A0A061I055_CRIGR Loading...

Kelch-like 13

Substrate-specific adapter of a BCR (BTB-CUL3-RBX1) E3 ubiquitin-protein ligase complex required for mitotic progression and cytokinesis. The BCR(KLHL9-KLHL13) E3 ubiquitin ligase complex mediates the ubiquitination of AURKB and controls the dynamic behavior of AURKB on mitotic chromosomes and thereby coordinates faithful mitotic progression and completion of cytokinesis.

AlphaFold DB , UniProt , Accession A0A061I055, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene n/a, Length 655 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	26.1	Very low	26	Very low	244 Å²	244	161.7 Å²	161.7	100%	1.202	86%	0.859	S	S	*	*				0	145.2	0	-76.5	-179.1	165.7	0	0	108.7
2	P	32.8	Very low	26	Very low	124 Å²	124	160.4 Å²	160.4	81%	0.805	85%	0.85	S	S	*	*			cis	-114	155.4	-37.8	33.9	-19.3	0	0	0	111.6
3	L	21.5	Very low	26	Very low	173 Å²	173	164 Å²	164	91%	0.906	85%	0.845	S	S	*	*			trans	-92.9	125.4	169.3	-89.4	150.8	0	0	0	109.2
4	K	24	Very low	25.8	Very low	203 Å²	203	166 Å²	166	88%	0.883	84%	0.844	S	S	*	*			trans	-116.2	133	167.4	-93.1	-174.8	176.3	178.9	0	109.3
5	W	23.8	Very low	25.7	Very low	244 Å²	244	166.6 Å²	166.6	92%	0.924	84%	0.839	S	S	*	*			trans	-78	144.3	176.8	-75.6	55.6	0	0	0	112
6	K	23.1	Very low	25.6	Very low	200 Å²	200	163.8 Å²	163.8	87%	0.87	84%	0.836	S	S	*	*			trans	-158.5	109.4	147.6	-108.1	-177.9	-176.8	-174.1	0	111.5
7	T	26.8	Very low	25.7	Very low	127 Å²	127	161.5 Å²	161.5	78%	0.779	83%	0.831	S	S	*	*			trans	33.7	117.9	134.9	55.6	0	0	0	0	120.6
8	S	25.1	Very low	25.7	Very low	122 Å²	122	159.2 Å²	159.2	85%	0.853	83%	0.828	S	S	*	*			trans	-152.3	140.8	145.8	59.5	0	0	0	0	112.1
9	S	27.8	Very low	25.6	Very low	104 Å²	104	157.6 Å²	157.6	73%	0.727	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-50.5	162.2	-176.5	-39.4	0	0	0	0	116.4	V11	S9-V11 PolarHBondContact O-N 3.21Å
10	P	28.1	Very low	25.7	Very low	128 Å²	128	158.3 Å²	158.3	83%	0.831	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-73.2	121.4	-175.8	28.7	-32	0	0	0	111.8
11	V	26.7	Very low	25.7	Very low	110 Å²	110	159.9 Å²	159.9	67%	0.667	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-80.3	118.1	170.6	175.2	0	0	0	0	108.6	S9 W13	S9-V11 PolarHBondContact O-N 3.21Å; V11-W13 PolarHBondContact O-N 3.26Å
12	I	26.6	Very low	25.7	Very low	146 Å²	146	155.1 Å²	155.1	75%	0.749	81%	0.814	S	S	*	*			trans	-70.2	112.2	171.6	-64.2	166.4	0	0	0	108.1	K14	I12-K14 HydrophobicContact CG2-CG 4.42Å; I12-K14 PolarHBondContact O-N 3.31Å
13	W	25.1	Very low	25.3	Very low	207 Å²	207	154 Å²	154	78%	0.784	81%	0.809	S	S	*	*			trans	-84.3	106.4	169.9	-71.4	87.5	0	0	0	109.6	V11	V11-W13 PolarHBondContact O-N 3.26Å
14	K	24.1	Very low	25.6	Very low	192 Å²	192	157 Å²	157	84%	0.835	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-83	119.7	165.4	-74.2	-178.3	176.3	179.2	0	108.7	I12	I12-K14 HydrophobicContact CG2-CG 4.42Å; I12-K14 PolarHBondContact O-N 3.31Å
15	F	24.4	Very low	25.7	Very low	175 Å²	175	152 Å²	152	77%	0.768	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-94.8	139.8	162.7	-82.6	-84.2	0	0	0	110.2
16	P	24.3	Very low	25.8	Very low	122 Å²	122	147.4 Å²	147.4	79%	0.792	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-82.4	126.9	-178.1	32.2	-30.7	0	0	0	110.7
17	V	26.2	Very low	26.1	Very low	125 Å²	125	143.9 Å²	143.9	76%	0.758	80%	0.796	S	S	*	*			trans	-108.1	129.2	168.1	-177.5	0	0	0	0	107.9	V19	V17-V19 PolarHBondContact O-N 3.38Å
18	P	25.7	Very low	26	Very low	120 Å²	120	146.4 Å²	146.4	78%	0.779	80%	0.803	S	S	*	*			trans	-70	124.2	176.2	-9.9	24.9	0	0	0	110.4	L20	P18-L20 PolarHBondContact O-N 3.47Å
19	V	25	Very low	26	Very low	128 Å²	128	145.8 Å²	145.8	78%	0.776	80%	0.799	S	S	*	*			trans	-83.1	107.3	174.6	176.9	0	0	0	0	109	V17 K21	V17-V19 PolarHBondContact O-N 3.38Å; V19-K21 HydrophobicContact CG1-CG 4.43Å
20	L	25.9	Very low	26.1	Very low	172 Å²	172	146.1 Å²	146.1	90%	0.901	80%	0.799	S	S	*	*			trans	-91.3	111.9	159.4	-96.4	154.2	0	0	0	108.3	P18	P18-L20 PolarHBondContact O-N 3.47Å
21	K	26.1	Very low	26	Very low	192 Å²	192	145 Å²	145	84%	0.835	80%	0.801	S	S	*	*			trans	-68.3	126.4	175.8	-73	175.2	175.1	175.2	0	110.2	V19	V19-K21 HydrophobicContact CG1-CG 4.43Å
22	T	26.1	Very low	26	Very low	143 Å²	143	150.4 Å²	150.4	88%	0.877	81%	0.811	S	S	*	*			trans	-129.3	127.3	151.1	51.9	0	0	0	0	109.1
23	S	25	Very low	26	Very low	101 Å²	101	150.9 Å²	150.9	71%	0.706	81%	0.813	S	S	*	*			trans	-103.3	132.1	-177	57.1	0	0	0	0	110.6
24	R	27.8	Very low	25.9	Very low	237 Å²	237	146.4 Å²	146.4	89%	0.894	81%	0.813	S	S	*	*			trans	68	142	150.1	-65.5	178.7	-179.1	-172.7	-0.5	116.9
25	S	25.6	Very low	26	Very low	98 Å²	98	144.3 Å²	144.3	69%	0.685	81%	0.811	S	S	*	*			cis	173	124.5	-11.5	45.8	0	0	0	0	104.9
26	T	25.8	Very low	26	Very low	147 Å²	147	142 Å²	142	90%	0.902	81%	0.811	S	S	*	*			trans	-162.7	151.9	152.6	30.4	0	0	0	0	110.8
27	P	29.6	Very low	26.1	Very low	125 Å²	125	145.4 Å²	145.4	81%	0.812	82%	0.816	S	S	*	*			trans	-93.1	148.5	-154.7	35.9	-33.5	0	0	0	114.2
28	L	25.5	Very low	26.2	Very low	180 Å²	180	148.4 Å²	148.4	94%	0.942	82%	0.822	S	S	*	*			trans	-75.5	137.8	170.2	-75.2	142	0	0	0	110.8
29	S	25.6	Very low	26.3	Very low	109 Å²	109	152.1 Å²	152.1	76%	0.762	83%	0.829	S	S	*	*			trans	-114	136.6	158.2	175.4	0	0	0	0	108.7
30	P	29.4	Very low	26.3	Very low	111 Å²	111	153.9 Å²	153.9	72%	0.721	83%	0.834	S	S	*	*			trans	-89.5	120.3	-177.9	33.5	-28.7	0	0	0	110.9	Y32	P30-Y32 PolarHBondContact O-N 3Å
31	A	26.4	Very low	26.5	Very low	106 Å²	106	153.3 Å²	153.3	88%	0.876	83%	0.831	S	S	*	*			trans	-92.7	99.6	168.1	0	0	0	0	0	109.3
32	Y	25.2	Very low	26.6	Very low	222 Å²	222	153.2 Å²	153.2	87%	0.871	83%	0.833	S	S	*	*			trans	-68.8	142.2	163.6	-113.9	-100.3	0	0	0	109.9	P30 S34	P30-Y32 PolarHBondContact O-N 3Å; Y32-S34 PolarHBondContact O-N 3.18Å
33	I	26.9	Very low	26.6	Very low	156 Å²	156	154.4 Å²	154.4	80%	0.8	83%	0.831	S	S	*	*			trans	-64.7	120.9	169.9	-66.9	162.9	0	0	0	108.3
34	S	23.9	Very low	26.7	Very low	113 Å²	113	159.8 Å²	159.8	79%	0.79	84%	0.841	S	S	*	*			trans	-125.5	112.3	167.6	178.4	0	0	0	0	107.9	Y32	Y32-S34 PolarHBondContact O-N 3.18Å
35	L	25.3	Very low	26.6	Very low	149 Å²	149	155.8 Å²	155.8	78%	0.78	84%	0.837	S	S	*	*			trans	-94.3	156.8	164.9	-80.9	162.1	0	0	0	108.5
36	V	25.2	Very low	26.7	Very low	126 Å²	126	156.7 Å²	156.7	76%	0.764	84%	0.843	S	S	*	*			trans	92.1	98.7	173.6	-165.2	0	0	0	0	113.9
37	E	26.1	Very low	26.7	Very low	194 Å²	194	157.9 Å²	157.9	91%	0.907	84%	0.843	S	S	*	*				-146.5	131	128.2	-108.5	171.4	-169.2	0	0	108.3
38	E	28.4	Very low	26.5	Very low	187 Å²	187	155.1 Å²	155.1	87%	0.874	84%	0.837	S	S	*	*			trans	-66.9	137.2	-177.8	-62.8	171	138.8	0	0	110.2
39	E	27.4	Very low	26.6	Very low	199 Å²	199	152.6 Å²	152.6	93%	0.93	84%	0.835	S	S	*	*			trans	-121.2	116.2	162.7	-86.2	-167.2	160.9	0	0	111.1
40	D	26.4	Very low	27	Very low	164 Å²	164	152.7 Å²	152.7	88%	0.877	84%	0.835	S	S	*	*			trans	-61.1	145.5	173.3	-100.9	-41.6	0	0	0	113.1	H42	D40-H42 PolarHBondContact O-N 3.45Å
41	L	29.7	Very low	27	Very low	160 Å²	160	155.7 Å²	155.7	84%	0.838	84%	0.84	S	S	*	*			trans	-66.8	121.5	170	-128.7	86.1	0	0	0	110.2
42	H	27.8	Very low	27.3	Very low	190 Å²	190	158.8 Å²	158.8	88%	0.88	84%	0.838	S	S	*	*			trans	-152	108.1	145.5	-107.6	-67.3	0	0	0	112.5	D40 K44	D40-H42 PolarHBondContact O-N 3.45Å; H42-K44 PolarHBondContact O-N 3.5Å
43	M	26.1	Very low	28.1	Very low	169 Å²	169	151.9 Å²	151.9	83%	0.833	83%	0.834	S	S	*	*			trans	-52.8	131	160.2	-85.2	-167.1	177.9	0	0	110.8
44	K	26.5	Very low	28.2	Very low	214 Å²	214	152 Å²	152	93%	0.93	84%	0.835	S	S	*	*			trans	-141.7	113.9	144.5	-102.3	178.6	-176.9	174.8	0	110.1	H42	H42-K44 PolarHBondContact O-N 3.5Å
45	L	26.4	Very low	28.9	Very low	153 Å²	153	151 Å²	151	80%	0.801	83%	0.828	S	S	*	*			trans	-67.1	136.8	161.6	-83.1	133	0	0	0	110
46	S	26.4	Very low	29.4	Very low	117 Å²	117	148.5 Å²	148.5	82%	0.818	83%	0.829	S	S	*	*			trans	-152	119.9	143.2	63.9	0	0	0	0	110.8
47	L	27.4	Very low	30.3	Very low	171 Å²	171	148 Å²	148	90%	0.895	82%	0.818	S	S	*	*			trans	-65.6	154.7	165.5	-73.3	111.5	0	0	0	111.2
48	G	25.5	Very low	31.1	Very low	67 Å²	67	144.9 Å²	144.9	69%	0.691	81%	0.808	S	S	*	*			trans	142.4	104.5	143.9	0	0	0	0	0	118.4
49	S	26.7	Very low	32	Very low	127 Å²	127	145 Å²	145	89%	0.888	81%	0.808	S	S	*	*			trans	72.6	129.8	141.3	56.2	0	0	0	0	121.6
50	S	34.3	Very low	32.8	Very low	111 Å²	111	140.2 Å²	140.2	78%	0.776	80%	0.797	S	S	*	*			trans	-64.5	139.7	172.5	54.8	0	0	0	0	113.9
51	E	29.6	Very low	33.7	Very low	175 Å²	175	138.2 Å²	138.2	82%	0.818	79%	0.794	S	S	*	*			trans	-160	131.5	136.5	-114.6	178.4	-171.1	0	0	111.4
52	M	31.2	Very low	34.7	Very low	171 Å²	171	140.2 Å²	140.2	84%	0.842	80%	0.796	S	S	*	*			trans	41	95.1	161	-66.9	-162.1	-112.5	0	0	120.5
53	G	42.1	Very low	35.6	Very low	76 Å²	76	135.6 Å²	135.6	78%	0.784	79%	0.79	S	S	*	*				52.7	75	115.4	0	0	0	0	0	119
54	L	30.7	Very low	36.9	Very low	158 Å²	158	131 Å²	131	83%	0.827	79%	0.787	S	S	*	*			trans	-160.2	112.3	141.4	-97.4	135.9	0	0	0	107.2	A56	L54-A56 PolarHBondContact O-N 2.83Å
55	S	37.3	Very low	38.7	Very low	92 Å²	92	127.1 Å²	127.1	64%	0.643	79%	0.787	S	S	*	*			trans	-57.3	125.6	-179	-179.1	0	0	0	0	110.6	H57	S55-H57 PolarHBondContact O-N 3.02Å
56	A	36.6	Very low	40.6	Very low	97 Å²	97	124.6 Å²	124.6	80%	0.802	78%	0.777	S	S	*	*	S	Bend	trans	-73.5	47.6	-177.5	0	0	0	0	0	113.5	L54	L54-A56 PolarHBondContact O-N 2.83Å
57	H	42.9	Very low	43.1	Very low	115 Å²	115	130.9 Å²	130.9	53%	0.532	78%	0.783	S	S	.	*			trans	-128.2	24.2	-176.3	-72.4	-13.5	0	0	0	113.9	S55	S55-H57 PolarHBondContact O-N 3.02Å
58	L	44.2	Very low	45.8	Very low	130 Å²	130	129.6 Å²	129.6	68%	0.681	78%	0.776	S	S	*	*			trans	-99.5	92.1	178.7	-72.8	163	0	0	0	111.3
59	Q	46.4	Very low	48.9	Very low	189 Å²	189	133.7 Å²	133.7	88%	0.883	78%	0.775	S	S	*	*			trans	-85	108.1	158.7	-92	179.5	-11.7	0	0	109.3
60	S	44.3	Very low	51.8	Low	99 Å²	99	133.2 Å²	133.2	69%	0.692	77%	0.767	S	S	*	*			trans	-90.1	108.2	174.9	144.5	0	0	0	0	109.8
61	C	46.3	Very low	54.5	Low	122 Å²	122	129.9 Å²	129.9	82%	0.824	74%	0.744	S	S	*	*			trans	-81.4	122.6	162.6	-76.6	0	0	0	0	109.8
62	K	51.1	Low	57.4	Low	202 Å²	202	126.4 Å²	126.4	88%	0.878	73%	0.731	S	S	*	*			trans	-88.4	108.4	172.7	-82	-176.8	176.8	176.7	0	110.4
63	A	46.7	Very low	60.3	Low	92 Å²	92	121.7 Å²	121.7	76%	0.76	71%	0.712	S	S	*	*	S	Bend	trans	-165.3	117.9	149	0	0	0	0	0	109.9
64	G	52.3	Low	62.8	Low	73 Å²	73	123.9 Å²	123.9	75%	0.753	70%	0.701	S	S	*	*	S	Bend	trans	80.9	162.5	175.8	0	0	0	0	0	115	T66	G64-T66 PolarHBondContact O-N 3.2Å
65	S	64.8	Low	65.6	Low	133 Å²	133	120.2 Å²	120.2	93%	0.93	69%	0.689	S	S	*	*	S	Bend	trans	-63.5	11.9	-176.7	57.8	0	0	0	0	115.7
66	T	65.3	Low	68.2	Low	99 Å²	99	118.4 Å²	118.4	61%	0.607	68%	0.676	S	S	*	*			trans	-114.4	119.5	-175.5	-53.2	0	0	0	0	109	G64 I68	G64-T66 PolarHBondContact O-N 3.2Å; T66-I68 HydrophobicContact CG2-CG1 4.47Å
67	R	79.8	Confident	70.9	Confident	250 Å²	250	117.8 Å²	117.8	94%	0.943	66%	0.662	S	S	*	*			trans	-95.3	122.9	170.3	-64.9	-176.2	-176.7	-178.7	1.4	108.6
68	I	84.7	Confident	73.3	Confident	144 Å²	144	115 Å²	115	74%	0.738	65%	0.653	S	S	*	*			trans	-96.9	123.5	175.2	-58.5	174.9	0	0	0	107.8	T66	T66-I68 HydrophobicContact CG2-CG1 4.47Å
69	F	89.1	Confident	75.7	Confident	152 Å²	152	111 Å²	111	67%	0.667	63%	0.632	S	S	*	*			trans	-104.1	129.8	171.3	168.6	-102.2	0	0	0	109.2
70	T	88.1	Confident	78	Confident	118 Å²	118	108.5 Å²	108.5	72%	0.724	62%	0.62	S	S	*	*			trans	-123	117.9	175.3	-54	0	0	0	0	108.3
71	S	91	Very high	80.4	Confident	41 Å²	41	105.5 Å²	105.5	29%	0.287	61%	0.605	S	S	.	*			trans	-86.1	133	174.7	173.8	0	0	0	0	110.6	T73 H74	S71-T73 PolarHBondContact OG-N 3.13Å; S71-T73 PolarHBondContact OG-OG1 3.11Å; S71-H74 PolarHBondContact OG-N 2.69Å; S71-H74 VanDerWaalsContact OG-N 3.08Å
72	N	91.4	Very high	82.8	Confident	102 Å²	102	102.6 Å²	102.6	55%	0.545	58%	0.578	S	S	.	*	S	Bend	trans	-83.3	-12.7	173.9	58.8	-11.2	0	0	0	113.7
73	T	92.1	Very high	84.9	Confident	72 Å²	72	95.4 Å²	95.4	44%	0.442	55%	0.548	S	S	.	.	S	Bend	trans	-111.4	-12.2	-177.5	54.3	0	0	0	0	113.6	S71 S75 S76 V77	S71-T73 PolarHBondContact OG-N 3.13Å; S71-T73 PolarHBondContact OG-OG1 3.11Å; T73-S75 VanDerWaalsContact C-N 3.31Å; T73-S75 PolarHBondContact O-N 3.35Å; T73-S76 PolarHBondContact O-N 3.43Å; T73-S76 PolarHBondContact O-OG 2.8Å; T73-V77 WeakPolarHBondContact O-CG2 3.11Å; T73-V77 PolarHBondContact O-N 3.31Å; T73-V77 VanDerWaalsContact O-N 3.08Å
74	H	93.6	Very high	87.2	Confident	122 Å²	122	96 Å²	96	57%	0.565	54%	0.535	S	S	*	.	H	α-helix	trans	-58.2	-41.7	-174.6	-177.6	60	0	0	0	112.8	S71 S76 V77 V78	S71-H74 PolarHBondContact OG-N 2.69Å; S71-H74 VanDerWaalsContact OG-N 3.08Å; H74-S76 PolarHBondContact O-N 3.42Å; H74-V77 PolarHBondContact O-N 2.84Å; H74-V78 WeakPolarHBondContact O-CB 3.41Å; H74-V78 VanDerWaalsContact O-CG2 3.26Å; H74-V78 WeakPolarHBondContact O-CG2 3.34Å; H74-V78 PolarHBondContact O-N 3.41Å
75	S	90.2	Very high	89.3	Confident	81 Å²	81	95 Å²	95	57%	0.566	51%	0.513	S	S	*	.	H	α-helix	trans	-61.8	-41.6	178.4	51.8	0	0	0	0	113.1	T73 V78 L79	T73-S75 VanDerWaalsContact C-N 3.31Å; T73-S75 PolarHBondContact O-N 3.35Å; S75-V78 PolarHBondContact O-N 3.35Å; S75-L79 WeakPolarHBondContact O-CG 3.22Å; S75-L79 PolarHBondContact O-N 2.85Å
76	S	91	Very high	90.8	Very high	53 Å²	53	90 Å²	90	37%	0.371	47%	0.473	S	S	.	.	H	α-helix	trans	-71.1	-38.2	179.2	62.2	0	0	0	0	112.1	T73 H74 L79 Q80	T73-S76 PolarHBondContact O-N 3.43Å; T73-S76 PolarHBondContact O-OG 2.8Å; H74-S76 PolarHBondContact O-N 3.42Å; S76-L79 PolarHBondContact O-N 2.93Å; S76-Q80 WeakPolarHBondContact O-CB 3.35Å; S76-Q80 VanDerWaalsContact O-CG 3.27Å; S76-Q80 WeakPolarHBondContact O-CG 3.4Å; S76-Q80 PolarHBondContact O-N 2.62Å
77	V	93.6	Very high	92.1	Very high	84 Å²	84	92.4 Å²	92.4	51%	0.509	48%	0.477	S	S	.	.	H	α-helix	trans	-64.2	-41.3	174.7	174.5	0	0	0	0	111	T73 H74 Q80 G81	T73-V77 WeakPolarHBondContact O-CG2 3.11Å; T73-V77 PolarHBondContact O-N 3.31Å; T73-V77 VanDerWaalsContact O-N 3.08Å; H74-V77 PolarHBondContact O-N 2.84Å; V77-Q80 PolarHBondContact O-N 3.41Å; V77-G81 PolarHBondContact O-N 2.88Å
78	V	94.1	Very high	92.8	Very high	58 Å²	58	84.7 Å²	84.7	35%	0.352	46%	0.455	S	S	.	.	H	α-helix	trans	-62.9	-46.4	175.8	169.6	0	0	0	0	111.1	H74 S75 Q80 G81 F82	H74-V78 WeakPolarHBondContact O-CB 3.41Å; H74-V78 VanDerWaalsContact O-CG2 3.26Å; H74-V78 WeakPolarHBondContact O-CG2 3.34Å; H74-V78 PolarHBondContact O-N 3.41Å; S75-V78 PolarHBondContact O-N 3.35Å; V78-Q80 PolarHBondContact O-N 3.45Å; V78-G81 PolarHBondContact O-N 3.3Å; V78-F82 HydrophobicContact CG1-CD2 3.75Å; V78-F82 HydrophobicContact CG1-CE2 3.69Å; V78-F82 WeakPolarHBondContact O-CD2 3.33Å; V78-F82 PolarHBondContact O-N 2.89Å
79	L	94.4	Very high	93.2	Very high	46 Å²	46	80 Å²	80	24%	0.241	44%	0.442	C	S	.	.	H	α-helix	trans	-61	-44	176.6	-77.2	174.5	0	0	0	112.3	S75 S76 G81 F82 E83 M111 A155	S75-L79 WeakPolarHBondContact O-CG 3.22Å; S75-L79 PolarHBondContact O-N 2.85Å; S76-L79 PolarHBondContact O-N 2.93Å; L79-G81 VanDerWaalsContact C-N 3.3Å; L79-G81 PolarHBondContact O-N 3.5Å; L79-F82 PolarHBondContact O-N 2.92Å; L79-E83 PolarHBondContact O-N 2.85Å; L79-M111 HydrophobicContact CD2-CE 3.66Å; L79-A155 HydrophobicContact CD1-CB 4.33Å
80	Q	94	Very high	93.4	Very high	135 Å²	135	77.2 Å²	77.2	63%	0.631	43%	0.433	S	S	*	.	H	α-helix	trans	-59.7	-40.4	174.1	-75.1	173.6	2.3	0	0	112.2	S76 V77 V78 E83 Q84	S76-Q80 WeakPolarHBondContact O-CB 3.35Å; S76-Q80 VanDerWaalsContact O-CG 3.27Å; S76-Q80 WeakPolarHBondContact O-CG 3.4Å; S76-Q80 PolarHBondContact O-N 2.62Å; V77-Q80 PolarHBondContact O-N 3.41Å; V78-Q80 PolarHBondContact O-N 3.45Å; Q80-E83 PolarHBondContact O-N 3.38Å; Q80-Q84 PolarHBondContact O-N 2.72Å
81	G	95.4	Very high	93.7	Very high	36 Å²	36	78.1 Å²	78.1	37%	0.371	43%	0.433	S	S	.	.	H	α-helix	trans	-61.5	-45.5	174.4	0	0	0	0	0	112.5	V77 V78 L79 E83 Q84 L85	V77-G81 PolarHBondContact O-N 2.88Å; V78-G81 PolarHBondContact O-N 3.3Å; L79-G81 VanDerWaalsContact C-N 3.3Å; L79-G81 PolarHBondContact O-N 3.5Å; G81-E83 PolarHBondContact O-N 3.47Å; G81-Q84 PolarHBondContact O-N 3.37Å; G81-L85 WeakPolarHBondContact O-CG 3.39Å; G81-L85 PolarHBondContact O-N 3.28Å
82	F	95.8	Very high	93.9	Very high	61 Å²	61	77.9 Å²	77.9	27%	0.268	43%	0.431	S	S	.	.	H	α-helix	trans	-65.2	-36.5	176.5	-85.9	-66.8	0	0	0	113.2	V78 L79 L85 R86 M111 Y153	V78-F82 HydrophobicContact CG1-CD2 3.75Å; V78-F82 HydrophobicContact CG1-CE2 3.69Å; V78-F82 WeakPolarHBondContact O-CD2 3.33Å; V78-F82 PolarHBondContact O-N 2.89Å; L79-F82 PolarHBondContact O-N 2.92Å; F82-L85 HydrophobicContact CD1-CD1 4.4Å; F82-L85 PolarHBondContact O-N 3.17Å; F82-R86 WeakPolarHBondContact O-CB 3.5Å; F82-R86 PolarHBondContact O-N 3.13Å; F82-M111 HydrophobicContact CB-SD 4.41Å; F82-M111 HydrophobicContact CD1-CG 4Å; F82-M111 HydrophobicContact CD1-SD 4.2Å; F82-M111 HydrophobicContact CD2-SD 3.81Å; F82-M111 HydrophobicContact CE1-CG 4.34Å; F82-M111 HydrophobicContact CE1-SD 4.43Å; F82-M111 HydrophobicContact CE2-SD 4.06Å; F82-M111 HydrophobicContact CG-CG 4.17Å; F82-M111 HydrophobicContact CG-SD 3.88Å; F82-M111 HydrophobicContact CZ-SD 4.36Å; F82-Y153 HydrophobicContact CB-CD1 3.95Å; F82-Y153 HydrophobicContact CB-CE1 3.92Å; F82-Y153 WeakPolarHBondContact O-CE1 3.49Å
83	E	95.1	Very high	94.1	Very high	51 Å²	51	76 Å²	76	24%	0.238	42%	0.421	C	S	.	.	H	α-helix	trans	-65.8	-42.7	175	179.3	58.2	-175.1	0	0	111.3	L79 Q80 G81 R86 H87 Y153 T154	L79-E83 PolarHBondContact O-N 2.85Å; Q80-E83 PolarHBondContact O-N 3.38Å; G81-E83 PolarHBondContact O-N 3.47Å; E83-R86 WeakPolarHBondContact O-CB 3.33Å; E83-R86 PolarHBondContact O-N 3.13Å; E83-R86 IonicContact OE2-NE 3.77Å; E83-H87 PolarHBondContact O-N 3.33Å; E83-Y153 HydrophobicContact CB-CD1 4.42Å; E83-Y153 WeakPolarHBondContact OE2-CB 3.41Å; E83-T154 HydrophobicContact CG-CG2 4.38Å
84	Q	95.4	Very high	94.2	Very high	105 Å²	105	72.7 Å²	72.7	49%	0.491	40%	0.4	S	S	.	.	H	α-helix	trans	-61.8	-46.2	175.1	-174.3	60.6	47.9	0	0	111.6	Q80 G81 R86 H87 D88	Q80-Q84 PolarHBondContact O-N 2.72Å; G81-Q84 PolarHBondContact O-N 3.37Å; Q84-R86 VanDerWaalsContact C-N 3.28Å; Q84-R86 PolarHBondContact O-N 3.05Å; Q84-H87 PolarHBondContact O-N 2.88Å; Q84-H87 VanDerWaalsContact O-N 3.16Å; Q84-D88 VanDerWaalsContact NE2-CG 3.29Å; Q84-D88 PolarHBondContact NE2-OD1 3.09Å; Q84-D88 PolarHBondContact NE2-OD2 2.84Å; Q84-D88 PolarHBondContact O-N 3.26Å
85	L	96.3	Very high	94.3	Very high	53 Å²	53	68.8 Å²	68.8	28%	0.277	39%	0.385	S	S	.	.	H	α-helix	trans	-57.9	-42.4	176.1	-72.7	172	0	0	0	111.7	G81 F82 D88 G89 L90 L91	G81-L85 WeakPolarHBondContact O-CG 3.39Å; G81-L85 PolarHBondContact O-N 3.28Å; F82-L85 HydrophobicContact CD1-CD1 4.4Å; F82-L85 PolarHBondContact O-N 3.17Å; L85-D88 PolarHBondContact O-N 3.28Å; L85-G89 PolarHBondContact O-N 2.91Å; L85-G89 VanDerWaalsContact O-N 3.08Å; L85-L90 HydrophobicContact CD2-CB 3.89Å; L85-L90 HydrophobicContact CD2-CD1 4.15Å; L85-L90 PolarHBondContact O-N 2.92Å; L85-L91 HydrophobicContact CD1-CD1 4.46Å
86	R	95.8	Very high	94.6	Very high	28 Å²	28	65 Å²	65	11%	0.106	36%	0.358	C	S	.	.	H	α-helix	trans	-63.2	-44.1	176.3	-178.6	-178.9	125.3	90.2	-11.4	111.6	F82 E83 Q84 D88 G89 P106 D150 Y153	F82-R86 WeakPolarHBondContact O-CB 3.5Å; F82-R86 PolarHBondContact O-N 3.13Å; E83-R86 WeakPolarHBondContact O-CB 3.33Å; E83-R86 PolarHBondContact O-N 3.13Å; E83-R86 IonicContact OE2-NE 3.77Å; Q84-R86 VanDerWaalsContact C-N 3.28Å; Q84-R86 PolarHBondContact O-N 3.05Å; R86-D88 VanDerWaalsContact C-N 3.31Å; R86-D88 PolarHBondContact O-N 3.33Å; R86-G89 PolarHBondContact O-N 2.89Å; R86-G89 VanDerWaalsContact O-N 3.1Å; R86-P106 WeakPolarHBondContact CG-O 3.44Å; R86-P106 PolarHBondContact NH1-O 3.42Å; R86-D150 IonicContact NH2-OD1 3.76Å; R86-Y153 HydrophobicContact CB-CD1 4.39Å; R86-Y153 HydrophobicContact CB-CE1 4Å; R86-Y153 HydrophobicContact CG-CE1 4.49Å
87	H	93.7	Very high	94.9	Very high	148 Å²	148	63.8 Å²	63.8	69%	0.685	35%	0.348	S	S	*	.	H	α-helix	trans	-63	-38.9	179.3	-159	71.2	0	0	0	112	E83 Q84 G89	E83-H87 PolarHBondContact O-N 3.33Å; Q84-H87 PolarHBondContact O-N 2.88Å; Q84-H87 VanDerWaalsContact O-N 3.16Å; H87-G89 PolarHBondContact O-N 3.48Å
88	D	94.7	Very high	94.9	Very high	89 Å²	89	59.8 Å²	59.8	48%	0.476	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-4.4	176.7	-62.1	-25.2	0	0	0	113	Q84 L85 R86 L90	Q84-D88 VanDerWaalsContact NE2-CG 3.29Å; Q84-D88 PolarHBondContact NE2-OD1 3.09Å; Q84-D88 PolarHBondContact NE2-OD2 2.84Å; Q84-D88 PolarHBondContact O-N 3.26Å; L85-D88 PolarHBondContact O-N 3.28Å; R86-D88 VanDerWaalsContact C-N 3.31Å; R86-D88 PolarHBondContact O-N 3.33Å; D88-L90 HydrophobicContact CB-CD1 3.9Å; D88-L90 HydrophobicContact CB-CG 3.88Å; D88-L90 PolarHBondContact O-N 3.37Å
89	G	92.8	Very high	94.6	Very high	45 Å²	45	58.3 Å²	58.3	46%	0.464	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.9	18.1	-177.2	0	0	0	0	0	114	L85 R86 H87	L85-G89 PolarHBondContact O-N 2.91Å; L85-G89 VanDerWaalsContact O-N 3.08Å; R86-G89 PolarHBondContact O-N 2.89Å; R86-G89 VanDerWaalsContact O-N 3.1Å; H87-G89 PolarHBondContact O-N 3.48Å
90	L	93.9	Very high	94.4	Very high	93 Å²	93	60.6 Å²	60.6	49%	0.487	33%	0.332	S	S	.	.			trans	-86	133.7	-177.4	-64.5	175.2	0	0	0	110.2	L85 D88 C92 H108	L85-L90 HydrophobicContact CD2-CB 3.89Å; L85-L90 HydrophobicContact CD2-CD1 4.15Å; L85-L90 PolarHBondContact O-N 2.92Å; D88-L90 HydrophobicContact CB-CD1 3.9Å; D88-L90 HydrophobicContact CB-CG 3.88Å; D88-L90 PolarHBondContact O-N 3.37Å; L90-C92 PolarHBondContact O-N 2.91Å; L90-H108 PolarHBondContact O-NE2 2.94Å; L90-H108 VanDerWaalsContact O-NE2 3.13Å
91	L	94.1	Very high	94.3	Very high	138 Å²	138	56.2 Å²	56.2	72%	0.723	32%	0.315	S	S	*	.	S	Bend	trans	61.1	9.3	176.8	-52	175.9	0	0	0	115.5	L85 D93 H108	L85-L91 HydrophobicContact CD1-CD1 4.46Å; L91-D93 PolarHBondContact O-N 3.41Å; L91-H108 PolarHBondContact O-CD2 3.37Å
92	C	94.9	Very high	94	Very high	35 Å²	35	60.5 Å²	60.5	24%	0.236	33%	0.33	C	S	.	.			trans	-66	118.2	169.2	-67.4	0	0	0	0	109.9	L90 P106 V107	L90-C92 PolarHBondContact O-N 2.91Å; C92-P106 HydrophobicContact CB-CB 3.96Å; C92-V107 WeakPolarHBondContact CA-O 3.16Å
93	D	94.6	Very high	93.8	Very high	64 Å²	64	60.1 Å²	60.1	34%	0.342	33%	0.33	S	S	.	.			trans	-111.2	5.8	-173	61.5	-11.6	0	0	0	112.9	L91 V107 H108 R109	L91-D93 PolarHBondContact O-N 3.41Å; D93-V107 PolarHBondContact N-O 3.01Å; D93-H108 VanDerWaalsContact OD1-CA 3.3Å; D93-H108 WeakPolarHBondContact OD1-CA 3.34Å; D93-R109 PolarHBondContact O-NE 3.18Å; D93-R109 WeakPolarHBondContact OD1-CG 3.06Å; D93-R109 PolarHBondContact OD1-N 2.95Å; D93-R109 WeakPolarHBondContact OD2-CB 3.48Å
94	V	95.8	Very high	93.8	Very high	2 Å²	2	60.8 Å²	60.8	1%	0.012	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.1	148.2	170.6	69.4	0	0	0	0	111.2	L96 V107 R109 F123 I135	V94-L96 HydrophobicContact CG2-CD2 4.46Å; V94-V107 HydrophobicContact CG1-CG2 3.47Å; V94-V107 VanDerWaalsContact CG1-CG2 3.47Å; V94-V107 PolarHBondContact N-O 3.32Å; V94-V107 PolarHBondContact O-N 3.45Å; V94-V107 VanDerWaalsContact O-O 3.07Å; V94-R109 HydrophobicContact CB-CG 3.83Å; V94-R109 HydrophobicContact CG1-CG 3.58Å; V94-F123 HydrophobicContact CG1-CZ 4.34Å; V94-I135 HydrophobicContact CG2-CD1 3.66Å; V94-I135 HydrophobicContact CG2-CG1 4.09Å
95	T	96.1	Very high	93.9	Very high	40 Å²	40	56.1 Å²	56.1	25%	0.245	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	124.8	171.7	-58.8	0	0	0	0	109.8	A104 M133 C134 I135	T95-A104 HydrophobicContact CG2-CB 3.66Å; T95-M133 PolarHBondContact N-O 3.47Å; T95-C134 WeakPolarHBondContact O-CA 3.33Å; T95-I135 PolarHBondContact O-N 3.3Å
96	L	96.1	Very high	93.9	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	133	174.9	-57.8	179.4	0	0	0	109.8	V94 F105 V107 M112 F119 I135 L137 L145 I149	V94-L96 HydrophobicContact CG2-CD2 4.46Å; L96-F105 HydrophobicContact CB-CB 4.46Å; L96-F105 PolarHBondContact N-O 2.92Å; L96-F105 WeakPolarHBondContact O-CB 3.4Å; L96-F105 PolarHBondContact O-N 3.36Å; L96-V107 HydrophobicContact CD1-CG2 3.85Å; L96-V107 HydrophobicContact CG-CG2 3.83Å; L96-M112 HydrophobicContact CD1-CE 4.08Å; L96-F119 HydrophobicContact CD1-CE1 3.93Å; L96-F119 HydrophobicContact CD1-CZ 3.71Å; L96-F119 HydrophobicContact CD2-CE1 4.1Å; L96-I135 HydrophobicContact CD2-CB 4.15Å; L96-L137 HydrophobicContact CB-CD1 4.31Å; L96-L137 HydrophobicContact CD1-CD1 4.21Å; L96-L137 HydrophobicContact CD2-CD1 4.31Å; L96-L145 HydrophobicContact CB-CD2 4.18Å; L96-L145 HydrophobicContact CD1-CD1 4.33Å; L96-I149 HydrophobicContact CD1-CD1 4.41Å
97	L	95.7	Very high	93.9	Very high	29 Å²	29	54.6 Å²	54.6	15%	0.152	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	130.7	171.5	-59	173.9	0	0	0	108.4	D103 A104 C134 I135 K136 L137	L97-D103 WeakPolarHBondContact CD2-O 3.39Å; L97-A104 HydrophobicContact CD2-CB 4.17Å; L97-C134 WeakPolarHBondContact CD1-SG 3.47Å; L97-I135 PolarHBondContact N-O 3.05Å; L97-K136 HydrophobicContact CB-CB 4.37Å; L97-K136 HydrophobicContact CB-CG 4.27Å; L97-K136 WeakPolarHBondContact O-CA 3.31Å; L97-L137 PolarHBondContact O-N 3.4Å
98	P	94.6	Very high	94.1	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	167.7	172.8	34.6	-35.9	0	0	0	110.2	D100 T101 D103 F105 V140 K142 L145	P98-D100 WeakPolarHBondContact CB-OD1 3.23Å; P98-T101 VanDerWaalsContact CG-OG1 3.25Å; P98-T101 WeakPolarHBondContact CG-OG1 3.45Å; P98-D103 WeakPolarHBondContact CD-O 3.36Å; P98-D103 HydrophobicContact CG-CB 4.47Å; P98-F105 HydrophobicContact CG-CE2 4.17Å; P98-V140 WeakPolarHBondContact CB-O 3.45Å; P98-K142 HydrophobicContact CB-CB 4.39Å; P98-K142 HydrophobicContact CG-CB 4.08Å; P98-L145 HydrophobicContact CB-CD2 3.98Å
99	G	88.3	Confident	94.1	Very high	27 Å²	27	45.3 Å²	45.3	28%	0.278	27%	0.272	S	S	.	.	S	Bend	trans	-75.2	-29.1	-176.1	0	0	0	0	0	113.5	L137 V140	G99-L137 WeakPolarHBondContact CA-O 3.4Å; G99-L137 PolarHBondContact N-O 2.9Å; G99-L137 VanDerWaalsContact N-O 3.09Å; G99-V140 PolarHBondContact N-O 3.13Å
100	D	89.1	Confident	94.1	Very high	93 Å²	93	47.6 Å²	47.6	50%	0.497	28%	0.277	S	S	.	.	S	Bend	trans	-93	-23.6	-170.7	59.9	-20.4	0	0	0	114	P98 S141 K142	P98-D100 WeakPolarHBondContact CB-OD1 3.23Å; D100-S141 WeakPolarHBondContact OD2-CA 3.26Å; D100-S141 WeakPolarHBondContact OD2-CB 3.42Å; D100-K142 PolarHBondContact OD1-N 2.91Å; D100-K142 PolarHBondContact OD2-N 3.44Å; D100-K142 VanDerWaalsContact OD2-N 3.13Å
101	T	91.6	Very high	94.2	Very high	44 Å²	44	44 Å²	44	27%	0.27	26%	0.258	S	S	.	.			trans	-136.6	168.2	177.7	73.7	0	0	0	0	111.5	P98 D103 K142	P98-T101 VanDerWaalsContact CG-OG1 3.25Å; P98-T101 WeakPolarHBondContact CG-OG1 3.45Å; T101-D103 VanDerWaalsContact C-N 3.3Å; T101-D103 VanDerWaalsContact CB-OD2 3.31Å; T101-D103 WeakPolarHBondContact CB-OD2 3.23Å; T101-D103 WeakPolarHBondContact OG1-CB 3.3Å; T101-D103 PolarHBondContact OG1-N 3.4Å; T101-D103 PolarHBondContact OG1-OD2 3.28Å; T101-K142 HydrophobicContact CG2-CB 4.46Å
102	D	89.9	Confident	94.3	Very high	126 Å²	126	37.4 Å²	37.4	67%	0.674	22%	0.223	S	C	*	.			trans	-97.2	27.1	172	-63.6	-39.8	0	0	0	111.8	A104 K136	D102-A104 PolarHBondContact O-N 3.45Å; D102-K136 IonicContact OD1-NZ 2.8Å; D102-K136 PolarHBondContact OD1-NZ 3.5Å
103	D	92.6	Very high	94.3	Very high	53 Å²	53	36.7 Å²	36.7	28%	0.283	22%	0.22	S	C	.	.			trans	-67	126.7	174.9	-71.5	-76.2	0	0	0	111.1	L97 P98 T101 F105 K142	L97-D103 WeakPolarHBondContact CD2-O 3.39Å; P98-D103 WeakPolarHBondContact CD-O 3.36Å; P98-D103 HydrophobicContact CG-CB 4.47Å; T101-D103 VanDerWaalsContact C-N 3.3Å; T101-D103 VanDerWaalsContact CB-OD2 3.31Å; T101-D103 WeakPolarHBondContact CB-OD2 3.23Å; T101-D103 WeakPolarHBondContact OG1-CB 3.3Å; T101-D103 PolarHBondContact OG1-N 3.4Å; T101-D103 PolarHBondContact OG1-OD2 3.28Å; D103-F105 HydrophobicContact CB-CE2 3.87Å; D103-F105 HydrophobicContact CB-CZ 4.46Å; D103-F105 WeakPolarHBondContact O-CD2 3.46Å; D103-K142 VanDerWaalsContact CG-CE 3.45Å; D103-K142 IonicContact OD1-NZ 2.97Å; D103-K142 PolarHBondContact OD1-NZ 3.02Å; D103-K142 WeakPolarHBondContact OD2-CD 3.01Å; D103-K142 WeakPolarHBondContact OD2-CE 3.08Å; D103-K142 IonicContact OD2-NZ 2.68Å; D103-K142 PolarHBondContact OD2-NZ 3.34Å
104	A	94.2	Very high	94.3	Very high	65 Å²	65	38 Å²	38	54%	0.537	23%	0.234	S	C	.	.			trans	-88.5	125.3	-178.8	0	0	0	0	0	112.7	T95 L97 D102 P106	T95-A104 HydrophobicContact CG2-CB 3.66Å; L97-A104 HydrophobicContact CD2-CB 4.17Å; D102-A104 PolarHBondContact O-N 3.45Å; A104-P106 WeakPolarHBondContact O-CD 3.46Å
105	F	96.6	Very high	94.2	Very high	6 Å²	6	39.8 Å²	39.8	3%	0.026	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	95.6	173.2	-63.6	-93.9	0	0	0	110.3	L96 P98 D103 V107 K142 L145 R146 I149	L96-F105 HydrophobicContact CB-CB 4.46Å; L96-F105 PolarHBondContact N-O 2.92Å; L96-F105 WeakPolarHBondContact O-CB 3.4Å; L96-F105 PolarHBondContact O-N 3.36Å; P98-F105 HydrophobicContact CG-CE2 4.17Å; D103-F105 HydrophobicContact CB-CE2 3.87Å; D103-F105 HydrophobicContact CB-CZ 4.46Å; D103-F105 WeakPolarHBondContact O-CD2 3.46Å; F105-V107 PolarHBondContact O-N 3.03Å; F105-K142 HydrophobicContact CE2-CG 4.36Å; F105-K142 HydrophobicContact CZ-CG 4.03Å; F105-L145 HydrophobicContact CD2-CD2 3.86Å; F105-L145 HydrophobicContact CE2-CD2 4.19Å; F105-L145 HydrophobicContact CG-CD2 4.45Å; F105-R146 HydrophobicContact CE1-CB 3.89Å; F105-R146 HydrophobicContact CE1-CG 4.22Å; F105-R146 HydrophobicContact CZ-CB 4.22Å; F105-I149 HydrophobicContact CB-CD1 3.72Å; F105-I149 HydrophobicContact CD1-CD1 4.07Å; F105-I149 HydrophobicContact CG-CD1 4.02Å
106	P	96.5	Very high	94.2	Very high	49 Å²	49	38 Å²	38	32%	0.318	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	129.7	173.7	28	-33	0	0	0	110	R86 C92 A104	R86-P106 WeakPolarHBondContact CG-O 3.44Å; R86-P106 PolarHBondContact NH1-O 3.42Å; C92-P106 HydrophobicContact CB-CB 3.96Å; A104-P106 WeakPolarHBondContact O-CD 3.46Å
107	V	97.1	Very high	94.1	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	171.3	-178.4	-61.7	0	0	0	0	110.8	C92 D93 V94 L96 F105 M112 I149 Y153	C92-V107 WeakPolarHBondContact CA-O 3.16Å; D93-V107 PolarHBondContact N-O 3.01Å; V94-V107 HydrophobicContact CG1-CG2 3.47Å; V94-V107 VanDerWaalsContact CG1-CG2 3.47Å; V94-V107 PolarHBondContact N-O 3.32Å; V94-V107 PolarHBondContact O-N 3.45Å; V94-V107 VanDerWaalsContact O-O 3.07Å; L96-V107 HydrophobicContact CD1-CG2 3.85Å; L96-V107 HydrophobicContact CG-CG2 3.83Å; F105-V107 PolarHBondContact O-N 3.03Å; V107-M112 HydrophobicContact CB-CG 4.11Å; V107-M112 HydrophobicContact CB-SD 4.17Å; V107-M112 HydrophobicContact CG1-SD 4.25Å; V107-M112 HydrophobicContact CG2-CG 3.75Å; V107-M112 HydrophobicContact CG2-SD 4.28Å; V107-I149 HydrophobicContact CG1-CD1 3.91Å; V107-I149 HydrophobicContact CG1-CG1 4.26Å; V107-I149 HydrophobicContact CG1-CG2 3.84Å; V107-Y153 HydrophobicContact CG1-CE2 4.43Å
108	H	96.6	Very high	94.1	Very high	8 Å²	8	44.1 Å²	44.1	4%	0.037	27%	0.267	C	S	.	.			trans	-102	123.2	175.6	-57.5	77.1	0	0	0	109.7	L90 L91 D93 V110 M111 M112 Y153	L90-H108 PolarHBondContact O-NE2 2.94Å; L90-H108 VanDerWaalsContact O-NE2 3.13Å; L91-H108 PolarHBondContact O-CD2 3.37Å; D93-H108 VanDerWaalsContact OD1-CA 3.3Å; D93-H108 WeakPolarHBondContact OD1-CA 3.34Å; H108-V110 HydrophobicContact CB-CG1 4.32Å; H108-V110 PolarHBondContact O-N 2.97Å; H108-M111 HydrophobicContact CB-CB 4.2Å; H108-M111 HydrophobicContact CB-CG 4.06Å; H108-M111 PolarHBondContact O-N 3.15Å; H108-M112 PolarHBondContact O-N 3.08Å; H108-M112 VanDerWaalsContact O-N 3.15Å; H108-Y153 WeakPolarHBondContact CB-OH 3.37Å; H108-Y153 PolarHBondContact N-OH 3.39Å; H108-Y153 AromaticContact ND1-CE1 3.9Å; H108-Y153 AromaticContact ND1-CZ 3.8Å; H108-Y153 PolarHBondContact ND1-OH 2.98Å
109	R	94.5	Very high	94.1	Very high	34 Å²	34	44.1 Å²	44.1	13%	0.128	27%	0.267	C	S	.	.	H	α-helix	trans	-52.4	-41.4	-180	-73.1	172	169.6	-90	-1.9	111.8	D93 V94 M111 M112 A113 F123 E129 Q130 L132	D93-R109 PolarHBondContact O-NE 3.18Å; D93-R109 WeakPolarHBondContact OD1-CG 3.06Å; D93-R109 PolarHBondContact OD1-N 2.95Å; D93-R109 WeakPolarHBondContact OD2-CB 3.48Å; V94-R109 HydrophobicContact CB-CG 3.83Å; V94-R109 HydrophobicContact CG1-CG 3.58Å; R109-M111 PolarHBondContact O-N 2.89Å; R109-M112 PolarHBondContact O-N 3.01Å; R109-A113 VanDerWaalsContact O-CB 3.23Å; R109-A113 WeakPolarHBondContact O-CB 3.41Å; R109-A113 PolarHBondContact O-N 2.81Å; R109-F123 HydrophobicContact CB-CD2 3.73Å; R109-F123 HydrophobicContact CB-CE2 3.89Å; R109-F123 HydrophobicContact CB-CG 4.43Å; R109-F123 HydrophobicContact CG-CD2 3.94Å; R109-F123 HydrophobicContact CG-CE2 3.87Å; R109-F123 HydrophobicContact CG-CG 4.34Å; R109-F123 HydrophobicContact CG-CZ 4.21Å; R109-E129 PolarHBondContact NH2-O 3.25Å; R109-E129 VanDerWaalsContact NH2-O 3.11Å; R109-Q130 VanDerWaalsContact CZ-O 3.31Å; R109-Q130 PolarHBondContact NH1-O 3.25Å; R109-Q130 PolarHBondContact NH2-O 3.38Å; R109-Q130 VanDerWaalsContact NH2-O 3.13Å; R109-L132 PolarHBondContact NH2-O 3.09Å
110	V	94	Very high	94.4	Very high	94 Å²	94	48 Å²	48	57%	0.57	28%	0.276	S	S	*	.	H	α-helix	trans	-64.3	-36.6	179.8	70.1	0	0	0	0	113	H108 S114	H108-V110 HydrophobicContact CB-CG1 4.32Å; H108-V110 PolarHBondContact O-N 2.97Å; V110-S114 VanDerWaalsContact O-CB 3.26Å; V110-S114 WeakPolarHBondContact O-CB 3.49Å; V110-S114 PolarHBondContact O-N 3.4Å; V110-S114 PolarHBondContact O-OG 3.47Å
111	M	95.4	Very high	94.6	Very high	17 Å²	17	46.1 Å²	46.1	8%	0.084	27%	0.274	C	S	.	.	H	α-helix	trans	-71.4	-41.8	177.6	-73.8	-58.9	-62.7	0	0	111.1	L79 F82 H108 R109 S114 A115 I152 Y153	L79-M111 HydrophobicContact CD2-CE 3.66Å; F82-M111 HydrophobicContact CB-SD 4.41Å; F82-M111 HydrophobicContact CD1-CG 4Å; F82-M111 HydrophobicContact CD1-SD 4.2Å; F82-M111 HydrophobicContact CD2-SD 3.81Å; F82-M111 HydrophobicContact CE1-CG 4.34Å; F82-M111 HydrophobicContact CE1-SD 4.43Å; F82-M111 HydrophobicContact CE2-SD 4.06Å; F82-M111 HydrophobicContact CG-CG 4.17Å; F82-M111 HydrophobicContact CG-SD 3.88Å; F82-M111 HydrophobicContact CZ-SD 4.36Å; H108-M111 HydrophobicContact CB-CB 4.2Å; H108-M111 HydrophobicContact CB-CG 4.06Å; H108-M111 PolarHBondContact O-N 3.15Å; R109-M111 PolarHBondContact O-N 2.89Å; M111-S114 PolarHBondContact O-OG 3.28Å; M111-A115 PolarHBondContact O-N 3.36Å; M111-I152 HydrophobicContact CB-CG2 4.32Å; M111-I152 HydrophobicContact CE-CG2 4.25Å; M111-Y153 HydrophobicContact CB-CE1 4.36Å; M111-Y153 HydrophobicContact CB-CE2 4.34Å; M111-Y153 HydrophobicContact CG-CE1 4Å
112	M	95.9	Very high	94.6	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-68.5	-44.8	178.1	-56.6	-52.7	-63.1	0	0	111.2	L96 V107 H108 R109 S114 A115 S116 F119 F123 I149 I152 Y153	L96-M112 HydrophobicContact CD1-CE 4.08Å; V107-M112 HydrophobicContact CB-CG 4.11Å; V107-M112 HydrophobicContact CB-SD 4.17Å; V107-M112 HydrophobicContact CG1-SD 4.25Å; V107-M112 HydrophobicContact CG2-CG 3.75Å; V107-M112 HydrophobicContact CG2-SD 4.28Å; H108-M112 PolarHBondContact O-N 3.08Å; H108-M112 VanDerWaalsContact O-N 3.15Å; R109-M112 PolarHBondContact O-N 3.01Å; M112-S114 VanDerWaalsContact C-N 3.32Å; M112-S114 PolarHBondContact O-N 3.1Å; M112-A115 PolarHBondContact O-N 3.42Å; M112-S116 VanDerWaalsContact O-CB 3.3Å; M112-S116 WeakPolarHBondContact O-CB 3.33Å; M112-S116 PolarHBondContact O-N 3.49Å; M112-F119 HydrophobicContact CB-CB 3.94Å; M112-F119 HydrophobicContact CB-CD1 4.45Å; M112-F119 HydrophobicContact CB-CD2 3.77Å; M112-F119 HydrophobicContact CB-CE2 4.4Å; M112-F119 HydrophobicContact CB-CG 3.81Å; M112-F119 HydrophobicContact CE-CD2 3.68Å; M112-F119 HydrophobicContact CE-CE2 3.21Å; M112-F119 HydrophobicContact CE-CZ 3.79Å; M112-F123 HydrophobicContact CB-CE2 4.01Å; M112-I149 HydrophobicContact CE-CG1 4.12Å; M112-I152 HydrophobicContact CE-CD1 3.39Å; M112-I152 HydrophobicContact SD-CD1 3.79Å; M112-I152 HydrophobicContact SD-CG2 4.35Å; M112-Y153 HydrophobicContact SD-CE2 4.41Å
113	A	95.1	Very high	94.7	Very high	20 Å²	20	39.6 Å²	39.6	17%	0.165	24%	0.236	C	C	.	.	H	α-helix	trans	-69.4	-24.4	179.1	0	0	0	0	0	114	R109 K120 F123	R109-A113 VanDerWaalsContact O-CB 3.23Å; R109-A113 WeakPolarHBondContact O-CB 3.41Å; R109-A113 PolarHBondContact O-N 2.81Å; A113-K120 HydrophobicContact CB-CB 4.18Å; A113-K120 WeakPolarHBondContact O-CB 3.26Å; A113-F123 HydrophobicContact CB-CD2 4.18Å
114	S	94.4	Very high	94.6	Very high	90 Å²	90	41.9 Å²	41.9	63%	0.629	25%	0.252	S	S	*	.	H	α-helix	trans	-76.7	-29.6	175.4	67.8	0	0	0	0	112.5	V110 M111 M112	V110-S114 VanDerWaalsContact O-CB 3.26Å; V110-S114 WeakPolarHBondContact O-CB 3.49Å; V110-S114 PolarHBondContact O-N 3.4Å; V110-S114 PolarHBondContact O-OG 3.47Å; M111-S114 PolarHBondContact O-OG 3.28Å; M112-S114 VanDerWaalsContact C-N 3.32Å; M112-S114 PolarHBondContact O-N 3.1Å
115	A	94.4	Very high	94	Very high	41 Å²	41	41.4 Å²	41.4	34%	0.339	25%	0.253	S	S	.	.	H	α-helix	trans	-98.4	-12.9	-177.2	0	0	0	0	0	114.5	M111 M112 I152 I176	M111-A115 PolarHBondContact O-N 3.36Å; M112-A115 PolarHBondContact O-N 3.42Å; A115-I152 HydrophobicContact CB-CB 4.44Å; A115-I152 HydrophobicContact CB-CD1 4.07Å; A115-I152 HydrophobicContact CB-CG1 3.74Å; A115-I152 HydrophobicContact CB-CG2 4.01Å; A115-I176 WeakPolarHBondContact O-CD1 3.46Å
116	S	96.5	Very high	93.2	Very high	2 Å²	2	44 Å²	44	1%	0.014	28%	0.282	C	S	.	.			trans	-141	122.6	-173.1	171.6	0	0	0	0	111.7	M112 Y118 F119 K120 L174	M112-S116 VanDerWaalsContact O-CB 3.3Å; M112-S116 WeakPolarHBondContact O-CB 3.33Å; M112-S116 PolarHBondContact O-N 3.49Å; S116-Y118 PolarHBondContact O-N 2.96Å; S116-Y118 WeakPolarHBondContact OG-CB 3.49Å; S116-Y118 PolarHBondContact OG-N 3.16Å; S116-F119 PolarHBondContact O-N 3.07Å; S116-F119 WeakPolarHBondContact OG-CD2 3.44Å; S116-F119 PolarHBondContact OG-N 2.88Å; S116-F119 VanDerWaalsContact OG-N 3.13Å; S116-K120 WeakPolarHBondContact O-CB 3.39Å; S116-K120 PolarHBondContact O-N 3.48Å; S116-L174 WeakPolarHBondContact CB-O 3.26Å; S116-L174 PolarHBondContact OG-O 2.93Å
117	D	93.9	Very high	92.5	Very high	96 Å²	96	47 Å²	47	51%	0.513	29%	0.293	S	S	.	.	H	α-helix	trans	-66.2	-29.1	172.9	-75.5	-38	0	0	0	112.3	K120 A121	D117-K120 PolarHBondContact O-N 3.13Å; D117-A121 WeakPolarHBondContact O-CB 3.49Å; D117-A121 PolarHBondContact O-N 2.95Å
118	Y	94.4	Very high	91.6	Very high	61 Å²	61	54.9 Å²	54.9	24%	0.239	33%	0.328	C	S	.	.	H	α-helix	trans	-61.1	-52.7	172.7	175.9	-93.9	0	0	0	111.4	S116 K120 A121 M122 L137 F173 L174	S116-Y118 PolarHBondContact O-N 2.96Å; S116-Y118 WeakPolarHBondContact OG-CB 3.49Å; S116-Y118 PolarHBondContact OG-N 3.16Å; Y118-K120 VanDerWaalsContact C-N 3.33Å; Y118-K120 PolarHBondContact O-N 2.92Å; Y118-A121 PolarHBondContact O-N 2.97Å; Y118-M122 HydrophobicContact CD1-CE 4.28Å; Y118-M122 HydrophobicContact CE1-CE 3.29Å; Y118-M122 HydrophobicContact CE2-CE 4.47Å; Y118-M122 VanDerWaalsContact CZ-CE 3.41Å; Y118-M122 WeakPolarHBondContact O-CB 3.47Å; Y118-M122 PolarHBondContact O-N 2.92Å; Y118-M122 WeakPolarHBondContact OH-CE 3.43Å; Y118-L137 HydrophobicContact CE1-CD2 4.15Å; Y118-F173 HydrophobicContact CE1-CE1 4.09Å; Y118-F173 HydrophobicContact CE2-CE1 4.08Å; Y118-F173 HydrophobicContact CE2-CZ 4.3Å; Y118-F173 AromaticContact CZ-CE1 3.62Å; Y118-F173 WeakPolarHBondContact OH-CE1 3.44Å; Y118-L174 HydrophobicContact CD1-CD2 3.65Å; Y118-L174 HydrophobicContact CE1-CD2 3.76Å; Y118-L174 HydrophobicContact CG-CD2 4.49Å
119	F	95.1	Very high	91	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-67.6	-35.7	177.8	-72.9	-59.9	0	0	0	112.1	L96 M112 S116 A121 M122 F123 L137 L174	L96-F119 HydrophobicContact CD1-CE1 3.93Å; L96-F119 HydrophobicContact CD1-CZ 3.71Å; L96-F119 HydrophobicContact CD2-CE1 4.1Å; M112-F119 HydrophobicContact CB-CB 3.94Å; M112-F119 HydrophobicContact CB-CD1 4.45Å; M112-F119 HydrophobicContact CB-CD2 3.77Å; M112-F119 HydrophobicContact CB-CE2 4.4Å; M112-F119 HydrophobicContact CB-CG 3.81Å; M112-F119 HydrophobicContact CE-CD2 3.68Å; M112-F119 HydrophobicContact CE-CE2 3.21Å; M112-F119 HydrophobicContact CE-CZ 3.79Å; S116-F119 PolarHBondContact O-N 3.07Å; S116-F119 WeakPolarHBondContact OG-CD2 3.44Å; S116-F119 PolarHBondContact OG-N 2.88Å; S116-F119 VanDerWaalsContact OG-N 3.13Å; F119-A121 PolarHBondContact O-N 2.61Å; F119-M122 HydrophobicContact CD1-SD 4.29Å; F119-M122 PolarHBondContact O-N 3.35Å; F119-F123 HydrophobicContact CB-CD2 4.28Å; F119-F123 HydrophobicContact CB-CE2 3.93Å; F119-F123 HydrophobicContact CB-CZ 4.38Å; F119-F123 HydrophobicContact CD1-CE1 4.33Å; F119-F123 HydrophobicContact CD1-CE2 4.07Å; F119-F123 AromaticContact CD1-CZ 3.69Å; F119-F123 HydrophobicContact CD1-CZ 3.69Å; F119-F123 HydrophobicContact CE1-CZ 4.42Å; F119-F123 HydrophobicContact CG-CE2 4.3Å; F119-F123 HydrophobicContact CG-CZ 4.38Å; F119-F123 WeakPolarHBondContact O-CB 3.34Å; F119-F123 WeakPolarHBondContact O-CD2 3.37Å; F119-F123 VanDerWaalsContact O-CG 3.23Å; F119-F123 WeakPolarHBondContact O-CG 3.48Å; F119-F123 PolarHBondContact O-N 3.46Å; F119-L137 HydrophobicContact CE1-CD1 4.18Å; F119-L137 HydrophobicContact CE1-CD2 4.31Å; F119-L137 HydrophobicContact CZ-CD1 3.96Å; F119-L174 HydrophobicContact CE1-CD2 4.27Å; F119-L174 HydrophobicContact CE2-CB 4.32Å; F119-L174 HydrophobicContact CE2-CD1 4.02Å; F119-L174 HydrophobicContact CE2-CD2 3.73Å; F119-L174 HydrophobicContact CE2-CG 4.24Å; F119-L174 HydrophobicContact CZ-CD1 4.15Å; F119-L174 HydrophobicContact CZ-CD2 3.53Å; F119-L174 HydrophobicContact CZ-CG 4.39Å
120	K	94.1	Very high	90.5	Very high	108 Å²	108	60 Å²	60	47%	0.47	35%	0.353	S	S	.	.	H	α-helix	trans	-58.3	-49.5	174.1	-171	177	177.3	-178.2	0	111.3	A113 S116 D117 Y118 F123 T124	A113-K120 HydrophobicContact CB-CB 4.18Å; A113-K120 WeakPolarHBondContact O-CB 3.26Å; S116-K120 WeakPolarHBondContact O-CB 3.39Å; S116-K120 PolarHBondContact O-N 3.48Å; D117-K120 PolarHBondContact O-N 3.13Å; Y118-K120 VanDerWaalsContact C-N 3.33Å; Y118-K120 PolarHBondContact O-N 2.92Å; K120-F123 PolarHBondContact O-N 3.36Å; K120-T124 WeakPolarHBondContact O-CB 3.33Å; K120-T124 PolarHBondContact O-N 3.32Å; K120-T124 PolarHBondContact O-OG1 2.87Å
121	A	92.9	Very high	90	Very high	55 Å²	55	63.8 Å²	63.8	46%	0.455	37%	0.365	S	S	.	.	H	α-helix	trans	-63.3	-43.6	176.4	0	0	0	0	0	111.6	D117 Y118 F119 F123 G125	D117-A121 WeakPolarHBondContact O-CB 3.49Å; D117-A121 PolarHBondContact O-N 2.95Å; Y118-A121 PolarHBondContact O-N 2.97Å; F119-A121 PolarHBondContact O-N 2.61Å; A121-F123 PolarHBondContact O-N 2.99Å; A121-G125 WeakPolarHBondContact O-CA 3.28Å; A121-G125 PolarHBondContact O-N 3.47Å
122	M	92.4	Very high	89.8	Confident	17 Å²	17	66.1 Å²	66.1	8%	0.084	38%	0.377	C	S	.	.	H	α-helix	trans	-60.3	-41.8	178.2	-177	-176.5	-75.5	0	0	112.7	Y118 F119 E129 I135 L137	Y118-M122 HydrophobicContact CD1-CE 4.28Å; Y118-M122 HydrophobicContact CE1-CE 3.29Å; Y118-M122 HydrophobicContact CE2-CE 4.47Å; Y118-M122 VanDerWaalsContact CZ-CE 3.41Å; Y118-M122 WeakPolarHBondContact O-CB 3.47Å; Y118-M122 PolarHBondContact O-N 2.92Å; Y118-M122 WeakPolarHBondContact OH-CE 3.43Å; F119-M122 HydrophobicContact CD1-SD 4.29Å; F119-M122 PolarHBondContact O-N 3.35Å; M122-E129 HydrophobicContact CG-CB 3.66Å; M122-E129 HydrophobicContact CG-CG 4.35Å; M122-E129 HydrophobicContact SD-CB 4.03Å; M122-E129 HydrophobicContact SD-CG 4.38Å; M122-I135 HydrophobicContact CE-CG2 4.5Å; M122-I135 HydrophobicContact SD-CD1 4Å; M122-I135 HydrophobicContact SD-CG2 4.07Å; M122-L137 HydrophobicContact CE-CD2 4.12Å
123	F	92.9	Very high	89.4	Confident	16 Å²	16	72.8 Å²	72.8	7%	0.07	41%	0.41	C	S	.	.	H	α-helix	trans	-89.9	-16.8	-173.8	-59	-22.1	0	0	0	114.2	V94 R109 M112 A113 F119 K120 A121 Q130 I135	V94-F123 HydrophobicContact CG1-CZ 4.34Å; R109-F123 HydrophobicContact CB-CD2 3.73Å; R109-F123 HydrophobicContact CB-CE2 3.89Å; R109-F123 HydrophobicContact CB-CG 4.43Å; R109-F123 HydrophobicContact CG-CD2 3.94Å; R109-F123 HydrophobicContact CG-CE2 3.87Å; R109-F123 HydrophobicContact CG-CG 4.34Å; R109-F123 HydrophobicContact CG-CZ 4.21Å; M112-F123 HydrophobicContact CB-CE2 4.01Å; A113-F123 HydrophobicContact CB-CD2 4.18Å; F119-F123 HydrophobicContact CB-CD2 4.28Å; F119-F123 HydrophobicContact CB-CE2 3.93Å; F119-F123 HydrophobicContact CB-CZ 4.38Å; F119-F123 HydrophobicContact CD1-CE1 4.33Å; F119-F123 HydrophobicContact CD1-CE2 4.07Å; F119-F123 AromaticContact CD1-CZ 3.69Å; F119-F123 HydrophobicContact CD1-CZ 3.69Å; F119-F123 HydrophobicContact CE1-CZ 4.42Å; F119-F123 HydrophobicContact CG-CE2 4.3Å; F119-F123 HydrophobicContact CG-CZ 4.38Å; F119-F123 WeakPolarHBondContact O-CB 3.34Å; F119-F123 WeakPolarHBondContact O-CD2 3.37Å; F119-F123 VanDerWaalsContact O-CG 3.23Å; F119-F123 WeakPolarHBondContact O-CG 3.48Å; F119-F123 PolarHBondContact O-N 3.46Å; K120-F123 PolarHBondContact O-N 3.36Å; A121-F123 PolarHBondContact O-N 2.99Å; F123-Q130 WeakPolarHBondContact O-CG 3.47Å; F123-I135 HydrophobicContact CE1-CD1 3.65Å; F123-I135 HydrophobicContact CZ-CD1 4.44Å
124	T	89.9	Confident	89.3	Confident	101 Å²	101	74.9 Å²	74.9	62%	0.62	42%	0.422	S	S	*	.	H	α-helix	trans	-120.7	-9.6	-177.3	67.4	0	0	0	0	114	K120 G126	K120-T124 WeakPolarHBondContact O-CB 3.33Å; K120-T124 PolarHBondContact O-N 3.32Å; K120-T124 PolarHBondContact O-OG1 2.87Å; T124-G126 PolarHBondContact O-N 2.58Å
125	G	81.6	Confident	89.3	Confident	54 Å²	54	70.8 Å²	70.8	56%	0.557	39%	0.394	S	S	*	.	S	Bend	trans	-89.3	9.3	-172.7	0	0	0	0	0	115.9	A121 M127	A121-G125 WeakPolarHBondContact O-CA 3.28Å; A121-G125 PolarHBondContact O-N 3.47Å; G125-M127 VanDerWaalsContact C-N 3.3Å; G125-M127 PolarHBondContact O-N 3.32Å
126	G	79.6	Confident	89.2	Confident	62 Å²	62	72.6 Å²	72.6	64%	0.639	39%	0.394	S	S	*	.			trans	73.4	19.7	-178.8	0	0	0	0	0	114.4	T124 Q130	T124-G126 PolarHBondContact O-N 2.58Å; G126-Q130 VanDerWaalsContact CA-OE1 3.3Å; G126-Q130 VanDerWaalsContact N-OE1 3.12Å
127	M	81.3	Confident	89	Confident	110 Å²	110	72.6 Å²	72.6	54%	0.542	39%	0.394	S	S	.	.			trans	-73	155.9	174.5	-62.7	-65.4	-158.6	0	0	110.7	G125 E129 Q130	G125-M127 VanDerWaalsContact C-N 3.3Å; G125-M127 PolarHBondContact O-N 3.32Å; M127-E129 WeakPolarHBondContact CB-OE2 3.46Å; M127-E129 PolarHBondContact O-N 3.27Å; M127-Q130 WeakPolarHBondContact O-CB 3.46Å; M127-Q130 PolarHBondContact O-N 2.89Å
128	K	79.3	Confident	88.7	Confident	167 Å²	167	74.4 Å²	74.4	73%	0.726	40%	0.399	S	S	*	.	G	3₁₀ helix	trans	-59.1	-33.5	-179.2	-172.8	179.8	178.7	-176.5	0	112	Q130 E131	K128-Q130 PolarHBondContact O-N 2.68Å; K128-E131 PolarHBondContact O-N 2.97Å
129	E	82.9	Confident	88.2	Confident	68 Å²	68	73.3 Å²	73.3	32%	0.318	41%	0.405	S	S	.	.	G	3₁₀ helix	trans	-62.1	-19.8	177.8	-66.4	76.4	-171	0	0	113.2	R109 M122 M127 E131 L132 I135	R109-E129 PolarHBondContact NH2-O 3.25Å; R109-E129 VanDerWaalsContact NH2-O 3.11Å; M122-E129 HydrophobicContact CG-CB 3.66Å; M122-E129 HydrophobicContact CG-CG 4.35Å; M122-E129 HydrophobicContact SD-CB 4.03Å; M122-E129 HydrophobicContact SD-CG 4.38Å; M127-E129 WeakPolarHBondContact CB-OE2 3.46Å; M127-E129 PolarHBondContact O-N 3.27Å; E129-E131 PolarHBondContact O-N 3.5Å; E129-L132 HydrophobicContact CG-CD1 4.44Å; E129-L132 PolarHBondContact O-N 2.98Å; E129-I135 HydrophobicContact CB-CD1 4.07Å; E129-I135 HydrophobicContact CB-CG1 4.4Å; E129-I135 HydrophobicContact CG-CG2 4.18Å; E129-I135 WeakPolarHBondContact O-CD1 3.25Å
