	-171.4	171.5	3.3	-87	0	0	0	0	108.3
169	D	31.7	Very low	33.9	Very low	124 Å²	124	137 Å²	137	66%	0.663	73%	0.727	S	S	*	*			cis	-170.8	166	-24.1	-86.6	-3.5	0	0	0	109.8
170	E	33.1	Very low	33.9	Very low	119 Å²	119	142.9 Å²	142.9	56%	0.556	73%	0.73	S	S	*	*			trans	61.9	152.6	167.2	-50.7	-45.9	102.5	0	0	121.4	K201	E170-K201 IonicContact OE1-NZ 2.73Å; E170-K201 PolarHBondContact OE1-NZ 3.27Å; E170-K201 IonicContact OE2-NZ 3.69Å; E170-K201 PolarHBondContact OE2-NZ 3.37Å
171	E	32.3	Very low	34	Very low	163 Å²	163	140.5 Å²	140.5	76%	0.762	73%	0.727	S	S	*	*			cis	-161.1	164.9	-1.1	-136.5	-177.8	161.5	0	0	113.9
172	E	32.5	Very low	34.2	Very low	132 Å²	132	142.3 Å²	142.3	62%	0.617	73%	0.734	S	S	*	*			trans	-100.3	-147	175.8	-144.3	-135.1	125.9	0	0	111	R174	E172-R174 PolarHBondContact OE1-N 3.31Å
173	P	36.2	Very low	34.4	Very low	77 Å²	77	144.4 Å²	144.4	50%	0.5	74%	0.737	S	S	.	*			cis	-137.2	-173.1	-16.9	29.3	-4	0	0	0	118.3
174	R	34.1	Very low	35.1	Very low	204 Å²	204	139.9 Å²	139.9	77%	0.77	72%	0.724	S	S	*	*			trans	113.3	156.4	148.2	-62.6	167.4	-159.8	-141.8	3.1	119.2	E172	E172-R174 PolarHBondContact OE1-N 3.31Å
175	E	38.7	Very low	35.8	Very low	146 Å²	146	136.3 Å²	136.3	68%	0.682	70%	0.702	S	S	*	*			cis	-160.3	152.4	9.6	-134.9	-177	125.8	0	0	116.8
176	N	35.3	Very low	36.2	Very low	123 Å²	123	137.6 Å²	137.6	66%	0.658	69%	0.692	S	S	*	*			trans	46	147.4	137	-84.5	-13.9	0	0	0	125.5
177	V	34.7	Very low	36.9	Very low	123 Å²	123	138.7 Å²	138.7	75%	0.745	68%	0.681	S	S	*	*			cis	-143	-82.4	-15.3	-129.7	0	0	0	0	117.7
178	P	35.9	Very low	37.7	Very low	113 Å²	113	140.7 Å²	140.7	73%	0.734	67%	0.672	S	S	*	*			trans	-136	146.8	-132.4	40	-23.1	0	0	0	121.7
179	Q	32	Very low	38.1	Very low	185 Å²	185	136.7 Å²	136.7	86%	0.864	65%	0.649	S	S	*	*			trans	-156.5	136.9	136.5	-116.2	-179	23.7	0	0	113.6
180	R	28.8	Very low	38.9	Very low	252 Å²	252	140 Å²	140	95%	0.951	65%	0.654	S	S	*	*			trans	10	98.7	172	-71.8	-179.1	170.1	168.9	-3	119
181	N	37	Very low	39.9	Very low	159 Å²	159	136.5 Å²	136.5	85%	0.85	64%	0.642	S	S	*	*			trans	-87.8	138.5	166.4	-83.2	8.7	0	0	0	113.7
182	V	38.4	Very low	40.7	Very low	133 Å²	133	132.9 Å²	132.9	81%	0.806	62%	0.622	S	S	*	*			trans	-70.9	156.7	159.5	175.6	0	0	0	0	109.1	E184	V182-E184 PolarHBondContact O-N 3.1Å
183	Y	36.6	Very low	41.2	Very low	200 Å²	200	132.5 Å²	132.5	78%	0.784	62%	0.615	S	S	*	*			trans	-67.5	99.1	172.3	178.3	-98.4	0	0	0	110.7
184	E	47.2	Very low	42	Very low	115 Å²	115	131 Å²	131	54%	0.537	61%	0.609	S	S	.	*			trans	-96.5	130	171	-173.1	169.5	-124.7	0	0	109.9	V182 Y186 R188	V182-E184 PolarHBondContact O-N 3.1Å; E184-Y186 PolarHBondContact O-N 3.36Å; E184-R188 HydrophobicContact CG-CB 4.11Å
185	P	47	Very low	43.1	Very low	40 Å²	40	130.9 Å²	130.9	26%	0.26	61%	0.609	S	S	.	*			trans	-59.8	131.5	178.3	-24.3	34.3	0	0	0	111.9	W187 R188	P185-W187 HydrophobicContact CB-CD2 4.33Å; P185-W187 HydrophobicContact CB-CG 4.4Å; P185-W187 HydrophobicContact CB-CZ2 4.15Å; P185-W187 VanDerWaalsContact CB-NE1 3.34Å; P185-W187 HydrophobicContact CG-CZ2 4.42Å; P185-W187 PolarHBondContact O-N 2.8Å; P185-R188 WeakPolarHBondContact O-CB 3.5Å; P185-R188 PolarHBondContact O-N 3.06Å
186	Y	48.2	Very low	43.3	Very low	144 Å²	144	130.9 Å²	130.9	57%	0.565	60%	0.603	S	S	*	*	G	3₁₀ helix	trans	-53.5	-30.4	-171.9	65.6	-89.4	0	0	0	114.7	E184 R188 S189	E184-Y186 PolarHBondContact O-N 3.36Å; Y186-R188 PolarHBondContact O-N 2.94Å; Y186-S189 PolarHBondContact O-N 3.17Å
187	W	47.6	Very low	44	Very low	159 Å²	159	131.4 Å²	131.4	60%	0.602	60%	0.596	S	S	*	*	G	3₁₀ helix	trans	-71.6	-9.6	177.6	56.9	-98.9	0	0	0	114.4	P185	P185-W187 HydrophobicContact CB-CD2 4.33Å; P185-W187 HydrophobicContact CB-CG 4.4Å; P185-W187 HydrophobicContact CB-CZ2 4.15Å; P185-W187 VanDerWaalsContact CB-NE1 3.34Å; P185-W187 HydrophobicContact CG-CZ2 4.42Å; P185-W187 PolarHBondContact O-N 2.8Å
188	R	48.6	Very low	44.2	Very low	121 Å²	121	128.2 Å²	128.2	46%	0.457	59%	0.588	S	S	.	*	G	3₁₀ helix	trans	-91.5	-17.5	169.6	-70.5	-169	156.2	-131.1	-11.3	113.7	E184 P185 Y186 Y190	E184-R188 HydrophobicContact CG-CB 4.11Å; P185-R188 WeakPolarHBondContact O-CB 3.5Å; P185-R188 PolarHBondContact O-N 3.06Å; Y186-R188 PolarHBondContact O-N 2.94Å; R188-Y190 PolarHBondContact O-N 2.8Å
189	S	45.2	Very low	44.2	Very low	38 Å²	38	126.8 Å²	126.8	27%	0.266	59%	0.586	S	S	.	*			trans	-82.6	104.9	-175.4	-163.4	0	0	0	0	111.5	Y186 S191 W192	Y186-S189 PolarHBondContact O-N 3.17Å; S189-S191 PolarHBondContact O-N 2.86Å; S189-S191 PolarHBondContact OG-OG 2.86Å; S189-W192 WeakPolarHBondContact O-CB 3.39Å; S189-W192 PolarHBondContact O-N 2.92Å
190	Y	47	Very low	44.3	Very low	195 Å²	195	123.8 Å²	123.8	77%	0.765	57%	0.572	S	S	*	*	H	α-helix	trans	-45.7	-36	169.6	-175.5	-97	0	0	0	112.6	R188 W192 Y193 A194	R188-Y190 PolarHBondContact O-N 2.8Å; Y190-W192 PolarHBondContact O-N 3.24Å; Y190-W192 VanDerWaalsContact O-N 3.13Å; Y190-Y193 PolarHBondContact O-N 2.9Å; Y190-A194 PolarHBondContact O-N 2.67Å
191	S	54.7	Low	44.7	Very low	45 Å²	45	116.4 Å²	116.4	32%	0.315	55%	0.547	S	S	.	.	H	α-helix	trans	-63.9	-14.7	178.8	81.7	0	0	0	0	115.4	S189 R195	S189-S191 PolarHBondContact O-N 2.86Å; S189-S191 PolarHBondContact OG-OG 2.86Å; S191-R195 WeakPolarHBondContact O-CB 3.3Å; S191-R195 PolarHBondContact O-NE 3.02Å; S191-R195 PolarHBondContact OG-NH2 3.4Å
192	W	48.8	Very low	44.5	Very low	86 Å²	86	115.4 Å²	115.4	33%	0.326	55%	0.547	S	S	.	.	H	α-helix	trans	-82.1	-42.9	175.2	-175.3	90.5	0	0	0	111.6	S189 Y190 R196 Y197	S189-W192 WeakPolarHBondContact O-CB 3.39Å; S189-W192 PolarHBondContact O-N 2.92Å; Y190-W192 PolarHBondContact O-N 3.24Å; Y190-W192 VanDerWaalsContact O-N 3.13Å; W192-R196 VanDerWaalsContact O-CB 3.29Å; W192-R196 WeakPolarHBondContact O-CB 3.4Å; W192-R196 PolarHBondContact O-N 3.1Å; W192-Y197 HydrophobicContact CZ3-CE2 4.44Å
193	Y	43.2	Very low	44.5	Very low	124 Å²	124	114.7 Å²	114.7	49%	0.486	54%	0.543	S	S	.	.	H	α-helix	trans	-66	-47.9	176	-85.6	-91	0	0	0	110.9	Y190 R195 R196 Y197	Y190-Y193 PolarHBondContact O-N 2.9Å; Y193-R195 VanDerWaalsContact C-N 3.33Å; Y193-R195 PolarHBondContact O-N 3.09Å; Y193-R196 PolarHBondContact O-N 2.87Å; Y193-Y197 AromaticContact CD1-CD2 3.7Å; Y193-Y197 HydrophobicContact CD1-CD2 3.7Å; Y193-Y197 AromaticContact CD1-CE2 3.52Å; Y193-Y197 HydrophobicContact CD1-CE2 3.52Å; Y193-Y197 HydrophobicContact CE1-CD2 4.45Å; Y193-Y197 AromaticContact CE1-CE2 3.86Å; Y193-Y197 HydrophobicContact CE1-CE2 3.86Å; Y193-Y197 HydrophobicContact CG-CD2 4.44Å; Y193-Y197 HydrophobicContact CG-CE2 4.42Å; Y193-Y197 WeakPolarHBondContact O-CD2 3.43Å; Y193-Y197 PolarHBondContact O-N 2.9Å
194	A	53.3	Low	44.4	Very low	45 Å²	45	112.9 Å²	112.9	37%	0.372	55%	0.547	S	S	.	.	H	α-helix	trans	-55	-45.5	178	0	0	0	0	0	112.6	Y190 R196 G198	Y190-A194 PolarHBondContact O-N 2.67Å; A194-R196 VanDerWaalsContact C-N 3.29Å; A194-R196 PolarHBondContact O-N 2.73Å; A194-G198 PolarHBondContact O-N 3.44Å; A194-G198 VanDerWaalsContact O-N 3.17Å
195	R	56.7	Low	43.6	Very low	203 Å²	203	111 Å²	111	77%	0.766	56%	0.558	S	S	*	*	H	α-helix	trans	-72.2	-14	177.7	-82.3	-178	-76.9	-171.6	-9.1	115.2	S191 Y193	S191-R195 WeakPolarHBondContact O-CB 3.3Å; S191-R195 PolarHBondContact O-NE 3.02Å; S191-R195 PolarHBondContact OG-NH2 3.4Å; Y193-R195 VanDerWaalsContact C-N 3.33Å; Y193-R195 PolarHBondContact O-N 3.09Å
196	R	42.4	Very low	42.8	Very low	145 Å²	145	116 Å²	116	55%	0.547	58%	0.583	S	S	.	*	H	α-helix	trans	-105	-23.5	-175.9	-163.3	173.3	-151.3	-141.3	5.3	113.9	W192 Y193 A194	W192-R196 VanDerWaalsContact O-CB 3.29Å; W192-R196 WeakPolarHBondContact O-CB 3.4Å; W192-R196 PolarHBondContact O-N 3.1Å; Y193-R196 PolarHBondContact O-N 2.87Å; A194-R196 VanDerWaalsContact C-N 3.29Å; A194-R196 PolarHBondContact O-N 2.73Å
197	Y	49.9	Very low	41.8	Very low	134 Å²	134	116.1 Å²	116.1	53%	0.525	59%	0.588	S	S	.	*	H	α-helix	trans	-117.6	-5.9	-176.6	-61.1	-74.3	0	0	0	114.1	W192 Y193	W192-Y197 HydrophobicContact CZ3-CE2 4.44Å; Y193-Y197 AromaticContact CD1-CD2 3.7Å; Y193-Y197 HydrophobicContact CD1-CD2 3.7Å; Y193-Y197 AromaticContact CD1-CE2 3.52Å; Y193-Y197 HydrophobicContact CD1-CE2 3.52Å; Y193-Y197 HydrophobicContact CE1-CD2 4.45Å; Y193-Y197 AromaticContact CE1-CE2 3.86Å; Y193-Y197 HydrophobicContact CE1-CE2 3.86Å; Y193-Y197 HydrophobicContact CG-CD2 4.44Å; Y193-Y197 HydrophobicContact CG-CE2 4.42Å; Y193-Y197 WeakPolarHBondContact O-CD2 3.43Å; Y193-Y197 PolarHBondContact O-N 2.9Å
198	G	40	Very low	41.1	Very low	56 Å²	56	114.2 Å²	114.2	58%	0.577	59%	0.594	S	S	*	*			trans	89.2	126.2	174.1	0	0	0	0	0	112.8	A194	A194-G198 PolarHBondContact O-N 3.44Å; A194-G198 VanDerWaalsContact O-N 3.17Å
199	A	35.5	Very low	40.1	Very low	83 Å²	83	117.2 Å²	117.2	69%	0.686	61%	0.605	S	S	*	*			trans	-89.8	163.2	145.3	0	0	0	0	0	107.8
200	E	34.7	Very low	39.5	Very low	123 Å²	123	123.2 Å²	123.2	58%	0.575	63%	0.631	S	S	*	*			trans	67.2	151.8	-172.8	-39.7	-168.4	138.2	0	0	113.9
201	K	36.3	Very low	39.1	Very low	96 Å²	96	119.5 Å²	119.5	42%	0.417	63%	0.628	S	S	.	*			cis	-122.5	142	10	-69	163.1	-176	128.3	0	110.9	E170 V203	E170-K201 IonicContact OE1-NZ 2.73Å; E170-K201 PolarHBondContact OE1-NZ 3.27Å; E170-K201 IonicContact OE2-NZ 3.69Å; E170-K201 PolarHBondContact OE2-NZ 3.37Å; K201-V203 PolarHBondContact O-N 3.03Å
202	T	32.8	Very low	38.5	Very low	139 Å²	139	119.8 Å²	119.8	85%	0.853	64%	0.639	S	S	*	*			trans	-71.8	114.6	173.5	44.6	0	0	0	0	109.7
203	V	38.5	Very low	38.6	Very low	118 Å²	118	119.1 Å²	119.1	72%	0.715	64%	0.644	S	S	*	*			trans	-98.9	120.1	167	180	0	0	0	0	107.4	K201	K201-V203 PolarHBondContact O-N 3.03Å
204	D	34.4	Very low	39.4	Very low	162 Å²	162	119.5 Å²	119.5	87%	0.866	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.1	135.2	177.6	-65	-67.1	0	0	0	111.2
205	G	30.6	Very low	40	Very low	76 Å²	76	122.9 Å²	122.9	78%	0.784	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	135.9	-9.1	167.2	0	0	0	0	0	117.6
206	D	30.7	Very low	41.1	Very low	145 Å²	145	120.1 Å²	120.1	78%	0.775	65%	0.653	S	S	*	*			trans	-150.7	124.6	163.7	-100.7	-41.1	0	0	0	109.3	V208	D206-V208 PolarHBondContact O-N 2.67Å
207	E	27.9	Very low	43.1	Very low	146 Å²	146	119.7 Å²	119.7	68%	0.682	65%	0.651	S	S	*	*			trans	-78.5	69.1	-179.7	-158.9	-169.4	-176.6	0	0	110.8	R209	E207-R209 VanDerWaalsContact CD-NE 3.35Å; E207-R209 HydrophobicContact CG-CG 4.01Å; E207-R209 PolarHBondContact O-N 2.99Å; E207-R209 IonicContact OE1-CZ 2.64Å; E207-R209 IonicContact OE1-NE 3.18Å; E207-R209 PolarHBondContact OE1-NE 3.4Å; E207-R209 IonicContact OE1-NH2 3.09Å; E207-R209 PolarHBondContact OE1-NH2 2.96Å; E207-R209 IonicContact OE2-CZ 3.77Å; E207-R209 IonicContact OE2-NE 2.76Å; E207-R209 IonicContact OE2-NH2 2.71Å; E207-R209 PolarHBondContact OE2-NH2 3.38Å
208	V	31.5	Very low	44.6	Very low	119 Å²	119	117.8 Å²	117.8	72%	0.721	65%	0.649	S	S	*	*			trans	-67.9	79.7	165.7	-175	0	0	0	0	107.9	D206 M210	D206-V208 PolarHBondContact O-N 2.67Å; V208-M210 VanDerWaalsContact C-N 3.26Å; V208-M210 PolarHBondContact O-N 3.34Å
209	R	28.3	Very low	47	Very low	183 Å²	183	120 Å²	120	69%	0.691	64%	0.644	S	S	*	*			trans	-60.3	98.2	161	-69.9	-166.4	-179.4	161.7	13.9	107.1	E207 V211	E207-R209 VanDerWaalsContact CD-NE 3.35Å; E207-R209 HydrophobicContact CG-CG 4.01Å; E207-R209 PolarHBondContact O-N 2.99Å; E207-R209 IonicContact OE1-CZ 2.64Å; E207-R209 IonicContact OE1-NE 3.18Å; E207-R209 PolarHBondContact OE1-NE 3.4Å; E207-R209 IonicContact OE1-NH2 3.09Å; E207-R209 PolarHBondContact OE1-NH2 2.96Å; E207-R209 IonicContact OE2-CZ 3.77Å; E207-R209 IonicContact OE2-NE 2.76Å; E207-R209 IonicContact OE2-NH2 2.71Å; E207-R209 PolarHBondContact OE2-NH2 3.38Å; R209-V211 PolarHBondContact O-N 3.31Å
210	M	33	Very low	49.4	Very low	165 Å²	165	118.3 Å²	118.3	81%	0.813	63%	0.626	S	S	*	*			trans	-50.2	99.6	150.3	-73.4	-66.2	-70	0	0	106.1	V208 G212	V208-M210 VanDerWaalsContact C-N 3.26Å; V208-M210 PolarHBondContact O-N 3.34Å; M210-G212 PolarHBondContact O-N 2.9Å
211	V	38	Very low	52	Low	116 Å²	116	118 Å²	118	70%	0.703	64%	0.635	S	S	*	*			trans	-56	118.5	179.4	177.1	0	0	0	0	105.8	R209 V213	R209-V211 PolarHBondContact O-N 3.31Å; V211-V213 WeakPolarHBondContact O-CG2 3.36Å; V211-V213 PolarHBondContact O-N 3.32Å
212	G	43.1	Very low	54.5	Low	52 Å²	52	114.4 Å²	114.4	54%	0.536	63%	0.625	S	S	.	*			trans	-55.1	109.8	179.9	0	0	0	0	0	107.8	M210 D214	M210-G212 PolarHBondContact O-N 2.9Å; G212-D214 PolarHBondContact O-N 3.42Å
213	V	51.1	Low	57	Low	71 Å²	71	111.9 Å²	111.9	43%	0.43	61%	0.605	S	S	.	*			trans	-76.2	81.6	-179.7	-172.7	0	0	0	0	106.1	V211 H215 Y248	V211-V213 WeakPolarHBondContact O-CG2 3.36Å; V211-V213 PolarHBondContact O-N 3.32Å; V213-H215 PolarHBondContact O-N 2.69Å; V213-H215 PolarHBondContact O-ND1 3.29Å; V213-Y248 HydrophobicContact CG1-CD1 4.32Å; V213-Y248 HydrophobicContact CG1-CE1 3.75Å; V213-Y248 HydrophobicContact CG2-CE1 4.02Å
214	D	58.3	Low	59.1	Low	132 Å²	132	112.4 Å²	112.4	71%	0.706	60%	0.604	S	S	*	*			trans	-64.1	100.4	-178.9	-75.4	-20.1	0	0	0	108.6	G212 Y216 S246	G212-D214 PolarHBondContact O-N 3.42Å; D214-Y216 VanDerWaalsContact O-CD1 3.23Å; D214-Y216 WeakPolarHBondContact O-CD1 3.44Å; D214-Y216 PolarHBondContact O-N 2.97Å; D214-S246 PolarHBondContact O-OG 2.97Å
215	H	67.4	Low	60.7	Low	116 Å²	116	109 Å²	109	54%	0.537	59%	0.592	S	S	.	*			trans	-75.3	70.9	177.2	-77.9	64.2	0	0	0	109.5	V213	V213-H215 PolarHBondContact O-N 2.69Å; V213-H215 PolarHBondContact O-ND1 3.29Å
216	Y	79.4	Confident	62	Low	146 Å²	146	111.9 Å²	111.9	57%	0.573	59%	0.589	S	S	*	*			trans	-78	167.3	173.2	67.5	-96.5	0	0	0	111.6	D214 I218 S246	D214-Y216 VanDerWaalsContact O-CD1 3.23Å; D214-Y216 WeakPolarHBondContact O-CD1 3.44Å; D214-Y216 PolarHBondContact O-N 2.97Å; Y216-I218 HydrophobicContact CD2-CG2 4.32Å; Y216-I218 HydrophobicContact CE2-CG2 4.35Å; Y216-S246 PolarHBondContact N-OG 3.14Å; Y216-S246 PolarHBondContact O-N 3.29Å; Y216-S246 PolarHBondContact O-OG 3.3Å
217	W	84.1	Confident	63.2	Low	136 Å²	136	111.3 Å²	111.3	52%	0.515	59%	0.586	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-137	150.6	162.6	57.9	88	0	0	0	109.2	V244 Y245	W217-V244 CarbonylContact C-O 3.54Å; W217-V244 WeakPolarHBondContact CA-O 3.3Å; W217-V244 WeakPolarHBondContact CB-O 3.25Å; W217-Y245 HydrophobicContact CB-CD1 3.93Å; W217-Y245 HydrophobicContact CB-CE1 4.34Å; W217-Y245 HydrophobicContact CB-CG 4.22Å; W217-Y245 HydrophobicContact CD2-CE1 4.42Å; W217-Y245 HydrophobicContact CE3-CD1 4.29Å; W217-Y245 HydrophobicContact CE3-CE1 4.23Å; W217-Y245 HydrophobicContact CG-CD1 4.5Å; W217-Y245 HydrophobicContact CG-CE1 4.48Å
218	I	81	Confident	64.5	Low	94 Å²	94	113.1 Å²	113.1	48%	0.482	60%	0.595	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-108.2	147.8	168.3	63.2	176.8	0	0	0	108.9	Y216 V220 V244	Y216-I218 HydrophobicContact CD2-CG2 4.32Å; Y216-I218 HydrophobicContact CE2-CG2 4.35Å; I218-V220 HydrophobicContact CD1-CG1 4.21Å; I218-V220 HydrophobicContact CG1-CG1 4.27Å; I218-V244 HydrophobicContact CG1-CB 3.93Å; I218-V244 HydrophobicContact CG1-CG1 4.49Å; I218-V244 PolarHBondContact N-O 3.47Å; I218-V244 PolarHBondContact O-N 3.26Å
219	E	91	Very high	65.5	Low	101 Å²	101	116.9 Å²	116.9	47%	0.472	60%	0.604	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-97	118.4	171.6	-76.2	-178.8	172.3	0	0	108.7	P241 I242 R243	E219-P241 HydrophobicContact CB-CB 3.88Å; E219-P241 HydrophobicContact CG-CB 4.3Å; E219-I242 WeakPolarHBondContact CA-O 3.49Å; E219-R243 HydrophobicContact CG-CG 3.74Å; E219-R243 IonicContact OE1-CZ 2.71Å; E219-R243 VanDerWaalsContact OE1-CZ 3.26Å; E219-R243 IonicContact OE1-NE 2.61Å; E219-R243 PolarHBondContact OE1-NE 2.99Å; E219-R243 IonicContact OE1-NH2 3.66Å; E219-R243 PolarHBondContact OE1-NH2 3.37Å
220	V	85.8	Confident	66.8	Low	49 Å²	49	111.8 Å²	111.8	30%	0.297	61%	0.609	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-101.4	159.2	173.5	-53.5	0	0	0	0	109.4	I218 G222 P241 I242 V244	I218-V220 HydrophobicContact CD1-CG1 4.21Å; I218-V220 HydrophobicContact CG1-CG1 4.27Å; V220-G222 PolarHBondContact O-N 3.25Å; V220-P241 CarbonylContact O-C 3.52Å; V220-P241 VanDerWaalsContact O-CA 3.29Å; V220-P241 WeakPolarHBondContact O-CA 3.16Å; V220-P241 WeakPolarHBondContact O-CB 3.3Å; V220-I242 HydrophobicContact CG2-CB 3.81Å; V220-I242 HydrophobicContact CG2-CG2 4.24Å; V220-I242 PolarHBondContact N-O 3.13Å; V220-I242 PolarHBondContact O-N 3.44Å; V220-V244 HydrophobicContact CG1-CG2 3.89Å; V220-V244 HydrophobicContact CG2-CG2 3.82Å
221	P	89.7	Confident	68.1	Low	117 Å²	117	108.3 Å²	108.3	76%	0.76	61%	0.607	S	S	*	*	P	Polyproline II helix	trans	-50.4	139.7	178.6	-29.1	36.7	0	0	0	112.8
222	G	88	Confident	69.2	Low	20 Å²	20	112.4 Å²	112.4	21%	0.206	62%	0.62	C	S	.	*			trans	-68	-179.3	178.7	0	0	0	0	0	113.2	V220 E240	V220-G222 PolarHBondContact O-N 3.25Å; G222-E240 VanDerWaalsContact CA-O 3.26Å; G222-E240 WeakPolarHBondContact CA-O 3.23Å
223	L	86.4	Confident	70.6	Confident	86 Å²	86	113.5 Å²	113.5	45%	0.45	62%	0.62	S	S	.	*			trans	-65	142.8	171.6	-62.9	170.9	0	0	0	109.9	F237 S238 I242	L223-F237 HydrophobicContact CD1-CB 3.87Å; L223-F237 HydrophobicContact CD1-CD1 4.09Å; L223-F237 HydrophobicContact CD1-CG 4.33Å; L223-S238 PolarHBondContact N-O 3.32Å; L223-I242 HydrophobicContact CD2-CD1 4.49Å; L223-I242 HydrophobicContact CG-CD1 4.43Å
224	N	80.8	Confident	72.2	Confident	129 Å²	129	120.2 Å²	120.2	69%	0.69	64%	0.643	S	S	*	*			trans	-57.9	143	175.4	-72.5	-11.4	0	0	0	110.9	D226	N224-D226 PolarHBondContact O-N 3.5Å
225	C	68	Low	73.6	Confident	90 Å²	90	118.6 Å²	118.6	61%	0.608	64%	0.638	S	S	*	*			trans	-75.1	75.1	161.2	43.8	0	0	0	0	109.5	D227 T239	C225-D227 WeakPolarHBondContact CB-OD2 3.37Å; C225-D227 PolarHBondContact O-N 3.11Å; C225-T239 HydrophobicContact CB-CG2 4.29Å
226	D	59.4	Low	74.2	Confident	136 Å²	136	122.1 Å²	122.1	73%	0.727	65%	0.652	S	S	*	*			trans	-73.9	66.2	167.9	-70.2	-22.6	0	0	0	109.2	N224 E228	N224-D226 PolarHBondContact O-N 3.5Å; D226-E228 PolarHBondContact O-N 3.46Å
227	D	55.7	Low	74.6	Confident	133 Å²	133	123 Å²	123	71%	0.711	66%	0.659	S	S	*	*			trans	-73.8	64.9	178.4	-73.9	-47.3	0	0	0	111.1	C225 E229	C225-D227 WeakPolarHBondContact CB-OD2 3.37Å; C225-D227 PolarHBondContact O-N 3.11Å; D227-E229 PolarHBondContact O-N 3.29Å
228	E	55	Low	74.7	Confident	184 Å²	184	119.9 Å²	119.9	86%	0.86	66%	0.658	S	S	*	*			trans	-65.6	88.7	154.6	-81.6	-97	134.1	0	0	107.8	D226 G230	D226-E228 PolarHBondContact O-N 3.46Å; E228-G230 PolarHBondContact O-N 3.38Å
229	E	52.2	Low	75	Confident	198 Å²	198	119.4 Å²	119.4	93%	0.925	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.5	72.7	179.8	-65.6	-171.1	116.8	0	0	112.6	D227	D227-E229 PolarHBondContact O-N 3.29Å
230	G	55.3	Low	75	Confident	76 Å²	76	120.9 Å²	120.9	78%	0.784	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-147.4	-11.9	-167.9	0	0	0	0	0	118.4	E228	E228-G230 PolarHBondContact O-N 3.38Å
231	A	60.9	Low	75.2	Confident	93 Å²	93	121.5 Å²	121.5	77%	0.769	67%	0.671	S	S	*	*			trans	-142.1	136.9	-173.8	0	0	0	0	0	115	S233	A231-S233 PolarHBondContact O-N 3.39Å
232	M	60.9	Low	75.3	Confident	201 Å²	201	119.5 Å²	119.5	99%	0.99	65%	0.653	S	S	*	*			trans	-77.1	59.2	177.9	-62.8	-171.9	-67.2	0	0	112.8
233	S	73	Confident	75.4	Confident	76 Å²	76	125 Å²	125	53%	0.531	67%	0.668	S	S	.	*			trans	-69.6	131.8	175	-176.8	0	0	0	0	111.6	A231 V235	A231-S233 PolarHBondContact O-N 3.39Å; S233-V235 WeakPolarHBondContact CB-O 3.39Å; S233-V235 PolarHBondContact OG-N 3.33Å; S233-V235 VanDerWaalsContact OG-N 3.09Å; S233-V235 PolarHBondContact OG-O 3.15Å
234	K	84.8	Confident	75.4	Confident	211 Å²	211	124.1 Å²	124.1	92%	0.917	67%	0.666	S	S	*	*	S	Bend	trans	-81.1	-18.5	168.3	-167.9	174.2	-179.8	-178.8	0	112.4
235	V	86	Confident	75.7	Confident	98 Å²	98	123.4 Å²	123.4	59%	0.594	66%	0.655	S	S	*	*			trans	-90.9	133.2	174.3	179.8	0	0	0	0	108.8	S233	S233-V235 WeakPolarHBondContact CB-O 3.39Å; S233-V235 PolarHBondContact OG-N 3.33Å; S233-V235 VanDerWaalsContact OG-N 3.09Å; S233-V235 PolarHBondContact OG-O 3.15Å
236	K	81.6	Confident	76.5	Confident	191 Å²	191	120.4 Å²	120.4	83%	0.83	64%	0.635	S	S	*	*			trans	-119.7	145.9	171.3	-63.3	-169.6	175.6	-165	0	109.2
237	F	86	Confident	77.6	Confident	163 Å²	163	119.1 Å²	119.1	72%	0.715	63%	0.632	S	S	*	*			trans	-91.4	150.4	172.2	-66.4	-78.8	0	0	0	110.1	L223 T239	L223-F237 HydrophobicContact CD1-CB 3.87Å; L223-F237 HydrophobicContact CD1-CD1 4.09Å; L223-F237 HydrophobicContact CD1-CG 4.33Å; F237-T239 PolarHBondContact O-N 2.97Å
238	S	87.4	Confident	79	Confident	72 Å²	72	117.4 Å²	117.4	50%	0.503	62%	0.616	S	S	.	*			trans	-82.4	116.2	178.4	-172.5	0	0	0	0	110.2	L223 E240	L223-S238 PolarHBondContact N-O 3.32Å; S238-E240 VanDerWaalsContact C-N 3.34Å; S238-E240 WeakPolarHBondContact OG-CB 3.46Å
239	T	88	Confident	80.2	Confident	83 Å²	83	110.2 Å²	110.2	51%	0.509	59%	0.591	S	S	.	*			trans	-85.7	-9.3	170.8	54.5	0	0	0	0	112.6	C225 F237	C225-T239 HydrophobicContact CB-CG2 4.29Å; F237-T239 PolarHBondContact O-N 2.97Å
240	E	89.7	Confident	81.5	Confident	133 Å²	133	105.9 Å²	105.9	62%	0.621	58%	0.578	S	S	*	*	S	Bend	trans	-58.2	151.1	170.2	-61.6	-66.8	167.1	0	0	111.6	G222 S238 I242	G222-E240 VanDerWaalsContact CA-O 3.26Å; G222-E240 WeakPolarHBondContact CA-O 3.23Å; S238-E240 VanDerWaalsContact C-N 3.34Å; S238-E240 WeakPolarHBondContact OG-CB 3.46Å; E240-I242 PolarHBondContact O-N 3.32Å
241	P	91.1	Very high	82.6	Confident	61 Å²	61	110.1 Å²	110.1	40%	0.396	58%	0.582	S	S	.	*	P	Polyproline II helix	trans	-53	135.2	176.5	-26.2	34.8	0	0	0	113.5	E219 V220	E219-P241 HydrophobicContact CB-CB 3.88Å; E219-P241 HydrophobicContact CG-CB 4.3Å; V220-P241 CarbonylContact O-C 3.52Å; V220-P241 VanDerWaalsContact O-CA 3.29Å; V220-P241 WeakPolarHBondContact O-CA 3.16Å; V220-P241 WeakPolarHBondContact O-CB 3.3Å
242	I	91.5	Very high	83.5	Confident	75 Å²	75	112.1 Å²	112.1	39%	0.385	58%	0.576	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-82.5	122.8	-179.3	-66.6	164.7	0	0	0	109	E219 V220 L223 E240 V244	E219-I242 WeakPolarHBondContact CA-O 3.49Å; V220-I242 HydrophobicContact CG2-CB 3.81Å; V220-I242 HydrophobicContact CG2-CG2 4.24Å; V220-I242 PolarHBondContact N-O 3.13Å; V220-I242 PolarHBondContact O-N 3.44Å; L223-I242 HydrophobicContact CD2-CD1 4.49Å; L223-I242 HydrophobicContact CG-CD1 4.43Å; E240-I242 PolarHBondContact O-N 3.32Å; I242-V244 HydrophobicContact CG2-CG2 4.33Å; I242-V244 PolarHBondContact O-N 3.24Å
243	R	90.1	Very high	84.5	Confident	137 Å²	137	107.4 Å²	107.4	52%	0.517	55%	0.548	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	107.8	173.8	-71.2	179.7	-179.4	154.9	9.7	110.9	E219 Y245	E219-R243 HydrophobicContact CG-CG 3.74Å; E219-R243 IonicContact OE1-CZ 2.71Å; E219-R243 VanDerWaalsContact OE1-CZ 3.26Å; E219-R243 IonicContact OE1-NE 2.61Å; E219-R243 PolarHBondContact OE1-NE 2.99Å; E219-R243 IonicContact OE1-NH2 3.66Å; E219-R243 PolarHBondContact OE1-NH2 3.37Å; R243-Y245 HydrophobicContact CB-CE2 4Å; R243-Y245 WeakPolarHBondContact O-CD2 3.49Å; R243-Y245 WeakPolarHBondContact O-CE2 3.48Å
244	V	86.9	Confident	85.2	Confident	67 Å²	67	106.6 Å²	106.6	41%	0.406	54%	0.537	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	109.9	172.8	-179.2	0	0	0	0	108	W217 I218 V220 I242	W217-V244 CarbonylContact C-O 3.54Å; W217-V244 WeakPolarHBondContact CA-O 3.3Å; W217-V244 WeakPolarHBondContact CB-O 3.25Å; I218-V244 HydrophobicContact CG1-CB 3.93Å; I218-V244 HydrophobicContact CG1-CG1 4.49Å; I218-V244 PolarHBondContact N-O 3.47Å; I218-V244 PolarHBondContact O-N 3.26Å; V220-V244 HydrophobicContact CG1-CG2 3.89Å; V220-V244 HydrophobicContact CG2-CG2 3.82Å; I242-V244 HydrophobicContact CG2-CG2 4.33Å; I242-V244 PolarHBondContact O-N 3.24Å
245	Y	86.3	Confident	85.4	Confident	114 Å²	114	102.2 Å²	102.2	45%	0.447	52%	0.515	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	148.6	-179.2	-60.8	-97.5	0	0	0	111	W217 R243	W217-Y245 HydrophobicContact CB-CD1 3.93Å; W217-Y245 HydrophobicContact CB-CE1 4.34Å; W217-Y245 HydrophobicContact CB-CG 4.22Å; W217-Y245 HydrophobicContact CD2-CE1 4.42Å; W217-Y245 HydrophobicContact CE3-CD1 4.29Å; W217-Y245 HydrophobicContact CE3-CE1 4.23Å; W217-Y245 HydrophobicContact CG-CD1 4.5Å; W217-Y245 HydrophobicContact CG-CE1 4.48Å; R243-Y245 HydrophobicContact CB-CE2 4Å; R243-Y245 WeakPolarHBondContact O-CD2 3.49Å; R243-Y245 WeakPolarHBondContact O-CE2 3.48Å
246	S	84.5	Confident	85.4	Confident	27 Å²	27	105.5 Å²	105.5	19%	0.189	52%	0.517	C	S	.	.			trans	-66.4	152.7	170.8	69.9	0	0	0	0	111.4	D214 Y216	D214-S246 PolarHBondContact O-OG 2.97Å; Y216-S246 PolarHBondContact N-OG 3.14Å; Y216-S246 PolarHBondContact O-N 3.29Å; Y216-S246 PolarHBondContact O-OG 3.3Å
247	T	83.7	Confident	85.7	Confident	108 Å²	108	101.2 Å²	101.2	66%	0.663	50%	0.503	S	S	*	.			trans	-148.3	154.4	172.5	-171.3	0	0	0	0	107.8	G249	T247-G249 PolarHBondContact O-N 2.88Å
248	Y	83.7	Confident	85.7	Confident	98 Å²	98	99.3 Å²	99.3	38%	0.384	50%	0.5	S	S	.	.			trans	-47.9	130.2	-176.1	-59.9	-78.2	0	0	0	112.8	V213 E252 Y253 R255	V213-Y248 HydrophobicContact CG1-CD1 4.32Å; V213-Y248 HydrophobicContact CG1-CE1 3.75Å; V213-Y248 HydrophobicContact CG2-CE1 4.02Å; Y248-E252 VanDerWaalsContact CA-OE2 3.26Å; Y248-E252 WeakPolarHBondContact CA-OE2 3.47Å; Y248-E252 HydrophobicContact CD1-CB 4.34Å; Y248-Y253 VanDerWaalsContact CB-CB 3.44Å; Y248-Y253 HydrophobicContact CD2-CD1 4.33Å; Y248-R255 VanDerWaalsContact O-CZ 3.26Å; Y248-R255 PolarHBondContact O-NH1 3.49Å; Y248-R255 PolarHBondContact O-NH2 3.36Å
249	G	79.9	Confident	85.6	Confident	32 Å²	32	101.1 Å²	101.1	33%	0.33	50%	0.504	S	S	.	.			trans	-60.2	164.7	170.6	0	0	0	0	0	112	T247 N251 E252 Y253 R255	T247-G249 PolarHBondContact O-N 2.88Å; G249-N251 PolarHBondContact O-N 2.52Å; G249-E252 PolarHBondContact N-OE2 3.36Å; G249-E252 PolarHBondContact O-N 2.87Å; G249-Y253 PolarHBondContact O-N 3.46Å; G249-R255 PolarHBondContact O-NH1 2.91Å
250	V	79.5	Confident	85.6	Confident	108 Å²	108	101.5 Å²	101.5	66%	0.655	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-32.1	174.9	-178.8	0	0	0	0	111.1	E252 Y253	V250-E252 VanDerWaalsContact C-N 3.3Å; V250-E252 PolarHBondContact O-N 2.86Å; V250-Y253 CarbonylContact O-C 3.57Å
251	N	79.8	Confident	85.4	Confident	164 Å²	164	98.3 Å²	98.3	88%	0.877	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-16.8	177.4	-55.6	-7.3	0	0	0	113.6	G249	G249-N251 PolarHBondContact O-N 2.52Å
252	E	79.4	Confident	85.2	Confident	135 Å²	135	99.6 Å²	99.6	63%	0.631	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.7	-36.7	-176.4	-61.4	171.6	166	0	0	111.5	Y248 G249 V250	Y248-E252 VanDerWaalsContact CA-OE2 3.26Å; Y248-E252 WeakPolarHBondContact CA-OE2 3.47Å; Y248-E252 HydrophobicContact CD1-CB 4.34Å; G249-E252 PolarHBondContact N-OE2 3.36Å; G249-E252 PolarHBondContact O-N 2.87Å; V250-E252 VanDerWaalsContact C-N 3.3Å; V250-E252 PolarHBondContact O-N 2.86Å
253	Y	82.7	Confident	84.8	Confident	103 Å²	103	101.9 Å²	101.9	40%	0.404	51%	0.514	S	S	.	.	S	Bend	trans	-135.1	99.6	173.4	178.9	-149.6	0	0	0	109.1	Y248 G249 V250 R255	Y248-Y253 VanDerWaalsContact CB-CB 3.44Å; Y248-Y253 HydrophobicContact CD2-CD1 4.33Å; G249-Y253 PolarHBondContact O-N 3.46Å; V250-Y253 CarbonylContact O-C 3.57Å; Y253-R255 HydrophobicContact CD1-CG 4.03Å; Y253-R255 HydrophobicContact CE1-CG 4.04Å; Y253-R255 HydrophobicContact CG-CG 4.41Å; Y253-R255 PolarHBondContact O-N 2.93Å; Y253-R255 PolarHBondContact O-NH1 3.41Å
254	D	86.4	Confident	84.5	Confident	58 Å²	58	96 Å²	96	31%	0.31	49%	0.494	S	S	.	.			trans	-63.6	123.6	168.5	-164.8	-8.7	0	0	0	109.3	R256	D254-R256 VanDerWaalsContact OD1-CB 3.27Å; D254-R256 WeakPolarHBondContact OD1-CB 3.41Å; D254-R256 VanDerWaalsContact OD1-CG 3.27Å; D254-R256 WeakPolarHBondContact OD1-CG 3.42Å; D254-R256 PolarHBondContact OD1-N 3.22Å; D254-R256 IonicContact OD1-NE 2.68Å; D254-R256 PolarHBondContact OD1-NE 3.13Å; D254-R256 IonicContact OD2-CZ 2.74Å; D254-R256 VanDerWaalsContact OD2-CZ 3.26Å; D254-R256 IonicContact OD2-NE 3.85Å; D254-R256 PolarHBondContact OD2-NE 2.88Å; D254-R256 IonicContact OD2-NH2 2.63Å; D254-R256 PolarHBondContact OD2-NH2 3.29Å
255	R	88.5	Confident	84.6	Confident	119 Å²	119	95.3 Å²	95.3	45%	0.449	50%	0.496	S	S	.	.			trans	-105.4	1	-178.3	-68.7	167.3	178.1	85.6	-17.2	112.1	Y248 G249 Y253	Y248-R255 VanDerWaalsContact O-CZ 3.26Å; Y248-R255 PolarHBondContact O-NH1 3.49Å; Y248-R255 PolarHBondContact O-NH2 3.36Å; G249-R255 PolarHBondContact O-NH1 2.91Å; Y253-R255 HydrophobicContact CD1-CG 4.03Å; Y253-R255 HydrophobicContact CE1-CG 4.04Å; Y253-R255 HydrophobicContact CG-CG 4.41Å; Y253-R255 PolarHBondContact O-N 2.93Å; Y253-R255 PolarHBondContact O-NH1 3.41Å
256	R	86.8	Confident	84.6	Confident	167 Å²	167	93.3 Å²	93.3	63%	0.63	50%	0.499	S	S	*	.			trans	-66	157.1	171	-63.5	178.8	-64.2	156	1.5	110.2	D254 D258	D254-R256 VanDerWaalsContact OD1-CB 3.27Å; D254-R256 WeakPolarHBondContact OD1-CB 3.41Å; D254-R256 VanDerWaalsContact OD1-CG 3.27Å; D254-R256 WeakPolarHBondContact OD1-CG 3.42Å; D254-R256 PolarHBondContact OD1-N 3.22Å; D254-R256 IonicContact OD1-NE 2.68Å; D254-R256 PolarHBondContact OD1-NE 3.13Å; D254-R256 IonicContact OD2-CZ 2.74Å; D254-R256 VanDerWaalsContact OD2-CZ 3.26Å; D254-R256 IonicContact OD2-NE 3.85Å; D254-R256 PolarHBondContact OD2-NE 2.88Å; D254-R256 IonicContact OD2-NH2 2.63Å; D254-R256 PolarHBondContact OD2-NH2 3.29Å; R256-D258 IonicContact NH1-OD2 3.88Å
257	N	87.1	Confident	84.7	Confident	101 Å²	101	92.6 Å²	92.6	54%	0.54	49%	0.494	S	S	.	.			trans	-146.6	63.9	-179.7	-165.9	10	0	0	0	109.1	D259 V260	N257-D259 PolarHBondContact O-N 3.38Å; N257-V260 HydrophobicContact CB-CG2 4.39Å; N257-V260 WeakPolarHBondContact ND2-CG2 3.07Å; N257-V260 WeakPolarHBondContact O-CB 3.41Å; N257-V260 PolarHBondContact O-N 3.36Å
258	D	86.4	Confident	85	Confident	124 Å²	124	90.9 Å²	90.9	66%	0.663	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-10.6	-174.5	-48.7	-24.1	0	0	0	112.2	R256 V260	R256-D258 IonicContact NH1-OD2 3.88Å; D258-V260 PolarHBondContact O-N 3.01Å
259	D	86	Confident	85.3	Confident	109 Å²	109	92.4 Å²	92.4	58%	0.583	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-8.1	169.2	-66.6	-12.6	0	0	0	113.3	R110 N257	R110-D259 IonicContact CZ-OD2 2.65Å; R110-D259 IonicContact NH1-OD1 3.98Å; R110-D259 IonicContact NH1-OD2 2.59Å; R110-D259 PolarHBondContact NH1-OD2 3.34Å; R110-D259 IonicContact NH2-OD2 2.8Å; R110-D259 PolarHBondContact NH2-OD2 2.85Å; N257-D259 PolarHBondContact O-N 3.38Å
260	V	87.5	Confident	85.7	Confident	92 Å²	92	94.6 Å²	94.6	56%	0.558	49%	0.486	S	S	*	.			trans	-100.4	105.2	-177.8	175.3	0	0	0	0	111.9	N257 D258 P262	N257-V260 HydrophobicContact CB-CG2 4.39Å; N257-V260 WeakPolarHBondContact ND2-CG2 3.07Å; N257-V260 WeakPolarHBondContact O-CB 3.41Å; N257-V260 PolarHBondContact O-N 3.36Å; D258-V260 PolarHBondContact O-N 3.01Å; V260-P262 WeakPolarHBondContact O-CD 3.37Å
261	D	85.2	Confident	86.2	Confident	66 Å²	66	89.6 Å²	89.6	35%	0.353	46%	0.456	S	S	.	.			trans	-105.2	106.5	167.2	177.3	-3.4	0	0	0	110.5	I263 A264 A265	D261-I263 VanDerWaalsContact C-N 3.25Å; D261-I263 PolarHBondContact O-N 2.87Å; D261-I263 WeakPolarHBondContact OD1-CA 3.46Å; D261-I263 VanDerWaalsContact OD1-CB 3.3Å; D261-I263 WeakPolarHBondContact OD1-CB 3.23Å; D261-I263 PolarHBondContact OD1-N 2.95Å; D261-A264 HydrophobicContact CB-CB 3.92Å; D261-A264 VanDerWaalsContact CG-CB 3.49Å; D261-A264 VanDerWaalsContact CG-N 3.35Å; D261-A264 PolarHBondContact OD1-N 3.37Å; D261-A264 WeakPolarHBondContact OD2-CB 3.48Å; D261-A264 PolarHBondContact OD2-N 2.9Å; D261-A265 WeakPolarHBondContact O-CB 3.4Å; D261-A265 PolarHBondContact O-N 3.42Å
262	P	87.4	Confident	86.7	Confident	88 Å²	88	86.7 Å²	86.7	57%	0.571	44%	0.437	S	S	*	.	H	α-helix	trans	-65.8	-23.3	176.7	-21.4	34	0	0	0	114.3	V260 S266	V260-P262 WeakPolarHBondContact O-CD 3.37Å; P262-S266 VanDerWaalsContact O-CB 3.25Å; P262-S266 WeakPolarHBondContact O-CB 3.46Å; P262-S266 PolarHBondContact O-N 3.47Å; P262-S266 VanDerWaalsContact O-N 3.07Å; P262-S266 PolarHBondContact O-OG 3.13Å
263	I	82.8	Confident	87.3	Confident	123 Å²	123	85.8 Å²	85.8	63%	0.631	43%	0.428	S	S	*	.	H	α-helix	trans	-78.1	-49.6	-179.4	-49.3	179.7	0	0	0	108.9	D261 A265 S266 A267 L307	D261-I263 VanDerWaalsContact C-N 3.25Å; D261-I263 PolarHBondContact O-N 2.87Å; D261-I263 WeakPolarHBondContact OD1-CA 3.46Å; D261-I263 VanDerWaalsContact OD1-CB 3.3Å; D261-I263 WeakPolarHBondContact OD1-CB 3.23Å; D261-I263 PolarHBondContact OD1-N 2.95Å; I263-A265 PolarHBondContact O-N 3.01Å; I263-S266 PolarHBondContact O-N 3.23Å; I263-A267 WeakPolarHBondContact O-CB 3.49Å; I263-A267 PolarHBondContact O-N 2.96Å; I263-L307 HydrophobicContact CB-CD2 4.31Å; I263-L307 HydrophobicContact CG2-CD2 3.86Å
264	A	84.9	Confident	87.6	Confident	13 Å²	13	85.9 Å²	85.9	11%	0.107	43%	0.427	C	S	.	.	H	α-helix	trans	-57.9	-48.1	172.7	0	0	0	0	0	111.9	D261 S266 A267 E268 L307	D261-A264 HydrophobicContact CB-CB 3.92Å; D261-A264 VanDerWaalsContact CG-CB 3.49Å; D261-A264 VanDerWaalsContact CG-N 3.35Å; D261-A264 PolarHBondContact OD1-N 3.37Å; D261-A264 WeakPolarHBondContact OD2-CB 3.48Å; D261-A264 PolarHBondContact OD2-N 2.9Å; A264-S266 VanDerWaalsContact C-N 3.33Å; A264-S266 PolarHBondContact O-N 2.9Å; A264-A267 PolarHBondContact O-N 2.81Å; A264-E268 WeakPolarHBondContact O-CG 3.39Å; A264-E268 PolarHBondContact O-N 3.41Å; A264-L307 HydrophobicContact CB-CD2 4.13Å
265	A	88	Confident	87.8	Confident	53 Å²	53	83.9 Å²	83.9	44%	0.438	42%	0.417	S	S	.	.	H	α-helix	trans	-63	-37.2	179.3	0	0	0	0	0	112.7	D261 I263 Y269	D261-A265 WeakPolarHBondContact O-CB 3.4Å; D261-A265 PolarHBondContact O-N 3.42Å; I263-A265 PolarHBondContact O-N 3.01Å; A265-Y269 VanDerWaalsContact O-CB 3.28Å; A265-Y269 WeakPolarHBondContact O-CB 3.43Å; A265-Y269 PolarHBondContact O-N 3.49Å