130	Q	84.4	Confident	88.1	Confident	80 Å²	80	73.4 Å²	73.4	37%	0.374	41%	0.406	S	S	.	.	G	3₁₀ helix	trans	-58.7	-35.9	174.9	-179.2	172.7	-22.3	0	0	112	R109 F123 G126 M127 K128	R109-Q130 VanDerWaalsContact CZ-O 3.31Å; R109-Q130 PolarHBondContact NH1-O 3.25Å; R109-Q130 PolarHBondContact NH2-O 3.38Å; R109-Q130 VanDerWaalsContact NH2-O 3.13Å; F123-Q130 WeakPolarHBondContact O-CG 3.47Å; G126-Q130 VanDerWaalsContact CA-OE1 3.3Å; G126-Q130 VanDerWaalsContact N-OE1 3.12Å; M127-Q130 WeakPolarHBondContact O-CB 3.46Å; M127-Q130 PolarHBondContact O-N 2.89Å; K128-Q130 PolarHBondContact O-N 2.68Å
131	E	84.1	Confident	88.2	Confident	175 Å²	175	69 Å²	69	82%	0.818	39%	0.389	S	S	*	.	S	Bend	trans	-96.8	-6.4	-177.1	-61.4	-176.5	171.9	0	0	113.1	K128 E129	K128-E131 PolarHBondContact O-N 2.97Å; E129-E131 PolarHBondContact O-N 3.5Å
132	L	89.6	Confident	88.3	Confident	65 Å²	65	69.4 Å²	69.4	34%	0.34	38%	0.38	S	S	.	.			trans	-82.6	130.5	-176.8	-63.9	-179.1	0	0	0	112	R109 E129 C134 I135	R109-L132 PolarHBondContact NH2-O 3.09Å; E129-L132 HydrophobicContact CG-CD1 4.44Å; E129-L132 PolarHBondContact O-N 2.98Å; L132-C134 VanDerWaalsContact C-N 3.28Å; L132-I135 HydrophobicContact CB-CG1 4.06Å
133	M	88.8	Confident	88.4	Confident	140 Å²	140	71.7 Å²	71.7	69%	0.69	40%	0.395	S	S	*	.	S	Bend	trans	-76.6	-18	171.1	-70.5	-64.9	177.1	0	0	113	T95	T95-M133 PolarHBondContact N-O 3.47Å
134	C	93	Very high	88.6	Confident	64 Å²	64	70.9 Å²	70.9	43%	0.432	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	122.7	-179.4	-169.1	0	0	0	0	110	T95 L97 L132	T95-C134 WeakPolarHBondContact O-CA 3.33Å; L97-C134 WeakPolarHBondContact CD1-SG 3.47Å; L132-C134 VanDerWaalsContact C-N 3.28Å
135	I	93.6	Very high	88.9	Confident	5 Å²	5	66.1 Å²	66.1	3%	0.026	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	123.8	-173.5	-58.4	170.9	0	0	0	109	V94 T95 L96 L97 M122 F123 E129 L132 L137	V94-I135 HydrophobicContact CG2-CD1 3.66Å; V94-I135 HydrophobicContact CG2-CG1 4.09Å; T95-I135 PolarHBondContact O-N 3.3Å; L96-I135 HydrophobicContact CD2-CB 4.15Å; L97-I135 PolarHBondContact N-O 3.05Å; M122-I135 HydrophobicContact CE-CG2 4.5Å; M122-I135 HydrophobicContact SD-CD1 4Å; M122-I135 HydrophobicContact SD-CG2 4.07Å; F123-I135 HydrophobicContact CE1-CD1 3.65Å; F123-I135 HydrophobicContact CZ-CD1 4.44Å; E129-I135 HydrophobicContact CB-CD1 4.07Å; E129-I135 HydrophobicContact CB-CG1 4.4Å; E129-I135 HydrophobicContact CG-CG2 4.18Å; E129-I135 WeakPolarHBondContact O-CD1 3.25Å; L132-I135 HydrophobicContact CB-CG1 4.06Å; I135-L137 HydrophobicContact CG2-CD2 4.18Å
136	K	92.9	Very high	89.5	Confident	79 Å²	79	68.8 Å²	68.8	34%	0.343	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	122	175.3	-166.3	158.4	-171.5	158.3	0	110.5	L97 D102 H138	L97-K136 HydrophobicContact CB-CB 4.37Å; L97-K136 HydrophobicContact CB-CG 4.27Å; L97-K136 WeakPolarHBondContact O-CA 3.31Å; D102-K136 IonicContact OD1-NZ 2.8Å; D102-K136 PolarHBondContact OD1-NZ 3.5Å; K136-H138 PolarHBondContact O-N 3.26Å
137	L	93.1	Very high	90.3	Very high	2 Å²	2	68.1 Å²	68.1	1%	0.01	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	86	-178.5	-63	175.3	0	0	0	109.7	L96 L97 G99 Y118 F119 M122 I135 G139 V140 L145 L174	L96-L137 HydrophobicContact CB-CD1 4.31Å; L96-L137 HydrophobicContact CD1-CD1 4.21Å; L96-L137 HydrophobicContact CD2-CD1 4.31Å; L97-L137 PolarHBondContact O-N 3.4Å; G99-L137 WeakPolarHBondContact CA-O 3.4Å; G99-L137 PolarHBondContact N-O 2.9Å; G99-L137 VanDerWaalsContact N-O 3.09Å; Y118-L137 HydrophobicContact CE1-CD2 4.15Å; F119-L137 HydrophobicContact CE1-CD1 4.18Å; F119-L137 HydrophobicContact CE1-CD2 4.31Å; F119-L137 HydrophobicContact CZ-CD1 3.96Å; M122-L137 HydrophobicContact CE-CD2 4.12Å; I135-L137 HydrophobicContact CG2-CD2 4.18Å; L137-G139 PolarHBondContact O-N 2.98Å; L137-V140 HydrophobicContact CB-CB 4.37Å; L137-V140 HydrophobicContact CB-CG2 4.31Å; L137-V140 PolarHBondContact O-N 3.21Å; L137-L145 HydrophobicContact CD1-CD1 3.83Å; L137-L145 HydrophobicContact CD1-CD2 4.32Å; L137-L174 HydrophobicContact CD1-CD2 4.3Å
138	H	87.1	Confident	91.1	Very high	134 Å²	134	62.9 Å²	62.9	62%	0.62	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	119.8	174.3	-63.1	-66.9	0	0	0	109.9	K136 F173	K136-H138 PolarHBondContact O-N 3.26Å; H138-F173 WeakPolarHBondContact O-CZ 3.44Å
139	G	83.9	Confident	91.9	Very high	37 Å²	37	54.9 Å²	54.9	38%	0.381	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	103.7	8.1	-177.5	0	0	0	0	0	115.3	L137	L137-G139 PolarHBondContact O-N 2.98Å
140	V	93.3	Very high	92.5	Very high	2 Å²	2	54.2 Å²	54.2	1%	0.012	27%	0.273	C	S	.	.			trans	-126.1	125.7	172.7	-171.6	0	0	0	0	109.7	P98 G99 L137 L145 A170 F173 L174	P98-V140 WeakPolarHBondContact CB-O 3.45Å; G99-V140 PolarHBondContact N-O 3.13Å; L137-V140 HydrophobicContact CB-CB 4.37Å; L137-V140 HydrophobicContact CB-CG2 4.31Å; L137-V140 PolarHBondContact O-N 3.21Å; V140-L145 HydrophobicContact CG1-CB 3.79Å; V140-L145 HydrophobicContact CG1-CD1 4.47Å; V140-A170 HydrophobicContact CG1-CB 3.62Å; V140-F173 HydrophobicContact CG2-CB 4.21Å; V140-F173 HydrophobicContact CG2-CD1 3.38Å; V140-F173 HydrophobicContact CG2-CE1 3.93Å; V140-F173 HydrophobicContact CG2-CG 3.92Å; V140-L174 HydrophobicContact CG2-CD2 4.42Å; V140-L174 HydrophobicContact CG2-CG 4.34Å
141	S	95.1	Very high	93.1	Very high	15 Å²	15	52.5 Å²	52.5	11%	0.105	26%	0.264	C	S	.	.			trans	-74.9	158.7	176.7	72.9	0	0	0	0	112.2	D100 V143 G144 L145 D166	D100-S141 WeakPolarHBondContact OD2-CA 3.26Å; D100-S141 WeakPolarHBondContact OD2-CB 3.42Å; S141-V143 PolarHBondContact O-N 3.4Å; S141-G144 PolarHBondContact O-N 3.2Å; S141-G144 PolarHBondContact OG-N 3.5Å; S141-L145 WeakPolarHBondContact O-CB 3.28Å; S141-L145 PolarHBondContact O-N 2.96Å; S141-D166 VanDerWaalsContact CB-OD1 3.32Å; S141-D166 WeakPolarHBondContact CB-OD1 3.39Å; S141-D166 WeakPolarHBondContact OG-CB 3.19Å; S141-D166 VanDerWaalsContact OG-CG 3.26Å; S141-D166 PolarHBondContact OG-OD1 3.21Å
142	K	95.7	Very high	93.6	Very high	65 Å²	65	44.7 Å²	44.7	28%	0.283	23%	0.228	S	C	.	.	H	α-helix	trans	-53	-42.5	174.3	-179.3	-166.6	-173.8	151.2	0	112.4	P98 D100 T101 D103 F105 R146	P98-K142 HydrophobicContact CB-CB 4.39Å; P98-K142 HydrophobicContact CG-CB 4.08Å; D100-K142 PolarHBondContact OD1-N 2.91Å; D100-K142 PolarHBondContact OD2-N 3.44Å; D100-K142 VanDerWaalsContact OD2-N 3.13Å; T101-K142 HydrophobicContact CG2-CB 4.46Å; D103-K142 VanDerWaalsContact CG-CE 3.45Å; D103-K142 IonicContact OD1-NZ 2.97Å; D103-K142 PolarHBondContact OD1-NZ 3.02Å; D103-K142 WeakPolarHBondContact OD2-CD 3.01Å; D103-K142 WeakPolarHBondContact OD2-CE 3.08Å; D103-K142 IonicContact OD2-NZ 2.68Å; D103-K142 PolarHBondContact OD2-NZ 3.34Å; F105-K142 HydrophobicContact CE2-CG 4.36Å; F105-K142 HydrophobicContact CZ-CG 4.03Å; K142-R146 WeakPolarHBondContact O-CB 3.36Å; K142-R146 PolarHBondContact O-N 3.4Å; K142-R146 VanDerWaalsContact O-N 3.08Å
143	V	95.2	Very high	93.9	Very high	64 Å²	64	41.6 Å²	41.6	39%	0.388	21%	0.212	S	C	.	.	H	α-helix	trans	-67.7	-49.3	-177.2	178.1	0	0	0	0	110.1	S141 R146 K147 N163 D166	S141-V143 PolarHBondContact O-N 3.4Å; V143-R146 PolarHBondContact O-N 2.99Å; V143-K147 WeakPolarHBondContact O-CG 3.3Å; V143-K147 PolarHBondContact O-N 3.39Å; V143-K147 VanDerWaalsContact O-N 3.08Å; V143-N163 HydrophobicContact CG1-CB 4.23Å; V143-D166 HydrophobicContact CB-CB 4.08Å; V143-D166 HydrophobicContact CG1-CB 4.13Å
144	G	95.4	Very high	94.2	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-61.6	-48.2	178.7	0	0	0	0	0	111.9	S141 R146 K147 I148 D166	S141-G144 PolarHBondContact O-N 3.2Å; S141-G144 PolarHBondContact OG-N 3.5Å; G144-R146 VanDerWaalsContact C-N 3.34Å; G144-R146 PolarHBondContact O-N 2.96Å; G144-K147 PolarHBondContact O-N 2.82Å; G144-I148 WeakPolarHBondContact O-CG1 3.41Å; G144-I148 PolarHBondContact O-N 3.05Å; G144-D166 WeakPolarHBondContact CA-O 3.36Å
145	L	96.3	Very high	94.2	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-59.3	-44.9	179.2	-176	58.2	0	0	0	111.8	L96 P98 F105 L137 V140 S141 K147 I148 I149 L174	L96-L145 HydrophobicContact CB-CD2 4.18Å; L96-L145 HydrophobicContact CD1-CD1 4.33Å; P98-L145 HydrophobicContact CB-CD2 3.98Å; F105-L145 HydrophobicContact CD2-CD2 3.86Å; F105-L145 HydrophobicContact CE2-CD2 4.19Å; F105-L145 HydrophobicContact CG-CD2 4.45Å; L137-L145 HydrophobicContact CD1-CD1 3.83Å; L137-L145 HydrophobicContact CD1-CD2 4.32Å; V140-L145 HydrophobicContact CG1-CB 3.79Å; V140-L145 HydrophobicContact CG1-CD1 4.47Å; S141-L145 WeakPolarHBondContact O-CB 3.28Å; S141-L145 PolarHBondContact O-N 2.96Å; L145-K147 PolarHBondContact O-N 3.49Å; L145-I148 PolarHBondContact O-N 3.34Å; L145-I149 HydrophobicContact CD1-CD1 3.87Å; L145-I149 HydrophobicContact CD1-CG1 4.18Å; L145-I149 HydrophobicContact CG-CD1 3.79Å; L145-I149 HydrophobicContact CG-CG1 4.48Å; L145-I149 VanDerWaalsContact O-CG1 3.28Å; L145-I149 WeakPolarHBondContact O-CG1 3.27Å; L145-I149 PolarHBondContact O-N 2.87Å; L145-L174 HydrophobicContact CD1-CD1 4.14Å
146	R	95.8	Very high	94.2	Very high	110 Å²	110	45 Å²	45	42%	0.415	23%	0.232	S	C	.	.	H	α-helix	trans	-58.7	-49.3	176.5	-178	178.3	-61.1	-97	-5.2	111.4	F105 K142 V143 G144 I148 I149 D150	F105-R146 HydrophobicContact CE1-CB 3.89Å; F105-R146 HydrophobicContact CE1-CG 4.22Å; F105-R146 HydrophobicContact CZ-CB 4.22Å; K142-R146 WeakPolarHBondContact O-CB 3.36Å; K142-R146 PolarHBondContact O-N 3.4Å; K142-R146 VanDerWaalsContact O-N 3.08Å; V143-R146 PolarHBondContact O-N 2.99Å; G144-R146 VanDerWaalsContact C-N 3.34Å; G144-R146 PolarHBondContact O-N 2.96Å; R146-I148 VanDerWaalsContact C-N 3.32Å; R146-I148 PolarHBondContact O-N 2.64Å; R146-I149 PolarHBondContact O-N 3Å; R146-D150 WeakPolarHBondContact CG-OD2 3.04Å; R146-D150 WeakPolarHBondContact O-CB 3.38Å; R146-D150 PolarHBondContact O-N 2.91Å
147	K	96.4	Very high	94.3	Very high	48 Å²	48	43 Å²	43	21%	0.209	23%	0.225	C	C	.	.	H	α-helix	trans	-59.8	-41.1	180	-72.7	-75.1	-178	170.1	0	112.6	V143 G144 L145 F151 L157 S158 T167	V143-K147 WeakPolarHBondContact O-CG 3.3Å; V143-K147 PolarHBondContact O-N 3.39Å; V143-K147 VanDerWaalsContact O-N 3.08Å; G144-K147 PolarHBondContact O-N 2.82Å; L145-K147 PolarHBondContact O-N 3.49Å; K147-F151 WeakPolarHBondContact O-CB 3.5Å; K147-F151 PolarHBondContact O-N 3.37Å; K147-L157 HydrophobicContact CB-CD1 3.98Å; K147-L157 HydrophobicContact CD-CD1 3.94Å; K147-L157 HydrophobicContact CG-CD1 4.49Å; K147-S158 PolarHBondContact NZ-O 2.87Å; K147-T167 HydrophobicContact CB-CG2 4.13Å
148	I	97	Very high	94.2	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-66.3	-45.8	177	-66	-53.5	0	0	0	111.4	G144 L145 R146 F151 I152 A170 A171 L174 I176 V179	G144-I148 WeakPolarHBondContact O-CG1 3.41Å; G144-I148 PolarHBondContact O-N 3.05Å; L145-I148 PolarHBondContact O-N 3.34Å; R146-I148 VanDerWaalsContact C-N 3.32Å; R146-I148 PolarHBondContact O-N 2.64Å; I148-F151 PolarHBondContact O-N 3.24Å; I148-I152 HydrophobicContact CG2-CD1 3.88Å; I148-I152 VanDerWaalsContact O-CG1 3.31Å; I148-I152 WeakPolarHBondContact O-CG1 3.26Å; I148-I152 PolarHBondContact O-N 2.9Å; I148-A170 HydrophobicContact CD1-CB 4.49Å; I148-A170 HydrophobicContact CG1-CB 3.67Å; I148-A171 HydrophobicContact CD1-CB 3.87Å; I148-L174 HydrophobicContact CB-CD1 4.37Å; I148-L174 HydrophobicContact CG1-CD1 4.43Å; I148-L174 HydrophobicContact CG2-CD1 3.95Å; I148-I176 HydrophobicContact CD1-CB 4.44Å; I148-I176 HydrophobicContact CD1-CG1 4.29Å; I148-I176 HydrophobicContact CG2-CD1 4.18Å; I148-I176 HydrophobicContact CG2-CG1 3.73Å; I148-V179 HydrophobicContact CD1-CB 4.27Å; I148-V179 HydrophobicContact CD1-CG1 3.87Å; I148-V179 HydrophobicContact CD1-CG2 4.25Å
149	I	96.3	Very high	94.4	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-64.6	-47.5	178.9	-63.6	167	0	0	0	110.3	L96 F105 V107 M112 L145 R146 F151 I152 Y153	L96-I149 HydrophobicContact CD1-CD1 4.41Å; F105-I149 HydrophobicContact CB-CD1 3.72Å; F105-I149 HydrophobicContact CD1-CD1 4.07Å; F105-I149 HydrophobicContact CG-CD1 4.02Å; V107-I149 HydrophobicContact CG1-CD1 3.91Å; V107-I149 HydrophobicContact CG1-CG1 4.26Å; V107-I149 HydrophobicContact CG1-CG2 3.84Å; M112-I149 HydrophobicContact CE-CG1 4.12Å; L145-I149 HydrophobicContact CD1-CD1 3.87Å; L145-I149 HydrophobicContact CD1-CG1 4.18Å; L145-I149 HydrophobicContact CG-CD1 3.79Å; L145-I149 HydrophobicContact CG-CG1 4.48Å; L145-I149 VanDerWaalsContact O-CG1 3.28Å; L145-I149 WeakPolarHBondContact O-CG1 3.27Å; L145-I149 PolarHBondContact O-N 2.87Å; R146-I149 PolarHBondContact O-N 3Å; I149-F151 PolarHBondContact O-N 3.22Å; I149-I152 PolarHBondContact O-N 3.38Å; I149-Y153 HydrophobicContact CG2-CD2 3.75Å; I149-Y153 HydrophobicContact CG2-CE2 3.9Å; I149-Y153 WeakPolarHBondContact O-CD2 3.24Å; I149-Y153 PolarHBondContact O-N 3.14Å; I149-Y153 VanDerWaalsContact O-N 3.09Å
150	D	95.4	Very high	94.7	Very high	53 Å²	53	42.6 Å²	42.6	28%	0.283	22%	0.224	S	C	.	.	H	α-helix	trans	-57.2	-39.9	177.8	-64.9	-10	0	0	0	110.6	R86 R146 Y153 T154	R86-D150 IonicContact NH2-OD1 3.76Å; R146-D150 WeakPolarHBondContact CG-OD2 3.04Å; R146-D150 WeakPolarHBondContact O-CB 3.38Å; R146-D150 PolarHBondContact O-N 2.91Å; D150-Y153 PolarHBondContact O-N 2.97Å; D150-T154 VanDerWaalsContact O-CB 3.27Å; D150-T154 WeakPolarHBondContact O-CB 3.36Å; D150-T154 WeakPolarHBondContact O-CG2 3.32Å; D150-T154 PolarHBondContact O-N 3.08Å; D150-T154 PolarHBondContact O-OG1 3.42Å
151	F	96.6	Very high	94.2	Very high	44 Å²	44	47.5 Å²	47.5	19%	0.193	25%	0.249	C	C	.	.	H	α-helix	trans	-62.9	-45.6	173.7	171.6	-99.1	0	0	0	112.8	K147 I148 I149 Y153 T154 A155 K156 L157 I176 P178 V179	K147-F151 WeakPolarHBondContact O-CB 3.5Å; K147-F151 PolarHBondContact O-N 3.37Å; I148-F151 PolarHBondContact O-N 3.24Å; I149-F151 PolarHBondContact O-N 3.22Å; F151-Y153 PolarHBondContact O-N 3.31Å; F151-T154 PolarHBondContact O-N 3.08Å; F151-A155 WeakPolarHBondContact O-CA 3.32Å; F151-A155 PolarHBondContact O-N 3.09Å; F151-K156 WeakPolarHBondContact CA-O 3.37Å; F151-L157 HydrophobicContact CD2-CB 4.15Å; F151-I176 HydrophobicContact CD1-CG2 4.05Å; F151-I176 HydrophobicContact CE1-CG2 3.89Å; F151-P178 HydrophobicContact CZ-CB 4.06Å; F151-V179 HydrophobicContact CB-CG2 4.34Å; F151-V179 HydrophobicContact CD1-CG2 3.42Å; F151-V179 VanDerWaalsContact CD1-CG2 3.42Å; F151-V179 HydrophobicContact CD2-CG2 4.02Å; F151-V179 HydrophobicContact CE1-CG2 3.61Å; F151-V179 HydrophobicContact CE2-CG2 4.18Å; F151-V179 HydrophobicContact CG-CG2 3.64Å; F151-V179 HydrophobicContact CZ-CG2 3.99Å
152	I	96.2	Very high	93.8	Very high	11 Å²	11	53.6 Å²	53.6	6%	0.056	28%	0.28	C	S	.	.	H	α-helix	trans	-59.8	-37.7	-179.5	-71.3	168.5	0	0	0	111.3	M111 M112 A115 I148 I149 I176	M111-I152 HydrophobicContact CB-CG2 4.32Å; M111-I152 HydrophobicContact CE-CG2 4.25Å; M112-I152 HydrophobicContact CE-CD1 3.39Å; M112-I152 HydrophobicContact SD-CD1 3.79Å; M112-I152 HydrophobicContact SD-CG2 4.35Å; A115-I152 HydrophobicContact CB-CB 4.44Å; A115-I152 HydrophobicContact CB-CD1 4.07Å; A115-I152 HydrophobicContact CB-CG1 3.74Å; A115-I152 HydrophobicContact CB-CG2 4.01Å; I148-I152 HydrophobicContact CG2-CD1 3.88Å; I148-I152 VanDerWaalsContact O-CG1 3.31Å; I148-I152 WeakPolarHBondContact O-CG1 3.26Å; I148-I152 PolarHBondContact O-N 2.9Å; I149-I152 PolarHBondContact O-N 3.38Å; I152-I176 HydrophobicContact CD1-CD1 4.14Å
153	Y	95.6	Very high	93.6	Very high	1 Å²	1	51.2 Å²	51.2	0%	0.004	27%	0.271	C	S	.	.	H	α-helix	trans	-89.1	-26.4	-177.7	-79	-91	0	0	0	114.2	F82 E83 R86 V107 H108 M111 M112 I149 D150 F151	F82-Y153 HydrophobicContact CB-CD1 3.95Å; F82-Y153 HydrophobicContact CB-CE1 3.92Å; F82-Y153 WeakPolarHBondContact O-CE1 3.49Å; E83-Y153 HydrophobicContact CB-CD1 4.42Å; E83-Y153 WeakPolarHBondContact OE2-CB 3.41Å; R86-Y153 HydrophobicContact CB-CD1 4.39Å; R86-Y153 HydrophobicContact CB-CE1 4Å; R86-Y153 HydrophobicContact CG-CE1 4.49Å; V107-Y153 HydrophobicContact CG1-CE2 4.43Å; H108-Y153 WeakPolarHBondContact CB-OH 3.37Å; H108-Y153 PolarHBondContact N-OH 3.39Å; H108-Y153 AromaticContact ND1-CE1 3.9Å; H108-Y153 AromaticContact ND1-CZ 3.8Å; H108-Y153 PolarHBondContact ND1-OH 2.98Å; M111-Y153 HydrophobicContact CB-CE1 4.36Å; M111-Y153 HydrophobicContact CB-CE2 4.34Å; M111-Y153 HydrophobicContact CG-CE1 4Å; M112-Y153 HydrophobicContact SD-CE2 4.41Å; I149-Y153 HydrophobicContact CG2-CD2 3.75Å; I149-Y153 HydrophobicContact CG2-CE2 3.9Å; I149-Y153 WeakPolarHBondContact O-CD2 3.24Å; I149-Y153 PolarHBondContact O-N 3.14Å; I149-Y153 VanDerWaalsContact O-N 3.09Å; D150-Y153 PolarHBondContact O-N 2.97Å; F151-Y153 PolarHBondContact O-N 3.31Å
154	T	94.3	Very high	93.4	Very high	54 Å²	54	48.3 Å²	48.3	33%	0.331	25%	0.253	S	S	.	.	H	α-helix	trans	-113.5	-12.6	-173.8	70.7	0	0	0	0	114.7	E83 D150 F151 K156	E83-T154 HydrophobicContact CG-CG2 4.38Å; D150-T154 VanDerWaalsContact O-CB 3.27Å; D150-T154 WeakPolarHBondContact O-CB 3.36Å; D150-T154 WeakPolarHBondContact O-CG2 3.32Å; D150-T154 PolarHBondContact O-N 3.08Å; D150-T154 PolarHBondContact O-OG1 3.42Å; F151-T154 PolarHBondContact O-N 3.08Å; T154-K156 PolarHBondContact O-N 2.79Å; T154-K156 PolarHBondContact OG1-N 2.85Å
155	A	93.1	Very high	93.1	Very high	65 Å²	65	53.4 Å²	53.4	54%	0.537	28%	0.276	S	S	.	.	S	Bend	trans	55.6	21	-167.3	0	0	0	0	0	114.2	L79 F151	L79-A155 HydrophobicContact CD1-CB 4.33Å; F151-A155 WeakPolarHBondContact O-CA 3.32Å; F151-A155 PolarHBondContact O-N 3.09Å
156	K	93.3	Very high	93	Very high	162 Å²	162	55.5 Å²	55.5	70%	0.704	29%	0.288	S	S	*	.			trans	-120.3	141.1	179.9	-65.9	177.5	-177.6	178.9	0	110.8	F151 T154	F151-K156 WeakPolarHBondContact CA-O 3.37Å; T154-K156 PolarHBondContact O-N 2.79Å; T154-K156 PolarHBondContact OG1-N 2.85Å
157	L	94.4	Very high	93	Very high	37 Å²	37	50.2 Å²	50.2	19%	0.194	27%	0.268	C	S	.	.			trans	-139.3	136.4	174.7	-177.7	65.5	0	0	0	109.9	K147 F151 L159 T167 V179 F182	K147-L157 HydrophobicContact CB-CD1 3.98Å; K147-L157 HydrophobicContact CD-CD1 3.94Å; K147-L157 HydrophobicContact CG-CD1 4.49Å; F151-L157 HydrophobicContact CD2-CB 4.15Å; L157-L159 HydrophobicContact CD2-CD1 4.24Å; L157-L159 HydrophobicContact CD2-CD2 4.37Å; L157-L159 HydrophobicContact CD2-CG 4.09Å; L157-L159 HydrophobicContact CG-CG 4.19Å; L157-T167 HydrophobicContact CD1-CG2 4.14Å; L157-T167 HydrophobicContact CD2-CG2 4.2Å; L157-V179 HydrophobicContact CD2-CB 4.28Å; L157-V179 HydrophobicContact CD2-CG1 3.51Å; L157-V179 HydrophobicContact CD2-CG2 4.06Å; L157-F182 HydrophobicContact CD2-CD1 3.82Å; L157-F182 HydrophobicContact CD2-CE1 4.32Å; L157-F182 HydrophobicContact CG-CD1 4.44Å; L157-F182 HydrophobicContact CG-CE1 4.49Å
158	S	91.9	Very high	92.9	Very high	79 Å²	79	48 Å²	48	55%	0.552	26%	0.258	S	S	*	.			trans	-118.1	120.7	173.4	168.1	0	0	0	0	108.6	K147	K147-S158 PolarHBondContact NZ-O 2.87Å
159	L	92	Very high	92.7	Very high	20 Å²	20	51.2 Å²	51.2	11%	0.105	27%	0.273	C	S	.	.			trans	-114.3	145.1	-179.7	-74.7	177.7	0	0	0	111.3	L157 N163 L164 T167 F182 C183 F186	L157-L159 HydrophobicContact CD2-CD1 4.24Å; L157-L159 HydrophobicContact CD2-CD2 4.37Å; L157-L159 HydrophobicContact CD2-CG 4.09Å; L157-L159 HydrophobicContact CG-CG 4.19Å; L159-N163 WeakPolarHBondContact CA-OD1 3.32Å; L159-L164 HydrophobicContact CD1-CD1 4.27Å; L159-L164 HydrophobicContact CD2-CD1 4.4Å; L159-T167 HydrophobicContact CD2-CG2 3.75Å; L159-F182 HydrophobicContact CB-CE1 4.2Å; L159-F182 HydrophobicContact CD1-CD1 3.39Å; L159-F182 HydrophobicContact CD1-CE1 3.48Å; L159-F182 VanDerWaalsContact CD1-CE1 3.48Å; L159-F182 HydrophobicContact CG-CD1 4.13Å; L159-F182 HydrophobicContact CG-CE1 3.84Å; L159-C183 HydrophobicContact CD1-CB 4.46Å; L159-F186 HydrophobicContact CD1-CB 4.45Å
160	N	89.5	Confident	92.7	Very high	64 Å²	64	51.2 Å²	51.2	34%	0.342	27%	0.273	S	S	.	.			trans	-146.4	175.6	166.1	64.5	20.1	0	0	0	108.6	D162 N163 L164	N160-D162 PolarHBondContact O-N 2.61Å; N160-D162 WeakPolarHBondContact OD1-CB 3.34Å; N160-D162 PolarHBondContact OD1-N 2.89Å; N160-D162 VanDerWaalsContact OD1-N 3.12Å; N160-N163 PolarHBondContact N-OD1 3.46Å; N160-N163 PolarHBondContact O-N 3.41Å; N160-N163 PolarHBondContact O-OD1 3.47Å; N160-N163 PolarHBondContact OD1-N 3.18Å; N160-N163 PolarHBondContact OD1-ND2 3.19Å; N160-N163 PolarHBondContact OD1-OD1 2.89Å; N160-L164 VanDerWaalsContact O-CB 3.28Å; N160-L164 WeakPolarHBondContact O-CB 3.31Å; N160-L164 PolarHBondContact O-N 3.27Å
161	M	82.6	Confident	92.7	Very high	106 Å²	106	48.7 Å²	48.7	52%	0.522	26%	0.26	S	S	.	.	H	α-helix	trans	-62.9	-28.6	-178.7	-66.6	-60.1	-72.1	0	0	113.2	L164 F186	M161-L164 HydrophobicContact SD-CD2 4.28Å; M161-F186 HydrophobicContact SD-CE1 3.97Å
162	D	86.9	Confident	92.6	Very high	142 Å²	142	49 Å²	49	76%	0.759	27%	0.267	S	S	*	.	H	α-helix	trans	-72.6	-33.9	-178.1	-53.7	-40.9	0	0	0	112.8	N160	N160-D162 PolarHBondContact O-N 2.61Å; N160-D162 WeakPolarHBondContact OD1-CB 3.34Å; N160-D162 PolarHBondContact OD1-N 2.89Å; N160-D162 VanDerWaalsContact OD1-N 3.12Å
163	N	90.8	Very high	92.5	Very high	16 Å²	16	52 Å²	52	9%	0.086	28%	0.28	C	S	.	.	H	α-helix	trans	-106.1	-1.8	-177.4	67.1	35.5	0	0	0	114.1	V143 L159 N160 T167	V143-N163 HydrophobicContact CG1-CB 4.23Å; L159-N163 WeakPolarHBondContact CA-OD1 3.32Å; N160-N163 PolarHBondContact N-OD1 3.46Å; N160-N163 PolarHBondContact O-N 3.41Å; N160-N163 PolarHBondContact O-OD1 3.47Å; N160-N163 PolarHBondContact OD1-N 3.18Å; N160-N163 PolarHBondContact OD1-ND2 3.19Å; N160-N163 PolarHBondContact OD1-OD1 2.89Å; N163-T167 VanDerWaalsContact O-CB 3.32Å; N163-T167 WeakPolarHBondContact O-CB 3.22Å; N163-T167 PolarHBondContact O-N 3.04Å; N163-T167 PolarHBondContact O-OG1 3.32Å
164	L	91.2	Very high	92.4	Very high	3 Å²	3	51.9 Å²	51.9	2%	0.016	28%	0.28	C	S	.	.	H	α-helix	trans	-63	-47.9	-174.9	177.3	64.4	0	0	0	112	L159 N160 M161 T167 L168 C183 F186 L187	L159-L164 HydrophobicContact CD1-CD1 4.27Å; L159-L164 HydrophobicContact CD2-CD1 4.4Å; N160-L164 VanDerWaalsContact O-CB 3.28Å; N160-L164 WeakPolarHBondContact O-CB 3.31Å; N160-L164 PolarHBondContact O-N 3.27Å; M161-L164 HydrophobicContact SD-CD2 4.28Å; L164-T167 PolarHBondContact O-N 3.08Å; L164-L168 WeakPolarHBondContact O-CB 3.47Å; L164-L168 PolarHBondContact O-N 3.08Å; L164-C183 HydrophobicContact CD1-CB 4.21Å; L164-F186 HydrophobicContact CD1-CD1 4.03Å; L164-F186 HydrophobicContact CD2-CD1 4.09Å; L164-F186 HydrophobicContact CD2-CE1 4.14Å; L164-L187 HydrophobicContact CD2-CD2 3.46Å; L164-L187 VanDerWaalsContact CD2-CD2 3.46Å; L164-L187 HydrophobicContact CD2-CG 4.02Å
165	Q	90.6	Very high	92.5	Very high	106 Å²	106	53.8 Å²	53.8	50%	0.495	29%	0.285	S	S	.	.	H	α-helix	trans	-63.6	-48.2	-175.9	-175.1	172.1	-18.7	0	0	111.1	T167 L168 E169	Q165-T167 VanDerWaalsContact C-N 3.34Å; Q165-T167 PolarHBondContact O-N 3.35Å; Q165-L168 PolarHBondContact O-N 3.01Å; Q165-E169 WeakPolarHBondContact O-CB 3.27Å; Q165-E169 PolarHBondContact O-N 3.3Å
166	D	93.6	Very high	92.6	Very high	44 Å²	44	50.7 Å²	50.7	24%	0.235	26%	0.259	C	S	.	.	H	α-helix	trans	-58	-45.2	175.8	-71.8	-57.1	0	0	0	112.4	S141 V143 G144 A170	S141-D166 VanDerWaalsContact CB-OD1 3.32Å; S141-D166 WeakPolarHBondContact CB-OD1 3.39Å; S141-D166 WeakPolarHBondContact OG-CB 3.19Å; S141-D166 VanDerWaalsContact OG-CG 3.26Å; S141-D166 PolarHBondContact OG-OD1 3.21Å; V143-D166 HydrophobicContact CB-CB 4.08Å; V143-D166 HydrophobicContact CG1-CB 4.13Å; G144-D166 WeakPolarHBondContact CA-O 3.36Å; D166-A170 VanDerWaalsContact O-CB 3.32Å; D166-A170 WeakPolarHBondContact O-CB 3.49Å; D166-A170 PolarHBondContact O-N 3.23Å
167	T	95.3	Very high	92.6	Very high	0 Å²	0	48 Å²	48	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-69.5	-40.2	-178.3	-53.3	0	0	0	0	111.4	K147 L157 L159 N163 L164 Q165 A171 V179	K147-T167 HydrophobicContact CB-CG2 4.13Å; L157-T167 HydrophobicContact CD1-CG2 4.14Å; L157-T167 HydrophobicContact CD2-CG2 4.2Å; L159-T167 HydrophobicContact CD2-CG2 3.75Å; N163-T167 VanDerWaalsContact O-CB 3.32Å; N163-T167 WeakPolarHBondContact O-CB 3.22Å; N163-T167 PolarHBondContact O-N 3.04Å; N163-T167 PolarHBondContact O-OG1 3.32Å; L164-T167 PolarHBondContact O-N 3.08Å; Q165-T167 VanDerWaalsContact C-N 3.34Å; Q165-T167 PolarHBondContact O-N 3.35Å; T167-A171 VanDerWaalsContact O-CB 3.24Å; T167-A171 WeakPolarHBondContact O-CB 3.33Å; T167-A171 PolarHBondContact O-N 3.43Å; T167-V179 HydrophobicContact CG2-CG1 3.98Å
168	L	94.3	Very high	92.6	Very high	0 Å²	0	50 Å²	50	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-67.5	-43.8	178.9	-176.9	72.4	0	0	0	111.3	L164 Q165 A171 S172 L180 C183 I202 Y206 L208	L164-L168 WeakPolarHBondContact O-CB 3.47Å; L164-L168 PolarHBondContact O-N 3.08Å; Q165-L168 PolarHBondContact O-N 3.01Å; L168-A171 PolarHBondContact O-N 2.8Å; L168-S172 VanDerWaalsContact O-CB 3.27Å; L168-S172 WeakPolarHBondContact O-CB 3.41Å; L168-S172 PolarHBondContact O-N 3.09Å; L168-L180 HydrophobicContact CD1-CD2 3.79Å; L168-C183 HydrophobicContact CD1-CB 3.58Å; L168-I202 HydrophobicContact CD2-CG2 3.5Å; L168-Y206 HydrophobicContact CD2-CD2 3.33Å; L168-Y206 HydrophobicContact CD2-CE2 3.73Å; L168-Y206 HydrophobicContact CD2-CG 3.84Å; L168-Y206 HydrophobicContact CG-CD2 4.11Å; L168-Y206 HydrophobicContact CG-CE2 4.43Å; L168-Y206 HydrophobicContact CG-CG 4.19Å; L168-L208 HydrophobicContact CD1-CD1 4.06Å; L168-L208 HydrophobicContact CD2-CD1 4.01Å
169	E	93.3	Very high	92.8	Very high	69 Å²	69	46.3 Å²	46.3	32%	0.322	24%	0.241	S	C	.	.	H	α-helix	trans	-59	-48.9	175	-173.8	173	-168.2	0	0	110.7	Q165 A171 S172 F173 Y206	Q165-E169 WeakPolarHBondContact O-CB 3.27Å; Q165-E169 PolarHBondContact O-N 3.3Å; E169-A171 PolarHBondContact O-N 2.95Å; E169-S172 PolarHBondContact O-N 3.34Å; E169-F173 VanDerWaalsContact O-CB 3.28Å; E169-F173 WeakPolarHBondContact O-CB 3.27Å; E169-F173 PolarHBondContact O-N 3.35Å; E169-Y206 HydrophobicContact CB-CE1 3.97Å; E169-Y206 HydrophobicContact CG-CE1 4.24Å
170	A	95.3	Very high	92.8	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-61.5	-45.4	177.1	0	0	0	0	0	112.5	V140 I148 D166 S172 F173 L174	V140-A170 HydrophobicContact CG1-CB 3.62Å; I148-A170 HydrophobicContact CD1-CB 4.49Å; I148-A170 HydrophobicContact CG1-CB 3.67Å; D166-A170 VanDerWaalsContact O-CB 3.32Å; D166-A170 WeakPolarHBondContact O-CB 3.49Å; D166-A170 PolarHBondContact O-N 3.23Å; A170-S172 VanDerWaalsContact C-N 3.33Å; A170-S172 PolarHBondContact O-N 3.04Å; A170-F173 PolarHBondContact O-N 2.84Å; A170-L174 WeakPolarHBondContact O-CB 3.44Å; A170-L174 VanDerWaalsContact O-CG 3.26Å; A170-L174 WeakPolarHBondContact O-CG 3.16Å; A170-L174 PolarHBondContact O-N 2.74Å
171	A	95.5	Very high	93.1	Very high	0 Å²	0	47 Å²	47	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-64.5	-38.7	179.2	0	0	0	0	0	112.1	I148 T167 L168 E169 Q175 I176 V179 L180	I148-A171 HydrophobicContact CD1-CB 3.87Å; T167-A171 VanDerWaalsContact O-CB 3.24Å; T167-A171 WeakPolarHBondContact O-CB 3.33Å; T167-A171 PolarHBondContact O-N 3.43Å; L168-A171 PolarHBondContact O-N 2.8Å; E169-A171 PolarHBondContact O-N 2.95Å; A171-Q175 CarbonylContact O-C 3.6Å; A171-Q175 WeakPolarHBondContact O-CA 3.37Å; A171-Q175 PolarHBondContact O-N 3.46Å; A171-I176 PolarHBondContact O-N 3.36Å; A171-V179 HydrophobicContact CB-CB 4.01Å; A171-V179 HydrophobicContact CB-CG1 3.62Å; A171-L180 HydrophobicContact CB-CD2 3.77Å; A171-L180 HydrophobicContact CB-CG 3.85Å
172	S	94.2	Very high	93.6	Very high	50 Å²	50	46.4 Å²	46.4	35%	0.35	24%	0.24	S	C	.	.	H	α-helix	trans	-67.4	-50.2	177.2	-172.4	0	0	0	0	110.8	L168 E169 A170 Q175	L168-S172 VanDerWaalsContact O-CB 3.27Å; L168-S172 WeakPolarHBondContact O-CB 3.41Å; L168-S172 PolarHBondContact O-N 3.09Å; E169-S172 PolarHBondContact O-N 3.34Å; A170-S172 VanDerWaalsContact C-N 3.33Å; A170-S172 PolarHBondContact O-N 3.04Å; S172-Q175 PolarHBondContact O-N 3.14Å
173	F	94.1	Very high	94	Very high	73 Å²	73	39.7 Å²	39.7	32%	0.32	20%	0.203	S	C	.	.	H	α-helix	trans	-63.9	-45	-178.8	-174.9	-91.6	0	0	0	111.7	Y118 H138 V140 E169 A170 Q175	Y118-F173 HydrophobicContact CE1-CE1 4.09Å; Y118-F173 HydrophobicContact CE2-CE1 4.08Å; Y118-F173 HydrophobicContact CE2-CZ 4.3Å; Y118-F173 AromaticContact CZ-CE1 3.62Å; Y118-F173 WeakPolarHBondContact OH-CE1 3.44Å; H138-F173 WeakPolarHBondContact O-CZ 3.44Å; V140-F173 HydrophobicContact CG2-CB 4.21Å; V140-F173 HydrophobicContact CG2-CD1 3.38Å; V140-F173 HydrophobicContact CG2-CE1 3.93Å; V140-F173 HydrophobicContact CG2-CG 3.92Å; E169-F173 VanDerWaalsContact O-CB 3.28Å; E169-F173 WeakPolarHBondContact O-CB 3.27Å; E169-F173 PolarHBondContact O-N 3.35Å; A170-F173 PolarHBondContact O-N 2.84Å; F173-Q175 VanDerWaalsContact C-N 3.3Å; F173-Q175 PolarHBondContact O-N 2.72Å
174	L	95.2	Very high	94.2	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.9	4.9	-178.7	-57.1	174.7	0	0	0	113.3	S116 Y118 F119 L137 V140 L145 I148 A170 I176	S116-L174 WeakPolarHBondContact CB-O 3.26Å; S116-L174 PolarHBondContact OG-O 2.93Å; Y118-L174 HydrophobicContact CD1-CD2 3.65Å; Y118-L174 HydrophobicContact CE1-CD2 3.76Å; Y118-L174 HydrophobicContact CG-CD2 4.49Å; F119-L174 HydrophobicContact CE1-CD2 4.27Å; F119-L174 HydrophobicContact CE2-CB 4.32Å; F119-L174 HydrophobicContact CE2-CD1 4.02Å; F119-L174 HydrophobicContact CE2-CD2 3.73Å; F119-L174 HydrophobicContact CE2-CG 4.24Å; F119-L174 HydrophobicContact CZ-CD1 4.15Å; F119-L174 HydrophobicContact CZ-CD2 3.53Å; F119-L174 HydrophobicContact CZ-CG 4.39Å; L137-L174 HydrophobicContact CD1-CD2 4.3Å; V140-L174 HydrophobicContact CG2-CD2 4.42Å; V140-L174 HydrophobicContact CG2-CG 4.34Å; L145-L174 HydrophobicContact CD1-CD1 4.14Å; I148-L174 HydrophobicContact CB-CD1 4.37Å; I148-L174 HydrophobicContact CG1-CD1 4.43Å; I148-L174 HydrophobicContact CG2-CD1 3.95Å; A170-L174 WeakPolarHBondContact O-CB 3.44Å; A170-L174 VanDerWaalsContact O-CG 3.26Å; A170-L174 WeakPolarHBondContact O-CG 3.16Å; A170-L174 PolarHBondContact O-N 2.74Å; L174-I176 VanDerWaalsContact C-N 3.34Å; L174-I176 HydrophobicContact CB-CG1 4.13Å; L174-I176 PolarHBondContact O-N 3.17Å
175	Q	94.9	Very high	94.3	Very high	93 Å²	93	45.1 Å²	45.1	44%	0.435	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.8	42.3	176.5	-56.2	-179.1	9.3	0	0	114.2	A171 S172 F173 L177	A171-Q175 CarbonylContact O-C 3.6Å; A171-Q175 WeakPolarHBondContact O-CA 3.37Å; A171-Q175 PolarHBondContact O-N 3.46Å; S172-Q175 PolarHBondContact O-N 3.14Å; F173-Q175 VanDerWaalsContact C-N 3.3Å; F173-Q175 PolarHBondContact O-N 2.72Å; Q175-L177 PolarHBondContact O-N 3.03Å
176	I	95.9	Very high	94.5	Very high	1 Å²	1	42.8 Å²	42.8	1%	0.005	22%	0.222	C	C	.	.			trans	-90	82	176.5	-49.6	-65.6	0	0	0	109.3	A115 I148 F151 I152 A171 L174 V179 L180	A115-I176 WeakPolarHBondContact O-CD1 3.46Å; I148-I176 HydrophobicContact CD1-CB 4.44Å; I148-I176 HydrophobicContact CD1-CG1 4.29Å; I148-I176 HydrophobicContact CG2-CD1 4.18Å; I148-I176 HydrophobicContact CG2-CG1 3.73Å; F151-I176 HydrophobicContact CD1-CG2 4.05Å; F151-I176 HydrophobicContact CE1-CG2 3.89Å; I152-I176 HydrophobicContact CD1-CD1 4.14Å; A171-I176 PolarHBondContact O-N 3.36Å; L174-I176 VanDerWaalsContact C-N 3.34Å; L174-I176 HydrophobicContact CB-CG1 4.13Å; L174-I176 PolarHBondContact O-N 3.17Å; I176-V179 HydrophobicContact CB-CB 4.31Å; I176-V179 HydrophobicContact CB-CG2 4.44Å; I176-V179 HydrophobicContact CG2-CB 3.86Å; I176-V179 HydrophobicContact CG2-CG2 3.54Å; I176-V179 PolarHBondContact O-N 3.49Å; I176-V179 VanDerWaalsContact O-N 3.14Å; I176-L180 PolarHBondContact O-N 2.89Å; I176-L180 VanDerWaalsContact O-N 3.09Å
177	L	92.8	Very high	94.5	Very high	104 Å²	104	40.8 Å²	40.8	55%	0.545	21%	0.212	S	C	.	.	H	α-helix	trans	-54.7	-43.5	-173.1	-56.9	-178.8	0	0	0	114.5	Q175 V179 L180 D181	Q175-L177 PolarHBondContact O-N 3.03Å; L177-V179 VanDerWaalsContact C-N 3.27Å; L177-V179 PolarHBondContact O-N 3.32Å; L177-L180 HydrophobicContact CD2-CD1 4.16Å; L177-L180 WeakPolarHBondContact O-CB 3.32Å; L177-L180 PolarHBondContact O-N 3.05Å; L177-L180 VanDerWaalsContact O-N 3.15Å; L177-D181 PolarHBondContact O-N 3.18Å
178	P	95.1	Very high	94.5	Very high	80 Å²	80	43 Å²	43	52%	0.519	22%	0.223	S	C	.	.	H	α-helix	trans	-62.3	-33.9	179.5	-24.3	35.5	0	0	0	113.6	F151 F182	F151-P178 HydrophobicContact CZ-CB 4.06Å; P178-F182 WeakPolarHBondContact O-CB 3.41Å; P178-F182 PolarHBondContact O-N 3.15Å
179	V	95.1	Very high	94.5	Very high	1 Å²	1	47.5 Å²	47.5	1%	0.006	25%	0.254	C	S	.	.	H	α-helix	trans	-72.8	-40.7	176.4	173.1	0	0	0	0	110.4	I148 F151 L157 T167 A171 I176 L177 D181 F182 C183	I148-V179 HydrophobicContact CD1-CB 4.27Å; I148-V179 HydrophobicContact CD1-CG1 3.87Å; I148-V179 HydrophobicContact CD1-CG2 4.25Å; F151-V179 HydrophobicContact CB-CG2 4.34Å; F151-V179 HydrophobicContact CD1-CG2 3.42Å; F151-V179 VanDerWaalsContact CD1-CG2 3.42Å; F151-V179 HydrophobicContact CD2-CG2 4.02Å; F151-V179 HydrophobicContact CE1-CG2 3.61Å; F151-V179 HydrophobicContact CE2-CG2 4.18Å; F151-V179 HydrophobicContact CG-CG2 3.64Å; F151-V179 HydrophobicContact CZ-CG2 3.99Å; L157-V179 HydrophobicContact CD2-CB 4.28Å; L157-V179 HydrophobicContact CD2-CG1 3.51Å; L157-V179 HydrophobicContact CD2-CG2 4.06Å; T167-V179 HydrophobicContact CG2-CG1 3.98Å; A171-V179 HydrophobicContact CB-CB 4.01Å; A171-V179 HydrophobicContact CB-CG1 3.62Å; I176-V179 HydrophobicContact CB-CB 4.31Å; I176-V179 HydrophobicContact CB-CG2 4.44Å; I176-V179 HydrophobicContact CG2-CB 3.86Å; I176-V179 HydrophobicContact CG2-CG2 3.54Å; I176-V179 PolarHBondContact O-N 3.49Å; I176-V179 VanDerWaalsContact O-N 3.14Å; L177-V179 VanDerWaalsContact C-N 3.27Å; L177-V179 PolarHBondContact O-N 3.32Å; V179-D181 VanDerWaalsContact C-N 3.34Å; V179-D181 PolarHBondContact O-N 3.42Å; V179-F182 PolarHBondContact O-N 3.28Å; V179-C183 PolarHBondContact O-N 2.95Å; V179-C183 PolarHBondContact O-SG 3.05Å
180	L	93.4	Very high	94.4	Very high	20 Å²	20	45.7 Å²	45.7	11%	0.105	26%	0.255	C	S	.	.	H	α-helix	trans	-58.1	-46.9	173.1	-74.1	173.4	0	0	0	111.3	L168 A171 I176 L177 F182 C183 K184	L168-L180 HydrophobicContact CD1-CD2 3.79Å; A171-L180 HydrophobicContact CB-CD2 3.77Å; A171-L180 HydrophobicContact CB-CG 3.85Å; I176-L180 PolarHBondContact O-N 2.89Å; I176-L180 VanDerWaalsContact O-N 3.09Å; L177-L180 HydrophobicContact CD2-CD1 4.16Å; L177-L180 WeakPolarHBondContact O-CB 3.32Å; L177-L180 PolarHBondContact O-N 3.05Å; L177-L180 VanDerWaalsContact O-N 3.15Å; L180-F182 VanDerWaalsContact C-N 3.34Å; L180-F182 PolarHBondContact O-N 2.84Å; L180-C183 WeakPolarHBondContact O-CB 3.48Å; L180-C183 PolarHBondContact O-N 3.21Å; L180-C183 VanDerWaalsContact O-N 3.17Å; L180-K184 WeakPolarHBondContact O-CG 3.48Å; L180-K184 PolarHBondContact O-N 3.28Å
181	D	94.2	Very high	94.3	Very high	78 Å²	78	46.4 Å²	46.4	42%	0.417	26%	0.259	S	S	.	.	H	α-helix	trans	-63.2	-40.8	179.1	-69.3	-23.5	0	0	0	111.7	L177 V179 C183 K184 V185	L177-D181 PolarHBondContact O-N 3.18Å; V179-D181 VanDerWaalsContact C-N 3.34Å; V179-D181 PolarHBondContact O-N 3.42Å; D181-C183 PolarHBondContact O-N 3.28Å; D181-K184 WeakPolarHBondContact O-CB 3.36Å; D181-K184 PolarHBondContact O-N 2.88Å; D181-K184 IonicContact OD1-NZ 2.74Å; D181-K184 PolarHBondContact OD1-NZ 2.94Å; D181-V185 WeakPolarHBondContact O-CG2 3.43Å; D181-V185 PolarHBondContact O-N 3.25Å
182	F	94.6	Very high	94.3	Very high	95 Å²	95	49.3 Å²	49.3	42%	0.417	28%	0.276	S	S	.	.	H	α-helix	trans	-62.4	-41	172.9	-176.3	-115	0	0	0	112.6	L157 L159 P178 V179 L180 K184 V185 F186	L157-F182 HydrophobicContact CD2-CD1 3.82Å; L157-F182 HydrophobicContact CD2-CE1 4.32Å; L157-F182 HydrophobicContact CG-CD1 4.44Å; L157-F182 HydrophobicContact CG-CE1 4.49Å; L159-F182 HydrophobicContact CB-CE1 4.2Å; L159-F182 HydrophobicContact CD1-CD1 3.39Å; L159-F182 HydrophobicContact CD1-CE1 3.48Å; L159-F182 VanDerWaalsContact CD1-CE1 3.48Å; L159-F182 HydrophobicContact CG-CD1 4.13Å; L159-F182 HydrophobicContact CG-CE1 3.84Å; P178-F182 WeakPolarHBondContact O-CB 3.41Å; P178-F182 PolarHBondContact O-N 3.15Å; V179-F182 PolarHBondContact O-N 3.28Å; L180-F182 VanDerWaalsContact C-N 3.34Å; L180-F182 PolarHBondContact O-N 2.84Å; F182-K184 VanDerWaalsContact C-N 3.34Å; F182-K184 PolarHBondContact O-N 2.79Å; F182-V185 PolarHBondContact O-N 3.03Å; F182-F186 WeakPolarHBondContact O-CB 3.39Å; F182-F186 PolarHBondContact O-N 2.9Å
183	C	94.4	Very high	94.3	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-63	-39	174.9	-64.7	0	0	0	0	112	L159 L164 L168 V179 L180 D181 F186 L187	L159-C183 HydrophobicContact CD1-CB 4.46Å; L164-C183 HydrophobicContact CD1-CB 4.21Å; L168-C183 HydrophobicContact CD1-CB 3.58Å; V179-C183 PolarHBondContact O-N 2.95Å; V179-C183 PolarHBondContact O-SG 3.05Å; L180-C183 WeakPolarHBondContact O-CB 3.48Å; L180-C183 PolarHBondContact O-N 3.21Å; L180-C183 VanDerWaalsContact O-N 3.17Å; D181-C183 PolarHBondContact O-N 3.28Å; C183-F186 PolarHBondContact O-N 2.82Å; C183-L187 WeakPolarHBondContact O-CB 3.38Å; C183-L187 WeakPolarHBondContact O-CG 3.49Å; C183-L187 PolarHBondContact O-N 3.26Å
184	K	94.4	Very high	94.2	Very high	40 Å²	40	51.3 Å²	51.3	17%	0.174	29%	0.287	C	S	.	.	H	α-helix	trans	-61.4	-47.5	175.2	-66.5	171.1	-165.1	163	0	111.2	L180 D181 F182 F186 L187 I188 L208 V211	L180-K184 WeakPolarHBondContact O-CG 3.48Å; L180-K184 PolarHBondContact O-N 3.28Å; D181-K184 WeakPolarHBondContact O-CB 3.36Å; D181-K184 PolarHBondContact O-N 2.88Å; D181-K184 IonicContact OD1-NZ 2.74Å; D181-K184 PolarHBondContact OD1-NZ 2.94Å; F182-K184 VanDerWaalsContact C-N 3.34Å; F182-K184 PolarHBondContact O-N 2.79Å; K184-F186 VanDerWaalsContact C-N 3.34Å; K184-F186 PolarHBondContact O-N 3.41Å; K184-L187 PolarHBondContact O-N 2.61Å; K184-I188 WeakPolarHBondContact O-CB 3.47Å; K184-I188 VanDerWaalsContact O-CG1 3.31Å; K184-I188 WeakPolarHBondContact O-CG1 3.45Å; K184-I188 PolarHBondContact O-N 3.5Å; K184-L208 HydrophobicContact CG-CD1 4.49Å; K184-L208 HydrophobicContact CG-CD2 4.26Å; K184-V211 HydrophobicContact CB-CG2 3.77Å; K184-V211 HydrophobicContact CG-CG2 3.86Å
185	V	94.3	Very high	94.1	Very high	94 Å²	94	53 Å²	53	57%	0.57	30%	0.295	S	S	*	.	H	α-helix	trans	-60.9	-45.4	178.1	172.9	0	0	0	0	110.6	D181 F182 L187 I188 S189	D181-V185 WeakPolarHBondContact O-CG2 3.43Å; D181-V185 PolarHBondContact O-N 3.25Å; F182-V185 PolarHBondContact O-N 3.03Å; V185-L187 PolarHBondContact O-N 3.45Å; V185-I188 PolarHBondContact O-N 2.93Å; V185-S189 WeakPolarHBondContact O-CB 3.4Å; V185-S189 PolarHBondContact O-N 3.12Å; V185-S189 PolarHBondContact O-OG 3.4Å
186	F	93.9	Very high	94.1	Very high	56 Å²	56	48.6 Å²	48.6	25%	0.246	28%	0.275	C	S	.	.	H	α-helix	trans	-58	-49.7	176.4	-177.1	-97.4	0	0	0	111.5	L159 M161 L164 F182 C183 K184 I188 S189 G190	L159-F186 HydrophobicContact CD1-CB 4.45Å; M161-F186 HydrophobicContact SD-CE1 3.97Å; L164-F186 HydrophobicContact CD1-CD1 4.03Å; L164-F186 HydrophobicContact CD2-CD1 4.09Å; L164-F186 HydrophobicContact CD2-CE1 4.14Å; F182-F186 WeakPolarHBondContact O-CB 3.39Å; F182-F186 PolarHBondContact O-N 2.9Å; C183-F186 PolarHBondContact O-N 2.82Å; K184-F186 VanDerWaalsContact C-N 3.34Å; K184-F186 PolarHBondContact O-N 3.41Å; F186-I188 PolarHBondContact O-N 3.2Å; F186-S189 PolarHBondContact O-N 3.25Å; F186-S189 PolarHBondContact O-OG 3.34Å; F186-G190 PolarHBondContact O-N 2.91Å
187	L	94.1	Very high	94	Very high	3 Å²	3	49.3 Å²	49.3	2%	0.016	28%	0.279	C	S	.	.	H	α-helix	trans	-58.3	-48.8	177.3	-80.1	173.8	0	0	0	112.5	L164 C183 K184 V185 S189 G190 V191 V199 I202 L208 V211	L164-L187 HydrophobicContact CD2-CD2 3.46Å; L164-L187 VanDerWaalsContact CD2-CD2 3.46Å; L164-L187 HydrophobicContact CD2-CG 4.02Å; C183-L187 WeakPolarHBondContact O-CB 3.38Å; C183-L187 WeakPolarHBondContact O-CG 3.49Å; C183-L187 PolarHBondContact O-N 3.26Å; K184-L187 PolarHBondContact O-N 2.61Å; V185-L187 PolarHBondContact O-N 3.45Å; L187-S189 VanDerWaalsContact C-N 3.34Å; L187-S189 PolarHBondContact O-N 3.01Å; L187-G190 PolarHBondContact O-N 3.3Å; L187-V191 WeakPolarHBondContact O-CG2 3.28Å; L187-V191 PolarHBondContact O-N 2.97Å; L187-V199 HydrophobicContact CB-CG1 4.27Å; L187-V199 HydrophobicContact CD2-CG1 3.9Å; L187-V199 HydrophobicContact CD2-CG2 4.1Å; L187-I202 HydrophobicContact CD1-CG2 4.09Å; L187-L208 HydrophobicContact CD1-CD1 3.87Å; L187-V211 HydrophobicContact CB-CG1 4Å; L187-V211 HydrophobicContact CB-CG2 4.45Å; L187-V211 HydrophobicContact CD1-CG1 4.31Å
188	I	95.3	Very high	93.9	Very high	46 Å²	46	47.8 Å²	47.8	24%	0.236	27%	0.269	C	S	.	.	H	α-helix	trans	-60.9	-44.2	179.8	-71.8	167.4	0	0	0	110.8	K184 V185 F186 G190 V211 Y214	K184-I188 WeakPolarHBondContact O-CB 3.47Å; K184-I188 VanDerWaalsContact O-CG1 3.31Å; K184-I188 WeakPolarHBondContact O-CG1 3.45Å; K184-I188 PolarHBondContact O-N 3.5Å; V185-I188 PolarHBondContact O-N 2.93Å; F186-I188 PolarHBondContact O-N 3.2Å; I188-G190 VanDerWaalsContact C-N 3.26Å; I188-G190 PolarHBondContact O-N 3.23Å; I188-V211 HydrophobicContact CD1-CG2 4.24Å; I188-V211 HydrophobicContact CG1-CB 4.47Å; I188-V211 HydrophobicContact CG1-CG1 4.42Å; I188-V211 HydrophobicContact CG1-CG2 4.13Å; I188-Y214 HydrophobicContact CB-CD1 4.48Å; I188-Y214 HydrophobicContact CG1-CD1 4.37Å; I188-Y214 HydrophobicContact CG1-CG 4.22Å; I188-Y214 HydrophobicContact CG2-CD1 4.04Å; I188-Y214 HydrophobicContact CG2-CD2 3.8Å; I188-Y214 HydrophobicContact CG2-CE1 4.06Å; I188-Y214 HydrophobicContact CG2-CE2 3.8Å; I188-Y214 HydrophobicContact CG2-CG 3.91Å
189	S	93.8	Very high	93.9	Very high	94 Å²	94	44.1 Å²	44.1	66%	0.657	25%	0.245	S	C	*	.	H	α-helix	trans	-69	-23.8	-179.9	70.8	0	0	0	0	113.7	V185 F186 L187	V185-S189 WeakPolarHBondContact O-CB 3.4Å; V185-S189 PolarHBondContact O-N 3.12Å; V185-S189 PolarHBondContact O-OG 3.4Å; F186-S189 PolarHBondContact O-N 3.25Å; F186-S189 PolarHBondContact O-OG 3.34Å; L187-S189 VanDerWaalsContact C-N 3.34Å; L187-S189 PolarHBondContact O-N 3.01Å
190	G	91.3	Very high	93.8	Very high	32 Å²	32	44 Å²	44	33%	0.33	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.8	2.7	-176.3	0	0	0	0	0	115.2	F186 L187 I188 T192 N195	F186-G190 PolarHBondContact O-N 2.91Å; L187-G190 PolarHBondContact O-N 3.3Å; I188-G190 VanDerWaalsContact C-N 3.26Å; I188-G190 PolarHBondContact O-N 3.23Å; G190-T192 PolarHBondContact O-N 3.05Å; G190-N195 PolarHBondContact O-ND2 3.48Å
191	V	94.5	Very high	93.8	Very high	15 Å²	15	50 Å²	50	9%	0.091	27%	0.266	C	S	.	.			trans	-67.9	124.5	-178.6	-177.3	0	0	0	0	111.1	L187 N195 C196 V199 Y214 V215 F218	L187-V191 WeakPolarHBondContact O-CG2 3.28Å; L187-V191 PolarHBondContact O-N 2.97Å; V191-N195 WeakPolarHBondContact CA-OD1 3.44Å; V191-C196 HydrophobicContact CG1-CB 3.75Å; V191-V199 HydrophobicContact CG2-CG1 4.07Å; V191-Y214 HydrophobicContact CB-CE1 3.95Å; V191-Y214 HydrophobicContact CG1-CE1 4.47Å; V191-Y214 HydrophobicContact CG2-CD1 3.97Å; V191-Y214 HydrophobicContact CG2-CE1 3.79Å; V191-V215 HydrophobicContact CG2-CG2 4.26Å; V191-F218 HydrophobicContact CG1-CB 4.43Å; V191-F218 HydrophobicContact CG1-CD1 3.71Å; V191-F218 HydrophobicContact CG1-CD2 4.04Å; V191-F218 HydrophobicContact CG1-CE1 3.9Å; V191-F218 HydrophobicContact CG1-CE2 4.22Å; V191-F218 HydrophobicContact CG1-CG 3.8Å; V191-F218 HydrophobicContact CG1-CZ 4.16Å
192	T	94.8	Very high	93.7	Very high	60 Å²	60	47 Å²	47	37%	0.368	25%	0.25	S	S	.	.			trans	-128.9	172	175.1	70.1	0	0	0	0	110.6	G190 D194 N195 C196	G190-T192 PolarHBondContact O-N 3.05Å; T192-D194 PolarHBondContact O-N 3.47Å; T192-D194 PolarHBondContact OG1-N 3.25Å; T192-N195 PolarHBondContact N-OD1 2.9Å; T192-N195 PolarHBondContact O-N 3.42Å; T192-N195 PolarHBondContact O-OD1 3.05Å; T192-N195 PolarHBondContact OG1-N 2.92Å; T192-N195 PolarHBondContact OG1-OD1 3.19Å; T192-C196 WeakPolarHBondContact O-CB 3.31Å; T192-C196 PolarHBondContact O-N 2.94Å
193	L	94.4	Very high	93.6	Very high	51 Å²	51	42.5 Å²	42.5	27%	0.267	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-30.2	175.1	-69.4	175.4	0	0	0	113	F218 N222 A225 L226 T229	L193-F218 HydrophobicContact CD2-CE1 4.18Å; L193-F218 HydrophobicContact CD2-CZ 4.33Å; L193-N222 HydrophobicContact CD2-CB 3.73Å; L193-A225 HydrophobicContact CD1-CB 3.92Å; L193-A225 HydrophobicContact CD2-CB 4.19Å; L193-L226 WeakPolarHBondContact O-CD1 3.18Å; L193-T229 HydrophobicContact CB-CG2 4.42Å
194	D	92.5	Very high	93.5	Very high	115 Å²	115	48 Å²	48	62%	0.615	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	-27.5	-175.4	-54.1	-58.9	0	0	0	112.7	T192	T192-D194 PolarHBondContact O-N 3.47Å; T192-D194 PolarHBondContact OG1-N 3.25Å
195	N	92.6	Very high	93.3	Very high	35 Å²	35	50.1 Å²	50.1	19%	0.187	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.4	-7.2	-175.2	74.8	16.1	0	0	0	114.4	G190 V191 T192 V197 E198 V199	G190-N195 PolarHBondContact O-ND2 3.48Å; V191-N195 WeakPolarHBondContact CA-OD1 3.44Å; T192-N195 PolarHBondContact N-OD1 2.9Å; T192-N195 PolarHBondContact O-N 3.42Å; T192-N195 PolarHBondContact O-OD1 3.05Å; T192-N195 PolarHBondContact OG1-N 2.92Å; T192-N195 PolarHBondContact OG1-OD1 3.19Å; N195-V197 PolarHBondContact O-N 3.37Å; N195-V197 VanDerWaalsContact O-N 3.14Å; N195-E198 PolarHBondContact O-N 2.94Å; N195-V199 HydrophobicContact CB-CG2 4.47Å; N195-V199 WeakPolarHBondContact O-CG2 3.35Å; N195-V199 PolarHBondContact O-N 3.28Å
196	C	94.8	Very high	93.1	Very high	1 Å²	1	47.3 Å²	47.3	1%	0.007	26%	0.256	C	S	.	.	H	α-helix	trans	-59.8	-32.6	-171.9	63.1	0	0	0	0	113.6	V191 T192 G200 V215 F218	V191-C196 HydrophobicContact CG1-CB 3.75Å; T192-C196 WeakPolarHBondContact O-CB 3.31Å; T192-C196 PolarHBondContact O-N 2.94Å; C196-G200 PolarHBondContact O-N 3.26Å; C196-V215 HydrophobicContact CB-CG1 4.29Å; C196-V215 VanDerWaalsContact O-CG1 3.26Å; C196-V215 WeakPolarHBondContact O-CG1 3.21Å; C196-F218 HydrophobicContact CB-CD1 3.91Å; C196-F218 HydrophobicContact CB-CE1 3.92Å
197	V	93.9	Very high	93	Very high	16 Å²	16	52.1 Å²	52.1	10%	0.097	28%	0.278	C	S	.	.	H	α-helix	trans	-68.7	-43.6	178	-176.4	0	0	0	0	110.6	N195 G200 R201 E231 K234 L235	N195-V197 PolarHBondContact O-N 3.37Å; N195-V197 VanDerWaalsContact O-N 3.14Å; V197-G200 PolarHBondContact O-N 3.37Å; V197-R201 PolarHBondContact O-N 3.02Å; V197-E231 HydrophobicContact CG2-CB 4.33Å; V197-K234 HydrophobicContact CG1-CB 3.93Å; V197-L235 HydrophobicContact CG1-CD2 4.27Å; V197-L235 HydrophobicContact CG2-CD2 3.84Å; V197-L235 HydrophobicContact CG2-CG 4.22Å
198	E	91.3	Very high	93	Very high	71 Å²	71	52.4 Å²	52.4	33%	0.332	28%	0.28	S	S	.	.	H	α-helix	trans	-68	-45.3	178.5	-175.8	52.3	-129.7	0	0	111.5	N195 G200 R201 I202	N195-E198 PolarHBondContact O-N 2.94Å; E198-G200 PolarHBondContact O-N 3.49Å; E198-R201 WeakPolarHBondContact O-CA 3.17Å; E198-R201 WeakPolarHBondContact O-CB 3.38Å; E198-R201 PolarHBondContact O-N 2.98Å; E198-R201 IonicContact OE1-CZ 3.45Å; E198-R201 IonicContact OE1-NE 3.21Å; E198-R201 PolarHBondContact OE1-NE 3.22Å; E198-R201 IonicContact OE1-NH2 3.13Å; E198-R201 PolarHBondContact OE1-NH2 3.38Å; E198-R201 IonicContact OE2-CZ 3.28Å; E198-R201 IonicContact OE2-NE 2.82Å; E198-R201 PolarHBondContact OE2-NE 2.89Å; E198-R201 IonicContact OE2-NH2 3.25Å; E198-R201 PolarHBondContact OE2-NH2 2.84Å; E198-I202 HydrophobicContact CG-CD1 4.39Å; E198-I202 WeakPolarHBondContact O-CG1 2.88Å; E198-I202 PolarHBondContact O-N 2.95Å
199	V	93.6	Very high	92.9	Very high	3 Å²	3	55.5 Å²	55.5	2%	0.018	30%	0.301	C	S	.	.	H	α-helix	trans	-58.6	-38.9	173.5	175	0	0	0	0	110.9	L187 V191 N195 I202 A203 V211 V215	L187-V199 HydrophobicContact CB-CG1 4.27Å; L187-V199 HydrophobicContact CD2-CG1 3.9Å; L187-V199 HydrophobicContact CD2-CG2 4.1Å; V191-V199 HydrophobicContact CG2-CG1 4.07Å; N195-V199 HydrophobicContact CB-CG2 4.47Å; N195-V199 WeakPolarHBondContact O-CG2 3.35Å; N195-V199 PolarHBondContact O-N 3.28Å; V199-I202 PolarHBondContact O-N 3.1Å; V199-A203 WeakPolarHBondContact O-CB 3.36Å; V199-A203 PolarHBondContact O-N 3.33Å; V199-V211 HydrophobicContact CG1-CG1 3.89Å; V199-V215 HydrophobicContact CB-CG2 4.43Å; V199-V215 HydrophobicContact CG1-CG2 3.8Å
200	G	94.1	Very high	93	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-61.4	-41.5	172.6	0	0	0	0	0	113.6	C196 V197 E198 A203 N204 R239	C196-G200 PolarHBondContact O-N 3.26Å; V197-G200 PolarHBondContact O-N 3.37Å; E198-G200 PolarHBondContact O-N 3.49Å; G200-A203 PolarHBondContact O-N 3.04Å; G200-N204 PolarHBondContact O-N 3.24Å; G200-R239 PolarHBondContact O-NH2 3.1Å
201	R	92.6	Very high	93.2	Very high	146 Å²	146	55.1 Å²	55.1	55%	0.551	28%	0.281	S	S	*	.	H	α-helix	trans	-63.2	-47	175.2	-174	179.7	68.1	142.1	-7.2	111.2	V197 E198 A203 N204 T205	V197-R201 PolarHBondContact O-N 3.02Å; E198-R201 WeakPolarHBondContact O-CA 3.17Å; E198-R201 WeakPolarHBondContact O-CB 3.38Å; E198-R201 PolarHBondContact O-N 2.98Å; E198-R201 IonicContact OE1-CZ 3.45Å; E198-R201 IonicContact OE1-NE 3.21Å; E198-R201 PolarHBondContact OE1-NE 3.22Å; E198-R201 IonicContact OE1-NH2 3.13Å; E198-R201 PolarHBondContact OE1-NH2 3.38Å; E198-R201 IonicContact OE2-CZ 3.28Å; E198-R201 IonicContact OE2-NE 2.82Å; E198-R201 PolarHBondContact OE2-NE 2.89Å; E198-R201 IonicContact OE2-NH2 3.25Å; E198-R201 PolarHBondContact OE2-NH2 2.84Å; R201-A203 VanDerWaalsContact C-N 3.33Å; R201-A203 PolarHBondContact O-N 3.45Å; R201-N204 PolarHBondContact O-N 3.03Å; R201-T205 PolarHBondContact O-N 2.96Å; R201-T205 PolarHBondContact O-OG1 3.5Å
202	I	91.7	Very high	93.2	Very high	15 Å²	15	56.3 Å²	56.3	8%	0.077	29%	0.286	C	S	.	.	H	α-helix	trans	-57.1	-48.4	175.5	-66.2	169.4	0	0	0	109.9	L168 L187 E198 V199 N204 T205 Y206	L168-I202 HydrophobicContact CD2-CG2 3.5Å; L187-I202 HydrophobicContact CD1-CG2 4.09Å; E198-I202 HydrophobicContact CG-CD1 4.39Å; E198-I202 WeakPolarHBondContact O-CG1 2.88Å; E198-I202 PolarHBondContact O-N 2.95Å; V199-I202 PolarHBondContact O-N 3.1Å; I202-N204 VanDerWaalsContact C-N 3.31Å; I202-N204 PolarHBondContact O-N 3.11Å; I202-T205 PolarHBondContact O-N 3.11Å; I202-Y206 HydrophobicContact CG2-CD2 3.86Å; I202-Y206 HydrophobicContact CG2-CE2 4.14Å; I202-Y206 VanDerWaalsContact O-CD2 3.26Å; I202-Y206 WeakPolarHBondContact O-CD2 3.18Å; I202-Y206 PolarHBondContact O-N 2.9Å; I202-Y206 VanDerWaalsContact O-N 3.09Å
203	A	93.6	Very high	93.2	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-58.9	-41.4	179.7	0	0	0	0	0	112.4	V199 G200 R201 H207 L208 V211 D212	V199-A203 WeakPolarHBondContact O-CB 3.36Å; V199-A203 PolarHBondContact O-N 3.33Å; G200-A203 PolarHBondContact O-N 3.04Å; R201-A203 VanDerWaalsContact C-N 3.33Å; R201-A203 PolarHBondContact O-N 3.45Å; A203-H207 CarbonylContact O-C 3.54Å; A203-H207 WeakPolarHBondContact O-CA 3.49Å; A203-H207 PolarHBondContact O-N 2.85Å; A203-L208 HydrophobicContact CB-CB 4.22Å; A203-L208 PolarHBondContact O-N 2.94Å; A203-V211 HydrophobicContact CB-CB 4Å; A203-V211 HydrophobicContact CB-CG1 3.94Å; A203-D212 HydrophobicContact CB-CB 4.1Å
204	N	92.1	Very high	93.4	Very high	114 Å²	114	63.1 Å²	63.1	61%	0.61	31%	0.307	S	S	*	.	H	α-helix	trans	-68.6	-46.2	177.3	-169.2	45.4	0	0	0	112.4	G200 R201 I202 Y206 H207	G200-N204 PolarHBondContact O-N 3.24Å; R201-N204 PolarHBondContact O-N 3.03Å; I202-N204 VanDerWaalsContact C-N 3.31Å; I202-N204 PolarHBondContact O-N 3.11Å; N204-Y206 VanDerWaalsContact C-N 3.29Å; N204-Y206 PolarHBondContact O-N 3.22Å; N204-H207 PolarHBondContact O-N 2.81Å
205	T	91	Very high	93.6	Very high	86 Å²	86	57.6 Å²	57.6	53%	0.528	28%	0.277	S	S	.	.	H	α-helix	trans	-58.1	-40.8	-179.8	-59.9	0	0	0	0	112.2	R201 I202	R201-T205 PolarHBondContact O-N 2.96Å; R201-T205 PolarHBondContact O-OG1 3.5Å; I202-T205 PolarHBondContact O-N 3.11Å
206	Y	89.6	Confident	93.7	Very high	35 Å²	35	57.1 Å²	57.1	14%	0.137	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.6	12.4	-178.6	-60.1	-74.8	0	0	0	113.7	L168 E169 I202 N204 L208	L168-Y206 HydrophobicContact CD2-CD2 3.33Å; L168-Y206 HydrophobicContact CD2-CE2 3.73Å; L168-Y206 HydrophobicContact CD2-CG 3.84Å; L168-Y206 HydrophobicContact CG-CD2 4.11Å; L168-Y206 HydrophobicContact CG-CE2 4.43Å; L168-Y206 HydrophobicContact CG-CG 4.19Å; E169-Y206 HydrophobicContact CB-CE1 3.97Å; E169-Y206 HydrophobicContact CG-CE1 4.24Å; I202-Y206 HydrophobicContact CG2-CD2 3.86Å; I202-Y206 HydrophobicContact CG2-CE2 4.14Å; I202-Y206 VanDerWaalsContact O-CD2 3.26Å; I202-Y206 WeakPolarHBondContact O-CD2 3.18Å; I202-Y206 PolarHBondContact O-N 2.9Å; I202-Y206 VanDerWaalsContact O-N 3.09Å; N204-Y206 VanDerWaalsContact C-N 3.29Å; N204-Y206 PolarHBondContact O-N 3.22Å; Y206-L208 VanDerWaalsContact C-N 3.26Å; Y206-L208 PolarHBondContact O-N 3.43Å
207	H	91.1	Very high	93.7	Very high	156 Å²	156	61.1 Å²	61.1	72%	0.722	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.8	36.8	178.6	-52.4	84.1	0	0	0	114.2	A203 N204 T209	A203-H207 CarbonylContact O-C 3.54Å; A203-H207 WeakPolarHBondContact O-CA 3.49Å; A203-H207 PolarHBondContact O-N 2.85Å; N204-H207 PolarHBondContact O-N 2.81Å; H207-T209 PolarHBondContact O-N 2.93Å
208	L	93.8	Very high	93.8	Very high	10 Å²	10	62 Å²	62	5%	0.052	30%	0.302	C	S	.	.			trans	-81.1	78.3	178.5	-53.3	-179.3	0	0	0	110.9	L168 K184 L187 A203 Y206 E210 V211 D212	L168-L208 HydrophobicContact CD1-CD1 4.06Å; L168-L208 HydrophobicContact CD2-CD1 4.01Å; K184-L208 HydrophobicContact CG-CD1 4.49Å; K184-L208 HydrophobicContact CG-CD2 4.26Å; L187-L208 HydrophobicContact CD1-CD1 3.87Å; A203-L208 HydrophobicContact CB-CB 4.22Å; A203-L208 PolarHBondContact O-N 2.94Å; Y206-L208 VanDerWaalsContact C-N 3.26Å; Y206-L208 PolarHBondContact O-N 3.43Å; L208-E210 VanDerWaalsContact C-N 3.31Å; L208-E210 PolarHBondContact O-N 3.33Å; L208-V211 HydrophobicContact CB-CB 4.05Å; L208-V211 HydrophobicContact CB-CG2 3.96Å; L208-V211 HydrophobicContact CD1-CG2 4.23Å; L208-V211 PolarHBondContact O-N 3.07Å; L208-D212 PolarHBondContact O-N 2.93Å
209	T	93.7	Very high	94	Very high	111 Å²	111	58.6 Å²	58.6	68%	0.681	29%	0.286	S	S	*	.	H	α-helix	trans	-56.3	-38	-172.8	54.1	0	0	0	0	114.7	H207 D212 K213	H207-T209 PolarHBondContact O-N 2.93Å; T209-D212 PolarHBondContact O-N 3.34Å; T209-K213 WeakPolarHBondContact O-CB 3.42Å; T209-K213 PolarHBondContact O-N 2.84Å
210	E	95.1	Very high	94.1	Very high	118 Å²	118	59.1 Å²	59.1	55%	0.551	29%	0.288	S	S	*	.	H	α-helix	trans	-68.4	-44.1	179.7	-66.9	176.4	167.2	0	0	112	L208 D212 K213 Y214	L208-E210 VanDerWaalsContact C-N 3.31Å; L208-E210 PolarHBondContact O-N 3.33Å; E210-D212 VanDerWaalsContact C-N 3.35Å; E210-K213 PolarHBondContact O-N 2.61Å; E210-Y214 PolarHBondContact O-N 2.95Å
211	V	95.9	Very high	94.1	Very high	0 Å²	0	65.8 Å²	65.8	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-64.1	-44.7	175.7	-175.2	0	0	0	0	109.2	K184 L187 I188 V199 A203 L208 K213 Y214 V215	K184-V211 HydrophobicContact CB-CG2 3.77Å; K184-V211 HydrophobicContact CG-CG2 3.86Å; L187-V211 HydrophobicContact CB-CG1 4Å; L187-V211 HydrophobicContact CB-CG2 4.45Å; L187-V211 HydrophobicContact CD1-CG1 4.31Å; I188-V211 HydrophobicContact CD1-CG2 4.24Å; I188-V211 HydrophobicContact CG1-CB 4.47Å; I188-V211 HydrophobicContact CG1-CG1 4.42Å; I188-V211 HydrophobicContact CG1-CG2 4.13Å; V199-V211 HydrophobicContact CG1-CG1 3.89Å; A203-V211 HydrophobicContact CB-CB 4Å; A203-V211 HydrophobicContact CB-CG1 3.94Å; L208-V211 HydrophobicContact CB-CB 4.05Å; L208-V211 HydrophobicContact CB-CG2 3.96Å; L208-V211 HydrophobicContact CD1-CG2 4.23Å; L208-V211 PolarHBondContact O-N 3.07Å; V211-K213 PolarHBondContact O-N 3.4Å; V211-Y214 WeakPolarHBondContact O-CB 3.02Å; V211-Y214 PolarHBondContact O-N 3.05Å; V211-V215 HydrophobicContact CG1-CG2 4.28Å; V211-V215 VanDerWaalsContact O-CG2 3.3Å; V211-V215 WeakPolarHBondContact O-CG2 3.3Å; V211-V215 PolarHBondContact O-N 3.14Å
212	D	95.1	Very high	94.2	Very high	40 Å²	40	61 Å²	61	21%	0.214	30%	0.303	C	S	.	.	H	α-helix	trans	-60.2	-46	179.2	-168.2	62.9	0	0	0	112.3	A203 L208 T209 E210 Y214 V215 N216 R239	A203-D212 HydrophobicContact CB-CB 4.1Å; L208-D212 PolarHBondContact O-N 2.93Å; T209-D212 PolarHBondContact O-N 3.34Å; E210-D212 VanDerWaalsContact C-N 3.35Å; D212-Y214 VanDerWaalsContact C-N 3.32Å; D212-Y214 PolarHBondContact O-N 3.35Å; D212-V215 PolarHBondContact O-N 3.18Å; D212-N216 WeakPolarHBondContact O-CB 3.28Å; D212-N216 VanDerWaalsContact O-CG 3.25Å; D212-N216 PolarHBondContact O-N 3.22Å; D212-N216 PolarHBondContact O-ND2 3.27Å; D212-N216 PolarHBondContact OD2-ND2 3.18Å; D212-R239 IonicContact OD1-CZ 2.61Å; D212-R239 IonicContact OD1-NH1 2.85Å; D212-R239 IonicContact OD1-NH2 3.87Å; D212-R239 PolarHBondContact OD1-NH2 3.06Å
213	K	95.6	Very high	94.3	Very high	154 Å²	154	60.3 Å²	60.3	67%	0.67	30%	0.299	S	S	*	.	H	α-helix	trans	-59.6	-42.5	175.1	-175.5	179.9	178.8	-177.8	0	111.8	T209 E210 V211 T217	T209-K213 WeakPolarHBondContact O-CB 3.42Å; T209-K213 PolarHBondContact O-N 2.84Å; E210-K213 PolarHBondContact O-N 2.61Å; V211-K213 PolarHBondContact O-N 3.4Å; K213-T217 PolarHBondContact O-N 3.41Å; K213-T217 PolarHBondContact O-OG1 3.31Å
214	Y	96.9	Very high	94.3	Very high	99 Å²	99	62.3 Å²	62.3	39%	0.388	31%	0.312	S	S	.	.	H	α-helix	trans	-62.4	-48.5	176.2	-178.9	-89.9	0	0	0	111.3	I188 V191 E210 V211 D212 N216 T217 F218	I188-Y214 HydrophobicContact CB-CD1 4.48Å; I188-Y214 HydrophobicContact CG1-CD1 4.37Å; I188-Y214 HydrophobicContact CG1-CG 4.22Å; I188-Y214 HydrophobicContact CG2-CD1 4.04Å; I188-Y214 HydrophobicContact CG2-CD2 3.8Å; I188-Y214 HydrophobicContact CG2-CE1 4.06Å; I188-Y214 HydrophobicContact CG2-CE2 3.8Å; I188-Y214 HydrophobicContact CG2-CG 3.91Å; V191-Y214 HydrophobicContact CB-CE1 3.95Å; V191-Y214 HydrophobicContact CG1-CE1 4.47Å; V191-Y214 HydrophobicContact CG2-CD1 3.97Å; V191-Y214 HydrophobicContact CG2-CE1 3.79Å; E210-Y214 PolarHBondContact O-N 2.95Å; V211-Y214 WeakPolarHBondContact O-CB 3.02Å; V211-Y214 PolarHBondContact O-N 3.05Å; D212-Y214 VanDerWaalsContact C-N 3.32Å; D212-Y214 PolarHBondContact O-N 3.35Å; Y214-N216 PolarHBondContact O-N 2.85Å; Y214-T217 WeakPolarHBondContact O-CB 3.36Å; Y214-T217 PolarHBondContact O-N 2.95Å; Y214-F218 WeakPolarHBondContact O-CB 3.3Å; Y214-F218 PolarHBondContact O-N 2.84Å
215	V	96.7	Very high	94.3	Very high	0 Å²	0	59.1 Å²	59.1	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-63.2	-41.9	178.9	-178	0	0	0	0	111.1	V191 C196 V199 V211 D212 T217 F218 V219	V191-V215 HydrophobicContact CG2-CG2 4.26Å; C196-V215 HydrophobicContact CB-CG1 4.29Å; C196-V215 VanDerWaalsContact O-CG1 3.26Å; C196-V215 WeakPolarHBondContact O-CG1 3.21Å; V199-V215 HydrophobicContact CB-CG2 4.43Å; V199-V215 HydrophobicContact CG1-CG2 3.8Å; V211-V215 HydrophobicContact CG1-CG2 4.28Å; V211-V215 VanDerWaalsContact O-CG2 3.3Å; V211-V215 WeakPolarHBondContact O-CG2 3.3Å; V211-V215 PolarHBondContact O-N 3.14Å; D212-V215 PolarHBondContact O-N 3.18Å; V215-T217 VanDerWaalsContact C-N 3.3Å; V215-T217 PolarHBondContact O-N 2.89Å; V215-F218 WeakPolarHBondContact O-CB 3.48Å; V215-F218 PolarHBondContact O-N 2.86Å; V215-V219 HydrophobicContact CG1-CG2 4.11Å; V215-V219 WeakPolarHBondContact O-CB 3.37Å; V215-V219 VanDerWaalsContact O-CG2 3.3Å; V215-V219 WeakPolarHBondContact O-CG2 3.43Å; V215-V219 PolarHBondContact O-N 3.17Å
216	N	95.4	Very high	94.4	Very high	24 Å²	24	55 Å²	55	13%	0.128	28%	0.277	C	S	.	.	H	α-helix	trans	-59	-43	175.6	-73.7	-27.6	0	0	0	111.3	D212 Y214 V219 L220 F242	D212-N216 WeakPolarHBondContact O-CB 3.28Å; D212-N216 VanDerWaalsContact O-CG 3.25Å; D212-N216 PolarHBondContact O-N 3.22Å; D212-N216 PolarHBondContact O-ND2 3.27Å; D212-N216 PolarHBondContact OD2-ND2 3.18Å; Y214-N216 PolarHBondContact O-N 2.85Å; N216-V219 PolarHBondContact O-N 3.02Å; N216-L220 VanDerWaalsContact O-CG 3.28Å; N216-L220 WeakPolarHBondContact O-CG 3.4Å; N216-L220 PolarHBondContact O-N 3.45Å; N216-F242 HydrophobicContact CB-CD1 4.39Å; N216-F242 HydrophobicContact CB-CE1 3.76Å; N216-F242 HydrophobicContact CB-CZ 4.35Å
217	T	95.7	Very high	94.5	Very high	86 Å²	86	54.8 Å²	54.8	53%	0.528	28%	0.277	S	S	.	.	H	α-helix	trans	-65.2	-41.8	175.3	-53.1	0	0	0	0	111.7	K213 Y214 V215 L220 K221	K213-T217 PolarHBondContact O-N 3.41Å; K213-T217 PolarHBondContact O-OG1 3.31Å; Y214-T217 WeakPolarHBondContact O-CB 3.36Å; Y214-T217 PolarHBondContact O-N 2.95Å; V215-T217 VanDerWaalsContact C-N 3.3Å; V215-T217 PolarHBondContact O-N 2.89Å; T217-L220 PolarHBondContact O-N 3.46Å; T217-K221 WeakPolarHBondContact O-CB 3.3Å; T217-K221 PolarHBondContact O-N 3.32Å
218	F	96	Very high	94.4	Very high	33 Å²	33	50.7 Å²	50.7	15%	0.145	28%	0.277	C	S	.	.	H	α-helix	trans	-62.3	-45.5	176.9	-179.2	-88	0	0	0	111.7	V191 L193 C196 Y214 V215 K221 N222	V191-F218 HydrophobicContact CG1-CB 4.43Å; V191-F218 HydrophobicContact CG1-CD1 3.71Å; V191-F218 HydrophobicContact CG1-CD2 4.04Å; V191-F218 HydrophobicContact CG1-CE1 3.9Å; V191-F218 HydrophobicContact CG1-CE2 4.22Å; V191-F218 HydrophobicContact CG1-CG 3.8Å; V191-F218 HydrophobicContact CG1-CZ 4.16Å; L193-F218 HydrophobicContact CD2-CE1 4.18Å; L193-F218 HydrophobicContact CD2-CZ 4.33Å; C196-F218 HydrophobicContact CB-CD1 3.91Å; C196-F218 HydrophobicContact CB-CE1 3.92Å; Y214-F218 WeakPolarHBondContact O-CB 3.3Å; Y214-F218 PolarHBondContact O-N 2.84Å; V215-F218 WeakPolarHBondContact O-CB 3.48Å; V215-F218 PolarHBondContact O-N 2.86Å; F218-K221 PolarHBondContact O-N 3.23Å; F218-N222 WeakPolarHBondContact O-CB 3.32Å; F218-N222 PolarHBondContact O-N 2.95Å; F218-N222 PolarHBondContact O-ND2 3.38Å
219	V	95.7	Very high	94.1	Very high	1 Å²	1	53 Å²	53	1%	0.006	29%	0.291	C	S	.	.	H	α-helix	trans	-63.4	-46.1	177.4	172.7	0	0	0	0	110.3	V215 N216 K221 N222 F223 L226 V243	V215-V219 HydrophobicContact CG1-CG2 4.11Å; V215-V219 WeakPolarHBondContact O-CB 3.37Å; V215-V219 VanDerWaalsContact O-CG2 3.3Å; V215-V219 WeakPolarHBondContact O-CG2 3.43Å; V215-V219 PolarHBondContact O-N 3.17Å; N216-V219 PolarHBondContact O-N 3.02Å; V219-K221 VanDerWaalsContact C-N 3.3Å; V219-K221 PolarHBondContact O-N 3.44Å; V219-N222 CarbonylContact O-C 3.56Å; V219-N222 PolarHBondContact O-N 3.48Å; V219-F223 HydrophobicContact CG1-CD2 4.01Å; V219-F223 WeakPolarHBondContact O-CA 3.45Å; V219-F223 VanDerWaalsContact O-CB 3.29Å; V219-F223 WeakPolarHBondContact O-CB 3.46Å; V219-F223 PolarHBondContact O-N 2.92Å; V219-L226 HydrophobicContact CG1-CD2 4.17Å; V219-V243 HydrophobicContact CG1-CG2 3.68Å
220	L	94.9	Very high	93.7	Very high	13 Å²	13	49 Å²	49	7%	0.068	27%	0.272	C	S	.	.	H	α-helix	trans	-59.1	-39.6	177.2	-73.7	172.9	0	0	0	113	N216 T217 F242 V243 L249	N216-L220 VanDerWaalsContact O-CG 3.28Å; N216-L220 WeakPolarHBondContact O-CG 3.4Å; N216-L220 PolarHBondContact O-N 3.45Å; T217-L220 PolarHBondContact O-N 3.46Å; L220-F242 HydrophobicContact CD1-CE1 3.63Å; L220-F242 HydrophobicContact CD1-CZ 3.87Å; L220-F242 HydrophobicContact CD2-CE1 4.34Å; L220-F242 HydrophobicContact CG-CE1 4.01Å; L220-V243 HydrophobicContact CD2-CB 4.39Å; L220-V243 HydrophobicContact CD2-CG1 4.34Å; L220-V243 HydrophobicContact CD2-CG2 4.23Å; L220-L249 HydrophobicContact CD2-CB 4.15Å; L220-L249 HydrophobicContact CD2-CD1 4.33Å
221	K	93.4	Very high	93.5	Very high	140 Å²	140	45.2 Å²	45.2	61%	0.609	25%	0.254	S	S	*	.	H	α-helix	trans	-71.8	-34.6	179.6	-175.1	-180	175.9	-174.9	0	112.6	T217 F218 V219	T217-K221 WeakPolarHBondContact O-CB 3.3Å; T217-K221 PolarHBondContact O-N 3.32Å; F218-K221 PolarHBondContact O-N 3.23Å; V219-K221 VanDerWaalsContact C-N 3.3Å; V219-K221 PolarHBondContact O-N 3.44Å
222	N	94.3	Very high	93.3	Very high	47 Å²	47	45.3 Å²	45.3	25%	0.251	26%	0.255	S	S	.	.	H	α-helix	trans	-114.8	13.2	-170.9	-57	-75.8	0	0	0	113.9	L193 F218 V219 P224 A225 L226	L193-N222 HydrophobicContact CD2-CB 3.73Å; F218-N222 WeakPolarHBondContact O-CB 3.32Å; F218-N222 PolarHBondContact O-N 2.95Å; F218-N222 PolarHBondContact O-ND2 3.38Å; V219-N222 CarbonylContact O-C 3.56Å; V219-N222 PolarHBondContact O-N 3.48Å; N222-P224 VanDerWaalsContact C-CD 3.46Å; N222-A225 WeakPolarHBondContact O-CB 3.26Å; N222-A225 PolarHBondContact O-N 3.33Å; N222-L226 PolarHBondContact O-N 3.49Å
223	F	94.8	Very high	93.3	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-55.4	-41.6	-177	-164.4	-109.5	0	0	0	113.9	V219 A225 L226 M227 L235 L240 V243 L249 L257	V219-F223 HydrophobicContact CG1-CD2 4.01Å; V219-F223 WeakPolarHBondContact O-CA 3.45Å; V219-F223 VanDerWaalsContact O-CB 3.29Å; V219-F223 WeakPolarHBondContact O-CB 3.46Å; V219-F223 PolarHBondContact O-N 2.92Å; F223-A225 VanDerWaalsContact C-N 3.3Å; F223-A225 PolarHBondContact O-N 3.49Å; F223-L226 HydrophobicContact CD2-CD2 4.34Å; F223-L226 PolarHBondContact O-N 2.95Å; F223-M227 HydrophobicContact CD1-CE 4.2Å; F223-M227 HydrophobicContact CD1-CG 4.11Å; F223-M227 HydrophobicContact CD1-SD 4.12Å; F223-M227 HydrophobicContact CE1-CE 4.38Å; F223-M227 HydrophobicContact CE1-CG 3.86Å; F223-M227 HydrophobicContact CE1-SD 3.73Å; F223-M227 HydrophobicContact CZ-CG 4.22Å; F223-M227 WeakPolarHBondContact O-CG 3.42Å; F223-M227 PolarHBondContact O-N 3.33Å; F223-L235 HydrophobicContact CE2-CD1 4.11Å; F223-L240 HydrophobicContact CZ-CD1 4.22Å; F223-V243 HydrophobicContact CD1-CG1 4.18Å; F223-V243 HydrophobicContact CD2-CG1 3.76Å; F223-V243 HydrophobicContact CE1-CG1 4.21Å; F223-V243 HydrophobicContact CE2-CG1 3.79Å; F223-V243 HydrophobicContact CG-CG1 3.95Å; F223-V243 HydrophobicContact CZ-CG1 4.02Å; F223-L249 HydrophobicContact CB-CD1 3.57Å; F223-L249 HydrophobicContact CD1-CD1 4.07Å; F223-L249 HydrophobicContact CG-CD1 4.01Å; F223-L257 HydrophobicContact CD1-CD2 4.17Å; F223-L257 HydrophobicContact CE1-CD2 3.82Å
224	P	92.6	Very high	93.2	Very high	42 Å²	42	44.2 Å²	44.2	27%	0.273	25%	0.25	S	S	.	.	H	α-helix	trans	-55.5	-43.4	174.2	-22	29.5	0	0	0	113.2	N222 M227 K250 Q251	N222-P224 VanDerWaalsContact C-CD 3.46Å; P224-M227 PolarHBondContact O-N 2.84Å; P224-K250 WeakPolarHBondContact CG-O 3.39Å; P224-Q251 HydrophobicContact CG-CB 3.99Å
225	A	93.4	Very high	93.1	Very high	46 Å²	46	39.6 Å²	39.6	38%	0.38	23%	0.232	S	C	.	.	H	α-helix	trans	-69.4	-40.5	178.2	0	0	0	0	0	111.4	L193 N222 F223 M227 G228 T229	L193-A225 HydrophobicContact CD1-CB 3.92Å; L193-A225 HydrophobicContact CD2-CB 4.19Å; N222-A225 WeakPolarHBondContact O-CB 3.26Å; N222-A225 PolarHBondContact O-N 3.33Å; F223-A225 VanDerWaalsContact C-N 3.3Å; F223-A225 PolarHBondContact O-N 3.49Å; A225-M227 VanDerWaalsContact C-N 3.28Å; A225-M227 PolarHBondContact O-N 3.04Å; A225-G228 WeakPolarHBondContact O-CA 3.31Å; A225-G228 PolarHBondContact O-N 3.4Å; A225-T229 PolarHBondContact O-N 2.78Å
226	L	93.8	Very high	93	Very high	1 Å²	1	42.4 Å²	42.4	1%	0.005	25%	0.25	C	S	.	.	H	α-helix	trans	-63.1	-32.5	177.2	-169	70.4	0	0	0	112.6	L193 V219 N222 F223 G228 T229 E231 F232 L235	L193-L226 WeakPolarHBondContact O-CD1 3.18Å; V219-L226 HydrophobicContact CG1-CD2 4.17Å; N222-L226 PolarHBondContact O-N 3.49Å; F223-L226 HydrophobicContact CD2-CD2 4.34Å; F223-L226 PolarHBondContact O-N 2.95Å; L226-G228 PolarHBondContact O-N 3.21Å; L226-T229 PolarHBondContact O-N 3.19Å; L226-T229 PolarHBondContact O-OG1 3.49Å; L226-E231 HydrophobicContact CD1-CB 3.86Å; L226-F232 HydrophobicContact CD2-CB 4.07Å; L226-F232 HydrophobicContact CG-CB 3.97Å; L226-L235 HydrophobicContact CD2-CD1 4.27Å
227	M	91.3	Very high	93	Very high	30 Å²	30	43.3 Å²	43.3	15%	0.148	25%	0.253	C	S	.	.	H	α-helix	trans	-63.2	-22.2	173	-73.6	-166.7	-67.9	0	0	113.1	F223 P224 A225 D256 A260	F223-M227 HydrophobicContact CD1-CE 4.2Å; F223-M227 HydrophobicContact CD1-CG 4.11Å; F223-M227 HydrophobicContact CD1-SD 4.12Å; F223-M227 HydrophobicContact CE1-CE 4.38Å; F223-M227 HydrophobicContact CE1-CG 3.86Å; F223-M227 HydrophobicContact CE1-SD 3.73Å; F223-M227 HydrophobicContact CZ-CG 4.22Å; F223-M227 WeakPolarHBondContact O-CG 3.42Å; F223-M227 PolarHBondContact O-N 3.33Å; P224-M227 PolarHBondContact O-N 2.84Å; A225-M227 VanDerWaalsContact C-N 3.28Å; A225-M227 PolarHBondContact O-N 3.04Å; M227-D256 HydrophobicContact CE-CB 4.44Å; M227-A260 HydrophobicContact CG-CB 4.45Å; M227-A260 HydrophobicContact SD-CB 3.59Å; M227-A260 VanDerWaalsContact SD-CB 3.59Å
228	G	87.9	Confident	93	Very high	70 Å²	70	45.6 Å²	45.6	72%	0.722	26%	0.258	S	S	*	.	H	α-helix	trans	-84.6	-28.6	176.9	0	0	0	0	0	114.5	A225 L226	A225-G228 WeakPolarHBondContact O-CA 3.31Å; A225-G228 PolarHBondContact O-N 3.4Å; L226-G228 PolarHBondContact O-N 3.21Å
229	T	88.7	Confident	92.9	Very high	57 Å²	57	44.9 Å²	44.9	35%	0.35	25%	0.254	S	S	.	.	H	α-helix	trans	-82	-19	-178.8	65.1	0	0	0	0	113.4	L193 A225 L226 E231	L193-T229 HydrophobicContact CB-CG2 4.42Å; A225-T229 PolarHBondContact O-N 2.78Å; L226-T229 PolarHBondContact O-N 3.19Å; L226-T229 PolarHBondContact O-OG1 3.49Å; T229-E231 PolarHBondContact O-N 3.46Å; T229-E231 PolarHBondContact OG1-N 3.24Å
230	G	84.9	Confident	92.9	Very high	27 Å²	27	45 Å²	45	28%	0.278	26%	0.255	S	S	.	.	S	Bend	trans	82.9	-12.7	-175.7	0	0	0	0	0	114.2	F232 L233	G230-F232 PolarHBondContact O-N 2.9Å; G230-F232 VanDerWaalsContact O-N 3.16Å; G230-L233 WeakPolarHBondContact O-CB 3.49Å; G230-L233 PolarHBondContact O-N 3.16Å; G230-L233 VanDerWaalsContact O-N 3.07Å
231	E	90.3	Very high	93.1	Very high	39 Å²	39	45 Å²	45	18%	0.182	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-59.6	-27.8	177	-69.5	-57.9	126.3	0	0	112.4	V197 L226 T229 L233 K234	V197-E231 HydrophobicContact CG2-CB 4.33Å; L226-E231 HydrophobicContact CD1-CB 3.86Å; T229-E231 PolarHBondContact O-N 3.46Å; T229-E231 PolarHBondContact OG1-N 3.24Å; E231-L233 PolarHBondContact O-N 3.02Å; E231-K234 WeakPolarHBondContact O-CB 3.4Å; E231-K234 PolarHBondContact O-N 3.12Å; E231-K234 IonicContact OE1-NZ 3.57Å; E231-K234 PolarHBondContact OE1-NZ 3.13Å; E231-K234 WeakPolarHBondContact OE2-CD 3.38Å; E231-K234 WeakPolarHBondContact OE2-CE 3.32Å; E231-K234 IonicContact OE2-NZ 2.79Å; E231-K234 PolarHBondContact OE2-NZ 3.18Å
232	F	92.9	Very high	93.2	Very high	3 Å²	3	42.3 Å²	42.3	1%	0.013	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-56.3	-26.2	175.8	86.9	-85.9	0	0	0	113.4	L226 G230 K234 L235 A260 R263 W264	L226-F232 HydrophobicContact CD2-CB 4.07Å; L226-F232 HydrophobicContact CG-CB 3.97Å; G230-F232 PolarHBondContact O-N 2.9Å; G230-F232 VanDerWaalsContact O-N 3.16Å; F232-K234 PolarHBondContact O-N 3.49Å; F232-L235 HydrophobicContact CB-CD1 4.11Å; F232-L235 VanDerWaalsContact O-CB 3.32Å; F232-L235 WeakPolarHBondContact O-CB 3.41Å; F232-L235 WeakPolarHBondContact O-CD1 3.47Å; F232-L235 WeakPolarHBondContact O-CG 3.41Å; F232-L235 PolarHBondContact O-N 3.3Å; F232-A260 HydrophobicContact CE2-CB 4.28Å; F232-R263 HydrophobicContact CZ-CB 4.16Å; F232-W264 HydrophobicContact CE2-CB 4.42Å
233	L	94.6	Very high	93.3	Very high	42 Å²	42	40.1 Å²	40.1	22%	0.22	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-66.3	-22.5	178.6	-69	174.1	0	0	0	112.8	G230 E231 R263 W264 L267 R271	G230-L233 WeakPolarHBondContact O-CB 3.49Å; G230-L233 PolarHBondContact O-N 3.16Å; G230-L233 VanDerWaalsContact O-N 3.07Å; E231-L233 PolarHBondContact O-N 3.02Å; L233-R263 HydrophobicContact CD2-CB 4.23Å; L233-W264 HydrophobicContact CD2-CB 4.39Å; L233-L267 HydrophobicContact CB-CD2 4.06Å; L233-R271 PolarHBondContact O-NH1 3.48Å
234	K	94	Very high	93.4	Very high	128 Å²	128	40.1 Å²	40.1	56%	0.557	23%	0.234	S	C	*	.	G	3₁₀ helix	trans	-87.3	-4.1	178.2	-57	179.1	-166.1	159.9	0	112.9	V197 E231 F232	V197-K234 HydrophobicContact CG1-CB 3.93Å; E231-K234 WeakPolarHBondContact O-CB 3.4Å; E231-K234 PolarHBondContact O-N 3.12Å; E231-K234 IonicContact OE1-NZ 3.57Å; E231-K234 PolarHBondContact OE1-NZ 3.13Å; E231-K234 WeakPolarHBondContact OE2-CD 3.38Å; E231-K234 WeakPolarHBondContact OE2-CE 3.32Å; E231-K234 IonicContact OE2-NZ 2.79Å; E231-K234 PolarHBondContact OE2-NZ 3.18Å; F232-K234 PolarHBondContact O-N 3.49Å
235	L	94.5	Very high	93.5	Very high	2 Å²	2	40.9 Å²	40.9	1%	0.01	24%	0.24	C	C	.	.			trans	-62.1	137.8	178.9	-72.9	169.8	0	0	0	110.9	V197 F223 L226 F232 R239 W264	V197-L235 HydrophobicContact CG1-CD2 4.27Å; V197-L235 HydrophobicContact CG2-CD2 3.84Å; V197-L235 HydrophobicContact CG2-CG 4.22Å; F223-L235 HydrophobicContact CE2-CD1 4.11Å; L226-L235 HydrophobicContact CD2-CD1 4.27Å; F232-L235 HydrophobicContact CB-CD1 4.11Å; F232-L235 VanDerWaalsContact O-CB 3.32Å; F232-L235 WeakPolarHBondContact O-CB 3.41Å; F232-L235 WeakPolarHBondContact O-CD1 3.47Å; F232-L235 WeakPolarHBondContact O-CG 3.41Å; F232-L235 PolarHBondContact O-N 3.3Å; L235-R239 HydrophobicContact CD2-CB 4.48Å; L235-R239 HydrophobicContact CD2-CG 4.08Å; L235-W264 PolarHBondContact O-NE1 3.17Å
236	P	94	Very high	93.6	Very high	59 Å²	59	39.4 Å²	39.4	38%	0.383	23%	0.227	S	C	.	.			trans	-68.6	157.3	171.3	29.8	-34.3	0	0	0	111	E238 R239 L240	P236-E238 VanDerWaalsContact C-N 3.27Å; P236-E238 PolarHBondContact O-N 3.31Å; P236-R239 HydrophobicContact CG-CB 3.87Å; P236-R239 PolarHBondContact O-N 3.43Å; P236-L240 PolarHBondContact O-N 2.79Å; P236-L240 VanDerWaalsContact O-N 3.07Å
237	F	95.1	Very high	93.7	Very high	44 Å²	44	42.5 Å²	42.5	19%	0.193	24%	0.244	C	C	.	.	H	α-helix	trans	-52.1	-46.2	-178.5	163.7	-99.1	0	0	0	112	R239 L240 A241 W264 F274 K277 L278	F237-R239 VanDerWaalsContact C-N 3.3Å; F237-R239 PolarHBondContact O-N 2.89Å; F237-L240 PolarHBondContact O-N 2.81Å; F237-A241 HydrophobicContact CE2-CB 4.47Å; F237-A241 HydrophobicContact CZ-CB 4.33Å; F237-A241 VanDerWaalsContact O-CB 3.28Å; F237-A241 WeakPolarHBondContact O-CB 3.49Å; F237-A241 PolarHBondContact O-N 2.79Å; F237-W264 HydrophobicContact CB-CH2 4.18Å; F237-F274 HydrophobicContact CD1-CD1 4.5Å; F237-F274 HydrophobicContact CD2-CB 3.72Å; F237-F274 AromaticContact CD2-CD1 3.69Å; F237-F274 HydrophobicContact CD2-CD1 3.69Å; F237-F274 HydrophobicContact CD2-CD2 4.3Å; F237-F274 HydrophobicContact CD2-CE1 4.41Å; F237-F274 AromaticContact CD2-CG 3.64Å; F237-F274 HydrophobicContact CD2-CG 3.64Å; F237-F274 HydrophobicContact CE2-CB 3.83Å; F237-F274 AromaticContact CE2-CD1 3.82Å; F237-F274 HydrophobicContact CE2-CD1 3.82Å; F237-F274 HydrophobicContact CE2-CG 4.02Å; F237-F274 HydrophobicContact CG-CD1 4.06Å; F237-F274 HydrophobicContact CG-CE1 4.34Å; F237-F274 HydrophobicContact CG-CG 4.25Å; F237-F274 HydrophobicContact CZ-CD1 4.3Å; F237-K277 HydrophobicContact CE2-CB 4.04Å; F237-K277 HydrophobicContact CZ-CB 4.01Å; F237-K277 HydrophobicContact CZ-CD 4.07Å; F237-L278 HydrophobicContact CD2-CD1 4.43Å; F237-L278 HydrophobicContact CD2-CD2 3.82Å; F237-L278 HydrophobicContact CD2-CG 4.11Å; F237-L278 HydrophobicContact CE2-CD2 3.63Å; F237-L278 HydrophobicContact CE2-CG 3.87Å
238	E	94.9	Very high	93.7	Very high	133 Å²	133	43.4 Å²	43.4	62%	0.621	25%	0.253	S	S	*	.	H	α-helix	trans	-60.7	-41.7	-175.7	-63.1	73.5	-161.2	0	0	111.2	P236 F242	P236-E238 VanDerWaalsContact C-N 3.27Å; P236-E238 PolarHBondContact O-N 3.31Å; E238-F242 WeakPolarHBondContact O-CB 3.42Å; E238-F242 PolarHBondContact O-N 3.47Å
239	R	95.1	Very high	93.9	Very high	19 Å²	19	40.4 Å²	40.4	7%	0.072	22%	0.22	C	C	.	.	H	α-helix	trans	-74.3	-40.9	-179	-168.1	166.9	-57.2	-143.7	-1	111.7	G200 D212 L235 P236 F237 F242 V243	G200-R239 PolarHBondContact O-NH2 3.1Å; D212-R239 IonicContact OD1-CZ 2.61Å; D212-R239 IonicContact OD1-NH1 2.85Å; D212-R239 IonicContact OD1-NH2 3.87Å; D212-R239 PolarHBondContact OD1-NH2 3.06Å; L235-R239 HydrophobicContact CD2-CB 4.48Å; L235-R239 HydrophobicContact CD2-CG 4.08Å; P236-R239 HydrophobicContact CG-CB 3.87Å; P236-R239 PolarHBondContact O-N 3.43Å; F237-R239 VanDerWaalsContact C-N 3.3Å; F237-R239 PolarHBondContact O-N 2.89Å; R239-F242 WeakPolarHBondContact O-CB 3.44Å; R239-F242 PolarHBondContact O-N 3.25Å; R239-V243 VanDerWaalsContact O-CG2 3.3Å; R239-V243 WeakPolarHBondContact O-CG2 3.27Å; R239-V243 PolarHBondContact O-N 3.22Å
240	L	96.4	Very high	93.6	Very high	2 Å²	2	42.2 Å²	42.2	1%	0.01	22%	0.223	C	C	.	.	H	α-helix	trans	-63.9	-44.4	174.9	-179.1	60.7	0	0	0	110.8	F223 P236 F237 F242 V243 L244 W264 L278	F223-L240 HydrophobicContact CZ-CD1 4.22Å; P236-L240 PolarHBondContact O-N 2.79Å; P236-L240 VanDerWaalsContact O-N 3.07Å; F237-L240 PolarHBondContact O-N 2.81Å; L240-F242 VanDerWaalsContact C-N 3.32Å; L240-F242 PolarHBondContact O-N 3.04Å; L240-V243 PolarHBondContact O-N 3.15Å; L240-L244 HydrophobicContact CD1-CD1 4.21Å; L240-L244 HydrophobicContact CD1-CG 4.13Å; L240-L244 HydrophobicContact CG-CD1 3.98Å; L240-L244 HydrophobicContact CG-CG 4.33Å; L240-L244 WeakPolarHBondContact O-CB 3.42Å; L240-L244 VanDerWaalsContact O-CG 3.26Å; L240-L244 WeakPolarHBondContact O-CG 3.24Å; L240-L244 PolarHBondContact O-N 2.9Å; L240-W264 HydrophobicContact CD2-CB 3.94Å; L240-W264 HydrophobicContact CD2-CD2 3.49Å; L240-W264 VanDerWaalsContact CD2-CD2 3.49Å; L240-W264 HydrophobicContact CD2-CE3 3.93Å; L240-W264 HydrophobicContact CD2-CG 3.48Å; L240-W264 VanDerWaalsContact CD2-CG 3.48Å; L240-L278 HydrophobicContact CD2-CD1 3.96Å; L240-L278 HydrophobicContact CD2-CD2 4.42Å; L240-L278 HydrophobicContact CG-CD2 4.32Å
241	A	97.4	Very high	93.6	Very high	15 Å²	15	48.8 Å²	48.8	12%	0.124	25%	0.247	C	C	.	.	H	α-helix	trans	-58.9	-44	174.9	0	0	0	0	0	111.5	F237 L244 S245 L278	F237-A241 HydrophobicContact CE2-CB 4.47Å; F237-A241 HydrophobicContact CZ-CB 4.33Å; F237-A241 VanDerWaalsContact O-CB 3.28Å; F237-A241 WeakPolarHBondContact O-CB 3.49Å; F237-A241 PolarHBondContact O-N 2.79Å; A241-L244 PolarHBondContact O-N 3.4Å; A241-S245 WeakPolarHBondContact O-CB 3.24Å; A241-S245 PolarHBondContact O-N 3.06Å; A241-S245 PolarHBondContact O-OG 2.7Å; A241-L278 HydrophobicContact CB-CD2 3.91Å
242	F	96.1	Very high	93.6	Very high	83 Å²	83	47.8 Å²	47.8	36%	0.364	24%	0.244	S	C	.	.	H	α-helix	trans	-57.5	-50.8	174.1	170.7	-100.3	0	0	0	111.8	N216 L220 E238 R239 L240 L244 S245 S246	N216-F242 HydrophobicContact CB-CD1 4.39Å; N216-F242 HydrophobicContact CB-CE1 3.76Å; N216-F242 HydrophobicContact CB-CZ 4.35Å; L220-F242 HydrophobicContact CD1-CE1 3.63Å; L220-F242 HydrophobicContact CD1-CZ 3.87Å; L220-F242 HydrophobicContact CD2-CE1 4.34Å; L220-F242 HydrophobicContact CG-CE1 4.01Å; E238-F242 WeakPolarHBondContact O-CB 3.42Å; E238-F242 PolarHBondContact O-N 3.47Å; R239-F242 WeakPolarHBondContact O-CB 3.44Å; R239-F242 PolarHBondContact O-N 3.25Å; L240-F242 VanDerWaalsContact C-N 3.32Å; L240-F242 PolarHBondContact O-N 3.04Å; F242-L244 PolarHBondContact O-N 3.25Å; F242-S245 PolarHBondContact O-N 3.21Å; F242-S245 VanDerWaalsContact O-N 3.13Å; F242-S245 PolarHBondContact O-OG 2.94Å; F242-S246 PolarHBondContact O-N 3.27Å; F242-S246 VanDerWaalsContact O-N 3.08Å
243	V	96.1	Very high	93.6	Very high	0 Å²	0	51 Å²	51	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-57.3	-49.5	177.9	170.4	0	0	0	0	111.1	V219 L220 F223 R239 L240 S245 S246 L249	V219-V243 HydrophobicContact CG1-CG2 3.68Å; L220-V243 HydrophobicContact CD2-CB 4.39Å; L220-V243 HydrophobicContact CD2-CG1 4.34Å; L220-V243 HydrophobicContact CD2-CG2 4.23Å; F223-V243 HydrophobicContact CD1-CG1 4.18Å; F223-V243 HydrophobicContact CD2-CG1 3.76Å; F223-V243 HydrophobicContact CE1-CG1 4.21Å; F223-V243 HydrophobicContact CE2-CG1 3.79Å; F223-V243 HydrophobicContact CG-CG1 3.95Å; F223-V243 HydrophobicContact CZ-CG1 4.02Å; R239-V243 VanDerWaalsContact O-CG2 3.3Å; R239-V243 WeakPolarHBondContact O-CG2 3.27Å; R239-V243 PolarHBondContact O-N 3.22Å; L240-V243 PolarHBondContact O-N 3.15Å; V243-S245 PolarHBondContact O-N 2.99Å; V243-S246 PolarHBondContact O-N 3.08Å; V243-L249 HydrophobicContact CG1-CD1 3.99Å; V243-L249 HydrophobicContact CG1-CD2 4.1Å
244	L	96.7	Very high	93.6	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-66.1	-22.8	179.7	-66	174.3	0	0	0	113.1	L240 A241 F242 L257 T261 L278 N281 R336	L240-L244 HydrophobicContact CD1-CD1 4.21Å; L240-L244 HydrophobicContact CD1-CG 4.13Å; L240-L244 HydrophobicContact CG-CD1 3.98Å; L240-L244 HydrophobicContact CG-CG 4.33Å; L240-L244 WeakPolarHBondContact O-CB 3.42Å; L240-L244 VanDerWaalsContact O-CG 3.26Å; L240-L244 WeakPolarHBondContact O-CG 3.24Å; L240-L244 PolarHBondContact O-N 2.9Å; A241-L244 PolarHBondContact O-N 3.4Å; F242-L244 PolarHBondContact O-N 3.25Å; L244-L257 HydrophobicContact CD2-CB 3.86Å; L244-L257 HydrophobicContact CD2-CD1 4.37Å; L244-L257 HydrophobicContact CD2-CD2 4.2Å; L244-L257 HydrophobicContact CD2-CG 4.35Å; L244-T261 HydrophobicContact CD1-CG2 4.28Å; L244-T261 WeakPolarHBondContact CD1-OG1 3.43Å; L244-L278 HydrophobicContact CD1-CB 4.22Å; L244-L278 HydrophobicContact CD1-CD2 4.07Å; L244-N281 HydrophobicContact CB-CB 3.65Å; L244-R336 PolarHBondContact O-NH1 2.91Å; L244-R336 PolarHBondContact O-NH2 3.46Å
245	S	95.9	Very high	93.7	Very high	58 Å²	58	44.2 Å²	44.2	41%	0.406	23%	0.233	S	C	.	.	H	α-helix	trans	-88.3	-21	178	71.3	0	0	0	0	113.5	A241 F242 V243	A241-S245 WeakPolarHBondContact O-CB 3.24Å; A241-S245 PolarHBondContact O-N 3.06Å; A241-S245 PolarHBondContact O-OG 2.7Å; F242-S245 PolarHBondContact O-N 3.21Å; F242-S245 VanDerWaalsContact O-N 3.13Å; F242-S245 PolarHBondContact O-OG 2.94Å; V243-S245 PolarHBondContact O-N 2.99Å
246	S	95.8	Very high	93.8	Very high	16 Å²	16	47.1 Å²	47.1	11%	0.112	25%	0.249	C	C	.	.			trans	-75.5	138.6	-169.4	-175.9	0	0	0	0	113.7	F242 V243 S248 R336	F242-S246 PolarHBondContact O-N 3.27Å; F242-S246 VanDerWaalsContact O-N 3.08Å; V243-S246 PolarHBondContact O-N 3.08Å; S246-S248 PolarHBondContact OG-N 2.82Å; S246-S248 VanDerWaalsContact OG-N 3.13Å; S246-R336 WeakPolarHBondContact O-CD 3.3Å; S246-R336 VanDerWaalsContact O-CG 3.27Å; S246-R336 WeakPolarHBondContact O-CG 3.48Å; S246-R336 PolarHBondContact O-NH1 2.92Å
247	N	94.1	Very high	93.9	Very high	66 Å²	66	44.3 Å²	44.3	35%	0.353	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79	-17.7	169.2	-82.3	-27.6	0	0	0	113.2	L249 R283 S337 D338	N247-L249 VanDerWaalsContact C-N 3.26Å; N247-L249 PolarHBondContact O-N 3.27Å; N247-R283 VanDerWaalsContact OD1-CZ 3.31Å; N247-R283 PolarHBondContact OD1-NH1 3.08Å; N247-R283 VanDerWaalsContact OD1-NH1 3.1Å; N247-R283 PolarHBondContact OD1-NH2 3.04Å; N247-S337 CarbonylContact O-C 3.59Å; N247-S337 VanDerWaalsContact O-CA 3.28Å; N247-S337 WeakPolarHBondContact O-CA 3.32Å; N247-D338 HydrophobicContact CB-CB 4.32Å; N247-D338 PolarHBondContact O-N 2.99Å
248	S	93.1	Very high	94	Very high	48 Å²	48	42.4 Å²	42.4	34%	0.336	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.7	1.7	-179.6	-51	0	0	0	0	113	S246 K250 D338	S246-S248 PolarHBondContact OG-N 2.82Å; S246-S248 VanDerWaalsContact OG-N 3.13Å; S248-K250 PolarHBondContact O-N 2.66Å; S248-D338 WeakPolarHBondContact CB-OD2 3.45Å; S248-D338 PolarHBondContact OG-OD2 2.98Å
249	L	92.2	Very high	94.1	Very high	8 Å²	8	39.9 Å²	39.9	4%	0.042	21%	0.209	C	C	.	.			trans	-69.1	122.7	173.8	-179.3	60.7	0	0	0	109.7	L220 F223 V243 N247 C252 L257	L220-L249 HydrophobicContact CD2-CB 4.15Å; L220-L249 HydrophobicContact CD2-CD1 4.33Å; F223-L249 HydrophobicContact CB-CD1 3.57Å; F223-L249 HydrophobicContact CD1-CD1 4.07Å; F223-L249 HydrophobicContact CG-CD1 4.01Å; V243-L249 HydrophobicContact CG1-CD1 3.99Å; V243-L249 HydrophobicContact CG1-CD2 4.1Å; N247-L249 VanDerWaalsContact C-N 3.26Å; N247-L249 PolarHBondContact O-N 3.27Å; L249-C252 HydrophobicContact CD2-CB 4.46Å; L249-L257 HydrophobicContact CD2-CD1 3.77Å; L249-L257 HydrophobicContact CD2-CD2 3.65Å; L249-L257 HydrophobicContact CD2-CG 4.34Å
250	K	82	Confident	94.1	Very high	94 Å²	94	39.1 Å²	39.1	41%	0.409	21%	0.207	S	C	.	.			trans	-105.1	147.9	-173.5	-65.3	178.4	-178.6	169.9	0	111.4	P224 S248 C252	P224-K250 WeakPolarHBondContact CG-O 3.39Å; S248-K250 PolarHBondContact O-N 2.66Å; K250-C252 VanDerWaalsContact C-N 3.34Å; K250-C252 PolarHBondContact O-N 3.28Å
251	Q	84.1	Confident	94.2	Very high	166 Å²	166	39 Å²	39	78%	0.776	21%	0.206	S	C	*	.	S	Bend	trans	58.2	36.5	166.2	-60.9	174.5	-33.6	0	0	115.1	P224	P224-Q251 HydrophobicContact CG-CB 3.99Å
252	C	90.4	Very high	94.1	Very high	18 Å²	18	38.7 Å²	38.7	12%	0.122	20%	0.203	C	C	.	.			trans	-128.6	129.8	172.8	-71.1	0	0	0	0	109.9	L249 K250 L257	L249-C252 HydrophobicContact CD2-CB 4.46Å; K250-C252 VanDerWaalsContact C-N 3.34Å; K250-C252 PolarHBondContact O-N 3.28Å; C252-L257 HydrophobicContact CB-CD2 3.73Å; C252-L257 HydrophobicContact CB-CG 4.12Å
253	T	92.9	Very high	94.1	Very high	71 Å²	71	40.7 Å²	40.7	44%	0.436	21%	0.208	S	C	.	.			trans	-76.5	156.4	167.9	72	0	0	0	0	110	L255 D256 L257	T253-L255 PolarHBondContact O-N 2.98Å; T253-L255 PolarHBondContact OG1-N 3.06Å; T253-D256 WeakPolarHBondContact CB-OD2 3.4Å; T253-D256 PolarHBondContact N-OD2 3.16Å; T253-D256 WeakPolarHBondContact O-CB 3.26Å; T253-D256 PolarHBondContact O-N 3.13Å; T253-D256 VanDerWaalsContact O-N 3.08Å; T253-D256 PolarHBondContact OG1-N 3.07Å; T253-D256 VanDerWaalsContact OG1-N 3.15Å; T253-D256 PolarHBondContact OG1-OD2 3.43Å; T253-L257 WeakPolarHBondContact O-CG 3.46Å; T253-L257 PolarHBondContact O-N 2.94Å; T253-L257 VanDerWaalsContact O-N 3.13Å
254	E	95.4	Very high	94.2	Very high	15 Å²	15	41 Å²	41	7%	0.07	21%	0.209	C	C	.	.	H	α-helix	trans	-60.6	-29.9	174.8	-65.4	-63.6	148.7	0	0	111.8	L257 F258 I282 R283 L286 M287 R336	E254-L257 PolarHBondContact O-N 3.39Å; E254-F258 WeakPolarHBondContact O-CB 3.29Å; E254-F258 PolarHBondContact O-N 3.43Å; E254-I282 HydrophobicContact CB-CG2 4.46Å; E254-R283 HydrophobicContact CG-CB 3.9Å; E254-R283 PolarHBondContact OE2-N 3.27Å; E254-L286 HydrophobicContact CG-CB 4.14Å; E254-L286 HydrophobicContact CG-CD1 4.13Å; E254-M287 VanDerWaalsContact C-CE 3.46Å; E254-M287 HydrophobicContact CB-CE 3.81Å; E254-M287 HydrophobicContact CB-CG 4.1Å; E254-M287 VanDerWaalsContact O-CE 3.26Å; E254-M287 WeakPolarHBondContact O-CE 3.27Å; E254-R336 IonicContact OE1-CZ 3.77Å; E254-R336 IonicContact OE1-NE 2.94Å; E254-R336 PolarHBondContact OE1-NE 2.89Å; E254-R336 IonicContact OE1-NH2 3.09Å; E254-R336 PolarHBondContact OE1-NH2 3.25Å; E254-R336 VanDerWaalsContact OE1-NH2 3.1Å; E254-R336 IonicContact OE2-NH2 3.87Å; E254-R336 PolarHBondContact OE2-NH2 3.3Å
255	L	96.3	Very high	94.1	Very high	12 Å²	12	41 Å²	41	6%	0.063	21%	0.209	C	C	.	.	H	α-helix	trans	-65.1	-41.1	175.2	-179.4	63.8	0	0	0	111.6	T253 L257 F258 K259 E291 Y295	T253-L255 PolarHBondContact O-N 2.98Å; T253-L255 PolarHBondContact OG1-N 3.06Å; L255-L257 VanDerWaalsContact C-N 3.34Å; L255-F258 HydrophobicContact CD1-CD1 4.49Å; L255-F258 PolarHBondContact O-N 3.36Å; L255-K259 HydrophobicContact CD1-CD 4.49Å; L255-K259 HydrophobicContact CG-CD 4.21Å; L255-K259 WeakPolarHBondContact O-CG 3.35Å; L255-K259 PolarHBondContact O-N 3.04Å; L255-E291 HydrophobicContact CD1-CB 4.47Å; L255-E291 HydrophobicContact CD2-CB 4.43Å; L255-E291 HydrophobicContact CD2-CG 3.91Å; L255-E291 WeakPolarHBondContact CD2-OE1 3.3Å; L255-Y295 HydrophobicContact CD1-CD2 3.88Å; L255-Y295 HydrophobicContact CD1-CG 3.96Å; L255-Y295 HydrophobicContact CD2-CD2 3.87Å; L255-Y295 HydrophobicContact CD2-CE2 4.03Å
256	D	95.3	Very high	94.1	Very high	63 Å²	63	46.2 Å²	46.2	34%	0.337	22%	0.22	S	C	.	.	H	α-helix	trans	-64.1	-42.9	176.5	-59.9	-42.9	0	0	0	110.9	M227 T253 F258 K259 A260	M227-D256 HydrophobicContact CE-CB 4.44Å; T253-D256 WeakPolarHBondContact CB-OD2 3.4Å; T253-D256 PolarHBondContact N-OD2 3.16Å; T253-D256 WeakPolarHBondContact O-CB 3.26Å; T253-D256 PolarHBondContact O-N 3.13Å; T253-D256 VanDerWaalsContact O-N 3.08Å; T253-D256 PolarHBondContact OG1-N 3.07Å; T253-D256 VanDerWaalsContact OG1-N 3.15Å; T253-D256 PolarHBondContact OG1-OD2 3.43Å; D256-F258 VanDerWaalsContact C-N 3.33Å; D256-F258 PolarHBondContact O-N 2.71Å; D256-K259 PolarHBondContact O-N 3.19Å; D256-A260 VanDerWaalsContact O-CB 3.27Å; D256-A260 WeakPolarHBondContact O-CB 3.35Å; D256-A260 PolarHBondContact O-N 3.39Å
257	L	96.7	Very high	93.9	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-62.2	-41.1	175.8	-60	-177.3	0	0	0	111.8	F223 L244 L249 C252 T253 E254 L255 A260 T261	F223-L257 HydrophobicContact CD1-CD2 4.17Å; F223-L257 HydrophobicContact CE1-CD2 3.82Å; L244-L257 HydrophobicContact CD2-CB 3.86Å; L244-L257 HydrophobicContact CD2-CD1 4.37Å; L244-L257 HydrophobicContact CD2-CD2 4.2Å; L244-L257 HydrophobicContact CD2-CG 4.35Å; L249-L257 HydrophobicContact CD2-CD1 3.77Å; L249-L257 HydrophobicContact CD2-CD2 3.65Å; L249-L257 HydrophobicContact CD2-CG 4.34Å; C252-L257 HydrophobicContact CB-CD2 3.73Å; C252-L257 HydrophobicContact CB-CG 4.12Å; T253-L257 WeakPolarHBondContact O-CG 3.46Å; T253-L257 PolarHBondContact O-N 2.94Å; T253-L257 VanDerWaalsContact O-N 3.13Å; E254-L257 PolarHBondContact O-N 3.39Å; L255-L257 VanDerWaalsContact C-N 3.34Å; L257-A260 PolarHBondContact O-N 3.47Å; L257-T261 VanDerWaalsContact O-CB 3.29Å; L257-T261 WeakPolarHBondContact O-CB 3.5Å; L257-T261 PolarHBondContact O-N 2.8Å; L257-T261 PolarHBondContact O-OG1 3Å
258	F	97.9	Very high	93.7	Very high	4 Å²	4	51 Å²	51	2%	0.018	24%	0.241	C	C	.	.	H	α-helix	trans	-62.2	-49	174.9	173.6	-103.2	0	0	0	112.3	E254 L255 D256 A260 T261 C262 M279 I282 F284 M287 V296 V299 M302	E254-F258 WeakPolarHBondContact O-CB 3.29Å; E254-F258 PolarHBondContact O-N 3.43Å; L255-F258 HydrophobicContact CD1-CD1 4.49Å; L255-F258 PolarHBondContact O-N 3.36Å; D256-F258 VanDerWaalsContact C-N 3.33Å; D256-F258 PolarHBondContact O-N 2.71Å; F258-A260 PolarHBondContact O-N 2.75Å; F258-T261 PolarHBondContact O-N 3.13Å; F258-C262 VanDerWaalsContact CZ-SG 3.59Å; F258-C262 PolarHBondContact O-N 3.41Å; F258-C262 PolarHBondContact O-SG 3.41Å; F258-M279 HydrophobicContact CD2-CE 3.86Å; F258-M279 HydrophobicContact CD2-SD 3.78Å; F258-M279 HydrophobicContact CE2-CE 3.68Å; F258-M279 HydrophobicContact CE2-SD 3.93Å; F258-I282 VanDerWaalsContact CA-CD1 3.49Å; F258-I282 HydrophobicContact CB-CD1 3.97Å; F258-I282 HydrophobicContact CB-CG2 4.38Å; F258-I282 HydrophobicContact CD2-CD1 4.17Å; F258-F284 AromaticContact CD2-CE1 3.65Å; F258-F284 HydrophobicContact CD2-CE1 3.65Å; F258-F284 AromaticContact CD2-CZ 3.9Å; F258-F284 HydrophobicContact CD2-CZ 3.9Å; F258-F284 HydrophobicContact CE2-CE1 4.06Å; F258-F284 HydrophobicContact CE2-CZ 4.25Å; F258-F284 HydrophobicContact CG-CE1 4.29Å; F258-M287 HydrophobicContact CB-CE 3.81Å; F258-M287 HydrophobicContact CG-CE 4.43Å; F258-V296 HydrophobicContact CD1-CG2 3.99Å; F258-V296 HydrophobicContact CD2-CG1 4.45Å; F258-V296 HydrophobicContact CE1-CB 4.19Å; F258-V296 HydrophobicContact CE1-CG1 4.29Å; F258-V296 HydrophobicContact CE1-CG2 3.93Å; F258-V296 HydrophobicContact CE2-CG1 3.85Å; F258-V296 HydrophobicContact CG-CG2 4.35Å; F258-V296 HydrophobicContact CZ-CB 4.12Å; F258-V296 HydrophobicContact CZ-CG1 3.75Å; F258-V296 HydrophobicContact CZ-CG2 4.23Å; F258-V299 HydrophobicContact CE1-CG2 4.09Å; F258-V299 HydrophobicContact CZ-CB 4.21Å; F258-V299 HydrophobicContact CZ-CG2 3.72Å; F258-M302 HydrophobicContact CE2-CG 4.05Å; F258-M302 HydrophobicContact CE2-SD 3.98Å; F258-M302 HydrophobicContact CZ-CG 4.17Å
259	K	96.4	Very high	93.4	Very high	80 Å²	80	56.6 Å²	56.6	35%	0.348	26%	0.262	S	S	.	.	H	α-helix	trans	-60.9	-45	176.9	-72.9	171.3	179	169.1	0	111.2	L255 D256 C262 R263	L255-K259 HydrophobicContact CD1-CD 4.49Å; L255-K259 HydrophobicContact CG-CD 4.21Å; L255-K259 WeakPolarHBondContact O-CG 3.35Å; L255-K259 PolarHBondContact O-N 3.04Å; D256-K259 PolarHBondContact O-N 3.19Å; K259-C262 PolarHBondContact O-N 3.35Å; K259-R263 WeakPolarHBondContact O-CG 3.4Å; K259-R263 PolarHBondContact O-N 3.43Å
260	A	95.9	Very high	93.4	Very high	2 Å²	2	60.5 Å²	60.5	2%	0.017	29%	0.288	C	S	.	.	H	α-helix	trans	-61.6	-44.6	177.7	0	0	0	0	0	112	M227 F232 D256 L257 F258 C262 R263 W264	M227-A260 HydrophobicContact CG-CB 4.45Å; M227-A260 HydrophobicContact SD-CB 3.59Å; M227-A260 VanDerWaalsContact SD-CB 3.59Å; F232-A260 HydrophobicContact CE2-CB 4.28Å; D256-A260 VanDerWaalsContact O-CB 3.27Å; D256-A260 WeakPolarHBondContact O-CB 3.35Å; D256-A260 PolarHBondContact O-N 3.39Å; L257-A260 PolarHBondContact O-N 3.47Å; F258-A260 PolarHBondContact O-N 2.75Å; A260-C262 PolarHBondContact O-N 2.79Å; A260-R263 PolarHBondContact O-N 3.42Å; A260-W264 PolarHBondContact O-N 3.29Å
261	T	97.2	Very high	94	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-61.6	-44	176.6	-56.9	0	0	0	0	111.1	L244 L257 F258 R263 W264 L265 L278 M279	L244-T261 HydrophobicContact CD1-CG2 4.28Å; L244-T261 WeakPolarHBondContact CD1-OG1 3.43Å; L257-T261 VanDerWaalsContact O-CB 3.29Å; L257-T261 WeakPolarHBondContact O-CB 3.5Å; L257-T261 PolarHBondContact O-N 2.8Å; L257-T261 PolarHBondContact O-OG1 3Å; F258-T261 PolarHBondContact O-N 3.13Å; T261-R263 VanDerWaalsContact C-N 3.32Å; T261-R263 PolarHBondContact O-N 3.18Å; T261-W264 PolarHBondContact O-N 2.83Å; T261-L265 HydrophobicContact CG2-CD1 3.95Å; T261-L265 HydrophobicContact CG2-CG 4.33Å; T261-L265 VanDerWaalsContact O-CB 3.32Å; T261-L265 WeakPolarHBondContact O-CB 3.35Å; T261-L265 VanDerWaalsContact O-CG 3.24Å; T261-L265 WeakPolarHBondContact O-CG 3.28Å; T261-L265 PolarHBondContact O-N 3Å; T261-L278 HydrophobicContact CG2-CB 3.75Å; T261-L278 HydrophobicContact CG2-CD1 3.97Å; T261-L278 HydrophobicContact CG2-CG 4.49Å; T261-M279 HydrophobicContact CG2-CE 3.93Å; T261-M279 HydrophobicContact CG2-SD 4.38Å
262	C	96.6	Very high	94.5	Very high	8 Å²	8	52.2 Å²	52.2	5%	0.054	25%	0.25	C	S	.	.	H	α-helix	trans	-60.4	-40	174.8	-69.4	0	0	0	0	112.4	F258 K259 A260 R266	F258-C262 VanDerWaalsContact CZ-SG 3.59Å; F258-C262 PolarHBondContact O-N 3.41Å; F258-C262 PolarHBondContact O-SG 3.41Å; K259-C262 PolarHBondContact O-N 3.35Å; A260-C262 PolarHBondContact O-N 2.79Å; C262-R266 WeakPolarHBondContact O-CB 3.3Å; C262-R266 VanDerWaalsContact O-CG 3.27Å; C262-R266 WeakPolarHBondContact O-CG 3.48Å; C262-R266 PolarHBondContact O-N 3.36Å