266	S	86.9	Confident	87.8	Confident	72 Å²	72	84.9 Å²	84.9	50%	0.503	43%	0.427	S	S	.	.	H	α-helix	trans	-68.6	-37.5	175.4	-61.9	0	0	0	0	112.4	P262 I263 A264 E270	P262-S266 VanDerWaalsContact O-CB 3.25Å; P262-S266 WeakPolarHBondContact O-CB 3.46Å; P262-S266 PolarHBondContact O-N 3.47Å; P262-S266 VanDerWaalsContact O-N 3.07Å; P262-S266 PolarHBondContact O-OG 3.13Å; I263-S266 PolarHBondContact O-N 3.23Å; A264-S266 VanDerWaalsContact C-N 3.33Å; A264-S266 PolarHBondContact O-N 2.9Å; S266-E270 PolarHBondContact O-N 3.33Å; S266-E270 VanDerWaalsContact O-N 3.08Å
267	A	86.8	Confident	87.9	Confident	12 Å²	12	82.2 Å²	82.2	10%	0.099	43%	0.425	C	S	.	.	H	α-helix	trans	-71.1	-35.9	177.6	0	0	0	0	0	112.5	I263 A264 L271 V301 K309	I263-A267 WeakPolarHBondContact O-CB 3.49Å; I263-A267 PolarHBondContact O-N 2.96Å; A264-A267 PolarHBondContact O-N 2.81Å; A267-L271 WeakPolarHBondContact O-CG 3.47Å; A267-V301 HydrophobicContact CB-CG2 3.85Å; A267-K309 HydrophobicContact CB-CB 3.83Å; A267-K309 HydrophobicContact CB-CG 3.84Å
268	E	88.8	Confident	88.2	Confident	71 Å²	71	78.3 Å²	78.3	33%	0.332	40%	0.403	S	S	.	.	H	α-helix	trans	-64.8	-50.1	169.9	-72.4	175.1	170.1	0	0	111	A264 E270 L271 E272 K309	A264-E268 WeakPolarHBondContact O-CG 3.39Å; A264-E268 PolarHBondContact O-N 3.41Å; E268-E270 PolarHBondContact O-N 2.99Å; E268-L271 WeakPolarHBondContact O-CA 3.45Å; E268-L271 WeakPolarHBondContact O-CB 3.45Å; E268-L271 PolarHBondContact O-N 3.47Å; E268-E272 PolarHBondContact O-N 2.87Å; E268-K309 HydrophobicContact CG-CD 4Å; E268-K309 WeakPolarHBondContact OE1-CE 3.13Å; E268-K309 IonicContact OE1-NZ 3.88Å; E268-K309 PolarHBondContact OE1-NZ 3.01Å
269	Y	90.5	Very high	88.6	Confident	130 Å²	130	76.3 Å²	76.3	51%	0.51	39%	0.393	S	S	.	.	H	α-helix	trans	-57.9	-43.1	-179.5	176.5	-95.8	0	0	0	113.4	A265 L271 E272 R273	A265-Y269 VanDerWaalsContact O-CB 3.28Å; A265-Y269 WeakPolarHBondContact O-CB 3.43Å; A265-Y269 PolarHBondContact O-N 3.49Å; Y269-L271 PolarHBondContact O-N 3.13Å; Y269-E272 PolarHBondContact O-N 3.01Å; Y269-R273 WeakPolarHBondContact O-CB 3.46Å; Y269-R273 PolarHBondContact O-N 3.21Å
270	E	88.3	Confident	89.1	Confident	78 Å²	78	75.1 Å²	75.1	36%	0.364	39%	0.385	S	S	.	.	H	α-helix	trans	-72.9	-8.5	176.8	-73.8	-67	135.7	0	0	113.9	S266 E268 R273 R274	S266-E270 PolarHBondContact O-N 3.33Å; S266-E270 VanDerWaalsContact O-N 3.08Å; E268-E270 PolarHBondContact O-N 2.99Å; E270-R273 VanDerWaalsContact CD-NH1 3.34Å; E270-R273 IonicContact OE1-CZ 2.7Å; E270-R273 IonicContact OE1-NH1 2.69Å; E270-R273 PolarHBondContact OE1-NH1 3.31Å; E270-R273 IonicContact OE2-NH1 2.67Å; E270-R273 PolarHBondContact OE2-NH1 3.47Å; E270-R273 VanDerWaalsContact OE2-NH1 3.09Å; E270-R274 WeakPolarHBondContact O-CD 3.34Å; E270-R274 WeakPolarHBondContact O-CG 3.39Å; E270-R274 PolarHBondContact O-NE 3.21Å; E270-R274 VanDerWaalsContact O-NE 3.15Å
271	L	89.7	Confident	89.6	Confident	4 Å²	4	73.6 Å²	73.6	2%	0.021	37%	0.372	C	S	.	.	H	α-helix	trans	-89.8	-43.4	165.9	-67.7	168.7	0	0	0	111.5	A267 E268 Y269 R273 R274 K309 I344	A267-L271 WeakPolarHBondContact O-CG 3.47Å; E268-L271 WeakPolarHBondContact O-CA 3.45Å; E268-L271 WeakPolarHBondContact O-CB 3.45Å; E268-L271 PolarHBondContact O-N 3.47Å; Y269-L271 PolarHBondContact O-N 3.13Å; L271-R273 PolarHBondContact O-N 3.35Å; L271-R274 PolarHBondContact O-N 2.65Å; L271-K309 HydrophobicContact CD1-CB 4.39Å; L271-I344 HydrophobicContact CB-CG2 3.73Å
272	E	91.4	Very high	90.2	Very high	102 Å²	102	77 Å²	77	48%	0.477	39%	0.385	S	S	.	.	H	α-helix	trans	-58.7	-46.4	175	-68.3	-173.1	147.3	0	0	111.5	E268 Y269 R274 L275 I344	E268-E272 PolarHBondContact O-N 2.87Å; Y269-E272 PolarHBondContact O-N 3.01Å; E272-R274 PolarHBondContact O-N 2.89Å; E272-R274 VanDerWaalsContact O-N 3.14Å; E272-L275 VanDerWaalsContact O-CB 3.23Å; E272-L275 WeakPolarHBondContact O-CB 3.47Å; E272-L275 WeakPolarHBondContact O-CG 3.46Å; E272-L275 PolarHBondContact O-N 3.02Å; E272-I344 HydrophobicContact CG-CD1 4.07Å; E272-I344 HydrophobicContact CG-CG2 3.87Å
273	R	91.3	Very high	90.7	Very high	116 Å²	116	72.9 Å²	72.9	44%	0.438	36%	0.359	S	S	.	.	G	3₁₀ helix	trans	-58.8	-24.9	179.7	-176.6	178.4	171.7	-136.7	-12.2	114	Y269 E270 L271 L275 E276	Y269-R273 WeakPolarHBondContact O-CB 3.46Å; Y269-R273 PolarHBondContact O-N 3.21Å; E270-R273 VanDerWaalsContact CD-NH1 3.34Å; E270-R273 IonicContact OE1-CZ 2.7Å; E270-R273 IonicContact OE1-NH1 2.69Å; E270-R273 PolarHBondContact OE1-NH1 3.31Å; E270-R273 IonicContact OE2-NH1 2.67Å; E270-R273 PolarHBondContact OE2-NH1 3.47Å; E270-R273 VanDerWaalsContact OE2-NH1 3.09Å; L271-R273 PolarHBondContact O-N 3.35Å; R273-L275 VanDerWaalsContact C-N 3.28Å; R273-L275 PolarHBondContact O-N 2.94Å; R273-E276 WeakPolarHBondContact O-CG 3.32Å
274	R	88.1	Confident	91.4	Very high	105 Å²	105	73.2 Å²	73.2	40%	0.396	36%	0.357	S	S	.	.	G	3₁₀ helix	trans	-68.2	-30.9	175.2	-67.5	170.6	-173.1	-143.3	-7.8	111.8	E270 L271 E272 E276 N277	E270-R274 WeakPolarHBondContact O-CD 3.34Å; E270-R274 WeakPolarHBondContact O-CG 3.39Å; E270-R274 PolarHBondContact O-NE 3.21Å; E270-R274 VanDerWaalsContact O-NE 3.15Å; L271-R274 PolarHBondContact O-N 2.65Å; E272-R274 PolarHBondContact O-N 2.89Å; E272-R274 VanDerWaalsContact O-N 3.14Å; R274-E276 PolarHBondContact O-N 3.41Å; R274-N277 PolarHBondContact O-N 2.94Å; R274-N277 VanDerWaalsContact O-N 3.17Å
275	L	90.7	Very high	91.9	Very high	17 Å²	17	73 Å²	73	9%	0.089	35%	0.354	C	S	.	.	G	3₁₀ helix	trans	-65.9	-22.9	-178.1	-54.1	-179.3	0	0	0	112.7	E272 R273 N277 M278 I280 I336 I344	E272-L275 VanDerWaalsContact O-CB 3.23Å; E272-L275 WeakPolarHBondContact O-CB 3.47Å; E272-L275 WeakPolarHBondContact O-CG 3.46Å; E272-L275 PolarHBondContact O-N 3.02Å; R273-L275 VanDerWaalsContact C-N 3.28Å; R273-L275 PolarHBondContact O-N 2.94Å; L275-N277 PolarHBondContact O-N 3.39Å; L275-M278 HydrophobicContact CD2-SD 3.73Å; L275-M278 PolarHBondContact O-N 3.43Å; L275-M278 VanDerWaalsContact O-N 3.1Å; L275-I280 HydrophobicContact CB-CD1 4.2Å; L275-I336 HydrophobicContact CD1-CD1 4.15Å; L275-I336 HydrophobicContact CD1-CG1 4.17Å; L275-I336 HydrophobicContact CD1-CG2 4.05Å; L275-I336 HydrophobicContact CD2-CD1 3.94Å; L275-I336 HydrophobicContact CD2-CG1 3.99Å; L275-I344 HydrophobicContact CD1-CD1 3.52Å; L275-I344 HydrophobicContact CD1-CG1 4.13Å
276	E	89.9	Confident	92.2	Very high	140 Å²	140	79.9 Å²	79.9	65%	0.654	37%	0.369	S	S	*	.	G	3₁₀ helix	trans	-57.8	-28.4	174.3	-58.7	-175.9	148.7	0	0	112.7	R273 R274	R273-E276 WeakPolarHBondContact O-CG 3.32Å; R274-E276 PolarHBondContact O-N 3.41Å
277	N	88.1	Confident	92.6	Very high	111 Å²	111	78.9 Å²	78.9	59%	0.594	36%	0.355	S	S	*	.	G	3₁₀ helix	trans	-97.4	-2	-179.4	-65.9	-55.4	0	0	0	113.9	R274 L275 R370	R274-N277 PolarHBondContact O-N 2.94Å; R274-N277 VanDerWaalsContact O-N 3.17Å; L275-N277 PolarHBondContact O-N 3.39Å; N277-R370 WeakPolarHBondContact O-CD 3.29Å; N277-R370 PolarHBondContact O-NH1 2.82Å
278	M	93	Very high	92.8	Very high	18 Å²	18	79.6 Å²	79.6	9%	0.089	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	158.8	-179.4	-59.5	-175.5	90.5	0	0	111.4	L275 Q334 G367 R368 E369 R370	L275-M278 HydrophobicContact CD2-SD 3.73Å; L275-M278 PolarHBondContact O-N 3.43Å; L275-M278 VanDerWaalsContact O-N 3.1Å; M278-Q334 HydrophobicContact CE-CB 4.09Å; M278-G367 WeakPolarHBondContact CE-O 3.49Å; M278-R368 WeakPolarHBondContact CA-O 3.4Å; M278-R368 WeakPolarHBondContact CB-O 3.47Å; M278-E369 HydrophobicContact CE-CB 4.29Å; M278-R370 PolarHBondContact O-NH2 2.6Å; M278-R370 VanDerWaalsContact O-NH2 3.1Å
279	D	95.6	Very high	92.8	Very high	83 Å²	83	83.1 Å²	83.1	44%	0.444	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	115.5	169.2	-69	-24	0	0	0	109.1	R368 R370	D279-R368 PolarHBondContact N-O 3.06Å; D279-R368 PolarHBondContact O-N 3.42Å; D279-R370 IonicContact OD1-CZ 2.63Å; D279-R370 IonicContact OD1-NE 3.98Å; D279-R370 PolarHBondContact OD1-NE 3.46Å; D279-R370 IonicContact OD1-NH2 2.68Å; D279-R370 PolarHBondContact OD1-NH2 3.02Å; D279-R370 IonicContact OD2-NE 2.66Å
280	I	96.7	Very high	92.7	Very high	83 Å²	83	85 Å²	85	43%	0.426	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	128.2	-172.4	-57.5	175.4	0	0	0	110	L275 I336 K365 I366	L275-I280 HydrophobicContact CB-CD1 4.2Å; I280-I336 HydrophobicContact CD1-CD1 4.09Å; I280-I336 HydrophobicContact CG1-CD1 3.93Å; I280-I336 HydrophobicContact CG2-CD1 3.96Å; I280-K365 HydrophobicContact CG2-CD 4.43Å; I280-K365 HydrophobicContact CG2-CG 3.85Å; I280-I366 CarbonylContact C-O 3.55Å; I280-I366 VanDerWaalsContact CA-O 3.3Å; I280-I366 WeakPolarHBondContact CA-O 3.46Å
281	F	97.6	Very high	93	Very high	61 Å²	61	82.2 Å²	82.2	27%	0.268	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	160.2	179.6	61.3	-82.2	0	0	0	112	V283 I366 R368	F281-V283 HydrophobicContact CD2-CG2 3.71Å; F281-V283 HydrophobicContact CE2-CG2 3.63Å; F281-I366 HydrophobicContact CD1-CB 4.47Å; F281-I366 HydrophobicContact CD2-CB 4.31Å; F281-I366 HydrophobicContact CE1-CB 4.04Å; F281-I366 HydrophobicContact CE1-CG2 3.75Å; F281-I366 HydrophobicContact CE2-CB 3.88Å; F281-I366 HydrophobicContact CE2-CG1 4.32Å; F281-I366 HydrophobicContact CE2-CG2 4.03Å; F281-I366 HydrophobicContact CZ-CB 3.72Å; F281-I366 HydrophobicContact CZ-CG2 3.41Å; F281-I366 VanDerWaalsContact CZ-CG2 3.41Å; F281-I366 PolarHBondContact N-O 2.94Å; F281-I366 PolarHBondContact O-N 3.17Å; F281-R368 HydrophobicContact CE1-CB 3.99Å
282	E	97.6	Very high	93.2	Very high	138 Å²	138	82.7 Å²	82.7	65%	0.645	40%	0.401	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.4	141.7	-177.4	-67.7	178.5	-177.6	0	0	111.2	F364 K365	E282-F364 CarbonylContact C-O 3.44Å; E282-F364 VanDerWaalsContact CA-O 3.32Å; E282-F364 WeakPolarHBondContact CA-O 3.45Å; E282-K365 HydrophobicContact CG-CG 4.18Å; E282-K365 IonicContact OE1-NZ 3.48Å
283	V	97.6	Very high	93.4	Very high	1 Å²	1	78.4 Å²	78.4	1%	0.006	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	112.8	-175.7	176.8	0	0	0	0	109.5	F281 R328 I329 F364 I366	F281-V283 HydrophobicContact CD2-CG2 3.71Å; F281-V283 HydrophobicContact CE2-CG2 3.63Å; V283-R328 HydrophobicContact CG2-CB 4.1Å; V283-I329 HydrophobicContact CB-CD1 4.28Å; V283-I329 HydrophobicContact CB-CG1 4.44Å; V283-I329 HydrophobicContact CG1-CD1 3.98Å; V283-I329 HydrophobicContact CG1-CG1 4.19Å; V283-I329 HydrophobicContact CG2-CD1 4.49Å; V283-I329 HydrophobicContact CG2-CG1 4.13Å; V283-F364 HydrophobicContact CB-CB 4.25Å; V283-F364 PolarHBondContact N-O 3.42Å; V283-F364 WeakPolarHBondContact O-CB 3.49Å; V283-F364 PolarHBondContact O-N 3.48Å; V283-I366 HydrophobicContact CG2-CG1 4.28Å
284	E	97.1	Very high	93.7	Very high	130 Å²	130	74.4 Å²	74.4	61%	0.607	37%	0.371	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.2	125.1	164.9	-58.5	-162	148.4	0	0	110	R328 T361 T363	E284-R328 PolarHBondContact O-NH2 3.19Å; E284-T361 HydrophobicContact CB-CG2 4.2Å; E284-T363 HydrophobicContact CG-CG2 4.3Å
285	L	95.9	Very high	94	Very high	7 Å²	7	71.5 Å²	71.5	4%	0.037	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	129.2	-178.1	-173.5	75.8	0	0	0	111.4	L292 A322 V323 D326 V362 F364	L285-L292 HydrophobicContact CD2-CD2 4.07Å; L285-A322 HydrophobicContact CD1-CB 4.47Å; L285-A322 HydrophobicContact CD2-CB 4.14Å; L285-A322 HydrophobicContact CG-CB 4.38Å; L285-V323 HydrophobicContact CD2-CG2 3.5Å; L285-D326 HydrophobicContact CD1-CB 3.46Å; L285-D326 VanDerWaalsContact CD1-CB 3.46Å; L285-V362 PolarHBondContact N-O 3.01Å; L285-V362 PolarHBondContact O-N 2.97Å; L285-F364 HydrophobicContact CB-CD2 4.24Å; L285-F364 HydrophobicContact CB-CE2 4.04Å; L285-F364 HydrophobicContact CD2-CE2 4.24Å
286	R	95.4	Very high	94.3	Very high	199 Å²	199	71.8 Å²	71.8	75%	0.751	37%	0.368	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.5	120.8	173.5	-165.6	177.9	-179.2	-159.9	0.2	110.7	G288	R286-G288 PolarHBondContact O-N 3.08Å
287	K	94.5	Very high	94.4	Very high	50 Å²	50	66.6 Å²	66.6	22%	0.217	34%	0.344	C	S	.	.			trans	-64.9	124.8	-179.5	-166.7	165.6	-176.7	168.6	0	110.3	L292 L355 R356 T358 G360 V362	K287-L292 HydrophobicContact CB-CD2 4.18Å; K287-L292 HydrophobicContact CD-CD2 4.26Å; K287-L292 HydrophobicContact CD-CG 4.34Å; K287-L292 HydrophobicContact CG-CD2 3.97Å; K287-L292 HydrophobicContact CG-CG 4.23Å; K287-L355 PolarHBondContact NZ-O 3.04Å; K287-R356 PolarHBondContact NZ-O 3.24Å; K287-T358 WeakPolarHBondContact CD-O 3.29Å; K287-T358 PolarHBondContact NZ-O 3.47Å; K287-T358 PolarHBondContact NZ-OG1 2.94Å; K287-G360 PolarHBondContact N-O 3.19Å; K287-V362 HydrophobicContact CB-CG2 4.29Å
288	G	90.4	Very high	94.6	Very high	28 Å²	28	62 Å²	62	29%	0.289	32%	0.323	S	S	.	.	B	Isolated β-bridge	trans	-81.3	175.4	-178.9	0	0	0	0	0	113.2	R286 Q290 G291	R286-G288 PolarHBondContact O-N 3.08Å; G288-Q290 PolarHBondContact O-N 3.33Å; G288-G291 WeakPolarHBondContact CA-O 3.37Å; G288-G291 PolarHBondContact N-O 3.24Å; G288-G291 WeakPolarHBondContact O-CA 3.25Å; G288-G291 PolarHBondContact O-N 3.1Å
289	P	89.4	Confident	94.4	Very high	145 Å²	145	62.8 Å²	62.8	94%	0.942	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-24.8	178.7	27.1	-34.9	0	0	0	113	G291	P289-G291 VanDerWaalsContact C-N 3.32Å
290	Q	88.6	Confident	93.7	Very high	169 Å²	169	60.7 Å²	60.7	79%	0.79	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94	15.7	172.5	-57.5	-177.4	14.4	0	0	112.4	G288	G288-Q290 PolarHBondContact O-N 3.33Å
291	G	93.5	Very high	92.5	Very high	19 Å²	19	59.8 Å²	59.8	20%	0.196	32%	0.323	C	S	.	.	B	Isolated β-bridge	trans	82.6	-144.1	-174	0	0	0	0	0	113.2	G288 P289	G288-G291 WeakPolarHBondContact CA-O 3.37Å; G288-G291 PolarHBondContact N-O 3.24Å; G288-G291 WeakPolarHBondContact O-CA 3.25Å; G288-G291 PolarHBondContact O-N 3.1Å; P289-G291 VanDerWaalsContact C-N 3.32Å
292	L	95.6	Very high	90.9	Very high	15 Å²	15	58.1 Å²	58.1	8%	0.079	32%	0.323	C	S	.	.	S	Bend	trans	-86.1	-24.8	-173.6	-61.9	165.5	0	0	0	113.2	L285 K287 F294 A322 V323 L355 V362 F364	L285-L292 HydrophobicContact CD2-CD2 4.07Å; K287-L292 HydrophobicContact CB-CD2 4.18Å; K287-L292 HydrophobicContact CD-CD2 4.26Å; K287-L292 HydrophobicContact CD-CG 4.34Å; K287-L292 HydrophobicContact CG-CD2 3.97Å; K287-L292 HydrophobicContact CG-CG 4.23Å; L292-F294 HydrophobicContact CB-CD1 3.81Å; L292-F294 HydrophobicContact CB-CE1 3.56Å; L292-F294 HydrophobicContact CB-CZ 4.49Å; L292-F294 HydrophobicContact CD1-CE1 3.99Å; L292-F294 HydrophobicContact CD1-CZ 4.2Å; L292-F294 HydrophobicContact CG-CE1 4.33Å; L292-A322 PolarHBondContact O-N 3.01Å; L292-V323 PolarHBondContact O-N 3.46Å; L292-L355 HydrophobicContact CD1-CB 4.37Å; L292-L355 HydrophobicContact CD1-CD2 3.97Å; L292-V362 HydrophobicContact CD2-CG2 4.2Å; L292-F364 HydrophobicContact CD1-CZ 3.97Å; L292-F364 HydrophobicContact CD2-CE2 4.25Å; L292-F364 HydrophobicContact CD2-CZ 4.02Å
293	G	95.1	Very high	89	Confident	12 Å²	12	55.1 Å²	55.1	12%	0.124	32%	0.322	C	S	.	.			trans	78.4	37.5	175.3	0	0	0	0	0	115.5	S318	G293-S318 WeakPolarHBondContact O-CB 3.45Å; G293-S318 PolarHBondContact O-N 3.13Å
294	F	96.5	Very high	87.2	Confident	32 Å²	32	63.7 Å²	63.7	14%	0.14	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	164.2	170.2	66.4	-92.5	0	0	0	111.4	L292 I296 V314 S316 I317 V323 I335 L355 F364	L292-F294 HydrophobicContact CB-CD1 3.81Å; L292-F294 HydrophobicContact CB-CE1 3.56Å; L292-F294 HydrophobicContact CB-CZ 4.49Å; L292-F294 HydrophobicContact CD1-CE1 3.99Å; L292-F294 HydrophobicContact CD1-CZ 4.2Å; L292-F294 HydrophobicContact CG-CE1 4.33Å; F294-I296 HydrophobicContact CD2-CG2 4.01Å; F294-I296 HydrophobicContact CE2-CG2 3.65Å; F294-V314 HydrophobicContact CB-CG1 4.32Å; F294-V314 HydrophobicContact CD2-CG1 4.49Å; F294-V314 HydrophobicContact CD2-CG2 4.43Å; F294-S316 CarbonylContact C-O 3.59Å; F294-S316 VanDerWaalsContact CA-O 3.23Å; F294-S316 WeakPolarHBondContact CA-O 3.46Å; F294-S316 WeakPolarHBondContact CB-O 3.31Å; F294-I317 HydrophobicContact CB-CG1 4.27Å; F294-V323 HydrophobicContact CD1-CB 4.15Å; F294-V323 HydrophobicContact CD1-CG2 3.45Å; F294-V323 VanDerWaalsContact CD1-CG2 3.45Å; F294-V323 HydrophobicContact CE1-CG2 3.8Å; F294-V323 HydrophobicContact CG-CG2 4.46Å; F294-I335 HydrophobicContact CE2-CD1 3.52Å; F294-I335 HydrophobicContact CZ-CD1 3.87Å; F294-L355 HydrophobicContact CE2-CD1 4.14Å; F294-L355 HydrophobicContact CE2-CD2 4.49Å; F294-L355 HydrophobicContact CZ-CD1 4.37Å; F294-L355 HydrophobicContact CZ-CD2 3.92Å; F294-F364 HydrophobicContact CE1-CE1 4.49Å; F294-F364 HydrophobicContact CE1-CZ 4.33Å; F294-F364 HydrophobicContact CZ-CE1 4.14Å; F294-F364 HydrophobicContact CZ-CZ 4.38Å
295	S	95.8	Very high	85.3	Confident	43 Å²	43	61.3 Å²	61.3	30%	0.301	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	154.1	172.5	75.6	0	0	0	0	111.3	K315 S316	S295-K315 PolarHBondContact O-N 3.36Å; S295-S316 PolarHBondContact N-O 2.85Å; S295-S316 PolarHBondContact OG-N 3.08Å; S295-S316 PolarHBondContact OG-OG 2.93Å
296	I	96	Very high	83.7	Confident	24 Å²	24	64.4 Å²	64.4	12%	0.123	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	150.2	179.1	59.5	161	0	0	0	112.7	F294 I312 F313 I335 Q348 A351 A352 L355	F294-I296 HydrophobicContact CD2-CG2 4.01Å; F294-I296 HydrophobicContact CE2-CG2 3.65Å; I296-I312 HydrophobicContact CB-CG2 3.97Å; I296-I312 HydrophobicContact CD1-CG2 3.78Å; I296-I312 HydrophobicContact CG1-CG2 4.5Å; I296-I312 HydrophobicContact CG2-CG2 3.95Å; I296-F313 CarbonylContact C-O 3.59Å; I296-F313 VanDerWaalsContact CA-O 3.25Å; I296-F313 WeakPolarHBondContact CA-O 3.16Å; I296-I335 HydrophobicContact CG2-CD1 3.86Å; I296-Q348 HydrophobicContact CD1-CG 4.15Å; I296-Q348 PolarHBondContact O-NE2 2.83Å; I296-A351 HydrophobicContact CD1-CB 3.93Å; I296-A352 HydrophobicContact CD1-CB 4.28Å; I296-L355 HydrophobicContact CD1-CD1 4.03Å; I296-L355 HydrophobicContact CG1-CD1 4.47Å; I296-L355 HydrophobicContact CG2-CD1 3.75Å
297	I	93.1	Very high	82.3	Confident	30 Å²	30	57 Å²	57	15%	0.154	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	137	165.4	-171.1	170.5	0	0	0	109	M299 F313 K315 I381	I297-M299 HydrophobicContact CD1-CG 4.25Å; I297-M299 HydrophobicContact CD1-SD 4.22Å; I297-M299 HydrophobicContact CG1-CG 4.05Å; I297-M299 HydrophobicContact CG1-SD 4.46Å; I297-M299 HydrophobicContact CG2-CG 4.37Å; I297-M299 HydrophobicContact CG2-SD 4.09Å; I297-F313 HydrophobicContact CG2-CB 3.98Å; I297-F313 PolarHBondContact N-O 2.97Å; I297-F313 PolarHBondContact O-N 3.29Å; I297-K315 HydrophobicContact CB-CB 4Å; I297-K315 HydrophobicContact CB-CD 4.22Å; I297-K315 HydrophobicContact CD1-CD 4.46Å; I297-K315 HydrophobicContact CG2-CB 3.94Å; I297-I381 HydrophobicContact CG2-CD1 4.17Å; I297-I381 HydrophobicContact CG2-CG1 4.07Å
298	G	92.4	Very high	81.5	Confident	16 Å²	16	60.1 Å²	60.1	17%	0.165	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	129	170.6	0	0	0	0	0	109.8	G311	G298-G311 WeakPolarHBondContact CA-O 3.5Å
299	M	88.9	Confident	81.4	Confident	33 Å²	33	60.7 Å²	60.7	16%	0.163	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	128	-179.9	-64.2	176.4	64.9	0	0	109.7	I297 G311 F313 I377 L380 I381	I297-M299 HydrophobicContact CD1-CG 4.25Å; I297-M299 HydrophobicContact CD1-SD 4.22Å; I297-M299 HydrophobicContact CG1-CG 4.05Å; I297-M299 HydrophobicContact CG1-SD 4.46Å; I297-M299 HydrophobicContact CG2-CG 4.37Å; I297-M299 HydrophobicContact CG2-SD 4.09Å; M299-G311 PolarHBondContact N-O 2.97Å; M299-G311 PolarHBondContact O-N 3.25Å; M299-F313 HydrophobicContact CB-CD2 4.05Å; M299-F313 HydrophobicContact CB-CE2 4.02Å; M299-F313 HydrophobicContact CG-CD2 4.44Å; M299-F313 HydrophobicContact SD-CD2 4.46Å; M299-I377 HydrophobicContact CE-CB 4.41Å; M299-I377 HydrophobicContact CE-CG2 3.75Å; M299-I377 HydrophobicContact SD-CG2 3.83Å; M299-L380 HydrophobicContact CE-CB 3.57Å; M299-L380 HydrophobicContact CE-CD1 3.69Å; M299-L380 HydrophobicContact CE-CG 4.29Å; M299-I381 HydrophobicContact SD-CD1 4.06Å; M299-I381 HydrophobicContact SD-CG1 3.62Å
300	G	80.3	Confident	81.5	Confident	39 Å²	39	54.8 Å²	54.8	40%	0.402	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	179.9	-156.8	-174.9	0	0	0	0	0	112.8
301	V	71.1	Confident	81.7	Confident	64 Å²	64	46.7 Å²	46.7	39%	0.388	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	145.9	-175.9	-74.3	0	0	0	0	110.6	A267 K309	A267-V301 HydrophobicContact CB-CG2 3.85Å; V301-K309 PolarHBondContact N-O 3.42Å
302	G	64.3	Low	81.8	Confident	26 Å²	26	45.8 Å²	45.8	27%	0.268	30%	0.302	S	S	.	.			trans	102.9	1.3	171.1	0	0	0	0	0	117	D304 A305 G306 L307	G302-D304 VanDerWaalsContact C-N 3.33Å; G302-D304 PolarHBondContact O-N 3.23Å; G302-A305 CarbonylContact O-C 3.4Å; G302-A305 WeakPolarHBondContact O-CA 3.33Å; G302-A305 PolarHBondContact O-N 2.97Å; G302-G306 PolarHBondContact O-N 3.5Å; G302-L307 CarbonylContact C-O 3.49Å; G302-L307 VanDerWaalsContact CA-O 3.31Å; G302-L307 WeakPolarHBondContact CA-O 3.42Å; G302-L307 PolarHBondContact O-N 3.06Å
303	A	58.4	Low	81.9	Confident	76 Å²	76	45.4 Å²	45.4	63%	0.628	30%	0.3	S	S	*	.	G	3₁₀ helix	trans	-53.8	-45.4	178	0	0	0	0	0	113.2	A305	A303-A305 PolarHBondContact O-N 3.21Å
304	D	59.3	Low	82	Confident	181 Å²	181	44.9 Å²	44.9	97%	0.968	29%	0.294	S	S	*	.	G	3₁₀ helix	trans	-74.3	-9.8	176.7	-55.5	-53.3	0	0	0	113.7	G302	G302-D304 VanDerWaalsContact C-N 3.33Å; G302-D304 PolarHBondContact O-N 3.23Å
305	A	57.6	Low	81.9	Confident	80 Å²	80	44.9 Å²	44.9	66%	0.661	29%	0.294	S	S	*	.	G	3₁₀ helix	trans	-107.4	7.3	-177.9	0	0	0	0	0	113.2	G302 A303 L307	G302-A305 CarbonylContact O-C 3.4Å; G302-A305 WeakPolarHBondContact O-CA 3.33Å; G302-A305 PolarHBondContact O-N 2.97Å; A303-A305 PolarHBondContact O-N 3.21Å; A305-L307 PolarHBondContact O-N 3.33Å
306	G	62.5	Low	81.9	Confident	71 Å²	71	44.9 Å²	44.9	73%	0.732	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.9	6.7	-175.6	0	0	0	0	0	114.8	G302	G302-G306 PolarHBondContact O-N 3.5Å
307	L	65.5	Low	81.9	Confident	44 Å²	44	46.1 Å²	46.1	23%	0.23	30%	0.3	C	S	.	.			trans	-104	94.6	-179.1	-121.7	77.2	0	0	0	110.1	I263 A264 G302 A305 K309	I263-L307 HydrophobicContact CB-CD2 4.31Å; I263-L307 HydrophobicContact CG2-CD2 3.86Å; A264-L307 HydrophobicContact CB-CD2 4.13Å; G302-L307 CarbonylContact C-O 3.49Å; G302-L307 VanDerWaalsContact CA-O 3.31Å; G302-L307 WeakPolarHBondContact CA-O 3.42Å; G302-L307 PolarHBondContact O-N 3.06Å; A305-L307 PolarHBondContact O-N 3.33Å; L307-K309 HydrophobicContact CD2-CG 4.31Å; L307-K309 HydrophobicContact CG-CG 4.46Å; L307-K309 PolarHBondContact O-N 3.08Å
308	E	76.8	Confident	82	Confident	115 Å²	115	47 Å²	47	54%	0.537	31%	0.31	S	S	.	.			trans	-76.1	68.8	176.9	-68.8	-168.4	-169.9	0	0	112.6	V346 S347	E308-V346 CarbonylContact O-C 3.49Å; E308-S347 WeakPolarHBondContact OE2-CB 3.31Å
309	K	88.5	Confident	82	Confident	41 Å²	41	51.6 Å²	51.6	18%	0.178	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	97.3	173.4	-62.5	-57.8	-172.7	178.3	0	109.8	A267 E268 L271 V301 L307 G345	A267-K309 HydrophobicContact CB-CB 3.83Å; A267-K309 HydrophobicContact CB-CG 3.84Å; E268-K309 HydrophobicContact CG-CD 4Å; E268-K309 WeakPolarHBondContact OE1-CE 3.13Å; E268-K309 IonicContact OE1-NZ 3.88Å; E268-K309 PolarHBondContact OE1-NZ 3.01Å; L271-K309 HydrophobicContact CD1-CB 4.39Å; V301-K309 PolarHBondContact N-O 3.42Å; L307-K309 HydrophobicContact CD2-CG 4.31Å; L307-K309 HydrophobicContact CG-CG 4.46Å; L307-K309 PolarHBondContact O-N 3.08Å; K309-G345 WeakPolarHBondContact CD-O 3.36Å; K309-G345 PolarHBondContact NZ-O 3Å
310	L	91.5	Very high	82.2	Confident	20 Å²	20	56.5 Å²	56.5	11%	0.105	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	145.4	-171.3	-47	174.6	0	0	0	111.9	I312 G345 V346 Q348	L310-I312 HydrophobicContact CB-CD1 4.39Å; L310-G345 WeakPolarHBondContact O-CA 3.46Å; L310-G345 PolarHBondContact O-N 3.4Å; L310-V346 WeakPolarHBondContact CB-O 3.4Å; L310-V346 PolarHBondContact N-O 3.07Å; L310-V346 PolarHBondContact O-N 3.15Å; L310-Q348 HydrophobicContact CD1-CB 4.19Å
311	G	93.7	Very high	82.8	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	144	153	0	0	0	0	0	109.5	G298 M299 F313	G298-G311 WeakPolarHBondContact CA-O 3.5Å; M299-G311 PolarHBondContact N-O 2.97Å; M299-G311 PolarHBondContact O-N 3.25Å; G311-F313 WeakPolarHBondContact O-CD2 3.34Å; G311-F313 WeakPolarHBondContact O-CE2 3.44Å
312	I	95.7	Very high	83.9	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	116.2	-175.2	-56.3	-61.2	0	0	0	109.4	I296 L310 I335 L343 V346 A351	I296-I312 HydrophobicContact CB-CG2 3.97Å; I296-I312 HydrophobicContact CD1-CG2 3.78Å; I296-I312 HydrophobicContact CG1-CG2 4.5Å; I296-I312 HydrophobicContact CG2-CG2 3.95Å; L310-I312 HydrophobicContact CB-CD1 4.39Å; I312-I335 HydrophobicContact CG2-CD1 4.4Å; I312-I335 PolarHBondContact O-N 2.76Å; I312-L343 HydrophobicContact CB-CB 4.49Å; I312-L343 HydrophobicContact CG1-CB 4.18Å; I312-L343 WeakPolarHBondContact CG1-O 3.25Å; I312-V346 HydrophobicContact CD1-CG2 4.26Å; I312-V346 HydrophobicContact CG1-CG2 4.02Å; I312-A351 HydrophobicContact CB-CB 4.48Å; I312-A351 HydrophobicContact CD1-CB 3.61Å; I312-A351 HydrophobicContact CG1-CB 3.65Å; I312-A351 HydrophobicContact CG2-CB 4.09Å
313	F	96.4	Very high	85.5	Confident	7 Å²	7	51.2 Å²	51.2	3%	0.031	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	149.5	-174.1	-60.1	-93.1	0	0	0	112	I296 I297 M299 G311 K315 D333 Q334 I377 I381	I296-F313 CarbonylContact C-O 3.59Å; I296-F313 VanDerWaalsContact CA-O 3.25Å; I296-F313 WeakPolarHBondContact CA-O 3.16Å; I297-F313 HydrophobicContact CG2-CB 3.98Å; I297-F313 PolarHBondContact N-O 2.97Å; I297-F313 PolarHBondContact O-N 3.29Å; M299-F313 HydrophobicContact CB-CD2 4.05Å; M299-F313 HydrophobicContact CB-CE2 4.02Å; M299-F313 HydrophobicContact CG-CD2 4.44Å; M299-F313 HydrophobicContact SD-CD2 4.46Å; G311-F313 WeakPolarHBondContact O-CD2 3.34Å; G311-F313 WeakPolarHBondContact O-CE2 3.44Å; F313-K315 PolarHBondContact O-N 3.15Å; F313-D333 CarbonylContact C-O 3.59Å; F313-D333 VanDerWaalsContact CA-O 3.3Å; F313-D333 WeakPolarHBondContact CA-O 3.26Å; F313-Q334 HydrophobicContact CD1-CB 3.74Å; F313-Q334 HydrophobicContact CD1-CG 4.05Å; F313-Q334 HydrophobicContact CE1-CB 3.53Å; F313-Q334 HydrophobicContact CE1-CG 3.68Å; F313-Q334 HydrophobicContact CE2-CG 4.49Å; F313-Q334 HydrophobicContact CZ-CB 4.27Å; F313-Q334 HydrophobicContact CZ-CG 3.91Å; F313-Q334 VanDerWaalsContact CZ-OE1 3.31Å; F313-I377 HydrophobicContact CD1-CG2 3.97Å; F313-I377 HydrophobicContact CD2-CG2 4.23Å; F313-I377 HydrophobicContact CE1-CD1 4.08Å; F313-I377 HydrophobicContact CE1-CG2 3.81Å; F313-I377 HydrophobicContact CE2-CD1 4.35Å; F313-I377 HydrophobicContact CE2-CG2 4.09Å; F313-I377 HydrophobicContact CG-CG2 4.18Å; F313-I377 HydrophobicContact CZ-CD1 3.63Å; F313-I377 HydrophobicContact CZ-CG2 3.9Å; F313-I381 HydrophobicContact CB-CD1 3.68Å; F313-I381 HydrophobicContact CD1-CD1 4.48Å; F313-I381 HydrophobicContact CG-CD1 4.15Å
314	V	97.1	Very high	87.3	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	107.9	174.1	-180	0	0	0	0	109.3	F294 I317 I329 Q330 C332 D333 I335	F294-V314 HydrophobicContact CB-CG1 4.32Å; F294-V314 HydrophobicContact CD2-CG1 4.49Å; F294-V314 HydrophobicContact CD2-CG2 4.43Å; V314-I317 HydrophobicContact CG1-CD1 4.34Å; V314-I317 HydrophobicContact CG1-CG1 3.88Å; V314-I329 HydrophobicContact CG2-CG2 3.87Å; V314-Q330 WeakPolarHBondContact CB-O 3.04Å; V314-Q330 WeakPolarHBondContact CG1-O 3.04Å; V314-C332 PolarHBondContact O-N 2.93Å; V314-D333 HydrophobicContact CG2-CB 4.17Å; V314-D333 PolarHBondContact N-O 3.09Å; V314-I335 HydrophobicContact CG2-CD1 4.16Å; V314-I335 HydrophobicContact CG2-CG1 4.11Å
315	K	95.8	Very high	88.9	Confident	32 Å²	32	47.8 Å²	47.8	14%	0.139	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	-45.4	-180	175.9	169	173.9	167.8	0	112	S295 I297 F313 V331 S384 L385 D388	S295-K315 PolarHBondContact O-N 3.36Å; I297-K315 HydrophobicContact CB-CB 4Å; I297-K315 HydrophobicContact CB-CD 4.22Å; I297-K315 HydrophobicContact CD1-CD 4.46Å; I297-K315 HydrophobicContact CG2-CB 3.94Å; F313-K315 PolarHBondContact O-N 3.15Å; K315-V331 WeakPolarHBondContact O-CG1 3.41Å; K315-S384 PolarHBondContact NZ-OG 3.05Å; K315-L385 HydrophobicContact CG-CD2 3.98Å; K315-L385 HydrophobicContact CG-CG 4.48Å; K315-L385 WeakPolarHBondContact O-CD1 3.4Å; K315-L385 WeakPolarHBondContact O-CD2 3.28Å; K315-D388 WeakPolarHBondContact CE-OD2 3.39Å; K315-D388 IonicContact NZ-OD1 3.94Å; K315-D388 IonicContact NZ-OD2 2.69Å; K315-D388 PolarHBondContact NZ-OD2 3.41Å
316	S	94.9	Very high	90.7	Very high	43 Å²	43	46.5 Å²	46.5	30%	0.301	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	153.5	177.3	67.9	0	0	0	0	111.6	F294 S295	F294-S316 CarbonylContact C-O 3.59Å; F294-S316 VanDerWaalsContact CA-O 3.23Å; F294-S316 WeakPolarHBondContact CA-O 3.46Å; F294-S316 WeakPolarHBondContact CB-O 3.31Å; S295-S316 PolarHBondContact N-O 2.85Å; S295-S316 PolarHBondContact OG-N 3.08Å; S295-S316 PolarHBondContact OG-OG 2.93Å
317	I	96.4	Very high	92.3	Very high	50 Å²	50	45.3 Å²	45.3	26%	0.256	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	131.9	177.1	-66.1	169.1	0	0	0	108.2	F294 V314 V323 A324 I329 V331	F294-I317 HydrophobicContact CB-CG1 4.27Å; V314-I317 HydrophobicContact CG1-CD1 4.34Å; V314-I317 HydrophobicContact CG1-CG1 3.88Å; I317-V323 HydrophobicContact CD1-CG1 3.78Å; I317-V323 HydrophobicContact CG1-CG1 3.94Å; I317-V323 HydrophobicContact CG2-CG1 3.94Å; I317-A324 HydrophobicContact CG2-CB 3.73Å; I317-I329 WeakPolarHBondContact CD1-O 3.48Å; I317-V331 HydrophobicContact CD1-CG2 4.24Å; I317-V331 HydrophobicContact CG1-CG2 4.22Å
318	S	95	Very high	93.8	Very high	50 Å²	50	48.2 Å²	48.2	35%	0.35	27%	0.274	S	S	.	.			trans	-78.9	131.1	-180	-52.6	0	0	0	0	110.4	G293 N320 G321 A324	G293-S318 WeakPolarHBondContact O-CB 3.45Å; G293-S318 PolarHBondContact O-N 3.13Å; S318-N320 PolarHBondContact O-N 2.9Å; S318-G321 PolarHBondContact O-N 3.22Å; S318-A324 WeakPolarHBondContact O-CB 3.49Å
319	P	93.1	Very high	94.8	Very high	111 Å²	111	43 Å²	43	72%	0.721	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.4	137.6	175.1	26.1	-34.1	0	0	0	110.3	G321	P319-G321 PolarHBondContact O-N 3.21Å; P319-G321 VanDerWaalsContact O-N 3.15Å
320	N	92.1	Very high	95.1	Very high	137 Å²	137	45.7 Å²	45.7	73%	0.733	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.2	9.6	-173.2	-47.6	-45	0	0	0	115.5	S318	S318-N320 PolarHBondContact O-N 2.9Å
321	G	93	Very high	95.3	Very high	4 Å²	4	47.6 Å²	47.6	4%	0.041	28%	0.275	C	S	.	.	S	Bend	trans	-69	162.4	170.2	0	0	0	0	0	112.7	S318 P319 V323 A324 L325	S318-G321 PolarHBondContact O-N 3.22Å; P319-G321 PolarHBondContact O-N 3.21Å; P319-G321 VanDerWaalsContact O-N 3.15Å; G321-V323 VanDerWaalsContact C-N 3.35Å; G321-V323 PolarHBondContact O-N 2.86Å; G321-A324 WeakPolarHBondContact O-CB 3.43Å; G321-A324 PolarHBondContact O-N 3.32Å; G321-L325 WeakPolarHBondContact O-CG 3.4Å; G321-L325 PolarHBondContact O-N 3.22Å
322	A	95.3	Very high	95.3	Very high	13 Å²	13	49.3 Å²	49.3	11%	0.107	29%	0.287	C	S	.	.	H	α-helix	trans	-58.3	-44.2	-177.4	0	0	0	0	0	112.4	L285 L292 A324 L325 D326	L285-A322 HydrophobicContact CD1-CB 4.47Å; L285-A322 HydrophobicContact CD2-CB 4.14Å; L285-A322 HydrophobicContact CG-CB 4.38Å; L292-A322 PolarHBondContact O-N 3.01Å; A322-A324 VanDerWaalsContact C-N 3.34Å; A322-A324 PolarHBondContact O-N 3.25Å; A322-L325 PolarHBondContact O-N 2.64Å; A322-D326 PolarHBondContact O-N 3.48Å
323	V	96.5	Very high	95.4	Very high	1 Å²	1	49.4 Å²	49.4	1%	0.006	29%	0.287	C	S	.	.	H	α-helix	trans	-60	-40.1	172.5	159.8	0	0	0	0	112.6	L285 L292 F294 I317 G321 L325 D326 G327 I329	L285-V323 HydrophobicContact CD2-CG2 3.5Å; L292-V323 PolarHBondContact O-N 3.46Å; F294-V323 HydrophobicContact CD1-CB 4.15Å; F294-V323 HydrophobicContact CD1-CG2 3.45Å; F294-V323 VanDerWaalsContact CD1-CG2 3.45Å; F294-V323 HydrophobicContact CE1-CG2 3.8Å; F294-V323 HydrophobicContact CG-CG2 4.46Å; I317-V323 HydrophobicContact CD1-CG1 3.78Å; I317-V323 HydrophobicContact CG1-CG1 3.94Å; I317-V323 HydrophobicContact CG2-CG1 3.94Å; G321-V323 VanDerWaalsContact C-N 3.35Å; G321-V323 PolarHBondContact O-N 2.86Å; V323-L325 VanDerWaalsContact C-N 3.3Å; V323-L325 PolarHBondContact O-N 2.71Å; V323-D326 PolarHBondContact O-N 3.13Å; V323-G327 PolarHBondContact O-N 3.22Å; V323-I329 HydrophobicContact CG1-CB 3.9Å; V323-I329 HydrophobicContact CG1-CG2 4.16Å; V323-I329 HydrophobicContact CG2-CB 4.49Å; V323-I329 HydrophobicContact CG2-CD1 4.24Å
324	A	95.6	Very high	95.4	Very high	44 Å²	44	49.2 Å²	49.2	36%	0.364	29%	0.286	S	S	.	.	H	α-helix	trans	-67.3	-30.7	179.6	0	0	0	0	0	113.2	I317 S318 G321 A322	I317-A324 HydrophobicContact CG2-CB 3.73Å; S318-A324 WeakPolarHBondContact O-CB 3.49Å; G321-A324 WeakPolarHBondContact O-CB 3.43Å; G321-A324 PolarHBondContact O-N 3.32Å; A322-A324 VanDerWaalsContact C-N 3.34Å; A322-A324 PolarHBondContact O-N 3.25Å
325	L	94.5	Very high	95.4	Very high	140 Å²	140	49.2 Å²	49.2	73%	0.733	29%	0.287	S	S	*	.	H	α-helix	trans	-78.3	-22.3	176.4	-65.9	170.6	0	0	0	112.9	G321 A322 V323	G321-L325 WeakPolarHBondContact O-CG 3.4Å; G321-L325 PolarHBondContact O-N 3.22Å; A322-L325 PolarHBondContact O-N 2.64Å; V323-L325 VanDerWaalsContact C-N 3.3Å; V323-L325 PolarHBondContact O-N 2.71Å
326	D	95.2	Very high	95.4	Very high	54 Å²	54	48.3 Å²	48.3	29%	0.289	28%	0.283	S	S	.	.	H	α-helix	trans	-91.2	-37.6	178.5	-176.2	90.6	0	0	0	113	L285 A322 V323 R328	L285-D326 HydrophobicContact CD1-CB 3.46Å; L285-D326 VanDerWaalsContact CD1-CB 3.46Å; A322-D326 PolarHBondContact O-N 3.48Å; V323-D326 PolarHBondContact O-N 3.13Å; D326-R328 PolarHBondContact O-N 3.05Å; D326-R328 VanDerWaalsContact O-N 3.12Å; D326-R328 IonicContact OD1-CZ 3.45Å; D326-R328 IonicContact OD1-NE 3.35Å; D326-R328 PolarHBondContact OD1-NE 3.38Å; D326-R328 IonicContact OD1-NH2 2.69Å; D326-R328 PolarHBondContact OD1-NH2 3.04Å; D326-R328 WeakPolarHBondContact OD2-CB 3.38Å; D326-R328 WeakPolarHBondContact OD2-CG 3.37Å; D326-R328 IonicContact OD2-CZ 3.53Å; D326-R328 PolarHBondContact OD2-N 3.18Å; D326-R328 IonicContact OD2-NE 2.79Å; D326-R328 PolarHBondContact OD2-NE 3.26Å; D326-R328 IonicContact OD2-NH2 3.45Å; D326-R328 PolarHBondContact OD2-NH2 3.39Å
327	G	95.3	Very high	95.6	Very high	45 Å²	45	48.8 Å²	48.8	46%	0.464	28%	0.281	S	S	.	.			trans	74.1	-7.2	170.6	0	0	0	0	0	116.8	V323	V323-G327 PolarHBondContact O-N 3.22Å
328	R	97.1	Very high	95.6	Very high	106 Å²	106	46.4 Å²	46.4	40%	0.4	27%	0.268	S	S	.	.	S	Bend	trans	-72.1	-38.4	179.1	-68.7	178.4	-77.5	173.7	-6.8	113.1	V283 E284 D326 R368	V283-R328 HydrophobicContact CG2-CB 4.1Å; E284-R328 PolarHBondContact O-NH2 3.19Å; D326-R328 PolarHBondContact O-N 3.05Å; D326-R328 VanDerWaalsContact O-N 3.12Å; D326-R328 IonicContact OD1-CZ 3.45Å; D326-R328 IonicContact OD1-NE 3.35Å; D326-R328 PolarHBondContact OD1-NE 3.38Å; D326-R328 IonicContact OD1-NH2 2.69Å; D326-R328 PolarHBondContact OD1-NH2 3.04Å; D326-R328 WeakPolarHBondContact OD2-CB 3.38Å; D326-R328 WeakPolarHBondContact OD2-CG 3.37Å; D326-R328 IonicContact OD2-CZ 3.53Å; D326-R328 PolarHBondContact OD2-N 3.18Å; D326-R328 IonicContact OD2-NE 2.79Å; D326-R328 PolarHBondContact OD2-NE 3.26Å; D326-R328 IonicContact OD2-NH2 3.45Å; D326-R328 PolarHBondContact OD2-NH2 3.39Å; R328-R368 PolarHBondContact O-NH2 2.96Å
329	I	97.2	Very high	95.7	Very high	6 Å²	6	46.7 Å²	46.7	3%	0.031	27%	0.266	C	S	.	.			trans	-88.4	136.9	179.2	-60.5	176.1	0	0	0	109.8	V283 V314 I317 V323 D333 F364 I366	V283-I329 HydrophobicContact CB-CD1 4.28Å; V283-I329 HydrophobicContact CB-CG1 4.44Å; V283-I329 HydrophobicContact CG1-CD1 3.98Å; V283-I329 HydrophobicContact CG1-CG1 4.19Å; V283-I329 HydrophobicContact CG2-CD1 4.49Å; V283-I329 HydrophobicContact CG2-CG1 4.13Å; V314-I329 HydrophobicContact CG2-CG2 3.87Å; I317-I329 WeakPolarHBondContact CD1-O 3.48Å; V323-I329 HydrophobicContact CG1-CB 3.9Å; V323-I329 HydrophobicContact CG1-CG2 4.16Å; V323-I329 HydrophobicContact CG2-CB 4.49Å; V323-I329 HydrophobicContact CG2-CD1 4.24Å; I329-D333 WeakPolarHBondContact CA-OD2 3.38Å; I329-D333 HydrophobicContact CG2-CB 4.43Å; I329-F364 HydrophobicContact CD1-CG 4.44Å; I329-I366 HydrophobicContact CD1-CD1 3.87Å; I329-I366 HydrophobicContact CD1-CG1 4.08Å; I329-I366 HydrophobicContact CG1-CD1 4.23Å; I329-I366 HydrophobicContact CG1-CG1 4.08Å
330	Q	95.8	Very high	95.7	Very high	96 Å²	96	50 Å²	50	45%	0.449	27%	0.269	S	S	.	.			trans	-126	168.4	-174.1	-65.5	178.5	3.3	0	0	111.3	V314 D333	V314-Q330 WeakPolarHBondContact CB-O 3.04Å; V314-Q330 WeakPolarHBondContact CG1-O 3.04Å; Q330-D333 PolarHBondContact N-OD2 2.96Å; Q330-D333 WeakPolarHBondContact O-CB 3.47Å; Q330-D333 PolarHBondContact O-N 2.95Å
331	V	95.2	Very high	95.9	Very high	60 Å²	60	47.9 Å²	47.9	36%	0.364	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	146.4	170.9	176.5	0	0	0	0	109.1	K315 I317 D333 I381 L385	K315-V331 WeakPolarHBondContact O-CG1 3.41Å; I317-V331 HydrophobicContact CD1-CG2 4.24Å; I317-V331 HydrophobicContact CG1-CG2 4.22Å; V331-D333 PolarHBondContact O-N 2.97Å; V331-I381 HydrophobicContact CG1-CG2 4.15Å; V331-L385 HydrophobicContact CG1-CD1 4.11Å
332	C	94.2	Very high	96.1	Very high	36 Å²	36	50.5 Å²	50.5	24%	0.243	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	72	-2.9	-171.1	-52	0	0	0	0	116.3	V314 I381	V314-C332 PolarHBondContact O-N 2.93Å; C332-I381 HydrophobicContact CB-CD1 4.25Å
333	D	96.9	Very high	96.1	Very high	2 Å²	2	49.9 Å²	49.9	1%	0.011	27%	0.266	C	S	.	.			trans	-62.1	139.4	169.6	-79.7	-7.8	0	0	0	111.5	F313 V314 I329 Q330 V331 I366 R368	F313-D333 CarbonylContact C-O 3.59Å; F313-D333 VanDerWaalsContact CA-O 3.3Å; F313-D333 WeakPolarHBondContact CA-O 3.26Å; V314-D333 HydrophobicContact CG2-CB 4.17Å; V314-D333 PolarHBondContact N-O 3.09Å; I329-D333 WeakPolarHBondContact CA-OD2 3.38Å; I329-D333 HydrophobicContact CG2-CB 4.43Å; Q330-D333 PolarHBondContact N-OD2 2.96Å; Q330-D333 WeakPolarHBondContact O-CB 3.47Å; Q330-D333 PolarHBondContact O-N 2.95Å; V331-D333 PolarHBondContact O-N 2.97Å; D333-I366 HydrophobicContact CB-CG2 3.73Å; D333-R368 VanDerWaalsContact CG-NH2 3.33Å; D333-R368 IonicContact OD1-CZ 3.71Å; D333-R368 IonicContact OD1-NE 3.21Å; D333-R368 PolarHBondContact OD1-NE 3.2Å; D333-R368 IonicContact OD1-NH2 2.73Å; D333-R368 PolarHBondContact OD1-NH2 3.35Å; D333-R368 VanDerWaalsContact OD1-NH2 3.12Å; D333-R368 IonicContact OD2-CZ 3.66Å; D333-R368 IonicContact OD2-NE 3.84Å; D333-R368 IonicContact OD2-NH2 3.35Å; D333-R368 PolarHBondContact OD2-NH2 3.39Å
334	Q	96.3	Very high	96	Very high	3 Å²	3	51 Å²	51	1%	0.014	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	130.5	170.8	-166.8	173	-24.7	0	0	110.7	M278 F313 I366 G367	M278-Q334 HydrophobicContact CE-CB 4.09Å; F313-Q334 HydrophobicContact CD1-CB 3.74Å; F313-Q334 HydrophobicContact CD1-CG 4.05Å; F313-Q334 HydrophobicContact CE1-CB 3.53Å; F313-Q334 HydrophobicContact CE1-CG 3.68Å; F313-Q334 HydrophobicContact CE2-CG 4.49Å; F313-Q334 HydrophobicContact CZ-CB 4.27Å; F313-Q334 HydrophobicContact CZ-CG 3.91Å; F313-Q334 VanDerWaalsContact CZ-OE1 3.31Å; Q334-I366 CarbonylContact O-C 3.52Å; Q334-I366 WeakPolarHBondContact O-CA 3.36Å; Q334-G367 PolarHBondContact N-O 2.95Å; Q334-G367 PolarHBondContact O-N 2.93Å
335	I	97.5	Very high	95.8	Very high	1 Å²	1	49 Å²	49	1%	0.005	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	109.5	172.6	-46.9	178.5	0	0	0	107.9	F294 I296 I312 V314 V338 L343 L355 F364 I366	F294-I335 HydrophobicContact CE2-CD1 3.52Å; F294-I335 HydrophobicContact CZ-CD1 3.87Å; I296-I335 HydrophobicContact CG2-CD1 3.86Å; I312-I335 HydrophobicContact CG2-CD1 4.4Å; I312-I335 PolarHBondContact O-N 2.76Å; V314-I335 HydrophobicContact CG2-CD1 4.16Å; V314-I335 HydrophobicContact CG2-CG1 4.11Å; I335-V338 HydrophobicContact CG2-CG2 3.6Å; I335-L343 HydrophobicContact CB-CD1 4.37Å; I335-L343 HydrophobicContact CG2-CD1 3.86Å; I335-L355 HydrophobicContact CD1-CD1 4.43Å; I335-F364 HydrophobicContact CG2-CD1 4.09Å; I335-I366 HydrophobicContact CG1-CD1 4.32Å; I335-I366 HydrophobicContact CG2-CD1 4.37Å
336	I	97	Very high	95.7	Very high	12 Å²	12	43.5 Å²	43.5	6%	0.062	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	-43.8	-177	-61.2	171.3	0	0	0	110.1	L275 I280 S342 L343 I344 K365	L275-I336 HydrophobicContact CD1-CD1 4.15Å; L275-I336 HydrophobicContact CD1-CG1 4.17Å; L275-I336 HydrophobicContact CD1-CG2 4.05Å; L275-I336 HydrophobicContact CD2-CD1 3.94Å; L275-I336 HydrophobicContact CD2-CG1 3.99Å; I280-I336 HydrophobicContact CD1-CD1 4.09Å; I280-I336 HydrophobicContact CG1-CD1 3.93Å; I280-I336 HydrophobicContact CG2-CD1 3.96Å; I336-S342 WeakPolarHBondContact O-CA 3.45Å; I336-L343 PolarHBondContact O-N 2.86Å; I336-I344 HydrophobicContact CG2-CD1 4.08Å; I336-I344 HydrophobicContact CG2-CG1 4.26Å; I336-K365 HydrophobicContact CB-CB 4.29Å; I336-K365 HydrophobicContact CB-CG 4.39Å; I336-K365 WeakPolarHBondContact CB-O 3.3Å; I336-K365 HydrophobicContact CG2-CD 4.42Å; I336-K365 PolarHBondContact N-O 3.33Å
337	E	97.6	Very high	95.5	Very high	54 Å²	54	42.5 Å²	42.5	25%	0.252	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	144.1	-172.6	-156.9	-172.7	119.5	0	0	110.6	K340 K341 F364 K365	E337-K340 WeakPolarHBondContact OE1-CA 3.44Å; E337-K341 CarbonylContact C-O 3.6Å; E337-K341 VanDerWaalsContact CA-O 3.31Å; E337-K341 WeakPolarHBondContact CA-O 3.31Å; E337-F364 WeakPolarHBondContact O-CA 3.32Å; E337-K365 HydrophobicContact CB-CB 3.47Å; E337-K365 VanDerWaalsContact CB-CB 3.47Å; E337-K365 HydrophobicContact CB-CD 4.22Å; E337-K365 HydrophobicContact CB-CG 4.49Å; E337-K365 PolarHBondContact N-O 3Å; E337-K365 PolarHBondContact O-N 2.94Å; E337-K365 IonicContact OE2-NZ 2.77Å
338	V	97.8	Very high	95.3	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	121.8	172.5	-176.2	0	0	0	0	109.3	I335 K340 K341 L343 I354 L355 T358 V362 T363 F364	I335-V338 HydrophobicContact CG2-CG2 3.6Å; V338-K340 VanDerWaalsContact C-N 3.25Å; V338-K340 PolarHBondContact O-N 2.98Å; V338-K341 PolarHBondContact N-O 3.32Å; V338-K341 WeakPolarHBondContact O-CB 3.29Å; V338-K341 PolarHBondContact O-N 3.38Å; V338-L343 HydrophobicContact CB-CD1 4.48Å; V338-L343 HydrophobicContact CG2-CD1 3.58Å; V338-L343 HydrophobicContact CG2-CG 4.24Å; V338-I354 HydrophobicContact CB-CG2 3.92Å; V338-I354 HydrophobicContact CG1-CG2 4.01Å; V338-L355 HydrophobicContact CG1-CD2 4.36Å; V338-L355 HydrophobicContact CG2-CD2 3.95Å; V338-T358 HydrophobicContact CG1-CG2 3.64Å; V338-V362 HydrophobicContact CG1-CG1 3.78Å; V338-T363 CarbonylContact C-O 3.58Å; V338-T363 WeakPolarHBondContact CA-O 3.07Å; V338-F364 HydrophobicContact CG1-CE1 4.18Å; V338-F364 HydrophobicContact CG2-CD1 3.78Å; V338-F364 HydrophobicContact CG2-CE1 3.8Å
339	D	96.3	Very high	95.1	Very high	55 Å²	55	42.4 Å²	42.4	29%	0.294	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	46.4	47.1	-179.4	-62.1	-28	0	0	0	112.9	K341 T358 V362 T363	D339-K341 VanDerWaalsContact C-N 3.3Å; D339-K341 PolarHBondContact O-N 3.21Å; D339-T358 VanDerWaalsContact OD2-CG2 3.28Å; D339-T358 WeakPolarHBondContact OD2-CG2 3.43Å; D339-V362 WeakPolarHBondContact OD1-CA 3.19Å; D339-T363 PolarHBondContact N-O 3.49Å; D339-T363 PolarHBondContact OD1-N 3.31Å; D339-T363 PolarHBondContact OD1-OG1 3.02Å
340	K	94.3	Very high	94.9	Very high	182 Å²	182	47.9 Å²	47.9	79%	0.791	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.6	22.6	-178.6	-55.5	179.4	-177.6	177.7	0	115.7	E337 V338	E337-K340 WeakPolarHBondContact OE1-CA 3.44Å; V338-K340 VanDerWaalsContact C-N 3.25Å; V338-K340 PolarHBondContact O-N 2.98Å
341	K	96.1	Very high	94.9	Very high	92 Å²	92	43.3 Å²	43.3	40%	0.4	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	123	170.9	-56.6	171.7	-173.2	170.9	0	109.4	E337 V338 D339 I354	E337-K341 CarbonylContact C-O 3.6Å; E337-K341 VanDerWaalsContact CA-O 3.31Å; E337-K341 WeakPolarHBondContact CA-O 3.31Å; V338-K341 PolarHBondContact N-O 3.32Å; V338-K341 WeakPolarHBondContact O-CB 3.29Å; V338-K341 PolarHBondContact O-N 3.38Å; D339-K341 VanDerWaalsContact C-N 3.3Å; D339-K341 PolarHBondContact O-N 3.21Å; K341-I354 HydrophobicContact CB-CD1 3.98Å; K341-I354 HydrophobicContact CD-CD1 3.78Å; K341-I354 HydrophobicContact CD-CG1 4.02Å; K341-I354 HydrophobicContact CD-CG2 4.24Å
342	S	95.8	Very high	95	Very high	59 Å²	59	41.4 Å²	41.4	41%	0.413	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.1	141	171.6	-178.4	0	0	0	0	110.8	I336 I344	I336-S342 WeakPolarHBondContact O-CA 3.45Å; S342-I344 WeakPolarHBondContact OG-CG1 3.46Å; S342-I344 PolarHBondContact OG-N 3.05Å
343	L	95.9	Very high	95	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.223	C	C	.	.			trans	-114.2	17.7	168.8	-61.3	-171.2	0	0	0	112	I312 I335 I336 V338 V346 A351 I354	I312-L343 HydrophobicContact CB-CB 4.49Å; I312-L343 HydrophobicContact CG1-CB 4.18Å; I312-L343 WeakPolarHBondContact CG1-O 3.25Å; I335-L343 HydrophobicContact CB-CD1 4.37Å; I335-L343 HydrophobicContact CG2-CD1 3.86Å; I336-L343 PolarHBondContact O-N 2.86Å; V338-L343 HydrophobicContact CB-CD1 4.48Å; V338-L343 HydrophobicContact CG2-CD1 3.58Å; V338-L343 HydrophobicContact CG2-CG 4.24Å; L343-V346 HydrophobicContact CB-CG2 4.28Å; L343-V346 HydrophobicContact CD2-CG2 4.27Å; L343-A351 HydrophobicContact CD1-CB 4.27Å; L343-A351 HydrophobicContact CD2-CB 4.18Å; L343-I354 HydrophobicContact CD2-CB 4.32Å; L343-I354 HydrophobicContact CD2-CD1 3.63Å; L343-I354 HydrophobicContact CD2-CG2 4.4Å
344	I	93.8	Very high	95	Very high	24 Å²	24	42.2 Å²	42.2	12%	0.123	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.5	132.2	170.5	-46.3	165.1	0	0	0	108.5	L271 E272 L275 I336 S342 V346	L271-I344 HydrophobicContact CB-CG2 3.73Å; E272-I344 HydrophobicContact CG-CD1 4.07Å; E272-I344 HydrophobicContact CG-CG2 3.87Å; L275-I344 HydrophobicContact CD1-CD1 3.52Å; L275-I344 HydrophobicContact CD1-CG1 4.13Å; I336-I344 HydrophobicContact CG2-CD1 4.08Å; I336-I344 HydrophobicContact CG2-CG1 4.26Å; S342-I344 WeakPolarHBondContact OG-CG1 3.46Å; S342-I344 PolarHBondContact OG-N 3.05Å; I344-V346 VanDerWaalsContact C-N 3.31Å; I344-V346 PolarHBondContact O-N 3.2Å
345	G	91.7	Very high	95	Very high	2 Å²	2	42.9 Å²	42.9	2%	0.021	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.6	22.2	172.3	0	0	0	0	0	114.9	K309 L310	K309-G345 WeakPolarHBondContact CD-O 3.36Å; K309-G345 PolarHBondContact NZ-O 3Å; L310-G345 WeakPolarHBondContact O-CA 3.46Å; L310-G345 PolarHBondContact O-N 3.4Å
346	V	92	Very high	95	Very high	24 Å²	24	51 Å²	51	15%	0.145	26%	0.258	C	S	.	.	B	Isolated β-bridge	trans	-107.2	159	-179.2	-54.5	0	0	0	0	111.8	E308 L310 I312 L343 I344 Y350 A351	E308-V346 CarbonylContact O-C 3.49Å; L310-V346 WeakPolarHBondContact CB-O 3.4Å; L310-V346 PolarHBondContact N-O 3.07Å; L310-V346 PolarHBondContact O-N 3.15Å; I312-V346 HydrophobicContact CD1-CG2 4.26Å; I312-V346 HydrophobicContact CG1-CG2 4.02Å; L343-V346 HydrophobicContact CB-CG2 4.28Å; L343-V346 HydrophobicContact CD2-CG2 4.27Å; I344-V346 VanDerWaalsContact C-N 3.31Å; I344-V346 PolarHBondContact O-N 3.2Å; V346-Y350 HydrophobicContact CB-CD1 3.72Å; V346-Y350 HydrophobicContact CB-CE1 4.45Å; V346-Y350 HydrophobicContact CB-CG 4.46Å; V346-Y350 HydrophobicContact CG1-CD1 3.79Å; V346-Y350 HydrophobicContact CG1-CE1 4.02Å; V346-Y350 HydrophobicContact CG2-CD1 4.1Å; V346-A351 HydrophobicContact CG2-CB 3.99Å
347	S	91.5	Very high	94.8	Very high	33 Å²	33	54 Å²	54	23%	0.231	28%	0.28	C	S	.	.			trans	-68.6	151.3	171	60.9	0	0	0	0	112	E308 A349 Y350 A351	E308-S347 WeakPolarHBondContact OE2-CB 3.31Å; S347-A349 PolarHBondContact O-N 3.31Å; S347-Y350 PolarHBondContact O-N 3.05Å; S347-Y350 VanDerWaalsContact O-N 3.08Å; S347-Y350 WeakPolarHBondContact OG-CB 3.23Å; S347-Y350 PolarHBondContact OG-N 3.49Å; S347-A351 PolarHBondContact O-N 3.35Å
348	Q	91.3	Very high	94.7	Very high	83 Å²	83	51.9 Å²	51.9	39%	0.388	27%	0.271	S	S	.	.	H	α-helix	trans	-60.9	-32.4	176.5	-168.1	-178	6.1	0	0	111.3	I296 L310 A352	I296-Q348 HydrophobicContact CD1-CG 4.15Å; I296-Q348 PolarHBondContact O-NE2 2.83Å; L310-Q348 HydrophobicContact CD1-CB 4.19Å; Q348-A352 VanDerWaalsContact O-CB 3.23Å; Q348-A352 WeakPolarHBondContact O-CB 3.47Å; Q348-A352 PolarHBondContact O-N 3.32Å
349	A	92.5	Very high	94.5	Very high	67 Å²	67	56.5 Å²	56.5	55%	0.554	30%	0.303	S	S	*	.	H	α-helix	trans	-64.1	-43.5	173.7	0	0	0	0	0	112.6	S347 S353	S347-A349 PolarHBondContact O-N 3.31Å; A349-S353 PolarHBondContact O-N 2.96Å
350	Y	94.1	Very high	94.4	Very high	120 Å²	120	56 Å²	56	47%	0.471	31%	0.312	S	S	.	.	H	α-helix	trans	-66.1	-47.6	177.2	-177.2	-97.3	0	0	0	111.5	V346 S347 A352 S353 I354	V346-Y350 HydrophobicContact CB-CD1 3.72Å; V346-Y350 HydrophobicContact CB-CE1 4.45Å; V346-Y350 HydrophobicContact CB-CG 4.46Å; V346-Y350 HydrophobicContact CG1-CD1 3.79Å; V346-Y350 HydrophobicContact CG1-CE1 4.02Å; V346-Y350 HydrophobicContact CG2-CD1 4.1Å; S347-Y350 PolarHBondContact O-N 3.05Å; S347-Y350 VanDerWaalsContact O-N 3.08Å; S347-Y350 WeakPolarHBondContact OG-CB 3.23Å; S347-Y350 PolarHBondContact OG-N 3.49Å; Y350-A352 VanDerWaalsContact C-N 3.34Å; Y350-A352 PolarHBondContact O-N 3.21Å; Y350-S353 WeakPolarHBondContact O-CA 3.15Å; Y350-S353 WeakPolarHBondContact O-CB 3.46Å; Y350-S353 PolarHBondContact O-N 3.43Å; Y350-S353 PolarHBondContact O-OG 3.04Å; Y350-I354 HydrophobicContact CD1-CD1 3.88Å; Y350-I354 HydrophobicContact CE1-CD1 3.27Å; Y350-I354 HydrophobicContact CE1-CG1 4.3Å; Y350-I354 PolarHBondContact O-N 3.35Å
351	A	95.8	Very high	94.5	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-58.1	-44.8	175.9	0	0	0	0	0	112.5	I296 I312 L343 V346 S347 S353 I354 L355	I296-A351 HydrophobicContact CD1-CB 3.93Å; I312-A351 HydrophobicContact CB-CB 4.48Å; I312-A351 HydrophobicContact CD1-CB 3.61Å; I312-A351 HydrophobicContact CG1-CB 3.65Å; I312-A351 HydrophobicContact CG2-CB 4.09Å; L343-A351 HydrophobicContact CD1-CB 4.27Å; L343-A351 HydrophobicContact CD2-CB 4.18Å; V346-A351 HydrophobicContact CG2-CB 3.99Å; S347-A351 PolarHBondContact O-N 3.35Å; A351-S353 VanDerWaalsContact C-N 3.27Å; A351-S353 PolarHBondContact O-N 2.97Å; A351-I354 PolarHBondContact O-N 3.19Å; A351-L355 WeakPolarHBondContact O-CG 3.23Å; A351-L355 PolarHBondContact O-N 2.77Å
352	A	95.6	Very high	94.5	Very high	20 Å²	20	46.9 Å²	46.9	17%	0.165	28%	0.279	C	S	.	.	H	α-helix	trans	-64.3	-30.7	174.3	0	0	0	0	0	112.7	I296 Q348 Y350 R356	I296-A352 HydrophobicContact CD1-CB 4.28Å; Q348-A352 VanDerWaalsContact O-CB 3.23Å; Q348-A352 WeakPolarHBondContact O-CB 3.47Å; Q348-A352 PolarHBondContact O-N 3.32Å; Y350-A352 VanDerWaalsContact C-N 3.34Å; Y350-A352 PolarHBondContact O-N 3.21Å; A352-R356 WeakPolarHBondContact O-CB 3.37Å; A352-R356 VanDerWaalsContact O-CG 3.3Å; A352-R356 WeakPolarHBondContact O-CG 3.42Å; A352-R356 VanDerWaalsContact O-CZ 3.32Å; A352-R356 PolarHBondContact O-N 2.83Å; A352-R356 VanDerWaalsContact O-N 3.09Å; A352-R356 PolarHBondContact O-NE 3.08Å
353	S	95.9	Very high	94.6	Very high	50 Å²	50	46.5 Å²	46.5	35%	0.35	27%	0.274	S	S	.	.	H	α-helix	trans	-67.4	-43.2	174.1	84.7	0	0	0	0	111.9	A349 Y350 A351 R356 S357	A349-S353 PolarHBondContact O-N 2.96Å; Y350-S353 WeakPolarHBondContact O-CA 3.15Å; Y350-S353 WeakPolarHBondContact O-CB 3.46Å; Y350-S353 PolarHBondContact O-N 3.43Å; Y350-S353 PolarHBondContact O-OG 3.04Å; A351-S353 VanDerWaalsContact C-N 3.27Å; A351-S353 PolarHBondContact O-N 2.97Å; S353-R356 PolarHBondContact O-N 2.72Å; S353-S357 WeakPolarHBondContact O-CB 3.33Å; S353-S357 PolarHBondContact O-N 3.17Å; S353-S357 PolarHBondContact O-OG 3.06Å
354	I	96.7	Very high	94.7	Very high	5 Å²	5	46.7 Å²	46.7	3%	0.026	28%	0.275	C	S	.	.	H	α-helix	trans	-61.4	-54.2	176	-73.4	172.7	0	0	0	110.1	V338 K341 L343 Y350 A351 R356 S357 T358	V338-I354 HydrophobicContact CB-CG2 3.92Å; V338-I354 HydrophobicContact CG1-CG2 4.01Å; K341-I354 HydrophobicContact CB-CD1 3.98Å; K341-I354 HydrophobicContact CD-CD1 3.78Å; K341-I354 HydrophobicContact CD-CG1 4.02Å; K341-I354 HydrophobicContact CD-CG2 4.24Å; L343-I354 HydrophobicContact CD2-CB 4.32Å; L343-I354 HydrophobicContact CD2-CD1 3.63Å; L343-I354 HydrophobicContact CD2-CG2 4.4Å; Y350-I354 HydrophobicContact CD1-CD1 3.88Å; Y350-I354 HydrophobicContact CE1-CD1 3.27Å; Y350-I354 HydrophobicContact CE1-CG1 4.3Å; Y350-I354 PolarHBondContact O-N 3.35Å; A351-I354 PolarHBondContact O-N 3.19Å; I354-R356 PolarHBondContact O-N 2.74Å; I354-S357 WeakPolarHBondContact O-CA 3.44Å; I354-S357 PolarHBondContact O-N 3.49Å; I354-S357 PolarHBondContact O-OG 2.9Å; I354-T358 WeakPolarHBondContact O-CG2 3.48Å; I354-T358 PolarHBondContact O-N 2.85Å
355	L	96.7	Very high	94.9	Very high	17 Å²	17	48.4 Å²	48.4	9%	0.089	28%	0.282	C	S	.	.	H	α-helix	trans	-58.2	-33.3	-179.9	-68.9	170	0	0	0	113.4	K287 L292 F294 I296 I335 V338 A351 T358 F364	K287-L355 PolarHBondContact NZ-O 3.04Å; L292-L355 HydrophobicContact CD1-CB 4.37Å; L292-L355 HydrophobicContact CD1-CD2 3.97Å; F294-L355 HydrophobicContact CE2-CD1 4.14Å; F294-L355 HydrophobicContact CE2-CD2 4.49Å; F294-L355 HydrophobicContact CZ-CD1 4.37Å; F294-L355 HydrophobicContact CZ-CD2 3.92Å; I296-L355 HydrophobicContact CD1-CD1 4.03Å; I296-L355 HydrophobicContact CG1-CD1 4.47Å; I296-L355 HydrophobicContact CG2-CD1 3.75Å; I335-L355 HydrophobicContact CD1-CD1 4.43Å; V338-L355 HydrophobicContact CG1-CD2 4.36Å; V338-L355 HydrophobicContact CG2-CD2 3.95Å; A351-L355 WeakPolarHBondContact O-CG 3.23Å; A351-L355 PolarHBondContact O-N 2.77Å; L355-T358 PolarHBondContact O-OG1 3.34Å; L355-T358 VanDerWaalsContact O-OG1 3.08Å; L355-F364 HydrophobicContact CD2-CE1 3.8Å; L355-F364 HydrophobicContact CD2-CZ 4.33Å
356	R	95.5	Very high	95.2	Very high	172 Å²	172	48.3 Å²	48.3	65%	0.649	28%	0.281	S	S	*	.	H	α-helix	trans	-69.1	-44.3	170.8	-77	-176	-65.5	-103.2	0	112	K287 A352 S353 I354 T358	K287-R356 PolarHBondContact NZ-O 3.24Å; A352-R356 WeakPolarHBondContact O-CB 3.37Å; A352-R356 VanDerWaalsContact O-CG 3.3Å; A352-R356 WeakPolarHBondContact O-CG 3.42Å; A352-R356 VanDerWaalsContact O-CZ 3.32Å; A352-R356 PolarHBondContact O-N 2.83Å; A352-R356 VanDerWaalsContact O-N 3.09Å; A352-R356 PolarHBondContact O-NE 3.08Å; S353-R356 PolarHBondContact O-N 2.72Å; I354-R356 PolarHBondContact O-N 2.74Å; R356-T358 VanDerWaalsContact C-N 3.31Å; R356-T358 PolarHBondContact O-N 2.68Å
357	S	94.6	Very high	95.5	Very high	75 Å²	75	47.2 Å²	47.2	52%	0.524	27%	0.274	S	S	.	.	H	α-helix	trans	-67.8	-19.8	-175.7	73.8	0	0	0	0	116	S353 I354	S353-S357 WeakPolarHBondContact O-CB 3.33Å; S353-S357 PolarHBondContact O-N 3.17Å; S353-S357 PolarHBondContact O-OG 3.06Å; I354-S357 WeakPolarHBondContact O-CA 3.44Å; I354-S357 PolarHBondContact O-N 3.49Å; I354-S357 PolarHBondContact O-OG 2.9Å
358	T	94.9	Very high	95.7	Very high	9 Å²	9	48.8 Å²	48.8	6%	0.055	28%	0.275	C	S	.	.			trans	-60.6	152.1	-180	63.4	0	0	0	0	112.7	K287 V338 D339 I354 L355 R356 V362	K287-T358 WeakPolarHBondContact CD-O 3.29Å; K287-T358 PolarHBondContact NZ-O 3.47Å; K287-T358 PolarHBondContact NZ-OG1 2.94Å; V338-T358 HydrophobicContact CG1-CG2 3.64Å; D339-T358 VanDerWaalsContact OD2-CG2 3.28Å; D339-T358 WeakPolarHBondContact OD2-CG2 3.43Å; I354-T358 WeakPolarHBondContact O-CG2 3.48Å; I354-T358 PolarHBondContact O-N 2.85Å; L355-T358 PolarHBondContact O-OG1 3.34Å; L355-T358 VanDerWaalsContact O-OG1 3.08Å; R356-T358 VanDerWaalsContact C-N 3.31Å; R356-T358 PolarHBondContact O-N 2.68Å; T358-V362 HydrophobicContact CG2-CG1 3.76Å; T358-V362 HydrophobicContact CG2-CG2 4.37Å
359	S	93.3	Very high	95.7	Very high	97 Å²	97	48.3 Å²	48.3	68%	0.678	27%	0.273	S	S	*	.			trans	-151.8	154.8	177.6	70.6	0	0	0	0	112	T361	S359-T361 PolarHBondContact O-N 3.45Å
360	G	94.6	Very high	95.6	Very high	46 Å²	46	52.1 Å²	52.1	47%	0.474	27%	0.272	S	S	.	.	S	Bend	trans	70.1	-125.1	-178.7	0	0	0	0	0	112.9	K287	K287-G360 PolarHBondContact N-O 3.19Å
361	T	95.8	Very high	95.4	Very high	81 Å²	81	50.4 Å²	50.4	50%	0.497	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	129.9	170.5	-57.1	0	0	0	0	108.7	E284 S359	E284-T361 HydrophobicContact CB-CG2 4.2Å; S359-T361 PolarHBondContact O-N 3.45Å
362	V	97.3	Very high	95	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	131	-175.4	-174.6	0	0	0	0	108.4	L285 K287 L292 V338 D339 T358 F364	L285-V362 PolarHBondContact N-O 3.01Å; L285-V362 PolarHBondContact O-N 2.97Å; K287-V362 HydrophobicContact CB-CG2 4.29Å; L292-V362 HydrophobicContact CD2-CG2 4.2Å; V338-V362 HydrophobicContact CG1-CG1 3.78Å; D339-V362 WeakPolarHBondContact OD1-CA 3.19Å; T358-V362 HydrophobicContact CG2-CG1 3.76Å; T358-V362 HydrophobicContact CG2-CG2 4.37Å; V362-F364 HydrophobicContact CB-CD2 4.39Å; V362-F364 HydrophobicContact CB-CE2 3.74Å; V362-F364 HydrophobicContact CB-CZ 4.33Å; V362-F364 HydrophobicContact CG1-CD2 4.04Å; V362-F364 HydrophobicContact CG1-CE1 4.41Å; V362-F364 HydrophobicContact CG1-CE2 3.42Å; V362-F364 VanDerWaalsContact CG1-CE2 3.42Å; V362-F364 HydrophobicContact CG1-CZ 3.63Å
363	T	97.7	Very high	94.4	Very high	51 Å²	51	60.1 Å²	60.1	31%	0.313	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	126.6	176.1	61.6	0	0	0	0	110.1	E284 V338 D339	E284-T363 HydrophobicContact CG-CG2 4.3Å; V338-T363 CarbonylContact C-O 3.58Å; V338-T363 WeakPolarHBondContact CA-O 3.07Å; D339-T363 PolarHBondContact N-O 3.49Å; D339-T363 PolarHBondContact OD1-N 3.31Å; D339-T363 PolarHBondContact OD1-OG1 3.02Å
364	F	98.3	Very high	94	Very high	5 Å²	5	64 Å²	64	2%	0.022	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	145.4	177.5	-68.3	-90.9	0	0	0	111.2	E282 V283 L285 L292 F294 I329 I335 E337 V338 L355 V362 I366	E282-F364 CarbonylContact C-O 3.44Å; E282-F364 VanDerWaalsContact CA-O 3.32Å; E282-F364 WeakPolarHBondContact CA-O 3.45Å; V283-F364 HydrophobicContact CB-CB 4.25Å; V283-F364 PolarHBondContact N-O 3.42Å; V283-F364 WeakPolarHBondContact O-CB 3.49Å; V283-F364 PolarHBondContact O-N 3.48Å; L285-F364 HydrophobicContact CB-CD2 4.24Å; L285-F364 HydrophobicContact CB-CE2 4.04Å; L285-F364 HydrophobicContact CD2-CE2 4.24Å; L292-F364 HydrophobicContact CD1-CZ 3.97Å; L292-F364 HydrophobicContact CD2-CE2 4.25Å; L292-F364 HydrophobicContact CD2-CZ 4.02Å; F294-F364 HydrophobicContact CE1-CE1 4.49Å; F294-F364 HydrophobicContact CE1-CZ 4.33Å; F294-F364 HydrophobicContact CZ-CE1 4.14Å; F294-F364 HydrophobicContact CZ-CZ 4.38Å; I329-F364 HydrophobicContact CD1-CG 4.44Å; I335-F364 HydrophobicContact CG2-CD1 4.09Å; E337-F364 WeakPolarHBondContact O-CA 3.32Å; V338-F364 HydrophobicContact CG1-CE1 4.18Å; V338-F364 HydrophobicContact CG2-CD1 3.78Å; V338-F364 HydrophobicContact CG2-CE1 3.8Å; L355-F364 HydrophobicContact CD2-CE1 3.8Å; L355-F364 HydrophobicContact CD2-CZ 4.33Å; V362-F364 HydrophobicContact CB-CD2 4.39Å; V362-F364 HydrophobicContact CB-CE2 3.74Å; V362-F364 HydrophobicContact CB-CZ 4.33Å; V362-F364 HydrophobicContact CG1-CD2 4.04Å; V362-F364 HydrophobicContact CG1-CE1 4.41Å; V362-F364 HydrophobicContact CG1-CE2 3.42Å; V362-F364 VanDerWaalsContact CG1-CE2 3.42Å; V362-F364 HydrophobicContact CG1-CZ 3.63Å; F364-I366 HydrophobicContact CB-CD1 4Å; F364-I366 HydrophobicContact CB-CG1 4.17Å; F364-I366 HydrophobicContact CD1-CD1 4.4Å
365	K	97.9	Very high	93.5	Very high	60 Å²	60	64.1 Å²	64.1	26%	0.261	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	126.2	162.1	-162.5	168.7	-169.7	150.7	0	108.4	I280 E282 I336 E337	I280-K365 HydrophobicContact CG2-CD 4.43Å; I280-K365 HydrophobicContact CG2-CG 3.85Å; E282-K365 HydrophobicContact CG-CG 4.18Å; E282-K365 IonicContact OE1-NZ 3.48Å; I336-K365 HydrophobicContact CB-CB 4.29Å; I336-K365 HydrophobicContact CB-CG 4.39Å; I336-K365 WeakPolarHBondContact CB-O 3.3Å; I336-K365 HydrophobicContact CG2-CD 4.42Å; I336-K365 PolarHBondContact N-O 3.33Å; E337-K365 HydrophobicContact CB-CB 3.47Å; E337-K365 VanDerWaalsContact CB-CB 3.47Å; E337-K365 HydrophobicContact CB-CD 4.22Å; E337-K365 HydrophobicContact CB-CG 4.49Å; E337-K365 PolarHBondContact N-O 3Å; E337-K365 PolarHBondContact O-N 2.94Å; E337-K365 IonicContact OE2-NZ 2.77Å
366	I	98	Very high	93.1	Very high	0 Å²	0	70.6 Å²	70.6	0%	0	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	136.4	-169.1	-55.6	-64.6	0	0	0	108.9	I280 F281 V283 I329 D333 Q334 I335 F364	I280-I366 CarbonylContact C-O 3.55Å; I280-I366 VanDerWaalsContact CA-O 3.3Å; I280-I366 WeakPolarHBondContact CA-O 3.46Å; F281-I366 HydrophobicContact CD1-CB 4.47Å; F281-I366 HydrophobicContact CD2-CB 4.31Å; F281-I366 HydrophobicContact CE1-CB 4.04Å; F281-I366 HydrophobicContact CE1-CG2 3.75Å; F281-I366 HydrophobicContact CE2-CB 3.88Å; F281-I366 HydrophobicContact CE2-CG1 4.32Å; F281-I366 HydrophobicContact CE2-CG2 4.03Å; F281-I366 HydrophobicContact CZ-CB 3.72Å; F281-I366 HydrophobicContact CZ-CG2 3.41Å; F281-I366 VanDerWaalsContact CZ-CG2 3.41Å; F281-I366 PolarHBondContact N-O 2.94Å; F281-I366 PolarHBondContact O-N 3.17Å; V283-I366 HydrophobicContact CG2-CG1 4.28Å; I329-I366 HydrophobicContact CD1-CD1 3.87Å; I329-I366 HydrophobicContact CD1-CG1 4.08Å; I329-I366 HydrophobicContact CG1-CD1 4.23Å; I329-I366 HydrophobicContact CG1-CG1 4.08Å; D333-I366 HydrophobicContact CB-CG2 3.73Å; Q334-I366 CarbonylContact O-C 3.52Å; Q334-I366 WeakPolarHBondContact O-CA 3.36Å; I335-I366 HydrophobicContact CG1-CD1 4.32Å; I335-I366 HydrophobicContact CG2-CD1 4.37Å; F364-I366 HydrophobicContact CB-CD1 4Å; F364-I366 HydrophobicContact CB-CG1 4.17Å; F364-I366 HydrophobicContact CD1-CD1 4.4Å
367	G	96.8	Very high	92.7	Very high	0 Å²	0	63.7 Å²	63.7	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	129	168	0	0	0	0	0	110.2	M278 Q334	M278-G367 WeakPolarHBondContact CE-O 3.49Å; Q334-G367 PolarHBondContact N-O 2.95Å; Q334-G367 PolarHBondContact O-N 2.93Å
368	R	95.5	Very high	92.5	Very high	66 Å²	66	60.2 Å²	60.2	25%	0.249	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	140.2	170.1	-175.6	170.4	-64.1	150.7	8.8	110.1	M278 D279 F281 R328 D333	M278-R368 WeakPolarHBondContact CA-O 3.4Å; M278-R368 WeakPolarHBondContact CB-O 3.47Å; D279-R368 PolarHBondContact N-O 3.06Å; D279-R368 PolarHBondContact O-N 3.42Å; F281-R368 HydrophobicContact CE1-CB 3.99Å; R328-R368 PolarHBondContact O-NH2 2.96Å; D333-R368 VanDerWaalsContact CG-NH2 3.33Å; D333-R368 IonicContact OD1-CZ 3.71Å; D333-R368 IonicContact OD1-NE 3.21Å; D333-R368 PolarHBondContact OD1-NE 3.2Å; D333-R368 IonicContact OD1-NH2 2.73Å; D333-R368 PolarHBondContact OD1-NH2 3.35Å; D333-R368 VanDerWaalsContact OD1-NH2 3.12Å; D333-R368 IonicContact OD2-CZ 3.66Å; D333-R368 IonicContact OD2-NE 3.84Å; D333-R368 IonicContact OD2-NH2 3.35Å; D333-R368 PolarHBondContact OD2-NH2 3.39Å
369	E	93	Very high	92.3	Very high	74 Å²	74	62.1 Å²	62.1	35%	0.346	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	140.3	178.4	-166.1	164.7	177.9	0	0	111.1	M278 D371 S375	M278-E369 HydrophobicContact CE-CB 4.29Å; E369-D371 VanDerWaalsContact C-N 3.32Å; E369-D371 PolarHBondContact O-N 3.01Å; E369-S375 WeakPolarHBondContact OE2-CB 3.25Å; E369-S375 PolarHBondContact OE2-OG 3.34Å
370	R	90.2	Very high	92.2	Very high	146 Å²	146	61.8 Å²	61.8	55%	0.551	33%	0.326	S	S	*	.	S	Bend	trans	-69	-28.3	-175.7	-71	179.2	176.7	126.4	17.5	113.7	N277 M278 D279	N277-R370 WeakPolarHBondContact O-CD 3.29Å; N277-R370 PolarHBondContact O-NH1 2.82Å; M278-R370 PolarHBondContact O-NH2 2.6Å; M278-R370 VanDerWaalsContact O-NH2 3.1Å; D279-R370 IonicContact OD1-CZ 2.63Å; D279-R370 IonicContact OD1-NE 3.98Å; D279-R370 PolarHBondContact OD1-NE 3.46Å; D279-R370 IonicContact OD1-NH2 2.68Å; D279-R370 PolarHBondContact OD1-NH2 3.02Å; D279-R370 IonicContact OD2-NE 2.66Å
371	D	90	Very high	92.1	Very high	84 Å²	84	59.6 Å²	59.6	45%	0.449	30%	0.304	S	S	.	.			trans	-122.9	91.7	172.5	-174.2	-17.6	0	0	0	108.9	E369 E373 N374 S375	E369-D371 VanDerWaalsContact C-N 3.32Å; E369-D371 PolarHBondContact O-N 3.01Å; D371-E373 PolarHBondContact O-N 3.16Å; D371-E373 PolarHBondContact OD1-N 3.11Å; D371-N374 HydrophobicContact CB-CB 4.5Å; D371-N374 PolarHBondContact OD1-N 2.76Å; D371-N374 WeakPolarHBondContact OD2-CB 3.18Å; D371-S375 PolarHBondContact O-N 2.89Å
372	P	85.8	Confident	91.9	Very high	81 Å²	81	60.7 Å²	60.7	53%	0.526	30%	0.299	S	S	.	.	S	Bend	trans	-72.3	-15.1	-179.4	29.8	-35.6	0	0	0	113.2	R382	P372-R382 PolarHBondContact O-NH2 2.66Å
373	E	84.3	Confident	91.6	Very high	143 Å²	143	65.8 Å²	65.8	67%	0.668	32%	0.323	S	S	*	.	S	Bend	trans	-81.8	-45.4	179.3	-69.4	-58.5	166.8	0	0	111.3	D371 S375 R382	D371-E373 PolarHBondContact O-N 3.16Å; D371-E373 PolarHBondContact OD1-N 3.11Å; E373-S375 PolarHBondContact O-N 2.79Å; E373-R382 PolarHBondContact O-NH2 3Å; E373-R382 IonicContact OE2-CZ 2.77Å; E373-R382 IonicContact OE2-NH1 3.99Å; E373-R382 PolarHBondContact OE2-NH1 3.23Å
374	N	86.2	Confident	91.3	Very high	133 Å²	133	64.6 Å²	64.6	71%	0.711	32%	0.316	S	S	*	.	S	Bend	trans	-81.1	4.3	175.8	-160.6	78	0	0	0	113.7	D371 E376	D371-N374 HydrophobicContact CB-CB 4.5Å; D371-N374 PolarHBondContact OD1-N 2.76Å; D371-N374 WeakPolarHBondContact OD2-CB 3.18Å; N374-E376 PolarHBondContact O-N 2.99Å
375	S	87.4	Confident	90.9	Very high	6 Å²	6	66.4 Å²	66.4	4%	0.042	33%	0.326	C	S	.	.			trans	-63.8	113.7	177.7	-179.9	0	0	0	0	112.5	E369 D371 E373 I377 G378 A379	E369-S375 WeakPolarHBondContact OE2-CB 3.25Å; E369-S375 PolarHBondContact OE2-OG 3.34Å; D371-S375 PolarHBondContact O-N 2.89Å; E373-S375 PolarHBondContact O-N 2.79Å; S375-I377 VanDerWaalsContact C-N 3.32Å; S375-I377 PolarHBondContact O-N 2.77Å; S375-G378 PolarHBondContact O-N 3.06Å; S375-G378 PolarHBondContact OG-N 3.41Å; S375-A379 WeakPolarHBondContact O-CB 3.37Å; S375-A379 PolarHBondContact O-N 2.97Å
376	E	87.8	Confident	90.6	Very high	154 Å²	154	67.1 Å²	67.1	72%	0.72	33%	0.331	S	S	*	.	H	α-helix	trans	-57.5	-45.6	172.5	-65.2	-179.3	174.7	0	0	111.2	N374 A379 L380	N374-E376 PolarHBondContact O-N 2.99Å; E376-A379 PolarHBondContact O-N 3.33Å; E376-L380 WeakPolarHBondContact O-CG 3.38Å; E376-L380 PolarHBondContact O-N 3.19Å; E376-L380 VanDerWaalsContact O-N 3.13Å
377	I	88.1	Confident	90.2	Very high	27 Å²	27	71.2 Å²	71.2	14%	0.138	35%	0.349	C	S	.	.	H	α-helix	trans	-67.8	-44.4	-179.4	-57.1	-177.5	0	0	0	109.6	M299 F313 S375 A379 L380 I381	M299-I377 HydrophobicContact CE-CB 4.41Å; M299-I377 HydrophobicContact CE-CG2 3.75Å; M299-I377 HydrophobicContact SD-CG2 3.83Å; F313-I377 HydrophobicContact CD1-CG2 3.97Å; F313-I377 HydrophobicContact CD2-CG2 4.23Å; F313-I377 HydrophobicContact CE1-CD1 4.08Å; F313-I377 HydrophobicContact CE1-CG2 3.81Å; F313-I377 HydrophobicContact CE2-CD1 4.35Å; F313-I377 HydrophobicContact CE2-CG2 4.09Å; F313-I377 HydrophobicContact CG-CG2 4.18Å; F313-I377 HydrophobicContact CZ-CD1 3.63Å; F313-I377 HydrophobicContact CZ-CG2 3.9Å; S375-I377 VanDerWaalsContact C-N 3.32Å; S375-I377 PolarHBondContact O-N 2.77Å; I377-A379 VanDerWaalsContact C-N 3.31Å; I377-A379 PolarHBondContact O-N 3.31Å; I377-L380 PolarHBondContact O-N 2.89Å; I377-I381 HydrophobicContact CG2-CD1 3.97Å; I377-I381 HydrophobicContact CG2-CG1 4.5Å; I377-I381 WeakPolarHBondContact O-CG1 3.35Å; I377-I381 PolarHBondContact O-N 3.01Å
378	G	90	Very high	89.8	Confident	1 Å²	1	74.6 Å²	74.6	1%	0.01	37%	0.368	C	S	.	.	H	α-helix	trans	-63.8	-32.3	175.9	0	0	0	0	0	113.4	S375 R382	S375-G378 PolarHBondContact O-N 3.06Å; S375-G378 PolarHBondContact OG-N 3.41Å; G378-R382 VanDerWaalsContact O-CB 3.3Å; G378-R382 WeakPolarHBondContact O-CB 3.36Å; G378-R382 WeakPolarHBondContact O-CG 3.38Å; G378-R382 PolarHBondContact O-N 3.37Å; G378-R382 PolarHBondContact O-NE 2.83Å