263	R	95.8	Very high	94.7	Very high	125 Å²	125	57.7 Å²	57.7	47%	0.472	28%	0.278	S	S	.	.	H	α-helix	trans	-64.5	-43.8	175.2	-70	-170.7	-59.1	-177.9	7	112	F232 L233 K259 A260 T261 L265 R266	F232-R263 HydrophobicContact CZ-CB 4.16Å; L233-R263 HydrophobicContact CD2-CB 4.23Å; K259-R263 WeakPolarHBondContact O-CG 3.4Å; K259-R263 PolarHBondContact O-N 3.43Å; A260-R263 PolarHBondContact O-N 3.42Å; T261-R263 VanDerWaalsContact C-N 3.32Å; T261-R263 PolarHBondContact O-N 3.18Å; R263-L265 VanDerWaalsContact C-N 3.35Å; R263-R266 PolarHBondContact O-N 3.38Å
264	W	96.8	Very high	94.9	Very high	6 Å²	6	57.4 Å²	57.4	2%	0.023	27%	0.271	C	S	.	.	H	α-helix	trans	-63.6	-41.3	178.1	-177.4	96.3	0	0	0	112.3	F232 L233 L235 F237 L240 A260 T261 R271 F274 L278	F232-W264 HydrophobicContact CE2-CB 4.42Å; L233-W264 HydrophobicContact CD2-CB 4.39Å; L235-W264 PolarHBondContact O-NE1 3.17Å; F237-W264 HydrophobicContact CB-CH2 4.18Å; L240-W264 HydrophobicContact CD2-CB 3.94Å; L240-W264 HydrophobicContact CD2-CD2 3.49Å; L240-W264 VanDerWaalsContact CD2-CD2 3.49Å; L240-W264 HydrophobicContact CD2-CE3 3.93Å; L240-W264 HydrophobicContact CD2-CG 3.48Å; L240-W264 VanDerWaalsContact CD2-CG 3.48Å; A260-W264 PolarHBondContact O-N 3.29Å; T261-W264 PolarHBondContact O-N 2.83Å; W264-R271 VanDerWaalsContact CE2-NH1 3.3Å; W264-R271 HydrophobicContact CE3-CB 4.31Å; W264-R271 HydrophobicContact CE3-CG 4.48Å; W264-R271 HydrophobicContact CH2-CB 4.21Å; W264-R271 HydrophobicContact CH2-CG 3.84Å; W264-R271 HydrophobicContact CZ2-CG 4.42Å; W264-R271 HydrophobicContact CZ3-CB 3.76Å; W264-R271 HydrophobicContact CZ3-CG 3.87Å; W264-R271 VanDerWaalsContact NE1-NH1 3.19Å; W264-R271 WeakPolarHBondContact O-CD 3.43Å; W264-R271 PolarHBondContact O-NH1 2.93Å; W264-F274 HydrophobicContact CH2-CD2 4.11Å; W264-F274 HydrophobicContact CZ3-CB 4.47Å; W264-F274 HydrophobicContact CZ3-CD2 4.31Å; W264-L278 HydrophobicContact CE3-CD1 3.74Å; W264-L278 HydrophobicContact CZ3-CD1 3.66Å
265	L	96.4	Very high	94.9	Very high	0 Å²	0	57 Å²	57	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-62.4	-49.1	177.4	-78.5	173	0	0	0	110.8	T261 R263 L267 R271 M272 A275 L278 M279 F301	T261-L265 HydrophobicContact CG2-CD1 3.95Å; T261-L265 HydrophobicContact CG2-CG 4.33Å; T261-L265 VanDerWaalsContact O-CB 3.32Å; T261-L265 WeakPolarHBondContact O-CB 3.35Å; T261-L265 VanDerWaalsContact O-CG 3.24Å; T261-L265 WeakPolarHBondContact O-CG 3.28Å; T261-L265 PolarHBondContact O-N 3Å; R263-L265 VanDerWaalsContact C-N 3.35Å; L265-L267 PolarHBondContact O-N 2.8Å; L265-L267 VanDerWaalsContact O-N 3.11Å; L265-R271 HydrophobicContact CD2-CB 4.34Å; L265-R271 WeakPolarHBondContact CD2-O 3.47Å; L265-M272 HydrophobicContact CB-CE 3.43Å; L265-M272 VanDerWaalsContact CB-CE 3.43Å; L265-M272 HydrophobicContact CD2-CE 4.35Å; L265-M272 HydrophobicContact CG-CE 4.43Å; L265-M272 WeakPolarHBondContact O-CE 3.21Å; L265-A275 HydrophobicContact CD1-CB 3.92Å; L265-A275 HydrophobicContact CD2-CB 4.19Å; L265-L278 HydrophobicContact CD2-CD1 4.08Å; L265-L278 HydrophobicContact CG-CD1 4.37Å; L265-M279 HydrophobicContact CD1-CE 3.96Å; L265-F301 HydrophobicContact CD1-CE1 4.44Å; L265-F301 HydrophobicContact CD1-CZ 3.94Å
266	R	94.2	Very high	94.9	Very high	169 Å²	169	57.4 Å²	57.4	64%	0.638	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-6.5	-175.6	-70.6	175.4	-171	-176.3	2.5	115.1	C262 R263	C262-R266 WeakPolarHBondContact O-CB 3.3Å; C262-R266 VanDerWaalsContact O-CG 3.27Å; C262-R266 WeakPolarHBondContact O-CG 3.48Å; C262-R266 PolarHBondContact O-N 3.36Å; R263-R266 PolarHBondContact O-N 3.38Å
267	L	92.6	Very high	95	Very high	90 Å²	90	60 Å²	60	47%	0.471	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-38.6	-178.5	-170.4	70.6	0	0	0	112.2	L233 L265	L233-L267 HydrophobicContact CB-CD2 4.06Å; L265-L267 PolarHBondContact O-N 2.8Å; L265-L267 VanDerWaalsContact O-N 3.11Å
268	E	89.9	Confident	95.1	Very high	91 Å²	91	60 Å²	60	43%	0.425	28%	0.284	S	S	.	.	S	Bend	trans	-140.3	129	-175.5	-66.4	166.2	-164.3	0	0	109.1	P270 R271	E268-P270 VanDerWaalsContact C-CD 3.41Å; E268-R271 HydrophobicContact CB-CG 3.99Å; E268-R271 VanDerWaalsContact O-CB 3.3Å; E268-R271 WeakPolarHBondContact O-CB 3.42Å; E268-R271 PolarHBondContact O-N 2.93Å; E268-R271 IonicContact OE1-CZ 3.05Å; E268-R271 IonicContact OE1-NE 2.88Å; E268-R271 IonicContact OE1-NH2 2.79Å; E268-R271 PolarHBondContact OE1-NH2 3.42Å; E268-R271 IonicContact OE2-CZ 2.68Å; E268-R271 IonicContact OE2-NE 3.63Å; E268-R271 PolarHBondContact OE2-NE 2.68Å; E268-R271 IonicContact OE2-NH2 2.91Å; E268-R271 PolarHBondContact OE2-NH2 3.15Å
269	E	85.6	Confident	95	Very high	166 Å²	166	59.9 Å²	59.9	78%	0.776	28%	0.283	S	S	*	.	G	3₁₀ helix	trans	-49	-45	-179.8	-72.9	-72	164.2	0	0	114.2	R271 M272	E269-R271 PolarHBondContact O-N 3.27Å; E269-M272 PolarHBondContact O-N 2.93Å; E269-M272 VanDerWaalsContact O-N 3.11Å
270	P	93.5	Very high	95.1	Very high	91 Å²	91	61.1 Å²	61.1	59%	0.591	29%	0.288	S	S	*	.	G	3₁₀ helix	trans	-61.6	-19.1	179.4	-23.2	34.9	0	0	0	114.1	E268 M272 D273	E268-P270 VanDerWaalsContact C-CD 3.41Å; P270-M272 PolarHBondContact O-N 3.19Å; P270-D273 PolarHBondContact O-N 3.21Å
271	R	94.8	Very high	95.2	Very high	24 Å²	24	63.2 Å²	63.2	9%	0.091	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-70.8	-19.4	179.9	-65.5	177.7	-173.8	-161.5	1.1	112.4	L233 W264 L265 E268 E269 D273 F274	L233-R271 PolarHBondContact O-NH1 3.48Å; W264-R271 VanDerWaalsContact CE2-NH1 3.3Å; W264-R271 HydrophobicContact CE3-CB 4.31Å; W264-R271 HydrophobicContact CE3-CG 4.48Å; W264-R271 HydrophobicContact CH2-CB 4.21Å; W264-R271 HydrophobicContact CH2-CG 3.84Å; W264-R271 HydrophobicContact CZ2-CG 4.42Å; W264-R271 HydrophobicContact CZ3-CB 3.76Å; W264-R271 HydrophobicContact CZ3-CG 3.87Å; W264-R271 VanDerWaalsContact NE1-NH1 3.19Å; W264-R271 WeakPolarHBondContact O-CD 3.43Å; W264-R271 PolarHBondContact O-NH1 2.93Å; L265-R271 HydrophobicContact CD2-CB 4.34Å; L265-R271 WeakPolarHBondContact CD2-O 3.47Å; E268-R271 HydrophobicContact CB-CG 3.99Å; E268-R271 VanDerWaalsContact O-CB 3.3Å; E268-R271 WeakPolarHBondContact O-CB 3.42Å; E268-R271 PolarHBondContact O-N 2.93Å; E268-R271 IonicContact OE1-CZ 3.05Å; E268-R271 IonicContact OE1-NE 2.88Å; E268-R271 IonicContact OE1-NH2 2.79Å; E268-R271 PolarHBondContact OE1-NH2 3.42Å; E268-R271 IonicContact OE2-CZ 2.68Å; E268-R271 IonicContact OE2-NE 3.63Å; E268-R271 PolarHBondContact OE2-NE 2.68Å; E268-R271 IonicContact OE2-NH2 2.91Å; E268-R271 PolarHBondContact OE2-NH2 3.15Å; E269-R271 PolarHBondContact O-N 3.27Å; R271-D273 PolarHBondContact O-N 3.01Å; R271-F274 HydrophobicContact CB-CD2 4.47Å; R271-F274 WeakPolarHBondContact O-CB 3.44Å; R271-F274 PolarHBondContact O-N 3.46Å
272	M	94.4	Very high	95.2	Very high	62 Å²	62	63.2 Å²	63.2	31%	0.305	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-56.9	-30.7	175.9	-75.1	-48.1	103.9	0	0	112.9	L265 E269 P270 F274 A275	L265-M272 HydrophobicContact CB-CE 3.43Å; L265-M272 VanDerWaalsContact CB-CE 3.43Å; L265-M272 HydrophobicContact CD2-CE 4.35Å; L265-M272 HydrophobicContact CG-CE 4.43Å; L265-M272 WeakPolarHBondContact O-CE 3.21Å; E269-M272 PolarHBondContact O-N 2.93Å; E269-M272 VanDerWaalsContact O-N 3.11Å; P270-M272 PolarHBondContact O-N 3.19Å; M272-F274 PolarHBondContact O-N 3.42Å; M272-F274 VanDerWaalsContact O-N 3.1Å; M272-A275 WeakPolarHBondContact O-CB 3.47Å; M272-A275 PolarHBondContact O-N 3.37Å
273	D	94.1	Very high	95.2	Very high	132 Å²	132	63.6 Å²	63.6	71%	0.706	30%	0.3	S	S	*	.	G	3₁₀ helix	trans	-62.2	-20.4	177.1	-66.3	-18.9	0	0	0	112.7	P270 R271	P270-D273 PolarHBondContact O-N 3.21Å; R271-D273 PolarHBondContact O-N 3.01Å
274	F	96.2	Very high	95.3	Very high	65 Å²	65	57.7 Å²	57.7	29%	0.285	28%	0.277	S	S	.	.	G	3₁₀ helix	trans	-91.1	-6.3	176.2	-56	-60.4	0	0	0	113.8	F237 W264 R271 M272 A276 K277 L278	F237-F274 HydrophobicContact CD1-CD1 4.5Å; F237-F274 HydrophobicContact CD2-CB 3.72Å; F237-F274 AromaticContact CD2-CD1 3.69Å; F237-F274 HydrophobicContact CD2-CD1 3.69Å; F237-F274 HydrophobicContact CD2-CD2 4.3Å; F237-F274 HydrophobicContact CD2-CE1 4.41Å; F237-F274 AromaticContact CD2-CG 3.64Å; F237-F274 HydrophobicContact CD2-CG 3.64Å; F237-F274 HydrophobicContact CE2-CB 3.83Å; F237-F274 AromaticContact CE2-CD1 3.82Å; F237-F274 HydrophobicContact CE2-CD1 3.82Å; F237-F274 HydrophobicContact CE2-CG 4.02Å; F237-F274 HydrophobicContact CG-CD1 4.06Å; F237-F274 HydrophobicContact CG-CE1 4.34Å; F237-F274 HydrophobicContact CG-CG 4.25Å; F237-F274 HydrophobicContact CZ-CD1 4.3Å; W264-F274 HydrophobicContact CH2-CD2 4.11Å; W264-F274 HydrophobicContact CZ3-CB 4.47Å; W264-F274 HydrophobicContact CZ3-CD2 4.31Å; R271-F274 HydrophobicContact CB-CD2 4.47Å; R271-F274 WeakPolarHBondContact O-CB 3.44Å; R271-F274 PolarHBondContact O-N 3.46Å; M272-F274 PolarHBondContact O-N 3.42Å; M272-F274 VanDerWaalsContact O-N 3.1Å; F274-A276 PolarHBondContact O-N 3.11Å; F274-K277 HydrophobicContact CD1-CD 4.4Å; F274-K277 WeakPolarHBondContact O-CB 3.17Å; F274-K277 PolarHBondContact O-N 3.25Å; F274-L278 HydrophobicContact CB-CD1 4.38Å; F274-L278 HydrophobicContact CB-CG 4.48Å; F274-L278 PolarHBondContact O-N 3.48Å
275	A	96.4	Very high	95.3	Very high	7 Å²	7	57.4 Å²	57.4	6%	0.058	28%	0.276	C	S	.	.	H	α-helix	trans	-54.2	-55.5	-172.9	0	0	0	0	0	112.1	L265 M272 K277 L278 M279 F301	L265-A275 HydrophobicContact CD1-CB 3.92Å; L265-A275 HydrophobicContact CD2-CB 4.19Å; M272-A275 WeakPolarHBondContact O-CB 3.47Å; M272-A275 PolarHBondContact O-N 3.37Å; A275-K277 PolarHBondContact O-N 2.92Å; A275-L278 PolarHBondContact O-N 3.33Å; A275-M279 WeakPolarHBondContact O-CB 3.49Å; A275-M279 VanDerWaalsContact O-CG 3.24Å; A275-M279 WeakPolarHBondContact O-CG 3.36Å; A275-M279 PolarHBondContact O-N 3.33Å; A275-F301 HydrophobicContact CB-CD2 4.05Å; A275-F301 HydrophobicContact CB-CE2 4.06Å; A275-F301 HydrophobicContact CB-CG 4.47Å; A275-F301 HydrophobicContact CB-CZ 4.48Å
276	A	96.7	Very high	95.2	Very high	21 Å²	21	58.3 Å²	58.3	17%	0.174	28%	0.281	C	S	.	.	H	α-helix	trans	-59.9	-33	178.9	0	0	0	0	0	113.2	F274 K280 T307	F274-A276 PolarHBondContact O-N 3.11Å; A276-K280 WeakPolarHBondContact O-CG 3.48Å; A276-K280 PolarHBondContact O-N 3.17Å; A276-T307 HydrophobicContact CB-CG2 4.29Å
277	K	97.3	Very high	95.3	Very high	118 Å²	118	50.4 Å²	50.4	51%	0.513	25%	0.251	S	S	.	.	H	α-helix	trans	-72.7	-41.7	179.4	-66.3	177.3	-177.1	169.7	0	111.7	F237 F274 A275 N281	F237-K277 HydrophobicContact CE2-CB 4.04Å; F237-K277 HydrophobicContact CZ-CB 4.01Å; F237-K277 HydrophobicContact CZ-CD 4.07Å; F274-K277 HydrophobicContact CD1-CD 4.4Å; F274-K277 WeakPolarHBondContact O-CB 3.17Å; F274-K277 PolarHBondContact O-N 3.25Å; A275-K277 PolarHBondContact O-N 2.92Å; K277-N281 PolarHBondContact O-ND2 3.4Å
278	L	97.8	Very high	95.3	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-72.7	-40.9	177.8	-66.5	175.5	0	0	0	111.7	F237 L240 A241 L244 T261 W264 L265 F274 A275 K280 N281	F237-L278 HydrophobicContact CD2-CD1 4.43Å; F237-L278 HydrophobicContact CD2-CD2 3.82Å; F237-L278 HydrophobicContact CD2-CG 4.11Å; F237-L278 HydrophobicContact CE2-CD2 3.63Å; F237-L278 HydrophobicContact CE2-CG 3.87Å; L240-L278 HydrophobicContact CD2-CD1 3.96Å; L240-L278 HydrophobicContact CD2-CD2 4.42Å; L240-L278 HydrophobicContact CG-CD2 4.32Å; A241-L278 HydrophobicContact CB-CD2 3.91Å; L244-L278 HydrophobicContact CD1-CB 4.22Å; L244-L278 HydrophobicContact CD1-CD2 4.07Å; T261-L278 HydrophobicContact CG2-CB 3.75Å; T261-L278 HydrophobicContact CG2-CD1 3.97Å; T261-L278 HydrophobicContact CG2-CG 4.49Å; W264-L278 HydrophobicContact CE3-CD1 3.74Å; W264-L278 HydrophobicContact CZ3-CD1 3.66Å; L265-L278 HydrophobicContact CD2-CD1 4.08Å; L265-L278 HydrophobicContact CG-CD1 4.37Å; F274-L278 HydrophobicContact CB-CD1 4.38Å; F274-L278 HydrophobicContact CB-CG 4.48Å; F274-L278 PolarHBondContact O-N 3.48Å; A275-L278 PolarHBondContact O-N 3.33Å; L278-K280 PolarHBondContact O-N 3.18Å; L278-N281 WeakPolarHBondContact O-CB 3.5Å; L278-N281 PolarHBondContact O-N 2.64Å
279	M	97.5	Very high	95.5	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-62.8	-29.4	-178.7	-69.2	-51.6	171.7	0	0	113.1	F258 T261 L265 A275 N281 I282 F284 F301 M302 L311	F258-M279 HydrophobicContact CD2-CE 3.86Å; F258-M279 HydrophobicContact CD2-SD 3.78Å; F258-M279 HydrophobicContact CE2-CE 3.68Å; F258-M279 HydrophobicContact CE2-SD 3.93Å; T261-M279 HydrophobicContact CG2-CE 3.93Å; T261-M279 HydrophobicContact CG2-SD 4.38Å; L265-M279 HydrophobicContact CD1-CE 3.96Å; A275-M279 WeakPolarHBondContact O-CB 3.49Å; A275-M279 VanDerWaalsContact O-CG 3.24Å; A275-M279 WeakPolarHBondContact O-CG 3.36Å; A275-M279 PolarHBondContact O-N 3.33Å; M279-N281 PolarHBondContact O-N 3.47Å; M279-N281 VanDerWaalsContact O-N 3.15Å; M279-I282 PolarHBondContact O-N 2.99Å; M279-I282 HydrophobicContact SD-CD1 3.63Å; M279-I282 HydrophobicContact SD-CG1 4.47Å; M279-F284 HydrophobicContact CB-CE2 4.28Å; M279-F284 HydrophobicContact CB-CZ 4.42Å; M279-F284 WeakPolarHBondContact O-CE2 3.38Å; M279-F284 HydrophobicContact SD-CZ 3.91Å; M279-F301 HydrophobicContact CE-CE2 3.51Å; M279-F301 HydrophobicContact CE-CZ 3.43Å; M279-F301 VanDerWaalsContact CE-CZ 3.43Å; M279-F301 HydrophobicContact CG-CE2 4.04Å; M279-M302 HydrophobicContact CE-SD 4.42Å; M279-M302 HydrophobicContact CG-SD 3.94Å; M279-M302 HydrophobicContact SD-SD 4.2Å; M279-L311 HydrophobicContact CB-CD1 3.9Å
280	K	96.8	Very high	96	Very high	106 Å²	106	46.2 Å²	46.2	46%	0.461	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-25.3	173.1	-77.2	177	-172.3	-171.9	0	113.8	A276 L278 I282 T307 L311	A276-K280 WeakPolarHBondContact O-CG 3.48Å; A276-K280 PolarHBondContact O-N 3.17Å; L278-K280 PolarHBondContact O-N 3.18Å; K280-I282 VanDerWaalsContact C-N 3.33Å; K280-T307 HydrophobicContact CD-CG2 4.32Å; K280-T307 HydrophobicContact CG-CG2 4.07Å; K280-L311 HydrophobicContact CG-CD1 4.38Å
281	N	97.8	Very high	96.1	Very high	46 Å²	46	44.1 Å²	44.1	25%	0.246	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.8	-8.2	-179.8	-59.4	-40.6	0	0	0	112.7	L244 K277 L278 M279 R336	L244-N281 HydrophobicContact CB-CB 3.65Å; K277-N281 PolarHBondContact O-ND2 3.4Å; L278-N281 WeakPolarHBondContact O-CB 3.5Å; L278-N281 PolarHBondContact O-N 2.64Å; M279-N281 PolarHBondContact O-N 3.47Å; M279-N281 VanDerWaalsContact O-N 3.15Å; N281-R336 PolarHBondContact O-NH2 2.72Å
282	I	97.6	Very high	96.2	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.218	C	C	.	.	S	Bend	trans	-90.9	133.4	177.4	-54.4	-169.6	0	0	0	109.7	E254 F258 M279 K280 F284 M287	E254-I282 HydrophobicContact CB-CG2 4.46Å; F258-I282 VanDerWaalsContact CA-CD1 3.49Å; F258-I282 HydrophobicContact CB-CD1 3.97Å; F258-I282 HydrophobicContact CB-CG2 4.38Å; F258-I282 HydrophobicContact CD2-CD1 4.17Å; M279-I282 PolarHBondContact O-N 2.99Å; M279-I282 HydrophobicContact SD-CD1 3.63Å; M279-I282 HydrophobicContact SD-CG1 4.47Å; K280-I282 VanDerWaalsContact C-N 3.33Å; I282-F284 VanDerWaalsContact C-N 3.35Å; I282-F284 HydrophobicContact CB-CD2 4.34Å; I282-F284 HydrophobicContact CB-CE2 3.86Å; I282-F284 HydrophobicContact CB-CZ 3.97Å; I282-F284 HydrophobicContact CD1-CZ 4.5Å; I282-F284 HydrophobicContact CG2-CD1 4.22Å; I282-F284 HydrophobicContact CG2-CD2 4.34Å; I282-F284 HydrophobicContact CG2-CE1 3.97Å; I282-F284 HydrophobicContact CG2-CE2 4.11Å; I282-F284 HydrophobicContact CG2-CG 4.4Å; I282-F284 HydrophobicContact CG2-CZ 3.92Å; I282-F284 WeakPolarHBondContact O-CD2 3.48Å; I282-F284 PolarHBondContact O-N 2.86Å; I282-M287 HydrophobicContact CG2-CE 3.74Å
283	R	97	Very high	96.3	Very high	17 Å²	17	44.5 Å²	44.5	6%	0.064	23%	0.225	C	C	.	.			trans	-92.9	66.5	-175.3	-56.2	-173.2	-173.2	177	5.4	110.6	N247 E254 P285 L286 D331 R332 A334 I335 R336	N247-R283 VanDerWaalsContact OD1-CZ 3.31Å; N247-R283 PolarHBondContact OD1-NH1 3.08Å; N247-R283 VanDerWaalsContact OD1-NH1 3.1Å; N247-R283 PolarHBondContact OD1-NH2 3.04Å; E254-R283 HydrophobicContact CG-CB 3.9Å; E254-R283 PolarHBondContact OE2-N 3.27Å; R283-P285 VanDerWaalsContact C-N 3.25Å; R283-P285 VanDerWaalsContact O-N 3.15Å; R283-L286 HydrophobicContact CB-CD1 3.7Å; R283-L286 HydrophobicContact CB-CG 3.89Å; R283-L286 HydrophobicContact CG-CD1 4.43Å; R283-L286 WeakPolarHBondContact O-CB 3.42Å; R283-L286 PolarHBondContact O-N 2.83Å; R283-D331 PolarHBondContact NE-O 3.13Å; R283-R332 VanDerWaalsContact CB-O 3.28Å; R283-R332 WeakPolarHBondContact CB-O 3.45Å; R283-A334 VanDerWaalsContact CD-O 3.3Å; R283-A334 WeakPolarHBondContact CD-O 3.35Å; R283-A334 PolarHBondContact NH1-O 3.18Å; R283-I335 PolarHBondContact NH1-O 2.96Å; R283-R336 VanDerWaalsContact NH1-N 3.2Å
284	F	97.6	Very high	96.4	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-49.7	-36.2	178.6	-63.1	-76.3	0	0	0	114.6	F258 M279 I282 L286 M287 L292 V296 M302 L311 A315	F258-F284 AromaticContact CD2-CE1 3.65Å; F258-F284 HydrophobicContact CD2-CE1 3.65Å; F258-F284 AromaticContact CD2-CZ 3.9Å; F258-F284 HydrophobicContact CD2-CZ 3.9Å; F258-F284 HydrophobicContact CE2-CE1 4.06Å; F258-F284 HydrophobicContact CE2-CZ 4.25Å; F258-F284 HydrophobicContact CG-CE1 4.29Å; M279-F284 HydrophobicContact CB-CE2 4.28Å; M279-F284 HydrophobicContact CB-CZ 4.42Å; M279-F284 WeakPolarHBondContact O-CE2 3.38Å; M279-F284 HydrophobicContact SD-CZ 3.91Å; I282-F284 VanDerWaalsContact C-N 3.35Å; I282-F284 HydrophobicContact CB-CD2 4.34Å; I282-F284 HydrophobicContact CB-CE2 3.86Å; I282-F284 HydrophobicContact CB-CZ 3.97Å; I282-F284 HydrophobicContact CD1-CZ 4.5Å; I282-F284 HydrophobicContact CG2-CD1 4.22Å; I282-F284 HydrophobicContact CG2-CD2 4.34Å; I282-F284 HydrophobicContact CG2-CE1 3.97Å; I282-F284 HydrophobicContact CG2-CE2 4.11Å; I282-F284 HydrophobicContact CG2-CG 4.4Å; I282-F284 HydrophobicContact CG2-CZ 3.92Å; I282-F284 WeakPolarHBondContact O-CD2 3.48Å; I282-F284 PolarHBondContact O-N 2.86Å; F284-L286 PolarHBondContact O-N 2.89Å; F284-M287 HydrophobicContact CD1-CE 3.64Å; F284-M287 HydrophobicContact CD1-SD 3.8Å; F284-M287 HydrophobicContact CE1-CE 3.92Å; F284-M287 HydrophobicContact CE1-SD 4.45Å; F284-M287 WeakPolarHBondContact O-CB 3.32Å; F284-M287 PolarHBondContact O-N 3.19Å; F284-L292 HydrophobicContact CB-CD2 4.2Å; F284-L292 HydrophobicContact CD1-CD2 4.26Å; F284-V296 HydrophobicContact CD1-CG1 3.98Å; F284-V296 HydrophobicContact CD1-CG2 4.26Å; F284-V296 HydrophobicContact CE1-CG1 3.56Å; F284-V296 HydrophobicContact CE1-CG2 4.18Å; F284-V296 HydrophobicContact CZ-CG1 4.45Å; F284-M302 HydrophobicContact CE1-CE 4.03Å; F284-M302 HydrophobicContact CE2-CE 4.12Å; F284-M302 HydrophobicContact CZ-CE 3.63Å; F284-M302 HydrophobicContact CZ-SD 4.37Å; F284-L311 HydrophobicContact CD2-CB 3.96Å; F284-L311 HydrophobicContact CD2-CD1 4.47Å; F284-L311 HydrophobicContact CE2-CB 4.17Å; F284-L311 HydrophobicContact CE2-CD1 4.03Å; F284-A315 HydrophobicContact CB-CB 3.62Å
285	P	96.8	Very high	96.4	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-59.3	-15.5	174.4	-26.7	36.1	0	0	0	115.5	R283 E314 A315 Y318 Q319 T333	R283-P285 VanDerWaalsContact C-N 3.25Å; R283-P285 VanDerWaalsContact O-N 3.15Å; P285-E314 HydrophobicContact CG-CG 4.24Å; P285-A315 HydrophobicContact CG-CB 4.31Å; P285-Y318 HydrophobicContact CB-CD1 3.99Å; P285-Y318 HydrophobicContact CB-CD2 4.46Å; P285-Y318 HydrophobicContact CB-CG 3.93Å; P285-Q319 PolarHBondContact O-NE2 3.34Å; P285-T333 HydrophobicContact CB-CG2 3.81Å; P285-T333 HydrophobicContact CG-CG2 4.04Å
286	L	94.8	Very high	96.5	Very high	19 Å²	19	44.6 Å²	44.6	10%	0.099	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-87.5	-14.1	175.3	-57.8	-176.3	0	0	0	113.5	E254 R283 F284 T333 A334 R417 Y418	E254-L286 HydrophobicContact CG-CB 4.14Å; E254-L286 HydrophobicContact CG-CD1 4.13Å; R283-L286 HydrophobicContact CB-CD1 3.7Å; R283-L286 HydrophobicContact CB-CG 3.89Å; R283-L286 HydrophobicContact CG-CD1 4.43Å; R283-L286 WeakPolarHBondContact O-CB 3.42Å; R283-L286 PolarHBondContact O-N 2.83Å; F284-L286 PolarHBondContact O-N 2.89Å; L286-T333 VanDerWaalsContact CD2-O 3.28Å; L286-T333 WeakPolarHBondContact CD2-O 3.35Å; L286-A334 WeakPolarHBondContact CD1-O 3.42Å; L286-R417 VanDerWaalsContact CD2-CD 3.47Å; L286-R417 HydrophobicContact CD2-CG 4.24Å; L286-Y418 VanDerWaalsContact C-OH 3.32Å; L286-Y418 WeakPolarHBondContact O-CE1 3.39Å; L286-Y418 PolarHBondContact O-OH 2.68Å
287	M	95.3	Very high	96.4	Very high	3 Å²	3	47.1 Å²	47.1	2%	0.015	23%	0.228	C	C	.	.	S	Bend	trans	-74.9	148.6	175	-61.6	179.4	-172.6	0	0	110.6	E254 F258 I282 F284 E291 L292 V296 Q319	E254-M287 VanDerWaalsContact C-CE 3.46Å; E254-M287 HydrophobicContact CB-CE 3.81Å; E254-M287 HydrophobicContact CB-CG 4.1Å; E254-M287 VanDerWaalsContact O-CE 3.26Å; E254-M287 WeakPolarHBondContact O-CE 3.27Å; F258-M287 HydrophobicContact CB-CE 3.81Å; F258-M287 HydrophobicContact CG-CE 4.43Å; I282-M287 HydrophobicContact CG2-CE 3.74Å; F284-M287 HydrophobicContact CD1-CE 3.64Å; F284-M287 HydrophobicContact CD1-SD 3.8Å; F284-M287 HydrophobicContact CE1-CE 3.92Å; F284-M287 HydrophobicContact CE1-SD 4.45Å; F284-M287 WeakPolarHBondContact O-CB 3.32Å; F284-M287 PolarHBondContact O-N 3.19Å; M287-E291 HydrophobicContact CB-CB 4.22Å; M287-L292 HydrophobicContact CB-CD2 3.95Å; M287-L292 HydrophobicContact CB-CG 3.98Å; M287-L292 HydrophobicContact CG-CD2 4.48Å; M287-L292 HydrophobicContact SD-CD2 3.87Å; M287-V296 HydrophobicContact CE-CG2 4.36Å; M287-V296 HydrophobicContact SD-CG2 3.62Å; M287-Q319 PolarHBondContact O-NE2 2.93Å
288	T	93.6	Very high	96.4	Very high	45 Å²	45	45.8 Å²	45.8	28%	0.276	23%	0.23	S	C	.	.			trans	-68.7	156.4	172.3	65.4	0	0	0	0	111	Q290 E291 L292 Y418	T288-Q290 PolarHBondContact O-N 3.46Å; T288-E291 WeakPolarHBondContact CB-OE2 3.27Å; T288-E291 WeakPolarHBondContact CG2-OE2 3.4Å; T288-E291 PolarHBondContact N-OE2 2.87Å; T288-E291 PolarHBondContact O-N 2.82Å; T288-E291 VanDerWaalsContact OG1-CD 3.29Å; T288-E291 WeakPolarHBondContact OG1-CG 3.28Å; T288-E291 PolarHBondContact OG1-N 3.1Å; T288-E291 PolarHBondContact OG1-OE2 2.79Å; T288-L292 PolarHBondContact O-N 3.46Å; T288-L292 VanDerWaalsContact O-N 3.12Å; T288-Y418 HydrophobicContact CG2-CE1 4.23Å
289	P	94.9	Very high	96.3	Very high	69 Å²	69	46.2 Å²	46.2	45%	0.448	23%	0.233	S	C	.	.	H	α-helix	trans	-55.4	-36.4	176.1	-27.6	35.5	0	0	0	113.5	L292 I293 Q319	P289-L292 PolarHBondContact O-N 3.34Å; P289-I293 VanDerWaalsContact O-CG1 3.3Å; P289-I293 WeakPolarHBondContact O-CG1 3.27Å; P289-I293 PolarHBondContact O-N 2.91Å; P289-I293 VanDerWaalsContact O-N 3.13Å; P289-Q319 HydrophobicContact CG-CB 4.27Å
290	Q	94.9	Very high	96.2	Very high	145 Å²	145	51.4 Å²	51.4	68%	0.678	26%	0.26	S	S	*	.	H	α-helix	trans	-66.1	-39.8	177.9	-68.1	-179.5	-6.3	0	0	111.8	T288 I293 N294	T288-Q290 PolarHBondContact O-N 3.46Å; Q290-I293 PolarHBondContact O-N 2.97Å; Q290-N294 WeakPolarHBondContact O-CB 3.31Å; Q290-N294 VanDerWaalsContact O-CG 3.26Å; Q290-N294 PolarHBondContact O-N 2.92Å; Q290-N294 PolarHBondContact O-ND2 2.67Å
291	E	96.4	Very high	96.1	Very high	48 Å²	48	47.9 Å²	47.9	22%	0.224	25%	0.245	C	C	.	.	H	α-helix	trans	-67.6	-41.5	178.6	-69.4	167.3	132.8	0	0	111.9	L255 M287 T288 I293 Y295 V296	L255-E291 HydrophobicContact CD1-CB 4.47Å; L255-E291 HydrophobicContact CD2-CB 4.43Å; L255-E291 HydrophobicContact CD2-CG 3.91Å; L255-E291 WeakPolarHBondContact CD2-OE1 3.3Å; M287-E291 HydrophobicContact CB-CB 4.22Å; T288-E291 WeakPolarHBondContact CB-OE2 3.27Å; T288-E291 WeakPolarHBondContact CG2-OE2 3.4Å; T288-E291 PolarHBondContact N-OE2 2.87Å; T288-E291 PolarHBondContact O-N 2.82Å; T288-E291 VanDerWaalsContact OG1-CD 3.29Å; T288-E291 WeakPolarHBondContact OG1-CG 3.28Å; T288-E291 PolarHBondContact OG1-N 3.1Å; T288-E291 PolarHBondContact OG1-OE2 2.79Å; E291-I293 PolarHBondContact O-N 3.45Å; E291-Y295 HydrophobicContact CB-CD2 4.38Å; E291-Y295 HydrophobicContact CG-CD2 4.5Å; E291-Y295 WeakPolarHBondContact O-CB 3.41Å; E291-Y295 PolarHBondContact O-N 3.06Å; E291-V296 PolarHBondContact O-N 3.36Å
292	L	96.8	Very high	96	Very high	4 Å²	4	45.7 Å²	45.7	2%	0.021	23%	0.234	C	C	.	.	I	π-helix	trans	-59.5	-46.5	176.3	-68.3	172.2	0	0	0	111.4	F284 M287 T288 P289 V296 Q297 L312 A315 Q319	F284-L292 HydrophobicContact CB-CD2 4.2Å; F284-L292 HydrophobicContact CD1-CD2 4.26Å; M287-L292 HydrophobicContact CB-CD2 3.95Å; M287-L292 HydrophobicContact CB-CG 3.98Å; M287-L292 HydrophobicContact CG-CD2 4.48Å; M287-L292 HydrophobicContact SD-CD2 3.87Å; T288-L292 PolarHBondContact O-N 3.46Å; T288-L292 VanDerWaalsContact O-N 3.12Å; P289-L292 PolarHBondContact O-N 3.34Å; L292-V296 HydrophobicContact CD2-CG2 4.21Å; L292-V296 WeakPolarHBondContact O-CB 3.23Å; L292-V296 PolarHBondContact O-N 3.32Å; L292-Q297 WeakPolarHBondContact O-CG 3.28Å; L292-Q297 PolarHBondContact O-N 3.44Å; L292-L312 HydrophobicContact CD2-CD2 4.26Å; L292-A315 HydrophobicContact CD1-CB 3.95Å; L292-A315 HydrophobicContact CD2-CB 4.17Å; L292-Q319 HydrophobicContact CD1-CG 4.34Å
293	I	95.9	Very high	95.9	Very high	90 Å²	90	52.7 Å²	52.7	46%	0.462	26%	0.26	S	S	.	.	I	π-helix	trans	-72	-50	-178.2	-65.3	167.2	0	0	0	111.2	P289 Q290 E291	P289-I293 VanDerWaalsContact O-CG1 3.3Å; P289-I293 WeakPolarHBondContact O-CG1 3.27Å; P289-I293 PolarHBondContact O-N 2.91Å; P289-I293 VanDerWaalsContact O-N 3.13Å; Q290-I293 PolarHBondContact O-N 2.97Å; E291-I293 PolarHBondContact O-N 3.45Å
294	N	96.8	Very high	95.8	Very high	94 Å²	94	57.3 Å²	57.3	50%	0.503	29%	0.29	S	S	.	.	I	π-helix	trans	-80.6	-24.5	-168.8	-64.4	-19.5	0	0	0	113.4	Q290 T298	Q290-N294 WeakPolarHBondContact O-CB 3.31Å; Q290-N294 VanDerWaalsContact O-CG 3.26Å; Q290-N294 PolarHBondContact O-N 2.92Å; Q290-N294 PolarHBondContact O-ND2 2.67Å; N294-T298 VanDerWaalsContact O-CG2 3.27Å; N294-T298 WeakPolarHBondContact O-CG2 3.29Å
295	Y	97.1	Very high	95.8	Very high	111 Å²	111	60 Å²	60	44%	0.435	31%	0.305	S	S	.	.	I	π-helix	trans	-120.2	-42.4	-176.4	-58.8	-71.4	0	0	0	113.9	L255 E291 T298	L255-Y295 HydrophobicContact CD1-CD2 3.88Å; L255-Y295 HydrophobicContact CD1-CG 3.96Å; L255-Y295 HydrophobicContact CD2-CD2 3.87Å; L255-Y295 HydrophobicContact CD2-CE2 4.03Å; E291-Y295 HydrophobicContact CB-CD2 4.38Å; E291-Y295 HydrophobicContact CG-CD2 4.5Å; E291-Y295 WeakPolarHBondContact O-CB 3.41Å; E291-Y295 PolarHBondContact O-N 3.06Å; Y295-T298 PolarHBondContact O-OG1 3.14Å
296	V	97.1	Very high	95.8	Very high	0 Å²	0	65.7 Å²	65.7	0%	0	34%	0.335	C	S	.	.	I	π-helix	trans	-82.5	-47.6	-172.5	-171.5	0	0	0	0	111.5	F258 F284 M287 E291 L292 T298 V299 M302 L312	F258-V296 HydrophobicContact CD1-CG2 3.99Å; F258-V296 HydrophobicContact CD2-CG1 4.45Å; F258-V296 HydrophobicContact CE1-CB 4.19Å; F258-V296 HydrophobicContact CE1-CG1 4.29Å; F258-V296 HydrophobicContact CE1-CG2 3.93Å; F258-V296 HydrophobicContact CE2-CG1 3.85Å; F258-V296 HydrophobicContact CG-CG2 4.35Å; F258-V296 HydrophobicContact CZ-CB 4.12Å; F258-V296 HydrophobicContact CZ-CG1 3.75Å; F258-V296 HydrophobicContact CZ-CG2 4.23Å; F284-V296 HydrophobicContact CD1-CG1 3.98Å; F284-V296 HydrophobicContact CD1-CG2 4.26Å; F284-V296 HydrophobicContact CE1-CG1 3.56Å; F284-V296 HydrophobicContact CE1-CG2 4.18Å; F284-V296 HydrophobicContact CZ-CG1 4.45Å; M287-V296 HydrophobicContact CE-CG2 4.36Å; M287-V296 HydrophobicContact SD-CG2 3.62Å; E291-V296 PolarHBondContact O-N 3.36Å; L292-V296 HydrophobicContact CD2-CG2 4.21Å; L292-V296 WeakPolarHBondContact O-CB 3.23Å; L292-V296 PolarHBondContact O-N 3.32Å; V296-T298 PolarHBondContact O-N 3.25Å; V296-V299 PolarHBondContact O-N 3.18Å; V296-M302 HydrophobicContact CG1-CE 3.75Å; V296-M302 HydrophobicContact CG1-CG 4.11Å; V296-M302 HydrophobicContact CG1-SD 4.49Å; V296-L312 HydrophobicContact CB-CD2 4.19Å; V296-L312 HydrophobicContact CG1-CD2 3.54Å; V296-L312 HydrophobicContact CG1-CG 4.38Å
297	Q	95.2	Very high	95.9	Very high	74 Å²	74	66.8 Å²	66.8	35%	0.346	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-19.3	179.8	-73.2	-178.1	-2.9	0	0	113.5	L292 V299 R303 L312	L292-Q297 WeakPolarHBondContact O-CG 3.28Å; L292-Q297 PolarHBondContact O-N 3.44Å; Q297-V299 PolarHBondContact O-N 3.43Å; Q297-R303 WeakPolarHBondContact O-CD 3.46Å; Q297-R303 PolarHBondContact O-NE 2.95Å; Q297-R303 VanDerWaalsContact O-NE 3.15Å; Q297-L312 HydrophobicContact CG-CD1 4.16Å
298	T	96.2	Very high	96	Very high	91 Å²	91	66.7 Å²	66.7	56%	0.558	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.6	-11.5	177.8	63.7	0	0	0	0	113.1	N294 Y295 V296	N294-T298 VanDerWaalsContact O-CG2 3.27Å; N294-T298 WeakPolarHBondContact O-CG2 3.29Å; Y295-T298 PolarHBondContact O-OG1 3.14Å; V296-T298 PolarHBondContact O-N 3.25Å
299	V	96.5	Very high	96.2	Very high	9 Å²	9	66.6 Å²	66.6	6%	0.055	34%	0.341	C	S	.	.	S	Bend	trans	-90.2	125	178.6	-179.8	0	0	0	0	110.7	F258 V296 Q297 F301 M302	F258-V299 HydrophobicContact CE1-CG2 4.09Å; F258-V299 HydrophobicContact CZ-CB 4.21Å; F258-V299 HydrophobicContact CZ-CG2 3.72Å; V296-V299 PolarHBondContact O-N 3.18Å; Q297-V299 PolarHBondContact O-N 3.43Å; V299-F301 HydrophobicContact CG1-CD1 3.6Å; V299-F301 HydrophobicContact CG1-CE1 3.25Å; V299-F301 HydrophobicContact CG1-CE2 4.27Å; V299-F301 HydrophobicContact CG1-CG 4.24Å; V299-F301 HydrophobicContact CG1-CZ 3.62Å; V299-F301 PolarHBondContact O-N 2.82Å; V299-M302 HydrophobicContact CB-CB 4.48Å; V299-M302 HydrophobicContact CB-CG 3.98Å; V299-M302 HydrophobicContact CG1-CG 4.17Å; V299-M302 WeakPolarHBondContact O-CB 3.34Å; V299-M302 PolarHBondContact O-N 3.34Å; V299-M302 VanDerWaalsContact O-N 3.13Å
300	D	94.9	Very high	96.4	Very high	108 Å²	108	67.2 Å²	67.2	58%	0.578	34%	0.341	S	S	*	.	H	α-helix	trans	-59.5	-48.3	-169.9	-67.1	-24.9	0	0	0	114.5	M302 R303 T304	D300-M302 PolarHBondContact O-N 3.19Å; D300-R303 WeakPolarHBondContact O-CA 3.36Å; D300-R303 WeakPolarHBondContact O-CB 3.49Å; D300-R303 PolarHBondContact O-N 3.45Å; D300-R303 IonicContact OD1-CZ 2.81Å; D300-R303 IonicContact OD1-NH2 2.79Å; D300-R303 PolarHBondContact OD1-NH2 3.34Å; D300-T304 PolarHBondContact O-N 3.05Å; D300-T304 VanDerWaalsContact O-N 3.12Å; D300-T304 PolarHBondContact O-OG1 3.23Å
301	F	94.9	Very high	96.5	Very high	33 Å²	33	60.5 Å²	60.5	15%	0.145	31%	0.31	C	S	.	.	H	α-helix	trans	-65.9	-20.9	-179.4	67.7	-101.2	0	0	0	113.1	L265 A275 M279 V299 R303 T304 D305	L265-F301 HydrophobicContact CD1-CE1 4.44Å; L265-F301 HydrophobicContact CD1-CZ 3.94Å; A275-F301 HydrophobicContact CB-CD2 4.05Å; A275-F301 HydrophobicContact CB-CE2 4.06Å; A275-F301 HydrophobicContact CB-CG 4.47Å; A275-F301 HydrophobicContact CB-CZ 4.48Å; M279-F301 HydrophobicContact CE-CE2 3.51Å; M279-F301 HydrophobicContact CE-CZ 3.43Å; M279-F301 VanDerWaalsContact CE-CZ 3.43Å; M279-F301 HydrophobicContact CG-CE2 4.04Å; V299-F301 HydrophobicContact CG1-CD1 3.6Å; V299-F301 HydrophobicContact CG1-CE1 3.25Å; V299-F301 HydrophobicContact CG1-CE2 4.27Å; V299-F301 HydrophobicContact CG1-CG 4.24Å; V299-F301 HydrophobicContact CG1-CZ 3.62Å; V299-F301 PolarHBondContact O-N 2.82Å; F301-R303 PolarHBondContact O-N 3.26Å; F301-T304 WeakPolarHBondContact CA-OG1 3.37Å; F301-D305 VanDerWaalsContact O-CB 3.31Å; F301-D305 WeakPolarHBondContact O-CB 3.47Å; F301-D305 PolarHBondContact O-N 2.64Å
302	M	96.9	Very high	96.5	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-67.5	-20.1	172.1	-64.5	-60.1	-56.8	0	0	112.2	F258 M279 F284 V296 V299 D300 C308 V309 L312	F258-M302 HydrophobicContact CE2-CG 4.05Å; F258-M302 HydrophobicContact CE2-SD 3.98Å; F258-M302 HydrophobicContact CZ-CG 4.17Å; M279-M302 HydrophobicContact CE-SD 4.42Å; M279-M302 HydrophobicContact CG-SD 3.94Å; M279-M302 HydrophobicContact SD-SD 4.2Å; F284-M302 HydrophobicContact CE1-CE 4.03Å; F284-M302 HydrophobicContact CE2-CE 4.12Å; F284-M302 HydrophobicContact CZ-CE 3.63Å; F284-M302 HydrophobicContact CZ-SD 4.37Å; V296-M302 HydrophobicContact CG1-CE 3.75Å; V296-M302 HydrophobicContact CG1-CG 4.11Å; V296-M302 HydrophobicContact CG1-SD 4.49Å; V299-M302 HydrophobicContact CB-CB 4.48Å; V299-M302 HydrophobicContact CB-CG 3.98Å; V299-M302 HydrophobicContact CG1-CG 4.17Å; V299-M302 WeakPolarHBondContact O-CB 3.34Å; V299-M302 PolarHBondContact O-N 3.34Å; V299-M302 VanDerWaalsContact O-N 3.13Å; D300-M302 PolarHBondContact O-N 3.19Å; M302-C308 HydrophobicContact CE-CB 3.93Å; M302-C308 HydrophobicContact SD-CB 3.78Å; M302-V309 WeakPolarHBondContact O-CG2 3.3Å; M302-L312 HydrophobicContact CB-CD1 3.97Å; M302-L312 HydrophobicContact CE-CD1 4.24Å; M302-L312 HydrophobicContact CE-CD2 4.28Å; M302-L312 HydrophobicContact CE-CG 3.84Å; M302-L312 WeakPolarHBondContact O-CD1 3.44Å
303	R	95.1	Very high	96.5	Very high	146 Å²	146	63.1 Å²	63.1	55%	0.551	33%	0.325	S	S	*	.	H	α-helix	trans	-104.3	-18.2	179.7	-62.1	-176.1	-71	135.6	-0.9	113.8	Q297 D300 F301 V309	Q297-R303 WeakPolarHBondContact O-CD 3.46Å; Q297-R303 PolarHBondContact O-NE 2.95Å; Q297-R303 VanDerWaalsContact O-NE 3.15Å; D300-R303 WeakPolarHBondContact O-CA 3.36Å; D300-R303 WeakPolarHBondContact O-CB 3.49Å; D300-R303 PolarHBondContact O-N 3.45Å; D300-R303 IonicContact OD1-CZ 2.81Å; D300-R303 IonicContact OD1-NH2 2.79Å; D300-R303 PolarHBondContact OD1-NH2 3.34Å; F301-R303 PolarHBondContact O-N 3.26Å; R303-V309 WeakPolarHBondContact O-CG2 3.42Å
304	T	94.9	Very high	96.6	Very high	115 Å²	115	61.2 Å²	61.2	71%	0.706	31%	0.314	S	S	*	.	H	α-helix	trans	-108.2	-33.5	-176.3	59.2	0	0	0	0	113.5	D300 F301	D300-T304 PolarHBondContact O-N 3.05Å; D300-T304 VanDerWaalsContact O-N 3.12Å; D300-T304 PolarHBondContact O-OG1 3.23Å; F301-T304 WeakPolarHBondContact CA-OG1 3.37Å
305	D	96.6	Very high	96.6	Very high	56 Å²	56	56.8 Å²	56.8	30%	0.299	29%	0.29	S	S	.	.	S	Bend	trans	-78.4	126.9	176.7	175	-99.8	0	0	0	111.1	F301 T307 C308 V309	F301-D305 VanDerWaalsContact O-CB 3.31Å; F301-D305 WeakPolarHBondContact O-CB 3.47Å; F301-D305 PolarHBondContact O-N 2.64Å; D305-T307 VanDerWaalsContact C-N 3.28Å; D305-T307 PolarHBondContact O-N 3.05Å; D305-T307 WeakPolarHBondContact OD1-CA 3.47Å; D305-T307 WeakPolarHBondContact OD1-CB 3.08Å; D305-T307 PolarHBondContact OD1-N 3.43Å; D305-C308 HydrophobicContact CB-CB 4.16Å; D305-C308 PolarHBondContact O-N 2.86Å; D305-C308 VanDerWaalsContact O-N 3.16Å; D305-C308 PolarHBondContact OD1-N 3.02Å; D305-C308 PolarHBondContact OD1-SG 3.35Å; D305-V309 VanDerWaalsContact O-CG2 3.32Å; D305-V309 WeakPolarHBondContact O-CG2 3.5Å; D305-V309 PolarHBondContact O-N 2.9Å
306	N	97.1	Very high	96.5	Very high	119 Å²	119	53.1 Å²	53.1	64%	0.636	28%	0.281	S	S	*	.	H	α-helix	trans	-61.3	-35	-175.9	-176.3	63.5	0	0	0	112.8	N310	N306-N310 PolarHBondContact O-N 3.28Å; N306-N310 PolarHBondContact O-ND2 3.18Å
307	T	97.3	Very high	96.5	Very high	43 Å²	43	57 Å²	57	26%	0.264	30%	0.302	S	S	.	.	H	α-helix	trans	-66.5	-48.5	176.9	-55.4	0	0	0	0	110.1	A276 K280 D305 V309 N310 L311	A276-T307 HydrophobicContact CB-CG2 4.29Å; K280-T307 HydrophobicContact CD-CG2 4.32Å; K280-T307 HydrophobicContact CG-CG2 4.07Å; D305-T307 VanDerWaalsContact C-N 3.28Å; D305-T307 PolarHBondContact O-N 3.05Å; D305-T307 WeakPolarHBondContact OD1-CA 3.47Å; D305-T307 WeakPolarHBondContact OD1-CB 3.08Å; D305-T307 PolarHBondContact OD1-N 3.43Å; T307-V309 PolarHBondContact O-N 2.91Å; T307-N310 PolarHBondContact O-N 3.06Å; T307-L311 WeakPolarHBondContact O-CG 3.42Å; T307-L311 PolarHBondContact O-N 2.9Å; T307-L311 VanDerWaalsContact O-N 3.1Å
308	C	97.4	Very high	96.6	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-65.5	-38.4	-177.9	-59.6	0	0	0	0	112.4	M302 D305 N310 L311 L312	M302-C308 HydrophobicContact CE-CB 3.93Å; M302-C308 HydrophobicContact SD-CB 3.78Å; D305-C308 HydrophobicContact CB-CB 4.16Å; D305-C308 PolarHBondContact O-N 2.86Å; D305-C308 VanDerWaalsContact O-N 3.16Å; D305-C308 PolarHBondContact OD1-N 3.02Å; D305-C308 PolarHBondContact OD1-SG 3.35Å; C308-N310 VanDerWaalsContact C-N 3.33Å; C308-N310 PolarHBondContact O-N 3.25Å; C308-L311 WeakPolarHBondContact O-CB 3.43Å; C308-L311 PolarHBondContact O-N 2.95Å; C308-L312 PolarHBondContact O-N 3.37Å
309	V	97.6	Very high	96.5	Very high	43 Å²	43	51 Å²	51	26%	0.261	27%	0.267	S	S	.	.	H	α-helix	trans	-60.1	-44	173.5	170.7	0	0	0	0	111	M302 R303 D305 T307 L311 L312 L313	M302-V309 WeakPolarHBondContact O-CG2 3.3Å; R303-V309 WeakPolarHBondContact O-CG2 3.42Å; D305-V309 VanDerWaalsContact O-CG2 3.32Å; D305-V309 WeakPolarHBondContact O-CG2 3.5Å; D305-V309 PolarHBondContact O-N 2.9Å; T307-V309 PolarHBondContact O-N 2.91Å; V309-L311 VanDerWaalsContact C-N 3.32Å; V309-L311 PolarHBondContact O-N 3.18Å; V309-L312 WeakPolarHBondContact O-CB 3.27Å; V309-L312 PolarHBondContact O-N 3.25Å; V309-L313 HydrophobicContact CG1-CD1 4.09Å; V309-L313 HydrophobicContact CG1-CG 4.39Å; V309-L313 WeakPolarHBondContact O-CG 3.3Å; V309-L313 PolarHBondContact O-N 3.41Å
310	N	97.9	Very high	96.4	Very high	83 Å²	83	57.5 Å²	57.5	44%	0.444	30%	0.299	S	S	.	.	H	α-helix	trans	-64.1	-35.7	177.4	-75.1	-47.6	0	0	0	112.7	N306 T307 C308 L312 L313 E314	N306-N310 PolarHBondContact O-N 3.28Å; N306-N310 PolarHBondContact O-ND2 3.18Å; T307-N310 PolarHBondContact O-N 3.06Å; C308-N310 VanDerWaalsContact C-N 3.33Å; C308-N310 PolarHBondContact O-N 3.25Å; N310-L312 VanDerWaalsContact C-N 3.35Å; N310-L313 PolarHBondContact O-N 3.42Å; N310-E314 PolarHBondContact O-N 3.31Å
311	L	98	Very high	96.4	Very high	4 Å²	4	56 Å²	56	2%	0.021	29%	0.289	C	S	.	.	H	α-helix	trans	-63.7	-40.3	173.6	-65.8	171.7	0	0	0	111.8	M279 K280 F284 T307 C308 V309 A315	M279-L311 HydrophobicContact CB-CD1 3.9Å; K280-L311 HydrophobicContact CG-CD1 4.38Å; F284-L311 HydrophobicContact CD2-CB 3.96Å; F284-L311 HydrophobicContact CD2-CD1 4.47Å; F284-L311 HydrophobicContact CE2-CB 4.17Å; F284-L311 HydrophobicContact CE2-CD1 4.03Å; T307-L311 WeakPolarHBondContact O-CG 3.42Å; T307-L311 PolarHBondContact O-N 2.9Å; T307-L311 VanDerWaalsContact O-N 3.1Å; C308-L311 WeakPolarHBondContact O-CB 3.43Å; C308-L311 PolarHBondContact O-N 2.95Å; V309-L311 VanDerWaalsContact C-N 3.32Å; V309-L311 PolarHBondContact O-N 3.18Å; L311-A315 PolarHBondContact O-N 3.22Å; L311-A315 VanDerWaalsContact O-N 3.11Å
312	L	96.7	Very high	96.4	Very high	14 Å²	14	56.8 Å²	56.8	7%	0.073	30%	0.298	C	S	.	.	H	α-helix	trans	-66.5	-43.9	175.1	-81	-178	0	0	0	112.4	L292 V296 Q297 M302 C308 V309 N310 E314 A315 S316	L292-L312 HydrophobicContact CD2-CD2 4.26Å; V296-L312 HydrophobicContact CB-CD2 4.19Å; V296-L312 HydrophobicContact CG1-CD2 3.54Å; V296-L312 HydrophobicContact CG1-CG 4.38Å; Q297-L312 HydrophobicContact CG-CD1 4.16Å; M302-L312 HydrophobicContact CB-CD1 3.97Å; M302-L312 HydrophobicContact CE-CD1 4.24Å; M302-L312 HydrophobicContact CE-CD2 4.28Å; M302-L312 HydrophobicContact CE-CG 3.84Å; M302-L312 WeakPolarHBondContact O-CD1 3.44Å; C308-L312 PolarHBondContact O-N 3.37Å; V309-L312 WeakPolarHBondContact O-CB 3.27Å; V309-L312 PolarHBondContact O-N 3.25Å; N310-L312 VanDerWaalsContact C-N 3.35Å; L312-E314 VanDerWaalsContact C-N 3.33Å; L312-E314 PolarHBondContact O-N 3.47Å; L312-A315 PolarHBondContact O-N 3.32Å; L312-S316 WeakPolarHBondContact O-CB 3.42Å; L312-S316 PolarHBondContact O-N 2.95Å; L312-S316 PolarHBondContact O-OG 3.22Å
313	L	96.4	Very high	96.4	Very high	92 Å²	92	60.4 Å²	60.4	48%	0.482	31%	0.313	S	S	.	.	H	α-helix	trans	-60.9	-42.3	177.8	-71.6	173.7	0	0	0	111.7	V309 N310 S316 N317	V309-L313 HydrophobicContact CG1-CD1 4.09Å; V309-L313 HydrophobicContact CG1-CG 4.39Å; V309-L313 WeakPolarHBondContact O-CG 3.3Å; V309-L313 PolarHBondContact O-N 3.41Å; N310-L313 PolarHBondContact O-N 3.42Å; L313-S316 PolarHBondContact O-N 2.89Å; L313-N317 WeakPolarHBondContact O-CB 3.47Å; L313-N317 PolarHBondContact O-N 3.3Å; L313-N317 PolarHBondContact O-ND2 2.9Å
314	E	97.3	Very high	96.4	Very high	51 Å²	51	55.9 Å²	55.9	24%	0.238	30%	0.299	C	S	.	.	H	α-helix	trans	-57.2	-51.8	172.6	176.9	-169.9	-133.4	0	0	111.3	P285 N310 L312 S316 N317 Y318 R332	P285-E314 HydrophobicContact CG-CG 4.24Å; N310-E314 PolarHBondContact O-N 3.31Å; L312-E314 VanDerWaalsContact C-N 3.33Å; L312-E314 PolarHBondContact O-N 3.47Å; E314-S316 PolarHBondContact O-N 3.45Å; E314-N317 PolarHBondContact O-N 3.22Å; E314-Y318 VanDerWaalsContact O-CB 3.31Å; E314-Y318 WeakPolarHBondContact O-CB 3.46Å; E314-Y318 PolarHBondContact O-N 2.91Å; E314-R332 IonicContact OE1-CZ 3.69Å; E314-R332 IonicContact OE1-NE 3.1Å; E314-R332 PolarHBondContact OE1-NE 3.08Å; E314-R332 IonicContact OE1-NH2 3.53Å; E314-R332 PolarHBondContact OE1-NH2 2.97Å; E314-R332 IonicContact OE2-CZ 3.56Å; E314-R332 IonicContact OE2-NE 2.61Å; E314-R332 PolarHBondContact OE2-NE 3.15Å; E314-R332 IonicContact OE2-NH2 2.81Å; E314-R332 PolarHBondContact OE2-NH2 2.94Å
315	A	97.4	Very high	96.5	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-61	-43.6	-179	0	0	0	0	0	112.1	F284 P285 L292 L311 L312 Y318 Q319	F284-A315 HydrophobicContact CB-CB 3.62Å; P285-A315 HydrophobicContact CG-CB 4.31Å; L292-A315 HydrophobicContact CD1-CB 3.95Å; L292-A315 HydrophobicContact CD2-CB 4.17Å; L311-A315 PolarHBondContact O-N 3.22Å; L311-A315 VanDerWaalsContact O-N 3.11Å; L312-A315 PolarHBondContact O-N 3.32Å; A315-Y318 PolarHBondContact O-N 3.05Å; A315-Q319 WeakPolarHBondContact O-CB 3.31Å; A315-Q319 VanDerWaalsContact O-CG 3.3Å; A315-Q319 WeakPolarHBondContact O-CG 3.43Å; A315-Q319 PolarHBondContact O-N 3.26Å
316	S	95.5	Very high	96.6	Very high	35 Å²	35	48.2 Å²	48.2	25%	0.245	25%	0.254	C	S	.	.	H	α-helix	trans	-61.3	-49	175.7	-65.5	0	0	0	0	111.8	L312 L313 E314 Y318 Q319 M320	L312-S316 WeakPolarHBondContact O-CB 3.42Å; L312-S316 PolarHBondContact O-N 2.95Å; L312-S316 PolarHBondContact O-OG 3.22Å; L313-S316 PolarHBondContact O-N 2.89Å; E314-S316 PolarHBondContact O-N 3.45Å; S316-Y318 VanDerWaalsContact C-N 3.32Å; S316-Y318 PolarHBondContact O-N 2.78Å; S316-Q319 PolarHBondContact O-N 2.87Å; S316-M320 WeakPolarHBondContact O-CB 3.46Å; S316-M320 VanDerWaalsContact O-CG 3.26Å; S316-M320 WeakPolarHBondContact O-CG 3.26Å; S316-M320 PolarHBondContact O-N 2.99Å
317	N	96.1	Very high	96.6	Very high	81 Å²	81	44.9 Å²	44.9	43%	0.433	24%	0.238	S	C	.	.	H	α-helix	trans	-60.2	-43.4	178	-73.2	-22.7	0	0	0	111.7	L313 E314 Q319 M320 M321	L313-N317 WeakPolarHBondContact O-CB 3.47Å; L313-N317 PolarHBondContact O-N 3.3Å; L313-N317 PolarHBondContact O-ND2 2.9Å; E314-N317 PolarHBondContact O-N 3.22Å; N317-Q319 PolarHBondContact O-N 3.35Å; N317-M320 PolarHBondContact O-N 3.26Å; N317-M321 WeakPolarHBondContact O-CG 3.12Å; N317-M321 PolarHBondContact O-N 2.99Å
318	Y	96.9	Very high	96.5	Very high	4 Å²	4	45.7 Å²	45.7	2%	0.016	24%	0.239	C	C	.	.	H	α-helix	trans	-62.3	-41.9	178.6	-173.1	-80	0	0	0	112	P285 E314 A315 S316 Q325 M328 Q329 T333 R417	P285-Y318 HydrophobicContact CB-CD1 3.99Å; P285-Y318 HydrophobicContact CB-CD2 4.46Å; P285-Y318 HydrophobicContact CB-CG 3.93Å; E314-Y318 VanDerWaalsContact O-CB 3.31Å; E314-Y318 WeakPolarHBondContact O-CB 3.46Å; E314-Y318 PolarHBondContact O-N 2.91Å; A315-Y318 PolarHBondContact O-N 3.05Å; S316-Y318 VanDerWaalsContact C-N 3.32Å; S316-Y318 PolarHBondContact O-N 2.78Å; Y318-Q325 HydrophobicContact CD1-CG 3.93Å; Y318-Q325 HydrophobicContact CE1-CB 3.95Å; Y318-Q325 VanDerWaalsContact CE1-CD 3.45Å; Y318-Q325 HydrophobicContact CE1-CG 3.41Å; Y318-Q325 VanDerWaalsContact CE1-CG 3.41Å; Y318-Q325 HydrophobicContact CE2-CB 4.15Å; Y318-Q325 HydrophobicContact CE2-CG 4.14Å; Y318-Q325 HydrophobicContact CG-CG 4.43Å; Y318-Q325 WeakPolarHBondContact O-CG 3.39Å; Y318-Q325 PolarHBondContact O-NE2 2.98Å; Y318-M328 HydrophobicContact CD2-CB 4.05Å; Y318-M328 HydrophobicContact CD2-CE 4.36Å; Y318-M328 HydrophobicContact CE2-CB 4.02Å; Y318-Q329 PolarHBondContact OH-NE2 3.15Å; Y318-Q329 VanDerWaalsContact OH-NE2 3.15Å; Y318-T333 HydrophobicContact CD2-CG2 3.53Å; Y318-T333 HydrophobicContact CE2-CG2 3.36Å; Y318-T333 HydrophobicContact CG-CG2 4.31Å; Y318-R417 PolarHBondContact OH-NH1 3.33Å; Y318-R417 VanDerWaalsContact OH-NH1 3.11Å
319	Q	94.9	Very high	96.4	Very high	34 Å²	34	49 Å²	49	16%	0.159	26%	0.255	C	S	.	.	H	α-helix	trans	-72.5	-29.5	178.3	-70.5	-66.4	-34.9	0	0	112.9	P285 M287 P289 L292 A315 S316 N317 M321 Y418	P285-Q319 PolarHBondContact O-NE2 3.34Å; M287-Q319 PolarHBondContact O-NE2 2.93Å; P289-Q319 HydrophobicContact CG-CB 4.27Å; L292-Q319 HydrophobicContact CD1-CG 4.34Å; A315-Q319 WeakPolarHBondContact O-CB 3.31Å; A315-Q319 VanDerWaalsContact O-CG 3.3Å; A315-Q319 WeakPolarHBondContact O-CG 3.43Å; A315-Q319 PolarHBondContact O-N 3.26Å; S316-Q319 PolarHBondContact O-N 2.87Å; N317-Q319 PolarHBondContact O-N 3.35Å; Q319-M321 VanDerWaalsContact C-N 3.32Å; Q319-M321 PolarHBondContact O-N 3.48Å; Q319-Y418 PolarHBondContact NE2-OH 3.26Å; Q319-Y418 VanDerWaalsContact NE2-OH 3.15Å
320	M	94.9	Very high	96.2	Very high	146 Å²	146	49.2 Å²	49.2	72%	0.719	26%	0.258	S	S	*	.	H	α-helix	trans	-75	-17.3	177.7	-74.4	178.9	68	0	0	114.2	S316 N317 P322	S316-M320 WeakPolarHBondContact O-CB 3.46Å; S316-M320 VanDerWaalsContact O-CG 3.26Å; S316-M320 WeakPolarHBondContact O-CG 3.26Å; S316-M320 PolarHBondContact O-N 2.99Å; N317-M320 PolarHBondContact O-N 3.26Å; M320-P322 WeakPolarHBondContact O-CD 3.42Å
321	M	95.3	Very high	96	Very high	78 Å²	78	52 Å²	52	38%	0.384	27%	0.273	S	S	.	.			trans	-116.6	62	-174.6	-60.4	-177.9	-177.9	0	0	112.1	N317 Q319 F323 M324 Q325 M328	N317-M321 WeakPolarHBondContact O-CG 3.12Å; N317-M321 PolarHBondContact O-N 2.99Å; Q319-M321 VanDerWaalsContact C-N 3.32Å; Q319-M321 PolarHBondContact O-N 3.48Å; M321-F323 VanDerWaalsContact C-N 3.28Å; M321-F323 PolarHBondContact O-N 3.29Å; M321-F323 VanDerWaalsContact O-N 3.14Å; M321-M324 HydrophobicContact CB-CB 3.97Å; M321-M324 HydrophobicContact CB-CG 4.17Å; M321-M324 HydrophobicContact CB-SD 4.38Å; M321-M324 HydrophobicContact CG-SD 4.48Å; M321-M324 PolarHBondContact O-N 2.93Å; M321-M324 HydrophobicContact SD-CE 4.45Å; M321-M324 HydrophobicContact SD-SD 3.78Å; M321-Q325 WeakPolarHBondContact O-CG 3.35Å; M321-Q325 PolarHBondContact O-N 2.78Å; M321-M328 HydrophobicContact CB-SD 4.26Å; M321-M328 HydrophobicContact SD-CE 4.38Å; M321-M328 HydrophobicContact SD-SD 4.28Å
322	P	94.3	Very high	95.8	Very high	49 Å²	49	55.5 Å²	55.5	32%	0.318	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-41.1	-170	21.4	-33.4	0	0	0	112.9	M320 M324 Q325 R413	M320-P322 WeakPolarHBondContact O-CD 3.42Å; P322-M324 PolarHBondContact O-N 3.15Å; P322-Q325 WeakPolarHBondContact O-CB 3.44Å; P322-Q325 WeakPolarHBondContact O-CG 3.36Å; P322-R413 PolarHBondContact O-NH1 3.39Å; P322-R413 PolarHBondContact O-NH2 2.91Å
323	F	96.1	Very high	95.8	Very high	75 Å²	75	55 Å²	55	33%	0.329	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-31.9	-179.7	-49.1	-53.9	0	0	0	113.4	M321 P326 I422 V424 P463 N466	M321-F323 VanDerWaalsContact C-N 3.28Å; M321-F323 PolarHBondContact O-N 3.29Å; M321-F323 VanDerWaalsContact O-N 3.14Å; F323-P326 WeakPolarHBondContact O-CD 3.28Å; F323-I422 HydrophobicContact CD1-CD1 4.23Å; F323-I422 HydrophobicContact CE1-CD1 4.19Å; F323-V424 HydrophobicContact CD1-CG1 4.05Å; F323-V424 HydrophobicContact CE1-CG1 4.36Å; F323-P463 CarbonylContact C-O 3.56Å; F323-P463 VanDerWaalsContact C-O 3.29Å; F323-P463 WeakPolarHBondContact O-CB 3.25Å; F323-N466 HydrophobicContact CB-CB 4.13Å; F323-N466 HydrophobicContact CD2-CB 3.94Å; F323-N466 HydrophobicContact CG-CB 3.96Å