379	A	91.4	Very high	89.5	Confident	49 Å²	49	77 Å²	77	41%	0.405	38%	0.38	S	S	.	.	H	α-helix	trans	-66.2	-45.5	171.8	0	0	0	0	0	111.8	S375 E376 I377 R382 Q383	S375-A379 WeakPolarHBondContact O-CB 3.37Å; S375-A379 PolarHBondContact O-N 2.97Å; E376-A379 PolarHBondContact O-N 3.33Å; I377-A379 VanDerWaalsContact C-N 3.31Å; I377-A379 PolarHBondContact O-N 3.31Å; A379-R382 PolarHBondContact O-N 2.9Å; A379-Q383 WeakPolarHBondContact O-CB 3.45Å; A379-Q383 PolarHBondContact O-N 2.75Å
380	L	90.7	Very high	89.2	Confident	90 Å²	90	78.8 Å²	78.8	47%	0.471	39%	0.388	S	S	.	.	H	α-helix	trans	-65.1	-38.4	176.9	-70.9	168	0	0	0	112.8	M299 E376 I377 Q383 S384	M299-L380 HydrophobicContact CE-CB 3.57Å; M299-L380 HydrophobicContact CE-CD1 3.69Å; M299-L380 HydrophobicContact CE-CG 4.29Å; E376-L380 WeakPolarHBondContact O-CG 3.38Å; E376-L380 PolarHBondContact O-N 3.19Å; E376-L380 VanDerWaalsContact O-N 3.13Å; I377-L380 PolarHBondContact O-N 2.89Å; L380-Q383 PolarHBondContact O-N 2.71Å; L380-S384 PolarHBondContact O-N 3.32Å
381	I	91.3	Very high	88.8	Confident	0 Å²	0	80.3 Å²	80.3	0%	0	39%	0.394	C	S	.	.	H	α-helix	trans	-65.8	-45.7	173.9	-65.6	172.1	0	0	0	110.5	I297 M299 F313 V331 C332 I377 Q383 S384 L385	I297-I381 HydrophobicContact CG2-CD1 4.17Å; I297-I381 HydrophobicContact CG2-CG1 4.07Å; M299-I381 HydrophobicContact SD-CD1 4.06Å; M299-I381 HydrophobicContact SD-CG1 3.62Å; F313-I381 HydrophobicContact CB-CD1 3.68Å; F313-I381 HydrophobicContact CD1-CD1 4.48Å; F313-I381 HydrophobicContact CG-CD1 4.15Å; V331-I381 HydrophobicContact CG1-CG2 4.15Å; C332-I381 HydrophobicContact CB-CD1 4.25Å; I377-I381 HydrophobicContact CG2-CD1 3.97Å; I377-I381 HydrophobicContact CG2-CG1 4.5Å; I377-I381 WeakPolarHBondContact O-CG1 3.35Å; I377-I381 PolarHBondContact O-N 3.01Å; I381-Q383 VanDerWaalsContact C-N 3.29Å; I381-Q383 PolarHBondContact O-N 3.01Å; I381-S384 PolarHBondContact O-N 3.15Å; I381-L385 HydrophobicContact CG2-CD1 4.22Å; I381-L385 WeakPolarHBondContact O-CG 3.22Å; I381-L385 PolarHBondContact O-N 3.49Å
382	R	92	Very high	88.3	Confident	104 Å²	104	80 Å²	80	39%	0.392	40%	0.398	S	S	.	.	H	α-helix	trans	-55.8	-43.4	173.2	-76.6	178.7	-76.7	-174.4	0.6	111.3	P372 E373 G378 A379 E386	P372-R382 PolarHBondContact O-NH2 2.66Å; E373-R382 PolarHBondContact O-NH2 3Å; E373-R382 IonicContact OE2-CZ 2.77Å; E373-R382 IonicContact OE2-NH1 3.99Å; E373-R382 PolarHBondContact OE2-NH1 3.23Å; G378-R382 VanDerWaalsContact O-CB 3.3Å; G378-R382 WeakPolarHBondContact O-CB 3.36Å; G378-R382 WeakPolarHBondContact O-CG 3.38Å; G378-R382 PolarHBondContact O-N 3.37Å; G378-R382 PolarHBondContact O-NE 2.83Å; A379-R382 PolarHBondContact O-N 2.9Å; R382-E386 PolarHBondContact O-N 3.03Å; R382-E386 VanDerWaalsContact O-N 3.13Å
383	Q	91.2	Very high	88.1	Confident	107 Å²	107	79.1 Å²	79.1	50%	0.5	40%	0.398	S	S	.	.	H	α-helix	trans	-65.4	-43.4	176.7	-169.3	-174.9	24.2	0	0	112.6	A379 L380 I381 L385 E386 Q387	A379-Q383 WeakPolarHBondContact O-CB 3.45Å; A379-Q383 PolarHBondContact O-N 2.75Å; L380-Q383 PolarHBondContact O-N 2.71Å; I381-Q383 VanDerWaalsContact C-N 3.29Å; I381-Q383 PolarHBondContact O-N 3.01Å; Q383-L385 VanDerWaalsContact C-N 3.35Å; Q383-L385 PolarHBondContact O-N 3.04Å; Q383-E386 PolarHBondContact O-N 2.85Å; Q383-Q387 WeakPolarHBondContact O-CG 3.34Å; Q383-Q387 PolarHBondContact O-N 2.95Å
384	S	90.8	Very high	87.7	Confident	26 Å²	26	76 Å²	76	18%	0.182	40%	0.396	C	S	.	.	H	α-helix	trans	-62.4	-41.3	177.7	-174.8	0	0	0	0	112	K315 L380 I381 E386 Q387 D388	K315-S384 PolarHBondContact NZ-OG 3.05Å; L380-S384 PolarHBondContact O-N 3.32Å; I381-S384 PolarHBondContact O-N 3.15Å; S384-E386 VanDerWaalsContact C-N 3.32Å; S384-E386 PolarHBondContact O-N 3.3Å; S384-Q387 PolarHBondContact O-N 2.87Å; S384-D388 PolarHBondContact O-N 3.48Å
385	L	91.1	Very high	86.9	Confident	44 Å²	44	73.9 Å²	73.9	23%	0.23	40%	0.398	C	S	.	.	H	α-helix	trans	-64.1	-35.9	174.9	-71.4	170	0	0	0	112.8	K315 V331 I381 Q383 K389	K315-L385 HydrophobicContact CG-CD2 3.98Å; K315-L385 HydrophobicContact CG-CG 4.48Å; K315-L385 WeakPolarHBondContact O-CD1 3.4Å; K315-L385 WeakPolarHBondContact O-CD2 3.28Å; V331-L385 HydrophobicContact CG1-CD1 4.11Å; I381-L385 HydrophobicContact CG2-CD1 4.22Å; I381-L385 WeakPolarHBondContact O-CG 3.22Å; I381-L385 PolarHBondContact O-N 3.49Å; Q383-L385 VanDerWaalsContact C-N 3.35Å; Q383-L385 PolarHBondContact O-N 3.04Å; L385-K389 WeakPolarHBondContact O-CG 3.48Å; L385-K389 PolarHBondContact O-N 3.44Å; L385-K389 VanDerWaalsContact O-N 3.09Å
386	E	91.1	Very high	85.8	Confident	75 Å²	75	81.1 Å²	81.1	35%	0.35	44%	0.436	S	S	.	.	H	α-helix	trans	-72.5	-38.2	177.8	-171.3	52.8	-141.7	0	0	111.9	R382 Q383 S384 D388 K389 Q390	R382-E386 PolarHBondContact O-N 3.03Å; R382-E386 VanDerWaalsContact O-N 3.13Å; Q383-E386 PolarHBondContact O-N 2.85Å; S384-E386 VanDerWaalsContact C-N 3.32Å; S384-E386 PolarHBondContact O-N 3.3Å; E386-D388 PolarHBondContact O-N 2.92Å; E386-K389 PolarHBondContact O-N 3.46Å; E386-K389 WeakPolarHBondContact OE2-CE 3.43Å; E386-K389 IonicContact OE2-NZ 3.86Å; E386-K389 PolarHBondContact OE2-NZ 3.38Å; E386-Q390 VanDerWaalsContact O-CG 3.32Å; E386-Q390 WeakPolarHBondContact O-CG 3.36Å; E386-Q390 PolarHBondContact O-N 3.39Å; E386-Q390 PolarHBondContact OE1-NE2 3.45Å; E386-Q390 VanDerWaalsContact OE1-NE2 3.13Å
387	Q	88.6	Confident	84.3	Confident	85 Å²	85	75.8 Å²	75.8	40%	0.397	42%	0.423	S	S	.	.	H	α-helix	trans	-63.1	-39.5	171.2	-70.4	-179.8	10.6	0	0	112.4	Q383 S384 Q390 R391	Q383-Q387 WeakPolarHBondContact O-CG 3.34Å; Q383-Q387 PolarHBondContact O-N 2.95Å; S384-Q387 PolarHBondContact O-N 2.87Å; Q387-Q390 PolarHBondContact O-N 2.93Å; Q387-R391 WeakPolarHBondContact O-CB 3.39Å; Q387-R391 VanDerWaalsContact O-CG 3.25Å; Q387-R391 WeakPolarHBondContact O-CG 3.42Å; Q387-R391 PolarHBondContact O-N 3.31Å
388	D	88.5	Confident	82.1	Confident	71 Å²	71	78.1 Å²	78.1	38%	0.38	45%	0.453	S	S	.	.	H	α-helix	trans	-63.4	-43.2	175.4	-72.3	-14.1	0	0	0	111.5	K315 S384 E386 R391 S392	K315-D388 WeakPolarHBondContact CE-OD2 3.39Å; K315-D388 IonicContact NZ-OD1 3.94Å; K315-D388 IonicContact NZ-OD2 2.69Å; K315-D388 PolarHBondContact NZ-OD2 3.41Å; S384-D388 PolarHBondContact O-N 3.48Å; E386-D388 PolarHBondContact O-N 2.92Å; D388-R391 PolarHBondContact O-N 3.2Å; D388-S392 PolarHBondContact O-N 3.41Å; D388-S392 PolarHBondContact O-OG 2.87Å
389	K	89.1	Confident	79.7	Confident	116 Å²	116	86.4 Å²	86.4	50%	0.504	50%	0.496	S	S	.	.	H	α-helix	trans	-57.7	-50.8	173.4	-73.5	178.9	-132.3	158.4	0	111.3	L385 E386 R391 S392 A393	L385-K389 WeakPolarHBondContact O-CG 3.48Å; L385-K389 PolarHBondContact O-N 3.44Å; L385-K389 VanDerWaalsContact O-N 3.09Å; E386-K389 PolarHBondContact O-N 3.46Å; E386-K389 WeakPolarHBondContact OE2-CE 3.43Å; E386-K389 IonicContact OE2-NZ 3.86Å; E386-K389 PolarHBondContact OE2-NZ 3.38Å; K389-R391 VanDerWaalsContact C-N 3.33Å; K389-R391 PolarHBondContact O-N 2.61Å; K389-S392 PolarHBondContact O-N 3.42Å; K389-S392 VanDerWaalsContact O-N 3.1Å; K389-S392 PolarHBondContact O-OG 3.01Å; K389-A393 PolarHBondContact O-N 3Å
390	Q	87.1	Confident	77.5	Confident	113 Å²	113	89.8 Å²	89.8	53%	0.528	51%	0.514	S	S	.	.	H	α-helix	trans	-62	-40	-178.4	-70.9	171.5	15.6	0	0	111.9	E386 Q387 A393 A394	E386-Q390 VanDerWaalsContact O-CG 3.32Å; E386-Q390 WeakPolarHBondContact O-CG 3.36Å; E386-Q390 PolarHBondContact O-N 3.39Å; E386-Q390 PolarHBondContact OE1-NE2 3.45Å; E386-Q390 VanDerWaalsContact OE1-NE2 3.13Å; Q387-Q390 PolarHBondContact O-N 2.93Å; Q390-A393 PolarHBondContact O-N 3.16Å; Q390-A394 VanDerWaalsContact O-CB 3.31Å; Q390-A394 WeakPolarHBondContact O-CB 3.44Å; Q390-A394 PolarHBondContact O-N 3.03Å
391	R	82.8	Confident	75.1	Confident	177 Å²	177	90.3 Å²	90.3	67%	0.668	53%	0.531	S	S	*	.	H	α-helix	trans	-61.7	-43.3	171.9	-72.5	167	-178.4	-96.4	1.7	112.1	Q387 D388 K389 A395	Q387-R391 WeakPolarHBondContact O-CB 3.39Å; Q387-R391 VanDerWaalsContact O-CG 3.25Å; Q387-R391 WeakPolarHBondContact O-CG 3.42Å; Q387-R391 PolarHBondContact O-N 3.31Å; D388-R391 PolarHBondContact O-N 3.2Å; K389-R391 VanDerWaalsContact C-N 3.33Å; K389-R391 PolarHBondContact O-N 2.61Å; R391-A395 WeakPolarHBondContact O-CB 3.23Å; R391-A395 PolarHBondContact O-N 3Å; R391-A395 VanDerWaalsContact O-N 3.1Å
392	S	80	Confident	72.5	Confident	77 Å²	77	94.6 Å²	94.6	54%	0.538	57%	0.566	S	S	.	*	H	α-helix	trans	-67.6	-39.2	178.4	70.4	0	0	0	0	112.8	D388 K389 A395 D396	D388-S392 PolarHBondContact O-N 3.41Å; D388-S392 PolarHBondContact O-OG 2.87Å; K389-S392 PolarHBondContact O-N 3.42Å; K389-S392 VanDerWaalsContact O-N 3.1Å; K389-S392 PolarHBondContact O-OG 3.01Å; S392-A395 PolarHBondContact O-N 3.36Å; S392-D396 PolarHBondContact O-N 3.17Å
393	A	80.8	Confident	70.3	Confident	63 Å²	63	95.6 Å²	95.6	52%	0.521	59%	0.587	S	S	.	*	H	α-helix	trans	-67.7	-40.1	176.1	0	0	0	0	0	112.1	K389 Q390 A395 D396 G397	K389-A393 PolarHBondContact O-N 3Å; Q390-A393 PolarHBondContact O-N 3.16Å; A393-A395 VanDerWaalsContact C-N 3.27Å; A393-A395 PolarHBondContact O-N 2.91Å; A393-D396 PolarHBondContact O-N 3.37Å; A393-G397 PolarHBondContact O-N 3.31Å
394	A	75.9	Confident	67.8	Low	77 Å²	77	99.8 Å²	99.8	64%	0.636	61%	0.606	S	S	*	*	H	α-helix	trans	-69.5	-23	176.1	0	0	0	0	0	113.5	Q390	Q390-A394 VanDerWaalsContact O-CB 3.31Å; Q390-A394 WeakPolarHBondContact O-CB 3.44Å; Q390-A394 PolarHBondContact O-N 3.03Å
395	A	69.3	Low	65.2	Low	90 Å²	90	107.8 Å²	107.8	74%	0.744	64%	0.643	S	S	*	*	H	α-helix	trans	-78.9	-25.9	174.6	0	0	0	0	0	113.3	R391 S392 A393	R391-A395 WeakPolarHBondContact O-CB 3.23Å; R391-A395 PolarHBondContact O-N 3Å; R391-A395 VanDerWaalsContact O-N 3.1Å; S392-A395 PolarHBondContact O-N 3.36Å; A393-A395 VanDerWaalsContact C-N 3.27Å; A393-A395 PolarHBondContact O-N 2.91Å
396	D	64.7	Low	62.6	Low	158 Å²	158	110.2 Å²	110.2	85%	0.845	67%	0.669	S	S	*	*	H	α-helix	trans	-103.3	-17.7	-177.1	-156.6	40.8	0	0	0	112.9	S392 A393	S392-D396 PolarHBondContact O-N 3.17Å; A393-D396 PolarHBondContact O-N 3.37Å
397	G	55.2	Low	59.9	Low	42 Å²	42	114.9 Å²	114.9	43%	0.433	70%	0.696	S	S	.	*			trans	-124.7	106.4	-175.3	0	0	0	0	0	114.7	A393	A393-G397 PolarHBondContact O-N 3.31Å
398	G	43.3	Very low	57.8	Low	75 Å²	75	117.5 Å²	117.5	77%	0.773	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-68.1	143.3	168.6	0	0	0	0	0	112.8	P400	G398-P400 WeakPolarHBondContact O-CD 3.26Å
399	L	38.3	Very low	55.4	Low	176 Å²	176	118.2 Å²	118.2	92%	0.921	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-63	133.3	-169.9	-72.6	77.6	0	0	0	114.5
400	P	45.5	Very low	53.4	Low	119 Å²	119	118.9 Å²	118.9	77%	0.773	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-97.2	145.1	148.3	6.3	14.7	0	0	0	110.8	G398	G398-P400 WeakPolarHBondContact O-CD 3.26Å
401	A	40.4	Very low	51.3	Low	101 Å²	101	118.9 Å²	118.9	84%	0.835	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-79.2	156.8	-179	0	0	0	0	0	113.6
402	A	36.5	Very low	49.2	Very low	90 Å²	90	118 Å²	118	74%	0.744	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-65.8	133.5	178.6	0	0	0	0	0	112.5
403	P	46.8	Very low	47.5	Very low	126 Å²	126	120.7 Å²	120.7	82%	0.818	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-78.2	138.3	179.6	31.3	-34.2	0	0	0	112
404	Q	38.7	Very low	45.6	Very low	194 Å²	194	122.8 Å²	122.8	91%	0.907	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-86.8	133.8	175.8	-63.2	169.2	36	0	0	110.1
405	M	35.7	Very low	44.3	Very low	195 Å²	195	128.7 Å²	128.7	96%	0.961	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-79.9	129.5	177.6	-71.9	-88.2	-80.1	0	0	110.8
406	A	37.4	Very low	43.2	Very low	94 Å²	94	127.9 Å²	127.9	78%	0.777	81%	0.812	S	S	*	*			trans	-133.7	121.5	174.9	0	0	0	0	0	111
407	L	34.3	Very low	42.2	Very low	174 Å²	174	123.7 Å²	123.7	91%	0.911	81%	0.806	S	S	*	*			trans	-81	137.4	177.8	-77.9	149.6	0	0	0	111.3
408	V	42.6	Very low	41.7	Very low	139 Å²	139	129.8 Å²	129.8	84%	0.842	83%	0.829	S	S	*	*			trans	-138.3	128	167.5	-176.1	0	0	0	0	109.2
409	A	39.3	Very low	41.7	Very low	87 Å²	87	129.4 Å²	129.4	72%	0.719	83%	0.825	S	S	*	*			trans	-89.4	151.9	-179.3	0	0	0	0	0	112.4
410	P	46.4	Very low	42.2	Very low	129 Å²	129	130.2 Å²	130.2	84%	0.838	82%	0.824	S	S	*	*			trans	-75.4	143.1	178.3	31.2	-34.9	0	0	0	112.2
411	S	43.9	Very low	42.2	Very low	114 Å²	114	132.9 Å²	132.9	80%	0.797	83%	0.832	S	S	*	*			trans	-109.2	140	177.4	-170.2	0	0	0	0	111.3
412	L	38.2	Very low	42.5	Very low	159 Å²	159	131 Å²	131	83%	0.832	82%	0.822	S	S	*	*			trans	-88.6	142.3	175.8	-92.4	73.5	0	0	0	111.5
413	C	43.9	Very low	43.2	Very low	133 Å²	133	133.2 Å²	133.2	90%	0.899	82%	0.821	S	S	*	*			trans	-105	120.8	166.9	-62.4	0	0	0	0	110.6
414	S	42.4	Very low	43.6	Very low	107 Å²	107	131.3 Å²	131.3	75%	0.748	81%	0.808	S	S	*	*			trans	-78.7	152.5	175.2	-53.5	0	0	0	0	112.6
415	H	48.1	Very low	44.7	Very low	200 Å²	200	127.6 Å²	127.6	93%	0.926	80%	0.795	S	S	*	*			trans	172.4	141.7	144.5	-95	81.8	0	0	0	107.1
416	G	46	Very low	46	Very low	74 Å²	74	121.8 Å²	121.8	76%	0.763	78%	0.778	S	S	*	*			cis	156.9	92.4	-10.3	0	0	0	0	0	112.9
417	G	43.2	Very low	47.5	Very low	69 Å²	69	124.6 Å²	124.6	71%	0.711	77%	0.772	S	S	*	*			trans	83.4	151.1	179.9	0	0	0	0	0	114.4
418	D	46	Very low	49.3	Very low	170 Å²	170	120.2 Å²	120.2	91%	0.909	75%	0.749	S	S	*	*			cis	-151.7	151.1	-0.6	-108.4	-24.3	0	0	0	113.3
419	G	42	Very low	51.1	Low	68 Å²	68	117.1 Å²	117.1	70%	0.701	73%	0.728	S	S	*	*			trans	72.4	59.1	132.5	0	0	0	0	0	122.2
420	H	48.8	Very low	53	Low	193 Å²	193	116.4 Å²	116.4	89%	0.894	72%	0.718	S	S	*	*			trans	-149.4	147.1	143.8	-127.4	-95.5	0	0	0	112.6	G422	H420-G422 PolarHBondContact O-N 3.21Å
421	N	46	Very low	54.7	Low	175 Å²	175	115 Å²	115	94%	0.936	70%	0.702	S	S	*	*	S	Bend	trans	-79.2	106.1	-165.9	-75.7	-54.5	0	0	0	114.1
422	G	46.6	Very low	56.7	Low	62 Å²	62	115.2 Å²	115.2	64%	0.639	69%	0.686	S	S	*	*	S	Bend	trans	-175.3	141.8	165.3	0	0	0	0	0	108.8	H420 P424	H420-G422 PolarHBondContact O-N 3.21Å; G422-P424 VanDerWaalsContact O-CD 3.24Å; G422-P424 WeakPolarHBondContact O-CD 3.27Å
423	L	50.4	Low	59	Low	136 Å²	136	111 Å²	111	71%	0.712	67%	0.669	S	S	*	*			trans	-77.3	113.9	177	179.1	69	0	0	0	108.8
424	P	55.5	Low	61	Low	85 Å²	85	108.8 Å²	108.8	55%	0.552	65%	0.652	S	S	*	*			trans	-77.2	135.8	-179.2	31.4	-34.2	0	0	0	111	G422 A426 K427	G422-P424 VanDerWaalsContact O-CD 3.24Å; G422-P424 WeakPolarHBondContact O-CD 3.27Å; P424-A426 PolarHBondContact O-N 2.91Å; P424-K427 PolarHBondContact O-N 2.73Å
425	D	61.6	Low	63.3	Low	116 Å²	116	109.7 Å²	109.7	62%	0.62	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54	-30	-175	-61.5	-80.2	0	0	0	113.9	K427 L428 D429	D425-K427 PolarHBondContact O-N 2.85Å; D425-L428 WeakPolarHBondContact O-CA 3.27Å; D425-L428 WeakPolarHBondContact O-CB 3.37Å; D425-L428 PolarHBondContact O-N 2.84Å; D425-D429 PolarHBondContact O-N 2.92Å; D425-D429 VanDerWaalsContact O-N 3.07Å
426	A	63.5	Low	65.3	Low	73 Å²	73	106.4 Å²	106.4	60%	0.603	63%	0.629	S	S	*	*	H	α-helix	trans	-48.1	-30.6	179.4	0	0	0	0	0	115	P424 S430	P424-A426 PolarHBondContact O-N 2.91Å; A426-S430 PolarHBondContact O-N 3.35Å
427	K	69.1	Low	67.4	Low	153 Å²	153	105.1 Å²	105.1	67%	0.665	61%	0.611	S	S	*	*	H	α-helix	trans	-80.7	-28.4	176.7	-163.9	171.2	-175.9	178.7	0	113.3	P424 D425	P424-K427 PolarHBondContact O-N 2.73Å; D425-K427 PolarHBondContact O-N 2.85Å
428	L	72.9	Confident	69.7	Low	82 Å²	82	106.1 Å²	106.1	43%	0.429	60%	0.599	S	S	.	*	H	α-helix	trans	-69.3	-41.3	169.9	-117.1	75	0	0	0	110.6	D425 S430 I431 R432	D425-L428 WeakPolarHBondContact O-CA 3.27Å; D425-L428 WeakPolarHBondContact O-CB 3.37Å; D425-L428 PolarHBondContact O-N 2.84Å; L428-S430 VanDerWaalsContact C-N 3.34Å; L428-S430 PolarHBondContact O-N 2.89Å; L428-I431 PolarHBondContact O-N 2.98Å; L428-I431 VanDerWaalsContact O-N 3.13Å; L428-R432 WeakPolarHBondContact O-CG 3.41Å; L428-R432 PolarHBondContact O-N 2.92Å
429	D	79.7	Confident	71.9	Confident	75 Å²	75	100.6 Å²	100.6	40%	0.401	58%	0.578	S	S	.	*	H	α-helix	trans	-66.4	-34.2	-178.6	-63.5	-34.6	0	0	0	112.9	D425 I431 R432 S433	D425-D429 PolarHBondContact O-N 2.92Å; D425-D429 VanDerWaalsContact O-N 3.07Å; D429-I431 VanDerWaalsContact C-N 3.33Å; D429-I431 PolarHBondContact O-N 3.49Å; D429-R432 PolarHBondContact O-N 3.05Å; D429-R432 IonicContact OD1-CZ 3.12Å; D429-R432 IonicContact OD1-NH1 3.72Å; D429-R432 PolarHBondContact OD1-NH1 3.47Å; D429-S433 WeakPolarHBondContact O-CB 3.34Å; D429-S433 PolarHBondContact O-N 3.06Å
430	S	78.5	Confident	74.3	Confident	72 Å²	72	102.8 Å²	102.8	50%	0.503	57%	0.572	S	S	.	*	H	α-helix	trans	-59.8	-39.8	170.8	178.7	0	0	0	0	112.8	A426 L428 V434	A426-S430 PolarHBondContact O-N 3.35Å; L428-S430 VanDerWaalsContact C-N 3.34Å; L428-S430 PolarHBondContact O-N 2.89Å; S430-V434 PolarHBondContact O-N 3.48Å
431	I	82.9	Confident	76.3	Confident	98 Å²	98	98.7 Å²	98.7	50%	0.503	56%	0.557	S	S	.	*	H	α-helix	trans	-71.7	-43	177.9	-63.4	173.5	0	0	0	110.6	L428 D429 S433 V434 Q435	L428-I431 PolarHBondContact O-N 2.98Å; L428-I431 VanDerWaalsContact O-N 3.13Å; D429-I431 VanDerWaalsContact C-N 3.33Å; D429-I431 PolarHBondContact O-N 3.49Å; I431-S433 VanDerWaalsContact C-N 3.29Å; I431-S433 PolarHBondContact O-N 2.81Å; I431-V434 PolarHBondContact O-N 2.79Å; I431-Q435 WeakPolarHBondContact O-CG 3.21Å; I431-Q435 PolarHBondContact O-N 2.68Å; I431-Q435 VanDerWaalsContact O-N 3.11Å
432	R	86.6	Confident	78.6	Confident	120 Å²	120	96.3 Å²	96.3	45%	0.453	54%	0.54	S	S	.	.	H	α-helix	trans	-56.2	-43.4	174.8	-69.6	167.9	173.2	153	-4.6	111.6	L428 D429 Q435 Q436	L428-R432 WeakPolarHBondContact O-CG 3.41Å; L428-R432 PolarHBondContact O-N 2.92Å; D429-R432 PolarHBondContact O-N 3.05Å; D429-R432 IonicContact OD1-CZ 3.12Å; D429-R432 IonicContact OD1-NH1 3.72Å; D429-R432 PolarHBondContact OD1-NH1 3.47Å; R432-Q435 PolarHBondContact O-N 3.27Å; R432-Q436 WeakPolarHBondContact O-CG 3.18Å; R432-Q436 PolarHBondContact O-N 3.33Å
433	S	84.5	Confident	80.8	Confident	70 Å²	70	99.5 Å²	99.5	49%	0.49	54%	0.538	S	S	.	.	H	α-helix	trans	-60.4	-45.2	178.3	178.4	0	0	0	0	112.8	D429 I431 Q435 Q436 A437	D429-S433 WeakPolarHBondContact O-CB 3.34Å; D429-S433 PolarHBondContact O-N 3.06Å; I431-S433 VanDerWaalsContact C-N 3.29Å; I431-S433 PolarHBondContact O-N 2.81Å; S433-Q435 PolarHBondContact O-N 3.09Å; S433-Q436 PolarHBondContact O-N 3.04Å; S433-A437 PolarHBondContact O-N 3.47Å
434	V	87.5	Confident	82.8	Confident	87 Å²	87	98.6 Å²	98.6	53%	0.527	53%	0.53	S	S	.	.	H	α-helix	trans	-65.3	-38.4	176.6	176.8	0	0	0	0	111.8	S430 I431 A437 I438	S430-V434 PolarHBondContact O-N 3.48Å; I431-V434 PolarHBondContact O-N 2.79Å; V434-A437 PolarHBondContact O-N 3.43Å; V434-I438 HydrophobicContact CG1-CD1 4.32Å; V434-I438 WeakPolarHBondContact O-CG1 3.31Å; V434-I438 PolarHBondContact O-N 3.05Å; V434-I438 VanDerWaalsContact O-N 3.13Å
435	Q	89	Confident	84.5	Confident	126 Å²	126	98.9 Å²	98.9	59%	0.589	53%	0.527	S	S	*	.	H	α-helix	trans	-65.7	-38.1	176.1	-70.4	178.2	-38.7	0	0	112.3	I431 R432 S433 I438 A439	I431-Q435 WeakPolarHBondContact O-CG 3.21Å; I431-Q435 PolarHBondContact O-N 2.68Å; I431-Q435 VanDerWaalsContact O-N 3.11Å; R432-Q435 PolarHBondContact O-N 3.27Å; S433-Q435 PolarHBondContact O-N 3.09Å; Q435-I438 PolarHBondContact O-N 3.24Å; Q435-A439 PolarHBondContact O-N 3.43Å
436	Q	90.9	Very high	86	Confident	130 Å²	130	97.4 Å²	97.4	61%	0.607	52%	0.518	S	S	*	.	H	α-helix	trans	-64.6	-41.5	172.9	-72.9	169.9	-20.4	0	0	111.9	R432 S433 I438 A439 L440	R432-Q436 WeakPolarHBondContact O-CG 3.18Å; R432-Q436 PolarHBondContact O-N 3.33Å; S433-Q436 PolarHBondContact O-N 3.04Å; Q436-I438 VanDerWaalsContact C-N 3.35Å; Q436-I438 PolarHBondContact O-N 3.47Å; Q436-A439 PolarHBondContact O-N 2.92Å; Q436-L440 WeakPolarHBondContact O-CG 3.29Å; Q436-L440 PolarHBondContact O-N 3.03Å; Q436-L440 VanDerWaalsContact O-N 3.15Å
437	A	90.3	Very high	87.4	Confident	47 Å²	47	96.2 Å²	96.2	39%	0.388	51%	0.508	S	S	.	.	H	α-helix	trans	-62.6	-37.9	177.7	0	0	0	0	0	113.1	S433 V434 L441	S433-A437 PolarHBondContact O-N 3.47Å; V434-A437 PolarHBondContact O-N 3.43Å; A437-L441 WeakPolarHBondContact O-CG 3.45Å; A437-L441 PolarHBondContact O-N 3.12Å
438	I	91.6	Very high	88.4	Confident	90 Å²	90	92.1 Å²	92.1	46%	0.462	50%	0.496	S	S	.	.	H	α-helix	trans	-65.8	-45.7	175.6	-67.2	167.6	0	0	0	110.9	V434 Q435 Q436 L440 L441 E442	V434-I438 HydrophobicContact CG1-CD1 4.32Å; V434-I438 WeakPolarHBondContact O-CG1 3.31Å; V434-I438 PolarHBondContact O-N 3.05Å; V434-I438 VanDerWaalsContact O-N 3.13Å; Q435-I438 PolarHBondContact O-N 3.24Å; Q436-I438 VanDerWaalsContact C-N 3.35Å; Q436-I438 PolarHBondContact O-N 3.47Å; I438-L440 VanDerWaalsContact C-N 3.29Å; I438-L440 PolarHBondContact O-N 3.39Å; I438-L441 PolarHBondContact O-N 2.75Å; I438-L441 VanDerWaalsContact O-N 3.15Å; I438-E442 HydrophobicContact CG2-CG 4.5Å; I438-E442 PolarHBondContact O-N 3.12Å
439	A	91.4	Very high	89.5	Confident	55 Å²	55	93.8 Å²	93.8	46%	0.455	50%	0.5	S	S	.	.	H	α-helix	trans	-60.1	-38.4	179.8	0	0	0	0	0	112.7	Q435 Q436 E442 E443	Q435-A439 PolarHBondContact O-N 3.43Å; Q436-A439 PolarHBondContact O-N 2.92Å; A439-E442 PolarHBondContact O-N 3.22Å; A439-E443 PolarHBondContact O-N 3.06Å; A439-E443 VanDerWaalsContact O-N 3.08Å
440	L	92.9	Very high	90.1	Very high	113 Å²	113	96.5 Å²	96.5	59%	0.592	50%	0.504	S	S	*	.	H	α-helix	trans	-65.8	-40	175.7	-69.3	167.9	0	0	0	112.5	Q436 I438 E443 E444	Q436-L440 WeakPolarHBondContact O-CG 3.29Å; Q436-L440 PolarHBondContact O-N 3.03Å; Q436-L440 VanDerWaalsContact O-N 3.15Å; I438-L440 VanDerWaalsContact C-N 3.29Å; I438-L440 PolarHBondContact O-N 3.39Å; L440-E443 PolarHBondContact O-N 3.18Å; L440-E444 PolarHBondContact O-N 3.3Å
441	L	91.9	Very high	90.7	Very high	107 Å²	107	97.8 Å²	97.8	56%	0.56	50%	0.503	S	S	*	.	H	α-helix	trans	-68.4	-34.3	176.3	-71.9	168.2	0	0	0	112.5	A437 I438 L445	A437-L441 WeakPolarHBondContact O-CG 3.45Å; A437-L441 PolarHBondContact O-N 3.12Å; I438-L441 PolarHBondContact O-N 2.75Å; I438-L441 VanDerWaalsContact O-N 3.15Å; L441-L445 WeakPolarHBondContact O-CB 3.42Å; L441-L445 PolarHBondContact O-N 2.86Å
442	E	92.7	Very high	91.1	Very high	126 Å²	126	97.3 Å²	97.3	59%	0.589	50%	0.504	S	S	*	.	H	α-helix	trans	-67.9	-36.4	173.2	-70.1	-175.2	156.5	0	0	111.9	I438 A439 L446	I438-E442 HydrophobicContact CG2-CG 4.5Å; I438-E442 PolarHBondContact O-N 3.12Å; A439-E442 PolarHBondContact O-N 3.22Å; E442-L446 WeakPolarHBondContact O-CB 3.48Å; E442-L446 WeakPolarHBondContact O-CG 3.4Å; E442-L446 PolarHBondContact O-N 3.39Å
443	E	92.9	Very high	91.4	Very high	128 Å²	128	97.4 Å²	97.4	60%	0.598	51%	0.51	S	S	*	.	H	α-helix	trans	-66	-43.9	172.8	-176.4	167	-157	0	0	112.2	A439 L440 L445 L446 A447	A439-E443 PolarHBondContact O-N 3.06Å; A439-E443 VanDerWaalsContact O-N 3.08Å; L440-E443 PolarHBondContact O-N 3.18Å; E443-L445 PolarHBondContact O-N 3.19Å; E443-L446 CarbonylContact O-C 3.58Å; E443-L446 PolarHBondContact O-N 3.22Å; E443-A447 PolarHBondContact O-N 3.27Å
444	E	93	Very high	91.8	Very high	118 Å²	118	101.1 Å²	101.1	55%	0.551	52%	0.517	S	S	*	.	H	α-helix	trans	-63.2	-39.9	176.2	-172.8	174.3	-157.6	0	0	112.3	L440 L446 A447 T448	L440-E444 PolarHBondContact O-N 3.3Å; E444-L446 VanDerWaalsContact C-N 3.33Å; E444-L446 PolarHBondContact O-N 2.96Å; E444-A447 PolarHBondContact O-N 2.88Å; E444-T448 PolarHBondContact O-N 2.88Å; E444-T448 PolarHBondContact O-OG1 2.87Å
445	L	92.2	Very high	92	Very high	91 Å²	91	102.5 Å²	102.5	48%	0.476	52%	0.517	S	S	.	.	H	α-helix	trans	-66.8	-34.5	174.9	-163.9	155.4	0	0	0	111.8	L441 E443 T448 K449	L441-L445 WeakPolarHBondContact O-CB 3.42Å; L441-L445 PolarHBondContact O-N 2.86Å; E443-L445 PolarHBondContact O-N 3.19Å; L445-T448 WeakPolarHBondContact CA-OG1 3.43Å; L445-T448 PolarHBondContact O-OG1 3.42Å; L445-T448 VanDerWaalsContact O-OG1 3.13Å; L445-K449 HydrophobicContact CD2-CD 3.91Å; L445-K449 VanDerWaalsContact CD2-CE 3.46Å; L445-K449 WeakPolarHBondContact O-CG 3.44Å; L445-K449 PolarHBondContact O-N 2.93Å
446	L	93	Very high	92.2	Very high	85 Å²	85	103.4 Å²	103.4	45%	0.445	52%	0.521	S	S	.	.	H	α-helix	trans	-73.3	-32.1	171.7	-77.3	167.8	0	0	0	112.9	E442 E443 E444 R450	E442-L446 WeakPolarHBondContact O-CB 3.48Å; E442-L446 WeakPolarHBondContact O-CG 3.4Å; E442-L446 PolarHBondContact O-N 3.39Å; E443-L446 CarbonylContact O-C 3.58Å; E443-L446 PolarHBondContact O-N 3.22Å; E444-L446 VanDerWaalsContact C-N 3.33Å; E444-L446 PolarHBondContact O-N 2.96Å; L446-R450 WeakPolarHBondContact O-CD 3.45Å; L446-R450 VanDerWaalsContact O-CG 3.26Å; L446-R450 WeakPolarHBondContact O-CG 3.18Å; L446-R450 PolarHBondContact O-N 3.48Å
447	A	92.8	Very high	92.1	Very high	47 Å²	47	100.3 Å²	100.3	39%	0.388	51%	0.513	S	S	.	.	H	α-helix	trans	-66.5	-52.5	174.7	0	0	0	0	0	111.3	E443 E444 K449 R450 E451	E443-A447 PolarHBondContact O-N 3.27Å; E444-A447 PolarHBondContact O-N 2.88Å; A447-K449 PolarHBondContact O-N 2.84Å; A447-R450 PolarHBondContact O-N 2.96Å; A447-E451 PolarHBondContact O-N 3.49Å
448	T	90.4	Very high	92.3	Very high	67 Å²	67	103.3 Å²	103.3	41%	0.411	52%	0.522	S	S	.	.	H	α-helix	trans	-60.7	-38.6	179	48.3	0	0	0	0	112.7	E444 L445 E451 T452	E444-T448 PolarHBondContact O-N 2.88Å; E444-T448 PolarHBondContact O-OG1 2.87Å; L445-T448 WeakPolarHBondContact CA-OG1 3.43Å; L445-T448 PolarHBondContact O-OG1 3.42Å; L445-T448 VanDerWaalsContact O-OG1 3.13Å; T448-E451 WeakPolarHBondContact O-CB 3.36Å; T448-E451 PolarHBondContact O-N 3.19Å; T448-T452 PolarHBondContact O-N 2.72Å
449	K	94.4	Very high	92.2	Very high	117 Å²	117	105.1 Å²	105.1	51%	0.509	53%	0.532	S	S	.	.	H	α-helix	trans	-58	-52.7	171.9	-81.8	176.3	176.5	169.7	0	112.8	L445 A447 E451 T452 E453	L445-K449 HydrophobicContact CD2-CD 3.91Å; L445-K449 VanDerWaalsContact CD2-CE 3.46Å; L445-K449 WeakPolarHBondContact O-CG 3.44Å; L445-K449 PolarHBondContact O-N 2.93Å; A447-K449 PolarHBondContact O-N 2.84Å; K449-E451 PolarHBondContact O-N 2.71Å; K449-E451 VanDerWaalsContact O-N 3.17Å; K449-T452 PolarHBondContact O-N 3.01Å; K449-T452 VanDerWaalsContact O-N 3.08Å; K449-T452 PolarHBondContact O-OG1 3.41Å; K449-E453 PolarHBondContact O-N 3.04Å
450	R	92.5	Very high	92.1	Very high	132 Å²	132	106.4 Å²	106.4	50%	0.498	54%	0.538	S	S	.	.	H	α-helix	trans	-58.8	-28.8	176.9	-66.1	168.2	-168.7	131.2	-5.8	112.2	L446 A447 K454	L446-R450 WeakPolarHBondContact O-CD 3.45Å; L446-R450 VanDerWaalsContact O-CG 3.26Å; L446-R450 WeakPolarHBondContact O-CG 3.18Å; L446-R450 PolarHBondContact O-N 3.48Å; A447-R450 PolarHBondContact O-N 2.96Å; R450-K454 VanDerWaalsContact O-CG 3.31Å; R450-K454 WeakPolarHBondContact O-CG 3.46Å; R450-K454 PolarHBondContact O-N 3.07Å
451	E	91.5	Very high	92	Very high	100 Å²	100	105.6 Å²	105.6	47%	0.467	53%	0.534	S	S	.	.	H	α-helix	trans	-73.5	-43.1	175.3	-166.1	170	-143.7	0	0	112.2	A447 T448 K449 E453 K454 F455	A447-E451 PolarHBondContact O-N 3.49Å; T448-E451 WeakPolarHBondContact O-CB 3.36Å; T448-E451 PolarHBondContact O-N 3.19Å; K449-E451 PolarHBondContact O-N 2.71Å; K449-E451 VanDerWaalsContact O-N 3.17Å; E451-E453 VanDerWaalsContact C-N 3.31Å; E451-E453 PolarHBondContact O-N 3.14Å; E451-K454 WeakPolarHBondContact O-CB 3.45Å; E451-K454 PolarHBondContact O-N 3.42Å; E451-F455 HydrophobicContact CG-CD2 4.11Å; E451-F455 HydrophobicContact CG-CE2 3.64Å; E451-F455 HydrophobicContact CG-CZ 4.43Å; E451-F455 VanDerWaalsContact O-CD2 3.29Å; E451-F455 WeakPolarHBondContact O-CD2 3.38Å; E451-F455 PolarHBondContact O-N 3.21Å
452	T	91.5	Very high	91.7	Very high	87 Å²	87	102.4 Å²	102.4	53%	0.534	52%	0.521	S	S	.	.	H	α-helix	trans	-60.9	-37.6	173	59.5	0	0	0	0	112.9	T448 K449 F455 Q456	T448-T452 PolarHBondContact O-N 2.72Å; K449-T452 PolarHBondContact O-N 3.01Å; K449-T452 VanDerWaalsContact O-N 3.08Å; K449-T452 PolarHBondContact O-OG1 3.41Å; T452-F455 PolarHBondContact O-N 2.77Å; T452-Q456 PolarHBondContact O-N 3.23Å
453	E	93.1	Very high	91.8	Very high	123 Å²	123	104.8 Å²	104.8	58%	0.575	52%	0.524	S	S	*	.	H	α-helix	trans	-63.8	-40	174.8	-68.7	170.6	165.7	0	0	112.1	K449 E451 Q456 S457	K449-E453 PolarHBondContact O-N 3.04Å; E451-E453 VanDerWaalsContact C-N 3.31Å; E451-E453 PolarHBondContact O-N 3.14Å; E453-Q456 PolarHBondContact O-N 3.42Å; E453-S457 PolarHBondContact O-N 3.03Å
454	K	92.3	Very high	91.6	Very high	147 Å²	147	100.1 Å²	100.1	64%	0.639	51%	0.511	S	S	*	.	H	α-helix	trans	-62.1	-46.4	173.3	-70.9	167.3	-172.3	175.4	0	111.6	R450 E451 Q456 S457 L458	R450-K454 VanDerWaalsContact O-CG 3.31Å; R450-K454 WeakPolarHBondContact O-CG 3.46Å; R450-K454 PolarHBondContact O-N 3.07Å; E451-K454 WeakPolarHBondContact O-CB 3.45Å; E451-K454 PolarHBondContact O-N 3.42Å; K454-Q456 VanDerWaalsContact C-N 3.35Å; K454-Q456 PolarHBondContact O-N 3.33Å; K454-S457 PolarHBondContact O-N 2.82Å; K454-L458 WeakPolarHBondContact O-CB 3.38Å; K454-L458 PolarHBondContact O-N 3.47Å
455	F	92	Very high	91.4	Very high	117 Å²	117	100.6 Å²	100.6	51%	0.513	51%	0.513	S	S	.	.	H	α-helix	trans	-63.1	-40	177.6	-73.3	-55.8	0	0	0	112.1	E451 T452 S457 L458 L459	E451-F455 HydrophobicContact CG-CD2 4.11Å; E451-F455 HydrophobicContact CG-CE2 3.64Å; E451-F455 HydrophobicContact CG-CZ 4.43Å; E451-F455 VanDerWaalsContact O-CD2 3.29Å; E451-F455 WeakPolarHBondContact O-CD2 3.38Å; E451-F455 PolarHBondContact O-N 3.21Å; T452-F455 PolarHBondContact O-N 2.77Å; F455-S457 PolarHBondContact O-N 3.4Å; F455-L458 PolarHBondContact O-N 3.28Å; F455-L459 WeakPolarHBondContact O-CB 3.47Å; F455-L459 WeakPolarHBondContact O-CG 3.49Å; F455-L459 PolarHBondContact O-N 3.12Å
456	Q	92.3	Very high	91.3	Very high	145 Å²	145	102.2 Å²	102.2	68%	0.678	52%	0.516	S	S	*	.	H	α-helix	trans	-63.1	-41.5	175.8	-170.9	176.5	8.3	0	0	112.2	T452 E453 K454 S460	T452-Q456 PolarHBondContact O-N 3.23Å; E453-Q456 PolarHBondContact O-N 3.42Å; K454-Q456 VanDerWaalsContact C-N 3.35Å; K454-Q456 PolarHBondContact O-N 3.33Å; Q456-S460 PolarHBondContact O-N 3.21Å
457	S	90.5	Very high	91.2	Very high	65 Å²	65	102.8 Å²	102.8	46%	0.455	52%	0.517	S	S	.	.	H	α-helix	trans	-62.6	-46	174	-176.2	0	0	0	0	112	E453 K454 F455 L459 S460 N461	E453-S457 PolarHBondContact O-N 3.03Å; K454-S457 PolarHBondContact O-N 2.82Å; F455-S457 PolarHBondContact O-N 3.4Å; S457-L459 PolarHBondContact O-N 3.25Å; S457-S460 WeakPolarHBondContact O-CB 3.39Å; S457-S460 PolarHBondContact O-N 3.11Å; S457-N461 PolarHBondContact O-N 3.2Å; S457-N461 PolarHBondContact O-ND2 3.5Å
458	L	92.6	Very high	91	Very high	110 Å²	110	104.6 Å²	104.6	58%	0.576	52%	0.52	S	S	*	.	H	α-helix	trans	-61	-44	178.2	-175.3	63.3	0	0	0	112.3	K454 F455 S460 N461 S462	K454-L458 WeakPolarHBondContact O-CB 3.38Å; K454-L458 PolarHBondContact O-N 3.47Å; F455-L458 PolarHBondContact O-N 3.28Å; L458-S460 VanDerWaalsContact C-N 3.34Å; L458-S460 PolarHBondContact O-N 2.71Å; L458-N461 PolarHBondContact O-N 2.71Å; L458-S462 WeakPolarHBondContact O-CB 3.48Å; L458-S462 PolarHBondContact O-N 3.42Å
459	L	90.6	Very high	90.8	Very high	127 Å²	127	105.8 Å²	105.8	67%	0.665	52%	0.523	S	S	*	.	H	α-helix	trans	-63.5	-38.1	175.4	-73	169.8	0	0	0	112.3	F455 S457 R463	F455-L459 WeakPolarHBondContact O-CB 3.47Å; F455-L459 WeakPolarHBondContact O-CG 3.49Å; F455-L459 PolarHBondContact O-N 3.12Å; S457-L459 PolarHBondContact O-N 3.25Å; L459-R463 WeakPolarHBondContact O-CB 3.3Å; L459-R463 PolarHBondContact O-N 3.45Å
460	S	89.3	Confident	90.6	Very high	82 Å²	82	106.6 Å²	106.6	57%	0.573	53%	0.529	S	S	*	.	H	α-helix	trans	-64.4	-43.2	175.2	-168.9	0	0	0	0	111.9	Q456 S457 L458 R463 G464	Q456-S460 PolarHBondContact O-N 3.21Å; S457-S460 WeakPolarHBondContact O-CB 3.39Å; S457-S460 PolarHBondContact O-N 3.11Å; L458-S460 VanDerWaalsContact C-N 3.34Å; L458-S460 PolarHBondContact O-N 2.71Å; S460-R463 PolarHBondContact O-N 3.09Å; S460-G464 PolarHBondContact O-N 2.89Å; S460-G464 VanDerWaalsContact O-N 3.15Å
461	N	89.7	Confident	90.6	Very high	97 Å²	97	107.5 Å²	107.5	52%	0.519	53%	0.532	S	S	.	.	H	α-helix	trans	-66.8	-45.5	178.6	-67.7	-19.2	0	0	0	111.7	S457 L458 R463 G464 Q465	S457-N461 PolarHBondContact O-N 3.2Å; S457-N461 PolarHBondContact O-ND2 3.5Å; L458-N461 PolarHBondContact O-N 2.71Å; N461-R463 VanDerWaalsContact C-N 3.34Å; N461-R463 PolarHBondContact O-N 3.09Å; N461-G464 PolarHBondContact O-N 3.49Å; N461-Q465 WeakPolarHBondContact O-CG 3.5Å; N461-Q465 PolarHBondContact O-N 3.39Å
462	S	87.4	Confident	90.5	Very high	40 Å²	40	108.6 Å²	108.6	28%	0.28	54%	0.535	S	S	.	.	H	α-helix	trans	-58.9	-44	175.5	175.8	0	0	0	0	111.7	L458 G464 Q465 F466	L458-S462 WeakPolarHBondContact O-CB 3.48Å; L458-S462 PolarHBondContact O-N 3.42Å; S462-G464 VanDerWaalsContact C-N 3.31Å; S462-G464 PolarHBondContact O-N 3.35Å; S462-Q465 WeakPolarHBondContact O-CB 3.49Å; S462-Q465 PolarHBondContact O-N 3.45Å; S462-Q465 VanDerWaalsContact O-N 3.16Å; S462-F466 VanDerWaalsContact O-CD2 3.22Å; S462-F466 WeakPolarHBondContact O-CD2 3.26Å; S462-F466 PolarHBondContact O-N 2.96Å; S462-F466 WeakPolarHBondContact OG-CE2 3.26Å
463	R	92.8	Very high	90.5	Very high	175 Å²	175	112.5 Å²	112.5	66%	0.66	54%	0.542	S	S	*	.	H	α-helix	trans	-60	-38.8	175.5	-174.6	177.3	-178	172.2	3.5	112.8	L459 S460 N461 Q467	L459-R463 WeakPolarHBondContact O-CB 3.3Å; L459-R463 PolarHBondContact O-N 3.45Å; S460-R463 PolarHBondContact O-N 3.09Å; N461-R463 VanDerWaalsContact C-N 3.34Å; N461-R463 PolarHBondContact O-N 3.09Å; R463-Q467 WeakPolarHBondContact O-CG 3.5Å; R463-Q467 PolarHBondContact O-N 3.12Å
464	G	90.1	Very high	90.4	Very high	30 Å²	30	109.1 Å²	109.1	31%	0.309	53%	0.534	S	S	.	.	H	α-helix	trans	-63.7	-44.8	173.9	0	0	0	0	0	112.4	S460 N461 S462 F466 Q467 D468	S460-G464 PolarHBondContact O-N 2.89Å; S460-G464 VanDerWaalsContact O-N 3.15Å; N461-G464 PolarHBondContact O-N 3.49Å; S462-G464 VanDerWaalsContact C-N 3.31Å; S462-G464 PolarHBondContact O-N 3.35Å; G464-F466 VanDerWaalsContact C-N 3.35Å; G464-F466 PolarHBondContact O-N 3.17Å; G464-Q467 PolarHBondContact O-N 3.11Å; G464-D468 PolarHBondContact O-N 2.98Å
465	Q	89.3	Confident	90.3	Very high	128 Å²	128	107.1 Å²	107.1	60%	0.598	53%	0.531	S	S	*	.	H	α-helix	trans	-59.9	-42.1	177.1	-69.9	170.9	-17.6	0	0	112.3	N461 S462 D468 L469	N461-Q465 WeakPolarHBondContact O-CG 3.5Å; N461-Q465 PolarHBondContact O-N 3.39Å; S462-Q465 WeakPolarHBondContact O-CB 3.49Å; S462-Q465 PolarHBondContact O-N 3.45Å; S462-Q465 VanDerWaalsContact O-N 3.16Å; Q465-D468 PolarHBondContact O-N 3.46Å; Q465-L469 WeakPolarHBondContact O-CG 3.45Å; Q465-L469 PolarHBondContact O-N 3.45Å
466	F	89.6	Confident	90.1	Very high	126 Å²	126	103.5 Å²	103.5	55%	0.553	52%	0.522	S	S	*	.	H	α-helix	trans	-61.4	-43.9	174.3	-79	-65.5	0	0	0	112.5	S462 G464 D468 L469 E470	S462-F466 VanDerWaalsContact O-CD2 3.22Å; S462-F466 WeakPolarHBondContact O-CD2 3.26Å; S462-F466 PolarHBondContact O-N 2.96Å; S462-F466 WeakPolarHBondContact OG-CE2 3.26Å; G464-F466 VanDerWaalsContact C-N 3.35Å; G464-F466 PolarHBondContact O-N 3.17Å; F466-D468 VanDerWaalsContact C-N 3.32Å; F466-D468 PolarHBondContact O-N 2.93Å; F466-L469 WeakPolarHBondContact O-CB 3.29Å; F466-L469 PolarHBondContact O-N 2.86Å; F466-L469 VanDerWaalsContact O-N 3.12Å; F466-E470 WeakPolarHBondContact O-CG 3.47Å; F466-E470 PolarHBondContact O-N 3.4Å
467	Q	89.8	Confident	90	Very high	97 Å²	97	102 Å²	102	45%	0.453	51%	0.514	S	S	.	.	H	α-helix	trans	-65.1	-33.6	178.6	-71.1	-177.5	-22.4	0	0	113.2	R463 G464 R471	R463-Q467 WeakPolarHBondContact O-CG 3.5Å; R463-Q467 PolarHBondContact O-N 3.12Å; G464-Q467 PolarHBondContact O-N 3.11Å; Q467-R471 PolarHBondContact O-N 3.01Å
468	D	89.4	Confident	90	Very high	85 Å²	85	103.7 Å²	103.7	46%	0.455	52%	0.515	S	S	.	.	H	α-helix	trans	-74.4	-28	173.2	-82.1	-16.7	0	0	0	113	G464 Q465 F466 K472	G464-D468 PolarHBondContact O-N 2.98Å; Q465-D468 PolarHBondContact O-N 3.46Å; F466-D468 VanDerWaalsContact C-N 3.32Å; F466-D468 PolarHBondContact O-N 2.93Å; D468-K472 WeakPolarHBondContact O-CD 3.23Å; D468-K472 WeakPolarHBondContact O-CE 3.43Å; D468-K472 WeakPolarHBondContact O-CG 3.46Å; D468-K472 PolarHBondContact O-N 3.33Å
469	L	87.2	Confident	89.8	Confident	92 Å²	92	101.4 Å²	101.4	48%	0.482	50%	0.502	S	S	.	.	H	α-helix	trans	-71.9	-44.6	171.4	-74.1	165.5	0	0	0	111.6	Q465 F466 R471 K472 Y473	Q465-L469 WeakPolarHBondContact O-CG 3.45Å; Q465-L469 PolarHBondContact O-N 3.45Å; F466-L469 WeakPolarHBondContact O-CB 3.29Å; F466-L469 PolarHBondContact O-N 2.86Å; F466-L469 VanDerWaalsContact O-N 3.12Å; L469-R471 VanDerWaalsContact C-N 3.28Å; L469-R471 PolarHBondContact O-N 3.25Å; L469-K472 PolarHBondContact O-N 3.45Å; L469-Y473 WeakPolarHBondContact O-CB 3.31Å; L469-Y473 PolarHBondContact O-N 3.06Å
470	E	89.9	Confident	89.7	Confident	134 Å²	134	100 Å²	100	63%	0.626	50%	0.495	S	S	*	.	H	α-helix	trans	-54.9	-44	173.7	-73.5	179	142.8	0	0	111.6	F466 Y473 A474	F466-E470 WeakPolarHBondContact O-CG 3.47Å; F466-E470 PolarHBondContact O-N 3.4Å; E470-Y473 PolarHBondContact O-N 3.33Å; E470-A474 PolarHBondContact O-N 3.12Å
471	R	91.2	Very high	89.8	Confident	150 Å²	150	100 Å²	100	57%	0.566	48%	0.484	S	S	*	.	H	α-helix	trans	-62	-52	176.9	-168.6	-173.6	-50.6	-72.4	-6.1	112.1	Q467 L469 Y473 A474 D475	Q467-R471 PolarHBondContact O-N 3.01Å; L469-R471 VanDerWaalsContact C-N 3.28Å; L469-R471 PolarHBondContact O-N 3.25Å; R471-Y473 PolarHBondContact O-N 3.03Å; R471-A474 WeakPolarHBondContact O-CB 3.4Å; R471-A474 PolarHBondContact O-N 2.85Å; R471-A474 VanDerWaalsContact O-N 3.11Å; R471-D475 PolarHBondContact O-N 2.98Å
472	K	90.7	Very high	89.6	Confident	123 Å²	123	99.5 Å²	99.5	54%	0.535	48%	0.481	S	S	.	.	H	α-helix	trans	-58.5	-37.7	178.2	-68.8	160.2	-164.6	163	0	111.9	D468 L469 A476	D468-K472 WeakPolarHBondContact O-CD 3.23Å; D468-K472 WeakPolarHBondContact O-CE 3.43Å; D468-K472 WeakPolarHBondContact O-CG 3.46Å; D468-K472 PolarHBondContact O-N 3.33Å; L469-K472 PolarHBondContact O-N 3.45Å; K472-A476 VanDerWaalsContact O-CB 3.29Å; K472-A476 WeakPolarHBondContact O-CB 3.47Å; K472-A476 PolarHBondContact O-N 3.02Å
473	Y	90.4	Very high	89.6	Confident	170 Å²	170	103.4 Å²	103.4	67%	0.667	49%	0.491	S	S	*	.	H	α-helix	trans	-68.2	-39.1	176.9	-175.2	-107.8	0	0	0	112.3	L469 E470 R471 K477	L469-Y473 WeakPolarHBondContact O-CB 3.31Å; L469-Y473 PolarHBondContact O-N 3.06Å; E470-Y473 PolarHBondContact O-N 3.33Å; R471-Y473 PolarHBondContact O-N 3.03Å; Y473-K477 VanDerWaalsContact O-CB 3.26Å; Y473-K477 WeakPolarHBondContact O-CB 3.46Å; Y473-K477 PolarHBondContact O-N 3.3Å
474	A	90.6	Very high	89.3	Confident	51 Å²	51	99.8 Å²	99.8	42%	0.421	48%	0.482	S	S	.	.	H	α-helix	trans	-63.8	-47.5	172.9	0	0	0	0	0	111.9	E470 R471 A476 K477 E478	E470-A474 PolarHBondContact O-N 3.12Å; R471-A474 WeakPolarHBondContact O-CB 3.4Å; R471-A474 PolarHBondContact O-N 2.85Å; R471-A474 VanDerWaalsContact O-N 3.11Å; A474-A476 PolarHBondContact O-N 3.05Å; A474-K477 WeakPolarHBondContact O-CB 3.36Å; A474-K477 PolarHBondContact O-N 3.25Å; A474-K477 VanDerWaalsContact O-N 3.17Å; A474-E478 PolarHBondContact O-N 3.44Å; A474-E478 VanDerWaalsContact O-N 3.12Å
475	D	90.1	Very high	89.3	Confident	105 Å²	105	103.4 Å²	103.4	56%	0.561	49%	0.493	S	S	*	.	H	α-helix	trans	-60.3	-45.1	178.6	-63.1	-29.8	0	0	0	111.3	R471 K477 E478 L479	R471-D475 PolarHBondContact O-N 2.98Å; D475-K477 VanDerWaalsContact C-N 3.34Å; D475-K477 PolarHBondContact O-N 3.33Å; D475-E478 PolarHBondContact O-N 3.13Å; D475-L479 WeakPolarHBondContact O-CB 3.39Å; D475-L479 PolarHBondContact O-N 2.85Å; D475-L479 VanDerWaalsContact O-N 3.09Å
476	A	88.1	Confident	89.1	Confident	41 Å²	41	102.7 Å²	102.7	34%	0.339	49%	0.485	S	S	.	.	H	α-helix	trans	-63.7	-36.4	175.8	0	0	0	0	0	112.8	K472 A474 L479 I480	K472-A476 VanDerWaalsContact O-CB 3.29Å; K472-A476 WeakPolarHBondContact O-CB 3.47Å; K472-A476 PolarHBondContact O-N 3.02Å; A474-A476 PolarHBondContact O-N 3.05Å; A476-L479 PolarHBondContact O-N 2.98Å; A476-I480 VanDerWaalsContact O-CG1 3.31Å; A476-I480 WeakPolarHBondContact O-CG1 3.44Å; A476-I480 PolarHBondContact O-N 2.66Å
477	K	89.8	Confident	88.8	Confident	114 Å²	114	101.8 Å²	101.8	50%	0.496	48%	0.482	S	S	.	.	H	α-helix	trans	-67.6	-38.6	179.2	-176	176.6	-177.5	177.1	0	112.7	Y473 A474 D475 K481	Y473-K477 VanDerWaalsContact O-CB 3.26Å; Y473-K477 WeakPolarHBondContact O-CB 3.46Å; Y473-K477 PolarHBondContact O-N 3.3Å; A474-K477 WeakPolarHBondContact O-CB 3.36Å; A474-K477 PolarHBondContact O-N 3.25Å; A474-K477 VanDerWaalsContact O-N 3.17Å; D475-K477 VanDerWaalsContact C-N 3.34Å; D475-K477 PolarHBondContact O-N 3.33Å; K477-K481 PolarHBondContact O-N 3.38Å
478	E	90.9	Very high	88.7	Confident	101 Å²	101	103.9 Å²	103.9	47%	0.472	49%	0.49	S	S	.	.	H	α-helix	trans	-70.6	-40.9	173.4	-59.7	-49.4	124.6	0	0	111.2	A474 D475 I480 K481 D482	A474-E478 PolarHBondContact O-N 3.44Å; A474-E478 VanDerWaalsContact O-N 3.12Å; D475-E478 PolarHBondContact O-N 3.13Å; E478-I480 VanDerWaalsContact C-N 3.29Å; E478-I480 PolarHBondContact O-N 2.63Å; E478-K481 WeakPolarHBondContact O-CB 3.39Å; E478-K481 PolarHBondContact O-N 3.04Å; E478-K481 VanDerWaalsContact O-N 3.12Å; E478-K481 WeakPolarHBondContact OE1-CE 3.36Å; E478-K481 IonicContact OE1-NZ 2.87Å; E478-K481 PolarHBondContact OE1-NZ 3.48Å; E478-K481 WeakPolarHBondContact OE2-CE 3.48Å; E478-K481 IonicContact OE2-NZ 3.85Å; E478-K481 PolarHBondContact OE2-NZ 2.94Å; E478-D482 PolarHBondContact O-N 3.12Å
479	L	89.7	Confident	88.5	Confident	61 Å²	61	103.3 Å²	103.3	32%	0.319	49%	0.487	S	S	.	.	H	α-helix	trans	-56.2	-40.8	175.9	-178.3	67.3	0	0	0	112.7	F48 D475 A476 D482 Y483	F48-L479 HydrophobicContact CE1-CD2 4.34Å; F48-L479 HydrophobicContact CE2-CD2 3.86Å; F48-L479 HydrophobicContact CZ-CD1 4.33Å; F48-L479 HydrophobicContact CZ-CD2 3.59Å; D475-L479 WeakPolarHBondContact O-CB 3.39Å; D475-L479 PolarHBondContact O-N 2.85Å; D475-L479 VanDerWaalsContact O-N 3.09Å; A476-L479 PolarHBondContact O-N 2.98Å; L479-D482 WeakPolarHBondContact O-CB 3.26Å; L479-D482 PolarHBondContact O-N 3.44Å; L479-Y483 HydrophobicContact CD1-CD2 4.18Å; L479-Y483 HydrophobicContact CD1-CE2 3.72Å; L479-Y483 HydrophobicContact CD2-CE2 4.33Å; L479-Y483 HydrophobicContact CG-CD2 4.05Å; L479-Y483 HydrophobicContact CG-CE2 3.82Å; L479-Y483 VanDerWaalsContact O-CD2 3.23Å; L479-Y483 WeakPolarHBondContact O-CD2 3.46Å; L479-Y483 PolarHBondContact O-N 3.48Å
480	I	88.1	Confident	88.3	Confident	98 Å²	98	103.3 Å²	103.3	50%	0.503	49%	0.487	S	S	.	.	H	α-helix	trans	-62.9	-43.4	176.7	-71.7	163.8	0	0	0	111.6	A476 E478 D482 Y483 Q484	A476-I480 VanDerWaalsContact O-CG1 3.31Å; A476-I480 WeakPolarHBondContact O-CG1 3.44Å; A476-I480 PolarHBondContact O-N 2.66Å; E478-I480 VanDerWaalsContact C-N 3.29Å; E478-I480 PolarHBondContact O-N 2.63Å; I480-D482 VanDerWaalsContact C-N 3.31Å; I480-D482 PolarHBondContact O-N 3.17Å; I480-Y483 PolarHBondContact O-N 3.1Å; I480-Q484 WeakPolarHBondContact O-CG 3.38Å; I480-Q484 PolarHBondContact O-N 3.11Å
481	K	90.3	Very high	88	Confident	82 Å²	82	101.8 Å²	101.8	36%	0.357	48%	0.482	S	S	.	.	H	α-helix	trans	-61.4	-43	175.6	-61	176.4	-157.4	166.1	0	111.2	K477 E478 Y483 Q484 I485	K477-K481 PolarHBondContact O-N 3.38Å; E478-K481 WeakPolarHBondContact O-CB 3.39Å; E478-K481 PolarHBondContact O-N 3.04Å; E478-K481 VanDerWaalsContact O-N 3.12Å; E478-K481 WeakPolarHBondContact OE1-CE 3.36Å; E478-K481 IonicContact OE1-NZ 2.87Å; E478-K481 PolarHBondContact OE1-NZ 3.48Å; E478-K481 WeakPolarHBondContact OE2-CE 3.48Å; E478-K481 IonicContact OE2-NZ 3.85Å; E478-K481 PolarHBondContact OE2-NZ 2.94Å; K481-Y483 VanDerWaalsContact C-N 3.27Å; K481-Y483 PolarHBondContact O-N 3.5Å; K481-Q484 PolarHBondContact O-N 2.84Å; K481-I485 WeakPolarHBondContact O-CB 3.3Å; K481-I485 VanDerWaalsContact O-CG1 3.26Å; K481-I485 WeakPolarHBondContact O-CG1 3.48Å; K481-I485 PolarHBondContact O-N 3.2Å
482	D	87.4	Confident	87.8	Confident	86 Å²	86	98.2 Å²	98.2	46%	0.46	47%	0.474	S	S	.	.	H	α-helix	trans	-59.3	-38.1	177.9	-106	28.9	0	0	0	112	E478 L479 I480 R486	E478-D482 PolarHBondContact O-N 3.12Å; L479-D482 WeakPolarHBondContact O-CB 3.26Å; L479-D482 PolarHBondContact O-N 3.44Å; I480-D482 VanDerWaalsContact C-N 3.31Å; I480-D482 PolarHBondContact O-N 3.17Å; D482-R486 WeakPolarHBondContact O-CB 3.37Å; D482-R486 VanDerWaalsContact O-CG 3.3Å; D482-R486 WeakPolarHBondContact O-CG 3.46Å; D482-R486 PolarHBondContact O-N 3.28Å; D482-R486 VanDerWaalsContact O-N 3.1Å; D482-R486 PolarHBondContact O-NE 2.94Å; D482-R486 IonicContact OD2-NH1 3.26Å; D482-R486 PolarHBondContact OD2-NH1 3.48Å
483	Y	85.8	Confident	87.4	Confident	122 Å²	122	98.3 Å²	98.3	48%	0.478	47%	0.472	S	S	.	.	H	α-helix	trans	-67.3	-48.8	171.6	-82.9	-70.2	0	0	0	112.4	L479 I480 K481 I485 R486 E487	L479-Y483 HydrophobicContact CD1-CD2 4.18Å; L479-Y483 HydrophobicContact CD1-CE2 3.72Å; L479-Y483 HydrophobicContact CD2-CE2 4.33Å; L479-Y483 HydrophobicContact CG-CD2 4.05Å; L479-Y483 HydrophobicContact CG-CE2 3.82Å; L479-Y483 VanDerWaalsContact O-CD2 3.23Å; L479-Y483 WeakPolarHBondContact O-CD2 3.46Å; L479-Y483 PolarHBondContact O-N 3.48Å; I480-Y483 PolarHBondContact O-N 3.1Å; K481-Y483 VanDerWaalsContact C-N 3.27Å; K481-Y483 PolarHBondContact O-N 3.5Å; Y483-I485 VanDerWaalsContact C-N 3.26Å; Y483-I485 PolarHBondContact O-N 2.92Å; Y483-R486 VanDerWaalsContact CD1-NH2 3.33Å; Y483-R486 VanDerWaalsContact CG-NH2 3.32Å; Y483-R486 PolarHBondContact O-N 2.98Å; Y483-R486 VanDerWaalsContact O-N 3.11Å; Y483-E487 WeakPolarHBondContact O-CB 3.4Å; Y483-E487 PolarHBondContact O-N 3.34Å
484	Q	88.1	Confident	87	Confident	99 Å²	99	94.8 Å²	94.8	46%	0.463	46%	0.461	S	S	.	.	H	α-helix	trans	-59.1	-36.6	178	-70.4	174.1	-22	0	0	112.7	I480 K481 K488	I480-Q484 WeakPolarHBondContact O-CG 3.38Å; I480-Q484 PolarHBondContact O-N 3.11Å; K481-Q484 PolarHBondContact O-N 2.84Å; Q484-K488 WeakPolarHBondContact O-CB 3.48Å; Q484-K488 PolarHBondContact O-N 3.1Å; Q484-K488 VanDerWaalsContact O-N 3.1Å
485	I	88.8	Confident	86.7	Confident	107 Å²	107	98.4 Å²	98.4	55%	0.549	47%	0.469	S	S	.	.	H	α-helix	trans	-66.8	-48.3	174.5	-69.3	165	0	0	0	110.2	K481 Y483 E487 K488 D489	K481-I485 WeakPolarHBondContact O-CB 3.3Å; K481-I485 VanDerWaalsContact O-CG1 3.26Å; K481-I485 WeakPolarHBondContact O-CG1 3.48Å; K481-I485 PolarHBondContact O-N 3.2Å; Y483-I485 VanDerWaalsContact C-N 3.26Å; Y483-I485 PolarHBondContact O-N 2.92Å; I485-E487 PolarHBondContact O-N 3.32Å; I485-K488 PolarHBondContact O-N 3.49Å; I485-D489 WeakPolarHBondContact O-CB 3.37Å; I485-D489 PolarHBondContact O-N 3.01Å
486	R	86.3	Confident	86.5	Confident	112 Å²	112	97 Å²	97	42%	0.423	47%	0.468	S	S	.	.	H	α-helix	trans	-61.9	-41.2	178.6	-76.5	-175.7	-66	-102	1.3	113	D482 Y483 D489 L490	D482-R486 WeakPolarHBondContact O-CB 3.37Å; D482-R486 VanDerWaalsContact O-CG 3.3Å; D482-R486 WeakPolarHBondContact O-CG 3.46Å; D482-R486 PolarHBondContact O-N 3.28Å; D482-R486 VanDerWaalsContact O-N 3.1Å; D482-R486 PolarHBondContact O-NE 2.94Å; D482-R486 IonicContact OD2-NH1 3.26Å; D482-R486 PolarHBondContact OD2-NH1 3.48Å; Y483-R486 VanDerWaalsContact CD1-NH2 3.33Å; Y483-R486 VanDerWaalsContact CG-NH2 3.32Å; Y483-R486 PolarHBondContact O-N 2.98Å; Y483-R486 VanDerWaalsContact O-N 3.11Å; R486-D489 WeakPolarHBondContact O-CB 3.34Å; R486-D489 PolarHBondContact O-N 3.07Å; R486-L490 PolarHBondContact O-N 2.95Å
487	E	82.8	Confident	86.4	Confident	108 Å²	108	99.6 Å²	99.6	51%	0.505	47%	0.473	S	S	.	.	H	α-helix	trans	-62.7	-49.7	177.2	178.4	175.3	-135.2	0	0	111.3	Y483 I485 D489 L490 L491	Y483-E487 WeakPolarHBondContact O-CB 3.4Å; Y483-E487 PolarHBondContact O-N 3.34Å; I485-E487 PolarHBondContact O-N 3.32Å; E487-D489 VanDerWaalsContact C-N 3.28Å; E487-D489 PolarHBondContact O-N 3.44Å; E487-L490 WeakPolarHBondContact O-CB 3.49Å; E487-L490 PolarHBondContact O-N 3.3Å; E487-L491 HydrophobicContact CG-CD1 4.32Å; E487-L491 WeakPolarHBondContact O-CG 3.46Å; E487-L491 PolarHBondContact O-N 2.86Å
488	K	87.1	Confident	86.2	Confident	140 Å²	140	98.6 Å²	98.6	61%	0.609	47%	0.472	S	S	*	.	H	α-helix	trans	-58.4	-40.4	173.4	-177.7	169	-177.4	167.7	0	112.2	Q484 I485 L490 N492	Q484-K488 WeakPolarHBondContact O-CB 3.48Å; Q484-K488 PolarHBondContact O-N 3.1Å; Q484-K488 VanDerWaalsContact O-N 3.1Å; I485-K488 PolarHBondContact O-N 3.49Å; K488-L490 VanDerWaalsContact C-N 3.31Å; K488-L490 PolarHBondContact O-N 3.28Å; K488-N492 WeakPolarHBondContact O-CB 3.38Å; K488-N492 PolarHBondContact O-N 2.86Å; K488-N492 PolarHBondContact O-ND2 3.34Å
489	D	85	Confident	86.1	Confident	74 Å²	74	99.3 Å²	99.3	40%	0.396	47%	0.474	S	S	.	.	H	α-helix	trans	-65.4	-31.5	176.1	-116.7	35.5	0	0	0	113.1	I485 R486 E487 R493	I485-D489 WeakPolarHBondContact O-CB 3.37Å; I485-D489 PolarHBondContact O-N 3.01Å; R486-D489 WeakPolarHBondContact O-CB 3.34Å; R486-D489 PolarHBondContact O-N 3.07Å; E487-D489 VanDerWaalsContact C-N 3.28Å; E487-D489 PolarHBondContact O-N 3.44Å; D489-R493 WeakPolarHBondContact O-CG 3.49Å; D489-R493 PolarHBondContact O-NH1 2.98Å; D489-R493 VanDerWaalsContact O-NH1 3.17Å; D489-R493 IonicContact OD2-CZ 3.05Å; D489-R493 IonicContact OD2-NH1 3.06Å; D489-R493 IonicContact OD2-NH2 2.68Å; D489-R493 PolarHBondContact OD2-NH2 3.49Å
490	L	84.4	Confident	86	Confident	91 Å²	91	100.7 Å²	100.7	48%	0.476	48%	0.479	S	S	.	.	H	α-helix	trans	-71.8	-52.5	174.7	-173.3	68.8	0	0	0	110.8	R486 E487 K488 N492 R493 E494	R486-L490 PolarHBondContact O-N 2.95Å; E487-L490 WeakPolarHBondContact O-CB 3.49Å; E487-L490 PolarHBondContact O-N 3.3Å; K488-L490 VanDerWaalsContact C-N 3.31Å; K488-L490 PolarHBondContact O-N 3.28Å; L490-N492 VanDerWaalsContact C-N 3.28Å; L490-N492 PolarHBondContact O-N 3.21Å; L490-R493 WeakPolarHBondContact O-CA 3.34Å; L490-R493 WeakPolarHBondContact O-CB 3.4Å; L490-R493 PolarHBondContact O-N 2.72Å; L490-E494 PolarHBondContact O-N 2.96Å
491	L	83.7	Confident	85.8	Confident	102 Å²	102	100.6 Å²	100.6	53%	0.534	48%	0.478	S	S	.	.	H	α-helix	trans	-56	-41.6	178.3	-68	169.5	0	0	0	112	E487 R493 E494 E495	E487-L491 HydrophobicContact CG-CD1 4.32Å; E487-L491 WeakPolarHBondContact O-CG 3.46Å; E487-L491 PolarHBondContact O-N 2.86Å; L491-R493 VanDerWaalsContact C-N 3.27Å; L491-R493 PolarHBondContact O-N 2.99Å; L491-E494 PolarHBondContact O-N 2.94Å; L491-E495 PolarHBondContact O-N 3.46Å
492	N	86.3	Confident	85.7	Confident	75 Å²	75	103.3 Å²	103.3	40%	0.401	49%	0.487	S	S	.	.	H	α-helix	trans	-60.6	-32.7	175	-72.9	-33.2	0	0	0	113.2	K488 L490 S496	K488-N492 WeakPolarHBondContact O-CB 3.38Å; K488-N492 PolarHBondContact O-N 2.86Å; K488-N492 PolarHBondContact O-ND2 3.34Å; L490-N492 VanDerWaalsContact C-N 3.28Å; L490-N492 PolarHBondContact O-N 3.21Å; N492-S496 WeakPolarHBondContact O-CB 3.45Å; N492-S496 PolarHBondContact O-N 2.69Å; N492-S496 PolarHBondContact O-OG 2.86Å
493	R	82.6	Confident	85.8	Confident	126 Å²	126	104.2 Å²	104.2	48%	0.475	49%	0.488	S	S	.	.	H	α-helix	trans	-75.7	-43.8	176.2	-68.5	169.8	-168.4	111	16.9	110.9	D489 L490 L491 S496 H497	D489-R493 WeakPolarHBondContact O-CG 3.49Å; D489-R493 PolarHBondContact O-NH1 2.98Å; D489-R493 VanDerWaalsContact O-NH1 3.17Å; D489-R493 IonicContact OD2-CZ 3.05Å; D489-R493 IonicContact OD2-NH1 3.06Å; D489-R493 IonicContact OD2-NH2 2.68Å; D489-R493 PolarHBondContact OD2-NH2 3.49Å; L490-R493 WeakPolarHBondContact O-CA 3.34Å; L490-R493 WeakPolarHBondContact O-CB 3.4Å; L490-R493 PolarHBondContact O-N 2.72Å; L491-R493 VanDerWaalsContact C-N 3.27Å; L491-R493 PolarHBondContact O-N 2.99Å; R493-S496 WeakPolarHBondContact O-CB 3.44Å; R493-S496 PolarHBondContact O-N 3.29Å; R493-H497 PolarHBondContact O-CD2 3.32Å; R493-H497 PolarHBondContact O-N 2.93Å
494	E	81.1	Confident	85.8	Confident	95 Å²	95	102.5 Å²	102.5	44%	0.444	48%	0.483	S	S	.	.	H	α-helix	trans	-62.5	-45.8	178.2	-68.5	178.1	170.2	0	0	111.5	L490 L491 S496 H497 L498	L490-E494 PolarHBondContact O-N 2.96Å; L491-E494 PolarHBondContact O-N 2.94Å; E494-S496 VanDerWaalsContact C-N 3.3Å; E494-S496 PolarHBondContact O-N 3.32Å; E494-H497 PolarHBondContact O-N 3.24Å; E494-L498 WeakPolarHBondContact O-CB 3.49Å; E494-L498 VanDerWaalsContact O-CG 3.3Å; E494-L498 WeakPolarHBondContact O-CG 3.41Å; E494-L498 PolarHBondContact O-N 2.99Å
495	E	84.9	Confident	85.8	Confident	127 Å²	127	101.7 Å²	101.7	59%	0.593	48%	0.482	S	S	*	.	H	α-helix	trans	-60	-40.8	174.3	-166.7	-167.9	175.7	0	0	111.7	L491 L498 K499	L491-E495 PolarHBondContact O-N 3.46Å; E495-L498 PolarHBondContact O-N 3.05Å; E495-K499 WeakPolarHBondContact O-CB 3.37Å; E495-K499 PolarHBondContact O-N 2.96Å
496	S	86.2	Confident	85.9	Confident	76 Å²	76	101.2 Å²	101.2	53%	0.531	48%	0.478	S	S	.	.	H	α-helix	trans	-62.6	-44.3	176.9	-63.8	0	0	0	0	112.3	N492 R493 E494 K499 E500	N492-S496 WeakPolarHBondContact O-CB 3.45Å; N492-S496 PolarHBondContact O-N 2.69Å; N492-S496 PolarHBondContact O-OG 2.86Å; R493-S496 WeakPolarHBondContact O-CB 3.44Å; R493-S496 PolarHBondContact O-N 3.29Å; E494-S496 VanDerWaalsContact C-N 3.3Å; E494-S496 PolarHBondContact O-N 3.32Å; S496-K499 PolarHBondContact O-N 3.17Å; S496-E500 PolarHBondContact O-N 3.42Å
497	H	85.2	Confident	86	Confident	95 Å²	95	102.1 Å²	102.1	44%	0.44	49%	0.486	S	S	.	.	H	α-helix	trans	-69.4	-40.9	177	-73.5	-55.3	0	0	0	112.5	R493 E494 K499 E500 L501	R493-H497 PolarHBondContact O-CD2 3.32Å; R493-H497 PolarHBondContact O-N 2.93Å; E494-H497 PolarHBondContact O-N 3.24Å; H497-K499 PolarHBondContact O-N 2.92Å; H497-E500 IonicContact ND1-OE2 3.58Å; H497-E500 PolarHBondContact O-N 2.93Å; H497-L501 WeakPolarHBondContact O-CG 3.42Å; H497-L501 PolarHBondContact O-N 3.04Å
498	L	84.9	Confident	86.3	Confident	94 Å²	94	103.6 Å²	103.6	49%	0.492	49%	0.488	S	S	.	.	H	α-helix	trans	-62.1	-32.9	173.6	-72.2	171.3	0	0	0	112	E494 E495 L501 R502	E494-L498 WeakPolarHBondContact O-CB 3.49Å; E494-L498 VanDerWaalsContact O-CG 3.3Å; E494-L498 WeakPolarHBondContact O-CG 3.41Å; E494-L498 PolarHBondContact O-N 2.99Å; E495-L498 PolarHBondContact O-N 3.05Å; L498-L501 HydrophobicContact CD2-CD1 4.47Å; L498-R502 WeakPolarHBondContact O-CG 3.47Å; L498-R502 PolarHBondContact O-N 3.26Å; L498-R502 VanDerWaalsContact O-N 3.15Å; L498-R502 PolarHBondContact O-NE 3.29Å
499	K	88.9	Confident	86.3	Confident	116 Å²	116	100.7 Å²	100.7	50%	0.504	48%	0.479	S	S	.	.	H	α-helix	trans	-68.7	-45	172.2	-173.2	179.1	173.6	-177.7	0	112.1	E495 S496 H497 L501 R502 E503	E495-K499 WeakPolarHBondContact O-CB 3.37Å; E495-K499 PolarHBondContact O-N 2.96Å; S496-K499 PolarHBondContact O-N 3.17Å; H497-K499 PolarHBondContact O-N 2.92Å; K499-L501 VanDerWaalsContact C-N 3.3Å; K499-L501 PolarHBondContact O-N 2.86Å; K499-R502 PolarHBondContact O-N 3.37Å; K499-E503 WeakPolarHBondContact CE-OE1 3.4Å; K499-E503 IonicContact NZ-OE1 3.43Å; K499-E503 WeakPolarHBondContact O-CG 3.41Å; K499-E503 PolarHBondContact O-N 2.91Å
500	E	87.5	Confident	86.6	Confident	90 Å²	90	100.9 Å²	100.9	42%	0.421	48%	0.483	S	S	.	.	H	α-helix	trans	-62.1	-37	177.3	-163.2	-166.6	155.2	0	0	112.3	S496 H497 K504	S496-E500 PolarHBondContact O-N 3.42Å; H497-E500 IonicContact ND1-OE2 3.58Å; H497-E500 PolarHBondContact O-N 2.93Å; E500-K504 WeakPolarHBondContact O-CG 3.38Å; E500-K504 PolarHBondContact O-N 3.14Å; E500-K504 VanDerWaalsContact O-N 3.14Å; E500-K504 WeakPolarHBondContact OE1-CE 3.34Å; E500-K504 IonicContact OE1-NZ 3.09Å; E500-K504 PolarHBondContact OE1-NZ 3.19Å
501	L	85.2	Confident	86.8	Confident	95 Å²	95	100.7 Å²	100.7	50%	0.497	48%	0.482	S	S	.	.	H	α-helix	trans	-61.3	-54.1	172.2	-78.4	159.6	0	0	0	111.2	H497 L498 K499 E503 K504 D505	H497-L501 WeakPolarHBondContact O-CG 3.42Å; H497-L501 PolarHBondContact O-N 3.04Å; L498-L501 HydrophobicContact CD2-CD1 4.47Å; K499-L501 VanDerWaalsContact C-N 3.3Å; K499-L501 PolarHBondContact O-N 2.86Å; L501-E503 VanDerWaalsContact C-N 3.27Å; L501-E503 PolarHBondContact O-N 3.46Å; L501-K504 WeakPolarHBondContact O-CA 3.42Å; L501-K504 WeakPolarHBondContact O-CB 3.3Å; L501-K504 PolarHBondContact O-N 3.36Å; L501-D505 PolarHBondContact O-N 3.49Å
502	R	86.8	Confident	87	Confident	140 Å²	140	99.8 Å²	99.8	53%	0.528	48%	0.477	S	S	.	.	H	α-helix	trans	-56.4	-38.6	177.1	-71.5	-177.8	-63.1	-106.5	4.5	113.1	L498 K499 K504 D505 E506	L498-R502 WeakPolarHBondContact O-CG 3.47Å; L498-R502 PolarHBondContact O-N 3.26Å; L498-R502 VanDerWaalsContact O-N 3.15Å; L498-R502 PolarHBondContact O-NE 3.29Å; K499-R502 PolarHBondContact O-N 3.37Å; R502-K504 VanDerWaalsContact C-N 3.33Å; R502-D505 PolarHBondContact O-N 2.89Å; R502-E506 PolarHBondContact O-N 3.37Å
503	E	89.8	Confident	87.1	Confident	105 Å²	105	102.3 Å²	102.3	49%	0.491	48%	0.481	S	S	.	.	H	α-helix	trans	-68.8	-28.8	177.1	-74.9	-179.9	-164.9	0	0	112.9	K499 L501 Q507	K499-E503 WeakPolarHBondContact CE-OE1 3.4Å; K499-E503 IonicContact NZ-OE1 3.43Å; K499-E503 WeakPolarHBondContact O-CG 3.41Å; K499-E503 PolarHBondContact O-N 2.91Å; L501-E503 VanDerWaalsContact C-N 3.27Å; L501-E503 PolarHBondContact O-N 3.46Å; E503-Q507 WeakPolarHBondContact O-CG 3.37Å; E503-Q507 PolarHBondContact O-NE2 3.15Å
504	K	85.7	Confident	87.4	Confident	85 Å²	85	100.5 Å²	100.5	37%	0.37	48%	0.478	S	S	.	.	H	α-helix	trans	-78.6	-40.7	172.8	-74.5	165.3	176.1	166.6	0	112.2	E500 L501 R502 E506 Q507 Y508	E500-K504 WeakPolarHBondContact O-CG 3.38Å; E500-K504 PolarHBondContact O-N 3.14Å; E500-K504 VanDerWaalsContact O-N 3.14Å; E500-K504 WeakPolarHBondContact OE1-CE 3.34Å; E500-K504 IonicContact OE1-NZ 3.09Å; E500-K504 PolarHBondContact OE1-NZ 3.19Å; L501-K504 WeakPolarHBondContact O-CA 3.42Å; L501-K504 WeakPolarHBondContact O-CB 3.3Å; L501-K504 PolarHBondContact O-N 3.36Å; R502-K504 VanDerWaalsContact C-N 3.33Å; K504-E506 VanDerWaalsContact C-N 3.34Å; K504-E506 PolarHBondContact O-N 2.89Å; K504-Q507 WeakPolarHBondContact O-CB 3.38Å; K504-Q507 PolarHBondContact O-N 2.72Å; K504-Q507 VanDerWaalsContact O-N 3.09Å; K504-Y508 HydrophobicContact CB-CD2 4.46Å; K504-Y508 HydrophobicContact CB-CE2 4.18Å; K504-Y508 WeakPolarHBondContact O-CD2 3.17Å; K504-Y508 PolarHBondContact O-N 3.24Å
505	D	88.9	Confident	87.8	Confident	83 Å²	83	100.1 Å²	100.1	44%	0.444	48%	0.478	S	S	.	.	H	α-helix	trans	-60.7	-42.4	179.2	-67.6	-26	0	0	0	111.5	L501 R502 Q507 Y508 N509	L501-D505 PolarHBondContact O-N 3.49Å; R502-D505 PolarHBondContact O-N 2.89Å; D505-Q507 VanDerWaalsContact C-N 3.34Å; D505-Q507 PolarHBondContact O-N 3.29Å; D505-Y508 PolarHBondContact O-N 2.98Å; D505-N509 WeakPolarHBondContact O-CB 3.46Å; D505-N509 PolarHBondContact O-N 3.48Å; D505-N509 PolarHBondContact O-ND2 2.83Å
506	E	91.4	Very high	88	Confident	97 Å²	97	99.5 Å²	99.5	45%	0.453	48%	0.475	S	S	.	.	H	α-helix	trans	-65.1	-36.6	174.3	-175.1	55	-151.4	0	0	112.3	R502 K504 N509 V510 R513	R502-E506 PolarHBondContact O-N 3.37Å; K504-E506 VanDerWaalsContact C-N 3.34Å; K504-E506 PolarHBondContact O-N 2.89Å; E506-N509 PolarHBondContact O-N 3.31Å; E506-V510 WeakPolarHBondContact O-CG2 3.35Å; E506-V510 PolarHBondContact O-N 3.2Å; E506-R513 IonicContact OE1-CZ 3.78Å; E506-R513 IonicContact OE1-NH2 3.53Å; E506-R513 PolarHBondContact OE1-NH2 3.18Å
507	Q	88.8	Confident	88.2	Confident	130 Å²	130	101.8 Å²	101.8	61%	0.607	48%	0.478	S	S	*	.	H	α-helix	trans	-62.8	-42.5	174.4	-72.5	170.3	64.9	0	0	111.8	E503 K504 D505 V510 L511	E503-Q507 WeakPolarHBondContact O-CG 3.37Å; E503-Q507 PolarHBondContact O-NE2 3.15Å; K504-Q507 WeakPolarHBondContact O-CB 3.38Å; K504-Q507 PolarHBondContact O-N 2.72Å; K504-Q507 VanDerWaalsContact O-N 3.09Å; D505-Q507 VanDerWaalsContact C-N 3.34Å; D505-Q507 PolarHBondContact O-N 3.29Å; Q507-V510 PolarHBondContact O-N 3.44Å; Q507-L511 PolarHBondContact O-N 3.4Å
508	Y	87.9	Confident	88.1	Confident	140 Å²	140	100 Å²	100	55%	0.549	47%	0.468	S	S	.	.	H	α-helix	trans	-66.8	-41.3	174	-67.8	-54.8	0	0	0	111.8	K504 D505 V510 L511 I512	K504-Y508 HydrophobicContact CB-CD2 4.46Å; K504-Y508 HydrophobicContact CB-CE2 4.18Å; K504-Y508 WeakPolarHBondContact O-CD2 3.17Å; K504-Y508 PolarHBondContact O-N 3.24Å; D505-Y508 PolarHBondContact O-N 2.98Å; Y508-V510 VanDerWaalsContact C-N 3.33Å; Y508-V510 PolarHBondContact O-N 2.96Å; Y508-L511 PolarHBondContact O-N 2.86Å; Y508-L511 VanDerWaalsContact O-N 3.11Å; Y508-I512 WeakPolarHBondContact O-CB 3.49Å; Y508-I512 VanDerWaalsContact O-CG1 3.27Å; Y508-I512 WeakPolarHBondContact O-CG1 3.27Å; Y508-I512 PolarHBondContact O-N 3.13Å
509	N	87.5	Confident	88.3	Confident	78 Å²	78	99.1 Å²	99.1	42%	0.417	47%	0.467	S	S	.	.	H	α-helix	trans	-62.8	-35.9	176.1	-70.3	-27.4	0	0	0	112.5	D505 E506 R513	D505-N509 WeakPolarHBondContact O-CB 3.46Å; D505-N509 PolarHBondContact O-N 3.48Å; D505-N509 PolarHBondContact O-ND2 2.83Å; E506-N509 PolarHBondContact O-N 3.31Å; N509-R513 WeakPolarHBondContact O-CG 3.48Å; N509-R513 PolarHBondContact O-N 2.96Å; N509-R513 PolarHBondContact O-NE 3.48Å
510	V	91.5	Very high	88.3	Confident	78 Å²	78	98.6 Å²	98.6	47%	0.473	47%	0.473	S	S	.	.	H	α-helix	trans	-66.7	-43.3	171.2	171.3	0	0	0	0	111.1	E506 Q507 Y508 R513 H514	E506-V510 WeakPolarHBondContact O-CG2 3.35Å; E506-V510 PolarHBondContact O-N 3.2Å; Q507-V510 PolarHBondContact O-N 3.44Å; Y508-V510 VanDerWaalsContact C-N 3.33Å; Y508-V510 PolarHBondContact O-N 2.96Å; V510-R513 VanDerWaalsContact CG2-NH2 3.29Å; V510-H514 PolarHBondContact O-N 3.39Å
511	L	89.2	Confident	88.2	Confident	87 Å²	87	99.1 Å²	99.1	46%	0.455	48%	0.476	S	S	.	.	H	α-helix	trans	-65.7	-42.9	179.7	-179.9	59.5	0	0	0	112.4	Q507 Y508 H514 L515	Q507-L511 PolarHBondContact O-N 3.4Å; Y508-L511 PolarHBondContact O-N 2.86Å; Y508-L511 VanDerWaalsContact O-N 3.11Å; L511-H514 PolarHBondContact O-N 3.31Å; L511-L515 HydrophobicContact CD1-CD1 4.27Å; L511-L515 HydrophobicContact CD1-CG 4.3Å; L511-L515 HydrophobicContact CG-CD1 4.08Å; L511-L515 WeakPolarHBondContact O-CG 3.4Å; L511-L515 PolarHBondContact O-N 2.98Å
512	I	87.9	Confident	88	Confident	83 Å²	83	99 Å²	99	43%	0.426	48%	0.475	S	S	.	.	H	α-helix	trans	-58.9	-52.5	177.5	-70.7	163.7	0	0	0	109.9	Y508 H514 L515 E516	Y508-I512 WeakPolarHBondContact O-CB 3.49Å; Y508-I512 VanDerWaalsContact O-CG1 3.27Å; Y508-I512 WeakPolarHBondContact O-CG1 3.27Å; Y508-I512 PolarHBondContact O-N 3.13Å; I512-H514 PolarHBondContact O-N 3.34Å; I512-L515 PolarHBondContact O-N 2.59Å; I512-E516 HydrophobicContact CG2-CG 4.22Å; I512-E516 WeakPolarHBondContact O-CG 3.44Å; I512-E516 PolarHBondContact O-N 3.28Å
513	R	88	Confident	88	Confident	128 Å²	128	98.3 Å²	98.3	48%	0.483	48%	0.476	S	S	.	.	H	α-helix	trans	-52.9	-39.5	176	-76.2	175.9	-76.5	-179.1	-7.5	112.9	E506 N509 V510 E516 Q517	E506-R513 IonicContact OE1-CZ 3.78Å; E506-R513 IonicContact OE1-NH2 3.53Å; E506-R513 PolarHBondContact OE1-NH2 3.18Å; N509-R513 WeakPolarHBondContact O-CG 3.48Å; N509-R513 PolarHBondContact O-N 2.96Å; N509-R513 PolarHBondContact O-NE 3.48Å; V510-R513 VanDerWaalsContact CG2-NH2 3.29Å; R513-E516 WeakPolarHBondContact CA-OE2 3.48Å; R513-Q517 PolarHBondContact O-N 2.92Å; R513-Q517 VanDerWaalsContact O-N 3.16Å
514	H	88.7	Confident	87.9	Confident	89 Å²	89	98.9 Å²	98.9	41%	0.412	47%	0.474	S	S	.	.	H	α-helix	trans	-71.2	-34.5	177.2	-179.6	60.8	0	0	0	113.3	V510 L511 I512 K518	V510-H514 PolarHBondContact O-N 3.39Å; L511-H514 PolarHBondContact O-N 3.31Å; I512-H514 PolarHBondContact O-N 3.34Å; H514-K518 PolarHBondContact O-N 3.42Å
515	L	88.3	Confident	87.7	Confident	87 Å²	87	97 Å²	97	46%	0.455	47%	0.471	S	S	.	.	H	α-helix	trans	-73.3	-40.1	175.7	-68.7	172.1	0	0	0	111.8	L511 I512 Q517 K518 V519	L511-L515 HydrophobicContact CD1-CD1 4.27Å; L511-L515 HydrophobicContact CD1-CG 4.3Å; L511-L515 HydrophobicContact CG-CD1 4.08Å; L511-L515 WeakPolarHBondContact O-CG 3.4Å; L511-L515 PolarHBondContact O-N 2.98Å; I512-L515 PolarHBondContact O-N 2.59Å; L515-Q517 PolarHBondContact O-N 2.8Å; L515-K518 WeakPolarHBondContact O-CB 3.39Å; L515-K518 PolarHBondContact O-N 2.97Å; L515-V519 WeakPolarHBondContact O-CG2 3.49Å; L515-V519 PolarHBondContact O-N 2.98Å
516	E	90.2	Very high	87.4	Confident	114 Å²	114	99.8 Å²	99.8	53%	0.533	48%	0.479	S	S	.	.	H	α-helix	trans	-57.9	-47	173.3	-69.9	173.7	141.6	0	0	111.3	I512 R513 K518 V519 V520	I512-E516 HydrophobicContact CG2-CG 4.22Å; I512-E516 WeakPolarHBondContact O-CG 3.44Å; I512-E516 PolarHBondContact O-N 3.28Å; R513-E516 WeakPolarHBondContact CA-OE2 3.48Å; E516-K518 VanDerWaalsContact C-N 3.31Å; E516-K518 PolarHBondContact O-N 3.22Å; E516-V519 PolarHBondContact O-N 2.96Å; E516-V519 VanDerWaalsContact O-N 3.11Å; E516-V520 PolarHBondContact O-N 2.82Å
517	Q	89.6	Confident	87.2	Confident	124 Å²	124	101.3 Å²	101.3	58%	0.579	49%	0.487	S	S	*	.	H	α-helix	trans	-57.6	-42.3	175.8	-172.4	179.6	5.9	0	0	112.2	R513 L515 V520 E521	R513-Q517 PolarHBondContact O-N 2.92Å; R513-Q517 VanDerWaalsContact O-N 3.16Å; L515-Q517 PolarHBondContact O-N 2.8Å; Q517-V520 PolarHBondContact O-N 3.22Å; Q517-E521 PolarHBondContact O-N 3.09Å
518	K	84.5	Confident	87	Confident	56 Å²	56	99.4 Å²	99.4	24%	0.243	48%	0.477	C	S	.	.	H	α-helix	trans	-65.2	-37	175	-80.5	172.6	163.8	166.9	0	113.1	H514 L515 E516 V520 E521 N522 F593	H514-K518 PolarHBondContact O-N 3.42Å; L515-K518 WeakPolarHBondContact O-CB 3.39Å; L515-K518 PolarHBondContact O-N 2.97Å; E516-K518 VanDerWaalsContact C-N 3.31Å; E516-K518 PolarHBondContact O-N 3.22Å; K518-V520 VanDerWaalsContact C-N 3.35Å; K518-E521 PolarHBondContact O-N 3.5Å; K518-N522 WeakPolarHBondContact O-CB 3.39Å; K518-N522 VanDerWaalsContact O-CG 3.27Å; K518-N522 PolarHBondContact O-N 3.11Å; K518-N522 PolarHBondContact O-ND2 3.39Å; K518-F593 VanDerWaalsContact CE-CE2 3.47Å
519	V	87.4	Confident	86.6	Confident	77 Å²	77	93.4 Å²	93.4	47%	0.467	46%	0.457	S	S	.	.	H	α-helix	trans	-66.1	-39.1	176.3	170.5	0	0	0	0	110.9	L515 E516 K523	L515-V519 WeakPolarHBondContact O-CG2 3.49Å; L515-V519 PolarHBondContact O-N 2.98Å; E516-V519 PolarHBondContact O-N 2.96Å; E516-V519 VanDerWaalsContact O-N 3.11Å; V519-K523 HydrophobicContact CG1-CD 4.35Å; V519-K523 WeakPolarHBondContact O-CB 3.45Å; V519-K523 VanDerWaalsContact O-CG 3.29Å; V519-K523 WeakPolarHBondContact O-CG 3.48Å; V519-K523 PolarHBondContact O-N 3.47Å; V519-K523 VanDerWaalsContact O-N 3.13Å
520	V	90.3	Very high	86.5	Confident	105 Å²	105	98.6 Å²	98.6	64%	0.636	47%	0.471	S	S	*	.	H	α-helix	trans	-64.9	-46	173.6	174.9	0	0	0	0	111.3	E516 Q517 K518 K523 R524	E516-V520 PolarHBondContact O-N 2.82Å; Q517-V520 PolarHBondContact O-N 3.22Å; K518-V520 VanDerWaalsContact C-N 3.35Å; V520-K523 PolarHBondContact O-N 2.89Å; V520-R524 PolarHBondContact O-N 3.42Å
521	E	83.8	Confident	86.3	Confident	100 Å²	100	100.5 Å²	100.5	47%	0.467	47%	0.474	S	S	.	.	H	α-helix	trans	-63.4	-45.4	178.9	179.1	155.9	-125.1	0	0	112.7	Q517 K518 K523 R524 C525	Q517-E521 PolarHBondContact O-N 3.09Å; K518-E521 PolarHBondContact O-N 3.5Å; E521-K523 PolarHBondContact O-N 3.45Å; E521-R524 PolarHBondContact O-N 3.13Å; E521-R524 IonicContact OE1-NH2 3.12Å; E521-R524 PolarHBondContact OE1-NH2 3.25Å; E521-R524 VanDerWaalsContact OE1-NH2 3.09Å; E521-C525 PolarHBondContact O-N 3.01Å; E521-C525 VanDerWaalsContact O-N 3.17Å
522	N	80.9	Confident	86	Confident	92 Å²	92	97.3 Å²	97.3	49%	0.492	46%	0.458	S	S	.	.	H	α-helix	trans	-62.2	-40.9	177.7	-75.7	-15.7	0	0	0	112.3	K518 C525 F526	K518-N522 WeakPolarHBondContact O-CB 3.39Å; K518-N522 VanDerWaalsContact O-CG 3.27Å; K518-N522 PolarHBondContact O-N 3.11Å; K518-N522 PolarHBondContact O-ND2 3.39Å; N522-C525 PolarHBondContact O-N 3.05Å; N522-F526 WeakPolarHBondContact O-CD2 3.48Å; N522-F526 PolarHBondContact O-N 3.21Å