324	M	96.8	Very high	95.6	Very high	52 Å²	52	52.4 Å²	52.4	26%	0.256	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-19.8	-178.4	-59.1	-166.4	49.3	0	0	113.7	M321 P322 P326 V327 M328 K464	M321-M324 HydrophobicContact CB-CB 3.97Å; M321-M324 HydrophobicContact CB-CG 4.17Å; M321-M324 HydrophobicContact CB-SD 4.38Å; M321-M324 HydrophobicContact CG-SD 4.48Å; M321-M324 PolarHBondContact O-N 2.93Å; M321-M324 HydrophobicContact SD-CE 4.45Å; M321-M324 HydrophobicContact SD-SD 3.78Å; P322-M324 PolarHBondContact O-N 3.15Å; M324-P326 VanDerWaalsContact C-N 3.26Å; M324-P326 WeakPolarHBondContact O-CD 3.44Å; M324-V327 WeakPolarHBondContact O-CG2 3.34Å; M324-V327 PolarHBondContact O-N 3.49Å; M324-M328 HydrophobicContact CB-CG 4.18Å; M324-M328 HydrophobicContact CB-SD 3.53Å; M324-M328 VanDerWaalsContact CB-SD 3.53Å; M324-M328 HydrophobicContact CE-SD 4.43Å; M324-M328 WeakPolarHBondContact O-CG 3.45Å; M324-M328 PolarHBondContact O-N 2.72Å; M324-K464 HydrophobicContact CE-CB 4.39Å; M324-K464 HydrophobicContact CE-CG 4.11Å
325	Q	96.9	Very high	95.5	Very high	7 Å²	7	50.3 Å²	50.3	3%	0.033	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-42.4	-45.2	-179.8	-68.8	177.6	-15.2	0	0	114.2	Y318 M321 P322 V327 M328 Q329 F390	Y318-Q325 HydrophobicContact CD1-CG 3.93Å; Y318-Q325 HydrophobicContact CE1-CB 3.95Å; Y318-Q325 VanDerWaalsContact CE1-CD 3.45Å; Y318-Q325 HydrophobicContact CE1-CG 3.41Å; Y318-Q325 VanDerWaalsContact CE1-CG 3.41Å; Y318-Q325 HydrophobicContact CE2-CB 4.15Å; Y318-Q325 HydrophobicContact CE2-CG 4.14Å; Y318-Q325 HydrophobicContact CG-CG 4.43Å; Y318-Q325 WeakPolarHBondContact O-CG 3.39Å; Y318-Q325 PolarHBondContact O-NE2 2.98Å; M321-Q325 WeakPolarHBondContact O-CG 3.35Å; M321-Q325 PolarHBondContact O-N 2.78Å; P322-Q325 WeakPolarHBondContact O-CB 3.44Å; P322-Q325 WeakPolarHBondContact O-CG 3.36Å; Q325-V327 PolarHBondContact O-N 3.11Å; Q325-V327 VanDerWaalsContact O-N 3.11Å; Q325-M328 PolarHBondContact O-N 3.05Å; Q325-Q329 PolarHBondContact O-NE2 2.99Å; Q325-F390 HydrophobicContact CB-CE2 4.24Å; Q325-F390 HydrophobicContact CB-CZ 3.85Å
326	P	97.1	Very high	95.2	Very high	3 Å²	3	50.8 Å²	50.8	2%	0.019	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-58.9	-27	-179.7	-27.2	40.6	0	0	0	114.6	F323 M324 I387 G388 F390 Y392 R413	F323-P326 WeakPolarHBondContact O-CD 3.28Å; M324-P326 VanDerWaalsContact C-N 3.26Å; M324-P326 WeakPolarHBondContact O-CD 3.44Å; P326-I387 HydrophobicContact CB-CB 3.98Å; P326-I387 HydrophobicContact CB-CG2 3.69Å; P326-I387 WeakPolarHBondContact CB-O 3.32Å; P326-I387 WeakPolarHBondContact O-CG2 3.37Å; P326-G388 WeakPolarHBondContact O-CA 3.45Å; P326-F390 HydrophobicContact CB-CB 4.41Å; P326-F390 HydrophobicContact CB-CD2 3.83Å; P326-F390 HydrophobicContact CB-CE2 4.46Å; P326-F390 HydrophobicContact CB-CG 4.32Å; P326-F390 HydrophobicContact CG-CB 4.05Å; P326-F390 HydrophobicContact CG-CD1 4.42Å; P326-F390 HydrophobicContact CG-CD2 3.65Å; P326-F390 HydrophobicContact CG-CE2 4.18Å; P326-F390 HydrophobicContact CG-CG 3.79Å; P326-Y392 HydrophobicContact CB-CE2 4.48Å; P326-Y392 HydrophobicContact CG-CE2 4.35Å; P326-Y392 WeakPolarHBondContact CG-OH 3.48Å; P326-R413 VanDerWaalsContact CD-NH1 3.32Å; P326-R413 VanDerWaalsContact CG-NH1 3.33Å
327	V	97.1	Very high	95	Very high	49 Å²	49	50.2 Å²	50.2	30%	0.297	26%	0.264	S	S	.	.	G	3₁₀ helix	trans	-103.8	2.8	178.4	-61.6	0	0	0	0	113.2	M324 Q325 I387 G441 P463 K464	M324-V327 WeakPolarHBondContact O-CG2 3.34Å; M324-V327 PolarHBondContact O-N 3.49Å; Q325-V327 PolarHBondContact O-N 3.11Å; Q325-V327 VanDerWaalsContact O-N 3.11Å; V327-I387 HydrophobicContact CG1-CG2 4.06Å; V327-G441 WeakPolarHBondContact CG1-O 3.45Å; V327-P463 HydrophobicContact CG1-CB 4.27Å; V327-P463 HydrophobicContact CG1-CG 4.11Å; V327-P463 HydrophobicContact CG2-CB 4.44Å; V327-K464 HydrophobicContact CG2-CG 4.16Å
328	M	95.9	Very high	94.7	Very high	59 Å²	59	50.7 Å²	50.7	29%	0.291	27%	0.266	S	S	.	.	S	Bend	trans	-105	33.2	177.3	-65	173.3	67.4	0	0	111.7	Y318 M321 M324 Q325	Y318-M328 HydrophobicContact CD2-CB 4.05Å; Y318-M328 HydrophobicContact CD2-CE 4.36Å; Y318-M328 HydrophobicContact CE2-CB 4.02Å; M321-M328 HydrophobicContact CB-SD 4.26Å; M321-M328 HydrophobicContact SD-CE 4.38Å; M321-M328 HydrophobicContact SD-SD 4.28Å; M324-M328 HydrophobicContact CB-CG 4.18Å; M324-M328 HydrophobicContact CB-SD 3.53Å; M324-M328 VanDerWaalsContact CB-SD 3.53Å; M324-M328 HydrophobicContact CE-SD 4.43Å; M324-M328 WeakPolarHBondContact O-CG 3.45Å; M324-M328 PolarHBondContact O-N 2.72Å; Q325-M328 PolarHBondContact O-N 3.05Å
329	Q	94.9	Very high	94.3	Very high	71 Å²	71	52.1 Å²	52.1	33%	0.332	28%	0.275	S	S	.	.			trans	-76.7	139	-174.3	-65.2	-54.7	-59.2	0	0	113.3	Y318 Q325 T333	Y318-Q329 PolarHBondContact OH-NE2 3.15Å; Y318-Q329 VanDerWaalsContact OH-NE2 3.15Å; Q325-Q329 PolarHBondContact O-NE2 2.99Å; Q329-T333 VanDerWaalsContact CA-OG1 3.31Å; Q329-T333 WeakPolarHBondContact CA-OG1 3.5Å; Q329-T333 PolarHBondContact OE1-OG1 3.47Å; Q329-T333 VanDerWaalsContact OE1-OG1 3.05Å
330	S	94.8	Very high	94.2	Very high	47 Å²	47	52.9 Å²	52.9	33%	0.329	28%	0.282	S	S	.	.			trans	-148.8	173.1	169.9	70.5	0	0	0	0	109.9	R332 T333 A334	S330-R332 PolarHBondContact O-N 3.1Å; S330-R332 PolarHBondContact OG-N 3.4Å; S330-T333 PolarHBondContact N-OG1 3.11Å; S330-T333 PolarHBondContact O-N 2.75Å; S330-T333 PolarHBondContact O-OG1 3.22Å; S330-T333 VanDerWaalsContact O-OG1 3.08Å; S330-A334 PolarHBondContact O-N 3.5Å
331	D	92.6	Very high	94.2	Very high	142 Å²	142	46.3 Å²	46.3	76%	0.759	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-25.3	174.1	-61.1	-26	0	0	0	112.7	R283	R283-D331 PolarHBondContact NE-O 3.13Å
332	R	95.1	Very high	94.1	Very high	76 Å²	76	42.9 Å²	42.9	29%	0.287	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-8.8	178.2	-65.6	-162	-60.7	-119.2	-5	114.8	R283 E314 S330	R283-R332 VanDerWaalsContact CB-O 3.28Å; R283-R332 WeakPolarHBondContact CB-O 3.45Å; E314-R332 IonicContact OE1-CZ 3.69Å; E314-R332 IonicContact OE1-NE 3.1Å; E314-R332 PolarHBondContact OE1-NE 3.08Å; E314-R332 IonicContact OE1-NH2 3.53Å; E314-R332 PolarHBondContact OE1-NH2 2.97Å; E314-R332 IonicContact OE2-CZ 3.56Å; E314-R332 IonicContact OE2-NE 2.61Å; E314-R332 PolarHBondContact OE2-NE 3.15Å; E314-R332 IonicContact OE2-NH2 2.81Å; E314-R332 PolarHBondContact OE2-NH2 2.94Å; S330-R332 PolarHBondContact O-N 3.1Å; S330-R332 PolarHBondContact OG-N 3.4Å
333	T	95.1	Very high	94.2	Very high	3 Å²	3	40.6 Å²	40.6	2%	0.018	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108	-9	176.4	66.6	0	0	0	0	112.3	P285 L286 Y318 Q329 S330	P285-T333 HydrophobicContact CB-CG2 3.81Å; P285-T333 HydrophobicContact CG-CG2 4.04Å; L286-T333 VanDerWaalsContact CD2-O 3.28Å; L286-T333 WeakPolarHBondContact CD2-O 3.35Å; Y318-T333 HydrophobicContact CD2-CG2 3.53Å; Y318-T333 HydrophobicContact CE2-CG2 3.36Å; Y318-T333 HydrophobicContact CG-CG2 4.31Å; Q329-T333 VanDerWaalsContact CA-OG1 3.31Å; Q329-T333 WeakPolarHBondContact CA-OG1 3.5Å; Q329-T333 PolarHBondContact OE1-OG1 3.47Å; Q329-T333 VanDerWaalsContact OE1-OG1 3.05Å; S330-T333 PolarHBondContact N-OG1 3.11Å; S330-T333 PolarHBondContact O-N 2.75Å; S330-T333 PolarHBondContact O-OG1 3.22Å; S330-T333 VanDerWaalsContact O-OG1 3.08Å
334	A	93.6	Very high	94.1	Very high	38 Å²	38	37.3 Å²	37.3	31%	0.314	20%	0.204	S	C	.	.	S	Bend	trans	-77.9	143.2	176	0	0	0	0	0	111.4	R283 L286 S330 R336	R283-A334 VanDerWaalsContact CD-O 3.3Å; R283-A334 WeakPolarHBondContact CD-O 3.35Å; R283-A334 PolarHBondContact NH1-O 3.18Å; L286-A334 WeakPolarHBondContact CD1-O 3.42Å; S330-A334 PolarHBondContact O-N 3.5Å; A334-R336 PolarHBondContact O-N 3.21Å
335	I	93.4	Very high	94	Very high	7 Å²	7	35 Å²	35	4%	0.036	19%	0.193	C	C	.	.			trans	-56.1	137.1	172.4	-72.3	172.4	0	0	0	109.9	R283 S337 P416 R417 T635 F637	R283-I335 PolarHBondContact NH1-O 2.96Å; I335-S337 PolarHBondContact O-N 3.28Å; I335-P416 HydrophobicContact CD1-CB 4Å; I335-P416 HydrophobicContact CD1-CG 3.94Å; I335-R417 HydrophobicContact CD1-CB 4.43Å; I335-R417 HydrophobicContact CD1-CG 3.7Å; I335-R417 HydrophobicContact CG1-CB 4.46Å; I335-R417 HydrophobicContact CG1-CG 3.56Å; I335-T635 HydrophobicContact CB-CG2 3.96Å; I335-T635 VanDerWaalsContact CD1-O 3.31Å; I335-T635 WeakPolarHBondContact CD1-O 3.47Å; I335-T635 HydrophobicContact CG2-CG2 3.87Å; I335-F637 HydrophobicContact CD1-CE2 4.49Å; I335-F637 HydrophobicContact CG1-CE2 4.19Å; I335-F637 HydrophobicContact CG2-CD1 4.21Å; I335-F637 HydrophobicContact CG2-CD2 4.36Å; I335-F637 HydrophobicContact CG2-CE1 3.73Å; I335-F637 HydrophobicContact CG2-CE2 3.9Å; I335-F637 HydrophobicContact CG2-CZ 3.58Å
336	R	92.8	Very high	93.8	Very high	10 Å²	10	34.8 Å²	34.8	4%	0.038	19%	0.192	C	C	.	.	S	Bend	trans	-76.2	79.1	174.3	-171.5	-177.9	-62.6	-84.2	6.3	110.3	L244 S246 E254 N281 R283 A334	L244-R336 PolarHBondContact O-NH1 2.91Å; L244-R336 PolarHBondContact O-NH2 3.46Å; S246-R336 WeakPolarHBondContact O-CD 3.3Å; S246-R336 VanDerWaalsContact O-CG 3.27Å; S246-R336 WeakPolarHBondContact O-CG 3.48Å; S246-R336 PolarHBondContact O-NH1 2.92Å; E254-R336 IonicContact OE1-CZ 3.77Å; E254-R336 IonicContact OE1-NE 2.94Å; E254-R336 PolarHBondContact OE1-NE 2.89Å; E254-R336 IonicContact OE1-NH2 3.09Å; E254-R336 PolarHBondContact OE1-NH2 3.25Å; E254-R336 VanDerWaalsContact OE1-NH2 3.1Å; E254-R336 IonicContact OE2-NH2 3.87Å; E254-R336 PolarHBondContact OE2-NH2 3.3Å; N281-R336 PolarHBondContact O-NH2 2.72Å; R283-R336 VanDerWaalsContact NH1-N 3.2Å; A334-R336 PolarHBondContact O-N 3.21Å
337	S	91.6	Very high	93.4	Very high	24 Å²	24	34.6 Å²	34.6	17%	0.168	19%	0.191	C	C	.	.			trans	-155.7	141.6	176.6	-178.7	0	0	0	0	109.1	N247 I335 T339	N247-S337 CarbonylContact O-C 3.59Å; N247-S337 VanDerWaalsContact O-CA 3.28Å; N247-S337 WeakPolarHBondContact O-CA 3.32Å; I335-S337 PolarHBondContact O-N 3.28Å; S337-T339 PolarHBondContact OG-N 3.47Å; S337-T339 PolarHBondContact OG-O 3.29Å
338	D	88.9	Confident	93.1	Very high	90 Å²	90	32.4 Å²	32.4	48%	0.481	18%	0.178	S	C	.	.	S	Bend	trans	-91.3	-5.1	167.7	53.1	13.9	0	0	0	112.3	N247 S248	N247-D338 HydrophobicContact CB-CB 4.32Å; N247-D338 PolarHBondContact O-N 2.99Å; S248-D338 WeakPolarHBondContact CB-OD2 3.45Å; S248-D338 PolarHBondContact OG-OD2 2.98Å
339	T	89.3	Confident	92.6	Very high	34 Å²	34	31.2 Å²	31.2	21%	0.209	17%	0.172	C	C	.	.			trans	-98.2	125.7	-174.3	-46.7	0	0	0	0	110.8	S337 H341	S337-T339 PolarHBondContact OG-N 3.47Å; S337-T339 PolarHBondContact OG-O 3.29Å; T339-H341 WeakPolarHBondContact CG2-CE1 3.43Å; T339-H341 WeakPolarHBondContact CG2-NE2 3.26Å
340	T	92.4	Very high	91.4	Very high	51 Å²	51	32.5 Å²	32.5	31%	0.313	17%	0.174	S	C	.	.			trans	-107.6	148	169.5	-60.5	0	0	0	0	108.3	F585 T633 T635	T340-F585 HydrophobicContact CG2-CD2 4.45Å; T340-F585 HydrophobicContact CG2-CE2 4.23Å; T340-F585 WeakPolarHBondContact O-CE2 3.38Å; T340-T633 HydrophobicContact CG2-CG2 4.49Å; T340-T635 PolarHBondContact OG1-OG1 3.44Å
341	H	93.6	Very high	90.2	Very high	7 Å²	7	39.4 Å²	39.4	3%	0.032	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	145.7	-174.8	-62.4	-81.9	0	0	0	111.3	T339 V343 M361 Y362 T633 L634 V636	T339-H341 WeakPolarHBondContact CG2-CE1 3.43Å; T339-H341 WeakPolarHBondContact CG2-NE2 3.26Å; H341-V343 PolarHBondContact O-N 3.27Å; H341-M361 HydrophobicContact CB-CB 4.42Å; H341-M361 HydrophobicContact CB-CE 3.91Å; H341-M361 VanDerWaalsContact CD2-CE 3.4Å; H341-M361 WeakPolarHBondContact CD2-CE 3.48Å; H341-M361 WeakPolarHBondContact ND1-CE 3.5Å; H341-Y362 PolarHBondContact ND1-O 2.77Å; H341-T633 VanDerWaalsContact O-CA 3.27Å; H341-T633 WeakPolarHBondContact O-CA 3.44Å; H341-L634 PolarHBondContact N-O 2.91Å; H341-L634 PolarHBondContact O-N 3.16Å; H341-V636 HydrophobicContact CB-CG2 4.39Å
342	L	94.7	Very high	89.3	Confident	7 Å²	7	37.7 Å²	37.7	4%	0.037	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68	126.9	163.5	-179.6	67.3	0	0	0	108.7	M361 Y362 W369 A583 Y590 V592 F620 A631	L342-M361 CarbonylContact O-C 3.45Å; L342-M361 WeakPolarHBondContact O-CA 3.42Å; L342-Y362 PolarHBondContact O-N 2.78Å; L342-W369 HydrophobicContact CD2-CH2 3.95Å; L342-W369 HydrophobicContact CD2-CZ2 4.47Å; L342-W369 HydrophobicContact CG-CH2 4.21Å; L342-A583 HydrophobicContact CD1-CB 3.39Å; L342-Y590 HydrophobicContact CD2-CD1 4.38Å; L342-V592 HydrophobicContact CD2-CG2 4.29Å; L342-F620 HydrophobicContact CD2-CE2 4.43Å; L342-F620 HydrophobicContact CD2-CZ 4.12Å; L342-A631 HydrophobicContact CD1-CB 4.38Å
343	V	95.6	Very high	88.5	Confident	1 Å²	1	38.9 Å²	38.9	1%	0.006	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	135	-179.6	177	0	0	0	0	109.4	H341 L359 R360 M361 A631 C632 L634	H341-V343 PolarHBondContact O-N 3.27Å; V343-L359 HydrophobicContact CG1-CD1 3.38Å; V343-L359 HydrophobicContact CG1-CG 4Å; V343-R360 CarbonylContact C-O 3.43Å; V343-R360 VanDerWaalsContact CA-O 3.27Å; V343-R360 WeakPolarHBondContact CA-O 3.08Å; V343-M361 HydrophobicContact CG2-CB 4.13Å; V343-A631 CarbonylContact O-C 3.51Å; V343-A631 WeakPolarHBondContact O-CA 3.34Å; V343-C632 PolarHBondContact N-O 2.99Å; V343-C632 PolarHBondContact O-N 2.93Å; V343-L634 HydrophobicContact CB-CD1 4.37Å; V343-L634 HydrophobicContact CG1-CD1 4.25Å; V343-L634 HydrophobicContact CG2-CB 4Å; V343-L634 HydrophobicContact CG2-CD1 4.17Å; V343-L634 HydrophobicContact CG2-CG 4.29Å
344	T	94.6	Very high	88.1	Confident	6 Å²	6	41.9 Å²	41.9	4%	0.037	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	148.1	176.6	58	0	0	0	0	111.3	L359 R360 W369 V592 L622 I629 R630 A631	T344-L359 WeakPolarHBondContact O-CA 3.35Å; T344-R360 PolarHBondContact N-O 2.77Å; T344-R360 PolarHBondContact O-N 3.1Å; T344-W369 HydrophobicContact CG2-CH2 3.39Å; T344-W369 HydrophobicContact CG2-CZ2 4.35Å; T344-W369 HydrophobicContact CG2-CZ3 3.7Å; T344-W369 WeakPolarHBondContact OG1-CZ3 3.4Å; T344-V592 HydrophobicContact CG2-CG1 3.76Å; T344-L622 HydrophobicContact CG2-CD2 4.39Å; T344-I629 HydrophobicContact CG2-CD1 4.08Å; T344-R630 CarbonylContact C-O 3.51Å; T344-R630 VanDerWaalsContact CA-O 3.25Å; T344-R630 WeakPolarHBondContact CA-O 3.23Å; T344-A631 HydrophobicContact CG2-CB 4.23Å
345	L	94.4	Very high	87.9	Confident	3 Å²	3	40.8 Å²	40.8	2%	0.016	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	135.7	-178	178.3	70.8	0	0	0	111.8	E358 L359 M375 H382 I384 V393 W421 R630	L345-E358 WeakPolarHBondContact CA-O 3.18Å; L345-L359 HydrophobicContact CB-CD1 3.96Å; L345-L359 HydrophobicContact CD1-CB 4.04Å; L345-L359 HydrophobicContact CD1-CD1 3.91Å; L345-L359 HydrophobicContact CG-CD1 4.42Å; L345-M375 HydrophobicContact CD1-CG 4.06Å; L345-M375 HydrophobicContact CD1-SD 3.86Å; L345-M375 HydrophobicContact CD2-SD 4Å; L345-M375 HydrophobicContact CG-SD 4.36Å; L345-H382 WeakPolarHBondContact CD2-NE2 3.39Å; L345-I384 HydrophobicContact CD2-CG2 4.29Å; L345-V393 HydrophobicContact CD2-CB 4.19Å; L345-V393 HydrophobicContact CD2-CG1 3.92Å; L345-V393 HydrophobicContact CD2-CG2 3.17Å; L345-W421 HydrophobicContact CD1-CH2 4.43Å; L345-W421 HydrophobicContact CD1-CZ2 4.39Å; L345-W421 HydrophobicContact CD2-CH2 4.33Å; L345-R630 PolarHBondContact N-O 3.26Å; L345-R630 PolarHBondContact O-N 3.19Å
346	G	91.7	Very high	87.9	Confident	2 Å²	2	41.1 Å²	41.1	2%	0.021	21%	0.211	C	C	.	.			trans	63.7	-145.6	164	0	0	0	0	0	113.5	S356 E358 R379	G346-S356 WeakPolarHBondContact CA-O 3.25Å; G346-E358 PolarHBondContact N-O 3.11Å; G346-R379 WeakPolarHBondContact CA-O 3.3Å
347	G	90.4	Very high	87.9	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.227	C	C	.	.			trans	97.3	-178	-173.6	0	0	0	0	0	112.6	V355 S356 R379 G627	G347-V355 CarbonylContact O-C 3.52Å; G347-V355 WeakPolarHBondContact O-CA 3.38Å; G347-S356 PolarHBondContact O-N 3.26Å; G347-R379 PolarHBondContact N-O 3.47Å; G347-G627 CarbonylContact C-O 3.58Å; G347-G627 WeakPolarHBondContact CA-O 3.41Å
348	V	89.7	Confident	88	Confident	3 Å²	3	46 Å²	46	2%	0.018	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	134.1	-175.1	65.8	0	0	0	0	112.1	R350 V354 V355 Y380 Y400 M602 G627	V348-R350 PolarHBondContact O-N 3.37Å; V348-V354 WeakPolarHBondContact CA-O 3.25Å; V348-V354 WeakPolarHBondContact CG2-O 3.47Å; V348-V355 HydrophobicContact CB-CG2 4.45Å; V348-V355 HydrophobicContact CG2-CG2 4.12Å; V348-Y380 HydrophobicContact CB-CD2 4.4Å; V348-Y380 HydrophobicContact CB-CG 4.21Å; V348-Y380 HydrophobicContact CG1-CD2 4.1Å; V348-Y380 HydrophobicContact CG1-CG 4.4Å; V348-Y400 HydrophobicContact CG1-CD2 4.09Å; V348-Y400 HydrophobicContact CG1-CE2 4.34Å; V348-Y400 HydrophobicContact CG2-CD2 3.85Å; V348-M602 HydrophobicContact CG1-CE 4.17Å; V348-G627 PolarHBondContact N-O 3.4Å; V348-G627 PolarHBondContact O-N 3.05Å
349	L	84.5	Confident	88.2	Confident	33 Å²	33	41.8 Å²	41.8	17%	0.173	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	94.5	165.6	-67.4	97.2	0	0	0	108.5	Q351 Q352 L353 V354 E624 L626	L349-Q351 VanDerWaalsContact C-N 3.25Å; L349-Q351 PolarHBondContact O-N 2.5Å; L349-Q351 VanDerWaalsContact O-N 3.16Å; L349-Q352 HydrophobicContact CB-CB 4.49Å; L349-Q352 CarbonylContact O-C 3.51Å; L349-Q352 PolarHBondContact O-N 3.03Å; L349-L353 PolarHBondContact O-N 2.86Å; L349-V354 PolarHBondContact N-O 2.84Å; L349-V354 PolarHBondContact O-N 2.92Å; L349-E624 HydrophobicContact CD2-CB 4.44Å; L349-E624 HydrophobicContact CD2-CG 4.48Å; L349-L626 HydrophobicContact CD1-CD2 3.36Å; L349-L626 HydrophobicContact CG-CD2 3.67Å
350	R	71	Confident	88.5	Confident	99 Å²	99	41.8 Å²	41.8	37%	0.374	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-30.6	-172.5	-177.7	172.5	177.3	178.1	-0.7	114.6	V348 Q352 L353 Y400 Y595 M602	V348-R350 PolarHBondContact O-N 3.37Å; R350-Q352 VanDerWaalsContact C-N 3.26Å; R350-Q352 PolarHBondContact O-N 3.45Å; R350-L353 VanDerWaalsContact O-CD2 3.32Å; R350-L353 WeakPolarHBondContact O-CD2 3.36Å; R350-L353 PolarHBondContact O-N 2.86Å; R350-Y400 PolarHBondContact NE-OH 2.77Å; R350-Y595 PolarHBondContact NH1-OH 2.98Å; R350-M602 HydrophobicContact CB-CE 3.53Å; R350-M602 HydrophobicContact CB-CG 4.1Å; R350-M602 HydrophobicContact CG-CE 4.31Å
351	Q	69.7	Low	88.5	Confident	191 Å²	191	39.4 Å²	39.4	89%	0.893	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-31.4	178	-69.3	165.7	-8.8	0	0	112.3	L349	L349-Q351 VanDerWaalsContact C-N 3.25Å; L349-Q351 PolarHBondContact O-N 2.5Å; L349-Q351 VanDerWaalsContact O-N 3.16Å
352	Q	72.4	Confident	88.4	Confident	106 Å²	106	40 Å²	40	50%	0.495	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.7	-10.2	-179.7	-61.6	175.2	-0.8	0	0	112.2	L349 R350 V354	L349-Q352 HydrophobicContact CB-CB 4.49Å; L349-Q352 CarbonylContact O-C 3.51Å; L349-Q352 PolarHBondContact O-N 3.03Å; R350-Q352 VanDerWaalsContact C-N 3.26Å; R350-Q352 PolarHBondContact O-N 3.45Å; Q352-V354 HydrophobicContact CB-CB 4.25Å; Q352-V354 HydrophobicContact CB-CG2 3.79Å; Q352-V354 PolarHBondContact O-N 3.32Å
353	L	79.9	Confident	88.1	Confident	102 Å²	102	40.2 Å²	40.2	53%	0.534	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.3	26	-171.3	-55.5	174.3	0	0	0	112.9	L349 R350 Y400	L349-L353 PolarHBondContact O-N 2.86Å; R350-L353 VanDerWaalsContact O-CD2 3.32Å; R350-L353 WeakPolarHBondContact O-CD2 3.36Å; R350-L353 PolarHBondContact O-N 2.86Å; L353-Y400 HydrophobicContact CD2-CD1 3.58Å; L353-Y400 HydrophobicContact CD2-CE1 3.94Å; L353-Y400 HydrophobicContact CD2-CG 3.9Å
354	V	85.6	Confident	87.5	Confident	65 Å²	65	43.6 Å²	43.6	39%	0.394	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	125.4	-178.8	176.9	0	0	0	0	109.6	V348 L349 Q352	V348-V354 WeakPolarHBondContact CA-O 3.25Å; V348-V354 WeakPolarHBondContact CG2-O 3.47Å; L349-V354 PolarHBondContact N-O 2.84Å; L349-V354 PolarHBondContact O-N 2.92Å; Q352-V354 HydrophobicContact CB-CB 4.25Å; Q352-V354 HydrophobicContact CB-CG2 3.79Å; Q352-V354 PolarHBondContact O-N 3.32Å
355	V	90.7	Very high	87	Confident	16 Å²	16	50.3 Å²	50.3	10%	0.097	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	132.8	175.6	-174.7	0	0	0	0	108.8	G347 V348 P378 Y380 S398	G347-V355 CarbonylContact O-C 3.52Å; G347-V355 WeakPolarHBondContact O-CA 3.38Å; V348-V355 HydrophobicContact CB-CG2 4.45Å; V348-V355 HydrophobicContact CG2-CG2 4.12Å; V355-P378 HydrophobicContact CB-CB 3.87Å; V355-P378 HydrophobicContact CB-CG 4.36Å; V355-P378 HydrophobicContact CG1-CB 3.76Å; V355-P378 WeakPolarHBondContact O-CB 3.45Å; V355-Y380 HydrophobicContact CB-CD1 4.34Å; V355-Y380 HydrophobicContact CG1-CD1 3.73Å; V355-Y380 HydrophobicContact CG1-CG 4.29Å; V355-Y380 HydrophobicContact CG2-CD1 3.55Å; V355-Y380 HydrophobicContact CG2-CE1 3.99Å; V355-Y380 HydrophobicContact CG2-CG 4.42Å; V355-S398 WeakPolarHBondContact CB-O 3.5Å; V355-S398 VanDerWaalsContact CG2-O 3.27Å; V355-S398 WeakPolarHBondContact CG2-O 3.05Å
356	S	91.7	Very high	86.6	Confident	13 Å²	13	53.1 Å²	53.1	9%	0.091	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-82.3	148.2	179.6	-178.7	0	0	0	0	111.8	G346 G347 E358 P378 R379	G346-S356 WeakPolarHBondContact CA-O 3.25Å; G347-S356 PolarHBondContact O-N 3.26Å; S356-E358 PolarHBondContact OG-N 3.36Å; S356-E358 VanDerWaalsContact OG-N 3.12Å; S356-P378 WeakPolarHBondContact O-CA 3.15Å; S356-P378 WeakPolarHBondContact O-CB 3.26Å; S356-R379 PolarHBondContact O-N 3.47Å
357	K	92.6	Very high	86.3	Confident	88 Å²	88	59.6 Å²	59.6	38%	0.383	28%	0.283	S	S	.	.			trans	-113.5	0.7	170.6	65.1	-176.6	-172.4	169.5	0	112.5	P374 M375 P378	K357-P374 HydrophobicContact CD-CB 4.49Å; K357-P374 HydrophobicContact CG-CB 4.14Å; K357-P374 WeakPolarHBondContact O-CA 3.48Å; K357-M375 HydrophobicContact CB-CB 4.32Å; K357-M375 WeakPolarHBondContact CD-O 3.48Å; K357-M375 PolarHBondContact O-N 2.95Å; K357-P378 HydrophobicContact CB-CB 4.1Å
358	E	93.7	Very high	86.2	Confident	50 Å²	50	65.1 Å²	65.1	23%	0.234	31%	0.309	C	S	.	.			trans	-76.4	131.1	-170.1	-61.8	-57.2	126.4	0	0	110.8	L345 G346 S356 R360	L345-E358 WeakPolarHBondContact CA-O 3.18Å; G346-E358 PolarHBondContact N-O 3.11Å; S356-E358 PolarHBondContact OG-N 3.36Å; S356-E358 VanDerWaalsContact OG-N 3.12Å; E358-R360 HydrophobicContact CB-CG 4.37Å
359	L	94.6	Very high	86.2	Confident	0 Å²	0	67 Å²	67	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	121.1	167.1	-176.9	72.4	0	0	0	107.2	V343 T344 L345 L372 L391 F414 W421	V343-L359 HydrophobicContact CG1-CD1 3.38Å; V343-L359 HydrophobicContact CG1-CG 4Å; T344-L359 WeakPolarHBondContact O-CA 3.35Å; L345-L359 HydrophobicContact CB-CD1 3.96Å; L345-L359 HydrophobicContact CD1-CB 4.04Å; L345-L359 HydrophobicContact CD1-CD1 3.91Å; L345-L359 HydrophobicContact CG-CD1 4.42Å; L359-L372 HydrophobicContact CB-CB 4.2Å; L359-L372 HydrophobicContact CD2-CB 3.72Å; L359-L372 HydrophobicContact CD2-CD1 3.74Å; L359-L372 HydrophobicContact CD2-CG 4.38Å; L359-L372 HydrophobicContact CG-CB 3.97Å; L359-L372 HydrophobicContact CG-CD1 4.02Å; L359-L372 PolarHBondContact O-N 2.8Å; L359-L391 HydrophobicContact CD1-CD2 3.8Å; L359-F414 HydrophobicContact CD2-CD1 3.81Å; L359-F414 HydrophobicContact CD2-CD2 3.91Å; L359-F414 HydrophobicContact CD2-CE1 3.64Å; L359-F414 HydrophobicContact CD2-CE2 3.75Å; L359-F414 HydrophobicContact CD2-CG 3.93Å; L359-F414 HydrophobicContact CD2-CZ 3.61Å; L359-W421 HydrophobicContact CB-CZ2 4.32Å; L359-W421 HydrophobicContact CD1-CZ2 4.45Å; L359-W421 HydrophobicContact CD2-CZ2 3.83Å; L359-W421 HydrophobicContact CG-CZ2 4.43Å
360	R	94.2	Very high	86.5	Confident	35 Å²	35	67.7 Å²	67.7	13%	0.132	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	136.5	-176.4	-62.5	178.6	177.3	161	-1.6	110.5	V343 T344 E358 W369 K370 E624	V343-R360 CarbonylContact C-O 3.43Å; V343-R360 VanDerWaalsContact CA-O 3.27Å; V343-R360 WeakPolarHBondContact CA-O 3.08Å; T344-R360 PolarHBondContact N-O 2.77Å; T344-R360 PolarHBondContact O-N 3.1Å; E358-R360 HydrophobicContact CB-CG 4.37Å; R360-W369 HydrophobicContact CB-CE3 3.79Å; R360-W369 HydrophobicContact CB-CZ3 4.4Å; R360-K370 CarbonylContact C-O 3.55Å; R360-K370 WeakPolarHBondContact CA-O 3.49Å; R360-E624 IonicContact CZ-OE1 2.83Å; R360-E624 IonicContact NH1-OE1 3.88Å; R360-E624 PolarHBondContact NH1-OE1 2.79Å; R360-E624 IonicContact NH2-OE1 3.37Å; R360-E624 PolarHBondContact NH2-OE1 3.01Å
361	M	93.6	Very high	87.6	Confident	0 Å²	0	66.2 Å²	66.2	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	143.3	170.9	66.2	175.3	-64.4	0	0	110.5	H341 L342 V343 W369 K370 L372 V636 P638	H341-M361 HydrophobicContact CB-CB 4.42Å; H341-M361 HydrophobicContact CB-CE 3.91Å; H341-M361 VanDerWaalsContact CD2-CE 3.4Å; H341-M361 WeakPolarHBondContact CD2-CE 3.48Å; H341-M361 WeakPolarHBondContact ND1-CE 3.5Å; L342-M361 CarbonylContact O-C 3.45Å; L342-M361 WeakPolarHBondContact O-CA 3.42Å; V343-M361 HydrophobicContact CG2-CB 4.13Å; M361-W369 CarbonylContact O-C 3.58Å; M361-W369 WeakPolarHBondContact O-CA 3.38Å; M361-K370 HydrophobicContact CG-CB 3.94Å; M361-K370 PolarHBondContact N-O 2.9Å; M361-K370 PolarHBondContact O-N 3.27Å; M361-L372 HydrophobicContact CB-CD1 4.17Å; M361-L372 HydrophobicContact CB-CG 4.4Å; M361-L372 HydrophobicContact CG-CD2 4.33Å; M361-L372 HydrophobicContact CG-CG 4.27Å; M361-L372 HydrophobicContact SD-CD2 3.92Å; M361-L372 HydrophobicContact SD-CG 4.46Å; M361-V636 HydrophobicContact CB-CG2 4.48Å; M361-V636 HydrophobicContact CE-CG2 3.53Å; M361-V636 HydrophobicContact SD-CG2 3.64Å; M361-P638 HydrophobicContact CE-CB 4.32Å; M361-P638 HydrophobicContact CE-CG 4.34Å; M361-P638 HydrophobicContact SD-CB 4.5Å
362	Y	90.9	Very high	88.8	Confident	19 Å²	19	57.5 Å²	57.5	8%	0.075	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	121.8	171	-174.3	-110.3	0	0	0	109.7	H341 L342 E364 H367 W369 F620	H341-Y362 PolarHBondContact ND1-O 2.77Å; L342-Y362 PolarHBondContact O-N 2.78Å; Y362-E364 HydrophobicContact CD1-CG 4.05Å; Y362-E364 HydrophobicContact CE1-CG 4.08Å; Y362-H367 PolarHBondContact OH-ND1 2.89Å; Y362-H367 VanDerWaalsContact OH-ND1 3.1Å; Y362-W369 HydrophobicContact CD2-CD2 4.15Å; Y362-W369 AromaticContact CD2-CE2 3.92Å; Y362-W369 HydrophobicContact CD2-CG 4.39Å; Y362-W369 HydrophobicContact CD2-CZ2 4.34Å; Y362-W369 AromaticContact CD2-NE1 3.97Å; Y362-F620 AromaticContact CD1-CE1 3.9Å; Y362-F620 HydrophobicContact CD1-CE1 3.9Å; Y362-F620 AromaticContact CD1-CZ 3.8Å; Y362-F620 HydrophobicContact CD1-CZ 3.8Å; Y362-F620 HydrophobicContact CD2-CE1 4.34Å; Y362-F620 HydrophobicContact CD2-CE2 4.15Å; Y362-F620 HydrophobicContact CD2-CZ 4.01Å; Y362-F620 HydrophobicContact CE1-CD1 4.04Å; Y362-F620 AromaticContact CE1-CE1 3.33Å; Y362-F620 HydrophobicContact CE1-CE1 3.33Å; Y362-F620 AromaticContact CE1-CZ 3.73Å; Y362-F620 HydrophobicContact CE1-CZ 3.73Å; Y362-F620 AromaticContact CE2-CD1 3.93Å; Y362-F620 HydrophobicContact CE2-CD1 3.93Å; Y362-F620 HydrophobicContact CE2-CD2 4.27Å; Y362-F620 AromaticContact CE2-CE1 3.83Å; Y362-F620 HydrophobicContact CE2-CE1 3.83Å; Y362-F620 HydrophobicContact CE2-CE2 4.16Å; Y362-F620 HydrophobicContact CE2-CG 4.18Å; Y362-F620 AromaticContact CE2-CZ 3.95Å; Y362-F620 HydrophobicContact CE2-CZ 3.95Å; Y362-F620 HydrophobicContact CG-CE1 4.37Å; Y362-F620 HydrophobicContact CG-CE2 4.42Å; Y362-F620 AromaticContact CG-CZ 3.94Å; Y362-F620 HydrophobicContact CG-CZ 3.94Å; Y362-F620 AromaticContact CZ-CD1 3.51Å; Y362-F620 AromaticContact CZ-CE1 3.29Å; Y362-F620 AromaticContact CZ-CZ 3.81Å; Y362-F620 WeakPolarHBondContact OH-CD1 3.42Å
363	D	88.1	Confident	89.8	Confident	13 Å²	13	53.5 Å²	53.5	7%	0.07	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	108.9	172.3	-173	-13.2	0	0	0	109.4	K365 T366 H367 E368 K370	D363-K365 PolarHBondContact O-N 3.11Å; D363-K365 WeakPolarHBondContact OD1-CB 3.45Å; D363-K365 PolarHBondContact OD1-N 3.38Å; D363-T366 WeakPolarHBondContact CB-OG1 3.32Å; D363-T366 PolarHBondContact O-N 2.92Å; D363-H367 VanDerWaalsContact O-CA 3.27Å; D363-H367 WeakPolarHBondContact O-CA 3.36Å; D363-H367 PolarHBondContact O-N 2.93Å; D363-E368 PolarHBondContact N-O 2.59Å; D363-E368 PolarHBondContact O-N 2.83Å; D363-K370 HydrophobicContact CB-CD 4.22Å; D363-K370 WeakPolarHBondContact OD2-CE 3.26Å; D363-K370 IonicContact OD2-NZ 2.72Å; D363-K370 PolarHBondContact OD2-NZ 2.91Å
364	E	83.7	Confident	90.5	Very high	72 Å²	72	51.1 Å²	51.1	34%	0.336	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-24.7	-179.4	-58.4	-163.6	128.3	0	0	113.5	Y362 H367 F585	Y362-E364 HydrophobicContact CD1-CG 4.05Å; Y362-E364 HydrophobicContact CE1-CG 4.08Å; E364-H367 PolarHBondContact O-CE1 3.02Å; E364-H367 VanDerWaalsContact O-CE1 3.28Å; E364-H367 PolarHBondContact O-ND1 3.06Å; E364-F585 WeakPolarHBondContact OE1-CE1 3.15Å
365	K	84.1	Confident	90.9	Very high	146 Å²	146	48.1 Å²	48.1	64%	0.635	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-37.9	-178.1	-66.7	174.4	-176	145.2	0	111.8	D363	D363-K365 PolarHBondContact O-N 3.11Å; D363-K365 WeakPolarHBondContact OD1-CB 3.45Å; D363-K365 PolarHBondContact OD1-N 3.38Å
366	T	85.8	Confident	90.9	Very high	63 Å²	63	54.2 Å²	54.2	39%	0.387	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.9	-10.4	178.5	65.6	0	0	0	0	112.4	D363 E368	D363-T366 WeakPolarHBondContact CB-OG1 3.32Å; D363-T366 PolarHBondContact O-N 2.92Å; T366-E368 PolarHBondContact O-N 3.46Å
367	H	86.3	Confident	90.8	Very high	137 Å²	137	54.9 Å²	54.9	63%	0.634	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.2	31.8	-171.4	-62.3	-66.8	0	0	0	113.5	Y362 D363 E364	Y362-H367 PolarHBondContact OH-ND1 2.89Å; Y362-H367 VanDerWaalsContact OH-ND1 3.1Å; D363-H367 VanDerWaalsContact O-CA 3.27Å; D363-H367 WeakPolarHBondContact O-CA 3.36Å; D363-H367 PolarHBondContact O-N 2.93Å; E364-H367 PolarHBondContact O-CE1 3.02Å; E364-H367 VanDerWaalsContact O-CE1 3.28Å; E364-H367 PolarHBondContact O-ND1 3.06Å
368	E	88.4	Confident	90.8	Very high	117 Å²	117	52.5 Å²	52.5	55%	0.547	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	151.9	-175.7	-70.1	176.6	157.4	0	0	112.3	D363 T366	D363-E368 PolarHBondContact N-O 2.59Å; D363-E368 PolarHBondContact O-N 2.83Å; T366-E368 PolarHBondContact O-N 3.46Å
369	W	89.1	Confident	90.7	Very high	43 Å²	43	50.5 Å²	50.5	16%	0.163	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	125.7	169	-70.8	94.7	0	0	0	110.3	L342 T344 R360 M361 Y362 F620 L622 P623	L342-W369 HydrophobicContact CD2-CH2 3.95Å; L342-W369 HydrophobicContact CD2-CZ2 4.47Å; L342-W369 HydrophobicContact CG-CH2 4.21Å; T344-W369 HydrophobicContact CG2-CH2 3.39Å; T344-W369 HydrophobicContact CG2-CZ2 4.35Å; T344-W369 HydrophobicContact CG2-CZ3 3.7Å; T344-W369 WeakPolarHBondContact OG1-CZ3 3.4Å; R360-W369 HydrophobicContact CB-CE3 3.79Å; R360-W369 HydrophobicContact CB-CZ3 4.4Å; M361-W369 CarbonylContact O-C 3.58Å; M361-W369 WeakPolarHBondContact O-CA 3.38Å; Y362-W369 HydrophobicContact CD2-CD2 4.15Å; Y362-W369 AromaticContact CD2-CE2 3.92Å; Y362-W369 HydrophobicContact CD2-CG 4.39Å; Y362-W369 HydrophobicContact CD2-CZ2 4.34Å; Y362-W369 AromaticContact CD2-NE1 3.97Å; W369-F620 HydrophobicContact CZ2-CD2 4.42Å; W369-F620 AromaticContact CZ2-CE2 3.73Å; W369-F620 HydrophobicContact CZ2-CE2 3.73Å; W369-L622 HydrophobicContact CH2-CD2 4.1Å; W369-L622 HydrophobicContact CZ2-CD2 3.5Å; W369-P623 HydrophobicContact CB-CG 3.98Å; W369-P623 HydrophobicContact CG-CG 3.91Å
370	K	91.6	Very high	90.5	Very high	47 Å²	47	50.8 Å²	50.8	20%	0.204	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	135.7	176.5	-65.7	179.2	177.5	173.7	0	110.3	R360 M361 D363 P639	R360-K370 CarbonylContact C-O 3.55Å; R360-K370 WeakPolarHBondContact CA-O 3.49Å; M361-K370 HydrophobicContact CG-CB 3.94Å; M361-K370 PolarHBondContact N-O 2.9Å; M361-K370 PolarHBondContact O-N 3.27Å; D363-K370 HydrophobicContact CB-CD 4.22Å; D363-K370 WeakPolarHBondContact OD2-CE 3.26Å; D363-K370 IonicContact OD2-NZ 2.72Å; D363-K370 PolarHBondContact OD2-NZ 2.91Å; K370-P639 HydrophobicContact CB-CG 4.16Å; K370-P639 HydrophobicContact CD-CG 4.47Å
371	S	92.4	Very high	90.5	Very high	67 Å²	67	49.4 Å²	49.4	47%	0.469	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	134	176.5	-65	0	0	0	0	111.3
372	L	94.9	Very high	90.6	Very high	9 Å²	9	49.4 Å²	49.4	5%	0.047	26%	0.258	C	S	.	.			trans	-96.9	-178.1	163.7	-64.6	177.2	0	0	0	109	L359 M361 P374 F414 V636	L359-L372 HydrophobicContact CB-CB 4.2Å; L359-L372 HydrophobicContact CD2-CB 3.72Å; L359-L372 HydrophobicContact CD2-CD1 3.74Å; L359-L372 HydrophobicContact CD2-CG 4.38Å; L359-L372 HydrophobicContact CG-CB 3.97Å; L359-L372 HydrophobicContact CG-CD1 4.02Å; L359-L372 PolarHBondContact O-N 2.8Å; M361-L372 HydrophobicContact CB-CD1 4.17Å; M361-L372 HydrophobicContact CB-CG 4.4Å; M361-L372 HydrophobicContact CG-CD2 4.33Å; M361-L372 HydrophobicContact CG-CG 4.27Å; M361-L372 HydrophobicContact SD-CD2 3.92Å; M361-L372 HydrophobicContact SD-CG 4.46Å; L372-P374 WeakPolarHBondContact O-CD 3.28Å; L372-F414 HydrophobicContact CB-CZ 4.3Å; L372-F414 HydrophobicContact CD1-CE1 4.2Å; L372-F414 HydrophobicContact CD1-CZ 4.17Å; L372-V636 HydrophobicContact CD1-CG1 4.11Å
373	A	94.6	Very high	90.9	Very high	21 Å²	21	48.7 Å²	48.7	17%	0.174	26%	0.256	C	S	.	.	P	Polyproline II helix	trans	-59.7	123.6	176.9	0	0	0	0	0	109.9	F414 N419 W421	A373-F414 HydrophobicContact CB-CE2 4.35Å; A373-N419 WeakPolarHBondContact CB-O 3.31Å; A373-N419 WeakPolarHBondContact CB-OD1 3.35Å; A373-N419 PolarHBondContact N-ND2 2.85Å; A373-N419 PolarHBondContact N-OD1 3.01Å; A373-W421 PolarHBondContact O-NE1 2.81Å
374	P	94.9	Very high	91.3	Very high	52 Å²	52	49.4 Å²	49.4	34%	0.338	26%	0.259	S	S	.	.	P	Polyproline II helix	trans	-70.9	161.1	179.1	30.5	-35	0	0	0	110.6	K357 L372 W421	K357-P374 HydrophobicContact CD-CB 4.49Å; K357-P374 HydrophobicContact CG-CB 4.14Å; K357-P374 WeakPolarHBondContact O-CA 3.48Å; L372-P374 WeakPolarHBondContact O-CD 3.28Å; P374-W421 PolarHBondContact O-NE1 3.43Å
375	M	94	Very high	92	Very high	3 Å²	3	46.5 Å²	46.5	2%	0.015	25%	0.247	C	C	.	.	P	Polyproline II helix	trans	-69.5	153.8	167.9	-65.1	-175.6	63.4	0	0	110.8	L345 K357 A377 R379 V393 F412 W421	L345-M375 HydrophobicContact CD1-CG 4.06Å; L345-M375 HydrophobicContact CD1-SD 3.86Å; L345-M375 HydrophobicContact CD2-SD 4Å; L345-M375 HydrophobicContact CG-SD 4.36Å; K357-M375 HydrophobicContact CB-CB 4.32Å; K357-M375 WeakPolarHBondContact CD-O 3.48Å; K357-M375 PolarHBondContact O-N 2.95Å; M375-A377 VanDerWaalsContact C-N 3.33Å; M375-A377 WeakPolarHBondContact CB-O 3.46Å; M375-R379 HydrophobicContact CE-CG 3.55Å; M375-R379 HydrophobicContact SD-CB 4.36Å; M375-R379 HydrophobicContact SD-CG 3.88Å; M375-V393 HydrophobicContact CE-CB 4.28Å; M375-V393 HydrophobicContact CE-CG1 3.83Å; M375-V393 HydrophobicContact SD-CB 4.38Å; M375-V393 HydrophobicContact SD-CG1 3.86Å; M375-V393 HydrophobicContact SD-CG2 4.31Å; M375-F412 HydrophobicContact CE-CB 4.15Å; M375-F412 HydrophobicContact CE-CD2 3.53Å; M375-F412 HydrophobicContact CE-CE2 4.18Å; M375-F412 HydrophobicContact CE-CG 3.99Å; M375-W421 HydrophobicContact CG-CD2 4.31Å; M375-W421 HydrophobicContact CG-CH2 3.86Å; M375-W421 HydrophobicContact CG-CZ2 3.63Å; M375-W421 HydrophobicContact CG-CZ3 4.29Å; M375-W421 HydrophobicContact SD-CH2 4.27Å
376	D	89.8	Confident	92.7	Very high	144 Å²	144	41.8 Å²	41.8	77%	0.77	23%	0.231	S	C	*	.	S	Bend	trans	-66	-38.3	172.7	-67.2	-30	0	0	0	111.8
377	A	89.3	Confident	93.3	Very high	26 Å²	26	39.3 Å²	39.3	22%	0.215	22%	0.215	C	C	.	.	S	Bend	trans	-117.3	137.6	179.3	0	0	0	0	0	111.2	M375	M375-A377 VanDerWaalsContact C-N 3.33Å; M375-A377 WeakPolarHBondContact CB-O 3.46Å
378	P	92.2	Very high	93.7	Very high	39 Å²	39	34.2 Å²	34.2	25%	0.253	20%	0.2	S	C	.	.			trans	-69.1	151.8	179.2	31.6	-37	0	0	0	111.9	V355 S356 K357 S398	V355-P378 HydrophobicContact CB-CB 3.87Å; V355-P378 HydrophobicContact CB-CG 4.36Å; V355-P378 HydrophobicContact CG1-CB 3.76Å; V355-P378 WeakPolarHBondContact O-CB 3.45Å; S356-P378 WeakPolarHBondContact O-CA 3.15Å; S356-P378 WeakPolarHBondContact O-CB 3.26Å; K357-P378 HydrophobicContact CB-CB 4.1Å; P378-S398 WeakPolarHBondContact O-CA 3.47Å
379	R	92.7	Very high	94.2	Very high	8 Å²	8	30.6 Å²	30.6	3%	0.03	18%	0.184	C	C	.	.			trans	-141.9	131.5	-176.7	-66.5	-71.6	175.1	-100.2	9.3	111.8	G346 G347 S356 M375 H382 V393 G395 S398 T410	G346-R379 WeakPolarHBondContact CA-O 3.3Å; G347-R379 PolarHBondContact N-O 3.47Å; S356-R379 PolarHBondContact O-N 3.47Å; M375-R379 HydrophobicContact CE-CG 3.55Å; M375-R379 HydrophobicContact SD-CB 4.36Å; M375-R379 HydrophobicContact SD-CG 3.88Å; R379-H382 HydrophobicContact CB-CB 4.29Å; R379-H382 WeakPolarHBondContact CB-ND1 3.17Å; R379-H382 PolarHBondContact O-ND1 3.49Å; R379-V393 HydrophobicContact CG-CG1 4.24Å; R379-G395 WeakPolarHBondContact CD-O 3.2Å; R379-S398 PolarHBondContact NH1-OG 2.89Å; R379-T410 PolarHBondContact NH2-OG1 3.37Å
380	Y	90.7	Very high	94.6	Very high	5 Å²	5	28.7 Å²	28.7	2%	0.02	18%	0.177	C	C	.	.	B	Isolated β-bridge	trans	-133.2	159.2	161.2	80.3	-69.7	0	0	0	109.9	V348 V355 H382 Q397 N399 Y400 D401	V348-Y380 HydrophobicContact CB-CD2 4.4Å; V348-Y380 HydrophobicContact CB-CG 4.21Å; V348-Y380 HydrophobicContact CG1-CD2 4.1Å; V348-Y380 HydrophobicContact CG1-CG 4.4Å; V355-Y380 HydrophobicContact CB-CD1 4.34Å; V355-Y380 HydrophobicContact CG1-CD1 3.73Å; V355-Y380 HydrophobicContact CG1-CG 4.29Å; V355-Y380 HydrophobicContact CG2-CD1 3.55Å; V355-Y380 HydrophobicContact CG2-CE1 3.99Å; V355-Y380 HydrophobicContact CG2-CG 4.42Å; Y380-H382 PolarHBondContact O-N 2.88Å; Y380-H382 VanDerWaalsContact O-N 3.08Å; Y380-Q397 HydrophobicContact CD1-CB 3.95Å; Y380-Q397 VanDerWaalsContact CD1-O 3.26Å; Y380-Q397 WeakPolarHBondContact CD1-O 3.4Å; Y380-Q397 HydrophobicContact CE1-CB 3.25Å; Y380-Q397 HydrophobicContact CE1-CG 4.38Å; Y380-Q397 PolarHBondContact N-O 2.9Å; Y380-Q397 VanDerWaalsContact N-O 3.11Å; Y380-Q397 PolarHBondContact O-N 3.18Å; Y380-Q397 PolarHBondContact OH-NE2 2.98Å; Y380-N399 VanDerWaalsContact CE1-O 3.29Å; Y380-N399 WeakPolarHBondContact CE1-O 3.2Å; Y380-N399 PolarHBondContact OH-O 3.14Å; Y380-Y400 HydrophobicContact CE2-CD2 4.43Å; Y380-Y400 WeakPolarHBondContact OH-CA 3.44Å; Y380-D401 PolarHBondContact OH-N 3.2Å; Y380-D401 PolarHBondContact OH-O 2.98Å
381	Q	93.3	Very high	94.9	Very high	7 Å²	7	26.5 Å²	26.5	3%	0.033	17%	0.168	C	C	.	.	S	Bend	trans	56.2	24.4	-176.7	-69.7	-72.5	1.6	0	0	114.6	G396 T432 F433 D579 R630	Q381-G396 WeakPolarHBondContact O-CA 3.41Å; Q381-T432 VanDerWaalsContact CB-OG1 3.27Å; Q381-T432 WeakPolarHBondContact CB-OG1 3.43Å; Q381-T432 PolarHBondContact O-OG1 3.27Å; Q381-F433 HydrophobicContact CG-CD1 4.06Å; Q381-F433 HydrophobicContact CG-CE1 3.72Å; Q381-F433 HydrophobicContact CG-CE2 4.27Å; Q381-F433 HydrophobicContact CG-CG 4.49Å; Q381-F433 HydrophobicContact CG-CZ 3.81Å; Q381-F433 PolarHBondContact O-N 3.28Å; Q381-F433 VanDerWaalsContact OE1-CD1 3.24Å; Q381-D579 VanDerWaalsContact CD-OD1 3.25Å; Q381-D579 PolarHBondContact NE2-OD1 3.34Å; Q381-D579 PolarHBondContact NE2-OD2 3.49Å; Q381-D579 PolarHBondContact OE1-OD1 3.06Å; Q381-R630 VanDerWaalsContact OE1-NH2 3.09Å
382	H	95.9	Very high	95.2	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	15%	0.145	C	C	.	.			trans	-83.4	160.8	175.6	58.6	-85.9	0	0	0	110.4	L345 R379 Y380 I384 V393 V394 R630	L345-H382 WeakPolarHBondContact CD2-NE2 3.39Å; R379-H382 HydrophobicContact CB-CB 4.29Å; R379-H382 WeakPolarHBondContact CB-ND1 3.17Å; R379-H382 PolarHBondContact O-ND1 3.49Å; Y380-H382 PolarHBondContact O-N 2.88Å; Y380-H382 VanDerWaalsContact O-N 3.08Å; H382-I384 VanDerWaalsContact CD2-CG2 3.42Å; H382-I384 WeakPolarHBondContact CD2-CG2 3.48Å; H382-V393 HydrophobicContact CB-CG1 4.3Å; H382-V394 WeakPolarHBondContact CB-O 3.18Å; H382-R630 WeakPolarHBondContact NE2-CG 3.21Å; H382-R630 PolarHBondContact O-NE 3.13Å
383	G	97.1	Very high	95.3	Very high	3 Å²	3	23 Å²	23	3%	0.031	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	142.5	168.7	0	0	0	0	0	110.5	V394	G383-V394 PolarHBondContact N-O 3.33Å; G383-V394 PolarHBondContact O-N 3.38Å
384	I	97.5	Very high	95.5	Very high	29 Å²	29	22 Å²	22	15%	0.149	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	148.1	168.1	63.5	162.4	0	0	0	111.7	L345 H382 L391 Y392 V393 R630 A631 C632	L345-I384 HydrophobicContact CD2-CG2 4.29Å; H382-I384 VanDerWaalsContact CD2-CG2 3.42Å; H382-I384 WeakPolarHBondContact CD2-CG2 3.48Å; I384-L391 HydrophobicContact CB-CD1 3.94Å; I384-L391 HydrophobicContact CG2-CD1 4.25Å; I384-Y392 VanDerWaalsContact CA-O 3.25Å; I384-Y392 WeakPolarHBondContact CA-O 3.5Å; I384-V393 HydrophobicContact CG2-CG2 4.38Å; I384-R630 HydrophobicContact CB-CB 4.43Å; I384-R630 HydrophobicContact CD1-CB 3.57Å; I384-R630 HydrophobicContact CG1-CB 3.8Å; I384-R630 HydrophobicContact CG1-CG 4.32Å; I384-R630 HydrophobicContact CG2-CB 3.78Å; I384-R630 HydrophobicContact CG2-CG 4.12Å; I384-A631 VanDerWaalsContact CD1-O 3.23Å; I384-A631 WeakPolarHBondContact CD1-O 3.42Å; I384-C632 HydrophobicContact CD1-CB 3.92Å
385	A	98.1	Very high	95.7	Very high	10 Å²	10	19.5 Å²	19.5	8%	0.083	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.4	154.1	176.1	0	0	0	0	0	109.5	Y392 L436 A438 L443	A385-Y392 PolarHBondContact N-O 3.33Å; A385-Y392 PolarHBondContact O-N 3.2Å; A385-L436 HydrophobicContact CB-CD2 3.71Å; A385-L436 HydrophobicContact CB-CG 3.95Å; A385-A438 HydrophobicContact CB-CB 4.27Å; A385-L443 HydrophobicContact CB-CD2 3.55Å
386	V	98.3	Very high	95.8	Very high	48 Å²	48	19.3 Å²	19.3	29%	0.291	12%	0.118	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	126.9	179.2	-179.1	0	0	0	0	109.2	F390 L391 A438 C632 L634	V386-F390 VanDerWaalsContact CA-O 3.3Å; V386-F390 WeakPolarHBondContact CA-O 3.16Å; V386-L391 HydrophobicContact CG2-CD1 4.33Å; V386-A438 WeakPolarHBondContact O-CB 3.35Å; V386-C632 HydrophobicContact CG2-CB 4.16Å; V386-L634 HydrophobicContact CG1-CD2 3.84Å; V386-L634 HydrophobicContact CG2-CD2 3.83Å
387	I	98	Very high	95.9	Very high	11 Å²	11	12.5 Å²	12.5	6%	0.056	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	122.1	169.3	-59.3	175.2	0	0	0	107.1	P326 V327 N389 F390 Y392 A438 L443 P463	P326-I387 HydrophobicContact CB-CB 3.98Å; P326-I387 HydrophobicContact CB-CG2 3.69Å; P326-I387 WeakPolarHBondContact CB-O 3.32Å; P326-I387 WeakPolarHBondContact O-CG2 3.37Å; V327-I387 HydrophobicContact CG1-CG2 4.06Å; I387-N389 VanDerWaalsContact C-N 3.27Å; I387-N389 PolarHBondContact O-N 2.89Å; I387-F390 PolarHBondContact N-O 3.12Å; I387-F390 WeakPolarHBondContact O-CB 3.5Å; I387-F390 PolarHBondContact O-N 3.49Å; I387-Y392 HydrophobicContact CB-CE2 4.13Å; I387-Y392 HydrophobicContact CD1-CE2 4.26Å; I387-Y392 HydrophobicContact CG1-CE2 4.35Å; I387-A438 HydrophobicContact CD1-CB 4.44Å; I387-A438 HydrophobicContact CG1-CB 3.71Å; I387-L443 HydrophobicContact CD1-CD2 3.38Å; I387-L443 HydrophobicContact CD1-CG 3.64Å; I387-L443 HydrophobicContact CG1-CD2 3.78Å; I387-P463 HydrophobicContact CD1-CG 4.21Å
388	G	96.1	Very high	95.9	Very high	30 Å²	30	12.8 Å²	12.8	31%	0.309	8%	0.082	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.7	38.7	175.4	0	0	0	0	0	114.2	P326 F390	P326-G388 WeakPolarHBondContact O-CA 3.45Å; G388-F390 WeakPolarHBondContact O-CD2 3.47Å; G388-F390 WeakPolarHBondContact O-CE2 3.45Å; G388-F390 PolarHBondContact O-N 3.07Å
389	N	96.9	Very high	95.7	Very high	41 Å²	41	16.1 Å²	16.1	22%	0.219	10%	0.098	C	C	.	.	T	Hydrogen-bonded Turn	trans	66.5	9.2	-173.9	-163.1	48.9	0	0	0	115.2	I387 P416 T635	I387-N389 VanDerWaalsContact C-N 3.27Å; I387-N389 PolarHBondContact O-N 2.89Å; N389-P416 WeakPolarHBondContact ND2-CG 3.41Å; N389-P416 WeakPolarHBondContact O-CD 3.3Å; N389-P416 WeakPolarHBondContact O-CG 3.38Å; N389-T635 PolarHBondContact ND2-O 3.49Å; N389-T635 PolarHBondContact OD1-N 3.19Å
390	F	97.9	Very high	95.4	Very high	3 Å²	3	19.1 Å²	19.1	1%	0.013	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	127.9	169.3	-63.2	-99	0	0	0	110.1	Q325 P326 V386 I387 G388 Y392 R413 D415	Q325-F390 HydrophobicContact CB-CE2 4.24Å; Q325-F390 HydrophobicContact CB-CZ 3.85Å; P326-F390 HydrophobicContact CB-CB 4.41Å; P326-F390 HydrophobicContact CB-CD2 3.83Å; P326-F390 HydrophobicContact CB-CE2 4.46Å; P326-F390 HydrophobicContact CB-CG 4.32Å; P326-F390 HydrophobicContact CG-CB 4.05Å; P326-F390 HydrophobicContact CG-CD1 4.42Å; P326-F390 HydrophobicContact CG-CD2 3.65Å; P326-F390 HydrophobicContact CG-CE2 4.18Å; P326-F390 HydrophobicContact CG-CG 3.79Å; V386-F390 VanDerWaalsContact CA-O 3.3Å; V386-F390 WeakPolarHBondContact CA-O 3.16Å; I387-F390 PolarHBondContact N-O 3.12Å; I387-F390 WeakPolarHBondContact O-CB 3.5Å; I387-F390 PolarHBondContact O-N 3.49Å; G388-F390 WeakPolarHBondContact O-CD2 3.47Å; G388-F390 WeakPolarHBondContact O-CE2 3.45Å; G388-F390 PolarHBondContact O-N 3.07Å; F390-Y392 HydrophobicContact CB-CE2 4.33Å; F390-R413 HydrophobicContact CB-CG 4Å; F390-R413 HydrophobicContact CD1-CG 4.49Å; F390-D415 HydrophobicContact CD1-CB 4.16Å; F390-D415 HydrophobicContact CE1-CB 4.01Å; F390-D415 VanDerWaalsContact CE1-CG 3.48Å; F390-D415 WeakPolarHBondContact CE1-OD2 3.49Å
391	L	98.4	Very high	95.3	Very high	1 Å²	1	20.4 Å²	20.4	1%	0.005	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	128.5	177	166.2	67.1	0	0	0	110.1	L359 I384 V386 V393 R413 F414 W421 L634	L359-L391 HydrophobicContact CD1-CD2 3.8Å; I384-L391 HydrophobicContact CB-CD1 3.94Å; I384-L391 HydrophobicContact CG2-CD1 4.25Å; V386-L391 HydrophobicContact CG2-CD1 4.33Å; L391-V393 HydrophobicContact CG-CG2 4.33Å; L391-R413 CarbonylContact O-C 3.6Å; L391-R413 VanDerWaalsContact O-CA 3.29Å; L391-R413 WeakPolarHBondContact O-CA 3.49Å; L391-F414 HydrophobicContact CB-CB 4.15Å; L391-F414 PolarHBondContact N-O 3.02Å; L391-F414 PolarHBondContact O-N 3.48Å; L391-W421 HydrophobicContact CD2-CH2 4.25Å; L391-L634 HydrophobicContact CB-CD1 3.85Å; L391-L634 HydrophobicContact CB-CD2 4.24Å; L391-L634 HydrophobicContact CD2-CD1 4.17Å
392	Y	98.6	Very high	94.8	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	141.1	171.4	-73	-96.7	0	0	0	110.7	P326 I384 A385 I387 F390 V411 F412 R413 V424 L443 Y461	P326-Y392 HydrophobicContact CB-CE2 4.48Å; P326-Y392 HydrophobicContact CG-CE2 4.35Å; P326-Y392 WeakPolarHBondContact CG-OH 3.48Å; I384-Y392 VanDerWaalsContact CA-O 3.25Å; I384-Y392 WeakPolarHBondContact CA-O 3.5Å; A385-Y392 PolarHBondContact N-O 3.33Å; A385-Y392 PolarHBondContact O-N 3.2Å; I387-Y392 HydrophobicContact CB-CE2 4.13Å; I387-Y392 HydrophobicContact CD1-CE2 4.26Å; I387-Y392 HydrophobicContact CG1-CE2 4.35Å; F390-Y392 HydrophobicContact CB-CE2 4.33Å; Y392-V411 HydrophobicContact CD1-CG1 4.31Å; Y392-F412 CarbonylContact C-O 3.54Å; Y392-F412 WeakPolarHBondContact CA-O 3.44Å; Y392-R413 HydrophobicContact CD1-CB 4.03Å; Y392-R413 HydrophobicContact CD1-CG 4.08Å; Y392-R413 HydrophobicContact CD2-CG 4.25Å; Y392-R413 HydrophobicContact CE1-CB 3.94Å; Y392-R413 HydrophobicContact CE1-CG 3.84Å; Y392-R413 HydrophobicContact CE2-CG 4Å; Y392-R413 HydrophobicContact CG-CG 4.31Å; Y392-V424 HydrophobicContact CD1-CG2 4.47Å; Y392-V424 HydrophobicContact CE1-CG2 4.28Å; Y392-L443 HydrophobicContact CD1-CD1 3.57Å; Y392-L443 HydrophobicContact CD2-CD1 4.03Å; Y392-L443 HydrophobicContact CD2-CD2 4.47Å; Y392-L443 HydrophobicContact CE1-CD1 4.02Å; Y392-L443 HydrophobicContact CE2-CD1 4.45Å; Y392-L443 HydrophobicContact CG-CD1 3.54Å; Y392-Y461 HydrophobicContact CE1-CD1 4.39Å; Y392-Y461 AromaticContact CE1-CE1 3.77Å; Y392-Y461 HydrophobicContact CE1-CE1 3.77Å
393	V	98.1	Very high	94.3	Very high	1 Å²	1	29.8 Å²	29.8	1%	0.006	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	111.9	177.2	-177.8	0	0	0	0	107.5	L345 M375 R379 H382 I384 L391 V411 F412 W421	L345-V393 HydrophobicContact CD2-CB 4.19Å; L345-V393 HydrophobicContact CD2-CG1 3.92Å; L345-V393 HydrophobicContact CD2-CG2 3.17Å; M375-V393 HydrophobicContact CE-CB 4.28Å; M375-V393 HydrophobicContact CE-CG1 3.83Å; M375-V393 HydrophobicContact SD-CB 4.38Å; M375-V393 HydrophobicContact SD-CG1 3.86Å; M375-V393 HydrophobicContact SD-CG2 4.31Å; R379-V393 HydrophobicContact CG-CG1 4.24Å; H382-V393 HydrophobicContact CB-CG1 4.3Å; I384-V393 HydrophobicContact CG2-CG2 4.38Å; L391-V393 HydrophobicContact CG-CG2 4.33Å; V393-V411 WeakPolarHBondContact O-CA 3.46Å; V393-F412 PolarHBondContact N-O 3.2Å; V393-F412 PolarHBondContact O-N 2.63Å; V393-W421 HydrophobicContact CB-CZ3 4.32Å; V393-W421 HydrophobicContact CG2-CH2 3.61Å; V393-W421 HydrophobicContact CG2-CZ3 3.56Å
394	V	98.4	Very high	93.8	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	132.1	-169.1	178.9	0	0	0	0	109.3	H382 G383 V411 L427 F434 L436 W468	H382-V394 WeakPolarHBondContact CB-O 3.18Å; G383-V394 PolarHBondContact N-O 3.33Å; G383-V394 PolarHBondContact O-N 3.38Å; V394-V411 HydrophobicContact CB-CG1 4.45Å; V394-V411 HydrophobicContact CB-CG2 4.32Å; V394-V411 HydrophobicContact CG1-CG2 3.92Å; V394-V411 HydrophobicContact CG2-CG1 3.63Å; V394-V411 HydrophobicContact CG2-CG2 4.18Å; V394-L427 HydrophobicContact CG1-CD1 3.64Å; V394-L427 HydrophobicContact CG1-CD2 3.91Å; V394-L427 HydrophobicContact CG1-CG 3.87Å; V394-F434 HydrophobicContact CB-CE2 4.45Å; V394-F434 HydrophobicContact CB-CZ 3.93Å; V394-F434 HydrophobicContact CG1-CE2 4.07Å; V394-F434 HydrophobicContact CG1-CZ 3.69Å; V394-F434 WeakPolarHBondContact O-CE1 3.44Å; V394-F434 WeakPolarHBondContact O-CZ 3.41Å; V394-L436 HydrophobicContact CB-CD1 4.25Å; V394-L436 HydrophobicContact CB-CD2 3.84Å; V394-L436 HydrophobicContact CG1-CD1 4.36Å; V394-L436 HydrophobicContact CG2-CD1 3.95Å; V394-L436 HydrophobicContact CG2-CD2 3.43Å; V394-L436 VanDerWaalsContact CG2-CD2 3.43Å; V394-L436 HydrophobicContact CG2-CG 4.38Å; V394-W468 HydrophobicContact CG1-CH2 4.09Å; V394-W468 HydrophobicContact CG1-CZ2 4Å; V394-W468 HydrophobicContact CG2-CH2 4.3Å; V394-W468 HydrophobicContact CG2-CZ2 4.1Å
395	G	97.7	Very high	93.5	Very high	0 Å²	0	35 Å²	35	0%	0	19%	0.185	C	C	.	.			trans	58.1	-139.1	170.3	0	0	0	0	0	113.9	R379 V408 T410	R379-G395 WeakPolarHBondContact CD-O 3.2Å; G395-V408 WeakPolarHBondContact CA-O 3.12Å; G395-V408 WeakPolarHBondContact O-CG2 3.26Å; G395-T410 PolarHBondContact N-O 2.83Å; G395-T410 VanDerWaalsContact N-O 3.14Å
396	G	96.1	Very high	93.3	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.194	C	C	.	.			trans	83.1	-149.6	-175.9	0	0	0	0	0	112	Q381 A407 V408 R431	Q381-G396 WeakPolarHBondContact O-CA 3.41Å; G396-A407 CarbonylContact O-C 3.42Å; G396-A407 WeakPolarHBondContact O-CA 3.4Å; G396-V408 WeakPolarHBondContact O-CG2 3.43Å; G396-V408 PolarHBondContact O-N 2.68Å; G396-R431 PolarHBondContact N-O 2.93Å
397	Q	92.9	Very high	93.3	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.184	C	C	.	.	B	Isolated β-bridge	trans	-140.8	141.3	-175.5	-68.7	175	111.5	0	0	110.5	Y380 D401 G404 T406 T432	Y380-Q397 HydrophobicContact CD1-CB 3.95Å; Y380-Q397 VanDerWaalsContact CD1-O 3.26Å; Y380-Q397 WeakPolarHBondContact CD1-O 3.4Å; Y380-Q397 HydrophobicContact CE1-CB 3.25Å; Y380-Q397 HydrophobicContact CE1-CG 4.38Å; Y380-Q397 PolarHBondContact N-O 2.9Å; Y380-Q397 VanDerWaalsContact N-O 3.11Å; Y380-Q397 PolarHBondContact O-N 3.18Å; Y380-Q397 PolarHBondContact OH-NE2 2.98Å; Q397-D401 PolarHBondContact NE2-O 3.07Å; Q397-D401 PolarHBondContact OE1-O 3.48Å; Q397-G404 VanDerWaalsContact OE1-CA 3.3Å; Q397-T406 PolarHBondContact OE1-OG1 2.67Å; Q397-T432 HydrophobicContact CG-CG2 4.14Å; Q397-T432 PolarHBondContact NE2-OG1 2.85Å
398	S	90.1	Very high	93.2	Very high	32 Å²	32	35.5 Å²	35.5	22%	0.224	19%	0.189	C	C	.	.	S	Bend	trans	-84.8	-26.8	173.4	-50.4	0	0	0	0	112.9	V355 P378 R379	V355-S398 WeakPolarHBondContact CB-O 3.5Å; V355-S398 VanDerWaalsContact CG2-O 3.27Å; V355-S398 WeakPolarHBondContact CG2-O 3.05Å; P378-S398 WeakPolarHBondContact O-CA 3.47Å; R379-S398 PolarHBondContact NH1-OG 2.89Å
399	N	87.6	Confident	93.3	Very high	109 Å²	109	36.3 Å²	36.3	58%	0.583	19%	0.186	S	C	*	.	S	Bend	trans	-125.3	140	-174.5	-63.6	-24.4	0	0	0	109.4	Y380 D401 T406	Y380-N399 VanDerWaalsContact CE1-O 3.29Å; Y380-N399 WeakPolarHBondContact CE1-O 3.2Å; Y380-N399 PolarHBondContact OH-O 3.14Å; N399-D401 PolarHBondContact O-N 3.15Å; N399-D401 VanDerWaalsContact O-N 3.16Å; N399-T406 HydrophobicContact CB-CG2 4.34Å; N399-T406 PolarHBondContact O-OG1 3.15Å
400	Y	86.4	Confident	93.3	Very high	71 Å²	71	35.6 Å²	35.6	28%	0.278	18%	0.183	S	C	.	.			trans	-60.7	116.4	-179.8	-177.3	-91.5	0	0	0	112.6	V348 R350 L353 Y380 T402	V348-Y400 HydrophobicContact CG1-CD2 4.09Å; V348-Y400 HydrophobicContact CG1-CE2 4.34Å; V348-Y400 HydrophobicContact CG2-CD2 3.85Å; R350-Y400 PolarHBondContact NE-OH 2.77Å; L353-Y400 HydrophobicContact CD2-CD1 3.58Å; L353-Y400 HydrophobicContact CD2-CE1 3.94Å; L353-Y400 HydrophobicContact CD2-CG 3.9Å; Y380-Y400 HydrophobicContact CE2-CD2 4.43Å; Y380-Y400 WeakPolarHBondContact OH-CA 3.44Å; Y400-T402 HydrophobicContact CE1-CG2 4.11Å; Y400-T402 WeakPolarHBondContact OH-CG2 3.47Å
401	D	87.7	Confident	93.4	Very high	32 Å²	32	35.4 Å²	35.4	17%	0.171	18%	0.182	C	C	.	.			trans	-149.6	132.8	172.2	-179.7	70.7	0	0	0	109.8	Y380 Q397 N399 K403 G404 K405 T406	Y380-D401 PolarHBondContact OH-N 3.2Å; Y380-D401 PolarHBondContact OH-O 2.98Å; Q397-D401 PolarHBondContact NE2-O 3.07Å; Q397-D401 PolarHBondContact OE1-O 3.48Å; N399-D401 PolarHBondContact O-N 3.15Å; N399-D401 VanDerWaalsContact O-N 3.16Å; D401-K403 WeakPolarHBondContact OD2-CA 3.44Å; D401-K403 PolarHBondContact OD2-N 3.26Å; D401-G404 PolarHBondContact OD2-N 2.75Å; D401-K405 PolarHBondContact OD2-N 2.86Å; D401-T406 HydrophobicContact CB-CG2 4.16Å
402	T	83	Confident	93.3	Very high	81 Å²	81	36.3 Å²	36.3	50%	0.497	19%	0.186	S	C	.	.	S	Bend	trans	-90.2	-7.8	-179.9	55.5	0	0	0	0	112.8	Y400	Y400-T402 HydrophobicContact CE1-CG2 4.11Å; Y400-T402 WeakPolarHBondContact OH-CG2 3.47Å
403	K	85.7	Confident	93.3	Very high	124 Å²	124	36.6 Å²	36.6	54%	0.539	19%	0.187	S	C	.	.	S	Bend	trans	-105.5	-1.7	-174.2	-66.3	-169.4	176.9	-171	0	114	D401 K405 R449	D401-K403 WeakPolarHBondContact OD2-CA 3.44Å; D401-K403 PolarHBondContact OD2-N 3.26Å; K403-K405 HydrophobicContact CB-CG 4.33Å; K403-R449 VanDerWaalsContact C-NE 3.3Å; K403-R449 VanDerWaalsContact CA-NH2 3.3Å; K403-R449 VanDerWaalsContact O-CZ 3.24Å; K403-R449 PolarHBondContact O-NE 2.81Å; K403-R449 PolarHBondContact O-NH2 2.81Å
404	G	87.3	Confident	93.3	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.187	C	C	.	.	S	Bend	trans	78.3	13.4	-179.3	0	0	0	0	0	115	Q397 D401 T406 A407 T432 N450 A451	Q397-G404 VanDerWaalsContact OE1-CA 3.3Å; D401-G404 PolarHBondContact OD2-N 2.75Å; G404-T406 PolarHBondContact O-N 2.83Å; G404-A407 WeakPolarHBondContact O-CB 3.32Å; G404-A407 PolarHBondContact O-N 2.86Å; G404-T432 VanDerWaalsContact CA-CG2 3.48Å; G404-N450 CarbonylContact O-C 3.6Å; G404-N450 VanDerWaalsContact O-CA 3.27Å; G404-N450 WeakPolarHBondContact O-CA 3.39Å; G404-A451 PolarHBondContact O-N 3.44Å
405	K	90.7	Very high	93.1	Very high	140 Å²	140	37.2 Å²	37.2	61%	0.609	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-26.7	-177.3	-67.7	-176.5	176.6	-174.8	0	113	D401 K403	D401-K405 PolarHBondContact OD2-N 2.86Å; K403-K405 HydrophobicContact CB-CG 4.33Å
406	T	94.3	Very high	93	Very high	46 Å²	46	37.4 Å²	37.4	28%	0.282	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.8	19.3	-177.9	59.8	0	0	0	0	112.2	Q397 N399 D401 G404	Q397-T406 PolarHBondContact OE1-OG1 2.67Å; N399-T406 HydrophobicContact CB-CG2 4.34Å; N399-T406 PolarHBondContact O-OG1 3.15Å; D401-T406 HydrophobicContact CB-CG2 4.16Å; G404-T406 PolarHBondContact O-N 2.83Å
407	A	96.8	Very high	92.7	Very high	9 Å²	9	38.5 Å²	38.5	7%	0.074	20%	0.196	C	C	.	.	B	Isolated β-bridge	trans	-54.8	142.4	177.6	0	0	0	0	0	111.2	G396 G404 K430 T432 N450	G396-A407 CarbonylContact O-C 3.42Å; G396-A407 WeakPolarHBondContact O-CA 3.4Å; G404-A407 WeakPolarHBondContact O-CB 3.32Å; G404-A407 PolarHBondContact O-N 2.86Å; A407-K430 HydrophobicContact CB-CB 3.99Å; A407-K430 WeakPolarHBondContact O-CD 3.49Å; A407-T432 HydrophobicContact CB-CG2 4.15Å; A407-N450 HydrophobicContact CB-CB 3.95Å
408	V	97.2	Very high	92.5	Very high	25 Å²	25	41.7 Å²	41.7	15%	0.152	21%	0.209	C	C	.	.			trans	-119.1	163.9	175.7	-58.8	0	0	0	0	111.1	G395 G396 R431	G395-V408 WeakPolarHBondContact CA-O 3.12Å; G395-V408 WeakPolarHBondContact O-CG2 3.26Å; G396-V408 WeakPolarHBondContact O-CG2 3.43Å; G396-V408 PolarHBondContact O-N 2.68Å; V408-R431 PolarHBondContact O-N 2.89Å
409	D	97.6	Very high	92.6	Very high	47 Å²	47	43.1 Å²	43.1	25%	0.251	21%	0.214	S	C	.	.			trans	-111.2	-11.7	-179.7	46.4	24	0	0	0	112.5	S426 L427 K430	D409-S426 CarbonylContact O-C 3.54Å; D409-S426 VanDerWaalsContact O-CA 3.31Å; D409-S426 WeakPolarHBondContact O-CA 3.4Å; D409-S426 WeakPolarHBondContact O-CB 3.45Å; D409-L427 HydrophobicContact CB-CB 4.08Å; D409-L427 PolarHBondContact O-N 3.06Å; D409-K430 HydrophobicContact CB-CG 3.81Å; D409-K430 VanDerWaalsContact OD2-CE 3.28Å; D409-K430 WeakPolarHBondContact OD2-CE 3.38Å
410	T	97.9	Very high	92.9	Very high	26 Å²	26	44.7 Å²	44.7	16%	0.16	22%	0.215	C	C	.	.			trans	-60.3	141.1	-176.8	59.5	0	0	0	0	111.8	R379 G395	R379-T410 PolarHBondContact NH2-OG1 3.37Å; G395-T410 PolarHBondContact N-O 2.83Å; G395-T410 VanDerWaalsContact N-O 3.14Å
411	V	98.1	Very high	93.4	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	128.3	176.1	-174.7	0	0	0	0	110.3	Y392 V393 V394 Q423 V424 A425 L427 W468	Y392-V411 HydrophobicContact CD1-CG1 4.31Å; V393-V411 WeakPolarHBondContact O-CA 3.46Å; V394-V411 HydrophobicContact CB-CG1 4.45Å; V394-V411 HydrophobicContact CB-CG2 4.32Å; V394-V411 HydrophobicContact CG1-CG2 3.92Å; V394-V411 HydrophobicContact CG2-CG1 3.63Å; V394-V411 HydrophobicContact CG2-CG2 4.18Å; V411-Q423 WeakPolarHBondContact O-CG 3.36Å; V411-V424 HydrophobicContact CB-CG2 3.68Å; V411-V424 HydrophobicContact CG1-CG2 3.38Å; V411-V424 PolarHBondContact O-N 2.82Å; V411-A425 WeakPolarHBondContact CG2-O 3.43Å; V411-L427 HydrophobicContact CG2-CG 4.33Å; V411-W468 HydrophobicContact CG2-CZ2 4.01Å
412	F	97.7	Very high	93.9	Very high	20 Å²	20	44.4 Å²	44.4	9%	0.088	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	145.7	177.4	-63.3	-84.8	0	0	0	110.4	M375 Y392 V393 W421 I422 Q423	M375-F412 HydrophobicContact CE-CB 4.15Å; M375-F412 HydrophobicContact CE-CD2 3.53Å; M375-F412 HydrophobicContact CE-CE2 4.18Å; M375-F412 HydrophobicContact CE-CG 3.99Å; Y392-F412 CarbonylContact C-O 3.54Å; Y392-F412 WeakPolarHBondContact CA-O 3.44Å; V393-F412 PolarHBondContact N-O 3.2Å; V393-F412 PolarHBondContact O-N 2.63Å; F412-W421 HydrophobicContact CB-CE3 3.8Å; F412-W421 HydrophobicContact CB-CZ3 4.09Å; F412-I422 CarbonylContact C-O 3.58Å; F412-I422 WeakPolarHBondContact CA-O 3.41Å; F412-Q423 HydrophobicContact CD1-CB 4.04Å; F412-Q423 HydrophobicContact CD1-CG 4.37Å; F412-Q423 HydrophobicContact CE1-CB 3.92Å; F412-Q423 HydrophobicContact CE1-CG 4.1Å
413	R	97.8	Very high	94.5	Very high	5 Å²	5	45.8 Å²	45.8	2%	0.019	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	125.5	174	-171.3	-168.3	74.3	178.8	8.1	109.9	P322 P326 F390 L391 Y392 W421 I422 V424	P322-R413 PolarHBondContact O-NH1 3.39Å; P322-R413 PolarHBondContact O-NH2 2.91Å; P326-R413 VanDerWaalsContact CD-NH1 3.32Å; P326-R413 VanDerWaalsContact CG-NH1 3.33Å; F390-R413 HydrophobicContact CB-CG 4Å; F390-R413 HydrophobicContact CD1-CG 4.49Å; L391-R413 CarbonylContact O-C 3.6Å; L391-R413 VanDerWaalsContact O-CA 3.29Å; L391-R413 WeakPolarHBondContact O-CA 3.49Å; Y392-R413 HydrophobicContact CD1-CB 4.03Å; Y392-R413 HydrophobicContact CD1-CG 4.08Å; Y392-R413 HydrophobicContact CD2-CG 4.25Å; Y392-R413 HydrophobicContact CE1-CB 3.94Å; Y392-R413 HydrophobicContact CE1-CG 3.84Å; Y392-R413 HydrophobicContact CE2-CG 4Å; Y392-R413 HydrophobicContact CG-CG 4.31Å; R413-W421 WeakPolarHBondContact O-CA 2.93Å; R413-I422 HydrophobicContact CB-CG1 4.11Å; R413-I422 PolarHBondContact N-O 3.22Å; R413-I422 VanDerWaalsContact NH2-CD1 3.33Å; R413-I422 PolarHBondContact O-N 3.48Å; R413-V424 HydrophobicContact CB-CG1 4.16Å
414	F	97.9	Very high	95.1	Very high	1 Å²	1	40.2 Å²	40.2	0%	0.004	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	131.2	172.4	-177.9	-113.1	0	0	0	110.7	L359 L372 A373 L391 P416 N419 W421 L634 V636	L359-F414 HydrophobicContact CD2-CD1 3.81Å; L359-F414 HydrophobicContact CD2-CD2 3.91Å; L359-F414 HydrophobicContact CD2-CE1 3.64Å; L359-F414 HydrophobicContact CD2-CE2 3.75Å; L359-F414 HydrophobicContact CD2-CG 3.93Å; L359-F414 HydrophobicContact CD2-CZ 3.61Å; L372-F414 HydrophobicContact CB-CZ 4.3Å; L372-F414 HydrophobicContact CD1-CE1 4.2Å; L372-F414 HydrophobicContact CD1-CZ 4.17Å; A373-F414 HydrophobicContact CB-CE2 4.35Å; L391-F414 HydrophobicContact CB-CB 4.15Å; L391-F414 PolarHBondContact N-O 3.02Å; L391-F414 PolarHBondContact O-N 3.48Å; F414-P416 HydrophobicContact CD1-CB 4.44Å; F414-P416 HydrophobicContact CE1-CB 4.01Å; F414-N419 WeakPolarHBondContact CE2-OD1 3.39Å; F414-N419 VanDerWaalsContact CZ-OD1 3.25Å; F414-N419 WeakPolarHBondContact CZ-OD1 3.23Å; F414-W421 HydrophobicContact CB-CD2 3.87Å; F414-W421 HydrophobicContact CB-CE3 3.63Å; F414-W421 HydrophobicContact CB-CH2 3.64Å; F414-W421 HydrophobicContact CB-CZ2 3.86Å; F414-W421 HydrophobicContact CB-CZ3 3.52Å; F414-W421 AromaticContact CD2-CD1 4Å; F414-W421 AromaticContact CD2-CD2 3.85Å; F414-W421 HydrophobicContact CD2-CD2 3.85Å; F414-W421 AromaticContact CD2-CE2 3.51Å; F414-W421 HydrophobicContact CD2-CE3 4.49Å; F414-W421 HydrophobicContact CD2-CG 4.17Å; F414-W421 AromaticContact CD2-CZ2 3.91Å; F414-W421 HydrophobicContact CD2-CZ2 3.91Å; F414-W421 AromaticContact CD2-NE1 3.57Å; F414-W421 HydrophobicContact CG-CD2 4.34Å; F414-W421 HydrophobicContact CG-CH2 4.33Å; F414-W421 HydrophobicContact CG-CZ2 4.08Å; F414-L634 HydrophobicContact CD1-CD1 4.27Å; F414-V636 HydrophobicContact CE1-CG1 4.28Å
415	D	95.4	Very high	95.6	Very high	13 Å²	13	41.4 Å²	41.4	7%	0.07	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	106.9	170.9	-170.6	-21.7	0	0	0	109.7	F390 R417 Y418 N419 K420	F390-D415 HydrophobicContact CD1-CB 4.16Å; F390-D415 HydrophobicContact CE1-CB 4.01Å; F390-D415 VanDerWaalsContact CE1-CG 3.48Å; F390-D415 WeakPolarHBondContact CE1-OD2 3.49Å; D415-R417 PolarHBondContact O-N 3.24Å; D415-R417 VanDerWaalsContact OD1-CB 3.23Å; D415-R417 WeakPolarHBondContact OD1-CB 3.4Å; D415-R417 WeakPolarHBondContact OD1-CG 3.39Å; D415-R417 IonicContact OD1-CZ 2.75Å; D415-R417 PolarHBondContact OD1-N 2.91Å; D415-R417 IonicContact OD1-NE 2.68Å; D415-R417 PolarHBondContact OD1-NE 2.82Å; D415-R417 IonicContact OD1-NH2 2.71Å; D415-R417 IonicContact OD2-CZ 3.81Å; D415-R417 IonicContact OD2-NE 2.64Å; D415-R417 PolarHBondContact OD2-NE 3.18Å; D415-R417 IonicContact OD2-NH2 3.47Å; D415-R417 PolarHBondContact OD2-NH2 2.8Å; D415-Y418 PolarHBondContact O-N 2.84Å; D415-Y418 WeakPolarHBondContact OD2-CD2 3.47Å; D415-N419 PolarHBondContact O-N 2.9Å; D415-K420 PolarHBondContact N-O 2.89Å; D415-K420 PolarHBondContact O-N 3.05Å
416	P	94.6	Very high	96	Very high	5 Å²	5	37 Å²	37	3%	0.032	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69	-13.4	-177.5	31.4	-39.4	0	0	0	113.7	I335 N389 F414 T635 V636	I335-P416 HydrophobicContact CD1-CB 4Å; I335-P416 HydrophobicContact CD1-CG 3.94Å; N389-P416 WeakPolarHBondContact ND2-CG 3.41Å; N389-P416 WeakPolarHBondContact O-CD 3.3Å; N389-P416 WeakPolarHBondContact O-CG 3.38Å; F414-P416 HydrophobicContact CD1-CB 4.44Å; F414-P416 HydrophobicContact CE1-CB 4.01Å; P416-T635 WeakPolarHBondContact CB-O 3.44Å; P416-V636 HydrophobicContact CB-CB 4.37Å; P416-V636 HydrophobicContact CB-CG1 3.44Å; P416-V636 VanDerWaalsContact CB-CG1 3.44Å
417	R	89.7	Confident	96.2	Very high	23 Å²	23	35.1 Å²	35.1	9%	0.087	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-35.8	-177.7	-58.5	170.3	-64.7	159.8	7.7	111.6	L286 Y318 I335 D415	L286-R417 VanDerWaalsContact CD2-CD 3.47Å; L286-R417 HydrophobicContact CD2-CG 4.24Å; Y318-R417 PolarHBondContact OH-NH1 3.33Å; Y318-R417 VanDerWaalsContact OH-NH1 3.11Å; I335-R417 HydrophobicContact CD1-CB 4.43Å; I335-R417 HydrophobicContact CD1-CG 3.7Å; I335-R417 HydrophobicContact CG1-CB 4.46Å; I335-R417 HydrophobicContact CG1-CG 3.56Å; D415-R417 PolarHBondContact O-N 3.24Å; D415-R417 VanDerWaalsContact OD1-CB 3.23Å; D415-R417 WeakPolarHBondContact OD1-CB 3.4Å; D415-R417 WeakPolarHBondContact OD1-CG 3.39Å; D415-R417 IonicContact OD1-CZ 2.75Å; D415-R417 PolarHBondContact OD1-N 2.91Å; D415-R417 IonicContact OD1-NE 2.68Å; D415-R417 PolarHBondContact OD1-NE 2.82Å; D415-R417 IonicContact OD1-NH2 2.71Å; D415-R417 IonicContact OD2-CZ 3.81Å; D415-R417 IonicContact OD2-NE 2.64Å; D415-R417 PolarHBondContact OD2-NE 3.18Å; D415-R417 IonicContact OD2-NH2 3.47Å; D415-R417 PolarHBondContact OD2-NH2 2.8Å
418	Y	88.9	Confident	96.3	Very high	67 Å²	67	38.8 Å²	38.8	26%	0.263	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-114.5	1.2	-176.6	-52.4	-60.6	0	0	0	112.8	L286 T288 Q319 D415 K420	L286-Y418 VanDerWaalsContact C-OH 3.32Å; L286-Y418 WeakPolarHBondContact O-CE1 3.39Å; L286-Y418 PolarHBondContact O-OH 2.68Å; T288-Y418 HydrophobicContact CG2-CE1 4.23Å; Q319-Y418 PolarHBondContact NE2-OH 3.26Å; Q319-Y418 VanDerWaalsContact NE2-OH 3.15Å; D415-Y418 PolarHBondContact O-N 2.84Å; D415-Y418 WeakPolarHBondContact OD2-CD2 3.47Å; Y418-K420 VanDerWaalsContact C-N 3.33Å; Y418-K420 WeakPolarHBondContact O-CG 3.19Å; Y418-K420 PolarHBondContact O-N 2.96Å
419	N	93.3	Very high	96.3	Very high	62 Å²	62	40 Å²	40	33%	0.332	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.4	51.3	-174.8	-168.7	32.4	0	0	0	111.4	A373 F414 D415	A373-N419 WeakPolarHBondContact CB-O 3.31Å; A373-N419 WeakPolarHBondContact CB-OD1 3.35Å; A373-N419 PolarHBondContact N-ND2 2.85Å; A373-N419 PolarHBondContact N-OD1 3.01Å; F414-N419 WeakPolarHBondContact CE2-OD1 3.39Å; F414-N419 VanDerWaalsContact CZ-OD1 3.25Å; F414-N419 WeakPolarHBondContact CZ-OD1 3.23Å; D415-N419 PolarHBondContact O-N 2.9Å
420	K	94	Very high	96.3	Very high	141 Å²	141	42.8 Å²	42.8	61%	0.613	21%	0.209	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-136.1	149.5	-172.7	-79.7	176.9	-174.2	-177.9	0	112.2	D415 Y418	D415-K420 PolarHBondContact N-O 2.89Å; D415-K420 PolarHBondContact O-N 3.05Å; Y418-K420 VanDerWaalsContact C-N 3.33Å; Y418-K420 WeakPolarHBondContact O-CG 3.19Å; Y418-K420 PolarHBondContact O-N 2.96Å
421	W	96.8	Very high	96.2	Very high	38 Å²	38	41.5 Å²	41.5	14%	0.144	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	146.7	173.6	-65.6	93	0	0	0	110.9	L345 L359 A373 P374 M375 L391 V393 F412 R413 F414	L345-W421 HydrophobicContact CD1-CH2 4.43Å; L345-W421 HydrophobicContact CD1-CZ2 4.39Å; L345-W421 HydrophobicContact CD2-CH2 4.33Å; L359-W421 HydrophobicContact CB-CZ2 4.32Å; L359-W421 HydrophobicContact CD1-CZ2 4.45Å; L359-W421 HydrophobicContact CD2-CZ2 3.83Å; L359-W421 HydrophobicContact CG-CZ2 4.43Å; A373-W421 PolarHBondContact O-NE1 2.81Å; P374-W421 PolarHBondContact O-NE1 3.43Å; M375-W421 HydrophobicContact CG-CD2 4.31Å; M375-W421 HydrophobicContact CG-CH2 3.86Å; M375-W421 HydrophobicContact CG-CZ2 3.63Å; M375-W421 HydrophobicContact CG-CZ3 4.29Å; M375-W421 HydrophobicContact SD-CH2 4.27Å; L391-W421 HydrophobicContact CD2-CH2 4.25Å; V393-W421 HydrophobicContact CB-CZ3 4.32Å; V393-W421 HydrophobicContact CG2-CH2 3.61Å; V393-W421 HydrophobicContact CG2-CZ3 3.56Å; F412-W421 HydrophobicContact CB-CE3 3.8Å; F412-W421 HydrophobicContact CB-CZ3 4.09Å; R413-W421 WeakPolarHBondContact O-CA 2.93Å; F414-W421 HydrophobicContact CB-CD2 3.87Å; F414-W421 HydrophobicContact CB-CE3 3.63Å; F414-W421 HydrophobicContact CB-CH2 3.64Å; F414-W421 HydrophobicContact CB-CZ2 3.86Å; F414-W421 HydrophobicContact CB-CZ3 3.52Å; F414-W421 AromaticContact CD2-CD1 4Å; F414-W421 AromaticContact CD2-CD2 3.85Å; F414-W421 HydrophobicContact CD2-CD2 3.85Å; F414-W421 AromaticContact CD2-CE2 3.51Å; F414-W421 HydrophobicContact CD2-CE3 4.49Å; F414-W421 HydrophobicContact CD2-CG 4.17Å; F414-W421 AromaticContact CD2-CZ2 3.91Å; F414-W421 HydrophobicContact CD2-CZ2 3.91Å; F414-W421 AromaticContact CD2-NE1 3.57Å; F414-W421 HydrophobicContact CG-CD2 4.34Å; F414-W421 HydrophobicContact CG-CH2 4.33Å; F414-W421 HydrophobicContact CG-CZ2 4.08Å
422	I	96.4	Very high	96.2	Very high	60 Å²	60	41.5 Å²	41.5	31%	0.308	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	149	163	65.8	169.4	0	0	0	109.1	F323 F412 R413 V424	F323-I422 HydrophobicContact CD1-CD1 4.23Å; F323-I422 HydrophobicContact CE1-CD1 4.19Å; F412-I422 CarbonylContact C-O 3.58Å; F412-I422 WeakPolarHBondContact CA-O 3.41Å; R413-I422 HydrophobicContact CB-CG1 4.11Å; R413-I422 PolarHBondContact N-O 3.22Å; R413-I422 VanDerWaalsContact NH2-CD1 3.33Å; R413-I422 PolarHBondContact O-N 3.48Å; I422-V424 HydrophobicContact CD1-CG1 4.23Å; I422-V424 HydrophobicContact CG1-CG1 4.31Å
423	Q	96.9	Very high	96.1	Very high	109 Å²	109	41.5 Å²	41.5	51%	0.509	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	135.4	167.1	-170.6	172.3	-15.6	0	0	109.2	V411 F412	V411-Q423 WeakPolarHBondContact O-CG 3.36Å; F412-Q423 HydrophobicContact CD1-CB 4.04Å; F412-Q423 HydrophobicContact CD1-CG 4.37Å; F412-Q423 HydrophobicContact CE1-CB 3.92Å; F412-Q423 HydrophobicContact CE1-CG 4.1Å
424	V	97.9	Very high	96.1	Very high	8 Å²	8	41.7 Å²	41.7	5%	0.048	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	-177.5	172.4	-59.6	0	0	0	0	109.1	F323 Y392 V411 R413 I422 S426 Y461 N466	F323-V424 HydrophobicContact CD1-CG1 4.05Å; F323-V424 HydrophobicContact CE1-CG1 4.36Å; Y392-V424 HydrophobicContact CD1-CG2 4.47Å; Y392-V424 HydrophobicContact CE1-CG2 4.28Å; V411-V424 HydrophobicContact CB-CG2 3.68Å; V411-V424 HydrophobicContact CG1-CG2 3.38Å; V411-V424 PolarHBondContact O-N 2.82Å; R413-V424 HydrophobicContact CB-CG1 4.16Å; I422-V424 HydrophobicContact CD1-CG1 4.23Å; I422-V424 HydrophobicContact CG1-CG1 4.31Å; V424-S426 PolarHBondContact O-N 2.84Å; V424-Y461 HydrophobicContact CG2-CE2 4.45Å; V424-N466 WeakPolarHBondContact CB-OD1 3.23Å
425	A	98.4	Very high	96.1	Very high	25 Å²	25	42.6 Å²	42.6	21%	0.207	21%	0.207	C	C	.	.	P	Polyproline II helix	trans	-54.8	134.5	-180	0	0	0	0	0	112.3	V411 Y461 N466 W468	V411-A425 WeakPolarHBondContact CG2-O 3.43Å; A425-Y461 HydrophobicContact CB-CE2 4.34Å; A425-N466 WeakPolarHBondContact CB-O 3.38Å; A425-N466 PolarHBondContact N-OD1 2.82Å; A425-W468 PolarHBondContact O-NE1 2.99Å
426	S	98.5	Very high	96.3	Very high	46 Å²	46	42.5 Å²	42.5	32%	0.322	21%	0.206	S	C	.	.	P	Polyproline II helix	trans	-71.3	154.5	175.7	-62.6	0	0	0	0	111.2	D409 V424	D409-S426 CarbonylContact O-C 3.54Å; D409-S426 VanDerWaalsContact O-CA 3.31Å; D409-S426 WeakPolarHBondContact O-CA 3.4Å; D409-S426 WeakPolarHBondContact O-CB 3.45Å; V424-S426 PolarHBondContact O-N 2.84Å
427	L	98.6	Very high	96.4	Very high	8 Å²	8	42.8 Å²	42.8	4%	0.042	21%	0.209	C	C	.	.	P	Polyproline II helix	trans	-56.8	152.9	169.7	-68.7	166.2	0	0	0	111.2	V394 D409 V411 E429 R431 A445 E459 W468	V394-L427 HydrophobicContact CG1-CD1 3.64Å; V394-L427 HydrophobicContact CG1-CD2 3.91Å; V394-L427 HydrophobicContact CG1-CG 3.87Å; D409-L427 HydrophobicContact CB-CB 4.08Å; D409-L427 PolarHBondContact O-N 3.06Å; V411-L427 HydrophobicContact CG2-CG 4.33Å; L427-E429 VanDerWaalsContact C-N 3.35Å; L427-E429 VanDerWaalsContact CB-O 3.25Å; L427-E429 WeakPolarHBondContact CB-O 3.2Å; L427-R431 HydrophobicContact CD1-CB 4.31Å; L427-R431 HydrophobicContact CD1-CG 4.45Å; L427-A445 HydrophobicContact CD2-CB 4.02Å; L427-E459 HydrophobicContact CD2-CB 4.48Å; L427-W468 HydrophobicContact CD2-CD2 3.73Å; L427-W468 HydrophobicContact CD2-CE3 3.75Å; L427-W468 HydrophobicContact CD2-CG 4.46Å; L427-W468 HydrophobicContact CD2-CH2 3.76Å; L427-W468 HydrophobicContact CD2-CZ2 3.74Å; L427-W468 HydrophobicContact CD2-CZ3 3.76Å; L427-W468 HydrophobicContact CG-CZ2 4.46Å
428	N	98.4	Very high	96.8	Very high	85 Å²	85	43.3 Å²	43.3	46%	0.455	22%	0.217	S	C	.	.	S	Bend	trans	-71.2	-34.4	170.9	-61.2	-80.5	0	0	0	111.2	E459 W468 Y470	N428-E459 VanDerWaalsContact CB-OE2 3.25Å; N428-E459 WeakPolarHBondContact CB-OE2 3.33Å; N428-E459 PolarHBondContact N-OE2 2.82Å; N428-E459 PolarHBondContact ND2-OE2 2.95Å; N428-W468 VanDerWaalsContact ND2-CB 3.32Å; N428-W468 WeakPolarHBondContact ND2-CB 3.27Å; N428-W468 PolarHBondContact ND2-O 3.03Å; N428-Y470 HydrophobicContact CB-CE2 3.8Å; N428-Y470 WeakPolarHBondContact CB-OH 3.46Å
429	E	96.6	Very high	97.3	Very high	50 Å²	50	40.2 Å²	40.2	23%	0.234	21%	0.206	C	C	.	.	S	Bend	trans	-121.3	136.7	174.5	-80.1	163.6	-153.3	0	0	111.3	L427 R431 T457 E459 Y470	L427-E429 VanDerWaalsContact C-N 3.35Å; L427-E429 VanDerWaalsContact CB-O 3.25Å; L427-E429 WeakPolarHBondContact CB-O 3.2Å; E429-R431 WeakPolarHBondContact O-CG 3.38Å; E429-R431 PolarHBondContact O-N 3.29Å; E429-R431 IonicContact OE2-CZ 3.19Å; E429-R431 IonicContact OE2-NH1 3.28Å; E429-R431 IonicContact OE2-NH2 3.1Å; E429-R431 PolarHBondContact OE2-NH2 3.42Å; E429-T457 PolarHBondContact OE2-OG1 2.94Å; E429-E459 PolarHBondContact N-OE1 2.94Å; E429-Y470 VanDerWaalsContact CD-OH 3.31Å; E429-Y470 WeakPolarHBondContact CG-OH 3.47Å; E429-Y470 PolarHBondContact OE1-OH 3.35Å
430	K	97.9	Very high	97.4	Very high	106 Å²	106	42.2 Å²	42.2	46%	0.461	21%	0.211	S	C	.	.			trans	-63.3	135.2	171.3	-62.8	172.7	179.3	-173.5	0	109.4	A407 D409 N450	A407-K430 HydrophobicContact CB-CB 3.99Å; A407-K430 WeakPolarHBondContact O-CD 3.49Å; D409-K430 HydrophobicContact CB-CG 3.81Å; D409-K430 VanDerWaalsContact OD2-CE 3.28Å; D409-K430 WeakPolarHBondContact OD2-CE 3.38Å; K430-N450 WeakPolarHBondContact O-CB 3.4Å; K430-N450 PolarHBondContact O-ND2 3.43Å
431	R	97.4	Very high	97.6	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.196	C	C	.	.			trans	-142.4	141.1	-176.1	-64.2	174.5	-167.5	-79.1	-9.8	112.2	G396 V408 L427 E429 F434 G447 L455 T457 E459	G396-R431 PolarHBondContact N-O 2.93Å; V408-R431 PolarHBondContact O-N 2.89Å; L427-R431 HydrophobicContact CD1-CB 4.31Å; L427-R431 HydrophobicContact CD1-CG 4.45Å; E429-R431 WeakPolarHBondContact O-CG 3.38Å; E429-R431 PolarHBondContact O-N 3.29Å; E429-R431 IonicContact OE2-CZ 3.19Å; E429-R431 IonicContact OE2-NH1 3.28Å; E429-R431 IonicContact OE2-NH2 3.1Å; E429-R431 PolarHBondContact OE2-NH2 3.42Å; R431-F434 HydrophobicContact CB-CB 4.35Å; R431-F434 HydrophobicContact CB-CD1 3.68Å; R431-F434 HydrophobicContact CB-CE1 4.12Å; R431-F434 HydrophobicContact CB-CG 4.01Å; R431-G447 PolarHBondContact NH1-O 2.87Å; R431-L455 HydrophobicContact CG-CD1 3.7Å; R431-T457 VanDerWaalsContact CZ-OG1 3.29Å; R431-T457 PolarHBondContact NH1-O 3.03Å; R431-T457 VanDerWaalsContact NH1-O 3.14Å; R431-T457 PolarHBondContact NH1-OG1 3.25Å; R431-T457 PolarHBondContact NH2-OG1 3.36Å; R431-E459 IonicContact CZ-OE1 3.34Å; R431-E459 VanDerWaalsContact CZ-OE1 3.25Å; R431-E459 IonicContact NE-OE1 3.95Å; R431-E459 PolarHBondContact NE-OE1 3.26Å; R431-E459 IonicContact NH2-OE1 2.75Å; R431-E459 PolarHBondContact NH2-OE1 2.91Å
432	T	97	Very high	97.7	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.199	C	C	.	.	B	Isolated β-bridge	trans	-137.5	163	165.9	-176	0	0	0	0	109.4	Q381 Q397 G404 A407 F434 G448 R449	Q381-T432 VanDerWaalsContact CB-OG1 3.27Å; Q381-T432 WeakPolarHBondContact CB-OG1 3.43Å; Q381-T432 PolarHBondContact O-OG1 3.27Å; Q397-T432 HydrophobicContact CG-CG2 4.14Å; Q397-T432 PolarHBondContact NE2-OG1 2.85Å; G404-T432 VanDerWaalsContact CA-CG2 3.48Å; A407-T432 HydrophobicContact CB-CG2 4.15Å; T432-F434 PolarHBondContact O-N 3.38Å; T432-G448 CarbonylContact O-C 3.21Å; T432-G448 VanDerWaalsContact O-CA 3.3Å; T432-G448 WeakPolarHBondContact O-CA 3.34Å; T432-R449 HydrophobicContact CG2-CG 3.93Å; T432-R449 VanDerWaalsContact CG2-O 3.23Å; T432-R449 WeakPolarHBondContact CG2-O 3.5Å; T432-R449 PolarHBondContact N-O 2.97Å; T432-R449 PolarHBondContact O-N 2.85Å
433	F	96.2	Very high	97.8	Very high	20 Å²	20	34 Å²	34	9%	0.088	18%	0.184	C	C	.	.	S	Bend	trans	53.4	33.6	-177.2	-59.9	-89.1	0	0	0	113.4	Q381 R449 Y479 G480 L527	Q381-F433 HydrophobicContact CG-CD1 4.06Å; Q381-F433 HydrophobicContact CG-CE1 3.72Å; Q381-F433 HydrophobicContact CG-CE2 4.27Å; Q381-F433 HydrophobicContact CG-CG 4.49Å; Q381-F433 HydrophobicContact CG-CZ 3.81Å; Q381-F433 PolarHBondContact O-N 3.28Å; Q381-F433 VanDerWaalsContact OE1-CD1 3.24Å; F433-R449 HydrophobicContact CB-CG 4.43Å; F433-R449 HydrophobicContact CD2-CG 3.98Å; F433-Y479 HydrophobicContact CB-CD2 4.13Å; F433-Y479 HydrophobicContact CG-CD2 4.4Å; F433-Y479 WeakPolarHBondContact O-CA 3.18Å; F433-G480 PolarHBondContact O-N 3.44Å; F433-L527 HydrophobicContact CD1-CD2 3.64Å; F433-L527 HydrophobicContact CE1-CD2 3.93Å
434	F	97.8	Very high	97.9	Very high	8 Å²	8	29.4 Å²	29.4	4%	0.035	16%	0.162	C	C	.	.			trans	-106.2	163.6	-179	72.7	-81.6	0	0	0	109.8	V394 R431 T432 L436 A445 V446	V394-F434 HydrophobicContact CB-CE2 4.45Å; V394-F434 HydrophobicContact CB-CZ 3.93Å; V394-F434 HydrophobicContact CG1-CE2 4.07Å; V394-F434 HydrophobicContact CG1-CZ 3.69Å; V394-F434 WeakPolarHBondContact O-CE1 3.44Å; V394-F434 WeakPolarHBondContact O-CZ 3.41Å; R431-F434 HydrophobicContact CB-CB 4.35Å; R431-F434 HydrophobicContact CB-CD1 3.68Å; R431-F434 HydrophobicContact CB-CE1 4.12Å; R431-F434 HydrophobicContact CB-CG 4.01Å; T432-F434 PolarHBondContact O-N 3.38Å; F434-L436 HydrophobicContact CE2-CB 3.94Å; F434-L436 HydrophobicContact CE2-CD1 4.16Å; F434-A445 HydrophobicContact CD2-CB 3.93Å; F434-A445 HydrophobicContact CE2-CB 3.76Å; F434-V446 WeakPolarHBondContact CB-O 3.34Å
435	H	97.9	Very high	97.9	Very high	21 Å²	21	29 Å²	29	10%	0.097	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	138	171.7	178	65.4	0	0	0	111.4	S437 A445 V446 H481 G483 I492	H435-S437 PolarHBondContact CE1-OG 2.8Å; H435-S437 VanDerWaalsContact CE1-OG 3.26Å; H435-S437 WeakPolarHBondContact NE2-CB 3.41Å; H435-S437 PolarHBondContact NE2-OG 2.82Å; H435-A445 WeakPolarHBondContact O-CA 3.49Å; H435-V446 HydrophobicContact CB-CB 4.4Å; H435-V446 PolarHBondContact N-O 3.13Å; H435-V446 PolarHBondContact O-N 2.92Å; H435-H481 WeakPolarHBondContact CB-NE2 3.5Å; H435-H481 PolarHBondContact N-NE2 2.79Å; H435-G483 WeakPolarHBondContact CE1-CA 3.26Å; H435-G483 PolarHBondContact CE1-O 2.84Å; H435-G483 PolarHBondContact ND1-N 3.38Å; H435-I492 HydrophobicContact CB-CD1 4.07Å; H435-I492 WeakPolarHBondContact CD2-CD1 3.34Å
436	L	98.5	Very high	97.9	Very high	10 Å²	10	27.9 Å²	27.9	5%	0.052	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	131	171.4	-171.7	75.8	0	0	0	109.6	A385 V394 F434 L443 Y444 A445 W468	A385-L436 HydrophobicContact CB-CD2 3.71Å; A385-L436 HydrophobicContact CB-CG 3.95Å; V394-L436 HydrophobicContact CB-CD1 4.25Å; V394-L436 HydrophobicContact CB-CD2 3.84Å; V394-L436 HydrophobicContact CG1-CD1 4.36Å; V394-L436 HydrophobicContact CG2-CD1 3.95Å; V394-L436 HydrophobicContact CG2-CD2 3.43Å; V394-L436 VanDerWaalsContact CG2-CD2 3.43Å; V394-L436 HydrophobicContact CG2-CG 4.38Å; F434-L436 HydrophobicContact CE2-CB 3.94Å; F434-L436 HydrophobicContact CE2-CD1 4.16Å; L436-L443 HydrophobicContact CD1-CB 4.21Å; L436-Y444 WeakPolarHBondContact CA-O 3.44Å; L436-A445 HydrophobicContact CD1-CB 4.06Å; L436-W468 HydrophobicContact CD1-CH2 4.18Å
437	S	97.6	Very high	97.9	Very high	12 Å²	12	25.7 Å²	25.7	8%	0.084	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	146.3	172.5	-92.6	0	0	0	0	112.1	H435 L443 Y444	H435-S437 PolarHBondContact CE1-OG 2.8Å; H435-S437 VanDerWaalsContact CE1-OG 3.26Å; H435-S437 WeakPolarHBondContact NE2-CB 3.41Å; H435-S437 PolarHBondContact NE2-OG 2.82Å; S437-L443 CarbonylContact O-C 3.56Å; S437-L443 WeakPolarHBondContact O-CA 3.05Å; S437-Y444 PolarHBondContact N-O 2.95Å; S437-Y444 VanDerWaalsContact N-O 3.13Å; S437-Y444 PolarHBondContact O-N 2.82Å
438	A	98.3	Very high	97.8	Very high	33 Å²	33	25.3 Å²	25.3	27%	0.273	13%	0.133	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	123.7	164.1	0	0	0	0	0	109.4	A385 V386 I387 L442 L443	A385-A438 HydrophobicContact CB-CB 4.27Å; V386-A438 WeakPolarHBondContact O-CB 3.35Å; I387-A438 HydrophobicContact CD1-CB 4.44Å; I387-A438 HydrophobicContact CG1-CB 3.71Å; A438-L442 CarbonylContact C-O 3.6Å; A438-L442 WeakPolarHBondContact CA-O 3.44Å; A438-L443 HydrophobicContact CB-CD2 4.07Å
439	L	98.3	Very high	97.7	Very high	3 Å²	3	23 Å²	23	2%	0.016	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	123.8	-179.4	173.7	61.8	0	0	0	109.8	G441 L442 Y444 V485 M490 P510	L439-G441 PolarHBondContact O-N 2.87Å; L439-G441 VanDerWaalsContact O-N 3.15Å; L439-L442 PolarHBondContact N-O 3.06Å; L439-L442 PolarHBondContact O-N 3.05Å; L439-Y444 HydrophobicContact CB-CD2 3.79Å; L439-Y444 HydrophobicContact CB-CE2 3.74Å; L439-Y444 HydrophobicContact CD2-CD2 4.38Å; L439-Y444 HydrophobicContact CD2-CE2 4.11Å; L439-Y444 HydrophobicContact CG-CE2 4.13Å; L439-V485 HydrophobicContact CB-CG2 4.09Å; L439-V485 HydrophobicContact CD1-CG1 3.52Å; L439-V485 HydrophobicContact CD1-CG2 4.29Å; L439-M490 HydrophobicContact CD2-CB 4.09Å; L439-P510 HydrophobicContact CD2-CB 4.21Å; L439-P510 HydrophobicContact CD2-CG 3.62Å; L439-P510 HydrophobicContact CG-CG 4.16Å
440	K	97	Very high	97.7	Very high	104 Å²	104	21.7 Å²	21.7	45%	0.452	11%	0.112	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.9	36.9	-179.7	-62.2	178.9	177.3	166.7	0	113.7	L442 G488 P510 D511	K440-L442 VanDerWaalsContact C-N 3.32Å; K440-L442 PolarHBondContact O-N 3.4Å; K440-G488 VanDerWaalsContact CE-O 3.27Å; K440-G488 WeakPolarHBondContact CE-O 3.45Å; K440-G488 PolarHBondContact NZ-O 2.75Å; K440-P510 HydrophobicContact CD-CG 4.04Å; K440-D511 IonicContact NZ-OD1 2.85Å; K440-D511 PolarHBondContact NZ-OD1 2.82Å; K440-D511 IonicContact NZ-OD2 2.76Å; K440-D511 PolarHBondContact NZ-OD2 2.86Å
441	G	97.1	Very high	97.6	Very high	28 Å²	28	20.5 Å²	20.5	29%	0.289	12%	0.122	S	C	.	.	T	Hydrogen-bonded Turn	trans	79	9	179.3	0	0	0	0	0	115.2	V327 L439 P463	V327-G441 WeakPolarHBondContact CG1-O 3.45Å; L439-G441 PolarHBondContact O-N 2.87Å; L439-G441 VanDerWaalsContact O-N 3.15Å; G441-P463 WeakPolarHBondContact O-CD 3.25Å
442	L	98.6	Very high	97.4	Very high	39 Å²	39	25.2 Å²	25.2	20%	0.204	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	162	176	-54.6	173.9	0	0	0	109.6	A438 L439 K440 Y444 Y461 N462	A438-L442 CarbonylContact C-O 3.6Å; A438-L442 WeakPolarHBondContact CA-O 3.44Å; L439-L442 PolarHBondContact N-O 3.06Å; L439-L442 PolarHBondContact O-N 3.05Å; K440-L442 VanDerWaalsContact C-N 3.32Å; K440-L442 PolarHBondContact O-N 3.4Å; L442-Y444 HydrophobicContact CB-CE2 3.83Å; L442-Y461 WeakPolarHBondContact CA-O 3.47Å; L442-Y461 WeakPolarHBondContact CB-O 3.35Å; L442-N462 HydrophobicContact CD2-CB 3.9Å
443	L	98.8	Very high	97.3	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	141	170.7	-53.5	171.5	0	0	0	110.2	A385 I387 Y392 L436 S437 A438 C460 Y461 W468	A385-L443 HydrophobicContact CB-CD2 3.55Å; I387-L443 HydrophobicContact CD1-CD2 3.38Å; I387-L443 HydrophobicContact CD1-CG 3.64Å; I387-L443 HydrophobicContact CG1-CD2 3.78Å; Y392-L443 HydrophobicContact CD1-CD1 3.57Å; Y392-L443 HydrophobicContact CD2-CD1 4.03Å; Y392-L443 HydrophobicContact CD2-CD2 4.47Å; Y392-L443 HydrophobicContact CE1-CD1 4.02Å; Y392-L443 HydrophobicContact CE2-CD1 4.45Å; Y392-L443 HydrophobicContact CG-CD1 3.54Å; L436-L443 HydrophobicContact CD1-CB 4.21Å; S437-L443 CarbonylContact O-C 3.56Å; S437-L443 WeakPolarHBondContact O-CA 3.05Å; A438-L443 HydrophobicContact CB-CD2 4.07Å; L443-C460 CarbonylContact O-C 3.54Å; L443-C460 VanDerWaalsContact O-CA 3.22Å; L443-C460 WeakPolarHBondContact O-CA 3.43Å; L443-Y461 HydrophobicContact CD1-CD1 3.78Å; L443-Y461 HydrophobicContact CD1-CG 4.39Å; L443-Y461 HydrophobicContact CG-CD1 4.13Å; L443-Y461 PolarHBondContact N-O 3.04Å; L443-Y461 VanDerWaalsContact N-O 3.15Å; L443-Y461 PolarHBondContact O-N 3.16Å; L443-W468 HydrophobicContact CB-CH2 4.12Å
444	Y	98.8	Very high	97.3	Very high	12 Å²	12	27.6 Å²	27.6	5%	0.047	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	117.8	175.8	-67.4	-97.5	0	0	0	109.8	L436 S437 L439 L442 E459 C460 V471 M490 F508 P510	L436-Y444 WeakPolarHBondContact CA-O 3.44Å; S437-Y444 PolarHBondContact N-O 2.95Å; S437-Y444 VanDerWaalsContact N-O 3.13Å; S437-Y444 PolarHBondContact O-N 2.82Å; L439-Y444 HydrophobicContact CB-CD2 3.79Å; L439-Y444 HydrophobicContact CB-CE2 3.74Å; L439-Y444 HydrophobicContact CD2-CD2 4.38Å; L439-Y444 HydrophobicContact CD2-CE2 4.11Å; L439-Y444 HydrophobicContact CG-CE2 4.13Å; L442-Y444 HydrophobicContact CB-CE2 3.83Å; Y444-E459 CarbonylContact C-O 3.53Å; Y444-E459 VanDerWaalsContact CA-O 3.3Å; Y444-E459 WeakPolarHBondContact CA-O 3.35Å; Y444-C460 HydrophobicContact CD1-CB 4.05Å; Y444-C460 HydrophobicContact CE1-CB 3.83Å; Y444-C460 VanDerWaalsContact CE1-SG 3.59Å; Y444-C460 VanDerWaalsContact CZ-SG 3.54Å; Y444-V471 HydrophobicContact CD1-CG2 4.31Å; Y444-V471 HydrophobicContact CE1-CG2 4.4Å; Y444-M490 HydrophobicContact CG-CE 4.42Å; Y444-F508 AromaticContact CD1-CE1 3.93Å; Y444-F508 HydrophobicContact CD1-CE1 3.93Å; Y444-F508 AromaticContact CE1-CE1 3.65Å; Y444-F508 HydrophobicContact CE1-CE1 3.65Å; Y444-F508 HydrophobicContact CE1-CZ 4.34Å; Y444-P510 HydrophobicContact CE1-CB 4.48Å; Y444-P510 WeakPolarHBondContact OH-CB 3.36Å
445	A	98.7	Very high	97.3	Very high	0 Å²	0	28 Å²	28	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	114	174	0	0	0	0	0	109	L427 F434 H435 L436 V458 E459 W468	L427-A445 HydrophobicContact CD2-CB 4.02Å; F434-A445 HydrophobicContact CD2-CB 3.93Å; F434-A445 HydrophobicContact CE2-CB 3.76Å; H435-A445 WeakPolarHBondContact O-CA 3.49Å; L436-A445 HydrophobicContact CD1-CB 4.06Å; A445-V458 WeakPolarHBondContact O-CA 3.3Å; A445-E459 PolarHBondContact N-O 2.93Å; A445-E459 PolarHBondContact O-N 3.14Å; A445-W468 HydrophobicContact CB-CH2 4.13Å; A445-W468 HydrophobicContact CB-CZ3 3.84Å
446	V	98.6	Very high	97.2	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	118.9	-170.3	-177.3	0	0	0	0	110.5	F434 H435 V458 M474 H481 M490 I492 W515	F434-V446 WeakPolarHBondContact CB-O 3.34Å; H435-V446 HydrophobicContact CB-CB 4.4Å; H435-V446 PolarHBondContact N-O 3.13Å; H435-V446 PolarHBondContact O-N 2.92Å; V446-V458 HydrophobicContact CG1-CG2 4.15Å; V446-V458 HydrophobicContact CG2-CG1 3.97Å; V446-M474 HydrophobicContact CG1-CE 4.06Å; V446-M474 HydrophobicContact CG1-CG 4.27Å; V446-M474 HydrophobicContact CG1-SD 3.58Å; V446-M474 VanDerWaalsContact CG1-SD 3.58Å; V446-H481 PolarHBondContact O-CE1 2.77Å; V446-H481 PolarHBondContact O-NE2 2.91Å; V446-M490 HydrophobicContact CG2-CE 3.35Å; V446-M490 HydrophobicContact CG2-SD 3.83Å; V446-I492 HydrophobicContact CB-CD1 4.37Å; V446-I492 HydrophobicContact CG1-CD1 4.26Å; V446-I492 HydrophobicContact CG1-CG1 4.21Å; V446-I492 HydrophobicContact CG2-CD1 4.25Å; V446-W515 HydrophobicContact CG1-CH2 4Å; V446-W515 HydrophobicContact CG1-CZ2 4.25Å
447	G	97.9	Very high	97.2	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	19%	0.194	C	C	.	.			trans	61.4	-132.2	170.3	0	0	0	0	0	114.5	R431 L455 T457	R431-G447 PolarHBondContact NH1-O 2.87Å; G447-L455 WeakPolarHBondContact CA-O 3.22Å; G447-T457 PolarHBondContact N-O 3.31Å
448	G	97.3	Very high	97.3	Very high	0 Å²	0	29 Å²	29	0%	0	19%	0.19	C	C	.	.			trans	92.2	-156.9	-175.5	0	0	0	0	0	112.8	T432 L455 H478	T432-G448 CarbonylContact O-C 3.21Å; T432-G448 VanDerWaalsContact O-CA 3.3Å; T432-G448 WeakPolarHBondContact O-CA 3.34Å; G448-L455 PolarHBondContact O-N 3.32Å; G448-H478 PolarHBondContact N-O 2.94Å
449	R	96.1	Very high	97.3	Very high	38 Å²	38	27.4 Å²	27.4	14%	0.143	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	160	177.3	62.2	-173.5	-71.7	156.2	3.4	111.7	K403 T432 F433 G453 Y479	K403-R449 VanDerWaalsContact C-NE 3.3Å; K403-R449 VanDerWaalsContact CA-NH2 3.3Å; K403-R449 VanDerWaalsContact O-CZ 3.24Å; K403-R449 PolarHBondContact O-NE 2.81Å; K403-R449 PolarHBondContact O-NH2 2.81Å; T432-R449 HydrophobicContact CG2-CG 3.93Å; T432-R449 VanDerWaalsContact CG2-O 3.23Å; T432-R449 WeakPolarHBondContact CG2-O 3.5Å; T432-R449 PolarHBondContact N-O 2.97Å; T432-R449 PolarHBondContact O-N 2.85Å; F433-R449 HydrophobicContact CB-CG 4.43Å; F433-R449 HydrophobicContact CD2-CG 3.98Å; R449-G453 CarbonylContact C-O 3.5Å; R449-G453 WeakPolarHBondContact CA-O 3.45Å; R449-G453 WeakPolarHBondContact CB-O 3.46Å; R449-Y479 HydrophobicContact CB-CG 4.49Å; R449-Y479 HydrophobicContact CG-CG 4.3Å; R449-Y479 PolarHBondContact NH1-OH 3.36Å
450	N	96.3	Very high	97.3	Very high	22 Å²	22	27.7 Å²	27.7	12%	0.118	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	-164.6	171.7	66	24.7	0	0	0	110.9	G404 A407 K430 A452 G453 L455	G404-N450 CarbonylContact O-C 3.6Å; G404-N450 VanDerWaalsContact O-CA 3.27Å; G404-N450 WeakPolarHBondContact O-CA 3.39Å; A407-N450 HydrophobicContact CB-CB 3.95Å; K430-N450 WeakPolarHBondContact O-CB 3.4Å; K430-N450 PolarHBondContact O-ND2 3.43Å; N450-A452 PolarHBondContact O-N 2.98Å; N450-A452 WeakPolarHBondContact OD1-CA 3.43Å; N450-A452 WeakPolarHBondContact OD1-CB 3.36Å; N450-A452 PolarHBondContact OD1-N 2.87Å; N450-G453 PolarHBondContact N-O 3.25Å; N450-G453 PolarHBondContact O-N 2.85Å; N450-G453 VanDerWaalsContact O-N 3.16Å; N450-G453 PolarHBondContact OD1-N 3.13Å; N450-L455 HydrophobicContact CB-CD1 4.42Å
451	A	95.1	Very high	97.4	Very high	80 Å²	80	22.7 Å²	22.7	66%	0.661	16%	0.157	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-24.3	-179.9	0	0	0	0	0	114.2	G404	G404-A451 PolarHBondContact O-N 3.44Å
452	A	94.3	Very high	97.4	Very high	99 Å²	99	23.7 Å²	23.7	82%	0.818	16%	0.156	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-19.3	178.2	0	0	0	0	0	113.1	N450	N450-A452 PolarHBondContact O-N 2.98Å; N450-A452 WeakPolarHBondContact OD1-CA 3.43Å; N450-A452 WeakPolarHBondContact OD1-CB 3.36Å; N450-A452 PolarHBondContact OD1-N 2.87Å
453	G	94.4	Very high	97.4	Very high	26 Å²	26	21.9 Å²	21.9	27%	0.268	15%	0.146	S	C	.	.	E	Extended strand (participates in β ladder)	trans	135.8	-156.1	178.7	0	0	0	0	0	113.3	R449 N450	R449-G453 CarbonylContact C-O 3.5Å; R449-G453 WeakPolarHBondContact CA-O 3.45Å; R449-G453 WeakPolarHBondContact CB-O 3.46Å; N450-G453 PolarHBondContact N-O 3.25Å; N450-G453 PolarHBondContact O-N 2.85Å; N450-G453 VanDerWaalsContact O-N 3.16Å; N450-G453 PolarHBondContact OD1-N 3.13Å
454	E	95.9	Very high	97.3	Very high	44 Å²	44	28.3 Å²	28.3	21%	0.206	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	143.2	178.2	-50.8	172.7	158.1	0	0	110.1	P477 Y479 H498	E454-P477 HydrophobicContact CB-CB 3.62Å; E454-P477 HydrophobicContact CB-CG 3.97Å; E454-Y479 HydrophobicContact CG-CD1 3.95Å; E454-Y479 HydrophobicContact CG-CE1 4.21Å; E454-Y479 WeakPolarHBondContact OE1-CE1 3.33Å; E454-H498 PolarHBondContact OE1-N 2.8Å; E454-H498 IonicContact OE2-CE1 3.68Å; E454-H498 IonicContact OE2-CG 3.42Å; E454-H498 PolarHBondContact OE2-N 2.78Å; E454-H498 VanDerWaalsContact OE2-N 3.11Å; E454-H498 IonicContact OE2-ND1 3.68Å; E454-H498 PolarHBondContact OE2-ND1 3.35Å
455	L	97	Very high	97.3	Very high	17 Å²	17	31.2 Å²	31.2	9%	0.089	19%	0.194	C	C	.	.			trans	-115	130	-172.3	-59.5	169.7	0	0	0	111	R431 G447 G448 N450	R431-L455 HydrophobicContact CG-CD1 3.7Å; G447-L455 WeakPolarHBondContact CA-O 3.22Å; G448-L455 PolarHBondContact O-N 3.32Å; N450-L455 HydrophobicContact CB-CD1 4.42Å
456	P	97.2	Very high	97.2	Very high	36 Å²	36	32.9 Å²	32.9	23%	0.234	20%	0.203	C	C	.	.			trans	-92.5	-12.4	169.9	35.2	-32.7	0	0	0	112.6	K473 M474 P477	P456-K473 WeakPolarHBondContact O-CA 3.42Å; P456-K473 WeakPolarHBondContact O-CB 3.27Å; P456-M474 PolarHBondContact O-N 3.05Å; P456-P477 HydrophobicContact CB-CB 4.27Å
457	T	98.4	Very high	97.2	Very high	27 Å²	27	38.3 Å²	38.3	17%	0.166	23%	0.228	C	C	.	.			trans	-67.1	147.9	-172.7	39.5	0	0	0	0	112	E429 R431 G447 Y470	E429-T457 PolarHBondContact OE2-OG1 2.94Å; R431-T457 VanDerWaalsContact CZ-OG1 3.29Å; R431-T457 PolarHBondContact NH1-O 3.03Å; R431-T457 VanDerWaalsContact NH1-O 3.14Å; R431-T457 PolarHBondContact NH1-OG1 3.25Å; R431-T457 PolarHBondContact NH2-OG1 3.36Å; G447-T457 PolarHBondContact N-O 3.31Å; T457-Y470 HydrophobicContact CG2-CD1 4.45Å; T457-Y470 HydrophobicContact CG2-CE1 4.18Å
458	V	98.6	Very high	97.3	Very high	1 Å²	1	39 Å²	39	1%	0.006	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	130.7	177.8	-174.2	0	0	0	0	108	A445 V446 Y470 V471 A472 M474 W515	A445-V458 WeakPolarHBondContact O-CA 3.3Å; V446-V458 HydrophobicContact CG1-CG2 4.15Å; V446-V458 HydrophobicContact CG2-CG1 3.97Å; V458-Y470 WeakPolarHBondContact O-CA 3.45Å; V458-V471 HydrophobicContact CB-CG2 3.71Å; V458-V471 HydrophobicContact CG1-CG2 3.44Å; V458-V471 VanDerWaalsContact CG1-CG2 3.44Å; V458-V471 PolarHBondContact O-N 2.83Å; V458-A472 WeakPolarHBondContact CG2-O 3.22Å; V458-M474 HydrophobicContact CG2-CG 4.44Å; V458-W515 HydrophobicContact CG2-CZ2 3.93Å
459	E	98.6	Very high	97.3	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	140.9	-179.9	-61.3	-178.2	-120.8	0	0	110.6	L427 N428 E429 R431 Y444 A445 W468 T469 Y470	L427-E459 HydrophobicContact CD2-CB 4.48Å; N428-E459 VanDerWaalsContact CB-OE2 3.25Å; N428-E459 WeakPolarHBondContact CB-OE2 3.33Å; N428-E459 PolarHBondContact N-OE2 2.82Å; N428-E459 PolarHBondContact ND2-OE2 2.95Å; E429-E459 PolarHBondContact N-OE1 2.94Å; R431-E459 IonicContact CZ-OE1 3.34Å; R431-E459 VanDerWaalsContact CZ-OE1 3.25Å; R431-E459 IonicContact NE-OE1 3.95Å; R431-E459 PolarHBondContact NE-OE1 3.26Å; R431-E459 IonicContact NH2-OE1 2.75Å; R431-E459 PolarHBondContact NH2-OE1 2.91Å; Y444-E459 CarbonylContact C-O 3.53Å; Y444-E459 VanDerWaalsContact CA-O 3.3Å; Y444-E459 WeakPolarHBondContact CA-O 3.35Å; A445-E459 PolarHBondContact N-O 2.93Å; A445-E459 PolarHBondContact O-N 3.14Å; E459-W468 HydrophobicContact CB-CE3 3.63Å; E459-W468 HydrophobicContact CB-CZ3 4.12Å; E459-T469 CarbonylContact C-O 3.51Å; E459-T469 WeakPolarHBondContact CA-O 3.34Å; E459-Y470 HydrophobicContact CG-CD1 3.85Å; E459-Y470 HydrophobicContact CG-CE1 3.83Å