523	K	87.8	Confident	85.8	Confident	127 Å²	127	96.6 Å²	96.6	55%	0.552	46%	0.455	S	S	*	.	H	α-helix	trans	-57.9	-49.6	177.1	-80.2	174.9	177.4	-176.6	0	111.7	V519 V520 E521 C525 F526 E527	V519-K523 HydrophobicContact CG1-CD 4.35Å; V519-K523 WeakPolarHBondContact O-CB 3.45Å; V519-K523 VanDerWaalsContact O-CG 3.29Å; V519-K523 WeakPolarHBondContact O-CG 3.48Å; V519-K523 PolarHBondContact O-N 3.47Å; V519-K523 VanDerWaalsContact O-N 3.13Å; V520-K523 PolarHBondContact O-N 2.89Å; E521-K523 PolarHBondContact O-N 3.45Å; K523-C525 VanDerWaalsContact C-N 3.31Å; K523-C525 PolarHBondContact O-N 2.9Å; K523-F526 PolarHBondContact O-N 3.37Å; K523-F526 VanDerWaalsContact O-N 3.09Å; K523-E527 WeakPolarHBondContact O-CG 3.39Å; K523-E527 PolarHBondContact O-N 3.11Å
524	R	87.8	Confident	85.6	Confident	117 Å²	117	95.4 Å²	95.4	44%	0.442	46%	0.455	S	S	.	.	H	α-helix	trans	-53.7	-47.3	175.1	173.8	-176.9	64.2	121.4	-9.2	111.6	V520 E521 F526 E527 E528	V520-R524 PolarHBondContact O-N 3.42Å; E521-R524 PolarHBondContact O-N 3.13Å; E521-R524 IonicContact OE1-NH2 3.12Å; E521-R524 PolarHBondContact OE1-NH2 3.25Å; E521-R524 VanDerWaalsContact OE1-NH2 3.09Å; R524-F526 VanDerWaalsContact C-N 3.33Å; R524-F526 PolarHBondContact O-N 3.02Å; R524-E527 PolarHBondContact O-N 2.96Å; R524-E527 VanDerWaalsContact O-N 3.15Å; R524-E528 HydrophobicContact CG-CG 4.38Å; R524-E528 WeakPolarHBondContact CG-OE1 3.45Å; R524-E528 IonicContact NH1-OE1 2.73Å; R524-E528 PolarHBondContact NH1-OE1 3.29Å; R524-E528 WeakPolarHBondContact O-CG 3.35Å; R524-E528 PolarHBondContact O-N 3.42Å
525	C	81.7	Confident	85.6	Confident	44 Å²	44	95.2 Å²	95.2	30%	0.297	46%	0.456	S	S	.	.	H	α-helix	trans	-68.5	-28.2	-179.7	-67	0	0	0	0	113.5	E521 N522 K523 A529	E521-C525 PolarHBondContact O-N 3.01Å; E521-C525 VanDerWaalsContact O-N 3.17Å; N522-C525 PolarHBondContact O-N 3.05Å; K523-C525 VanDerWaalsContact C-N 3.31Å; K523-C525 PolarHBondContact O-N 2.9Å; C525-A529 VanDerWaalsContact O-CB 3.29Å; C525-A529 WeakPolarHBondContact O-CB 3.45Å; C525-A529 PolarHBondContact O-N 2.98Å
526	F	82.7	Confident	85.2	Confident	142 Å²	142	93 Å²	93	62%	0.623	44%	0.444	S	S	*	.	H	α-helix	trans	-70.6	-34.5	169.5	-79.2	-64.3	0	0	0	112.8	N522 K523 R524 A529 R530	N522-F526 WeakPolarHBondContact O-CD2 3.48Å; N522-F526 PolarHBondContact O-N 3.21Å; K523-F526 PolarHBondContact O-N 3.37Å; K523-F526 VanDerWaalsContact O-N 3.09Å; R524-F526 VanDerWaalsContact C-N 3.33Å; R524-F526 PolarHBondContact O-N 3.02Å; F526-A529 PolarHBondContact O-N 3.48Å; F526-R530 WeakPolarHBondContact O-CB 3.5Å; F526-R530 PolarHBondContact O-N 3.32Å
527	E	86	Confident	85	Confident	130 Å²	130	93.1 Å²	93.1	61%	0.607	44%	0.444	S	S	*	.	H	α-helix	trans	-71.9	-42.5	176.5	-71.3	154.2	178.1	0	0	111.3	K523 R524 A529 R530 H531	K523-E527 WeakPolarHBondContact O-CG 3.39Å; K523-E527 PolarHBondContact O-N 3.11Å; R524-E527 PolarHBondContact O-N 2.96Å; R524-E527 VanDerWaalsContact O-N 3.15Å; E527-A529 VanDerWaalsContact C-N 3.35Å; E527-A529 PolarHBondContact O-N 3.16Å; E527-R530 PolarHBondContact O-N 2.84Å; E527-H531 PolarHBondContact O-N 3.27Å
528	E	84.5	Confident	84.9	Confident	89 Å²	89	92.2 Å²	92.2	42%	0.416	44%	0.44	S	S	.	.	H	α-helix	trans	-56.3	-46.3	168.4	-70.8	166.2	176.5	0	0	110.9	R524 R530 H531 V532	R524-E528 HydrophobicContact CG-CG 4.38Å; R524-E528 WeakPolarHBondContact CG-OE1 3.45Å; R524-E528 IonicContact NH1-OE1 2.73Å; R524-E528 PolarHBondContact NH1-OE1 3.29Å; R524-E528 WeakPolarHBondContact O-CG 3.35Å; R524-E528 PolarHBondContact O-N 3.42Å; E528-R530 PolarHBondContact O-N 2.75Å; E528-H531 PolarHBondContact O-N 3.36Å; E528-V532 WeakPolarHBondContact O-CG2 3.45Å; E528-V532 PolarHBondContact O-N 3.2Å
529	A	80.4	Confident	84.8	Confident	15 Å²	15	94.1 Å²	94.1	12%	0.124	45%	0.446	C	S	.	.	H	α-helix	trans	-62.6	-41.7	177.1	0	0	0	0	0	113.5	C525 F526 E527 H531 V532 I533 F581	C525-A529 VanDerWaalsContact O-CB 3.29Å; C525-A529 WeakPolarHBondContact O-CB 3.45Å; C525-A529 PolarHBondContact O-N 2.98Å; F526-A529 PolarHBondContact O-N 3.48Å; E527-A529 VanDerWaalsContact C-N 3.35Å; E527-A529 PolarHBondContact O-N 3.16Å; A529-H531 PolarHBondContact O-N 2.86Å; A529-V532 WeakPolarHBondContact O-CB 3.38Å; A529-V532 PolarHBondContact O-N 3.17Å; A529-I533 WeakPolarHBondContact O-CG1 3.34Å; A529-I533 PolarHBondContact O-N 3.3Å; A529-F581 VanDerWaalsContact CA-CZ 3.5Å; A529-F581 HydrophobicContact CB-CE1 3.6Å; A529-F581 HydrophobicContact CB-CZ 3.62Å
530	R	86.2	Confident	84.8	Confident	187 Å²	187	93.8 Å²	93.8	71%	0.706	44%	0.443	S	S	*	.	H	α-helix	trans	-61.3	-43.8	179.8	-179.6	177.3	173.5	170.2	-0.8	111.9	F526 E527 E528 V532 I533 E534	F526-R530 WeakPolarHBondContact O-CB 3.5Å; F526-R530 PolarHBondContact O-N 3.32Å; E527-R530 PolarHBondContact O-N 2.84Å; E528-R530 PolarHBondContact O-N 2.75Å; R530-V532 VanDerWaalsContact C-N 3.28Å; R530-V532 PolarHBondContact O-N 3.33Å; R530-I533 PolarHBondContact O-N 3.37Å; R530-E534 PolarHBondContact O-N 3.12Å
531	H	86.4	Confident	84.7	Confident	118 Å²	118	94.9 Å²	94.9	55%	0.546	44%	0.442	S	S	.	.	H	α-helix	trans	-63	-33.2	179.2	-176.7	-100.3	0	0	0	112.6	E527 E528 A529 L535	E527-H531 PolarHBondContact O-N 3.27Å; E528-H531 PolarHBondContact O-N 3.36Å; A529-H531 PolarHBondContact O-N 2.86Å; H531-L535 WeakPolarHBondContact O-CG 3.39Å; H531-L535 PolarHBondContact O-N 2.96Å
532	V	82.1	Confident	84.8	Confident	20 Å²	20	93 Å²	93	12%	0.121	44%	0.443	C	S	.	.	H	α-helix	trans	-65.7	-45.7	175.6	173.3	0	0	0	0	111.4	E528 A529 R530 E534 L535 E536 W577 Y578	E528-V532 WeakPolarHBondContact O-CG2 3.45Å; E528-V532 PolarHBondContact O-N 3.2Å; A529-V532 WeakPolarHBondContact O-CB 3.38Å; A529-V532 PolarHBondContact O-N 3.17Å; R530-V532 VanDerWaalsContact C-N 3.28Å; R530-V532 PolarHBondContact O-N 3.33Å; V532-E534 PolarHBondContact O-N 3.31Å; V532-L535 PolarHBondContact O-N 3.28Å; V532-L535 VanDerWaalsContact O-N 3.14Å; V532-E536 HydrophobicContact CG1-CG 4.43Å; V532-E536 WeakPolarHBondContact O-CG 3.02Å; V532-E536 PolarHBondContact O-N 3.46Å; V532-W577 HydrophobicContact CB-CZ3 3.93Å; V532-W577 HydrophobicContact CG1-CE3 3.65Å; V532-W577 HydrophobicContact CG1-CH2 4.4Å; V532-W577 HydrophobicContact CG1-CZ3 3.42Å; V532-W577 VanDerWaalsContact CG1-CZ3 3.42Å; V532-W577 HydrophobicContact CG2-CE3 4.24Å; V532-W577 HydrophobicContact CG2-CH2 3.43Å; V532-W577 VanDerWaalsContact CG2-CH2 3.43Å; V532-W577 HydrophobicContact CG2-CZ3 3.26Å; V532-Y578 HydrophobicContact CG1-CD2 4.19Å; V532-Y578 HydrophobicContact CG1-CE2 4.37Å
533	I	83.5	Confident	85.1	Confident	68 Å²	68	94.7 Å²	94.7	35%	0.349	45%	0.446	S	S	.	.	H	α-helix	trans	-60.2	-38.8	-179.2	-63	169.7	0	0	0	110.5	A529 R530 E536 Q537 Y578	A529-I533 WeakPolarHBondContact O-CG1 3.34Å; A529-I533 PolarHBondContact O-N 3.3Å; R530-I533 PolarHBondContact O-N 3.37Å; I533-E536 PolarHBondContact O-N 3.28Å; I533-Q537 WeakPolarHBondContact O-CG 3.35Å; I533-Q537 PolarHBondContact O-N 3.5Å; I533-Q537 VanDerWaalsContact O-N 3.12Å; I533-Y578 HydrophobicContact CG1-CE2 4.06Å
534	E	85.6	Confident	85	Confident	102 Å²	102	94.9 Å²	94.9	48%	0.477	45%	0.449	S	S	.	.	H	α-helix	trans	-65.5	-40.4	176.6	-166.2	167.1	175.1	0	0	112.2	R530 V532 Q537 Q538	R530-E534 PolarHBondContact O-N 3.12Å; V532-E534 PolarHBondContact O-N 3.31Å; E534-Q537 PolarHBondContact O-N 3.47Å; E534-Q538 WeakPolarHBondContact O-CG 3.4Å; E534-Q538 PolarHBondContact O-N 2.98Å
535	L	87	Confident	85	Confident	86 Å²	86	96.8 Å²	96.8	45%	0.45	46%	0.461	S	S	.	.	H	α-helix	trans	-67.6	-34.8	172.9	-69	173.4	0	0	0	113.2	H531 V532 W539	H531-L535 WeakPolarHBondContact O-CG 3.39Å; H531-L535 PolarHBondContact O-N 2.96Å; V532-L535 PolarHBondContact O-N 3.28Å; V532-L535 VanDerWaalsContact O-N 3.14Å; L535-W539 PolarHBondContact O-N 3.48Å; L535-W539 VanDerWaalsContact O-N 3.08Å
536	E	81.1	Confident	85.1	Confident	40 Å²	40	102.6 Å²	102.6	19%	0.187	48%	0.476	C	S	.	.	H	α-helix	trans	-63.9	-43.3	174.6	-65.4	-129.6	148.4	0	0	111.7	V532 I533 W539 V540 A574 Y578	V532-E536 HydrophobicContact CG1-CG 4.43Å; V532-E536 WeakPolarHBondContact O-CG 3.02Å; V532-E536 PolarHBondContact O-N 3.46Å; I533-E536 PolarHBondContact O-N 3.28Å; E536-W539 WeakPolarHBondContact O-CB 3.48Å; E536-W539 PolarHBondContact O-N 2.87Å; E536-V540 WeakPolarHBondContact O-CG2 3.33Å; E536-V540 PolarHBondContact O-N 3.41Å; E536-A574 VanDerWaalsContact CD-CB 3.42Å; E536-A574 HydrophobicContact CG-CB 3.96Å; E536-A574 WeakPolarHBondContact OE1-CA 3.38Å; E536-A574 WeakPolarHBondContact OE1-CB 3.32Å; E536-Y578 HydrophobicContact CG-CD2 4.05Å; E536-Y578 HydrophobicContact CG-CE2 4.19Å; E536-Y578 WeakPolarHBondContact OE1-CB 3.32Å; E536-Y578 VanDerWaalsContact OE1-CD2 3.23Å; E536-Y578 WeakPolarHBondContact OE1-CD2 3.05Å
537	Q	84.7	Confident	85.1	Confident	116 Å²	116	98.7 Å²	98.7	54%	0.542	47%	0.47	S	S	.	.	H	α-helix	trans	-59.5	-49.6	178.2	-71.4	170.9	6.5	0	0	110.9	I533 E534 W539 V540 E541	I533-Q537 WeakPolarHBondContact O-CG 3.35Å; I533-Q537 PolarHBondContact O-N 3.5Å; I533-Q537 VanDerWaalsContact O-N 3.12Å; E534-Q537 PolarHBondContact O-N 3.47Å; Q537-W539 VanDerWaalsContact C-N 3.27Å; Q537-W539 PolarHBondContact O-N 3.15Å; Q537-V540 PolarHBondContact O-N 3.46Å; Q537-V540 VanDerWaalsContact O-N 3.14Å; Q537-E541 WeakPolarHBondContact O-CG 3.5Å; Q537-E541 PolarHBondContact O-N 3.41Å
538	Q	88	Confident	84.9	Confident	106 Å²	106	95.5 Å²	95.5	50%	0.495	46%	0.462	S	S	.	.	H	α-helix	trans	-57.5	-38.2	175.1	-66.6	173.4	25.2	0	0	112.6	E534 A542	E534-Q538 WeakPolarHBondContact O-CG 3.4Å; E534-Q538 PolarHBondContact O-N 2.98Å; Q538-A542 WeakPolarHBondContact O-CB 3.16Å; Q538-A542 PolarHBondContact O-N 3.34Å
539	W	83.8	Confident	84.8	Confident	96 Å²	96	96.1 Å²	96.1	36%	0.364	47%	0.468	S	S	.	.	H	α-helix	trans	-68.4	-39	177.4	-170.3	93	0	0	0	112.8	L535 E536 Q537 K543 C572	L535-W539 PolarHBondContact O-N 3.48Å; L535-W539 VanDerWaalsContact O-N 3.08Å; E536-W539 WeakPolarHBondContact O-CB 3.48Å; E536-W539 PolarHBondContact O-N 2.87Å; Q537-W539 VanDerWaalsContact C-N 3.27Å; Q537-W539 PolarHBondContact O-N 3.15Å; W539-K543 HydrophobicContact CE3-CD 4.41Å; W539-K543 HydrophobicContact CH2-CD 3.64Å; W539-K543 HydrophobicContact CZ3-CB 4.4Å; W539-K543 HydrophobicContact CZ3-CD 3.52Å; W539-K543 WeakPolarHBondContact O-CB 3.46Å; W539-K543 PolarHBondContact O-N 3.17Å; W539-C572 VanDerWaalsContact CE3-SG 3.57Å; W539-C572 HydrophobicContact CH2-CB 3.45Å; W539-C572 VanDerWaalsContact CH2-CB 3.45Å; W539-C572 WeakPolarHBondContact CH2-SG 3.38Å; W539-C572 HydrophobicContact CZ2-CB 4.1Å; W539-C572 HydrophobicContact CZ3-CB 3.8Å; W539-C572 WeakPolarHBondContact CZ3-SG 3.44Å
540	V	85.9	Confident	84.7	Confident	69 Å²	69	100 Å²	100	42%	0.418	49%	0.486	S	S	.	.	H	α-helix	trans	-65.1	-45.8	176.2	171.2	0	0	0	0	110.8	E536 Q537 K543 Q544	E536-V540 WeakPolarHBondContact O-CG2 3.33Å; E536-V540 PolarHBondContact O-N 3.41Å; Q537-V540 PolarHBondContact O-N 3.46Å; Q537-V540 VanDerWaalsContact O-N 3.14Å; V540-K543 PolarHBondContact O-N 3Å; V540-Q544 WeakPolarHBondContact O-CG 3.42Å; V540-Q544 PolarHBondContact O-N 3.26Å
541	E	88.1	Confident	84.3	Confident	129 Å²	129	94 Å²	94	60%	0.603	48%	0.476	S	S	*	.	H	α-helix	trans	-59.4	-48.1	175.1	-70.2	178.1	-177.6	0	0	111.9	Q537 K543 Q544 K545	Q537-E541 WeakPolarHBondContact O-CG 3.5Å; Q537-E541 PolarHBondContact O-N 3.41Å; E541-K543 VanDerWaalsContact C-N 3.28Å; E541-K543 PolarHBondContact O-N 3.09Å; E541-Q544 PolarHBondContact O-N 3.46Å; E541-K545 WeakPolarHBondContact O-CB 3.29Å; E541-K545 PolarHBondContact O-N 3.38Å
542	A	86.5	Confident	83.9	Confident	60 Å²	60	93.4 Å²	93.4	50%	0.496	47%	0.473	S	S	.	.	H	α-helix	trans	-60.2	-37.4	177.4	0	0	0	0	0	112.4	Q538 R546	Q538-A542 WeakPolarHBondContact O-CB 3.16Å; Q538-A542 PolarHBondContact O-N 3.34Å; A542-R546 PolarHBondContact O-N 3.04Å
543	K	86.8	Confident	83.6	Confident	127 Å²	127	95.6 Å²	95.6	55%	0.552	49%	0.493	S	S	*	.	H	α-helix	trans	-68	-42.5	175.5	-178.8	177.9	174.6	-173	0	112.3	W539 V540 E541 R546 A547	W539-K543 HydrophobicContact CE3-CD 4.41Å; W539-K543 HydrophobicContact CH2-CD 3.64Å; W539-K543 HydrophobicContact CZ3-CB 4.4Å; W539-K543 HydrophobicContact CZ3-CD 3.52Å; W539-K543 WeakPolarHBondContact O-CB 3.46Å; W539-K543 PolarHBondContact O-N 3.17Å; V540-K543 PolarHBondContact O-N 3Å; E541-K543 VanDerWaalsContact C-N 3.28Å; E541-K543 PolarHBondContact O-N 3.09Å; K543-R546 PolarHBondContact O-N 3.38Å; K543-A547 PolarHBondContact O-N 3.21Å; K543-A547 VanDerWaalsContact O-N 3.07Å
544	Q	85.7	Confident	82.8	Confident	132 Å²	132	95.9 Å²	95.9	62%	0.617	51%	0.506	S	S	*	.	H	α-helix	trans	-62.1	-46.3	175	-71.8	177	-0.4	0	0	110.9	V540 E541 R546 A547 S548	V540-Q544 WeakPolarHBondContact O-CG 3.42Å; V540-Q544 PolarHBondContact O-N 3.26Å; E541-Q544 PolarHBondContact O-N 3.46Å; Q544-R546 VanDerWaalsContact C-N 3.33Å; Q544-R546 PolarHBondContact O-N 3.13Å; Q544-A547 WeakPolarHBondContact O-CB 3.38Å; Q544-A547 PolarHBondContact O-N 2.91Å; Q544-S548 PolarHBondContact O-N 3.02Å; Q544-S548 VanDerWaalsContact O-N 3.13Å
545	K	87.8	Confident	81.6	Confident	157 Å²	157	97.8 Å²	97.8	68%	0.683	52%	0.52	S	S	*	.	H	α-helix	trans	-58.8	-41.9	177	-168.4	170.6	-174.2	172	0	112.4	E541 A547 S548 L549	E541-K545 WeakPolarHBondContact O-CB 3.29Å; E541-K545 PolarHBondContact O-N 3.38Å; K545-A547 VanDerWaalsContact C-N 3.34Å; K545-A547 PolarHBondContact O-N 2.97Å; K545-S548 PolarHBondContact O-N 3.26Å; K545-L549 WeakPolarHBondContact O-CG 3.36Å; K545-L549 PolarHBondContact O-N 3.23Å
546	R	83.9	Confident	80.4	Confident	166 Å²	166	101.4 Å²	101.4	63%	0.626	53%	0.534	S	S	*	.	H	α-helix	trans	-64.4	-35.6	173.7	-179.3	176.8	174.2	-171.2	-1.7	112.8	A542 K543 Q544 I550	A542-R546 PolarHBondContact O-N 3.04Å; K543-R546 PolarHBondContact O-N 3.38Å; Q544-R546 VanDerWaalsContact C-N 3.33Å; Q544-R546 PolarHBondContact O-N 3.13Å; R546-I550 HydrophobicContact CG-CD1 3.98Å; R546-I550 WeakPolarHBondContact O-CG1 3.44Å; R546-I550 PolarHBondContact O-N 3.14Å
547	A	82.6	Confident	79.2	Confident	59 Å²	59	106 Å²	106	49%	0.488	56%	0.56	S	S	.	*	H	α-helix	trans	-66.9	-40	178.9	0	0	0	0	0	112	K543 Q544 K545 I550 A551	K543-A547 PolarHBondContact O-N 3.21Å; K543-A547 VanDerWaalsContact O-N 3.07Å; Q544-A547 WeakPolarHBondContact O-CB 3.38Å; Q544-A547 PolarHBondContact O-N 2.91Å; K545-A547 VanDerWaalsContact C-N 3.34Å; K545-A547 PolarHBondContact O-N 2.97Å; A547-I550 PolarHBondContact O-N 3.33Å; A547-A551 PolarHBondContact O-N 3Å; A547-A551 VanDerWaalsContact O-N 3.09Å
548	S	82.5	Confident	77.6	Confident	63 Å²	63	105 Å²	105	44%	0.441	58%	0.58	S	S	.	*	H	α-helix	trans	-57.3	-54	174.3	-157.9	0	0	0	0	111.4	Q544 K545 I550 A551 E552	Q544-S548 PolarHBondContact O-N 3.02Å; Q544-S548 VanDerWaalsContact O-N 3.13Å; K545-S548 PolarHBondContact O-N 3.26Å; S548-I550 PolarHBondContact O-N 3.29Å; S548-I550 VanDerWaalsContact O-N 3.14Å; S548-A551 WeakPolarHBondContact O-CA 3.29Å; S548-A551 WeakPolarHBondContact O-CB 3.33Å; S548-A551 PolarHBondContact O-N 3.18Å; S548-E552 WeakPolarHBondContact CB-OE1 3.42Å; S548-E552 WeakPolarHBondContact O-CG 3.44Å; S548-E552 PolarHBondContact O-N 3.08Å; S548-E552 PolarHBondContact OG-OE1 3.45Å
549	L	82.1	Confident	75.8	Confident	102 Å²	102	107.4 Å²	107.4	53%	0.534	59%	0.592	S	S	.	*	H	α-helix	trans	-58.7	-31.1	-179.1	-65.6	169.9	0	0	0	113.6	K545 A553	K545-L549 WeakPolarHBondContact O-CG 3.36Å; K545-L549 PolarHBondContact O-N 3.23Å; L549-A553 WeakPolarHBondContact O-CB 3.48Å; L549-A553 PolarHBondContact O-N 2.97Å
550	I	79.5	Confident	73.6	Confident	98 Å²	98	112.6 Å²	112.6	50%	0.503	62%	0.62	S	S	.	*	H	α-helix	trans	-75.8	-38.6	175.5	-68	169.5	0	0	0	111.2	R546 A547 S548 A554	R546-I550 HydrophobicContact CG-CD1 3.98Å; R546-I550 WeakPolarHBondContact O-CG1 3.44Å; R546-I550 PolarHBondContact O-N 3.14Å; A547-I550 PolarHBondContact O-N 3.33Å; S548-I550 PolarHBondContact O-N 3.29Å; S548-I550 VanDerWaalsContact O-N 3.14Å; I550-A554 WeakPolarHBondContact O-CB 3.38Å; I550-A554 PolarHBondContact O-N 2.93Å
551	A	77.2	Confident	71.8	Confident	61 Å²	61	117.5 Å²	117.5	50%	0.504	64%	0.636	S	S	.	*	H	α-helix	trans	-68.5	-35.2	176.3	0	0	0	0	0	112.2	A547 S548 N555	A547-A551 PolarHBondContact O-N 3Å; A547-A551 VanDerWaalsContact O-N 3.09Å; S548-A551 WeakPolarHBondContact O-CA 3.29Å; S548-A551 WeakPolarHBondContact O-CB 3.33Å; S548-A551 PolarHBondContact O-N 3.18Å; A551-N555 PolarHBondContact O-ND2 3.23Å
552	E	77.7	Confident	69.5	Low	104 Å²	104	120 Å²	120	49%	0.486	65%	0.648	S	S	.	*	H	α-helix	trans	-63	-54.4	172.7	-70.5	153.1	-138.6	0	0	110.8	S548 A554 N555	S548-E552 WeakPolarHBondContact CB-OE1 3.42Å; S548-E552 WeakPolarHBondContact O-CG 3.44Å; S548-E552 PolarHBondContact O-N 3.08Å; S548-E552 PolarHBondContact OG-OE1 3.45Å; E552-A554 VanDerWaalsContact C-N 3.25Å; E552-A554 PolarHBondContact O-N 3.14Å; E552-N555 PolarHBondContact O-N 3.19Å
553	A	75.7	Confident	67.8	Low	66 Å²	66	122.2 Å²	122.2	55%	0.545	66%	0.656	S	S	.	*	H	α-helix	trans	-65.4	-21.1	-177	0	0	0	0	0	114.9	L549 N555	L549-A553 WeakPolarHBondContact O-CB 3.48Å; L549-A553 PolarHBondContact O-N 2.97Å; A553-N555 VanDerWaalsContact C-N 3.29Å; A553-N555 PolarHBondContact O-N 3.33Å
554	A	66	Low	65.8	Low	74 Å²	74	122.8 Å²	122.8	61%	0.612	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.6	-21.6	-179.2	0	0	0	0	0	113.9	I550 E552	I550-A554 WeakPolarHBondContact O-CB 3.38Å; I550-A554 PolarHBondContact O-N 2.93Å; E552-A554 VanDerWaalsContact C-N 3.25Å; E552-A554 PolarHBondContact O-N 3.14Å
555	N	61.4	Low	63.8	Low	143 Å²	143	122.4 Å²	122.4	77%	0.765	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.9	-12.6	-172.1	-68.4	-42.3	0	0	0	114.6	A551 E552 A553	A551-N555 PolarHBondContact O-ND2 3.23Å; E552-N555 PolarHBondContact O-N 3.19Å; A553-N555 VanDerWaalsContact C-N 3.29Å; A553-N555 PolarHBondContact O-N 3.33Å
556	E	61.2	Low	61.1	Low	161 Å²	161	126.1 Å²	126.1	75%	0.752	68%	0.684	S	S	*	*	S	Bend	trans	-97.7	-15.2	-165.7	-61.8	-166.7	145.5	0	0	115.7
557	N	57	Low	58.8	Low	138 Å²	138	121.6 Å²	121.6	74%	0.738	69%	0.688	S	S	*	*			trans	-138.6	96.7	-171.7	-81.3	-84.1	0	0	0	113.7	Q559	N557-Q559 VanDerWaalsContact C-N 3.3Å; N557-Q559 PolarHBondContact O-N 2.59Å
558	G	51.5	Low	56.8	Low	94 Å²	94	122 Å²	122	97%	0.969	69%	0.692	S	S	*	*			trans	-74.8	60.9	-179	0	0	0	0	0	115.8
559	Q	48.8	Very low	54.6	Low	157 Å²	157	128.7 Å²	128.7	73%	0.734	71%	0.708	S	S	*	*			trans	-121.6	111.8	162.2	-81.2	-151.8	-34.8	0	0	111.7	N557 K561	N557-Q559 VanDerWaalsContact C-N 3.3Å; N557-Q559 PolarHBondContact O-N 2.59Å; Q559-K561 PolarHBondContact O-N 2.9Å
560	E	37.4	Very low	52.6	Low	205 Å²	205	134.5 Å²	134.5	96%	0.958	72%	0.723	S	S	*	*			trans	-69.3	86.6	177.2	-170.7	175.4	-165	0	0	111.3
561	K	48.5	Very low	50.8	Low	171 Å²	171	134 Å²	134	74%	0.743	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-85.2	133.5	166.1	-70.8	178.6	-179.8	172	0	108.8	Q559	Q559-K561 PolarHBondContact O-N 2.9Å
562	Q	40	Very low	49.1	Very low	183 Å²	183	132.1 Å²	132.1	86%	0.855	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-52.8	138.9	-176.4	-69.8	-173.9	-10.5	0	0	111.9	L564	Q562-L564 PolarHBondContact O-N 2.97Å
563	P	50.7	Low	47.8	Very low	105 Å²	105	131.3 Å²	131.3	68%	0.682	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-63.1	124.8	178.3	26.2	-33.6	0	0	0	110
564	L	45.5	Very low	46.5	Very low	140 Å²	140	128.9 Å²	128.9	73%	0.733	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-55.6	138.3	169.6	-72.4	168.2	0	0	0	109.2	Q562 W566	Q562-L564 PolarHBondContact O-N 2.97Å; L564-W566 PolarHBondContact O-N 3.14Å
565	P	43.6	Very low	45.8	Very low	124 Å²	124	128.3 Å²	128.3	81%	0.805	68%	0.676	S	S	*	*			trans	-63.8	104.3	-175.7	24.9	-33.8	0	0	0	110.6	G567	P565-G567 PolarHBondContact O-N 3.36Å
566	W	30.1	Very low	45.4	Very low	235 Å²	235	124.1 Å²	124.1	89%	0.89	66%	0.656	S	S	*	*			trans	-72.8	53.3	178.1	-68.4	-36.9	0	0	0	112.5	L564	L564-W566 PolarHBondContact O-N 3.14Å
567	G	36.7	Very low	45.1	Very low	70 Å²	70	122.8 Å²	122.8	72%	0.722	64%	0.644	S	S	*	*			trans	-83.9	-13	174.1	0	0	0	0	0	114	P565 R569	P565-G567 PolarHBondContact O-N 3.36Å; G567-R569 PolarHBondContact O-N 2.63Å
568	A	39.2	Very low	44.7	Very low	68 Å²	68	119.4 Å²	119.4	56%	0.562	62%	0.621	S	S	*	*			trans	-70.4	92.1	172.2	0	0	0	0	0	109.8	W570	A568-W570 PolarHBondContact O-N 3.42Å
569	R	37.7	Very low	44.8	Very low	203 Å²	203	117.8 Å²	117.8	77%	0.766	60%	0.599	S	S	*	*			trans	-62.3	89.8	165.1	-174.4	-179.6	-173	-158.7	11.6	107.7	G567 H571	G567-R569 PolarHBondContact O-N 2.63Å; R569-H571 VanDerWaalsContact CD-NE2 3.33Å; R569-H571 WeakPolarHBondContact CD-NE2 3.44Å; R569-H571 VanDerWaalsContact CZ-NE2 3.34Å; R569-H571 PolarHBondContact NE-NE2 2.89Å; R569-H571 PolarHBondContact NH1-CE1 3.37Å; R569-H571 VanDerWaalsContact NH1-CE1 3.33Å; R569-H571 PolarHBondContact NH1-NE2 2.99Å; R569-H571 PolarHBondContact O-N 3.18Å
570	W	39.2	Very low	45.3	Very low	225 Å²	225	115.1 Å²	115.1	85%	0.852	59%	0.589	S	S	*	*			trans	-64.5	79.2	169.3	-71.1	91.7	0	0	0	108.6	A568 C572	A568-W570 PolarHBondContact O-N 3.42Å; W570-C572 PolarHBondContact O-N 2.96Å
571	H	42.3	Very low	46.1	Very low	88 Å²	88	107 Å²	107	41%	0.407	55%	0.551	S	S	.	*			trans	-50.4	107.8	157.8	-84.7	-89.5	0	0	0	106.3	R569 P573 V576	R569-H571 VanDerWaalsContact CD-NE2 3.33Å; R569-H571 WeakPolarHBondContact CD-NE2 3.44Å; R569-H571 VanDerWaalsContact CZ-NE2 3.34Å; R569-H571 PolarHBondContact NE-NE2 2.89Å; R569-H571 PolarHBondContact NH1-CE1 3.37Å; R569-H571 VanDerWaalsContact NH1-CE1 3.33Å; R569-H571 PolarHBondContact NH1-NE2 2.99Å; R569-H571 PolarHBondContact O-N 3.18Å; H571-P573 VanDerWaalsContact O-CD 3.28Å; H571-P573 WeakPolarHBondContact O-CD 3.33Å; H571-P573 VanDerWaalsContact O-N 3.1Å; H571-V576 HydrophobicContact CB-CG2 3.85Å; H571-V576 VanDerWaalsContact ND1-CG2 3.27Å; H571-V576 WeakPolarHBondContact ND1-CG2 3.42Å
572	C	41.6	Very low	46.3	Very low	21 Å²	21	102.5 Å²	102.5	14%	0.142	54%	0.535	C	S	.	.			trans	-51.4	117.4	167	165.6	0	0	0	0	105.9	W539 W570 A574 S575 V576	W539-C572 VanDerWaalsContact CE3-SG 3.57Å; W539-C572 HydrophobicContact CH2-CB 3.45Å; W539-C572 VanDerWaalsContact CH2-CB 3.45Å; W539-C572 WeakPolarHBondContact CH2-SG 3.38Å; W539-C572 HydrophobicContact CZ2-CB 4.1Å; W539-C572 HydrophobicContact CZ3-CB 3.8Å; W539-C572 WeakPolarHBondContact CZ3-SG 3.44Å; W570-C572 PolarHBondContact O-N 2.96Å; C572-A574 CarbonylContact O-C 3.49Å; C572-A574 PolarHBondContact O-N 3.26Å; C572-A574 WeakPolarHBondContact SG-CB 3.33Å; C572-S575 WeakPolarHBondContact CB-OG 3.5Å; C572-S575 PolarHBondContact O-N 3.16Å; C572-S575 PolarHBondContact O-OG 2.85Å; C572-S575 PolarHBondContact SG-N 2.87Å; C572-V576 PolarHBondContact O-N 2.94Å
573	P	49.3	Very low	47	Very low	87 Å²	87	95.2 Å²	95.2	57%	0.565	51%	0.509	S	S	*	.	H	α-helix	trans	-56.2	-43.6	-175.1	-27.7	36.4	0	0	0	109.9	H571 V576 W577	H571-P573 VanDerWaalsContact O-CD 3.28Å; H571-P573 WeakPolarHBondContact O-CD 3.33Å; H571-P573 VanDerWaalsContact O-N 3.1Å; P573-V576 PolarHBondContact O-N 3.47Å; P573-W577 WeakPolarHBondContact O-CB 3.36Å; P573-W577 PolarHBondContact O-N 2.76Å
574	A	49.2	Very low	47.2	Very low	15 Å²	15	95.1 Å²	95.1	12%	0.124	50%	0.502	C	S	.	.	H	α-helix	trans	-40	-67.2	161.3	0	0	0	0	0	112.4	E536 C572 V576 W577 Y578	E536-A574 VanDerWaalsContact CD-CB 3.42Å; E536-A574 HydrophobicContact CG-CB 3.96Å; E536-A574 WeakPolarHBondContact OE1-CA 3.38Å; E536-A574 WeakPolarHBondContact OE1-CB 3.32Å; C572-A574 CarbonylContact O-C 3.49Å; C572-A574 PolarHBondContact O-N 3.26Å; C572-A574 WeakPolarHBondContact SG-CB 3.33Å; A574-V576 PolarHBondContact O-N 2.79Å; A574-W577 CarbonylContact O-C 3.41Å; A574-W577 WeakPolarHBondContact O-CA 3.22Å; A574-W577 PolarHBondContact O-N 2.71Å; A574-Y578 VanDerWaalsContact O-CB 3.3Å; A574-Y578 WeakPolarHBondContact O-CB 3.35Å; A574-Y578 PolarHBondContact O-N 3.09Å
575	S	51.6	Low	47.4	Very low	61 Å²	61	90.2 Å²	90.2	43%	0.427	48%	0.478	S	S	.	.	H	α-helix	trans	-53.4	-25.3	-179.2	71.8	0	0	0	0	117.3	C572 A579	C572-S575 WeakPolarHBondContact CB-OG 3.5Å; C572-S575 PolarHBondContact O-N 3.16Å; C572-S575 PolarHBondContact O-OG 2.85Å; C572-S575 PolarHBondContact SG-N 2.87Å; S575-A579 VanDerWaalsContact O-CB 3.25Å; S575-A579 WeakPolarHBondContact O-CB 3.38Å; S575-A579 PolarHBondContact O-N 3.07Å
576	V	53.2	Low	47.5	Very low	56 Å²	56	89.5 Å²	89.5	34%	0.339	47%	0.467	S	S	.	.	H	α-helix	trans	-90.4	-38.5	174.2	178.7	0	0	0	0	111	H571 C572 P573 A574 A579 N580	H571-V576 HydrophobicContact CB-CG2 3.85Å; H571-V576 VanDerWaalsContact ND1-CG2 3.27Å; H571-V576 WeakPolarHBondContact ND1-CG2 3.42Å; C572-V576 PolarHBondContact O-N 2.94Å; P573-V576 PolarHBondContact O-N 3.47Å; A574-V576 PolarHBondContact O-N 2.79Å; V576-A579 PolarHBondContact O-N 3.49Å; V576-N580 WeakPolarHBondContact O-CB 3.47Å; V576-N580 PolarHBondContact O-N 3.07Å; V576-N580 PolarHBondContact O-OD1 2.99Å
577	W	54.9	Low	48.3	Very low	133 Å²	133	81.3 Å²	81.3	50%	0.504	45%	0.446	S	S	.	.	H	α-helix	trans	-66.1	-45.2	175.4	-154.8	96.4	0	0	0	110.6	V532 P573 A574 N580 F581	V532-W577 HydrophobicContact CB-CZ3 3.93Å; V532-W577 HydrophobicContact CG1-CE3 3.65Å; V532-W577 HydrophobicContact CG1-CH2 4.4Å; V532-W577 HydrophobicContact CG1-CZ3 3.42Å; V532-W577 VanDerWaalsContact CG1-CZ3 3.42Å; V532-W577 HydrophobicContact CG2-CE3 4.24Å; V532-W577 HydrophobicContact CG2-CH2 3.43Å; V532-W577 VanDerWaalsContact CG2-CH2 3.43Å; V532-W577 HydrophobicContact CG2-CZ3 3.26Å; P573-W577 WeakPolarHBondContact O-CB 3.36Å; P573-W577 PolarHBondContact O-N 2.76Å; A574-W577 CarbonylContact O-C 3.41Å; A574-W577 WeakPolarHBondContact O-CA 3.22Å; A574-W577 PolarHBondContact O-N 2.71Å; W577-N580 CarbonylContact O-C 3.5Å; W577-N580 VanDerWaalsContact O-C 3.32Å; W577-N580 WeakPolarHBondContact O-CA 3.18Å; W577-N580 PolarHBondContact O-N 3.42Å; W577-F581 HydrophobicContact CD2-CB 4.39Å; W577-F581 HydrophobicContact CE3-CB 3.51Å; W577-F581 HydrophobicContact CE3-CD1 4.42Å; W577-F581 HydrophobicContact CE3-CD2 4.25Å; W577-F581 AromaticContact CE3-CG 3.83Å; W577-F581 HydrophobicContact CE3-CG 3.83Å; W577-F581 HydrophobicContact CH2-CB 4.28Å; W577-F581 AromaticContact CH2-CD2 3.46Å; W577-F581 HydrophobicContact CH2-CD2 3.46Å; W577-F581 VanDerWaalsContact CH2-CD2 3.46Å; W577-F581 AromaticContact CH2-CE2 3.84Å; W577-F581 HydrophobicContact CH2-CE2 3.84Å; W577-F581 AromaticContact CH2-CG 3.87Å; W577-F581 HydrophobicContact CH2-CG 3.87Å; W577-F581 HydrophobicContact CZ2-CD2 4.47Å; W577-F581 HydrophobicContact CZ3-CB 3.43Å; W577-F581 VanDerWaalsContact CZ3-CB 3.43Å; W577-F581 AromaticContact CZ3-CD1 3.71Å; W577-F581 HydrophobicContact CZ3-CD1 3.71Å; W577-F581 AromaticContact CZ3-CD2 3.31Å; W577-F581 HydrophobicContact CZ3-CD2 3.31Å; W577-F581 HydrophobicContact CZ3-CE1 4.28Å; W577-F581 AromaticContact CZ3-CE2 3.92Å; W577-F581 HydrophobicContact CZ3-CE2 3.92Å; W577-F581 AromaticContact CZ3-CG 3.18Å; W577-F581 HydrophobicContact CZ3-CG 3.18Å; W577-F581 HydrophobicContact CZ3-CZ 4.37Å; W577-F581 WeakPolarHBondContact O-CA 3.24Å; W577-F581 WeakPolarHBondContact O-CB 3.45Å; W577-F581 PolarHBondContact O-N 3.43Å
578	Y	47.8	Very low	48.7	Very low	66 Å²	66	80.8 Å²	80.8	26%	0.259	43%	0.431	S	S	.	.	H	α-helix	trans	-66.1	-33.6	171.9	-139.1	-108.5	0	0	0	113.1	V532 I533 E536 A574 N580 F581 L582	V532-Y578 HydrophobicContact CG1-CD2 4.19Å; V532-Y578 HydrophobicContact CG1-CE2 4.37Å; I533-Y578 HydrophobicContact CG1-CE2 4.06Å; E536-Y578 HydrophobicContact CG-CD2 4.05Å; E536-Y578 HydrophobicContact CG-CE2 4.19Å; E536-Y578 WeakPolarHBondContact OE1-CB 3.32Å; E536-Y578 VanDerWaalsContact OE1-CD2 3.23Å; E536-Y578 WeakPolarHBondContact OE1-CD2 3.05Å; A574-Y578 VanDerWaalsContact O-CB 3.3Å; A574-Y578 WeakPolarHBondContact O-CB 3.35Å; A574-Y578 PolarHBondContact O-N 3.09Å; Y578-N580 VanDerWaalsContact C-N 3.35Å; Y578-F581 PolarHBondContact O-N 3.36Å; Y578-L582 HydrophobicContact CD1-CD1 3.58Å; Y578-L582 HydrophobicContact CD1-CG 3.92Å; Y578-L582 HydrophobicContact CE1-CD1 3.6Å; Y578-L582 HydrophobicContact CE1-CG 4.01Å; Y578-L582 VanDerWaalsContact O-CB 3.24Å; Y578-L582 WeakPolarHBondContact O-CB 3.17Å; Y578-L582 PolarHBondContact O-N 3.09Å
579	A	53.9	Low	48.7	Very low	61 Å²	61	82.3 Å²	82.3	50%	0.504	43%	0.434	S	S	.	.	H	α-helix	trans	-67.7	-37.9	169.7	0	0	0	0	0	111.4	S575 V576 G583	S575-A579 VanDerWaalsContact O-CB 3.25Å; S575-A579 WeakPolarHBondContact O-CB 3.38Å; S575-A579 PolarHBondContact O-N 3.07Å; V576-A579 PolarHBondContact O-N 3.49Å; A579-G583 WeakPolarHBondContact O-CA 3.07Å; A579-G583 PolarHBondContact O-N 3.36Å
580	N	58.7	Low	48.6	Very low	100 Å²	100	76 Å²	76	54%	0.535	43%	0.425	S	S	.	.	H	α-helix	trans	-79.3	-17.6	174.3	-68.1	-6.4	0	0	0	113.3	V576 W577 Y578 G583 D584	V576-N580 WeakPolarHBondContact O-CB 3.47Å; V576-N580 PolarHBondContact O-N 3.07Å; V576-N580 PolarHBondContact O-OD1 2.99Å; W577-N580 CarbonylContact O-C 3.5Å; W577-N580 VanDerWaalsContact O-C 3.32Å; W577-N580 WeakPolarHBondContact O-CA 3.18Å; W577-N580 PolarHBondContact O-N 3.42Å; Y578-N580 VanDerWaalsContact C-N 3.35Å; N580-G583 CarbonylContact O-C 3.32Å; N580-D584 WeakPolarHBondContact O-CB 3.06Å; N580-D584 VanDerWaalsContact O-CG 3.29Å; N580-D584 PolarHBondContact O-N 3.42Å
581	F	53.8	Low	48.3	Very low	34 Å²	34	70.5 Å²	70.5	15%	0.149	41%	0.407	C	S	.	.	H	α-helix	trans	-107.6	-33.6	-174	-178.3	-99.1	0	0	0	112.7	A529 W577 Y578 V585	A529-F581 VanDerWaalsContact CA-CZ 3.5Å; A529-F581 HydrophobicContact CB-CE1 3.6Å; A529-F581 HydrophobicContact CB-CZ 3.62Å; W577-F581 HydrophobicContact CD2-CB 4.39Å; W577-F581 HydrophobicContact CE3-CB 3.51Å; W577-F581 HydrophobicContact CE3-CD1 4.42Å; W577-F581 HydrophobicContact CE3-CD2 4.25Å; W577-F581 AromaticContact CE3-CG 3.83Å; W577-F581 HydrophobicContact CE3-CG 3.83Å; W577-F581 HydrophobicContact CH2-CB 4.28Å; W577-F581 AromaticContact CH2-CD2 3.46Å; W577-F581 HydrophobicContact CH2-CD2 3.46Å; W577-F581 VanDerWaalsContact CH2-CD2 3.46Å; W577-F581 AromaticContact CH2-CE2 3.84Å; W577-F581 HydrophobicContact CH2-CE2 3.84Å; W577-F581 AromaticContact CH2-CG 3.87Å; W577-F581 HydrophobicContact CH2-CG 3.87Å; W577-F581 HydrophobicContact CZ2-CD2 4.47Å; W577-F581 HydrophobicContact CZ3-CB 3.43Å; W577-F581 VanDerWaalsContact CZ3-CB 3.43Å; W577-F581 AromaticContact CZ3-CD1 3.71Å; W577-F581 HydrophobicContact CZ3-CD1 3.71Å; W577-F581 AromaticContact CZ3-CD2 3.31Å; W577-F581 HydrophobicContact CZ3-CD2 3.31Å; W577-F581 HydrophobicContact CZ3-CE1 4.28Å; W577-F581 AromaticContact CZ3-CE2 3.92Å; W577-F581 HydrophobicContact CZ3-CE2 3.92Å; W577-F581 AromaticContact CZ3-CG 3.18Å; W577-F581 HydrophobicContact CZ3-CG 3.18Å; W577-F581 HydrophobicContact CZ3-CZ 4.37Å; W577-F581 WeakPolarHBondContact O-CA 3.24Å; W577-F581 WeakPolarHBondContact O-CB 3.45Å; W577-F581 PolarHBondContact O-N 3.43Å; Y578-F581 PolarHBondContact O-N 3.36Å; F581-V585 HydrophobicContact CD1-CG2 4.04Å; F581-V585 HydrophobicContact CD2-CG2 4.09Å; F581-V585 HydrophobicContact CE1-CG2 3.65Å; F581-V585 HydrophobicContact CE2-CG2 3.71Å; F581-V585 HydrophobicContact CG-CG2 4.24Å; F581-V585 HydrophobicContact CZ-CG2 3.47Å; F581-V585 VanDerWaalsContact CZ-CG2 3.47Å; F581-V585 WeakPolarHBondContact O-CA 3.49Å; F581-V585 WeakPolarHBondContact O-CB 3.3Å; F581-V585 WeakPolarHBondContact O-CG2 3.38Å; F581-V585 PolarHBondContact O-N 3.25Å
582	L	54.1	Low	47.7	Very low	78 Å²	78	69.7 Å²	69.7	41%	0.408	41%	0.41	S	S	.	.	H	α-helix	trans	-65.5	-33.2	151.2	-68.9	177.2	0	0	0	109.4	Y578 L586	Y578-L582 HydrophobicContact CD1-CD1 3.58Å; Y578-L582 HydrophobicContact CD1-CG 3.92Å; Y578-L582 HydrophobicContact CE1-CD1 3.6Å; Y578-L582 HydrophobicContact CE1-CG 4.01Å; Y578-L582 VanDerWaalsContact O-CB 3.24Å; Y578-L582 WeakPolarHBondContact O-CB 3.17Å; Y578-L582 PolarHBondContact O-N 3.09Å; L582-L586 HydrophobicContact CB-CD1 4.25Å; L582-L586 WeakPolarHBondContact O-CA 2.9Å; L582-L586 WeakPolarHBondContact O-CB 3.23Å; L582-L586 WeakPolarHBondContact O-CG 3.06Å; L582-L586 PolarHBondContact O-N 3.27Å
583	G	53.8	Low	47.2	Very low	30 Å²	30	74.3 Å²	74.3	31%	0.309	43%	0.427	S	S	.	.	H	α-helix	trans	-51.8	-61.5	165.9	0	0	0	0	0	111.5	A579 N580 S587	A579-G583 WeakPolarHBondContact O-CA 3.07Å; A579-G583 PolarHBondContact O-N 3.36Å; N580-G583 CarbonylContact O-C 3.32Å; G583-S587 WeakPolarHBondContact O-CA 3.41Å; G583-S587 WeakPolarHBondContact O-CB 3.48Å; G583-S587 PolarHBondContact O-N 3.03Å
584	D	54.6	Low	46.4	Very low	102 Å²	102	76 Å²	76	55%	0.545	43%	0.432	S	S	.	.	H	α-helix	trans	-76.6	-26.5	-176	-82	-27.9	0	0	0	113.9	N580 S587 S588	N580-D584 WeakPolarHBondContact O-CB 3.06Å; N580-D584 VanDerWaalsContact O-CG 3.29Å; N580-D584 PolarHBondContact O-N 3.42Å; D584-S587 CarbonylContact O-C 3.54Å; D584-S587 VanDerWaalsContact O-C 3.29Å; D584-S588 WeakPolarHBondContact O-CA 3.38Å; D584-S588 WeakPolarHBondContact O-CB 3.41Å; D584-S588 PolarHBondContact O-N 2.86Å
585	V	49.4	Very low	45.6	Very low	38 Å²	38	81.8 Å²	81.8	23%	0.23	45%	0.45	C	S	.	.	H	α-helix	trans	-80.7	-46.2	175.2	172	0	0	0	0	110.7	F581 S587 S588 T589	F581-V585 HydrophobicContact CD1-CG2 4.04Å; F581-V585 HydrophobicContact CD2-CG2 4.09Å; F581-V585 HydrophobicContact CE1-CG2 3.65Å; F581-V585 HydrophobicContact CE2-CG2 3.71Å; F581-V585 HydrophobicContact CG-CG2 4.24Å; F581-V585 HydrophobicContact CZ-CG2 3.47Å; F581-V585 VanDerWaalsContact CZ-CG2 3.47Å; F581-V585 WeakPolarHBondContact O-CA 3.49Å; F581-V585 WeakPolarHBondContact O-CB 3.3Å; F581-V585 WeakPolarHBondContact O-CG2 3.38Å; F581-V585 PolarHBondContact O-N 3.25Å; V585-S587 VanDerWaalsContact C-N 3.27Å; V585-S587 PolarHBondContact O-N 3.2Å; V585-S588 CarbonylContact O-C 3.54Å; V585-S588 WeakPolarHBondContact O-CA 3.32Å; V585-S588 PolarHBondContact O-N 3.21Å; V585-T589 PolarHBondContact O-N 3.18Å; V585-T589 PolarHBondContact O-OG1 3.14Å; V585-T589 VanDerWaalsContact O-OG1 3.07Å