460	C	98.7	Very high	97.5	Very high	8 Å²	8	46.3 Å²	46.3	5%	0.054	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	120.6	179.2	-175.4	0	0	0	0	110.6	L443 Y444 W468 T469 V471	L443-C460 CarbonylContact O-C 3.54Å; L443-C460 VanDerWaalsContact O-CA 3.22Å; L443-C460 WeakPolarHBondContact O-CA 3.43Å; Y444-C460 HydrophobicContact CD1-CB 4.05Å; Y444-C460 HydrophobicContact CE1-CB 3.83Å; Y444-C460 VanDerWaalsContact CE1-SG 3.59Å; Y444-C460 VanDerWaalsContact CZ-SG 3.54Å; C460-W468 CarbonylContact O-C 3.29Å; C460-W468 WeakPolarHBondContact O-CA 3.26Å; C460-T469 PolarHBondContact N-O 2.83Å; C460-T469 PolarHBondContact O-N 3Å; C460-T469 PolarHBondContact O-OG1 2.9Å; C460-V471 HydrophobicContact CB-CG1 3.69Å
461	Y	98.8	Very high	97.6	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	130.3	173.6	179	-111.2	0	0	0	111.1	Y392 V424 A425 L442 L443 P463 N466 E467 W468	Y392-Y461 HydrophobicContact CE1-CD1 4.39Å; Y392-Y461 AromaticContact CE1-CE1 3.77Å; Y392-Y461 HydrophobicContact CE1-CE1 3.77Å; V424-Y461 HydrophobicContact CG2-CE2 4.45Å; A425-Y461 HydrophobicContact CB-CE2 4.34Å; L442-Y461 WeakPolarHBondContact CA-O 3.47Å; L442-Y461 WeakPolarHBondContact CB-O 3.35Å; L443-Y461 HydrophobicContact CD1-CD1 3.78Å; L443-Y461 HydrophobicContact CD1-CG 4.39Å; L443-Y461 HydrophobicContact CG-CD1 4.13Å; L443-Y461 PolarHBondContact N-O 3.04Å; L443-Y461 VanDerWaalsContact N-O 3.15Å; L443-Y461 PolarHBondContact O-N 3.16Å; Y461-P463 HydrophobicContact CD1-CG 4.04Å; Y461-P463 HydrophobicContact CE1-CB 4.13Å; Y461-P463 HydrophobicContact CE1-CG 3.81Å; Y461-N466 PolarHBondContact OH-OD1 3.15Å; Y461-E467 WeakPolarHBondContact CA-O 3.25Å; Y461-E467 WeakPolarHBondContact CD2-O 3.46Å; Y461-W468 AromaticContact CD2-CD1 3.77Å; Y461-W468 HydrophobicContact CD2-CD2 4.16Å; Y461-W468 AromaticContact CD2-CE2 3.81Å; Y461-W468 HydrophobicContact CD2-CG 4.16Å; Y461-W468 HydrophobicContact CD2-CZ2 4.39Å; Y461-W468 AromaticContact CD2-NE1 3.53Å; Y461-W468 HydrophobicContact CG-CD2 4.31Å; Y461-W468 AromaticContact CG-CE2 3.95Å; Y461-W468 HydrophobicContact CG-CZ2 4.13Å; Y461-W468 VanDerWaalsContact N-CE3 3.34Å
462	N	98.4	Very high	97.7	Very high	49 Å²	49	44.2 Å²	44.2	26%	0.262	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	110	173.1	-172.4	-12.7	0	0	0	111.3	L442 K464 T465 N466 E467	L442-N462 HydrophobicContact CD2-CB 3.9Å; N462-K464 PolarHBondContact O-N 2.81Å; N462-K464 WeakPolarHBondContact OD1-CB 3.27Å; N462-K464 WeakPolarHBondContact OD1-CG 3.36Å; N462-K464 PolarHBondContact OD1-N 2.77Å; N462-T465 PolarHBondContact O-N 2.89Å; N462-N466 WeakPolarHBondContact O-CA 3.4Å; N462-N466 PolarHBondContact O-N 2.82Å; N462-E467 PolarHBondContact N-O 3.2Å
463	P	98.1	Very high	97.9	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-20.2	176.1	-23.4	33.2	0	0	0	114.3	F323 V327 I387 G441 Y461	F323-P463 CarbonylContact C-O 3.56Å; F323-P463 VanDerWaalsContact C-O 3.29Å; F323-P463 WeakPolarHBondContact O-CB 3.25Å; V327-P463 HydrophobicContact CG1-CB 4.27Å; V327-P463 HydrophobicContact CG1-CG 4.11Å; V327-P463 HydrophobicContact CG2-CB 4.44Å; I387-P463 HydrophobicContact CD1-CG 4.21Å; G441-P463 WeakPolarHBondContact O-CD 3.25Å; Y461-P463 HydrophobicContact CD1-CG 4.04Å; Y461-P463 HydrophobicContact CE1-CB 4.13Å; Y461-P463 HydrophobicContact CE1-CG 3.81Å
464	K	96.8	Very high	98	Very high	135 Å²	135	45.1 Å²	45.1	59%	0.587	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-38.8	178	-58	-173.1	177.7	175.1	0	113	M324 V327 N462	M324-K464 HydrophobicContact CE-CB 4.39Å; M324-K464 HydrophobicContact CE-CG 4.11Å; V327-K464 HydrophobicContact CG2-CG 4.16Å; N462-K464 PolarHBondContact O-N 2.81Å; N462-K464 WeakPolarHBondContact OD1-CB 3.27Å; N462-K464 WeakPolarHBondContact OD1-CG 3.36Å; N462-K464 PolarHBondContact OD1-N 2.77Å
465	T	97.4	Very high	97.8	Very high	74 Å²	74	49.6 Å²	49.6	45%	0.454	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.8	-14.6	-179.6	59.6	0	0	0	0	112.3	N462 E467	N462-T465 PolarHBondContact O-N 2.89Å; T465-E467 VanDerWaalsContact C-N 3.35Å
466	N	98.2	Very high	97.5	Very high	35 Å²	35	53.5 Å²	53.5	19%	0.187	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	55.3	50.3	-170.5	-178.1	42.8	0	0	0	110.9	F323 V424 A425 Y461 N462	F323-N466 HydrophobicContact CB-CB 4.13Å; F323-N466 HydrophobicContact CD2-CB 3.94Å; F323-N466 HydrophobicContact CG-CB 3.96Å; V424-N466 WeakPolarHBondContact CB-OD1 3.23Å; A425-N466 WeakPolarHBondContact CB-O 3.38Å; A425-N466 PolarHBondContact N-OD1 2.82Å; Y461-N466 PolarHBondContact OH-OD1 3.15Å; N462-N466 WeakPolarHBondContact O-CA 3.4Å; N462-N466 PolarHBondContact O-N 2.82Å
467	E	98.4	Very high	97.4	Very high	113 Å²	113	52.6 Å²	52.6	53%	0.528	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	150	-177.4	-68	173.7	157.7	0	0	111	Y461 N462 T465	Y461-E467 WeakPolarHBondContact CA-O 3.25Å; Y461-E467 WeakPolarHBondContact CD2-O 3.46Å; N462-E467 PolarHBondContact N-O 3.2Å; T465-E467 VanDerWaalsContact C-N 3.35Å
468	W	98.8	Very high	97.1	Very high	14 Å²	14	52.5 Å²	52.5	5%	0.053	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	133.4	170.9	-72	91.3	0	0	0	110.3	V394 V411 A425 L427 N428 L436 L443 A445 E459 C460 Y461	V394-W468 HydrophobicContact CG1-CH2 4.09Å; V394-W468 HydrophobicContact CG1-CZ2 4Å; V394-W468 HydrophobicContact CG2-CH2 4.3Å; V394-W468 HydrophobicContact CG2-CZ2 4.1Å; V411-W468 HydrophobicContact CG2-CZ2 4.01Å; A425-W468 PolarHBondContact O-NE1 2.99Å; L427-W468 HydrophobicContact CD2-CD2 3.73Å; L427-W468 HydrophobicContact CD2-CE3 3.75Å; L427-W468 HydrophobicContact CD2-CG 4.46Å; L427-W468 HydrophobicContact CD2-CH2 3.76Å; L427-W468 HydrophobicContact CD2-CZ2 3.74Å; L427-W468 HydrophobicContact CD2-CZ3 3.76Å; L427-W468 HydrophobicContact CG-CZ2 4.46Å; N428-W468 VanDerWaalsContact ND2-CB 3.32Å; N428-W468 WeakPolarHBondContact ND2-CB 3.27Å; N428-W468 PolarHBondContact ND2-O 3.03Å; L436-W468 HydrophobicContact CD1-CH2 4.18Å; L443-W468 HydrophobicContact CB-CH2 4.12Å; A445-W468 HydrophobicContact CB-CH2 4.13Å; A445-W468 HydrophobicContact CB-CZ3 3.84Å; E459-W468 HydrophobicContact CB-CE3 3.63Å; E459-W468 HydrophobicContact CB-CZ3 4.12Å; C460-W468 CarbonylContact O-C 3.29Å; C460-W468 WeakPolarHBondContact O-CA 3.26Å; Y461-W468 AromaticContact CD2-CD1 3.77Å; Y461-W468 HydrophobicContact CD2-CD2 4.16Å; Y461-W468 AromaticContact CD2-CE2 3.81Å; Y461-W468 HydrophobicContact CD2-CG 4.16Å; Y461-W468 HydrophobicContact CD2-CZ2 4.39Å; Y461-W468 AromaticContact CD2-NE1 3.53Å; Y461-W468 HydrophobicContact CG-CD2 4.31Å; Y461-W468 AromaticContact CG-CE2 3.95Å; Y461-W468 HydrophobicContact CG-CZ2 4.13Å; Y461-W468 VanDerWaalsContact N-CE3 3.34Å
469	T	98.6	Very high	97	Very high	77 Å²	77	53.5 Å²	53.5	47%	0.472	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	149.3	177.5	54.4	0	0	0	0	110.5	E459 C460	E459-T469 CarbonylContact C-O 3.51Å; E459-T469 WeakPolarHBondContact CA-O 3.34Å; C460-T469 PolarHBondContact N-O 2.83Å; C460-T469 PolarHBondContact O-N 3Å; C460-T469 PolarHBondContact O-OG1 2.9Å
470	Y	98.7	Very high	96.9	Very high	115 Å²	115	53.8 Å²	53.8	45%	0.451	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	140.7	174.5	-68	-81.2	0	0	0	111	N428 E429 T457 V458 E459	N428-Y470 HydrophobicContact CB-CE2 3.8Å; N428-Y470 WeakPolarHBondContact CB-OH 3.46Å; E429-Y470 VanDerWaalsContact CD-OH 3.31Å; E429-Y470 WeakPolarHBondContact CG-OH 3.47Å; E429-Y470 PolarHBondContact OE1-OH 3.35Å; T457-Y470 HydrophobicContact CG2-CD1 4.45Å; T457-Y470 HydrophobicContact CG2-CE1 4.18Å; V458-Y470 WeakPolarHBondContact O-CA 3.45Å; E459-Y470 HydrophobicContact CG-CD1 3.85Å; E459-Y470 HydrophobicContact CG-CE1 3.83Å
471	V	98.6	Very high	96.8	Very high	34 Å²	34	53.9 Å²	53.9	21%	0.206	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	-175.3	172.6	-59.8	0	0	0	0	109.5	Y444 V458 C460 K473 F508 D513	Y444-V471 HydrophobicContact CD1-CG2 4.31Å; Y444-V471 HydrophobicContact CE1-CG2 4.4Å; V458-V471 HydrophobicContact CB-CG2 3.71Å; V458-V471 HydrophobicContact CG1-CG2 3.44Å; V458-V471 VanDerWaalsContact CG1-CG2 3.44Å; V458-V471 PolarHBondContact O-N 2.83Å; C460-V471 HydrophobicContact CB-CG1 3.69Å; V471-K473 PolarHBondContact O-N 3.05Å; V471-K473 VanDerWaalsContact O-N 3.13Å; V471-F508 HydrophobicContact CB-CZ 4.34Å; V471-F508 HydrophobicContact CG2-CZ 4.02Å; V471-D513 WeakPolarHBondContact CB-OD1 3.49Å
472	A	98.3	Very high	96.8	Very high	25 Å²	25	54.2 Å²	54.2	21%	0.207	27%	0.272	C	S	.	.	P	Polyproline II helix	trans	-54.2	123.5	-178.8	0	0	0	0	0	112	V458 F508 D513 W515	V458-A472 WeakPolarHBondContact CG2-O 3.22Å; A472-F508 HydrophobicContact CB-CE2 4.18Å; A472-D513 WeakPolarHBondContact CB-O 3.45Å; A472-D513 VanDerWaalsContact CB-OD1 3.26Å; A472-D513 WeakPolarHBondContact CB-OD1 3.47Å; A472-D513 PolarHBondContact N-OD1 3.45Å; A472-D513 PolarHBondContact N-OD2 3.23Å; A472-W515 PolarHBondContact O-NE1 2.68Å
473	K	97.9	Very high	96.7	Very high	138 Å²	138	52.1 Å²	52.1	60%	0.6	26%	0.262	S	S	*	.	P	Polyproline II helix	trans	-72.4	160.1	177.5	64.2	173.3	-176.2	172.9	0	111.9	P456 V471 W515	P456-K473 WeakPolarHBondContact O-CA 3.42Å; P456-K473 WeakPolarHBondContact O-CB 3.27Å; V471-K473 PolarHBondContact O-N 3.05Å; V471-K473 VanDerWaalsContact O-N 3.13Å; K473-W515 VanDerWaalsContact O-CD1 3.32Å; K473-W515 PolarHBondContact O-NE1 3.15Å
474	M	95.8	Very high	96.7	Very high	6 Å²	6	53 Å²	53	3%	0.03	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-68.6	154.9	165.8	-61	-177	-62.8	0	0	110.4	V446 P456 V458 E476 H478 W515	V446-M474 HydrophobicContact CG1-CE 4.06Å; V446-M474 HydrophobicContact CG1-CG 4.27Å; V446-M474 HydrophobicContact CG1-SD 3.58Å; V446-M474 VanDerWaalsContact CG1-SD 3.58Å; P456-M474 PolarHBondContact O-N 3.05Å; V458-M474 HydrophobicContact CG2-CG 4.44Å; M474-E476 VanDerWaalsContact CB-O 3.26Å; M474-E476 WeakPolarHBondContact CB-O 3.39Å; M474-H478 HydrophobicContact CE-CB 4.05Å; M474-H478 HydrophobicContact SD-CB 4.47Å; M474-W515 HydrophobicContact CG-CH2 4.33Å; M474-W515 HydrophobicContact CG-CZ2 4Å
475	N	91.7	Very high	96.8	Very high	137 Å²	137	48.4 Å²	48.4	73%	0.733	25%	0.251	S	S	*	.	S	Bend	trans	-67	-43.7	176.3	-71.5	-15.1	0	0	0	111.3
476	E	92.1	Very high	96.9	Very high	99 Å²	99	48.1 Å²	48.1	46%	0.463	24%	0.242	S	C	.	.	S	Bend	trans	-115.4	151.7	176.4	-65.6	-58.3	151.8	0	0	110.1	M474 H478 T497	M474-E476 VanDerWaalsContact CB-O 3.26Å; M474-E476 WeakPolarHBondContact CB-O 3.39Å; E476-H478 PolarHBondContact O-CD2 2.8Å; E476-T497 HydrophobicContact CB-CG2 4.25Å
477	P	93.8	Very high	96.8	Very high	18 Å²	18	49.6 Å²	49.6	12%	0.117	27%	0.266	C	S	.	.			trans	-76	138.8	174.1	33.6	-35	0	0	0	110.6	E454 P456 T497	E454-P477 HydrophobicContact CB-CB 3.62Å; E454-P477 HydrophobicContact CB-CG 3.97Å; P456-P477 HydrophobicContact CB-CB 4.27Å; P477-T497 WeakPolarHBondContact O-CB 3.46Å; P477-T497 VanDerWaalsContact O-CG2 3.3Å; P477-T497 WeakPolarHBondContact O-CG2 3.42Å; P477-T497 PolarHBondContact O-OG1 3.47Å
478	H	92.8	Very high	96.8	Very high	24 Å²	24	45.5 Å²	45.5	11%	0.111	25%	0.253	C	S	.	.			trans	-134	139.7	179.2	-63.8	-93.9	0	0	0	110.3	G448 M474 E476 H481 I496 T497	G448-H478 PolarHBondContact N-O 2.94Å; M474-H478 HydrophobicContact CE-CB 4.05Å; M474-H478 HydrophobicContact SD-CB 4.47Å; E476-H478 PolarHBondContact O-CD2 2.8Å; H478-H481 WeakPolarHBondContact CB-ND1 3.23Å; H478-H481 PolarHBondContact O-CE1 2.87Å; H478-H481 VanDerWaalsContact O-CE1 3.26Å; H478-H481 PolarHBondContact O-ND1 2.98Å; H478-I496 WeakPolarHBondContact CA-O 3.36Å; H478-T497 PolarHBondContact CE1-OG1 2.82Å; H478-T497 VanDerWaalsContact CE1-OG1 3.23Å; H478-T497 PolarHBondContact ND1-OG1 2.92Å
479	Y	96.5	Very high	96.8	Very high	22 Å²	22	46 Å²	46	9%	0.086	26%	0.258	C	S	.	.	B	Isolated β-bridge	trans	-130.2	158.7	165.4	75.3	-86.3	0	0	0	111	F433 R449 E454 H481 I496	F433-Y479 HydrophobicContact CB-CD2 4.13Å; F433-Y479 HydrophobicContact CG-CD2 4.4Å; F433-Y479 WeakPolarHBondContact O-CA 3.18Å; R449-Y479 HydrophobicContact CB-CG 4.49Å; R449-Y479 HydrophobicContact CG-CG 4.3Å; R449-Y479 PolarHBondContact NH1-OH 3.36Å; E454-Y479 HydrophobicContact CG-CD1 3.95Å; E454-Y479 HydrophobicContact CG-CE1 4.21Å; E454-Y479 WeakPolarHBondContact OE1-CE1 3.33Å; Y479-H481 PolarHBondContact O-N 2.97Å; Y479-H481 VanDerWaalsContact O-N 3.15Å; Y479-I496 HydrophobicContact CD1-CB 4.22Å; Y479-I496 WeakPolarHBondContact CD1-O 3.29Å; Y479-I496 HydrophobicContact CE1-CB 3.73Å; Y479-I496 HydrophobicContact CE1-CG2 3.64Å; Y479-I496 HydrophobicContact CE2-CB 4.12Å; Y479-I496 HydrophobicContact CE2-CD1 3.73Å; Y479-I496 HydrophobicContact CE2-CG1 4.49Å; Y479-I496 HydrophobicContact CE2-CG2 4.5Å; Y479-I496 PolarHBondContact N-O 2.91Å; Y479-I496 PolarHBondContact O-N 2.98Å; Y479-I496 WeakPolarHBondContact OH-CG2 3.43Å
480	G	95.8	Very high	96.8	Very high	6 Å²	6	42.3 Å²	42.3	6%	0.062	24%	0.235	C	C	.	.	S	Bend	trans	63.1	18.8	-177.3	0	0	0	0	0	113.6	F433 L527	F433-G480 PolarHBondContact O-N 3.44Å; G480-L527 PolarHBondContact O-N 3.1Å
481	H	97.6	Very high	96.8	Very high	11 Å²	11	37.5 Å²	37.5	5%	0.051	22%	0.217	C	C	.	.			trans	-79.5	162.6	170.6	56.9	-92	0	0	0	109.9	H435 V446 H478 Y479 I492 G494	H435-H481 WeakPolarHBondContact CB-NE2 3.5Å; H435-H481 PolarHBondContact N-NE2 2.79Å; V446-H481 PolarHBondContact O-CE1 2.77Å; V446-H481 PolarHBondContact O-NE2 2.91Å; H478-H481 WeakPolarHBondContact CB-ND1 3.23Å; H478-H481 PolarHBondContact O-CE1 2.87Å; H478-H481 VanDerWaalsContact O-CE1 3.26Å; H478-H481 PolarHBondContact O-ND1 2.98Å; Y479-H481 PolarHBondContact O-N 2.97Å; Y479-H481 VanDerWaalsContact O-N 3.15Å; H481-I492 HydrophobicContact CB-CG2 4Å; H481-I492 WeakPolarHBondContact CD2-CG2 3.22Å; H481-G494 WeakPolarHBondContact CB-O 3.44Å
482	A	97.7	Very high	96.8	Very high	7 Å²	7	36.2 Å²	36.2	6%	0.058	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	154.5	175.4	0	0	0	0	0	110.6	I492 S493 H528 M530	A482-I492 CarbonylContact O-C 3.5Å; A482-I492 WeakPolarHBondContact O-CA 3.34Å; A482-S493 PolarHBondContact N-O 2.85Å; A482-S493 PolarHBondContact O-N 2.76Å; A482-S493 PolarHBondContact O-OG 2.82Å; A482-H528 VanDerWaalsContact CB-CD2 3.47Å; A482-H528 WeakPolarHBondContact CB-CD2 3.33Å; A482-H528 WeakPolarHBondContact CB-NE2 3.48Å; A482-H528 WeakPolarHBondContact CB-O 3.44Å; A482-M530 HydrophobicContact CB-CB 3.73Å
483	G	97.8	Very high	96.7	Very high	5 Å²	5	35 Å²	35	5%	0.052	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	169.3	180	0	0	0	0	0	113.4	H435 Y491	H435-G483 WeakPolarHBondContact CE1-CA 3.26Å; H435-G483 PolarHBondContact CE1-O 2.84Å; H435-G483 PolarHBondContact ND1-N 3.38Å; G483-Y491 CarbonylContact C-O 3.55Å; G483-Y491 WeakPolarHBondContact CA-O 3.46Å
484	T	98.5	Very high	96.7	Very high	19 Å²	19	28.7 Å²	28.7	12%	0.117	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160	172.4	174.8	-165.8	0	0	0	0	110	Y491 M530 T532 L537	T484-Y491 PolarHBondContact N-O 2.85Å; T484-Y491 PolarHBondContact O-N 2.89Å; T484-M530 HydrophobicContact CG2-CE 3.86Å; T484-M530 HydrophobicContact CG2-CG 3.75Å; T484-M530 HydrophobicContact CG2-SD 4.02Å; T484-T532 WeakPolarHBondContact CG2-OG1 3.19Å; T484-T532 PolarHBondContact OG1-N 3.43Å; T484-T532 PolarHBondContact OG1-OG1 3.21Å; T484-L537 HydrophobicContact CG2-CB 3.98Å; T484-L537 HydrophobicContact CG2-CD2 3.59Å; T484-L537 HydrophobicContact CG2-CG 4.06Å
485	V	98.4	Very high	96.8	Very high	38 Å²	38	28.4 Å²	28.4	23%	0.23	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	132.6	-175.1	167.3	0	0	0	0	110.2	L439 V489 M490 T532	L439-V485 HydrophobicContact CB-CG2 4.09Å; L439-V485 HydrophobicContact CD1-CG1 3.52Å; L439-V485 HydrophobicContact CD1-CG2 4.29Å; V485-V489 WeakPolarHBondContact CA-O 3.35Å; V485-M490 HydrophobicContact CG2-CB 4.21Å; V485-M490 HydrophobicContact CG2-CG 4.42Å; V485-T532 PolarHBondContact O-OG1 2.87Å
486	Y	98.3	Very high	97	Very high	67 Å²	67	22.3 Å²	22.3	26%	0.263	14%	0.138	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	142	172.9	177.8	-100.1	0	0	0	110.2	G488 V489 T532 G534 D535 P562	Y486-G488 PolarHBondContact O-N 3.33Å; Y486-V489 PolarHBondContact N-O 2.68Å; Y486-V489 VanDerWaalsContact N-O 3.11Å; Y486-V489 VanDerWaalsContact O-CG2 3.23Å; Y486-V489 WeakPolarHBondContact O-CG2 3.27Å; Y486-V489 PolarHBondContact O-N 2.99Å; Y486-T532 HydrophobicContact CD2-CG2 3.87Å; Y486-T532 HydrophobicContact CG-CG2 4.43Å; Y486-G534 WeakPolarHBondContact CE2-O 3.44Å; Y486-D535 HydrophobicContact CE2-CB 4.26Å; Y486-D535 WeakPolarHBondContact OH-CB 3.49Å; Y486-P562 HydrophobicContact CD1-CB 4.12Å; Y486-P562 HydrophobicContact CD1-CG 3.61Å; Y486-P562 HydrophobicContact CE1-CB 4.08Å; Y486-P562 HydrophobicContact CE1-CG 3.83Å
487	G	97.1	Very high	97.1	Very high	67 Å²	67	18 Å²	18	69%	0.691	12%	0.119	S	C	*	.	T	Hydrogen-bonded Turn	trans	62.1	25.6	175.1	0	0	0	0	0	115	V489	G487-V489 VanDerWaalsContact C-N 3.31Å; G487-V489 PolarHBondContact O-N 2.83Å
488	G	97.6	Very high	97	Very high	26 Å²	26	22.8 Å²	22.8	27%	0.268	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	77.9	11.7	179.9	0	0	0	0	0	115.1	K440 Y486	K440-G488 VanDerWaalsContact CE-O 3.27Å; K440-G488 WeakPolarHBondContact CE-O 3.45Å; K440-G488 PolarHBondContact NZ-O 2.75Å; Y486-G488 PolarHBondContact O-N 3.33Å
489	V	98.6	Very high	96.7	Very high	24 Å²	24	27.4 Å²	27.4	15%	0.145	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	161.5	174.8	-60.4	0	0	0	0	110.3	V485 Y486 G487 Y491 F508 D509	V485-V489 WeakPolarHBondContact CA-O 3.35Å; Y486-V489 PolarHBondContact N-O 2.68Å; Y486-V489 VanDerWaalsContact N-O 3.11Å; Y486-V489 VanDerWaalsContact O-CG2 3.23Å; Y486-V489 WeakPolarHBondContact O-CG2 3.27Å; Y486-V489 PolarHBondContact O-N 2.99Å; G487-V489 VanDerWaalsContact C-N 3.31Å; G487-V489 PolarHBondContact O-N 2.83Å; V489-Y491 HydrophobicContact CG2-CD2 4.33Å; V489-Y491 HydrophobicContact CG2-CE2 3.47Å; V489-Y491 VanDerWaalsContact CG2-CE2 3.47Å; V489-F508 WeakPolarHBondContact CA-O 3.45Å; V489-F508 WeakPolarHBondContact CB-O 3.49Å; V489-D509 HydrophobicContact CG1-CB 3.99Å
490	M	98.6	Very high	96.6	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	137.9	179.2	177.2	172.2	57.8	0	0	110.5	L439 Y444 V446 V485 I492 C507 F508 W515	L439-M490 HydrophobicContact CD2-CB 4.09Å; Y444-M490 HydrophobicContact CG-CE 4.42Å; V446-M490 HydrophobicContact CG2-CE 3.35Å; V446-M490 HydrophobicContact CG2-SD 3.83Å; V485-M490 HydrophobicContact CG2-CB 4.21Å; V485-M490 HydrophobicContact CG2-CG 4.42Å; M490-I492 HydrophobicContact CG-CD1 4.05Å; M490-I492 HydrophobicContact CG-CG1 4.49Å; M490-I492 HydrophobicContact SD-CD1 4.14Å; M490-C507 CarbonylContact O-C 3.57Å; M490-C507 VanDerWaalsContact O-CA 3.3Å; M490-C507 WeakPolarHBondContact O-CA 3.19Å; M490-F508 HydrophobicContact CB-CB 4.41Å; M490-F508 HydrophobicContact CE-CB 4.13Å; M490-F508 HydrophobicContact CE-CD1 3.82Å; M490-F508 HydrophobicContact CE-CG 4.26Å; M490-F508 PolarHBondContact N-O 2.86Å; M490-F508 PolarHBondContact O-N 3.06Å; M490-W515 HydrophobicContact CE-CH2 4.16Å
491	Y	98.7	Very high	96.6	Very high	15 Å²	15	30.8 Å²	30.8	6%	0.059	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	134.4	177.1	-65.2	-95.5	0	0	0	109.6	G483 T484 V489 L505 M506 C507 K518 L537 Y560	G483-Y491 CarbonylContact C-O 3.55Å; G483-Y491 WeakPolarHBondContact CA-O 3.46Å; T484-Y491 PolarHBondContact N-O 2.85Å; T484-Y491 PolarHBondContact O-N 2.89Å; V489-Y491 HydrophobicContact CG2-CD2 4.33Å; V489-Y491 HydrophobicContact CG2-CE2 3.47Å; V489-Y491 VanDerWaalsContact CG2-CE2 3.47Å; Y491-L505 HydrophobicContact CD1-CD1 4.35Å; Y491-L505 HydrophobicContact CD1-CD2 4.3Å; Y491-L505 HydrophobicContact CD1-CG 4.39Å; Y491-M506 CarbonylContact C-O 3.57Å; Y491-M506 WeakPolarHBondContact CA-O 3.14Å; Y491-C507 HydrophobicContact CD1-CB 3.91Å; Y491-C507 HydrophobicContact CE1-CB 3.86Å; Y491-C507 VanDerWaalsContact CE1-SG 3.57Å; Y491-K518 HydrophobicContact CE1-CG 4.39Å; Y491-L537 HydrophobicContact CD1-CD2 4.36Å; Y491-L537 HydrophobicContact CD2-CD2 3.31Å; Y491-L537 HydrophobicContact CE2-CD2 3.84Å; Y491-L537 HydrophobicContact CG-CD2 3.61Å; Y491-Y560 HydrophobicContact CD1-CE1 4.33Å; Y491-Y560 AromaticContact CE1-CE1 3.94Å; Y491-Y560 HydrophobicContact CE1-CE1 3.94Å
492	I	98.4	Very high	96.5	Very high	7 Å²	7	32.1 Å²	32.1	4%	0.036	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	127.9	178.3	-56.2	-61.2	0	0	0	108.7	H435 V446 H481 A482 M490 L505 M506 W515	H435-I492 HydrophobicContact CB-CD1 4.07Å; H435-I492 WeakPolarHBondContact CD2-CD1 3.34Å; V446-I492 HydrophobicContact CB-CD1 4.37Å; V446-I492 HydrophobicContact CG1-CD1 4.26Å; V446-I492 HydrophobicContact CG1-CG1 4.21Å; V446-I492 HydrophobicContact CG2-CD1 4.25Å; H481-I492 HydrophobicContact CB-CG2 4Å; H481-I492 WeakPolarHBondContact CD2-CG2 3.22Å; A482-I492 CarbonylContact O-C 3.5Å; A482-I492 WeakPolarHBondContact O-CA 3.34Å; M490-I492 HydrophobicContact CG-CD1 4.05Å; M490-I492 HydrophobicContact CG-CG1 4.49Å; M490-I492 HydrophobicContact SD-CD1 4.14Å; I492-L505 CarbonylContact O-C 3.59Å; I492-L505 WeakPolarHBondContact O-CA 3.41Å; I492-M506 PolarHBondContact N-O 3.23Å; I492-M506 PolarHBondContact O-N 3.18Å; I492-W515 HydrophobicContact CB-CZ3 4.27Å; I492-W515 HydrophobicContact CG1-CH2 3.66Å; I492-W515 HydrophobicContact CG1-CZ3 3.73Å
493	S	97.9	Very high	96.5	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	140.7	-176.6	61.3	0	0	0	0	112.3	A482 E504 H528 M530	A482-S493 PolarHBondContact N-O 2.85Å; A482-S493 PolarHBondContact O-N 2.76Å; A482-S493 PolarHBondContact O-OG 2.82Å; S493-E504 WeakPolarHBondContact CA-O 3.37Å; S493-H528 PolarHBondContact O-CE1 3.23Å; S493-H528 PolarHBondContact O-NE2 2.9Å; S493-H528 VanDerWaalsContact O-NE2 3.16Å; S493-H528 PolarHBondContact OG-NE2 2.81Å; S493-M530 PolarHBondContact OG-SD 2.93Å
494	G	97.2	Very high	96.5	Very high	5 Å²	5	38.3 Å²	38.3	5%	0.052	22%	0.217	C	C	.	.			trans	56.6	-137	168.9	0	0	0	0	0	114.4	H481 Q502 E504	H481-G494 WeakPolarHBondContact CB-O 3.44Å; G494-Q502 WeakPolarHBondContact CA-O 3.25Å; G494-E504 PolarHBondContact N-O 3.38Å
495	G	96.8	Very high	96.4	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	21%	0.211	C	C	.	.			trans	91.9	-161.9	-174	0	0	0	0	0	112.5	Q502 R525	G495-Q502 PolarHBondContact O-N 3.09Å; G495-R525 PolarHBondContact N-O 2.91Å
496	I	95.8	Very high	96.4	Very high	8 Å²	8	37.2 Å²	37.2	4%	0.041	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	133.2	-174.8	-55.6	162.6	0	0	0	108.9	H478 Y479 T500 F501	H478-I496 WeakPolarHBondContact CA-O 3.36Å; Y479-I496 HydrophobicContact CD1-CB 4.22Å; Y479-I496 WeakPolarHBondContact CD1-O 3.29Å; Y479-I496 HydrophobicContact CE1-CB 3.73Å; Y479-I496 HydrophobicContact CE1-CG2 3.64Å; Y479-I496 HydrophobicContact CE2-CB 4.12Å; Y479-I496 HydrophobicContact CE2-CD1 3.73Å; Y479-I496 HydrophobicContact CE2-CG1 4.49Å; Y479-I496 HydrophobicContact CE2-CG2 4.5Å; Y479-I496 PolarHBondContact N-O 2.91Å; Y479-I496 PolarHBondContact O-N 2.98Å; Y479-I496 WeakPolarHBondContact OH-CG2 3.43Å; I496-T500 WeakPolarHBondContact CA-O 3.46Å; I496-F501 HydrophobicContact CD1-CD1 4.37Å; I496-F501 HydrophobicContact CD1-CE1 3.85Å; I496-F501 HydrophobicContact CD1-CZ 4.31Å; I496-F501 HydrophobicContact CG1-CD1 3.8Å; I496-F501 HydrophobicContact CG1-CE1 3.8Å
497	T	94.8	Very high	96.4	Very high	10 Å²	10	34.3 Å²	34.3	6%	0.061	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	124.8	174.7	-60.5	0	0	0	0	107.5	E476 P477 H478 D499 T500	E476-T497 HydrophobicContact CB-CG2 4.25Å; P477-T497 WeakPolarHBondContact O-CB 3.46Å; P477-T497 VanDerWaalsContact O-CG2 3.3Å; P477-T497 WeakPolarHBondContact O-CG2 3.42Å; P477-T497 PolarHBondContact O-OG1 3.47Å; H478-T497 PolarHBondContact CE1-OG1 2.82Å; H478-T497 VanDerWaalsContact CE1-OG1 3.23Å; H478-T497 PolarHBondContact ND1-OG1 2.92Å; T497-D499 VanDerWaalsContact C-N 3.28Å; T497-D499 PolarHBondContact O-N 3.01Å; T497-T500 PolarHBondContact N-O 3.14Å; T497-T500 WeakPolarHBondContact O-CB 3.47Å; T497-T500 PolarHBondContact O-N 2.94Å
498	H	91.8	Very high	96.5	Very high	118 Å²	118	31.2 Å²	31.2	55%	0.546	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.2	49.8	178.1	-53.9	-26	0	0	0	112.3	E454 T500	E454-H498 PolarHBondContact OE1-N 2.8Å; E454-H498 IonicContact OE2-CE1 3.68Å; E454-H498 IonicContact OE2-CG 3.42Å; E454-H498 PolarHBondContact OE2-N 2.78Å; E454-H498 VanDerWaalsContact OE2-N 3.11Å; E454-H498 IonicContact OE2-ND1 3.68Å; E454-H498 PolarHBondContact OE2-ND1 3.35Å; H498-T500 PolarHBondContact O-N 3.36Å; H498-T500 PolarHBondContact O-OG1 2.84Å
499	D	87.4	Confident	96.5	Very high	121 Å²	121	31.9 Å²	31.9	65%	0.647	16%	0.162	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.2	14.1	-177.3	-61.3	-47.8	0	0	0	115.5	T497	T497-D499 VanDerWaalsContact C-N 3.28Å; T497-D499 PolarHBondContact O-N 3.01Å
500	T	93.4	Very high	96.5	Very high	82 Å²	82	31.9 Å²	31.9	50%	0.503	16%	0.163	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	130.5	179.2	-55.4	0	0	0	0	111.4	I496 T497 H498 Q502	I496-T500 WeakPolarHBondContact CA-O 3.46Å; T497-T500 PolarHBondContact N-O 3.14Å; T497-T500 WeakPolarHBondContact O-CB 3.47Å; T497-T500 PolarHBondContact O-N 2.94Å; H498-T500 PolarHBondContact O-N 3.36Å; H498-T500 PolarHBondContact O-OG1 2.84Å; T500-Q502 PolarHBondContact O-NE2 3.06Å
501	F	95.7	Very high	96.4	Very high	17 Å²	17	37.8 Å²	37.8	8%	0.075	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	135.7	175.2	-71.2	-81.9	0	0	0	111.9	I496 V524 N543 H544 F545 Y551	I496-F501 HydrophobicContact CD1-CD1 4.37Å; I496-F501 HydrophobicContact CD1-CE1 3.85Å; I496-F501 HydrophobicContact CD1-CZ 4.31Å; I496-F501 HydrophobicContact CG1-CD1 3.8Å; I496-F501 HydrophobicContact CG1-CE1 3.8Å; F501-V524 HydrophobicContact CB-CB 3.91Å; F501-V524 HydrophobicContact CB-CG2 4.05Å; F501-N543 WeakPolarHBondContact CD1-O 3.4Å; F501-N543 WeakPolarHBondContact CE1-O 3.32Å; F501-N543 WeakPolarHBondContact CE1-OD1 3.21Å; F501-H544 HydrophobicContact CD2-CB 4.26Å; F501-H544 HydrophobicContact CE2-CB 4.49Å; F501-H544 HydrophobicContact CG-CB 4.26Å; F501-F545 AromaticContact CD2-CD2 3.7Å; F501-F545 HydrophobicContact CD2-CD2 3.7Å; F501-F545 AromaticContact CD2-CE2 3.89Å; F501-F545 HydrophobicContact CD2-CE2 3.89Å; F501-F545 HydrophobicContact CD2-CG 4.23Å; F501-F545 HydrophobicContact CE2-CD1 4.05Å; F501-F545 AromaticContact CE2-CD2 3.56Å; F501-F545 HydrophobicContact CE2-CD2 3.56Å; F501-F545 HydrophobicContact CE2-CE1 4.06Å; F501-F545 AromaticContact CE2-CE2 3.57Å; F501-F545 HydrophobicContact CE2-CE2 3.57Å; F501-F545 AromaticContact CE2-CG 3.8Å; F501-F545 HydrophobicContact CE2-CG 3.8Å; F501-F545 AromaticContact CE2-CZ 3.82Å; F501-F545 HydrophobicContact CE2-CZ 3.82Å; F501-Y551 HydrophobicContact CE2-CE1 4.27Å; F501-Y551 HydrophobicContact CZ-CD1 4.08Å; F501-Y551 AromaticContact CZ-CE1 3.8Å; F501-Y551 HydrophobicContact CZ-CE1 3.8Å
502	Q	96.7	Very high	96.4	Very high	38 Å²	38	40.8 Å²	40.8	18%	0.178	21%	0.214	C	C	.	.			trans	-106.8	158.1	-175.3	-59.1	-53.5	-47.8	0	0	110.6	G494 G495 T500 E504 V524 R525	G494-Q502 WeakPolarHBondContact CA-O 3.25Å; G495-Q502 PolarHBondContact O-N 3.09Å; T500-Q502 PolarHBondContact O-NE2 3.06Å; Q502-E504 WeakPolarHBondContact CA-OE2 3.41Å; Q502-E504 VanDerWaalsContact CB-OE2 3.25Å; Q502-E504 WeakPolarHBondContact CB-OE2 3.29Å; Q502-E504 PolarHBondContact OE1-OE2 3.26Å; Q502-E504 VanDerWaalsContact OE1-OE2 3.14Å; Q502-V524 WeakPolarHBondContact O-CA 3.45Å; Q502-R525 PolarHBondContact O-N 2.75Å; Q502-R525 VanDerWaalsContact O-N 3.15Å
503	K	96.8	Very high	96.4	Very high	85 Å²	85	43.9 Å²	43.9	37%	0.37	23%	0.231	S	C	.	.			trans	-126.6	-2.1	174.4	61.2	175.7	-176	175.9	0	113.6	P520 M521 V524	K503-P520 HydrophobicContact CD-CB 4.34Å; K503-P520 HydrophobicContact CG-CB 4.1Å; K503-P520 CarbonylContact O-C 3.58Å; K503-P520 WeakPolarHBondContact O-CA 3.49Å; K503-P520 WeakPolarHBondContact O-CB 3.44Å; K503-M521 HydrophobicContact CB-CB 4.29Å; K503-M521 HydrophobicContact CB-CE 4.47Å; K503-M521 PolarHBondContact O-N 3.05Å; K503-V524 HydrophobicContact CB-CG1 3.86Å; K503-V524 HydrophobicContact CD-CG1 4.28Å; K503-V524 HydrophobicContact CG-CG1 4.13Å
504	E	97.4	Very high	96.4	Very high	58 Å²	58	50.3 Å²	50.3	27%	0.271	26%	0.259	S	S	.	.			trans	-63.1	146.9	-174.9	-70.3	66.2	-152.3	0	0	110.5	S493 G494 Q502	S493-E504 WeakPolarHBondContact CA-O 3.37Å; G494-E504 PolarHBondContact N-O 3.38Å; Q502-E504 WeakPolarHBondContact CA-OE2 3.41Å; Q502-E504 VanDerWaalsContact CB-OE2 3.25Å; Q502-E504 WeakPolarHBondContact CB-OE2 3.29Å; Q502-E504 PolarHBondContact OE1-OE2 3.26Å; Q502-E504 VanDerWaalsContact OE1-OE2 3.14Å
505	L	98.1	Very high	96.4	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	118.6	170.2	-179.3	66.9	0	0	0	108	Y491 I492 K518 A519 M530 Y560 W567	Y491-L505 HydrophobicContact CD1-CD1 4.35Å; Y491-L505 HydrophobicContact CD1-CD2 4.3Å; Y491-L505 HydrophobicContact CD1-CG 4.39Å; I492-L505 CarbonylContact O-C 3.59Å; I492-L505 WeakPolarHBondContact O-CA 3.41Å; L505-K518 HydrophobicContact CB-CB 4.1Å; L505-K518 HydrophobicContact CD2-CB 3.67Å; L505-K518 HydrophobicContact CD2-CG 4.38Å; L505-K518 HydrophobicContact CG-CB 3.87Å; L505-K518 PolarHBondContact O-N 3.03Å; L505-A519 WeakPolarHBondContact CB-O 3.41Å; L505-M530 HydrophobicContact CD1-CE 4.18Å; L505-Y560 HydrophobicContact CD2-CD1 3.73Å; L505-Y560 HydrophobicContact CD2-CD2 3.74Å; L505-Y560 HydrophobicContact CD2-CE1 3.66Å; L505-Y560 HydrophobicContact CD2-CE2 3.65Å; L505-Y560 HydrophobicContact CD2-CG 3.78Å; L505-W567 HydrophobicContact CB-CZ2 4.39Å; L505-W567 HydrophobicContact CD1-CZ2 4.16Å; L505-W567 HydrophobicContact CD2-CZ2 3.82Å; L505-W567 HydrophobicContact CG-CZ2 4.35Å
506	M	98.1	Very high	96.5	Very high	34 Å²	34	55.1 Å²	55.1	17%	0.167	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	136.3	178.4	-61.1	-58.9	-64.7	0	0	109.6	Y491 I492 W515 Q517	Y491-M506 CarbonylContact C-O 3.57Å; Y491-M506 WeakPolarHBondContact CA-O 3.14Å; I492-M506 PolarHBondContact N-O 3.23Å; I492-M506 PolarHBondContact O-N 3.18Å; M506-W515 HydrophobicContact CB-CE3 3.7Å; M506-W515 HydrophobicContact CB-CZ3 3.86Å; M506-W515 HydrophobicContact CE-CB 4.16Å; M506-Q517 HydrophobicContact CE-CB 4.39Å; M506-Q517 HydrophobicContact SD-CB 3.93Å; M506-Q517 HydrophobicContact SD-CG 4.03Å
507	C	98.3	Very high	96.6	Very high	6 Å²	6	61 Å²	61	4%	0.041	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	118.8	-178.7	-178.4	0	0	0	0	110	M490 Y491 W515 T516 K518	M490-C507 CarbonylContact O-C 3.57Å; M490-C507 VanDerWaalsContact O-CA 3.3Å; M490-C507 WeakPolarHBondContact O-CA 3.19Å; Y491-C507 HydrophobicContact CD1-CB 3.91Å; Y491-C507 HydrophobicContact CE1-CB 3.86Å; Y491-C507 VanDerWaalsContact CE1-SG 3.57Å; C507-W515 CarbonylContact O-C 3.57Å; C507-W515 WeakPolarHBondContact O-CA 3.36Å; C507-T516 PolarHBondContact N-O 3.09Å; C507-T516 PolarHBondContact O-N 2.75Å; C507-T516 PolarHBondContact O-OG1 3.46Å; C507-K518 HydrophobicContact CB-CG 3.84Å
508	F	98.6	Very high	96.8	Very high	1 Å²	1	63.6 Å²	63.6	0%	0.004	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	123.2	177.6	177.9	-109.1	0	0	0	111.2	Y444 V471 A472 V489 M490 P510 D513 K514 W515	Y444-F508 AromaticContact CD1-CE1 3.93Å; Y444-F508 HydrophobicContact CD1-CE1 3.93Å; Y444-F508 AromaticContact CE1-CE1 3.65Å; Y444-F508 HydrophobicContact CE1-CE1 3.65Å; Y444-F508 HydrophobicContact CE1-CZ 4.34Å; V471-F508 HydrophobicContact CB-CZ 4.34Å; V471-F508 HydrophobicContact CG2-CZ 4.02Å; A472-F508 HydrophobicContact CB-CE2 4.18Å; V489-F508 WeakPolarHBondContact CA-O 3.45Å; V489-F508 WeakPolarHBondContact CB-O 3.49Å; M490-F508 HydrophobicContact CB-CB 4.41Å; M490-F508 HydrophobicContact CE-CB 4.13Å; M490-F508 HydrophobicContact CE-CD1 3.82Å; M490-F508 HydrophobicContact CE-CG 4.26Å; M490-F508 PolarHBondContact N-O 2.86Å; M490-F508 PolarHBondContact O-N 3.06Å; F508-P510 HydrophobicContact CE1-CB 3.9Å; F508-D513 WeakPolarHBondContact CE2-OD1 3.42Å; F508-D513 WeakPolarHBondContact CZ-OD1 3.37Å; F508-K514 WeakPolarHBondContact CA-O 3.47Å; F508-W515 HydrophobicContact CB-CD2 3.83Å; F508-W515 HydrophobicContact CB-CE3 3.68Å; F508-W515 HydrophobicContact CB-CH2 3.64Å; F508-W515 HydrophobicContact CB-CZ2 3.74Å; F508-W515 HydrophobicContact CB-CZ3 3.61Å; F508-W515 AromaticContact CD2-CD1 3.91Å; F508-W515 AromaticContact CD2-CD2 3.97Å; F508-W515 HydrophobicContact CD2-CD2 3.97Å; F508-W515 AromaticContact CD2-CE2 3.58Å; F508-W515 HydrophobicContact CD2-CG 4.18Å; F508-W515 AromaticContact CD2-CZ2 4Å; F508-W515 HydrophobicContact CD2-CZ2 4Å; F508-W515 AromaticContact CD2-NE1 3.51Å; F508-W515 HydrophobicContact CG-CD2 4.33Å; F508-W515 AromaticContact CG-CE2 3.97Å; F508-W515 HydrophobicContact CG-CH2 4.34Å; F508-W515 AromaticContact CG-CZ2 3.96Å; F508-W515 HydrophobicContact CG-CZ2 3.96Å
509	D	98.3	Very high	97.1	Very high	40 Å²	40	59.2 Å²	59.2	21%	0.214	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	113.2	171.1	175.5	10.3	0	0	0	110.2	V489 D511 T512 D513 K514	V489-D509 HydrophobicContact CG1-CB 3.99Å; D509-D511 VanDerWaalsContact C-N 3.28Å; D509-D511 PolarHBondContact O-N 3.2Å; D509-D511 PolarHBondContact OD1-N 3.17Å; D509-T512 WeakPolarHBondContact CB-OG1 3.14Å; D509-T512 VanDerWaalsContact CG-OG1 3.26Å; D509-T512 VanDerWaalsContact OD2-CG2 3.32Å; D509-T512 WeakPolarHBondContact OD2-CG2 3.39Å; D509-T512 PolarHBondContact OD2-OG1 2.83Å; D509-D513 WeakPolarHBondContact O-CA 3.3Å; D509-D513 PolarHBondContact O-N 2.97Å; D509-K514 PolarHBondContact N-O 2.87Å; D509-K514 PolarHBondContact O-N 2.94Å
510	P	97.7	Very high	97.6	Very high	25 Å²	25	56.2 Å²	56.2	16%	0.162	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-18.8	-179.4	32.6	-39.3	0	0	0	113.6	L439 K440 Y444 F508	L439-P510 HydrophobicContact CD2-CB 4.21Å; L439-P510 HydrophobicContact CD2-CG 3.62Å; L439-P510 HydrophobicContact CG-CG 4.16Å; K440-P510 HydrophobicContact CD-CG 4.04Å; Y444-P510 HydrophobicContact CE1-CB 4.48Å; Y444-P510 WeakPolarHBondContact OH-CB 3.36Å; F508-P510 HydrophobicContact CE1-CB 3.9Å
511	D	97.6	Very high	97.8	Very high	123 Å²	123	52.4 Å²	52.4	66%	0.658	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-33	180	-64.3	-21.6	0	0	0	111.3	K440 D509	K440-D511 IonicContact NZ-OD1 2.85Å; K440-D511 PolarHBondContact NZ-OD1 2.82Å; K440-D511 IonicContact NZ-OD2 2.76Å; K440-D511 PolarHBondContact NZ-OD2 2.86Å; D509-D511 VanDerWaalsContact C-N 3.28Å; D509-D511 PolarHBondContact O-N 3.2Å; D509-D511 PolarHBondContact OD1-N 3.17Å
512	T	97.8	Very high	97.8	Very high	78 Å²	78	56.6 Å²	56.6	48%	0.479	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.6	-7.2	178.2	59.5	0	0	0	0	113.6	D509 K514	D509-T512 WeakPolarHBondContact CB-OG1 3.14Å; D509-T512 VanDerWaalsContact CG-OG1 3.26Å; D509-T512 VanDerWaalsContact OD2-CG2 3.32Å; D509-T512 WeakPolarHBondContact OD2-CG2 3.39Å; D509-T512 PolarHBondContact OD2-OG1 2.83Å; T512-K514 VanDerWaalsContact C-N 3.34Å; T512-K514 WeakPolarHBondContact O-CG 3.42Å; T512-K514 PolarHBondContact O-N 2.86Å
513	D	98	Very high	97.7	Very high	72 Å²	72	56.6 Å²	56.6	39%	0.385	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.7	49.9	-174.4	-165.9	32.1	0	0	0	112.3	V471 A472 F508 D509	V471-D513 WeakPolarHBondContact CB-OD1 3.49Å; A472-D513 WeakPolarHBondContact CB-O 3.45Å; A472-D513 VanDerWaalsContact CB-OD1 3.26Å; A472-D513 WeakPolarHBondContact CB-OD1 3.47Å; A472-D513 PolarHBondContact N-OD1 3.45Å; A472-D513 PolarHBondContact N-OD2 3.23Å; F508-D513 WeakPolarHBondContact CE2-OD1 3.42Å; F508-D513 WeakPolarHBondContact CZ-OD1 3.37Å; D509-D513 WeakPolarHBondContact O-CA 3.3Å; D509-D513 PolarHBondContact O-N 2.97Å
514	K	97.9	Very high	97.7	Very high	135 Å²	135	55.1 Å²	55.1	59%	0.587	30%	0.297	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137	145.9	-173.7	-77	175.8	-173.8	-179.7	0	113.1	F508 D509 T512	F508-K514 WeakPolarHBondContact CA-O 3.47Å; D509-K514 PolarHBondContact N-O 2.87Å; D509-K514 PolarHBondContact O-N 2.94Å; T512-K514 VanDerWaalsContact C-N 3.34Å; T512-K514 WeakPolarHBondContact O-CG 3.42Å; T512-K514 PolarHBondContact O-N 2.86Å
515	W	98.4	Very high	97.6	Very high	38 Å²	38	52.4 Å²	52.4	14%	0.144	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	137	171	-69.3	92.1	0	0	0	110.8	V446 V458 A472 K473 M474 M490 I492 M506 C507 F508	V446-W515 HydrophobicContact CG1-CH2 4Å; V446-W515 HydrophobicContact CG1-CZ2 4.25Å; V458-W515 HydrophobicContact CG2-CZ2 3.93Å; A472-W515 PolarHBondContact O-NE1 2.68Å; K473-W515 VanDerWaalsContact O-CD1 3.32Å; K473-W515 PolarHBondContact O-NE1 3.15Å; M474-W515 HydrophobicContact CG-CH2 4.33Å; M474-W515 HydrophobicContact CG-CZ2 4Å; M490-W515 HydrophobicContact CE-CH2 4.16Å; I492-W515 HydrophobicContact CB-CZ3 4.27Å; I492-W515 HydrophobicContact CG1-CH2 3.66Å; I492-W515 HydrophobicContact CG1-CZ3 3.73Å; M506-W515 HydrophobicContact CB-CE3 3.7Å; M506-W515 HydrophobicContact CB-CZ3 3.86Å; M506-W515 HydrophobicContact CE-CB 4.16Å; C507-W515 CarbonylContact O-C 3.57Å; C507-W515 WeakPolarHBondContact O-CA 3.36Å; F508-W515 HydrophobicContact CB-CD2 3.83Å; F508-W515 HydrophobicContact CB-CE3 3.68Å; F508-W515 HydrophobicContact CB-CH2 3.64Å; F508-W515 HydrophobicContact CB-CZ2 3.74Å; F508-W515 HydrophobicContact CB-CZ3 3.61Å; F508-W515 AromaticContact CD2-CD1 3.91Å; F508-W515 AromaticContact CD2-CD2 3.97Å; F508-W515 HydrophobicContact CD2-CD2 3.97Å; F508-W515 AromaticContact CD2-CE2 3.58Å; F508-W515 HydrophobicContact CD2-CG 4.18Å; F508-W515 AromaticContact CD2-CZ2 4Å; F508-W515 HydrophobicContact CD2-CZ2 4Å; F508-W515 AromaticContact CD2-NE1 3.51Å; F508-W515 HydrophobicContact CG-CD2 4.33Å; F508-W515 AromaticContact CG-CE2 3.97Å; F508-W515 HydrophobicContact CG-CH2 4.34Å; F508-W515 AromaticContact CG-CZ2 3.96Å; F508-W515 HydrophobicContact CG-CZ2 3.96Å
516	T	97.8	Very high	97.6	Very high	68 Å²	68	52.4 Å²	52.4	42%	0.417	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	136.2	174.1	57.6	0	0	0	0	109.7	C507	C507-T516 PolarHBondContact N-O 3.09Å; C507-T516 PolarHBondContact O-N 2.75Å; C507-T516 PolarHBondContact O-OG1 3.46Å
517	Q	97.9	Very high	97.4	Very high	133 Å²	133	52 Å²	52	62%	0.621	28%	0.283	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.6	140.3	175	-172.6	172.8	-8.4	0	0	110	M506	M506-Q517 HydrophobicContact CE-CB 4.39Å; M506-Q517 HydrophobicContact SD-CB 3.93Å; M506-Q517 HydrophobicContact SD-CG 4.03Å
518	K	98.3	Very high	97.4	Very high	64 Å²	64	52.4 Å²	52.4	28%	0.278	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	176.2	176.9	-63.6	-59.4	-176.5	177	0	110.5	Y491 L505 C507	Y491-K518 HydrophobicContact CE1-CG 4.39Å; L505-K518 HydrophobicContact CB-CB 4.1Å; L505-K518 HydrophobicContact CD2-CB 3.67Å; L505-K518 HydrophobicContact CD2-CG 4.38Å; L505-K518 HydrophobicContact CG-CB 3.87Å; L505-K518 PolarHBondContact O-N 3.03Å; C507-K518 HydrophobicContact CB-CG 3.84Å
519	A	98.4	Very high	97.3	Very high	25 Å²	25	52.7 Å²	52.7	21%	0.207	29%	0.286	C	S	.	.	P	Polyproline II helix	trans	-55.9	129.2	176.6	0	0	0	0	0	110.9	L505 Y560 D565 W567	L505-A519 WeakPolarHBondContact CB-O 3.41Å; A519-Y560 HydrophobicContact CB-CE2 4.35Å; A519-D565 WeakPolarHBondContact CB-O 3.5Å; A519-D565 WeakPolarHBondContact CB-OD1 3.45Å; A519-D565 PolarHBondContact N-OD1 3.01Å; A519-W567 PolarHBondContact O-NE1 3.4Å
520	P	98.3	Very high	97.3	Very high	58 Å²	58	51.2 Å²	51.2	38%	0.377	28%	0.277	S	S	.	.	P	Polyproline II helix	trans	-73.2	155.7	-178.5	31.3	-35.4	0	0	0	111.2	K503 W567	K503-P520 HydrophobicContact CD-CB 4.34Å; K503-P520 HydrophobicContact CG-CB 4.1Å; K503-P520 CarbonylContact O-C 3.58Å; K503-P520 WeakPolarHBondContact O-CA 3.49Å; K503-P520 WeakPolarHBondContact O-CB 3.44Å; P520-W567 PolarHBondContact O-NE1 3.07Å
521	M	98.1	Very high	97.3	Very high	3 Å²	3	50.4 Å²	50.4	2%	0.015	27%	0.273	C	S	.	.	P	Polyproline II helix	trans	-59.5	161.2	171.2	-64.9	-179	-62.4	0	0	111.5	K503 R525 V539 W567	K503-M521 HydrophobicContact CB-CB 4.29Å; K503-M521 HydrophobicContact CB-CE 4.47Å; K503-M521 PolarHBondContact O-N 3.05Å; M521-R525 HydrophobicContact CE-CG 3.68Å; M521-R525 HydrophobicContact SD-CG 4.18Å; M521-V539 HydrophobicContact SD-CB 4.23Å; M521-V539 HydrophobicContact SD-CG1 3.68Å; M521-V539 HydrophobicContact SD-CG2 4Å; M521-W567 HydrophobicContact CG-CD2 4.18Å; M521-W567 HydrophobicContact CG-CE3 4.45Å; M521-W567 HydrophobicContact CG-CH2 3.73Å; M521-W567 HydrophobicContact CG-CZ2 3.37Å; M521-W567 HydrophobicContact CG-CZ3 4.25Å; M521-W567 HydrophobicContact SD-CH2 4.27Å; M521-W567 HydrophobicContact SD-CZ2 4.39Å
522	T	96.4	Very high	97.3	Very high	105 Å²	105	46 Å²	46	64%	0.644	25%	0.25	S	S	*	.	S	Bend	trans	-72.9	-37.1	176.5	-47.1	0	0	0	0	111.6	E558	T522-E558 WeakPolarHBondContact CB-OE2 3.33Å; T522-E558 PolarHBondContact N-OE1 2.88Å; T522-E558 PolarHBondContact N-OE2 2.81Å; T522-E558 PolarHBondContact OG1-OE2 2.85Å
523	T	94.3	Very high	97.4	Very high	37 Å²	37	43 Å²	43	23%	0.227	23%	0.232	C	C	.	.	S	Bend	trans	-118.6	134.3	-175.1	-48.1	0	0	0	0	110.6	V554	T523-V554 HydrophobicContact CG2-CG1 4.14Å
524	V	95.8	Very high	97.3	Very high	55 Å²	55	42.7 Å²	42.7	33%	0.333	25%	0.245	S	C	.	.			trans	-66.3	138.9	170.3	-64	0	0	0	0	109.4	F501 Q502 K503 H544	F501-V524 HydrophobicContact CB-CB 3.91Å; F501-V524 HydrophobicContact CB-CG2 4.05Å; Q502-V524 WeakPolarHBondContact O-CA 3.45Å; K503-V524 HydrophobicContact CB-CG1 3.86Å; K503-V524 HydrophobicContact CD-CG1 4.28Å; K503-V524 HydrophobicContact CG-CG1 4.13Å; V524-H544 HydrophobicContact CG2-CB 4.09Å
525	R	96.6	Very high	97.2	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	23%	0.234	C	C	.	.			trans	-159.4	148.5	-179.2	56.9	179.1	89	-142.1	6.6	112.1	G495 Q502 M521 H528 G541 N543 V554 S556 E558	G495-R525 PolarHBondContact N-O 2.91Å; Q502-R525 PolarHBondContact O-N 2.75Å; Q502-R525 VanDerWaalsContact O-N 3.15Å; M521-R525 HydrophobicContact CE-CG 3.68Å; M521-R525 HydrophobicContact SD-CG 4.18Å; R525-H528 HydrophobicContact CG-CB 4.26Å; R525-G541 PolarHBondContact NH1-O 2.94Å; R525-N543 WeakPolarHBondContact CA-O 3.25Å; R525-V554 HydrophobicContact CB-CG2 4.21Å; R525-V554 VanDerWaalsContact NH1-CG1 3.32Å; R525-S556 PolarHBondContact NH1-O 2.89Å; R525-S556 PolarHBondContact NH2-O 2.77Å; R525-E558 IonicContact CZ-OE1 3.54Å; R525-E558 IonicContact NH2-OE1 2.94Å; R525-E558 PolarHBondContact NH2-OE1 3.11Å
526	G	96.2	Very high	97.2	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	24%	0.243	C	C	.	.	B	Isolated β-bridge	trans	-131.5	165.1	168.9	0	0	0	0	0	110.4	H528 G542 N543	G526-H528 PolarHBondContact O-N 2.88Å; G526-G542 CarbonylContact O-C 3.57Å; G526-G542 WeakPolarHBondContact O-CA 3.49Å; G526-N543 PolarHBondContact N-O 2.87Å; G526-N543 PolarHBondContact O-N 2.94Å; G526-N543 PolarHBondContact O-OD1 2.99Å
527	L	95.7	Very high	97.2	Very high	27 Å²	27	38.5 Å²	38.5	14%	0.141	22%	0.223	C	C	.	.	S	Bend	trans	53.1	23	-176.6	-52.6	176.6	0	0	0	113.5	F433 G480 D579 W597	F433-L527 HydrophobicContact CD1-CD2 3.64Å; F433-L527 HydrophobicContact CE1-CD2 3.93Å; G480-L527 PolarHBondContact O-N 3.1Å; L527-D579 PolarHBondContact O-N 2.84Å; L527-W597 HydrophobicContact CD1-CZ2 4.21Å
528	H	97.3	Very high	97.2	Very high	13 Å²	13	32.3 Å²	32.3	6%	0.06	19%	0.194	C	C	.	.			trans	-80.2	177.6	172.9	62.7	-74.5	0	0	0	110.6	A482 S493 R525 G526 I540 G541	A482-H528 VanDerWaalsContact CB-CD2 3.47Å; A482-H528 WeakPolarHBondContact CB-CD2 3.33Å; A482-H528 WeakPolarHBondContact CB-NE2 3.48Å; A482-H528 WeakPolarHBondContact CB-O 3.44Å; S493-H528 PolarHBondContact O-CE1 3.23Å; S493-H528 PolarHBondContact O-NE2 2.9Å; S493-H528 VanDerWaalsContact O-NE2 3.16Å; S493-H528 PolarHBondContact OG-NE2 2.81Å; R525-H528 HydrophobicContact CG-CB 4.26Å; G526-H528 PolarHBondContact O-N 2.88Å; H528-I540 WeakPolarHBondContact CB-O 3.34Å; H528-G541 VanDerWaalsContact CB-O 3.23Å; H528-G541 WeakPolarHBondContact CB-O 3.36Å
529	C	97	Very high	97.2	Very high	7 Å²	7	29.3 Å²	29.3	5%	0.047	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	158.7	169.9	69.7	0	0	0	0	111.4	I540 V580 V582	C529-I540 PolarHBondContact N-O 2.92Å; C529-I540 PolarHBondContact O-N 3.4Å; C529-V580 HydrophobicContact CB-CG2 3.61Å; C529-V580 VanDerWaalsContact SG-CG2 3.58Å; C529-V582 HydrophobicContact CB-CB 3.88Å; C529-V582 HydrophobicContact CB-CG1 3.77Å; C529-V582 HydrophobicContact CB-CG2 4.48Å
530	M	97.8	Very high	97.2	Very high	9 Å²	9	28.1 Å²	28.1	4%	0.044	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	139.6	177.2	-169.5	177.2	-174.5	0	0	109.1	A482 T484 S493 L505 L537 Y538 V539 W567	A482-M530 HydrophobicContact CB-CB 3.73Å; T484-M530 HydrophobicContact CG2-CE 3.86Å; T484-M530 HydrophobicContact CG2-CG 3.75Å; T484-M530 HydrophobicContact CG2-SD 4.02Å; S493-M530 PolarHBondContact OG-SD 2.93Å; L505-M530 HydrophobicContact CD1-CE 4.18Å; M530-L537 HydrophobicContact CE-CB 3.47Å; M530-L537 VanDerWaalsContact CE-CB 3.47Å; M530-L537 HydrophobicContact CE-CD2 3.92Å; M530-L537 HydrophobicContact CE-CG 4.31Å; M530-Y538 WeakPolarHBondContact CA-O 3.21Å; M530-Y538 WeakPolarHBondContact CG-O 3.36Å; M530-V539 HydrophobicContact CB-CG2 4.25Å; M530-V539 HydrophobicContact CE-CG2 4.33Å; M530-V539 HydrophobicContact CG-CG2 3.83Å; M530-V539 HydrophobicContact SD-CG2 4.07Å; M530-W567 HydrophobicContact CE-CH2 4.36Å
531	C	98.1	Very high	97.1	Very high	9 Å²	9	25.4 Å²	25.4	6%	0.061	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151	162	176.2	65.1	0	0	0	0	111.2	L537 Y538 V582 V584 I589	C531-L537 CarbonylContact O-C 3.58Å; C531-L537 WeakPolarHBondContact O-CA 3.21Å; C531-Y538 PolarHBondContact N-O 3.19Å; C531-Y538 PolarHBondContact O-N 2.67Å; C531-V582 HydrophobicContact CB-CG2 4.05Å; C531-V584 HydrophobicContact CB-CG2 3.97Å; C531-I589 VanDerWaalsContact SG-CG2 3.56Å
532	T	98.2	Very high	97	Very high	30 Å²	30	25.3 Å²	25.3	18%	0.184	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	130.1	-179.6	-59.5	0	0	0	0	109.8	T484 V485 Y486 R536	T484-T532 WeakPolarHBondContact CG2-OG1 3.19Å; T484-T532 PolarHBondContact OG1-N 3.43Å; T484-T532 PolarHBondContact OG1-OG1 3.21Å; V485-T532 PolarHBondContact O-OG1 2.87Å; Y486-T532 HydrophobicContact CD2-CG2 3.87Å; Y486-T532 HydrophobicContact CG-CG2 4.43Å; T532-R536 WeakPolarHBondContact CA-O 3.15Å
533	V	98	Very high	97	Very high	16 Å²	16	20.3 Å²	20.3	10%	0.097	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	121	169.2	-173.2	0	0	0	0	108.1	D535 R536 Y538 V584 N587 I589 P611	V533-D535 PolarHBondContact O-N 2.94Å; V533-R536 PolarHBondContact N-O 2.87Å; V533-R536 PolarHBondContact O-N 2.99Å; V533-Y538 HydrophobicContact CB-CD2 4.29Å; V533-Y538 HydrophobicContact CB-CE2 3.82Å; V533-Y538 HydrophobicContact CG2-CD2 4.27Å; V533-Y538 HydrophobicContact CG2-CE2 4.23Å; V533-V584 HydrophobicContact CG2-CG1 3.85Å; V533-V584 HydrophobicContact CG2-CG2 3.81Å; V533-N587 HydrophobicContact CG1-CB 4.4Å; V533-I589 HydrophobicContact CG2-CD1 3.86Å; V533-I589 HydrophobicContact CG2-CG1 3.59Å; V533-P611 HydrophobicContact CG1-CG 4.27Å