586	L	47.1	Very low	44.5	Very low	108 Å²	108	87.2 Å²	87.2	57%	0.565	47%	0.466	S	S	*	.	H	α-helix	trans	-66.3	-34.4	171.7	-60.1	170.3	0	0	0	110.4	L582 S588 A590	L582-L586 HydrophobicContact CB-CD1 4.25Å; L582-L586 WeakPolarHBondContact O-CA 2.9Å; L582-L586 WeakPolarHBondContact O-CB 3.23Å; L582-L586 WeakPolarHBondContact O-CG 3.06Å; L582-L586 PolarHBondContact O-N 3.27Å; L586-S588 PolarHBondContact O-N 3.11Å; L586-A590 CarbonylContact O-C 3.29Å; L586-A590 VanDerWaalsContact O-CA 3.24Å; L586-A590 WeakPolarHBondContact O-CA 3.48Å; L586-A590 WeakPolarHBondContact O-CB 3.38Å; L586-A590 PolarHBondContact O-N 3.25Å
587	S	46.8	Very low	43.7	Very low	63 Å²	63	92 Å²	92	44%	0.441	48%	0.478	S	S	.	.	H	α-helix	trans	-83.6	11.8	168.5	-158.3	0	0	0	0	113.1	G583 D584 V585 K591	G583-S587 WeakPolarHBondContact O-CA 3.41Å; G583-S587 WeakPolarHBondContact O-CB 3.48Å; G583-S587 PolarHBondContact O-N 3.03Å; D584-S587 CarbonylContact O-C 3.54Å; D584-S587 VanDerWaalsContact O-C 3.29Å; V585-S587 VanDerWaalsContact C-N 3.27Å; V585-S587 PolarHBondContact O-N 3.2Å; S587-K591 VanDerWaalsContact O-CA 3.23Å; S587-K591 WeakPolarHBondContact O-CA 3.46Å; S587-K591 WeakPolarHBondContact O-CB 3.27Å; S587-K591 WeakPolarHBondContact O-CD 3.36Å; S587-K591 WeakPolarHBondContact O-CE 3.5Å; S587-K591 WeakPolarHBondContact O-CG 3.49Å; S587-K591 PolarHBondContact O-N 3.4Å; S587-K591 VanDerWaalsContact O-N 3.1Å
588	S	44.1	Very low	42.6	Very low	59 Å²	59	89.2 Å²	89.2	41%	0.413	48%	0.479	S	S	.	.	H	α-helix	trans	-116.2	-25.2	166.8	-159.3	0	0	0	0	113.1	D584 V585 L586 K591	D584-S588 WeakPolarHBondContact O-CA 3.38Å; D584-S588 WeakPolarHBondContact O-CB 3.41Å; D584-S588 PolarHBondContact O-N 2.86Å; V585-S588 CarbonylContact O-C 3.54Å; V585-S588 WeakPolarHBondContact O-CA 3.32Å; V585-S588 PolarHBondContact O-N 3.21Å; L586-S588 PolarHBondContact O-N 3.11Å; S588-K591 VanDerWaalsContact CB-NZ 3.27Å; S588-K591 PolarHBondContact OG-NZ 3.01Å
589	T	39	Very low	42	Very low	101 Å²	101	89 Å²	89	62%	0.62	49%	0.485	S	S	*	.	H	α-helix	trans	-85	-30	165	58.5	0	0	0	0	111.5	V585	V585-T589 PolarHBondContact O-N 3.18Å; V585-T589 PolarHBondContact O-OG1 3.14Å; V585-T589 VanDerWaalsContact O-OG1 3.07Å
590	A	36.2	Very low	41.2	Very low	71 Å²	71	92.1 Å²	92.1	59%	0.587	50%	0.498	S	S	*	.	S	Bend	trans	-114.1	28.7	163.5	0	0	0	0	0	112.5	L586 P592	L586-A590 CarbonylContact O-C 3.29Å; L586-A590 VanDerWaalsContact O-CA 3.24Å; L586-A590 WeakPolarHBondContact O-CA 3.48Å; L586-A590 WeakPolarHBondContact O-CB 3.38Å; L586-A590 PolarHBondContact O-N 3.25Å; A590-P592 WeakPolarHBondContact O-CD 3.37Å
591	K	33	Very low	40.3	Very low	108 Å²	108	89.5 Å²	89.5	47%	0.47	50%	0.495	S	S	.	.	S	Bend	trans	-54	123.6	143.9	-121.1	150.7	-121.1	160.3	0	103.7	S587 S588 F593	S587-K591 VanDerWaalsContact O-CA 3.23Å; S587-K591 WeakPolarHBondContact O-CA 3.46Å; S587-K591 WeakPolarHBondContact O-CB 3.27Å; S587-K591 WeakPolarHBondContact O-CD 3.36Å; S587-K591 WeakPolarHBondContact O-CE 3.5Å; S587-K591 WeakPolarHBondContact O-CG 3.49Å; S587-K591 PolarHBondContact O-N 3.4Å; S587-K591 VanDerWaalsContact O-N 3.1Å; S588-K591 VanDerWaalsContact CB-NZ 3.27Å; S588-K591 PolarHBondContact OG-NZ 3.01Å; K591-F593 PolarHBondContact O-N 3.24Å
592	P	29.9	Very low	39.8	Very low	72 Å²	72	89.5 Å²	89.5	47%	0.468	50%	0.498	S	S	.	.			trans	-57.8	111.2	164.7	25.4	-31	0	0	0	105.1	A590 D594 Q615	A590-P592 WeakPolarHBondContact O-CD 3.37Å; P592-D594 PolarHBondContact O-N 2.76Å; P592-D594 VanDerWaalsContact O-N 3.15Å; P592-Q615 HydrophobicContact CB-CG 4.49Å
593	F	30.8	Very low	39.7	Very low	117 Å²	117	91.7 Å²	91.7	51%	0.513	51%	0.506	S	S	.	.			trans	-45.5	127.8	-178.3	164.1	-116	0	0	0	107.4	K518 K591 R595	K518-F593 VanDerWaalsContact CE-CE2 3.47Å; K591-F593 PolarHBondContact O-N 3.24Å; F593-R595 HydrophobicContact CD1-CG 4.09Å; F593-R595 WeakPolarHBondContact O-CG 3.36Å; F593-R595 PolarHBondContact O-N 2.88Å
594	D	31.9	Very low	39.9	Very low	122 Å²	122	93.1 Å²	93.1	65%	0.652	51%	0.511	S	S	*	.			trans	-65	78.9	-168.6	-176.2	19.5	0	0	0	110.9	P592 K596	P592-D594 PolarHBondContact O-N 2.76Å; P592-D594 VanDerWaalsContact O-N 3.15Å; D594-K596 PolarHBondContact O-N 3.26Å
595	R	32.5	Very low	40.3	Very low	138 Å²	138	88.3 Å²	88.3	52%	0.521	49%	0.485	S	S	.	.			trans	-71.3	72.1	170.9	-64.3	-165.5	-160	-161	13.9	106	F593 W597	F593-R595 HydrophobicContact CD1-CG 4.09Å; F593-R595 WeakPolarHBondContact O-CG 3.36Å; F593-R595 PolarHBondContact O-N 2.88Å; R595-W597 VanDerWaalsContact O-CA 3.31Å; R595-W597 WeakPolarHBondContact O-CA 3.44Å; R595-W597 PolarHBondContact O-N 3.41Å
596	K	29.5	Very low	41.1	Very low	174 Å²	174	91.8 Å²	91.8	76%	0.757	50%	0.502	S	S	*	.			trans	-38.6	108.6	149.7	-85.5	-176.9	175.1	173.6	0	106.4	D594 S598	D594-K596 PolarHBondContact O-N 3.26Å; K596-S598 PolarHBondContact O-N 3.23Å
597	W	35.4	Very low	42.4	Very low	158 Å²	158	89.9 Å²	89.9	60%	0.598	50%	0.498	S	S	*	.			trans	-60.5	100.3	-153.8	-175.5	88	0	0	0	110.5	R595 P599	R595-W597 VanDerWaalsContact O-CA 3.31Å; R595-W597 WeakPolarHBondContact O-CA 3.44Å; R595-W597 PolarHBondContact O-N 3.41Å; W597-P599 HydrophobicContact CH2-CB 4.43Å; W597-P599 HydrophobicContact CZ3-CB 4.31Å
598	S	31.9	Very low	44	Very low	73 Å²	73	88.2 Å²	88.2	51%	0.51	48%	0.482	S	S	.	.			trans	-106.7	118.7	-172	-174.2	0	0	0	0	108.8	K596 V600	K596-S598 PolarHBondContact O-N 3.23Å; S598-V600 PolarHBondContact O-N 2.99Å
599	P	36.6	Very low	46	Very low	61 Å²	61	89.8 Å²	89.8	40%	0.396	49%	0.486	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.8	47.8	-176.2	35.4	-37.6	0	0	0	111.7	W597 Y671	W597-P599 HydrophobicContact CH2-CB 4.43Å; W597-P599 HydrophobicContact CZ3-CB 4.31Å; P599-Y671 HydrophobicContact CB-CE2 3.93Å; P599-Y671 PolarHBondContact O-OH 3.09Å
600	V	37	Very low	48.4	Very low	127 Å²	127	86.9 Å²	86.9	77%	0.77	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-138.8	14	-172.1	-159.1	0	0	0	0	111.2	S598	S598-V600 PolarHBondContact O-N 2.99Å
601	G	37.9	Very low	50.8	Low	46 Å²	46	87.1 Å²	87.1	47%	0.474	46%	0.46	S	S	.	.			trans	-157.8	31	-175.2	0	0	0	0	0	113.5	Q603	G601-Q603 PolarHBondContact O-N 3.02Å; G601-Q603 VanDerWaalsContact O-N 3.14Å
602	V	44.8	Very low	53.3	Low	34 Å²	34	83.7 Å²	83.7	21%	0.206	45%	0.447	C	S	.	.			trans	-81.2	91.9	178	-172.1	0	0	0	0	108.1	S604 W608 Y671	V602-S604 PolarHBondContact O-N 2.9Å; V602-W608 HydrophobicContact CG1-CZ2 4.3Å; V602-Y671 HydrophobicContact CG2-CE1 4.24Å
603	Q	50.6	Low	56	Low	124 Å²	124	80.2 Å²	80.2	58%	0.579	43%	0.425	S	S	*	.			trans	-47.7	131.2	156.3	-74.8	169.9	-76.3	0	0	107.5	G601 L605 W608	G601-Q603 PolarHBondContact O-N 3.02Å; G601-Q603 VanDerWaalsContact O-N 3.14Å; Q603-L605 PolarHBondContact O-N 2.76Å; Q603-W608 PolarHBondContact O-NE1 2.96Å
604	S	58.1	Low	58.8	Low	59 Å²	59	75 Å²	75	41%	0.413	40%	0.402	S	S	.	.			trans	-38.8	134.7	-170	178.7	0	0	0	0	111.6	V602 L606 S607	V602-S604 PolarHBondContact O-N 2.9Å; S604-L606 PolarHBondContact O-N 3.14Å; S604-S607 PolarHBondContact O-N 2.78Å; S604-S607 PolarHBondContact O-OG 2.75Å
605	L	62.9	Low	61.2	Low	1 Å²	1	71.7 Å²	71.7	1%	0.005	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-5.9	-176.1	-149.9	138.1	0	0	0	113.6	Q603 W608 G636 L640 L668 V672	Q603-L605 PolarHBondContact O-N 2.76Å; L605-W608 HydrophobicContact CD1-CD2 4.18Å; L605-W608 HydrophobicContact CD1-CE3 4.28Å; L605-W608 HydrophobicContact CD1-CH2 3.78Å; L605-W608 HydrophobicContact CD1-CZ2 3.65Å; L605-W608 HydrophobicContact CD1-CZ3 4.09Å; L605-W608 HydrophobicContact CG-CD2 3.78Å; L605-W608 HydrophobicContact CG-CE3 4.08Å; L605-W608 HydrophobicContact CG-CG 4.18Å; L605-W608 HydrophobicContact CG-CH2 4.43Å; L605-W608 HydrophobicContact CG-CZ2 4.15Å; L605-W608 HydrophobicContact CG-CZ3 4.39Å; L605-G636 WeakPolarHBondContact O-CA 3.26Å; L605-L640 HydrophobicContact CD2-CD1 3.87Å; L605-L640 HydrophobicContact CD2-CD2 3.6Å; L605-L640 HydrophobicContact CD2-CG 3.55Å; L605-L668 HydrophobicContact CD1-CB 4Å; L605-L668 HydrophobicContact CD1-CD1 4.1Å; L605-L668 HydrophobicContact CD1-CD2 3.84Å; L605-L668 HydrophobicContact CD1-CG 4.2Å; L605-V672 HydrophobicContact CB-CG2 4.14Å
606	L	66	Low	63.8	Low	111 Å²	111	65.8 Å²	65.8	58%	0.581	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.8	-19.3	168.6	-73.6	72.1	0	0	0	113.3	S604	S604-L606 PolarHBondContact O-N 3.14Å
607	S	74.7	Confident	66.7	Low	68 Å²	68	57.5 Å²	57.5	48%	0.476	33%	0.325	S	S	.	.	S	Bend	trans	-104.7	4.3	179.3	69.3	0	0	0	0	113.9	S604 D609	S604-S607 PolarHBondContact O-N 2.78Å; S604-S607 PolarHBondContact O-OG 2.75Å; S607-D609 PolarHBondContact O-N 2.86Å
608	W	82.1	Confident	69.1	Low	29 Å²	29	54.6 Å²	54.6	11%	0.11	32%	0.317	C	S	.	.			trans	-67.4	123.7	172.1	-75.7	18.7	0	0	0	110	V602 Q603 L605 D612 V613 F616 G636 L639 L668	V602-W608 HydrophobicContact CG1-CZ2 4.3Å; Q603-W608 PolarHBondContact O-NE1 2.96Å; L605-W608 HydrophobicContact CD1-CD2 4.18Å; L605-W608 HydrophobicContact CD1-CE3 4.28Å; L605-W608 HydrophobicContact CD1-CH2 3.78Å; L605-W608 HydrophobicContact CD1-CZ2 3.65Å; L605-W608 HydrophobicContact CD1-CZ3 4.09Å; L605-W608 HydrophobicContact CG-CD2 3.78Å; L605-W608 HydrophobicContact CG-CE3 4.08Å; L605-W608 HydrophobicContact CG-CG 4.18Å; L605-W608 HydrophobicContact CG-CH2 4.43Å; L605-W608 HydrophobicContact CG-CZ2 4.15Å; L605-W608 HydrophobicContact CG-CZ3 4.39Å; W608-D612 WeakPolarHBondContact CA-OD2 3.49Å; W608-D612 HydrophobicContact CB-CB 3.77Å; W608-D612 HydrophobicContact CD2-CB 4.19Å; W608-D612 HydrophobicContact CE3-CB 4.45Å; W608-D612 HydrophobicContact CG-CB 3.91Å; W608-V613 HydrophobicContact CE3-CG2 4.17Å; W608-F616 HydrophobicContact CH2-CB 4.25Å; W608-F616 HydrophobicContact CH2-CD2 4.27Å; W608-F616 HydrophobicContact CH2-CG 4.32Å; W608-F616 HydrophobicContact CZ3-CB 3.79Å; W608-F616 HydrophobicContact CZ3-CD1 4.4Å; W608-F616 HydrophobicContact CZ3-CD2 4.26Å; W608-F616 AromaticContact CZ3-CG 3.9Å; W608-F616 HydrophobicContact CZ3-CG 3.9Å; W608-G636 PolarHBondContact O-N 2.84Å; W608-L639 HydrophobicContact CE3-CD2 4.31Å; W608-L639 HydrophobicContact CZ3-CD2 4.08Å; W608-L668 HydrophobicContact CH2-CD1 4.11Å; W608-L668 HydrophobicContact CH2-CD2 4.06Å; W608-L668 HydrophobicContact CZ2-CD2 4.48Å; W608-L668 HydrophobicContact CZ3-CD1 4.34Å
609	D	85.9	Confident	71.5	Confident	92 Å²	92	54.5 Å²	54.5	49%	0.492	32%	0.316	S	S	.	.			trans	-81.5	-166.1	173.3	76.7	14.8	0	0	0	112	S607 D611 D612 V613	S607-D609 PolarHBondContact O-N 2.86Å; D609-D611 WeakPolarHBondContact OD1-CA 3.16Å; D609-D611 PolarHBondContact OD1-N 3.42Å; D609-D612 PolarHBondContact N-OD2 2.6Å; D609-D612 PolarHBondContact OD1-N 2.82Å; D609-V613 WeakPolarHBondContact O-CG2 3.42Å; D609-V613 PolarHBondContact O-N 3.15Å
610	C	87.8	Confident	73.7	Confident	40 Å²	40	52.5 Å²	52.5	27%	0.27	30%	0.303	S	S	.	.	H	α-helix	trans	-74.8	-30.6	178.9	-164.5	0	0	0	0	113.1	V613 C614	C610-V613 PolarHBondContact O-N 2.79Å; C610-C614 PolarHBondContact O-N 2.72Å; C610-C614 PolarHBondContact O-SG 3.1Å
611	D	86.4	Confident	76	Confident	75 Å²	75	49.1 Å²	49.1	40%	0.401	29%	0.294	S	S	.	.	H	α-helix	trans	-77.4	-34.8	176.4	-169.1	60.9	0	0	0	111.5	D609 V613 C614 Q615	D609-D611 WeakPolarHBondContact OD1-CA 3.16Å; D609-D611 PolarHBondContact OD1-N 3.42Å; D611-V613 PolarHBondContact O-N 3.35Å; D611-C614 CarbonylContact O-C 3.58Å; D611-C614 WeakPolarHBondContact O-CA 3.41Å; D611-C614 PolarHBondContact O-N 2.93Å; D611-Q615 WeakPolarHBondContact O-CB 3.24Å; D611-Q615 WeakPolarHBondContact O-CG 3.42Å; D611-Q615 PolarHBondContact O-N 2.88Å; D611-Q615 PolarHBondContact OD2-NE2 2.94Å
612	D	86.1	Confident	78.4	Confident	36 Å²	36	47 Å²	47	19%	0.193	27%	0.272	C	S	.	.	H	α-helix	trans	-53.7	-44.1	168.1	-81.9	-46.9	0	0	0	111.2	W608 D609 Q615 F616	W608-D612 WeakPolarHBondContact CA-OD2 3.49Å; W608-D612 HydrophobicContact CB-CB 3.77Å; W608-D612 HydrophobicContact CD2-CB 4.19Å; W608-D612 HydrophobicContact CE3-CB 4.45Å; W608-D612 HydrophobicContact CG-CB 3.91Å; D609-D612 PolarHBondContact N-OD2 2.6Å; D609-D612 PolarHBondContact OD1-N 2.82Å; D612-Q615 PolarHBondContact O-N 3.17Å; D612-F616 WeakPolarHBondContact O-CB 3.22Å; D612-F616 PolarHBondContact O-N 3.39Å
613	V	87.7	Confident	80.5	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-67.1	-37.5	175.1	173.1	0	0	0	0	111.8	W608 D609 C610 D611 F616 L617 F629 I634 L639	W608-V613 HydrophobicContact CE3-CG2 4.17Å; D609-V613 WeakPolarHBondContact O-CG2 3.42Å; D609-V613 PolarHBondContact O-N 3.15Å; C610-V613 PolarHBondContact O-N 2.79Å; D611-V613 PolarHBondContact O-N 3.35Å; V613-F616 PolarHBondContact O-N 2.76Å; V613-L617 HydrophobicContact CG1-CD1 4.25Å; V613-L617 WeakPolarHBondContact O-CG 3.45Å; V613-L617 PolarHBondContact O-N 3.42Å; V613-F629 HydrophobicContact CG1-CD1 3.85Å; V613-F629 HydrophobicContact CG1-CE1 4.43Å; V613-I634 WeakPolarHBondContact CB-O 3.2Å; V613-I634 HydrophobicContact CG1-CG2 4.28Å; V613-I634 WeakPolarHBondContact CG1-O 3.48Å; V613-I634 WeakPolarHBondContact CG2-O 3Å; V613-L639 HydrophobicContact CG1-CD1 4.47Å; V613-L639 HydrophobicContact CG1-CD2 4.33Å; V613-L639 HydrophobicContact CG2-CB 4.31Å; V613-L639 HydrophobicContact CG2-CD2 4.05Å
614	C	88.2	Confident	82.3	Confident	6 Å²	6	51.8 Å²	51.8	4%	0.041	29%	0.289	C	S	.	.	H	α-helix	trans	-69.1	-37.5	174.7	-67.6	0	0	0	0	113	C610 D611 L617 K618 V626	C610-C614 PolarHBondContact O-N 2.72Å; C610-C614 PolarHBondContact O-SG 3.1Å; D611-C614 CarbonylContact O-C 3.58Å; D611-C614 WeakPolarHBondContact O-CA 3.41Å; D611-C614 PolarHBondContact O-N 2.93Å; C614-L617 PolarHBondContact O-N 2.65Å; C614-K618 VanDerWaalsContact O-CG 3.27Å; C614-K618 WeakPolarHBondContact O-CG 3.04Å; C614-K618 PolarHBondContact O-N 2.9Å; C614-V626 HydrophobicContact CB-CG1 3.97Å; C614-V626 HydrophobicContact CB-CG2 4.23Å
615	Q	84	Confident	83.8	Confident	53 Å²	53	50.3 Å²	50.3	25%	0.248	28%	0.275	C	S	.	.	H	α-helix	trans	-64.1	-42.9	171.7	-71.1	-176	41.6	0	0	111	P592 D611 D612 L617 K618 S619	P592-Q615 HydrophobicContact CB-CG 4.49Å; D611-Q615 WeakPolarHBondContact O-CB 3.24Å; D611-Q615 WeakPolarHBondContact O-CG 3.42Å; D611-Q615 PolarHBondContact O-N 2.88Å; D611-Q615 PolarHBondContact OD2-NE2 2.94Å; D612-Q615 PolarHBondContact O-N 3.17Å; Q615-L617 PolarHBondContact O-N 3.19Å; Q615-K618 WeakPolarHBondContact O-CB 2.87Å; Q615-K618 PolarHBondContact O-N 2.7Å; Q615-S619 PolarHBondContact O-N 3.3Å
616	F	87.2	Confident	85.1	Confident	14 Å²	14	51.5 Å²	51.5	6%	0.061	28%	0.282	C	S	.	.	H	α-helix	trans	-59.2	-42.5	171.3	163.1	-105.5	0	0	0	112.6	W608 D612 V613 S619 V620 L639 R664 L668	W608-F616 HydrophobicContact CH2-CB 4.25Å; W608-F616 HydrophobicContact CH2-CD2 4.27Å; W608-F616 HydrophobicContact CH2-CG 4.32Å; W608-F616 HydrophobicContact CZ3-CB 3.79Å; W608-F616 HydrophobicContact CZ3-CD1 4.4Å; W608-F616 HydrophobicContact CZ3-CD2 4.26Å; W608-F616 AromaticContact CZ3-CG 3.9Å; W608-F616 HydrophobicContact CZ3-CG 3.9Å; D612-F616 WeakPolarHBondContact O-CB 3.22Å; D612-F616 PolarHBondContact O-N 3.39Å; V613-F616 PolarHBondContact O-N 2.76Å; F616-S619 PolarHBondContact O-N 2.9Å; F616-S619 PolarHBondContact O-OG 3.23Å; F616-V620 HydrophobicContact CD2-CG2 3.99Å; F616-V620 HydrophobicContact CE2-CG2 3.61Å; F616-V620 HydrophobicContact CZ-CG2 3.99Å; F616-V620 VanDerWaalsContact O-CG2 3.27Å; F616-V620 WeakPolarHBondContact O-CG2 3.36Å; F616-V620 PolarHBondContact O-N 2.91Å; F616-L639 HydrophobicContact CD1-CD2 3.83Å; F616-L639 HydrophobicContact CE1-CD1 4.15Å; F616-L639 HydrophobicContact CE1-CD2 3.81Å; F616-R664 HydrophobicContact CE2-CB 4.03Å; F616-R664 HydrophobicContact CZ-CB 3.7Å; F616-L668 HydrophobicContact CD2-CD1 4.14Å; F616-L668 HydrophobicContact CE1-CD1 4.47Å; F616-L668 HydrophobicContact CE2-CD1 3.54Å; F616-L668 HydrophobicContact CZ-CD1 3.72Å
617	L	88.7	Confident	86.1	Confident	1 Å²	1	50.1 Å²	50.1	1%	0.005	28%	0.28	C	S	.	.	H	α-helix	trans	-65.4	-41.5	176.8	-73.1	163.2	0	0	0	112.4	V613 C614 Q615 V620 G621 L622 V626 F629	V613-L617 HydrophobicContact CG1-CD1 4.25Å; V613-L617 WeakPolarHBondContact O-CG 3.45Å; V613-L617 PolarHBondContact O-N 3.42Å; C614-L617 PolarHBondContact O-N 2.65Å; Q615-L617 PolarHBondContact O-N 3.19Å; L617-V620 PolarHBondContact O-N 3.27Å; L617-G621 PolarHBondContact O-N 2.93Å; L617-L622 HydrophobicContact CD2-CB 4.13Å; L617-L622 CarbonylContact O-C 3.57Å; L617-L622 WeakPolarHBondContact O-CA 3.21Å; L617-L622 PolarHBondContact O-N 2.9Å; L617-V626 HydrophobicContact CB-CG2 3.96Å; L617-V626 HydrophobicContact CD1-CG2 4.46Å; L617-F629 HydrophobicContact CD1-CB 3.63Å; L617-F629 HydrophobicContact CD1-CD1 3.68Å; L617-F629 HydrophobicContact CD1-CD2 3.48Å; L617-F629 VanDerWaalsContact CD1-CD2 3.48Å; L617-F629 HydrophobicContact CD1-CE1 4.13Å; L617-F629 HydrophobicContact CD1-CE2 3.92Å; L617-F629 HydrophobicContact CD1-CG 3.33Å; L617-F629 HydrophobicContact CD1-CZ 4.24Å; L617-F629 HydrophobicContact CD2-CD2 4.35Å; L617-F629 HydrophobicContact CD2-CE1 4.42Å; L617-F629 HydrophobicContact CD2-CE2 3.93Å; L617-F629 HydrophobicContact CD2-CZ 4Å
618	K	86.1	Confident	86.8	Confident	97 Å²	97	49.6 Å²	49.6	42%	0.422	27%	0.27	S	S	.	.	H	α-helix	trans	-56.8	-49.9	170.8	-67.4	162.2	-172	165.8	0	110.2	C614 Q615 V620 G621 E623 V626	C614-K618 VanDerWaalsContact O-CG 3.27Å; C614-K618 WeakPolarHBondContact O-CG 3.04Å; C614-K618 PolarHBondContact O-N 2.9Å; Q615-K618 WeakPolarHBondContact O-CB 2.87Å; Q615-K618 PolarHBondContact O-N 2.7Å; K618-V620 PolarHBondContact O-N 2.69Å; K618-V620 VanDerWaalsContact O-N 3.15Å; K618-G621 PolarHBondContact O-N 2.77Å; K618-E623 HydrophobicContact CG-CB 4.25Å; K618-V626 HydrophobicContact CG-CG2 4.19Å
619	S	83.1	Confident	87.1	Confident	71 Å²	71	48.2 Å²	48.2	50%	0.497	27%	0.265	S	S	.	.	H	α-helix	trans	-65.3	-18.7	-179.4	83.5	0	0	0	0	114.7	Q615 F616	Q615-S619 PolarHBondContact O-N 3.3Å; F616-S619 PolarHBondContact O-N 2.9Å; F616-S619 PolarHBondContact O-OG 3.23Å
620	V	83	Confident	87.2	Confident	19 Å²	19	46.2 Å²	46.2	12%	0.115	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.1	-5.9	176.5	175.1	0	0	0	0	112.3	F616 L617 K618 L622 L660 R664	F616-V620 HydrophobicContact CD2-CG2 3.99Å; F616-V620 HydrophobicContact CE2-CG2 3.61Å; F616-V620 HydrophobicContact CZ-CG2 3.99Å; F616-V620 VanDerWaalsContact O-CG2 3.27Å; F616-V620 WeakPolarHBondContact O-CG2 3.36Å; F616-V620 PolarHBondContact O-N 2.91Å; L617-V620 PolarHBondContact O-N 3.27Å; K618-V620 PolarHBondContact O-N 2.69Å; K618-V620 VanDerWaalsContact O-N 3.15Å; V620-L622 HydrophobicContact CG1-CD1 3.68Å; V620-L622 HydrophobicContact CG1-CG 4Å; V620-L660 HydrophobicContact CG1-CD1 4.36Å; V620-L660 HydrophobicContact CG1-CD2 3.8Å; V620-L660 HydrophobicContact CG1-CG 3.78Å; V620-R664 HydrophobicContact CG1-CG 3.92Å; V620-R664 HydrophobicContact CG2-CB 4.48Å; V620-R664 HydrophobicContact CG2-CG 3.94Å
621	G	85.9	Confident	87.3	Confident	56 Å²	56	50.4 Å²	50.4	58%	0.577	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.8	27.3	-175	0	0	0	0	0	113.2	L617 K618	L617-G621 PolarHBondContact O-N 2.93Å; K618-G621 PolarHBondContact O-N 2.77Å
622	L	87	Confident	87.3	Confident	2 Å²	2	50.6 Å²	50.6	1%	0.01	29%	0.286	C	S	.	.			trans	-119	24.7	-177.1	-66.9	177.8	0	0	0	112.5	L617 V620 K624 Y625 D657 L660 I661	L617-L622 HydrophobicContact CD2-CB 4.13Å; L617-L622 CarbonylContact O-C 3.57Å; L617-L622 WeakPolarHBondContact O-CA 3.21Å; L617-L622 PolarHBondContact O-N 2.9Å; V620-L622 HydrophobicContact CG1-CD1 3.68Å; V620-L622 HydrophobicContact CG1-CG 4Å; L622-K624 PolarHBondContact O-N 3.28Å; L622-K624 VanDerWaalsContact O-N 3.09Å; L622-Y625 HydrophobicContact CB-CD2 4.35Å; L622-Y625 HydrophobicContact CD2-CD2 4.2Å; L622-Y625 HydrophobicContact CD2-CE2 4.25Å; L622-Y625 PolarHBondContact O-N 2.79Å; L622-D657 HydrophobicContact CD2-CB 3.85Å; L622-L660 HydrophobicContact CD1-CD2 4.16Å; L622-L660 HydrophobicContact CD1-CG 4.33Å; L622-L660 HydrophobicContact CD2-CD2 4.36Å; L622-L660 HydrophobicContact CG-CD2 4.24Å; L622-I661 HydrophobicContact CD1-CD1 4.06Å; L622-I661 HydrophobicContact CD1-CG1 3.38Å
623	E	88.3	Confident	87.3	Confident	133 Å²	133	50.3 Å²	50.3	62%	0.621	29%	0.291	S	S	*	.	G	3₁₀ helix	trans	-49.2	-33.8	178.1	65.6	-167.8	174.1	0	0	114.1	K618 Y625 V626	K618-E623 HydrophobicContact CG-CB 4.25Å; E623-Y625 PolarHBondContact O-N 3.43Å; E623-V626 VanDerWaalsContact O-CB 3.24Å; E623-V626 WeakPolarHBondContact O-CB 3.25Å; E623-V626 WeakPolarHBondContact O-CG2 3.38Å; E623-V626 PolarHBondContact O-N 3.01Å
624	K	89.2	Confident	87.4	Confident	124 Å²	124	50.9 Å²	50.9	54%	0.539	29%	0.294	S	S	.	.	G	3₁₀ helix	trans	-58	-18.6	175.4	71.6	-164	-176.7	-165.6	0	114.6	L622 D657	L622-K624 PolarHBondContact O-N 3.28Å; L622-K624 VanDerWaalsContact O-N 3.09Å; K624-D657 WeakPolarHBondContact CE-OD2 3.23Å; K624-D657 IonicContact NZ-OD1 2.72Å; K624-D657 PolarHBondContact NZ-OD1 2.77Å; K624-D657 IonicContact NZ-OD2 3.26Å; K624-D657 PolarHBondContact NZ-OD2 2.66Å
625	Y	90.6	Very high	87.3	Confident	28 Å²	28	52.5 Å²	52.5	11%	0.11	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-101.7	-1.7	175.8	-62.1	-61.4	0	0	0	113.7	L622 E623 P627 E628 F629 I652 D657	L622-Y625 HydrophobicContact CB-CD2 4.35Å; L622-Y625 HydrophobicContact CD2-CD2 4.2Å; L622-Y625 HydrophobicContact CD2-CE2 4.25Å; L622-Y625 PolarHBondContact O-N 2.79Å; E623-Y625 PolarHBondContact O-N 3.43Å; Y625-P627 VanDerWaalsContact C-CD 3.48Å; Y625-P627 VanDerWaalsContact C-N 3.31Å; Y625-E628 WeakPolarHBondContact CD1-OE2 3.21Å; Y625-E628 PolarHBondContact O-N 3.31Å; Y625-F629 WeakPolarHBondContact O-CD2 3.39Å; Y625-F629 PolarHBondContact O-N 3.39Å; Y625-I652 HydrophobicContact CD1-CB 4.45Å; Y625-I652 HydrophobicContact CD1-CD1 4.47Å; Y625-I652 HydrophobicContact CD1-CG1 3.81Å; Y625-I652 HydrophobicContact CD1-CG2 4.28Å; Y625-I652 HydrophobicContact CD2-CG2 4.29Å; Y625-I652 HydrophobicContact CE1-CB 4.18Å; Y625-I652 HydrophobicContact CE1-CG1 4.03Å; Y625-I652 HydrophobicContact CE1-CG2 3.88Å; Y625-I652 HydrophobicContact CE2-CG2 3.85Å; Y625-I652 HydrophobicContact CG-CD1 4.44Å; Y625-I652 HydrophobicContact CG-CG1 4.25Å; Y625-I652 HydrophobicContact CG-CG2 4.49Å; Y625-D657 HydrophobicContact CE2-CB 3.72Å; Y625-D657 WeakPolarHBondContact CE2-OD2 3.08Å; Y625-D657 PolarHBondContact OH-OD2 3.21Å
626	V	88.3	Confident	87.4	Confident	27 Å²	27	50 Å²	50	16%	0.164	29%	0.291	C	S	.	.	H	α-helix	trans	-52.7	-42.8	175.3	163.7	0	0	0	0	112.3	C614 L617 K618 E623 E628 F629 A630	C614-V626 HydrophobicContact CB-CG1 3.97Å; C614-V626 HydrophobicContact CB-CG2 4.23Å; L617-V626 HydrophobicContact CB-CG2 3.96Å; L617-V626 HydrophobicContact CD1-CG2 4.46Å; K618-V626 HydrophobicContact CG-CG2 4.19Å; E623-V626 VanDerWaalsContact O-CB 3.24Å; E623-V626 WeakPolarHBondContact O-CB 3.25Å; E623-V626 WeakPolarHBondContact O-CG2 3.38Å; E623-V626 PolarHBondContact O-N 3.01Å; V626-E628 PolarHBondContact O-N 3.23Å; V626-F629 PolarHBondContact O-N 3.16Å; V626-A630 VanDerWaalsContact O-CB 3.28Å; V626-A630 WeakPolarHBondContact O-CB 3.48Å; V626-A630 PolarHBondContact O-N 2.92Å
627	P	87.6	Confident	87.2	Confident	82 Å²	82	52 Å²	52	53%	0.532	31%	0.305	S	S	.	.	H	α-helix	trans	-61	-40.7	174.9	-24.6	35.6	0	0	0	113.6	Y625 A630 V631	Y625-P627 VanDerWaalsContact C-CD 3.48Å; Y625-P627 VanDerWaalsContact C-N 3.31Å; P627-A630 PolarHBondContact O-N 3.33Å; P627-V631 WeakPolarHBondContact O-CB 2.95Å; P627-V631 VanDerWaalsContact O-CG2 3.26Å; P627-V631 WeakPolarHBondContact O-CG2 3.35Å; P627-V631 PolarHBondContact O-N 3.12Å
628	E	88.9	Confident	87.1	Confident	56 Å²	56	56.5 Å²	56.5	26%	0.262	33%	0.325	S	S	.	.	H	α-helix	trans	-67.5	-40.9	179.2	-68.1	-176.1	176.9	0	0	111.6	Y625 V626 N632 G651 I652	Y625-E628 WeakPolarHBondContact CD1-OE2 3.21Å; Y625-E628 PolarHBondContact O-N 3.31Å; V626-E628 PolarHBondContact O-N 3.23Å; E628-N632 WeakPolarHBondContact O-CB 3.41Å; E628-N632 PolarHBondContact O-N 3Å; E628-N632 VanDerWaalsContact O-N 3.09Å; E628-N632 PolarHBondContact O-ND2 3.14Å; E628-G651 WeakPolarHBondContact OE1-CA 3.46Å; E628-I652 WeakPolarHBondContact OE2-CG1 3.31Å
629	F	89.9	Confident	87.1	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-70.1	-36.9	176.5	-83.6	-108.5	0	0	0	112.7	V613 L617 Y625 V626 G633 I634 L639 L642 L647 M650 I652 I661	V613-F629 HydrophobicContact CG1-CD1 3.85Å; V613-F629 HydrophobicContact CG1-CE1 4.43Å; L617-F629 HydrophobicContact CD1-CB 3.63Å; L617-F629 HydrophobicContact CD1-CD1 3.68Å; L617-F629 HydrophobicContact CD1-CD2 3.48Å; L617-F629 VanDerWaalsContact CD1-CD2 3.48Å; L617-F629 HydrophobicContact CD1-CE1 4.13Å; L617-F629 HydrophobicContact CD1-CE2 3.92Å; L617-F629 HydrophobicContact CD1-CG 3.33Å; L617-F629 HydrophobicContact CD1-CZ 4.24Å; L617-F629 HydrophobicContact CD2-CD2 4.35Å; L617-F629 HydrophobicContact CD2-CE1 4.42Å; L617-F629 HydrophobicContact CD2-CE2 3.93Å; L617-F629 HydrophobicContact CD2-CZ 4Å; Y625-F629 WeakPolarHBondContact O-CD2 3.39Å; Y625-F629 PolarHBondContact O-N 3.39Å; V626-F629 PolarHBondContact O-N 3.16Å; F629-G633 PolarHBondContact O-N 3.5Å; F629-G633 VanDerWaalsContact O-N 3.09Å; F629-I634 HydrophobicContact CB-CB 4.44Å; F629-I634 HydrophobicContact CB-CG1 4.47Å; F629-I634 HydrophobicContact CD1-CB 3.72Å; F629-I634 HydrophobicContact CD1-CG1 3.9Å; F629-I634 HydrophobicContact CD1-CG2 3.7Å; F629-I634 HydrophobicContact CE1-CG2 4.07Å; F629-I634 HydrophobicContact CG-CB 4.46Å; F629-I634 HydrophobicContact CG-CG1 4.39Å; F629-I634 PolarHBondContact O-N 2.9Å; F629-L639 HydrophobicContact CE1-CD1 3.96Å; F629-L642 HydrophobicContact CE1-CD1 3.55Å; F629-L642 HydrophobicContact CZ-CD1 3.91Å; F629-L647 HydrophobicContact CZ-CD2 4.3Å; F629-M650 HydrophobicContact CE1-CE 4.42Å; F629-M650 HydrophobicContact CE2-CE 4.31Å; F629-M650 HydrophobicContact CZ-CE 4.16Å; F629-I652 HydrophobicContact CD2-CD1 4.36Å; F629-I652 HydrophobicContact CE2-CD1 3.49Å; F629-I652 VanDerWaalsContact CE2-CD1 3.49Å; F629-I652 HydrophobicContact CZ-CD1 4.13Å; F629-I661 HydrophobicContact CE2-CD1 4.34Å; F629-I661 HydrophobicContact CZ-CD1 4.23Å
630	A	88.1	Confident	87.1	Confident	50 Å²	50	50.3 Å²	50.3	41%	0.413	29%	0.291	S	S	.	.	H	α-helix	trans	-67.1	-46.5	176.2	0	0	0	0	0	112	V626 P627 N632 G633	V626-A630 VanDerWaalsContact O-CB 3.28Å; V626-A630 WeakPolarHBondContact O-CB 3.48Å; V626-A630 PolarHBondContact O-N 2.92Å; P627-A630 PolarHBondContact O-N 3.33Å; A630-N632 VanDerWaalsContact C-N 3.31Å; A630-N632 PolarHBondContact O-N 2.72Å; A630-G633 PolarHBondContact O-N 2.9Å
631	V	88.7	Confident	87.2	Confident	129 Å²	129	53.3 Å²	53.3	78%	0.782	31%	0.311	S	S	*	.	H	α-helix	trans	-64.9	-34.2	177.5	169.7	0	0	0	0	112	P627 G633	P627-V631 WeakPolarHBondContact O-CB 2.95Å; P627-V631 VanDerWaalsContact O-CG2 3.26Å; P627-V631 WeakPolarHBondContact O-CG2 3.35Å; P627-V631 PolarHBondContact O-N 3.12Å; V631-G633 VanDerWaalsContact C-N 3.28Å; V631-G633 PolarHBondContact O-N 3.02Å
632	N	86.3	Confident	87.1	Confident	79 Å²	79	51.9 Å²	51.9	42%	0.422	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	1.7	173.3	-72.3	-80.9	0	0	0	113.7	E628 A630 I634 M650	E628-N632 WeakPolarHBondContact O-CB 3.41Å; E628-N632 PolarHBondContact O-N 3Å; E628-N632 VanDerWaalsContact O-N 3.09Å; E628-N632 PolarHBondContact O-ND2 3.14Å; A630-N632 VanDerWaalsContact C-N 3.31Å; A630-N632 PolarHBondContact O-N 2.72Å; N632-I634 HydrophobicContact CB-CD1 3.96Å; N632-I634 HydrophobicContact CB-CG1 3.94Å; N632-I634 PolarHBondContact O-N 3.31Å; N632-M650 HydrophobicContact CB-CG 4.44Å; N632-M650 HydrophobicContact CB-SD 3.93Å
633	G	87.5	Confident	86.9	Confident	29 Å²	29	55.2 Å²	55.2	30%	0.299	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.3	46.1	176.2	0	0	0	0	0	113.7	F629 A630 V631 D635 K638	F629-G633 PolarHBondContact O-N 3.5Å; F629-G633 VanDerWaalsContact O-N 3.09Å; A630-G633 PolarHBondContact O-N 2.9Å; V631-G633 VanDerWaalsContact C-N 3.28Å; V631-G633 PolarHBondContact O-N 3.02Å; G633-D635 PolarHBondContact O-N 3.44Å; G633-K638 VanDerWaalsContact O-CD 3.23Å; G633-K638 WeakPolarHBondContact O-CD 3.19Å; G633-K638 PolarHBondContact O-NZ 2.81Å
634	I	88.3	Confident	86.6	Confident	12 Å²	12	50.2 Å²	50.2	6%	0.062	29%	0.292	C	S	.	.			trans	-82.8	100.3	-174.1	-55.1	-60.8	0	0	0	110.8	V613 F629 N632 K638 L639 L642 M650	V613-I634 WeakPolarHBondContact CB-O 3.2Å; V613-I634 HydrophobicContact CG1-CG2 4.28Å; V613-I634 WeakPolarHBondContact CG1-O 3.48Å; V613-I634 WeakPolarHBondContact CG2-O 3Å; F629-I634 HydrophobicContact CB-CB 4.44Å; F629-I634 HydrophobicContact CB-CG1 4.47Å; F629-I634 HydrophobicContact CD1-CB 3.72Å; F629-I634 HydrophobicContact CD1-CG1 3.9Å; F629-I634 HydrophobicContact CD1-CG2 3.7Å; F629-I634 HydrophobicContact CE1-CG2 4.07Å; F629-I634 HydrophobicContact CG-CB 4.46Å; F629-I634 HydrophobicContact CG-CG1 4.39Å; F629-I634 PolarHBondContact O-N 2.9Å; N632-I634 HydrophobicContact CB-CD1 3.96Å; N632-I634 HydrophobicContact CB-CG1 3.94Å; N632-I634 PolarHBondContact O-N 3.31Å; I634-K638 HydrophobicContact CD1-CB 4.23Å; I634-K638 HydrophobicContact CD1-CD 4.37Å; I634-K638 HydrophobicContact CG2-CB 3.96Å; I634-L639 HydrophobicContact CG2-CB 4.06Å; I634-L642 HydrophobicContact CD1-CD2 4.45Å; I634-L642 HydrophobicContact CG2-CD1 4.38Å; I634-M650 HydrophobicContact CD1-SD 3.95Å; I634-M650 HydrophobicContact CG1-SD 4.03Å
635	D	87.7	Confident	86.4	Confident	40 Å²	40	46.2 Å²	46.2	21%	0.214	29%	0.287	C	S	.	.			trans	-78.2	174.4	166.4	53.5	54.7	0	0	0	112.9	G633 P637 K638 L639	G633-D635 PolarHBondContact O-N 3.44Å; D635-P637 VanDerWaalsContact OD1-CD 3.28Å; D635-P637 WeakPolarHBondContact OD1-CD 3.11Å; D635-K638 PolarHBondContact O-N 3.33Å; D635-K638 WeakPolarHBondContact OD1-CB 3.28Å; D635-K638 VanDerWaalsContact OD1-CG 3.26Å; D635-K638 WeakPolarHBondContact OD1-CG 3.41Å; D635-K638 PolarHBondContact OD1-N 2.86Å; D635-K638 VanDerWaalsContact OD2-CD 3.28Å; D635-K638 WeakPolarHBondContact OD2-CD 3.46Å; D635-K638 WeakPolarHBondContact OD2-CE 3.33Å; D635-K638 IonicContact OD2-NZ 2.75Å; D635-K638 PolarHBondContact OD2-NZ 2.81Å; D635-L639 WeakPolarHBondContact O-CB 3.23Å; D635-L639 PolarHBondContact O-N 2.91Å
636	G	84.3	Confident	86.3	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-53.1	-50.8	177	0	0	0	0	0	114.7	L605 W608 K638 L639 L640	L605-G636 WeakPolarHBondContact O-CA 3.26Å; W608-G636 PolarHBondContact O-N 2.84Å; G636-K638 PolarHBondContact O-N 3.5Å; G636-L639 WeakPolarHBondContact O-CB 3.37Å; G636-L639 PolarHBondContact O-N 2.81Å; G636-L640 WeakPolarHBondContact O-CG 3.28Å; G636-L640 PolarHBondContact O-N 3.37Å
637	P	84.2	Confident	86.3	Confident	56 Å²	56	48.3 Å²	48.3	36%	0.364	29%	0.294	S	S	.	.	H	α-helix	trans	-53.2	-46.4	172.4	-29	35.4	0	0	0	114	D635 L640 C641	D635-P637 VanDerWaalsContact OD1-CD 3.28Å; D635-P637 WeakPolarHBondContact OD1-CD 3.11Å; P637-L640 PolarHBondContact O-N 3.34Å; P637-C641 PolarHBondContact O-N 3.31Å
638	K	86	Confident	86.3	Confident	97 Å²	97	49.6 Å²	49.6	42%	0.422	29%	0.291	S	S	.	.	H	α-helix	trans	-65.1	-41.7	176	-72.4	166.7	-169.8	142.6	0	111.9	G633 I634 D635 G636 L640 C641 L642	G633-K638 VanDerWaalsContact O-CD 3.23Å; G633-K638 WeakPolarHBondContact O-CD 3.19Å; G633-K638 PolarHBondContact O-NZ 2.81Å; I634-K638 HydrophobicContact CD1-CB 4.23Å; I634-K638 HydrophobicContact CD1-CD 4.37Å; I634-K638 HydrophobicContact CG2-CB 3.96Å; D635-K638 PolarHBondContact O-N 3.33Å; D635-K638 WeakPolarHBondContact OD1-CB 3.28Å; D635-K638 VanDerWaalsContact OD1-CG 3.26Å; D635-K638 WeakPolarHBondContact OD1-CG 3.41Å; D635-K638 PolarHBondContact OD1-N 2.86Å; D635-K638 VanDerWaalsContact OD2-CD 3.28Å; D635-K638 WeakPolarHBondContact OD2-CD 3.46Å; D635-K638 WeakPolarHBondContact OD2-CE 3.33Å; D635-K638 IonicContact OD2-NZ 2.75Å; D635-K638 PolarHBondContact OD2-NZ 2.81Å; G636-K638 PolarHBondContact O-N 3.5Å; K638-L640 VanDerWaalsContact C-N 3.28Å; K638-L640 PolarHBondContact O-N 2.89Å; K638-C641 CarbonylContact O-C 3.13Å; K638-C641 WeakPolarHBondContact O-CA 3.39Å; K638-C641 PolarHBondContact O-N 3.37Å; K638-L642 PolarHBondContact O-N 2.72Å
639	L	86.6	Confident	86.2	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-56.6	-41.8	175.8	176.8	67.2	0	0	0	111.2	W608 V613 F616 F629 I634 D635 G636 C641 L642 V665	W608-L639 HydrophobicContact CE3-CD2 4.31Å; W608-L639 HydrophobicContact CZ3-CD2 4.08Å; V613-L639 HydrophobicContact CG1-CD1 4.47Å; V613-L639 HydrophobicContact CG1-CD2 4.33Å; V613-L639 HydrophobicContact CG2-CB 4.31Å; V613-L639 HydrophobicContact CG2-CD2 4.05Å; F616-L639 HydrophobicContact CD1-CD2 3.83Å; F616-L639 HydrophobicContact CE1-CD1 4.15Å; F616-L639 HydrophobicContact CE1-CD2 3.81Å; F629-L639 HydrophobicContact CE1-CD1 3.96Å; I634-L639 HydrophobicContact CG2-CB 4.06Å; D635-L639 WeakPolarHBondContact O-CB 3.23Å; D635-L639 PolarHBondContact O-N 2.91Å; G636-L639 WeakPolarHBondContact O-CB 3.37Å; G636-L639 PolarHBondContact O-N 2.81Å; L639-C641 PolarHBondContact O-N 3.36Å; L639-L642 HydrophobicContact CD1-CD1 4.17Å; L639-L642 PolarHBondContact O-N 3.37Å; L639-V665 HydrophobicContact CD1-CG2 3.75Å; L639-V665 HydrophobicContact CG-CG2 3.93Å
640	L	83.3	Confident	86	Confident	38 Å²	38	52.3 Å²	52.3	20%	0.199	32%	0.319	C	S	.	.	H	α-helix	trans	-64.4	-25.8	173.3	-68.1	-172.6	0	0	0	113.4	L605 G636 P637 K638 V665 K669	L605-L640 HydrophobicContact CD2-CD1 3.87Å; L605-L640 HydrophobicContact CD2-CD2 3.6Å; L605-L640 HydrophobicContact CD2-CG 3.55Å; G636-L640 WeakPolarHBondContact O-CG 3.28Å; G636-L640 PolarHBondContact O-N 3.37Å; P637-L640 PolarHBondContact O-N 3.34Å; K638-L640 VanDerWaalsContact C-N 3.28Å; K638-L640 PolarHBondContact O-N 2.89Å; L640-V665 HydrophobicContact CD2-CG1 4.21Å; L640-K669 HydrophobicContact CD2-CD 4.29Å; L640-K669 HydrophobicContact CD2-CG 3.58Å; L640-K669 WeakPolarHBondContact O-CE 3.49Å; L640-K669 PolarHBondContact O-NZ 3.05Å
641	C	83.9	Confident	85.7	Confident	81 Å²	81	50.7 Å²	50.7	55%	0.547	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.2	8.3	-177.9	-73.3	0	0	0	0	114.3	P637 K638 L639 K646	P637-C641 PolarHBondContact O-N 3.31Å; K638-C641 CarbonylContact O-C 3.13Å; K638-C641 WeakPolarHBondContact O-CA 3.39Å; K638-C641 PolarHBondContact O-N 3.37Å; L639-C641 PolarHBondContact O-N 3.36Å; C641-K646 PolarHBondContact O-NZ 3.5Å
642	L	84.3	Confident	85.6	Confident	27 Å²	27	44.5 Å²	44.5	14%	0.141	27%	0.27	C	S	.	.			trans	-74.8	137.1	173.6	-66.8	-176.5	0	0	0	112.7	F629 I634 K638 L639 K646 L647 M650	F629-L642 HydrophobicContact CE1-CD1 3.55Å; F629-L642 HydrophobicContact CZ-CD1 3.91Å; I634-L642 HydrophobicContact CD1-CD2 4.45Å; I634-L642 HydrophobicContact CG2-CD1 4.38Å; K638-L642 PolarHBondContact O-N 2.72Å; L639-L642 HydrophobicContact CD1-CD1 4.17Å; L639-L642 PolarHBondContact O-N 3.37Å; L642-K646 HydrophobicContact CD2-CB 4.09Å; L642-K646 HydrophobicContact CD2-CD 4.33Å; L642-L647 HydrophobicContact CB-CD2 4.49Å; L642-L647 HydrophobicContact CD1-CD2 3.91Å; L642-M650 HydrophobicContact CD1-CE 3.89Å; L642-M650 HydrophobicContact CD2-CE 3.96Å; L642-M650 HydrophobicContact CD2-SD 4.4Å
643	D	83.6	Confident	85.6	Confident	71 Å²	71	48.7 Å²	48.7	38%	0.38	28%	0.281	S	S	.	.			trans	-124	176.2	175.8	64.3	60.3	0	0	0	111.6	G645 K646 L647	D643-G645 PolarHBondContact O-N 3.17Å; D643-G645 VanDerWaalsContact OD1-CA 3.28Å; D643-G645 WeakPolarHBondContact OD1-CA 3.36Å; D643-G645 PolarHBondContact OD1-N 3.42Å; D643-K646 PolarHBondContact O-N 2.7Å; D643-K646 PolarHBondContact OD1-N 2.83Å; D643-K646 VanDerWaalsContact OD2-CD 3.26Å; D643-K646 WeakPolarHBondContact OD2-CD 3.39Å; D643-K646 WeakPolarHBondContact OD2-CE 3.44Å; D643-K646 WeakPolarHBondContact OD2-CG 3.5Å; D643-K646 IonicContact OD2-NZ 2.88Å; D643-L647 WeakPolarHBondContact O-CD1 3.33Å; D643-L647 VanDerWaalsContact O-CG 3.25Å; D643-L647 WeakPolarHBondContact O-CG 3.45Å; D643-L647 PolarHBondContact O-N 3.01Å; D643-L647 VanDerWaalsContact O-N 3.09Å
644	G	81.8	Confident	85.7	Confident	28 Å²	28	50.7 Å²	50.7	29%	0.289	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-12.3	-177.4	0	0	0	0	0	115.7
645	G	85.5	Confident	85.6	Confident	41 Å²	41	56.5 Å²	56.5	42%	0.423	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.7	-49.4	173.1	0	0	0	0	0	111.8	D643 L647 K648 A649	D643-G645 PolarHBondContact O-N 3.17Å; D643-G645 VanDerWaalsContact OD1-CA 3.28Å; D643-G645 WeakPolarHBondContact OD1-CA 3.36Å; D643-G645 PolarHBondContact OD1-N 3.42Å; G645-L647 VanDerWaalsContact C-N 3.27Å; G645-L647 PolarHBondContact O-N 3.09Å; G645-K648 WeakPolarHBondContact O-CA 3.48Å; G645-K648 WeakPolarHBondContact O-CB 3.43Å; G645-K648 PolarHBondContact O-N 3.42Å; G645-A649 PolarHBondContact O-N 3.07Å
646	K	87.3	Confident	85.7	Confident	97 Å²	97	57.3 Å²	57.3	42%	0.422	32%	0.324	S	S	.	.	H	α-helix	trans	-54.9	-42.7	174.3	-68.1	175.1	-171.2	175.2	0	112.1	C641 L642 D643 K648 A649 M650	C641-K646 PolarHBondContact O-NZ 3.5Å; L642-K646 HydrophobicContact CD2-CB 4.09Å; L642-K646 HydrophobicContact CD2-CD 4.33Å; D643-K646 PolarHBondContact O-N 2.7Å; D643-K646 PolarHBondContact OD1-N 2.83Å; D643-K646 VanDerWaalsContact OD2-CD 3.26Å; D643-K646 WeakPolarHBondContact OD2-CD 3.39Å; D643-K646 WeakPolarHBondContact OD2-CE 3.44Å; D643-K646 WeakPolarHBondContact OD2-CG 3.5Å; D643-K646 IonicContact OD2-NZ 2.88Å; K646-K648 VanDerWaalsContact C-N 3.3Å; K646-K648 PolarHBondContact O-N 3.09Å; K646-A649 WeakPolarHBondContact O-CB 3.48Å; K646-A649 PolarHBondContact O-N 3.02Å; K646-A649 VanDerWaalsContact O-N 3.08Å; K646-M650 WeakPolarHBondContact O-CG 3.27Å; K646-M650 PolarHBondContact O-N 3.41Å; K646-M650 VanDerWaalsContact O-N 3.09Å
647	L	88.7	Confident	85.9	Confident	1 Å²	1	58.1 Å²	58.1	1%	0.005	33%	0.328	C	S	.	.	H	α-helix	trans	-60.4	-36.5	174.7	-67	166	0	0	0	112.7	F629 L642 D643 G645 M650 I652 R658 I661 K662	F629-L647 HydrophobicContact CZ-CD2 4.3Å; L642-L647 HydrophobicContact CB-CD2 4.49Å; L642-L647 HydrophobicContact CD1-CD2 3.91Å; D643-L647 WeakPolarHBondContact O-CD1 3.33Å; D643-L647 VanDerWaalsContact O-CG 3.25Å; D643-L647 WeakPolarHBondContact O-CG 3.45Å; D643-L647 PolarHBondContact O-N 3.01Å; D643-L647 VanDerWaalsContact O-N 3.09Å; G645-L647 VanDerWaalsContact C-N 3.27Å; G645-L647 PolarHBondContact O-N 3.09Å; L647-M650 HydrophobicContact CD2-CE 3.95Å; L647-I652 HydrophobicContact CD2-CD1 3.72Å; L647-I652 WeakPolarHBondContact O-CA 3.36Å; L647-I652 WeakPolarHBondContact O-CB 3.46Å; L647-I652 PolarHBondContact O-N 2.91Å; L647-I652 VanDerWaalsContact O-N 3.08Å; L647-R658 HydrophobicContact CB-CG 3.8Å; L647-R658 HydrophobicContact CD1-CB 4.33Å; L647-R658 HydrophobicContact CD1-CG 4.14Å; L647-I661 HydrophobicContact CD1-CG2 4.43Å; L647-I661 HydrophobicContact CD2-CD1 3.96Å; L647-I661 HydrophobicContact CD2-CG2 4.05Å; L647-K662 HydrophobicContact CD1-CD 4.5Å; L647-K662 HydrophobicContact CD1-CG 4Å
648	K	87.3	Confident	86.1	Confident	109 Å²	109	56.9 Å²	56.9	47%	0.474	32%	0.317	S	S	.	.	H	α-helix	trans	-67.4	-40.9	172.3	-71.6	-177.9	176.3	-173.2	0	111.6	G645 K646 M650 G651	G645-K648 WeakPolarHBondContact O-CA 3.48Å; G645-K648 WeakPolarHBondContact O-CB 3.43Å; G645-K648 PolarHBondContact O-N 3.42Å; K646-K648 VanDerWaalsContact C-N 3.3Å; K646-K648 PolarHBondContact O-N 3.09Å; K648-M650 VanDerWaalsContact C-N 3.28Å; K648-M650 PolarHBondContact O-N 3.12Å; K648-G651 PolarHBondContact O-N 2.93Å
649	A	87.2	Confident	86.2	Confident	88 Å²	88	54.2 Å²	54.2	73%	0.727	31%	0.312	S	S	*	.	H	α-helix	trans	-65.9	-28	-176.6	0	0	0	0	0	113.3	G645 K646	G645-A649 PolarHBondContact O-N 3.07Å; K646-A649 WeakPolarHBondContact O-CB 3.48Å; K646-A649 PolarHBondContact O-N 3.02Å; K646-A649 VanDerWaalsContact O-N 3.08Å
650	M	84.8	Confident	86.2	Confident	25 Å²	25	56.9 Å²	56.9	12%	0.123	33%	0.326	C	S	.	.	H	α-helix	trans	-78.5	-16.7	176	-64.2	-172	-56.2	0	0	114.3	F629 N632 I634 L642 K646 L647 K648 I652	F629-M650 HydrophobicContact CE1-CE 4.42Å; F629-M650 HydrophobicContact CE2-CE 4.31Å; F629-M650 HydrophobicContact CZ-CE 4.16Å; N632-M650 HydrophobicContact CB-CG 4.44Å; N632-M650 HydrophobicContact CB-SD 3.93Å; I634-M650 HydrophobicContact CD1-SD 3.95Å; I634-M650 HydrophobicContact CG1-SD 4.03Å; L642-M650 HydrophobicContact CD1-CE 3.89Å; L642-M650 HydrophobicContact CD2-CE 3.96Å; L642-M650 HydrophobicContact CD2-SD 4.4Å; K646-M650 WeakPolarHBondContact O-CG 3.27Å; K646-M650 PolarHBondContact O-N 3.41Å; K646-M650 VanDerWaalsContact O-N 3.09Å; L647-M650 HydrophobicContact CD2-CE 3.95Å; K648-M650 VanDerWaalsContact C-N 3.28Å; K648-M650 PolarHBondContact O-N 3.12Å; M650-I652 HydrophobicContact CE-CD1 4.05Å
651	G	83.3	Confident	86.4	Confident	16 Å²	16	55.2 Å²	55.2	17%	0.165	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	123.3	-8.1	-177.2	0	0	0	0	0	115.4	E628 K648 Y653	E628-G651 WeakPolarHBondContact OE1-CA 3.46Å; K648-G651 PolarHBondContact O-N 2.93Å; G651-Y653 VanDerWaalsContact C-N 3.31Å; G651-Y653 WeakPolarHBondContact O-CD2 3.33Å; G651-Y653 WeakPolarHBondContact O-CE2 3.27Å; G651-Y653 PolarHBondContact O-N 3.29Å
652	I	86.2	Confident	86.6	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	31%	0.311	C	S	.	.			trans	-82.2	68.2	-170.8	-43.3	174.8	0	0	0	111.3	Y625 E628 F629 L647 M650 N654 D657 R658 I661	Y625-I652 HydrophobicContact CD1-CB 4.45Å; Y625-I652 HydrophobicContact CD1-CD1 4.47Å; Y625-I652 HydrophobicContact CD1-CG1 3.81Å; Y625-I652 HydrophobicContact CD1-CG2 4.28Å; Y625-I652 HydrophobicContact CD2-CG2 4.29Å; Y625-I652 HydrophobicContact CE1-CB 4.18Å; Y625-I652 HydrophobicContact CE1-CG1 4.03Å; Y625-I652 HydrophobicContact CE1-CG2 3.88Å; Y625-I652 HydrophobicContact CE2-CG2 3.85Å; Y625-I652 HydrophobicContact CG-CD1 4.44Å; Y625-I652 HydrophobicContact CG-CG1 4.25Å; Y625-I652 HydrophobicContact CG-CG2 4.49Å; E628-I652 WeakPolarHBondContact OE2-CG1 3.31Å; F629-I652 HydrophobicContact CD2-CD1 4.36Å; F629-I652 HydrophobicContact CE2-CD1 3.49Å; F629-I652 VanDerWaalsContact CE2-CD1 3.49Å; F629-I652 HydrophobicContact CZ-CD1 4.13Å; L647-I652 HydrophobicContact CD2-CD1 3.72Å; L647-I652 WeakPolarHBondContact O-CA 3.36Å; L647-I652 WeakPolarHBondContact O-CB 3.46Å; L647-I652 PolarHBondContact O-N 2.91Å; L647-I652 VanDerWaalsContact O-N 3.08Å; M650-I652 HydrophobicContact CE-CD1 4.05Å; I652-N654 PolarHBondContact O-N 3.02Å; I652-D657 HydrophobicContact CG2-CB 4.41Å; I652-R658 HydrophobicContact CB-CG 4.19Å; I652-R658 HydrophobicContact CG2-CG 3.74Å; I652-R658 WeakPolarHBondContact O-CD 3.37Å; I652-R658 VanDerWaalsContact O-CG 3.25Å; I652-R658 WeakPolarHBondContact O-CG 3.47Å; I652-R658 PolarHBondContact O-NE 3.33Å; I652-I661 HydrophobicContact CD1-CD1 3.94Å; I652-I661 HydrophobicContact CG2-CD1 4.31Å
653	Y	85.9	Confident	86.8	Confident	166 Å²	166	60.7 Å²	60.7	65%	0.651	33%	0.331	S	S	*	.			trans	-68.3	-28.6	-176.2	-61.6	-72.9	0	0	0	114.1	G651 H655 R658	G651-Y653 VanDerWaalsContact C-N 3.31Å; G651-Y653 WeakPolarHBondContact O-CD2 3.33Å; G651-Y653 WeakPolarHBondContact O-CE2 3.27Å; G651-Y653 PolarHBondContact O-N 3.29Å; Y653-H655 PolarHBondContact O-N 2.7Å; Y653-R658 PolarHBondContact O-NE 3.29Å; Y653-R658 PolarHBondContact O-NH2 3.08Å
654	N	89.2	Confident	86.9	Confident	72 Å²	72	62.6 Å²	62.6	39%	0.385	33%	0.333	S	S	.	.			trans	-58.3	131.5	-177.9	-173.3	2.9	0	0	0	112	I652 A656 D657 R658	I652-N654 PolarHBondContact O-N 3.02Å; N654-A656 PolarHBondContact OD1-N 2.92Å; N654-D657 HydrophobicContact CB-CB 4.2Å; N654-D657 WeakPolarHBondContact CB-OD2 3.28Å; N654-D657 PolarHBondContact ND2-OD1 3.01Å; N654-D657 PolarHBondContact ND2-OD2 3.47Å; N654-R658 WeakPolarHBondContact O-CB 3.15Å; N654-R658 WeakPolarHBondContact O-CG 3.44Å; N654-R658 PolarHBondContact O-N 2.95Å; N654-R658 PolarHBondContact O-NE 2.89Å
655	H	87	Confident	87.1	Confident	133 Å²	133	61.9 Å²	61.9	62%	0.616	32%	0.323	S	S	*	.	H	α-helix	trans	-70.2	-39.7	177.4	-176.1	-99.2	0	0	0	112.5	Y653 A659	Y653-H655 PolarHBondContact O-N 2.7Å; H655-A659 WeakPolarHBondContact O-CB 3.39Å; H655-A659 PolarHBondContact O-N 3.33Å
656	A	88.4	Confident	87.1	Confident	57 Å²	57	67.3 Å²	67.3	47%	0.471	34%	0.335	S	S	.	.	H	α-helix	trans	-64.6	-49.6	-178.1	0	0	0	0	0	111.3	N654 R658 A659 L660	N654-A656 PolarHBondContact OD1-N 2.92Å; A656-R658 PolarHBondContact O-N 3.45Å; A656-A659 WeakPolarHBondContact O-CB 3.49Å; A656-A659 PolarHBondContact O-N 3.47Å; A656-A659 VanDerWaalsContact O-N 3.09Å; A656-L660 PolarHBondContact O-N 2.97Å
657	D	89.8	Confident	86.9	Confident	17 Å²	17	65.8 Å²	65.8	9%	0.091	33%	0.331	C	S	.	.	H	α-helix	trans	-64.2	-43	-179.9	-58.9	-29.1	0	0	0	111.4	L622 K624 Y625 I652 N654 A659 L660 I661	L622-D657 HydrophobicContact CD2-CB 3.85Å; K624-D657 WeakPolarHBondContact CE-OD2 3.23Å; K624-D657 IonicContact NZ-OD1 2.72Å; K624-D657 PolarHBondContact NZ-OD1 2.77Å; K624-D657 IonicContact NZ-OD2 3.26Å; K624-D657 PolarHBondContact NZ-OD2 2.66Å; Y625-D657 HydrophobicContact CE2-CB 3.72Å; Y625-D657 WeakPolarHBondContact CE2-OD2 3.08Å; Y625-D657 PolarHBondContact OH-OD2 3.21Å; I652-D657 HydrophobicContact CG2-CB 4.41Å; N654-D657 HydrophobicContact CB-CB 4.2Å; N654-D657 WeakPolarHBondContact CB-OD2 3.28Å; N654-D657 PolarHBondContact ND2-OD1 3.01Å; N654-D657 PolarHBondContact ND2-OD2 3.47Å; D657-A659 VanDerWaalsContact C-N 3.28Å; D657-A659 PolarHBondContact O-N 3.06Å; D657-L660 PolarHBondContact O-N 3.4Å; D657-L660 VanDerWaalsContact O-N 3.14Å; D657-I661 WeakPolarHBondContact O-CG1 3.33Å; D657-I661 PolarHBondContact O-N 3.44Å
658	R	88.3	Confident	86.6	Confident	31 Å²	31	66.5 Å²	66.5	12%	0.117	34%	0.335	C	S	.	.	H	α-helix	trans	-61.8	-33.2	172.5	-76.6	-170.7	-75.8	128.1	6.7	113.2	L647 I652 Y653 N654 A656 K662	L647-R658 HydrophobicContact CB-CG 3.8Å; L647-R658 HydrophobicContact CD1-CB 4.33Å; L647-R658 HydrophobicContact CD1-CG 4.14Å; I652-R658 HydrophobicContact CB-CG 4.19Å; I652-R658 HydrophobicContact CG2-CG 3.74Å; I652-R658 WeakPolarHBondContact O-CD 3.37Å; I652-R658 VanDerWaalsContact O-CG 3.25Å; I652-R658 WeakPolarHBondContact O-CG 3.47Å; I652-R658 PolarHBondContact O-NE 3.33Å; Y653-R658 PolarHBondContact O-NE 3.29Å; Y653-R658 PolarHBondContact O-NH2 3.08Å; N654-R658 WeakPolarHBondContact O-CB 3.15Å; N654-R658 WeakPolarHBondContact O-CG 3.44Å; N654-R658 PolarHBondContact O-N 2.95Å; N654-R658 PolarHBondContact O-NE 2.89Å; A656-R658 PolarHBondContact O-N 3.45Å; R658-K662 WeakPolarHBondContact O-CB 3.36Å; R658-K662 WeakPolarHBondContact O-CE 3.38Å; R658-K662 VanDerWaalsContact O-CG 3.3Å; R658-K662 WeakPolarHBondContact O-CG 3.36Å; R658-K662 PolarHBondContact O-N 3Å
659	A	87.7	Confident	86.3	Confident	40 Å²	40	66 Å²	66	33%	0.331	33%	0.332	S	S	.	.	H	α-helix	trans	-69.7	-40.9	173.9	0	0	0	0	0	111.4	H655 A656 D657 K663	H655-A659 WeakPolarHBondContact O-CB 3.39Å; H655-A659 PolarHBondContact O-N 3.33Å; A656-A659 WeakPolarHBondContact O-CB 3.49Å; A656-A659 PolarHBondContact O-N 3.47Å; A656-A659 VanDerWaalsContact O-N 3.09Å; D657-A659 VanDerWaalsContact C-N 3.28Å; D657-A659 PolarHBondContact O-N 3.06Å; A659-K663 WeakPolarHBondContact O-CB 3.26Å; A659-K663 PolarHBondContact O-N 2.89Å
660	L	87.5	Confident	85.8	Confident	57 Å²	57	64.4 Å²	64.4	30%	0.298	32%	0.316	S	S	.	.	H	α-helix	trans	-64.6	-46.6	177.9	-176.2	58.5	0	0	0	112.3	V620 L622 A656 D657 K663 R664	V620-L660 HydrophobicContact CG1-CD1 4.36Å; V620-L660 HydrophobicContact CG1-CD2 3.8Å; V620-L660 HydrophobicContact CG1-CG 3.78Å; L622-L660 HydrophobicContact CD1-CD2 4.16Å; L622-L660 HydrophobicContact CD1-CG 4.33Å; L622-L660 HydrophobicContact CD2-CD2 4.36Å; L622-L660 HydrophobicContact CG-CD2 4.24Å; A656-L660 PolarHBondContact O-N 2.97Å; D657-L660 PolarHBondContact O-N 3.4Å; D657-L660 VanDerWaalsContact O-N 3.14Å; L660-K663 WeakPolarHBondContact O-CB 3.28Å; L660-K663 PolarHBondContact O-N 3.25Å; L660-R664 HydrophobicContact CD1-CG 4.29Å; L660-R664 WeakPolarHBondContact O-CG 3.27Å; L660-R664 PolarHBondContact O-N 2.79Å
661	I	87.1	Confident	85.4	Confident	2 Å²	2	66.5 Å²	66.5	1%	0.01	32%	0.323	C	S	.	.	H	α-helix	trans	-57.8	-53.1	175.8	-63.2	165	0	0	0	110.1	L622 F629 L647 I652 D657 K663 R664 V665	L622-I661 HydrophobicContact CD1-CD1 4.06Å; L622-I661 HydrophobicContact CD1-CG1 3.38Å; F629-I661 HydrophobicContact CE2-CD1 4.34Å; F629-I661 HydrophobicContact CZ-CD1 4.23Å; L647-I661 HydrophobicContact CD1-CG2 4.43Å; L647-I661 HydrophobicContact CD2-CD1 3.96Å; L647-I661 HydrophobicContact CD2-CG2 4.05Å; I652-I661 HydrophobicContact CD1-CD1 3.94Å; I652-I661 HydrophobicContact CG2-CD1 4.31Å; D657-I661 WeakPolarHBondContact O-CG1 3.33Å; D657-I661 PolarHBondContact O-N 3.44Å; I661-K663 VanDerWaalsContact C-N 3.26Å; I661-K663 PolarHBondContact O-N 3.01Å; I661-R664 PolarHBondContact O-N 2.79Å; I661-V665 HydrophobicContact CG2-CG2 4.22Å; I661-V665 WeakPolarHBondContact O-CG2 3.27Å; I661-V665 PolarHBondContact O-N 2.78Å
662	K	87.4	Confident	84.9	Confident	94 Å²	94	67.3 Å²	67.3	41%	0.409	33%	0.325	S	S	.	.	H	α-helix	trans	-58.7	-36.2	178.9	-73.2	-179.2	-66.3	168.5	0	112.7	L647 R658 K666	L647-K662 HydrophobicContact CD1-CD 4.5Å; L647-K662 HydrophobicContact CD1-CG 4Å; R658-K662 WeakPolarHBondContact O-CB 3.36Å; R658-K662 WeakPolarHBondContact O-CE 3.38Å; R658-K662 VanDerWaalsContact O-CG 3.3Å; R658-K662 WeakPolarHBondContact O-CG 3.36Å; R658-K662 PolarHBondContact O-N 3Å; K662-K666 WeakPolarHBondContact O-CB 3.42Å; K662-K666 PolarHBondContact O-N 2.93Å; K662-K666 VanDerWaalsContact O-N 3.09Å
663	K	88.2	Confident	84.4	Confident	130 Å²	130	71.4 Å²	71.4	57%	0.565	35%	0.35	S	S	*	.	H	α-helix	trans	-64	-55.5	174.4	-176.3	-178.3	175.7	-176.4	0	110.6	A659 L660 I661 V665 K666 D667	A659-K663 WeakPolarHBondContact O-CB 3.26Å; A659-K663 PolarHBondContact O-N 2.89Å; L660-K663 WeakPolarHBondContact O-CB 3.28Å; L660-K663 PolarHBondContact O-N 3.25Å; I661-K663 VanDerWaalsContact C-N 3.26Å; I661-K663 PolarHBondContact O-N 3.01Å; K663-V665 PolarHBondContact O-N 2.89Å; K663-K666 WeakPolarHBondContact O-CA 3.49Å; K663-K666 WeakPolarHBondContact O-CB 3.33Å; K663-K666 PolarHBondContact O-N 3.37Å; K663-D667 PolarHBondContact O-N 3.26Å
664	R	86.3	Confident	84	Confident	111 Å²	111	70.4 Å²	70.4	42%	0.419	35%	0.349	S	S	.	.	H	α-helix	trans	-61.8	-39.4	-178.2	-65.8	-62.9	-162.6	172	8.9	112.9	F616 V620 L660 I661 K666 D667 L668	F616-R664 HydrophobicContact CE2-CB 4.03Å; F616-R664 HydrophobicContact CZ-CB 3.7Å; V620-R664 HydrophobicContact CG1-CG 3.92Å; V620-R664 HydrophobicContact CG2-CB 4.48Å; V620-R664 HydrophobicContact CG2-CG 3.94Å; L660-R664 HydrophobicContact CD1-CG 4.29Å; L660-R664 WeakPolarHBondContact O-CG 3.27Å; L660-R664 PolarHBondContact O-N 2.79Å; I661-R664 PolarHBondContact O-N 2.79Å; R664-K666 VanDerWaalsContact C-N 3.35Å; R664-K666 PolarHBondContact O-N 3.09Å; R664-D667 PolarHBondContact O-N 3.2Å; R664-L668 WeakPolarHBondContact O-CB 3.26Å; R664-L668 WeakPolarHBondContact O-CG 3.24Å; R664-L668 PolarHBondContact O-N 3.05Å
665	V	86	Confident	82.9	Confident	12 Å²	12	69.7 Å²	69.7	7%	0.073	34%	0.343	C	S	.	.	H	α-helix	trans	-65.2	-36.5	173.9	173.7	0	0	0	0	111.8	L639 L640 I661 K663 K669	L639-V665 HydrophobicContact CD1-CG2 3.75Å; L639-V665 HydrophobicContact CG-CG2 3.93Å; L640-V665 HydrophobicContact CD2-CG1 4.21Å; I661-V665 HydrophobicContact CG2-CG2 4.22Å; I661-V665 WeakPolarHBondContact O-CG2 3.27Å; I661-V665 PolarHBondContact O-N 2.78Å; K663-V665 PolarHBondContact O-N 2.89Å; V665-K669 WeakPolarHBondContact O-CG 3.39Å; V665-K669 PolarHBondContact O-N 2.94Å
666	K	85.5	Confident	82.3	Confident	156 Å²	156	71.2 Å²	71.2	68%	0.678	34%	0.343	S	S	*	.	H	α-helix	trans	-65.9	-42.3	172.2	-177.1	-176	177	-175.6	0	111.6	K662 K663 R664 K669 S670	K662-K666 WeakPolarHBondContact O-CB 3.42Å; K662-K666 PolarHBondContact O-N 2.93Å; K662-K666 VanDerWaalsContact O-N 3.09Å; K663-K666 WeakPolarHBondContact O-CA 3.49Å; K663-K666 WeakPolarHBondContact O-CB 3.33Å; K663-K666 PolarHBondContact O-N 3.37Å; R664-K666 VanDerWaalsContact C-N 3.35Å; R664-K666 PolarHBondContact O-N 3.09Å; K666-K669 PolarHBondContact O-N 2.93Å; K666-S670 PolarHBondContact O-N 2.94Å
667	D	83.4	Confident	81.8	Confident	65 Å²	65	75.4 Å²	75.4	35%	0.348	35%	0.351	S	S	.	.	H	α-helix	trans	-61.4	-48.3	178.4	-59.8	-26.2	0	0	0	110.2	K663 R664 S670 Y671	K663-D667 PolarHBondContact O-N 3.26Å; R664-D667 PolarHBondContact O-N 3.2Å; D667-S670 WeakPolarHBondContact O-CB 3.09Å; D667-S670 PolarHBondContact O-N 3.25Å; D667-S670 VanDerWaalsContact O-N 3.08Å; D667-S670 PolarHBondContact O-OG 2.89Å; D667-Y671 PolarHBondContact O-N 3.49Å
668	L	81.4	Confident	81	Confident	15 Å²	15	80.4 Å²	80.4	8%	0.079	38%	0.375	C	S	.	.	H	α-helix	trans	-57.2	-48.1	174.4	-74.2	167.3	0	0	0	112.9	L605 W608 F616 R664 S670 Y671 V672	L605-L668 HydrophobicContact CD1-CB 4Å; L605-L668 HydrophobicContact CD1-CD1 4.1Å; L605-L668 HydrophobicContact CD1-CD2 3.84Å; L605-L668 HydrophobicContact CD1-CG 4.2Å; W608-L668 HydrophobicContact CH2-CD1 4.11Å; W608-L668 HydrophobicContact CH2-CD2 4.06Å; W608-L668 HydrophobicContact CZ2-CD2 4.48Å; W608-L668 HydrophobicContact CZ3-CD1 4.34Å; F616-L668 HydrophobicContact CD2-CD1 4.14Å; F616-L668 HydrophobicContact CE1-CD1 4.47Å; F616-L668 HydrophobicContact CE2-CD1 3.54Å; F616-L668 HydrophobicContact CZ-CD1 3.72Å; R664-L668 WeakPolarHBondContact O-CB 3.26Å; R664-L668 WeakPolarHBondContact O-CG 3.24Å; R664-L668 PolarHBondContact O-N 3.05Å; L668-S670 PolarHBondContact O-N 3.03Å; L668-Y671 WeakPolarHBondContact O-CB 3.35Å; L668-Y671 PolarHBondContact O-N 3.06Å; L668-Y671 VanDerWaalsContact O-N 3.12Å; L668-V672 PolarHBondContact O-N 2.9Å; L668-V672 VanDerWaalsContact O-N 3.12Å
669	K	81	Confident	80.1	Confident	98 Å²	98	86.6 Å²	86.6	43%	0.426	40%	0.4	S	S	.	.	H	α-helix	trans	-56.4	-39.8	173.5	-75.7	-178.8	-179.5	-175.3	0	112.1	L640 V665 K666 Y671 V673	L640-K669 HydrophobicContact CD2-CD 4.29Å; L640-K669 HydrophobicContact CD2-CG 3.58Å; L640-K669 WeakPolarHBondContact O-CE 3.49Å; L640-K669 PolarHBondContact O-NZ 3.05Å; V665-K669 WeakPolarHBondContact O-CG 3.39Å; V665-K669 PolarHBondContact O-N 2.94Å; K666-K669 PolarHBondContact O-N 2.93Å; K669-Y671 VanDerWaalsContact C-N 3.33Å; K669-V673 WeakPolarHBondContact O-CG2 3.42Å; K669-V673 PolarHBondContact O-N 3.35Å
670	S	78	Confident	79.5	Confident	55 Å²	55	89 Å²	89	39%	0.385	40%	0.404	S	S	.	.	H	α-helix	trans	-70.3	-29.4	180	85.4	0	0	0	0	113	K666 D667 L668 K674	K666-S670 PolarHBondContact O-N 2.94Å; D667-S670 WeakPolarHBondContact O-CB 3.09Å; D667-S670 PolarHBondContact O-N 3.25Å; D667-S670 VanDerWaalsContact O-N 3.08Å; D667-S670 PolarHBondContact O-OG 2.89Å; L668-S670 PolarHBondContact O-N 3.03Å; S670-K674 WeakPolarHBondContact O-CD 3.38Å; S670-K674 VanDerWaalsContact O-CG 3.27Å; S670-K674 WeakPolarHBondContact O-CG 3.36Å; S670-K674 PolarHBondContact O-N 3.28Å
671	Y	76.2	Confident	79.1	Confident	70 Å²	70	92.2 Å²	92.2	28%	0.275	42%	0.416	S	S	.	.	H	α-helix	trans	-70.5	-55.5	176	-179.5	-86.4	0	0	0	110.9	P599 V602 D667 L668 K669 V673 K674 E675	P599-Y671 HydrophobicContact CB-CE2 3.93Å; P599-Y671 PolarHBondContact O-OH 3.09Å; V602-Y671 HydrophobicContact CG2-CE1 4.24Å; D667-Y671 PolarHBondContact O-N 3.49Å; L668-Y671 WeakPolarHBondContact O-CB 3.35Å; L668-Y671 PolarHBondContact O-N 3.06Å; L668-Y671 VanDerWaalsContact O-N 3.12Å; K669-Y671 VanDerWaalsContact C-N 3.33Å; Y671-V673 PolarHBondContact O-N 3.01Å; Y671-V673 VanDerWaalsContact O-N 3.16Å; Y671-K674 WeakPolarHBondContact O-CA 3.37Å; Y671-K674 WeakPolarHBondContact O-CB 3.48Å; Y671-K674 PolarHBondContact O-N 3.15Å; Y671-E675 WeakPolarHBondContact CE1-OE2 3.48Å; Y671-E675 PolarHBondContact O-N 2.78Å
672	V	72.6	Confident	78.5	Confident	32 Å²	32	95.8 Å²	95.8	19%	0.194	43%	0.433	C	S	.	.	H	α-helix	trans	-57.1	-35.9	-178.9	176.2	0	0	0	0	112.2	L605 L668 R676	L605-V672 HydrophobicContact CB-CG2 4.14Å; L668-V672 PolarHBondContact O-N 2.9Å; L668-V672 VanDerWaalsContact O-N 3.12Å; V672-R676 WeakPolarHBondContact O-CB 3.28Å; V672-R676 PolarHBondContact O-N 3.09Å; V672-R676 VanDerWaalsContact O-N 3.11Å
673	V	76.3	Confident	77.9	Confident	87 Å²	87	97.4 Å²	97.4	53%	0.527	44%	0.442	S	S	.	.	H	α-helix	trans	-72.8	-30.7	176.6	172.5	0	0	0	0	112.9	K669 Y671 K677	K669-V673 WeakPolarHBondContact O-CG2 3.42Å; K669-V673 PolarHBondContact O-N 3.35Å; Y671-V673 PolarHBondContact O-N 3.01Å; Y671-V673 VanDerWaalsContact O-N 3.16Å; V673-K677 WeakPolarHBondContact O-CG 3.34Å
674	K	75.9	Confident	77.4	Confident	145 Å²	145	96.9 Å²	96.9	63%	0.63	44%	0.439	S	S	*	.	H	α-helix	trans	-73.5	-46.5	173.1	-74.9	170.3	-179	177.9	0	111	S670 Y671 K677 M678	S670-K674 WeakPolarHBondContact O-CD 3.38Å; S670-K674 VanDerWaalsContact O-CG 3.27Å; S670-K674 WeakPolarHBondContact O-CG 3.36Å; S670-K674 PolarHBondContact O-N 3.28Å; Y671-K674 WeakPolarHBondContact O-CA 3.37Å; Y671-K674 WeakPolarHBondContact O-CB 3.48Å; Y671-K674 PolarHBondContact O-N 3.15Å; K674-K677 PolarHBondContact O-N 3.08Å; K674-K677 VanDerWaalsContact O-N 3.14Å; K674-M678 WeakPolarHBondContact O-CG 3.45Å; K674-M678 PolarHBondContact O-N 3.23Å
675	E	67.1	Low	77	Confident	56 Å²	56	97.9 Å²	97.9	26%	0.262	44%	0.443	S	S	.	.	H	α-helix	trans	-58.2	-49.6	-179.3	-177.6	175.6	-147.4	0	0	111.9	Y671 K677 M678 Y679	Y671-E675 WeakPolarHBondContact CE1-OE2 3.48Å; Y671-E675 PolarHBondContact O-N 2.78Å; E675-K677 VanDerWaalsContact C-N 3.27Å; E675-K677 PolarHBondContact O-N 2.99Å; E675-M678 WeakPolarHBondContact O-CB 3.46Å; E675-M678 PolarHBondContact O-N 2.85Å; E675-Y679 HydrophobicContact CG-CD2 4.13Å; E675-Y679 HydrophobicContact CG-CE2 4.23Å; E675-Y679 PolarHBondContact O-N 3.38Å
676	R	73.9	Confident	76.3	Confident	166 Å²	166	103 Å²	103	63%	0.626	47%	0.467	S	S	*	.	H	α-helix	trans	-55.1	-41.4	174.4	-176.9	177.1	-68.8	-100.5	-0.4	112.4	V672 E680	V672-R676 WeakPolarHBondContact O-CB 3.28Å; V672-R676 PolarHBondContact O-N 3.09Å; V672-R676 VanDerWaalsContact O-N 3.11Å; R676-E680 WeakPolarHBondContact O-CB 3.36Å; R676-E680 PolarHBondContact O-N 3.3Å
677	K	77.6	Confident	75.7	Confident	144 Å²	144	100.5 Å²	100.5	63%	0.626	46%	0.461	S	S	*	.	H	α-helix	trans	-71.9	-26.4	178	-73	-176.8	177.2	-169.9	0	113.6	V673 K674 E675 K681	V673-K677 WeakPolarHBondContact O-CG 3.34Å; K674-K677 PolarHBondContact O-N 3.08Å; K674-K677 VanDerWaalsContact O-N 3.14Å; E675-K677 VanDerWaalsContact C-N 3.27Å; E675-K677 PolarHBondContact O-N 2.99Å; K677-K681 VanDerWaalsContact O-CB 3.27Å; K677-K681 WeakPolarHBondContact O-CB 3.5Å; K677-K681 PolarHBondContact O-N 3.44Å
678	M	73.8	Confident	75.4	Confident	123 Å²	123	103.9 Å²	103.9	61%	0.606	47%	0.473	S	S	*	.	H	α-helix	trans	-71.2	-51.3	171.6	-72.1	-67.7	-68.3	0	0	110.4	K674 E675 E680 K681 E682	K674-M678 WeakPolarHBondContact O-CG 3.45Å; K674-M678 PolarHBondContact O-N 3.23Å; E675-M678 WeakPolarHBondContact O-CB 3.46Å; E675-M678 PolarHBondContact O-N 2.85Å; M678-E680 PolarHBondContact O-N 3.09Å; M678-K681 WeakPolarHBondContact O-CB 3.48Å; M678-K681 PolarHBondContact O-N 3.2Å; M678-K681 VanDerWaalsContact O-N 3.16Å; M678-E682 PolarHBondContact O-N 3.08Å
679	Y	70.1	Confident	74.9	Confident	161 Å²	161	107.9 Å²	107.9	63%	0.631	49%	0.493	S	S	*	.	H	α-helix	trans	-57.4	-46.2	176.7	-91.6	-78	0	0	0	112.8	E675 K681 E682 Q683	E675-Y679 HydrophobicContact CG-CD2 4.13Å; E675-Y679 HydrophobicContact CG-CE2 4.23Å; E675-Y679 PolarHBondContact O-N 3.38Å; Y679-K681 VanDerWaalsContact C-N 3.29Å; Y679-K681 PolarHBondContact O-N 3.36Å; Y679-E682 PolarHBondContact O-N 2.94Å; Y679-Q683 PolarHBondContact O-N 2.96Å
680	E	74.7	Confident	74.2	Confident	91 Å²	91	107.5 Å²	107.5	43%	0.425	50%	0.503	S	S	.	.	H	α-helix	trans	-63.6	-35.1	178.6	-164.6	-162.3	142.9	0	0	112.1	R676 M678 K684	R676-E680 WeakPolarHBondContact O-CB 3.36Å; R676-E680 PolarHBondContact O-N 3.3Å; M678-E680 PolarHBondContact O-N 3.09Å; E680-K684 HydrophobicContact CG-CD 4.4Å; E680-K684 WeakPolarHBondContact O-CB 3.2Å; E680-K684 WeakPolarHBondContact O-CD 3.38Å; E680-K684 VanDerWaalsContact O-CG 3.22Å; E680-K684 WeakPolarHBondContact O-CG 3.49Å; E680-K684 PolarHBondContact O-N 3.23Å; E680-K684 IonicContact OE1-NZ 3.55Å; E680-K684 PolarHBondContact OE1-NZ 3.48Å
681	K	78.6	Confident	73.5	Confident	123 Å²	123	112.6 Å²	112.6	54%	0.535	52%	0.521	S	S	.	.	H	α-helix	trans	-70	-36.4	175.3	-176.6	-177.3	176.6	-171.3	0	111.9	K677 M678 Y679 K684 R685	K677-K681 VanDerWaalsContact O-CB 3.27Å; K677-K681 WeakPolarHBondContact O-CB 3.5Å; K677-K681 PolarHBondContact O-N 3.44Å; M678-K681 WeakPolarHBondContact O-CB 3.48Å; M678-K681 PolarHBondContact O-N 3.2Å; M678-K681 VanDerWaalsContact O-N 3.16Å; Y679-K681 VanDerWaalsContact C-N 3.29Å; Y679-K681 PolarHBondContact O-N 3.36Å; K681-K684 CarbonylContact O-C 3.55Å; K681-K684 PolarHBondContact O-N 3.15Å; K681-R685 PolarHBondContact O-N 2.92Å; K681-R685 VanDerWaalsContact O-N 3.13Å
682	E	74.6	Confident	72.5	Confident	78 Å²	78	120.6 Å²	120.6	36%	0.364	56%	0.557	S	S	.	*	H	α-helix	trans	-79.5	-38.3	-178	-149.9	53.5	-120.8	0	0	112	M678 Y679 K684 R685 M686	M678-E682 PolarHBondContact O-N 3.08Å; Y679-E682 PolarHBondContact O-N 2.94Å; E682-K684 VanDerWaalsContact C-N 3.26Å; E682-K684 PolarHBondContact O-N 3.3Å; E682-R685 WeakPolarHBondContact O-CA 3.25Å; E682-R685 WeakPolarHBondContact O-CB 3.25Å; E682-R685 PolarHBondContact O-N 3.14Å; E682-R685 WeakPolarHBondContact OE1-CB 2.98Å; E682-R685 WeakPolarHBondContact OE1-CD 3.46Å; E682-R685 IonicContact OE1-NH1 3.75Å; E682-R685 WeakPolarHBondContact OE2-CD 3.21Å; E682-R685 IonicContact OE2-CZ 2.66Å; E682-R685 IonicContact OE2-NH1 3.9Å; E682-R685 PolarHBondContact OE2-NH1 3.28Å; E682-M686 PolarHBondContact O-N 2.73Å
683	Q	73.8	Confident	72.5	Confident	128 Å²	128	125.1 Å²	125.1	60%	0.598	58%	0.576	S	S	*	*	H	α-helix	trans	-57.9	-40.1	166.7	-74.3	-177.1	-26.6	0	0	111.8	Y679 R685 M686 L687	Y679-Q683 PolarHBondContact O-N 2.96Å; Q683-R685 PolarHBondContact O-N 2.91Å; Q683-M686 PolarHBondContact O-N 3.47Å; Q683-L687 WeakPolarHBondContact O-CB 3.42Å; Q683-L687 WeakPolarHBondContact O-CG 3.46Å; Q683-L687 PolarHBondContact O-N 3.24Å
684	K	78.7	Confident	72.3	Confident	118 Å²	118	127.1 Å²	127.1	51%	0.513	58%	0.578	S	S	.	*	H	α-helix	trans	-72.8	-6.6	174.1	-73.3	172.7	178.9	175.5	0	114.6	E680 K681 E682 K688	E680-K684 HydrophobicContact CG-CD 4.4Å; E680-K684 WeakPolarHBondContact O-CB 3.2Å; E680-K684 WeakPolarHBondContact O-CD 3.38Å; E680-K684 VanDerWaalsContact O-CG 3.22Å; E680-K684 WeakPolarHBondContact O-CG 3.49Å; E680-K684 PolarHBondContact O-N 3.23Å; E680-K684 IonicContact OE1-NZ 3.55Å; E680-K684 PolarHBondContact OE1-NZ 3.48Å; K681-K684 CarbonylContact O-C 3.55Å; K681-K684 PolarHBondContact O-N 3.15Å; E682-K684 VanDerWaalsContact C-N 3.26Å; E682-K684 PolarHBondContact O-N 3.3Å; K684-K688 WeakPolarHBondContact O-CD 3.44Å; K684-K688 WeakPolarHBondContact O-CG 2.96Å
685	R	78.1	Confident	72.1	Confident	132 Å²	132	126.1 Å²	126.1	50%	0.498	58%	0.575	S	S	.	*	H	α-helix	trans	-92.4	-49.5	165.8	-80.6	171.1	151.5	-170.6	-18.3	110.9	K681 E682 Q683 L687 K688 L689	K681-R685 PolarHBondContact O-N 2.92Å; K681-R685 VanDerWaalsContact O-N 3.13Å; E682-R685 WeakPolarHBondContact O-CA 3.25Å; E682-R685 WeakPolarHBondContact O-CB 3.25Å; E682-R685 PolarHBondContact O-N 3.14Å; E682-R685 WeakPolarHBondContact OE1-CB 2.98Å; E682-R685 WeakPolarHBondContact OE1-CD 3.46Å; E682-R685 IonicContact OE1-NH1 3.75Å; E682-R685 WeakPolarHBondContact OE2-CD 3.21Å; E682-R685 IonicContact OE2-CZ 2.66Å; E682-R685 IonicContact OE2-NH1 3.9Å; E682-R685 PolarHBondContact OE2-NH1 3.28Å; Q683-R685 PolarHBondContact O-N 2.91Å; R685-L687 VanDerWaalsContact C-N 3.34Å; R685-L687 PolarHBondContact O-N 3.37Å; R685-K688 CarbonylContact O-C 3.59Å; R685-K688 WeakPolarHBondContact O-CA 3.49Å; R685-K688 WeakPolarHBondContact O-CB 3.18Å; R685-K688 PolarHBondContact O-N 2.76Å; R685-L689 WeakPolarHBondContact O-CD1 3.3Å; R685-L689 PolarHBondContact O-N 3.39Å
686	M	70.5	Confident	72.4	Confident	119 Å²	119	130.2 Å²	130.2	59%	0.586	59%	0.594	S	S	*	*	H	α-helix	trans	-55.8	-46.5	177.8	-70	-57.7	-63.5	0	0	112	E682 Q683 K688 L689 S690	E682-M686 PolarHBondContact O-N 2.73Å; Q683-M686 PolarHBondContact O-N 3.47Å; M686-K688 VanDerWaalsContact C-N 3.26Å; M686-K688 PolarHBondContact O-N 2.85Å; M686-L689 WeakPolarHBondContact O-CA 3.47Å; M686-L689 WeakPolarHBondContact O-CB 3.4Å; M686-L689 PolarHBondContact O-N 3.45Å; M686-S690 PolarHBondContact O-N 2.87Å; M686-S690 PolarHBondContact O-OG 3.34Å
687	L	72.7	Confident	72.4	Confident	104 Å²	104	127.9 Å²	127.9	55%	0.545	59%	0.592	S	S	.	*	H	α-helix	trans	-59.2	-37	174.9	-75	167.6	0	0	0	112.5	Q683 R685 L689 S690 E691	Q683-L687 WeakPolarHBondContact O-CB 3.42Å; Q683-L687 WeakPolarHBondContact O-CG 3.46Å; Q683-L687 PolarHBondContact O-N 3.24Å; R685-L687 VanDerWaalsContact C-N 3.34Å; R685-L687 PolarHBondContact O-N 3.37Å; L687-L689 VanDerWaalsContact C-N 3.29Å; L687-L689 PolarHBondContact O-N 3.09Å; L687-S690 WeakPolarHBondContact CA-OG 3.46Å; L687-S690 PolarHBondContact O-N 2.96Å; L687-S690 PolarHBondContact O-OG 3.04Å; L687-E691 WeakPolarHBondContact O-CB 3.38Å; L687-E691 WeakPolarHBondContact O-CG 3.41Å; L687-E691 PolarHBondContact O-N 3.5Å
688	K	78.3	Confident	72	Confident	136 Å²	136	126.9 Å²	126.9	59%	0.591	59%	0.589	S	S	*	*	H	α-helix	trans	-79.7	-5.8	176.1	-69.5	-174.1	178.6	-169.8	0	114.5	K684 R685 M686 K692	K684-K688 WeakPolarHBondContact O-CD 3.44Å; K684-K688 WeakPolarHBondContact O-CG 2.96Å; R685-K688 CarbonylContact O-C 3.59Å; R685-K688 WeakPolarHBondContact O-CA 3.49Å; R685-K688 WeakPolarHBondContact O-CB 3.18Å; R685-K688 PolarHBondContact O-N 2.76Å; M686-K688 VanDerWaalsContact C-N 3.26Å; M686-K688 PolarHBondContact O-N 2.85Å; K688-K692 WeakPolarHBondContact O-CD 2.97Å; K688-K692 WeakPolarHBondContact O-CG 3.33Å
689	L	71.1	Confident	71.9	Confident	99 Å²	99	127.1 Å²	127.1	52%	0.518	59%	0.588	S	S	.	*	H	α-helix	trans	-92.6	-34.1	165	-97	74.5	0	0	0	110.8	R685 M686 L687 K692	R685-L689 WeakPolarHBondContact O-CD1 3.3Å; R685-L689 PolarHBondContact O-N 3.39Å; M686-L689 WeakPolarHBondContact O-CA 3.47Å; M686-L689 WeakPolarHBondContact O-CB 3.4Å; M686-L689 PolarHBondContact O-N 3.45Å; L687-L689 VanDerWaalsContact C-N 3.29Å; L687-L689 PolarHBondContact O-N 3.09Å; L689-K692 PolarHBondContact O-N 2.72Å
690	S	66	Low	72	Confident	91 Å²	91	124.5 Å²	124.5	64%	0.636	59%	0.585	S	S	*	*	H	α-helix	trans	-80.1	-17.9	176	58.7	0	0	0	0	114.6	M686 L687 K692	M686-S690 PolarHBondContact O-N 2.87Å; M686-S690 PolarHBondContact O-OG 3.34Å; L687-S690 WeakPolarHBondContact CA-OG 3.46Å; L687-S690 PolarHBondContact O-N 2.96Å; L687-S690 PolarHBondContact O-OG 3.04Å; S690-K692 VanDerWaalsContact C-N 3.31Å
691	E	62.2	Low	71.8	Confident	162 Å²	162	127.3 Å²	127.3	76%	0.757	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.6	5.8	170.5	-74.2	-177.5	144.1	0	0	113.1	L687	L687-E691 WeakPolarHBondContact O-CB 3.38Å; L687-E691 WeakPolarHBondContact O-CG 3.41Å; L687-E691 PolarHBondContact O-N 3.5Å
692	K	56.9	Low	71.2	Confident	238 Å²	238	127.7 Å²	127.7	100%	1.035	60%	0.604	S	S	*	*			trans	-123.8	0	-171.9	-89.7	-165.4	169.6	-157.7	0	113.3	K688 L689 S690	K688-K692 WeakPolarHBondContact O-CD 2.97Å; K688-K692 WeakPolarHBondContact O-CG 3.33Å; L689-K692 PolarHBondContact O-N 2.72Å; S690-K692 VanDerWaalsContact C-N 3.31Å

Retrieved 692 of 692 residues in 665 ms (Link to these results)

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