534	G	96.1	Very high	97	Very high	64 Å²	64	20.3 Å²	20.3	66%	0.66	12%	0.12	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.9	-121.8	-172.6	0	0	0	0	0	111.5	Y486	Y486-G534 WeakPolarHBondContact CE2-O 3.44Å
535	D	96	Very high	96.8	Very high	67 Å²	67	20.9 Å²	20.9	36%	0.358	12%	0.118	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.9	10	-179.5	67.4	-28.3	0	0	0	114.2	Y486 V533 P562	Y486-D535 HydrophobicContact CE2-CB 4.26Å; Y486-D535 WeakPolarHBondContact OH-CB 3.49Å; V533-D535 PolarHBondContact O-N 2.94Å; D535-P562 WeakPolarHBondContact O-CD 3.32Å
536	R	98.4	Very high	96.2	Very high	86 Å²	86	29.2 Å²	29.2	33%	0.325	15%	0.149	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	139.8	-173.4	-64.6	172.6	-171	-172.5	3.4	111.4	T532 V533 Y538 Y559	T532-R536 WeakPolarHBondContact CA-O 3.15Å; V533-R536 PolarHBondContact N-O 2.87Å; V533-R536 PolarHBondContact O-N 2.99Å; R536-Y538 HydrophobicContact CB-CD2 4.26Å; R536-Y538 HydrophobicContact CB-CE2 3.49Å; R536-Y538 VanDerWaalsContact CB-CE2 3.49Å; R536-Y538 VanDerWaalsContact CD-OH 3.3Å; R536-Y538 WeakPolarHBondContact CD-OH 3.27Å; R536-Y559 HydrophobicContact CB-CD2 3.89Å; R536-Y559 HydrophobicContact CB-CG 4.23Å; R536-Y559 HydrophobicContact CG-CD2 3.64Å; R536-Y559 HydrophobicContact CG-CE2 3.88Å; R536-Y559 HydrophobicContact CG-CG 4.31Å
537	L	98.6	Very high	95.3	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	110.7	176.9	-45.8	83.4	0	0	0	109.1	T484 Y491 M530 C531 Y559 Y560 P562	T484-L537 HydrophobicContact CG2-CB 3.98Å; T484-L537 HydrophobicContact CG2-CD2 3.59Å; T484-L537 HydrophobicContact CG2-CG 4.06Å; Y491-L537 HydrophobicContact CD1-CD2 4.36Å; Y491-L537 HydrophobicContact CD2-CD2 3.31Å; Y491-L537 HydrophobicContact CE2-CD2 3.84Å; Y491-L537 HydrophobicContact CG-CD2 3.61Å; M530-L537 HydrophobicContact CE-CB 3.47Å; M530-L537 VanDerWaalsContact CE-CB 3.47Å; M530-L537 HydrophobicContact CE-CD2 3.92Å; M530-L537 HydrophobicContact CE-CG 4.31Å; C531-L537 CarbonylContact O-C 3.58Å; C531-L537 WeakPolarHBondContact O-CA 3.21Å; L537-Y559 CarbonylContact O-C 3.57Å; L537-Y559 VanDerWaalsContact O-CA 3.25Å; L537-Y559 WeakPolarHBondContact O-CA 3.42Å; L537-Y560 HydrophobicContact CD1-CD1 3.72Å; L537-Y560 WeakPolarHBondContact CD1-O 3.47Å; L537-Y560 PolarHBondContact N-O 2.93Å; L537-Y560 VanDerWaalsContact N-O 3.1Å; L537-Y560 PolarHBondContact O-N 3.07Å; L537-P562 HydrophobicContact CD1-CG 3.17Å
538	Y	98.6	Very high	94.2	Very high	4 Å²	4	37.9 Å²	37.9	2%	0.016	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	135.8	-173.9	-66.6	-96.9	0	0	0	110.4	M530 C531 V533 R536 Y559 I570 I589 Y609	M530-Y538 WeakPolarHBondContact CA-O 3.21Å; M530-Y538 WeakPolarHBondContact CG-O 3.36Å; C531-Y538 PolarHBondContact N-O 3.19Å; C531-Y538 PolarHBondContact O-N 2.67Å; V533-Y538 HydrophobicContact CB-CD2 4.29Å; V533-Y538 HydrophobicContact CB-CE2 3.82Å; V533-Y538 HydrophobicContact CG2-CD2 4.27Å; V533-Y538 HydrophobicContact CG2-CE2 4.23Å; R536-Y538 HydrophobicContact CB-CD2 4.26Å; R536-Y538 HydrophobicContact CB-CE2 3.49Å; R536-Y538 VanDerWaalsContact CB-CE2 3.49Å; R536-Y538 VanDerWaalsContact CD-OH 3.3Å; R536-Y538 WeakPolarHBondContact CD-OH 3.27Å; Y538-Y559 HydrophobicContact CE1-CD1 4.15Å; Y538-Y559 HydrophobicContact CE1-CG 4.24Å; Y538-I570 HydrophobicContact CD1-CD1 3.81Å; Y538-I570 HydrophobicContact CE1-CD1 4.12Å; Y538-I589 HydrophobicContact CD1-CD1 3.9Å; Y538-I589 HydrophobicContact CD2-CD1 3.75Å; Y538-I589 HydrophobicContact CE1-CD1 4.47Å; Y538-I589 HydrophobicContact CE2-CD1 4.35Å; Y538-I589 HydrophobicContact CG-CD1 3.51Å; Y538-Y609 HydrophobicContact CD1-CE1 4.12Å; Y538-Y609 AromaticContact CE1-CE1 3.7Å; Y538-Y609 HydrophobicContact CE1-CE1 3.7Å
539	V	98.3	Very high	93.2	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	127.6	171.1	164.3	0	0	0	0	109.5	M521 M530 C557 E558 W567	M521-V539 HydrophobicContact SD-CB 4.23Å; M521-V539 HydrophobicContact SD-CG1 3.68Å; M521-V539 HydrophobicContact SD-CG2 4Å; M530-V539 HydrophobicContact CB-CG2 4.25Å; M530-V539 HydrophobicContact CE-CG2 4.33Å; M530-V539 HydrophobicContact CG-CG2 3.83Å; M530-V539 HydrophobicContact SD-CG2 4.07Å; V539-C557 WeakPolarHBondContact O-CA 3.46Å; V539-E558 HydrophobicContact CB-CG 4.5Å; V539-E558 PolarHBondContact N-O 3.13Å; V539-E558 PolarHBondContact O-N 2.94Å; V539-W567 HydrophobicContact CB-CH2 4.16Å; V539-W567 HydrophobicContact CB-CZ3 3.89Å; V539-W567 HydrophobicContact CG2-CH2 3.43Å; V539-W567 VanDerWaalsContact CG2-CH2 3.43Å; V539-W567 HydrophobicContact CG2-CZ3 3.66Å
540	I	97.8	Very high	92.7	Very high	1 Å²	1	45.4 Å²	45.4	1%	0.005	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	133.8	-165.1	-61.3	167.5	0	0	0	109.7	H528 C529 C557 M573 I589 V591 W616	H528-I540 WeakPolarHBondContact CB-O 3.34Å; C529-I540 PolarHBondContact N-O 2.92Å; C529-I540 PolarHBondContact O-N 3.4Å; I540-C557 HydrophobicContact CG1-CB 4.49Å; I540-M573 HydrophobicContact CG2-CE 3.82Å; I540-M573 HydrophobicContact CG2-CG 4.11Å; I540-M573 HydrophobicContact CG2-SD 3.56Å; I540-M573 VanDerWaalsContact CG2-SD 3.56Å; I540-I589 HydrophobicContact CD1-CB 4.45Å; I540-I589 HydrophobicContact CD1-CD1 3.99Å; I540-I589 HydrophobicContact CD1-CG2 3.69Å; I540-V591 HydrophobicContact CG2-CG2 3.87Å; I540-W616 HydrophobicContact CD1-CH2 4.06Å; I540-W616 HydrophobicContact CD1-CZ2 4.36Å; I540-W616 HydrophobicContact CG1-CH2 4.44Å; I540-W616 HydrophobicContact CG1-CZ2 4.42Å; I540-W616 HydrophobicContact CG2-CH2 3.65Å; I540-W616 HydrophobicContact CG2-CZ2 3.99Å
541	G	96.4	Very high	92.3	Very high	1 Å²	1	49.6 Å²	49.6	1%	0.01	28%	0.28	C	S	.	.			trans	68.3	-151.2	171.7	0	0	0	0	0	114.1	R525 H528 V554 M573	R525-G541 PolarHBondContact NH1-O 2.94Å; H528-G541 VanDerWaalsContact CB-O 3.23Å; H528-G541 WeakPolarHBondContact CB-O 3.36Å; G541-V554 WeakPolarHBondContact CA-O 3.02Å; G541-M573 WeakPolarHBondContact CA-SD 3.4Å; G541-M573 PolarHBondContact N-SD 3.46Å
542	G	96.3	Very high	92.1	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	29%	0.285	C	S	.	.			trans	89.8	-166.5	-173.6	0	0	0	0	0	113.2	G526 V554 Q577 S578	G526-G542 CarbonylContact O-C 3.57Å; G526-G542 WeakPolarHBondContact O-CA 3.49Å; G542-V554 PolarHBondContact O-N 3.41Å; G542-Q577 PolarHBondContact N-O 2.78Å; G542-S578 WeakPolarHBondContact CA-OG 3.31Å; G542-S578 PolarHBondContact O-OG 2.88Å
543	N	95.3	Very high	91.9	Very high	1 Å²	1	49.7 Å²	49.7	1%	0.005	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	163.1	-179.8	66.1	-12.5	0	0	0	112.2	F501 R525 G526 Y551 D552 S578 W597	F501-N543 WeakPolarHBondContact CD1-O 3.4Å; F501-N543 WeakPolarHBondContact CE1-O 3.32Å; F501-N543 WeakPolarHBondContact CE1-OD1 3.21Å; R525-N543 WeakPolarHBondContact CA-O 3.25Å; G526-N543 PolarHBondContact N-O 2.87Å; G526-N543 PolarHBondContact O-N 2.94Å; G526-N543 PolarHBondContact O-OD1 2.99Å; N543-Y551 WeakPolarHBondContact ND2-CD1 3.25Å; N543-D552 WeakPolarHBondContact CA-O 3.43Å; N543-D552 WeakPolarHBondContact CB-O 3.47Å; N543-S578 PolarHBondContact N-OG 3.48Å; N543-W597 VanDerWaalsContact CB-CD1 3.5Å; N543-W597 HydrophobicContact CB-CG 4.16Å; N543-W597 WeakPolarHBondContact ND2-CZ2 3.23Å; N543-W597 PolarHBondContact ND2-NE1 2.94Å
544	H	94.3	Very high	91.8	Very high	37 Å²	37	49 Å²	49	17%	0.171	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	-176.8	164.2	60.4	61.8	0	0	0	109.8	F501 V524 Y551 D552 V554	F501-H544 HydrophobicContact CD2-CB 4.26Å; F501-H544 HydrophobicContact CE2-CB 4.49Å; F501-H544 HydrophobicContact CG-CB 4.26Å; V524-H544 HydrophobicContact CG2-CB 4.09Å; H544-Y551 CarbonylContact O-C 3.59Å; H544-Y551 WeakPolarHBondContact O-CA 3.35Å; H544-D552 PolarHBondContact N-O 2.8Å; H544-D552 VanDerWaalsContact N-O 3.11Å; H544-D552 PolarHBondContact O-N 3.49Å; H544-V554 WeakPolarHBondContact CD2-CG2 3.37Å
545	F	91.6	Very high	91.8	Very high	67 Å²	67	49.6 Å²	49.6	29%	0.294	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	137.3	169.4	-64.5	-52.2	0	0	0	111.5	F501 D550 Y551	F501-F545 AromaticContact CD2-CD2 3.7Å; F501-F545 HydrophobicContact CD2-CD2 3.7Å; F501-F545 AromaticContact CD2-CE2 3.89Å; F501-F545 HydrophobicContact CD2-CE2 3.89Å; F501-F545 HydrophobicContact CD2-CG 4.23Å; F501-F545 HydrophobicContact CE2-CD1 4.05Å; F501-F545 AromaticContact CE2-CD2 3.56Å; F501-F545 HydrophobicContact CE2-CD2 3.56Å; F501-F545 HydrophobicContact CE2-CE1 4.06Å; F501-F545 AromaticContact CE2-CE2 3.57Å; F501-F545 HydrophobicContact CE2-CE2 3.57Å; F501-F545 AromaticContact CE2-CG 3.8Å; F501-F545 HydrophobicContact CE2-CG 3.8Å; F501-F545 AromaticContact CE2-CZ 3.82Å; F501-F545 HydrophobicContact CE2-CZ 3.82Å; F545-D550 CarbonylContact C-O 3.59Å; F545-D550 WeakPolarHBondContact CA-O 3.4Å; F545-Y551 HydrophobicContact CD1-CD1 4.23Å; F545-Y551 HydrophobicContact CD1-CE1 4.32Å; F545-Y551 HydrophobicContact CD1-CG 4.47Å; F545-Y551 AromaticContact CE1-CD1 3.98Å; F545-Y551 HydrophobicContact CE1-CD1 3.98Å; F545-Y551 HydrophobicContact CE1-CD2 4.28Å; F545-Y551 AromaticContact CE1-CE1 3.63Å; F545-Y551 HydrophobicContact CE1-CE1 3.63Å; F545-Y551 AromaticContact CE1-CE2 3.92Å; F545-Y551 HydrophobicContact CE1-CE2 3.92Å; F545-Y551 HydrophobicContact CE1-CG 4.31Å; F545-Y551 AromaticContact CE1-CZ 3.59Å; F545-Y551 HydrophobicContact CZ-CE1 4.2Å
546	R	83.4	Confident	91.8	Very high	174 Å²	174	48.9 Å²	48.9	66%	0.657	26%	0.262	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.8	112.3	160.1	179.2	175.4	-179.5	-179.2	1	107.6	D550 D552	R546-D550 PolarHBondContact N-O 2.8Å; R546-D552 HydrophobicContact CB-CB 3.78Å
547	G	78.9	Confident	91.8	Very high	72 Å²	72	44.9 Å²	44.9	74%	0.742	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	72.8	-133.5	-172.7	0	0	0	0	0	111.9
548	T	72.4	Confident	91.8	Very high	138 Å²	138	45.1 Å²	45.1	85%	0.847	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.2	-22.8	-170.3	49.8	0	0	0	0	115.3
549	S	76.1	Confident	91.8	Very high	74 Å²	74	46.6 Å²	46.6	52%	0.517	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-161.9	-6.4	-173.7	56	0	0	0	0	116.7
550	D	85.7	Confident	91.8	Very high	103 Å²	103	46.6 Å²	46.6	55%	0.551	26%	0.255	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.1	122.7	-178.2	-73.2	-30.1	0	0	0	109.8	F545 R546	F545-D550 CarbonylContact C-O 3.59Å; F545-D550 WeakPolarHBondContact CA-O 3.4Å; R546-D550 PolarHBondContact N-O 2.8Å
551	Y	89.6	Confident	91.8	Very high	98 Å²	98	47.1 Å²	47.1	38%	0.384	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	137.6	176.1	-70	-85.2	0	0	0	111.1	F501 N543 H544 F545 W597	F501-Y551 HydrophobicContact CE2-CE1 4.27Å; F501-Y551 HydrophobicContact CZ-CD1 4.08Å; F501-Y551 AromaticContact CZ-CE1 3.8Å; F501-Y551 HydrophobicContact CZ-CE1 3.8Å; N543-Y551 WeakPolarHBondContact ND2-CD1 3.25Å; H544-Y551 CarbonylContact O-C 3.59Å; H544-Y551 WeakPolarHBondContact O-CA 3.35Å; F545-Y551 HydrophobicContact CD1-CD1 4.23Å; F545-Y551 HydrophobicContact CD1-CE1 4.32Å; F545-Y551 HydrophobicContact CD1-CG 4.47Å; F545-Y551 AromaticContact CE1-CD1 3.98Å; F545-Y551 HydrophobicContact CE1-CD1 3.98Å; F545-Y551 HydrophobicContact CE1-CD2 4.28Å; F545-Y551 AromaticContact CE1-CE1 3.63Å; F545-Y551 HydrophobicContact CE1-CE1 3.63Å; F545-Y551 AromaticContact CE1-CE2 3.92Å; F545-Y551 HydrophobicContact CE1-CE2 3.92Å; F545-Y551 HydrophobicContact CE1-CG 4.31Å; F545-Y551 AromaticContact CE1-CZ 3.59Å; F545-Y551 HydrophobicContact CZ-CE1 4.2Å; Y551-W597 HydrophobicContact CD1-CD2 4.41Å; Y551-W597 HydrophobicContact CD1-CE3 4.24Å; Y551-W597 HydrophobicContact CD1-CH2 4.18Å; Y551-W597 HydrophobicContact CD1-CZ2 4.4Å; Y551-W597 HydrophobicContact CD1-CZ3 4.1Å; Y551-W597 AromaticContact CD2-CE3 3.83Å; Y551-W597 HydrophobicContact CD2-CE3 3.83Å; Y551-W597 HydrophobicContact CD2-CH2 4.11Å; Y551-W597 AromaticContact CD2-CZ3 3.44Å; Y551-W597 HydrophobicContact CD2-CZ3 3.44Å; Y551-W597 VanDerWaalsContact CD2-CZ3 3.44Å; Y551-W597 HydrophobicContact CE1-CH2 4.29Å; Y551-W597 HydrophobicContact CE2-CH2 4.27Å; Y551-W597 AromaticContact CE2-CZ3 3.96Å; Y551-W597 HydrophobicContact CE2-CZ3 3.96Å; Y551-W597 HydrophobicContact CG-CD2 4.05Å; Y551-W597 AromaticContact CG-CE3 3.52Å; Y551-W597 HydrophobicContact CG-CE3 3.52Å; Y551-W597 HydrophobicContact CG-CH2 4.06Å; Y551-W597 AromaticContact CG-CZ3 3.52Å; Y551-W597 HydrophobicContact CG-CZ3 3.52Å
552	D	93.4	Very high	91.9	Very high	32 Å²	32	48.3 Å²	48.3	17%	0.171	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	145.5	177.3	-169.1	16.9	0	0	0	110.2	N543 H544 R546 N598	N543-D552 WeakPolarHBondContact CA-O 3.43Å; N543-D552 WeakPolarHBondContact CB-O 3.47Å; H544-D552 PolarHBondContact N-O 2.8Å; H544-D552 VanDerWaalsContact N-O 3.11Å; H544-D552 PolarHBondContact O-N 3.49Å; R546-D552 HydrophobicContact CB-CB 3.78Å; D552-N598 PolarHBondContact OD1-ND2 3.14Å; D552-N598 PolarHBondContact OD1-OD1 2.83Å
553	D	94.8	Very high	91.9	Very high	9 Å²	9	54 Å²	54	5%	0.048	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	134.1	-179.8	-72.5	-46.7	0	0	0	110.7	L555 S596 W597 N598	D553-L555 PolarHBondContact O-N 3.29Å; D553-S596 PolarHBondContact OD2-OG 3.01Å; D553-W597 VanDerWaalsContact CG-N 3.34Å; D553-W597 WeakPolarHBondContact OD1-CB 3.19Å; D553-W597 VanDerWaalsContact OD1-CD1 3.32Å; D553-W597 PolarHBondContact OD1-N 2.86Å; D553-W597 PolarHBondContact OD2-N 3.25Å; D553-W597 VanDerWaalsContact OD2-N 3.11Å; D553-N598 WeakPolarHBondContact OD2-CB 3.48Å; D553-N598 PolarHBondContact OD2-N 2.91Å
554	V	96.1	Very high	92	Very high	2 Å²	2	60.2 Å²	60.2	1%	0.012	32%	0.324	C	S	.	.			trans	-89.5	103.9	174.6	-169.4	0	0	0	0	110.1	T523 R525 G541 G542 H544 S556	T523-V554 HydrophobicContact CG2-CG1 4.14Å; R525-V554 HydrophobicContact CB-CG2 4.21Å; R525-V554 VanDerWaalsContact NH1-CG1 3.32Å; G541-V554 WeakPolarHBondContact CA-O 3.02Å; G542-V554 PolarHBondContact O-N 3.41Å; H544-V554 WeakPolarHBondContact CD2-CG2 3.37Å; V554-S556 WeakPolarHBondContact CG1-OG 3.27Å
555	L	95.8	Very high	92.2	Very high	75 Å²	75	61.7 Å²	61.7	39%	0.393	33%	0.333	S	S	.	.			trans	-83	-28.2	176.6	-59.7	178.6	0	0	0	112.9	D553 C557 A572 M573 G576	D553-L555 PolarHBondContact O-N 3.29Å; L555-C557 PolarHBondContact O-N 2.95Å; L555-A572 HydrophobicContact CB-CB 4.31Å; L555-A572 VanDerWaalsContact O-CA 3.29Å; L555-A572 WeakPolarHBondContact O-CA 3.36Å; L555-A572 WeakPolarHBondContact O-CB 3.3Å; L555-M573 HydrophobicContact CD2-CB 4.39Å; L555-M573 PolarHBondContact O-N 2.83Å; L555-G576 VanDerWaalsContact CD2-CA 3.45Å
556	S	96.7	Very high	92.5	Very high	52 Å²	52	64.1 Å²	64.1	36%	0.364	35%	0.345	S	S	.	.			trans	-65.5	128	-179.2	55.7	0	0	0	0	110.7	R525 V554	R525-S556 PolarHBondContact NH1-O 2.89Å; R525-S556 PolarHBondContact NH2-O 2.77Å; V554-S556 WeakPolarHBondContact CG1-OG 3.27Å
557	C	97.8	Very high	93.3	Very high	3 Å²	3	56.7 Å²	56.7	2%	0.02	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	149.4	175.6	-62.9	0	0	0	0	109.2	V539 I540 L555 I570 M573	V539-C557 WeakPolarHBondContact O-CA 3.46Å; I540-C557 HydrophobicContact CG1-CB 4.49Å; L555-C557 PolarHBondContact O-N 2.95Å; C557-I570 VanDerWaalsContact C-CG1 3.43Å; C557-I570 HydrophobicContact CB-CD1 3.66Å; C557-I570 HydrophobicContact CB-CG1 3.57Å; C557-I570 WeakPolarHBondContact O-CG1 3.32Å; C557-I570 PolarHBondContact O-N 3.02Å; C557-M573 WeakPolarHBondContact SG-CG 3.49Å
558	E	98.2	Very high	94.2	Very high	4 Å²	4	55.4 Å²	55.4	2%	0.019	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	149.4	-179.8	51.8	-167.1	131.6	0	0	108.9	T522 R525 V539 W567 T568	T522-E558 WeakPolarHBondContact CB-OE2 3.33Å; T522-E558 PolarHBondContact N-OE1 2.88Å; T522-E558 PolarHBondContact N-OE2 2.81Å; T522-E558 PolarHBondContact OG1-OE2 2.85Å; R525-E558 IonicContact CZ-OE1 3.54Å; R525-E558 IonicContact NH2-OE1 2.94Å; R525-E558 PolarHBondContact NH2-OE1 3.11Å; V539-E558 HydrophobicContact CB-CG 4.5Å; V539-E558 PolarHBondContact N-O 3.13Å; V539-E558 PolarHBondContact O-N 2.94Å; E558-W567 HydrophobicContact CB-CE3 3.94Å; E558-W567 HydrophobicContact CG-CD2 4.36Å; E558-W567 HydrophobicContact CG-CE3 3.53Å; E558-W567 HydrophobicContact CG-CZ3 3.93Å; E558-T568 CarbonylContact C-O 3.5Å; E558-T568 VanDerWaalsContact CA-O 3.25Å; E558-T568 WeakPolarHBondContact CA-O 3.43Å
559	Y	98.5	Very high	95.4	Very high	36 Å²	36	53.7 Å²	53.7	14%	0.141	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	146.9	167.7	73.5	-96.9	0	0	0	110.7	R536 L537 Y538 W567 T568 I570	R536-Y559 HydrophobicContact CB-CD2 3.89Å; R536-Y559 HydrophobicContact CB-CG 4.23Å; R536-Y559 HydrophobicContact CG-CD2 3.64Å; R536-Y559 HydrophobicContact CG-CE2 3.88Å; R536-Y559 HydrophobicContact CG-CG 4.31Å; L537-Y559 CarbonylContact O-C 3.57Å; L537-Y559 VanDerWaalsContact O-CA 3.25Å; L537-Y559 WeakPolarHBondContact O-CA 3.42Å; Y538-Y559 HydrophobicContact CE1-CD1 4.15Å; Y538-Y559 HydrophobicContact CE1-CG 4.24Å; Y559-W567 VanDerWaalsContact C-CE3 3.46Å; Y559-W567 CarbonylContact O-C 3.59Å; Y559-W567 WeakPolarHBondContact O-CA 3.42Å; Y559-T568 HydrophobicContact CE1-CG2 3.79Å; Y559-T568 VanDerWaalsContact CZ-CB 3.49Å; Y559-T568 PolarHBondContact N-O 3.26Å; Y559-T568 PolarHBondContact O-N 2.9Å; Y559-I570 HydrophobicContact CD1-CG2 3.51Å; Y559-I570 HydrophobicContact CE1-CG2 3.78Å
560	Y	98.8	Very high	96.5	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	139.4	173.7	178.4	-108.1	0	0	0	110.1	Y491 L505 A519 L537 P562 D565 Q566 W567	Y491-Y560 HydrophobicContact CD1-CE1 4.33Å; Y491-Y560 AromaticContact CE1-CE1 3.94Å; Y491-Y560 HydrophobicContact CE1-CE1 3.94Å; L505-Y560 HydrophobicContact CD2-CD1 3.73Å; L505-Y560 HydrophobicContact CD2-CD2 3.74Å; L505-Y560 HydrophobicContact CD2-CE1 3.66Å; L505-Y560 HydrophobicContact CD2-CE2 3.65Å; L505-Y560 HydrophobicContact CD2-CG 3.78Å; A519-Y560 HydrophobicContact CB-CE2 4.35Å; L537-Y560 HydrophobicContact CD1-CD1 3.72Å; L537-Y560 WeakPolarHBondContact CD1-O 3.47Å; L537-Y560 PolarHBondContact N-O 2.93Å; L537-Y560 VanDerWaalsContact N-O 3.1Å; L537-Y560 PolarHBondContact O-N 3.07Å; Y560-P562 HydrophobicContact CD1-CG 4.09Å; Y560-P562 HydrophobicContact CE1-CB 4.22Å; Y560-P562 HydrophobicContact CE1-CG 3.98Å; Y560-D565 VanDerWaalsContact CE2-OD1 3.26Å; Y560-D565 WeakPolarHBondContact CE2-OD1 3.46Å; Y560-D565 VanDerWaalsContact CZ-OD1 3.27Å; Y560-D565 WeakPolarHBondContact OH-CA 3.45Å; Y560-D565 PolarHBondContact OH-OD1 3.38Å; Y560-Q566 WeakPolarHBondContact CA-O 3.43Å; Y560-W567 AromaticContact CD2-CD1 3.93Å; Y560-W567 HydrophobicContact CD2-CD2 4.1Å; Y560-W567 AromaticContact CD2-CE2 3.76Å; Y560-W567 HydrophobicContact CD2-CG 4.22Å; Y560-W567 HydrophobicContact CD2-CZ2 4.25Å; Y560-W567 AromaticContact CD2-NE1 3.61Å; Y560-W567 HydrophobicContact CG-CD2 4.39Å; Y560-W567 HydrophobicContact CG-CZ2 4.19Å
561	S	98.3	Very high	97.1	Very high	12 Å²	12	47.7 Å²	47.7	8%	0.084	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	110.2	170.1	-177.2	0	0	0	0	109.7	I563 H564 D565 Q566	S561-I563 PolarHBondContact O-N 3.38Å; S561-H564 PolarHBondContact O-N 3.49Å; S561-H564 PolarHBondContact OG-ND1 2.99Å; S561-D565 PolarHBondContact O-N 3.08Å; S561-Q566 PolarHBondContact N-O 3.12Å
562	P	97.8	Very high	97.4	Very high	25 Å²	25	45.6 Å²	45.6	16%	0.162	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-30.6	179.3	-30.6	40.1	0	0	0	114.4	Y486 D535 L537 Y560 H564	Y486-P562 HydrophobicContact CD1-CB 4.12Å; Y486-P562 HydrophobicContact CD1-CG 3.61Å; Y486-P562 HydrophobicContact CE1-CB 4.08Å; Y486-P562 HydrophobicContact CE1-CG 3.83Å; D535-P562 WeakPolarHBondContact O-CD 3.32Å; L537-P562 HydrophobicContact CD1-CG 3.17Å; Y560-P562 HydrophobicContact CD1-CG 4.09Å; Y560-P562 HydrophobicContact CE1-CB 4.22Å; Y560-P562 HydrophobicContact CE1-CG 3.98Å; P562-H564 VanDerWaalsContact C-N 3.34Å
563	I	97.2	Very high	97.6	Very high	121 Å²	121	44.4 Å²	44.4	62%	0.621	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-37.8	-179.3	-64.6	172.8	0	0	0	110.6	S561	S561-I563 PolarHBondContact O-N 3.38Å
564	H	97.8	Very high	97.5	Very high	131 Å²	131	48.6 Å²	48.6	61%	0.606	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.3	-8.2	-174.7	-55.8	94.9	0	0	0	113.3	S561 P562 Q566	S561-H564 PolarHBondContact O-N 3.49Å; S561-H564 PolarHBondContact OG-ND1 2.99Å; P562-H564 VanDerWaalsContact C-N 3.34Å; H564-Q566 VanDerWaalsContact C-N 3.27Å; H564-Q566 HydrophobicContact CB-CB 4.24Å; H564-Q566 PolarHBondContact O-N 2.95Å
565	D	98.3	Very high	97.2	Very high	68 Å²	68	55 Å²	55	36%	0.364	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.9	49.1	-171.7	-165	21.6	0	0	0	112.1	A519 Y560 S561	A519-D565 WeakPolarHBondContact CB-O 3.5Å; A519-D565 WeakPolarHBondContact CB-OD1 3.45Å; A519-D565 PolarHBondContact N-OD1 3.01Å; Y560-D565 VanDerWaalsContact CE2-OD1 3.26Å; Y560-D565 WeakPolarHBondContact CE2-OD1 3.46Å; Y560-D565 VanDerWaalsContact CZ-OD1 3.27Å; Y560-D565 WeakPolarHBondContact OH-CA 3.45Å; Y560-D565 PolarHBondContact OH-OD1 3.38Å; S561-D565 PolarHBondContact O-N 3.08Å
566	Q	98.3	Very high	96.9	Very high	117 Å²	117	51.6 Å²	51.6	55%	0.547	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	143.6	-172.6	-176.8	177.3	-0.3	0	0	112.2	Y560 S561 H564	Y560-Q566 WeakPolarHBondContact CA-O 3.43Å; S561-Q566 PolarHBondContact N-O 3.12Å; H564-Q566 VanDerWaalsContact C-N 3.27Å; H564-Q566 HydrophobicContact CB-CB 4.24Å; H564-Q566 PolarHBondContact O-N 2.95Å
567	W	98.6	Very high	96.7	Very high	19 Å²	19	49.2 Å²	49.2	7%	0.072	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	139.1	170.2	-67.4	91.4	0	0	0	111.9	L505 A519 P520 M521 M530 V539 E558 Y559 Y560	L505-W567 HydrophobicContact CB-CZ2 4.39Å; L505-W567 HydrophobicContact CD1-CZ2 4.16Å; L505-W567 HydrophobicContact CD2-CZ2 3.82Å; L505-W567 HydrophobicContact CG-CZ2 4.35Å; A519-W567 PolarHBondContact O-NE1 3.4Å; P520-W567 PolarHBondContact O-NE1 3.07Å; M521-W567 HydrophobicContact CG-CD2 4.18Å; M521-W567 HydrophobicContact CG-CE3 4.45Å; M521-W567 HydrophobicContact CG-CH2 3.73Å; M521-W567 HydrophobicContact CG-CZ2 3.37Å; M521-W567 HydrophobicContact CG-CZ3 4.25Å; M521-W567 HydrophobicContact SD-CH2 4.27Å; M521-W567 HydrophobicContact SD-CZ2 4.39Å; M530-W567 HydrophobicContact CE-CH2 4.36Å; V539-W567 HydrophobicContact CB-CH2 4.16Å; V539-W567 HydrophobicContact CB-CZ3 3.89Å; V539-W567 HydrophobicContact CG2-CH2 3.43Å; V539-W567 VanDerWaalsContact CG2-CH2 3.43Å; V539-W567 HydrophobicContact CG2-CZ3 3.66Å; E558-W567 HydrophobicContact CB-CE3 3.94Å; E558-W567 HydrophobicContact CG-CD2 4.36Å; E558-W567 HydrophobicContact CG-CE3 3.53Å; E558-W567 HydrophobicContact CG-CZ3 3.93Å; Y559-W567 VanDerWaalsContact C-CE3 3.46Å; Y559-W567 CarbonylContact O-C 3.59Å; Y559-W567 WeakPolarHBondContact O-CA 3.42Å; Y560-W567 AromaticContact CD2-CD1 3.93Å; Y560-W567 HydrophobicContact CD2-CD2 4.1Å; Y560-W567 AromaticContact CD2-CE2 3.76Å; Y560-W567 HydrophobicContact CD2-CG 4.22Å; Y560-W567 HydrophobicContact CD2-CZ2 4.25Å; Y560-W567 AromaticContact CD2-NE1 3.61Å; Y560-W567 HydrophobicContact CG-CD2 4.39Å; Y560-W567 HydrophobicContact CG-CZ2 4.19Å
568	T	98.3	Very high	96.5	Very high	44 Å²	44	49.1 Å²	49.1	27%	0.27	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	127.2	176.2	-56.6	0	0	0	0	109.5	E558 Y559	E558-T568 CarbonylContact C-O 3.5Å; E558-T568 VanDerWaalsContact CA-O 3.25Å; E558-T568 WeakPolarHBondContact CA-O 3.43Å; Y559-T568 HydrophobicContact CE1-CG2 3.79Å; Y559-T568 VanDerWaalsContact CZ-CB 3.49Å; Y559-T568 PolarHBondContact N-O 3.26Å; Y559-T568 PolarHBondContact O-N 2.9Å
569	P	98.2	Very high	96.1	Very high	103 Å²	103	49.9 Å²	49.9	67%	0.669	27%	0.265	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.2	148.2	176.2	29.6	-35	0	0	0	111.1
570	I	98.2	Very high	95.8	Very high	22 Å²	22	48.5 Å²	48.5	11%	0.113	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	177.4	175.4	51.7	159.8	0	0	0	110.3	Y538 C557 Y559 A572 Y609 D614	Y538-I570 HydrophobicContact CD1-CD1 3.81Å; Y538-I570 HydrophobicContact CE1-CD1 4.12Å; C557-I570 VanDerWaalsContact C-CG1 3.43Å; C557-I570 HydrophobicContact CB-CD1 3.66Å; C557-I570 HydrophobicContact CB-CG1 3.57Å; C557-I570 WeakPolarHBondContact O-CG1 3.32Å; C557-I570 PolarHBondContact O-N 3.02Å; Y559-I570 HydrophobicContact CD1-CG2 3.51Å; Y559-I570 HydrophobicContact CE1-CG2 3.78Å; I570-A572 PolarHBondContact O-N 3.34Å; I570-Y609 WeakPolarHBondContact CB-OH 3.27Å; I570-Y609 HydrophobicContact CD1-CE1 3.86Å; I570-Y609 HydrophobicContact CD1-CE2 4.02Å; I570-Y609 WeakPolarHBondContact CD1-OH 3.38Å; I570-Y609 WeakPolarHBondContact CG2-OH 3.16Å; I570-D614 VanDerWaalsContact CB-OD1 3.26Å; I570-D614 WeakPolarHBondContact CB-OD1 2.94Å
571	A	98	Very high	95.7	Very high	29 Å²	29	48.5 Å²	48.5	24%	0.24	26%	0.26	C	S	.	.	P	Polyproline II helix	trans	-51	135	176.4	0	0	0	0	0	112.2	Y609 D614 W616	A571-Y609 HydrophobicContact CB-CE2 4.41Å; A571-D614 WeakPolarHBondContact CB-O 3.45Å; A571-D614 WeakPolarHBondContact CB-OD1 3.47Å; A571-D614 PolarHBondContact N-OD1 2.77Å; A571-D614 PolarHBondContact N-OD2 2.63Å; A571-W616 PolarHBondContact O-NE1 3.11Å
572	A	97.3	Very high	95.6	Very high	54 Å²	54	49.6 Å²	49.6	45%	0.446	27%	0.266	S	S	.	.	P	Polyproline II helix	trans	-72.2	150.4	178.8	0	0	0	0	0	111.5	L555 I570	L555-A572 HydrophobicContact CB-CB 4.31Å; L555-A572 VanDerWaalsContact O-CA 3.29Å; L555-A572 WeakPolarHBondContact O-CA 3.36Å; L555-A572 WeakPolarHBondContact O-CB 3.3Å; I570-A572 PolarHBondContact O-N 3.34Å
573	M	95.8	Very high	95.5	Very high	7 Å²	7	48.6 Å²	48.6	3%	0.034	26%	0.26	C	S	.	.	P	Polyproline II helix	trans	-59.6	149.2	176.3	-57.4	-178.6	73.3	0	0	111.3	I540 G541 L555 C557 R575 Q577 V591 W616	I540-M573 HydrophobicContact CG2-CE 3.82Å; I540-M573 HydrophobicContact CG2-CG 4.11Å; I540-M573 HydrophobicContact CG2-SD 3.56Å; I540-M573 VanDerWaalsContact CG2-SD 3.56Å; G541-M573 WeakPolarHBondContact CA-SD 3.4Å; G541-M573 PolarHBondContact N-SD 3.46Å; L555-M573 HydrophobicContact CD2-CB 4.39Å; L555-M573 PolarHBondContact O-N 2.83Å; C557-M573 WeakPolarHBondContact SG-CG 3.49Å; M573-R575 VanDerWaalsContact C-N 3.29Å; M573-R575 WeakPolarHBondContact CB-O 3.11Å; M573-R575 PolarHBondContact O-N 3.23Å; M573-Q577 HydrophobicContact CE-CB 4.23Å; M573-Q577 HydrophobicContact CE-CG 4.3Å; M573-V591 HydrophobicContact CE-CB 4.42Å; M573-V591 HydrophobicContact CE-CG1 3.99Å; M573-V591 HydrophobicContact CE-CG2 4.38Å; M573-W616 HydrophobicContact CE-CH2 4.44Å; M573-W616 HydrophobicContact CG-CH2 4.2Å; M573-W616 HydrophobicContact CG-CZ2 3.87Å
574	L	93.6	Very high	95.5	Very high	96 Å²	96	45 Å²	45	50%	0.503	24%	0.243	S	C	.	.	S	Bend	trans	-68	-34.6	174.7	-52.2	171.8	0	0	0	111.3	Q607 W616	L574-Q607 VanDerWaalsContact CB-OE1 3.22Å; L574-W616 HydrophobicContact CD1-CB 4.2Å; L574-W616 HydrophobicContact CD2-CB 4Å; L574-W616 HydrophobicContact CG-CB 3.74Å
575	R	90.6	Very high	95.3	Very high	136 Å²	136	39.4 Å²	39.4	51%	0.513	22%	0.218	S	C	.	.	S	Bend	trans	-140	144.7	175.6	-68.6	-169.5	176.5	-163	-1.2	111	M573 I605 Q607	M573-R575 VanDerWaalsContact C-N 3.29Å; M573-R575 WeakPolarHBondContact CB-O 3.11Å; M573-R575 PolarHBondContact O-N 3.23Å; R575-I605 HydrophobicContact CG-CD1 4.47Å; R575-Q607 PolarHBondContact O-NE2 3.18Å
576	G	88.7	Confident	94.9	Very high	5 Å²	5	42.3 Å²	42.3	5%	0.052	23%	0.229	C	C	.	.			trans	-68.4	128.5	174.7	0	0	0	0	0	111.5	L555	L555-G576 VanDerWaalsContact CD2-CA 3.45Å
577	Q	92.3	Very high	94.7	Very high	1 Å²	1	42.3 Å²	42.3	1%	0.005	23%	0.232	C	C	.	.			trans	-137.6	125.5	175.9	-56.7	176	-80.5	0	0	109.5	G542 M573 V580 G593 V603 I605 Q607	G542-Q577 PolarHBondContact N-O 2.78Å; M573-Q577 HydrophobicContact CE-CB 4.23Å; M573-Q577 HydrophobicContact CE-CG 4.3Å; Q577-V580 HydrophobicContact CB-CG1 3.26Å; Q577-V580 HydrophobicContact CG-CG1 4.34Å; Q577-G593 PolarHBondContact NE2-O 2.71Å; Q577-V603 HydrophobicContact CG-CG2 4.07Å; Q577-I605 HydrophobicContact CG-CG2 4.5Å; Q577-I605 VanDerWaalsContact NE2-CG2 3.29Å; Q577-I605 PolarHBondContact NE2-O 3.22Å; Q577-I605 VanDerWaalsContact NE2-O 3.13Å; Q577-Q607 VanDerWaalsContact CD-NE2 3.32Å
578	S	93.1	Very high	94.7	Very high	1 Å²	1	44.1 Å²	44.1	1%	0.007	24%	0.241	C	C	.	.	B	Isolated β-bridge	trans	-106.8	158.2	165	-66.3	0	0	0	0	110.1	G542 N543 V580 G594 Y595 W597	G542-S578 WeakPolarHBondContact CA-OG 3.31Å; G542-S578 PolarHBondContact O-OG 2.88Å; N543-S578 PolarHBondContact N-OG 3.48Å; S578-V580 VanDerWaalsContact C-N 3.33Å; S578-V580 PolarHBondContact O-N 3.13Å; S578-G594 CarbonylContact O-C 3.54Å; S578-G594 VanDerWaalsContact O-CA 3.25Å; S578-G594 WeakPolarHBondContact O-CA 3.44Å; S578-Y595 PolarHBondContact N-O 2.95Å; S578-Y595 PolarHBondContact O-N 2.9Å; S578-W597 VanDerWaalsContact CB-NE1 3.35Å; S578-W597 VanDerWaalsContact OG-CD1 3.24Å; S578-W597 PolarHBondContact OG-NE1 3.03Å
579	D	90.5	Very high	94.6	Very high	20 Å²	20	42 Å²	42	11%	0.107	23%	0.228	C	C	.	.	S	Bend	trans	55.8	48.3	173.4	-166.9	29.3	0	0	0	113.3	Q381 L527 G628 R630	Q381-D579 VanDerWaalsContact CD-OD1 3.25Å; Q381-D579 PolarHBondContact NE2-OD1 3.34Å; Q381-D579 PolarHBondContact NE2-OD2 3.49Å; Q381-D579 PolarHBondContact OE1-OD1 3.06Å; L527-D579 PolarHBondContact O-N 2.84Å; D579-G628 VanDerWaalsContact CG-N 3.32Å; D579-G628 WeakPolarHBondContact O-CA 3.18Å; D579-G628 PolarHBondContact O-N 2.87Å; D579-G628 VanDerWaalsContact OD1-CA 3.27Å; D579-G628 WeakPolarHBondContact OD1-CA 3.25Å; D579-G628 WeakPolarHBondContact OD2-CA 3.5Å; D579-G628 PolarHBondContact OD2-N 2.86Å; D579-R630 IonicContact OD1-CZ 3.72Å; D579-R630 IonicContact OD1-NH1 2.68Å; D579-R630 PolarHBondContact OD1-NH1 2.86Å; D579-R630 VanDerWaalsContact OD1-NH1 3.09Å; D579-R630 IonicContact OD1-NH2 3.72Å
580	V	93.3	Very high	94.6	Very high	8 Å²	8	37.9 Å²	37.9	5%	0.048	20%	0.199	C	C	.	.			trans	-91.3	160.1	-173.3	-62.1	0	0	0	0	112.3	C529 Q577 S578 V591 I629 R630	C529-V580 HydrophobicContact CB-CG2 3.61Å; C529-V580 VanDerWaalsContact SG-CG2 3.58Å; Q577-V580 HydrophobicContact CB-CG1 3.26Å; Q577-V580 HydrophobicContact CG-CG1 4.34Å; S578-V580 VanDerWaalsContact C-N 3.33Å; S578-V580 PolarHBondContact O-N 3.13Å; V580-V591 HydrophobicContact CB-CG1 3.69Å; V580-V591 HydrophobicContact CG1-CG1 3.65Å; V580-V591 HydrophobicContact CG2-CG1 3.79Å; V580-I629 CarbonylContact C-O 3.58Å; V580-I629 VanDerWaalsContact C-O 3.29Å; V580-R630 PolarHBondContact O-NH1 2.78Å
581	G	94.8	Very high	94.5	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	136.9	155.2	0	0	0	0	0	109.5	V591 V592 I629	G581-V591 WeakPolarHBondContact O-CA 3.31Å; G581-V592 PolarHBondContact N-O 2.94Å; G581-V592 PolarHBondContact O-N 2.78Å; G581-I629 WeakPolarHBondContact CA-O 3.29Å; G581-I629 PolarHBondContact N-O 3.32Å
582	V	96.5	Very high	94.3	Very high	34 Å²	34	35.5 Å²	35.5	21%	0.206	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	131.8	173.1	65.5	0	0	0	0	110.1	C529 C531 I589 Y590	C529-V582 HydrophobicContact CB-CB 3.88Å; C529-V582 HydrophobicContact CB-CG1 3.77Å; C529-V582 HydrophobicContact CB-CG2 4.48Å; C531-V582 HydrophobicContact CB-CG2 4.05Å; V582-I589 HydrophobicContact CG2-CG2 3.82Å; V582-Y590 WeakPolarHBondContact CA-O 3.34Å
583	A	97	Very high	94.1	Very high	4 Å²	4	32.9 Å²	32.9	3%	0.033	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	142.3	174.9	0	0	0	0	0	110.3	L342 Y590 A631 T633	L342-A583 HydrophobicContact CD1-CB 3.39Å; A583-Y590 PolarHBondContact N-O 2.94Å; A583-Y590 PolarHBondContact O-N 3.28Å; A583-A631 HydrophobicContact CB-CB 4.13Å; A583-T633 HydrophobicContact CB-CG2 4.41Å
584	V	96.5	Very high	94	Very high	46 Å²	46	32.6 Å²	32.6	28%	0.279	16%	0.16	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	118.4	170.7	179	0	0	0	0	107.6	C531 V533 K588 T633	C531-V584 HydrophobicContact CB-CG2 3.97Å; V533-V584 HydrophobicContact CG2-CG1 3.85Å; V533-V584 HydrophobicContact CG2-CG2 3.81Å; V584-K588 CarbonylContact C-O 3.5Å; V584-K588 WeakPolarHBondContact CA-O 3.13Å; V584-T633 WeakPolarHBondContact O-CG2 3.37Å
585	F	93.6	Very high	93.9	Very high	14 Å²	14	28.9 Å²	28.9	6%	0.061	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	125.7	-178.3	-177.7	-102.6	0	0	0	109	T340 E364 N587 K588 Y590 T633	T340-F585 HydrophobicContact CG2-CD2 4.45Å; T340-F585 HydrophobicContact CG2-CE2 4.23Å; T340-F585 WeakPolarHBondContact O-CE2 3.38Å; E364-F585 WeakPolarHBondContact OE1-CE1 3.15Å; F585-N587 VanDerWaalsContact C-N 3.29Å; F585-N587 PolarHBondContact O-N 3.11Å; F585-K588 PolarHBondContact N-O 3.01Å; F585-K588 WeakPolarHBondContact O-CB 3.4Å; F585-K588 PolarHBondContact O-N 2.86Å; F585-Y590 HydrophobicContact CB-CD2 3.93Å; F585-Y590 HydrophobicContact CB-CE2 3.83Å; F585-Y590 HydrophobicContact CD1-CE2 4.09Å; F585-Y590 HydrophobicContact CG-CE2 4.47Å; F585-T633 HydrophobicContact CB-CG2 3.9Å; F585-T633 HydrophobicContact CD2-CG2 3.76Å; F585-T633 HydrophobicContact CG-CG2 4.3Å
586	E	90.7	Very high	94	Very high	129 Å²	129	22.6 Å²	22.6	60%	0.603	12%	0.116	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.4	47.5	-175.3	-60.5	-172	155.8	0	0	113.5	K588	E586-K588 PolarHBondContact O-N 3.03Å; E586-K588 VanDerWaalsContact O-N 3.11Å
587	N	94.1	Very high	94.1	Very high	116 Å²	116	24.9 Å²	24.9	62%	0.62	12%	0.123	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.9	14.5	-176.5	-63	-15.1	0	0	0	115.6	V533 F585 P611	V533-N587 HydrophobicContact CG1-CB 4.4Å; F585-N587 VanDerWaalsContact C-N 3.29Å; F585-N587 PolarHBondContact O-N 3.11Å; N587-P611 WeakPolarHBondContact O-CD 3.26Å
588	K	96.9	Very high	93.9	Very high	58 Å²	58	28.9 Å²	28.9	25%	0.252	15%	0.145	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	148.9	176	-63.9	174.9	-172.8	173.7	0	110.1	V584 F585 E586 Y590 K608 D610	V584-K588 CarbonylContact C-O 3.5Å; V584-K588 WeakPolarHBondContact CA-O 3.13Å; F585-K588 PolarHBondContact N-O 3.01Å; F585-K588 WeakPolarHBondContact O-CB 3.4Å; F585-K588 PolarHBondContact O-N 2.86Å; E586-K588 PolarHBondContact O-N 3.03Å; E586-K588 VanDerWaalsContact O-N 3.11Å; K588-Y590 HydrophobicContact CB-CD2 4.49Å; K588-Y590 HydrophobicContact CB-CE2 3.91Å; K588-K608 HydrophobicContact CB-CD 4.17Å; K588-K608 HydrophobicContact CB-CG 3.93Å; K588-K608 HydrophobicContact CD-CD 3.78Å; K588-K608 HydrophobicContact CD-CG 4.32Å; K588-D610 WeakPolarHBondContact CE-OD2 3.35Å; K588-D610 IonicContact NZ-OD2 2.8Å
589	I	98.1	Very high	93.6	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	120.7	-177.7	-53.8	171.9	0	0	0	108.4	C531 V533 Y538 I540 V582 K608 Y609	C531-I589 VanDerWaalsContact SG-CG2 3.56Å; V533-I589 HydrophobicContact CG2-CD1 3.86Å; V533-I589 HydrophobicContact CG2-CG1 3.59Å; Y538-I589 HydrophobicContact CD1-CD1 3.9Å; Y538-I589 HydrophobicContact CD2-CD1 3.75Å; Y538-I589 HydrophobicContact CE1-CD1 4.47Å; Y538-I589 HydrophobicContact CE2-CD1 4.35Å; Y538-I589 HydrophobicContact CG-CD1 3.51Å; I540-I589 HydrophobicContact CD1-CB 4.45Å; I540-I589 HydrophobicContact CD1-CD1 3.99Å; I540-I589 HydrophobicContact CD1-CG2 3.69Å; V582-I589 HydrophobicContact CG2-CG2 3.82Å; I589-K608 CarbonylContact O-C 3.29Å; I589-K608 VanDerWaalsContact O-CA 3.26Å; I589-K608 WeakPolarHBondContact O-CA 3.29Å; I589-Y609 HydrophobicContact CD1-CD1 3.97Å; I589-Y609 PolarHBondContact N-O 2.71Å; I589-Y609 PolarHBondContact O-N 2.9Å
590	Y	97.1	Very high	93.5	Very high	15 Å²	15	41.7 Å²	41.7	6%	0.059	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	124.5	176.2	-71.4	-107.8	0	0	0	109.3	L342 V582 A583 F585 K588 V606 Q607 K608 V619	L342-Y590 HydrophobicContact CD2-CD1 4.38Å; V582-Y590 WeakPolarHBondContact CA-O 3.34Å; A583-Y590 PolarHBondContact N-O 2.94Å; A583-Y590 PolarHBondContact O-N 3.28Å; F585-Y590 HydrophobicContact CB-CD2 3.93Å; F585-Y590 HydrophobicContact CB-CE2 3.83Å; F585-Y590 HydrophobicContact CD1-CE2 4.09Å; F585-Y590 HydrophobicContact CG-CE2 4.47Å; K588-Y590 HydrophobicContact CB-CD2 4.49Å; K588-Y590 HydrophobicContact CB-CE2 3.91Å; Y590-V606 HydrophobicContact CD1-CG1 4.04Å; Y590-Q607 CarbonylContact C-O 3.57Å; Y590-Q607 WeakPolarHBondContact CA-O 3.41Å; Y590-K608 HydrophobicContact CD1-CB 4.31Å; Y590-K608 HydrophobicContact CD2-CG 4.38Å; Y590-K608 HydrophobicContact CE1-CB 4.21Å; Y590-K608 HydrophobicContact CE1-CD 3.96Å; Y590-K608 HydrophobicContact CE1-CG 4.18Å; Y590-K608 HydrophobicContact CE2-CD 3.97Å; Y590-K608 HydrophobicContact CE2-CG 3.98Å; Y590-K608 VanDerWaalsContact CZ-CD 3.5Å; Y590-K608 WeakPolarHBondContact OH-CD 3.49Å; Y590-V619 HydrophobicContact CE1-CG2 4.16Å
591	V	96.5	Very high	93.2	Very high	1 Å²	1	43.7 Å²	43.7	1%	0.006	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	121.6	174.1	-174.6	0	0	0	0	108.2	I540 M573 V580 G581 V606 Q607 W616	I540-V591 HydrophobicContact CG2-CG2 3.87Å; M573-V591 HydrophobicContact CE-CB 4.42Å; M573-V591 HydrophobicContact CE-CG1 3.99Å; M573-V591 HydrophobicContact CE-CG2 4.38Å; V580-V591 HydrophobicContact CB-CG1 3.69Å; V580-V591 HydrophobicContact CG1-CG1 3.65Å; V580-V591 HydrophobicContact CG2-CG1 3.79Å; G581-V591 WeakPolarHBondContact O-CA 3.31Å; V591-V606 WeakPolarHBondContact O-CA 3.48Å; V591-Q607 HydrophobicContact CB-CB 4.49Å; V591-Q607 PolarHBondContact N-O 2.8Å; V591-Q607 PolarHBondContact O-N 2.95Å; V591-W616 HydrophobicContact CG2-CH2 3.82Å; V591-W616 HydrophobicContact CG2-CZ3 3.87Å
592	V	94.2	Very high	92.9	Very high	0 Å²	0	45 Å²	45	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	122.2	-163.4	179.3	0	0	0	0	110	L342 T344 G581 V606 L622 I629 A631	L342-V592 HydrophobicContact CD2-CG2 4.29Å; T344-V592 HydrophobicContact CG2-CG1 3.76Å; G581-V592 PolarHBondContact N-O 2.94Å; G581-V592 PolarHBondContact O-N 2.78Å; V592-V606 HydrophobicContact CB-CG2 4.5Å; V592-V606 HydrophobicContact CG1-CG2 4.13Å; V592-V606 HydrophobicContact CG2-CG1 3.98Å; V592-V606 HydrophobicContact CG2-CG2 4.31Å; V592-L622 HydrophobicContact CG1-CD1 3.7Å; V592-L622 HydrophobicContact CG1-CD2 3.71Å; V592-L622 HydrophobicContact CG1-CG 3.95Å; V592-I629 HydrophobicContact CG1-CD1 4.37Å; V592-I629 HydrophobicContact CG1-CG2 4.44Å; V592-I629 WeakPolarHBondContact O-CG2 3.22Å; V592-A631 HydrophobicContact CB-CB 4.31Å; V592-A631 HydrophobicContact CG2-CB 4.15Å
593	G	92.8	Very high	92.6	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	21%	0.212	C	C	.	.			trans	66.7	-143.2	171.5	0	0	0	0	0	114.4	Q577 V603 I605	Q577-G593 PolarHBondContact NE2-O 2.71Å; G593-V603 CarbonylContact C-O 3.6Å; G593-V603 WeakPolarHBondContact CA-O 3.43Å; G593-V603 WeakPolarHBondContact O-CG2 3.28Å; G593-I605 PolarHBondContact N-O 3.19Å
594	G	92.6	Very high	92.2	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	23%	0.226	C	C	.	.			trans	96.2	-163.6	176.4	0	0	0	0	0	114.1	S578 M602 V603 L626	S578-G594 CarbonylContact O-C 3.54Å; S578-G594 VanDerWaalsContact O-CA 3.25Å; S578-G594 WeakPolarHBondContact O-CA 3.44Å; G594-M602 WeakPolarHBondContact O-CA 3.36Å; G594-V603 PolarHBondContact O-N 3.22Å; G594-L626 PolarHBondContact N-O 2.85Å
595	Y	91.8	Very high	92	Very high	18 Å²	18	45.4 Å²	45.4	7%	0.071	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	133.5	-175.7	-172	-103.6	0	0	0	110.8	R350 S578 W597 R600 C601 M602	R350-Y595 PolarHBondContact NH1-OH 2.98Å; S578-Y595 PolarHBondContact N-O 2.95Å; S578-Y595 PolarHBondContact O-N 2.9Å; Y595-W597 AromaticContact CD1-CD2 3.76Å; Y595-W597 HydrophobicContact CD1-CD2 3.76Å; Y595-W597 AromaticContact CD1-CE2 3.73Å; Y595-W597 HydrophobicContact CD1-CE3 4.25Å; Y595-W597 HydrophobicContact CD1-CG 4.01Å; Y595-W597 HydrophobicContact CD1-CZ2 4.25Å; Y595-W597 AromaticContact CD1-NE1 3.9Å; Y595-W597 AromaticContact CE1-CD2 3.66Å; Y595-W597 HydrophobicContact CE1-CD2 3.66Å; Y595-W597 AromaticContact CE1-CE3 3.69Å; Y595-W597 HydrophobicContact CE1-CE3 3.69Å; Y595-W597 HydrophobicContact CE1-CG 4.1Å; Y595-W597 HydrophobicContact CE1-CZ2 4.45Å; Y595-W597 HydrophobicContact CE1-CZ3 4.16Å; Y595-R600 WeakPolarHBondContact CE2-O 3.42Å; Y595-R600 VanDerWaalsContact CZ-C 3.44Å; Y595-R600 WeakPolarHBondContact OH-CA 3.38Å; Y595-R600 PolarHBondContact OH-O 2.9Å; Y595-C601 VanDerWaalsContact CD2-C 3.42Å; Y595-C601 VanDerWaalsContact CD2-O 3.22Å; Y595-C601 WeakPolarHBondContact CD2-O 3.38Å; Y595-M602 HydrophobicContact CD2-CE 3.89Å; Y595-M602 HydrophobicContact CD2-CG 4.33Å; Y595-M602 HydrophobicContact CD2-SD 3.56Å; Y595-M602 VanDerWaalsContact CD2-SD 3.56Å; Y595-M602 HydrophobicContact CG-SD 4.2Å
596	S	92.6	Very high	92	Very high	4 Å²	4	44.8 Å²	44.8	3%	0.028	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	121.2	167.7	170.7	0	0	0	0	109.1	D553 N599 R600 C601	D553-S596 PolarHBondContact OD2-OG 3.01Å; S596-N599 PolarHBondContact OG-N 3.11Å; S596-N599 PolarHBondContact OG-ND2 2.86Å; S596-R600 VanDerWaalsContact O-CA 3.23Å; S596-R600 WeakPolarHBondContact O-CA 3.5Å; S596-R600 PolarHBondContact O-N 3.48Å; S596-C601 PolarHBondContact N-O 3Å; S596-C601 PolarHBondContact O-N 3.16Å
597	W	90.4	Very high	92.2	Very high	53 Å²	53	38.6 Å²	38.6	20%	0.201	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73	-35.5	177.7	-69.2	92.8	0	0	0	112.3	L527 N543 Y551 D553 S578 Y595 R600	L527-W597 HydrophobicContact CD1-CZ2 4.21Å; N543-W597 VanDerWaalsContact CB-CD1 3.5Å; N543-W597 HydrophobicContact CB-CG 4.16Å; N543-W597 WeakPolarHBondContact ND2-CZ2 3.23Å; N543-W597 PolarHBondContact ND2-NE1 2.94Å; Y551-W597 HydrophobicContact CD1-CD2 4.41Å; Y551-W597 HydrophobicContact CD1-CE3 4.24Å; Y551-W597 HydrophobicContact CD1-CH2 4.18Å; Y551-W597 HydrophobicContact CD1-CZ2 4.4Å; Y551-W597 HydrophobicContact CD1-CZ3 4.1Å; Y551-W597 AromaticContact CD2-CE3 3.83Å; Y551-W597 HydrophobicContact CD2-CE3 3.83Å; Y551-W597 HydrophobicContact CD2-CH2 4.11Å; Y551-W597 AromaticContact CD2-CZ3 3.44Å; Y551-W597 HydrophobicContact CD2-CZ3 3.44Å; Y551-W597 VanDerWaalsContact CD2-CZ3 3.44Å; Y551-W597 HydrophobicContact CE1-CH2 4.29Å; Y551-W597 HydrophobicContact CE2-CH2 4.27Å; Y551-W597 AromaticContact CE2-CZ3 3.96Å; Y551-W597 HydrophobicContact CE2-CZ3 3.96Å; Y551-W597 HydrophobicContact CG-CD2 4.05Å; Y551-W597 AromaticContact CG-CE3 3.52Å; Y551-W597 HydrophobicContact CG-CE3 3.52Å; Y551-W597 HydrophobicContact CG-CH2 4.06Å; Y551-W597 AromaticContact CG-CZ3 3.52Å; Y551-W597 HydrophobicContact CG-CZ3 3.52Å; D553-W597 VanDerWaalsContact CG-N 3.34Å; D553-W597 WeakPolarHBondContact OD1-CB 3.19Å; D553-W597 VanDerWaalsContact OD1-CD1 3.32Å; D553-W597 PolarHBondContact OD1-N 2.86Å; D553-W597 PolarHBondContact OD2-N 3.25Å; D553-W597 VanDerWaalsContact OD2-N 3.11Å; S578-W597 VanDerWaalsContact CB-NE1 3.35Å; S578-W597 VanDerWaalsContact OG-CD1 3.24Å; S578-W597 PolarHBondContact OG-NE1 3.03Å; Y595-W597 AromaticContact CD1-CD2 3.76Å; Y595-W597 HydrophobicContact CD1-CD2 3.76Å; Y595-W597 AromaticContact CD1-CE2 3.73Å; Y595-W597 HydrophobicContact CD1-CE3 4.25Å; Y595-W597 HydrophobicContact CD1-CG 4.01Å; Y595-W597 HydrophobicContact CD1-CZ2 4.25Å; Y595-W597 AromaticContact CD1-NE1 3.9Å; Y595-W597 AromaticContact CE1-CD2 3.66Å; Y595-W597 HydrophobicContact CE1-CD2 3.66Å; Y595-W597 AromaticContact CE1-CE3 3.69Å; Y595-W597 HydrophobicContact CE1-CE3 3.69Å; Y595-W597 HydrophobicContact CE1-CG 4.1Å; Y595-W597 HydrophobicContact CE1-CZ2 4.45Å; Y595-W597 HydrophobicContact CE1-CZ3 4.16Å; W597-R600 WeakPolarHBondContact O-CG 3.27Å; W597-R600 PolarHBondContact O-N 3.37Å
598	N	89.1	Confident	92.4	Very high	86 Å²	86	35 Å²	35	46%	0.46	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-40.5	178.2	-76.2	-25.1	0	0	0	112.1	D552 D553	D552-N598 PolarHBondContact OD1-ND2 3.14Å; D552-N598 PolarHBondContact OD1-OD1 2.83Å; D553-N598 WeakPolarHBondContact OD2-CB 3.48Å; D553-N598 PolarHBondContact OD2-N 2.91Å
599	N	86.9	Confident	92.4	Very high	101 Å²	101	32.4 Å²	32.4	54%	0.54	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-8.3	176.8	-61.5	-38.6	0	0	0	113.4	S596 C601	S596-N599 PolarHBondContact OG-N 3.11Å; S596-N599 PolarHBondContact OG-ND2 2.86Å; N599-C601 PolarHBondContact O-N 2.87Å
600	R	87.3	Confident	92.4	Very high	189 Å²	189	32.9 Å²	32.9	71%	0.713	15%	0.154	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.2	30	-177.9	-58	-178.9	178	-175.2	-2.2	114.2	Y595 S596 W597	Y595-R600 WeakPolarHBondContact CE2-O 3.42Å; Y595-R600 VanDerWaalsContact CZ-C 3.44Å; Y595-R600 WeakPolarHBondContact OH-CA 3.38Å; Y595-R600 PolarHBondContact OH-O 2.9Å; S596-R600 VanDerWaalsContact O-CA 3.23Å; S596-R600 WeakPolarHBondContact O-CA 3.5Å; S596-R600 PolarHBondContact O-N 3.48Å; W597-R600 WeakPolarHBondContact O-CG 3.27Å; W597-R600 PolarHBondContact O-N 3.37Å
601	C	87.6	Confident	92.4	Very high	49 Å²	49	33.2 Å²	33.2	33%	0.331	16%	0.158	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	157.2	-177	65.8	0	0	0	0	112.8	Y595 S596 N599	Y595-C601 VanDerWaalsContact CD2-C 3.42Å; Y595-C601 VanDerWaalsContact CD2-O 3.22Å; Y595-C601 WeakPolarHBondContact CD2-O 3.38Å; S596-C601 PolarHBondContact N-O 3Å; S596-C601 PolarHBondContact O-N 3.16Å; N599-C601 PolarHBondContact O-N 2.87Å
602	M	89.1	Confident	92.4	Very high	29 Å²	29	41.5 Å²	41.5	14%	0.143	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	145.2	164.2	-63.7	-58.3	178.3	0	0	108.9	V348 R350 G594 Y595 S625 G627	V348-M602 HydrophobicContact CG1-CE 4.17Å; R350-M602 HydrophobicContact CB-CE 3.53Å; R350-M602 HydrophobicContact CB-CG 4.1Å; R350-M602 HydrophobicContact CG-CE 4.31Å; G594-M602 WeakPolarHBondContact O-CA 3.36Å; Y595-M602 HydrophobicContact CD2-CE 3.89Å; Y595-M602 HydrophobicContact CD2-CG 4.33Å; Y595-M602 HydrophobicContact CD2-SD 3.56Å; Y595-M602 VanDerWaalsContact CD2-SD 3.56Å; Y595-M602 HydrophobicContact CG-SD 4.2Å; M602-S625 VanDerWaalsContact CB-O 3.29Å; M602-S625 WeakPolarHBondContact CB-O 3.5Å; M602-G627 WeakPolarHBondContact SD-CA 3.22Å; M602-G627 PolarHBondContact SD-N 2.99Å
603	V	89.6	Confident	92.6	Very high	8 Å²	8	47.8 Å²	47.8	5%	0.048	22%	0.224	C	C	.	.			trans	-121.1	141.2	180	-61.6	0	0	0	0	110.3	Q577 G593 G594 I605	Q577-V603 HydrophobicContact CG-CG2 4.07Å; G593-V603 CarbonylContact C-O 3.6Å; G593-V603 WeakPolarHBondContact CA-O 3.43Å; G593-V603 WeakPolarHBondContact O-CG2 3.28Å; G594-V603 PolarHBondContact O-N 3.22Å; V603-I605 HydrophobicContact CB-CG2 4.07Å; V603-I605 HydrophobicContact CG2-CG2 3.91Å
604	E	89.7	Confident	92.8	Very high	73 Å²	73	51 Å²	51	34%	0.341	24%	0.241	S	C	.	.			trans	-90.9	-8.7	176.2	61.3	-78.2	179.3	0	0	112.7	V606 D621 L622 S625	E604-V606 PolarHBondContact O-N 3.33Å; E604-D621 HydrophobicContact CB-CB 4.33Å; E604-D621 HydrophobicContact CG-CB 3.77Å; E604-D621 CarbonylContact O-C 3.48Å; E604-D621 WeakPolarHBondContact O-CA 3.33Å; E604-L622 HydrophobicContact CB-CB 4.13Å; E604-L622 PolarHBondContact O-N 3.25Å; E604-S625 PolarHBondContact OE2-OG 3.46Å
605	I	91.6	Very high	93.1	Very high	11 Å²	11	55.4 Å²	55.4	6%	0.056	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	135.4	-172.2	-169.2	174.2	0	0	0	112.3	R575 Q577 G593 V603 Q607 K618	R575-I605 HydrophobicContact CG-CD1 4.47Å; Q577-I605 HydrophobicContact CG-CG2 4.5Å; Q577-I605 VanDerWaalsContact NE2-CG2 3.29Å; Q577-I605 PolarHBondContact NE2-O 3.22Å; Q577-I605 VanDerWaalsContact NE2-O 3.13Å; G593-I605 PolarHBondContact N-O 3.19Å; V603-I605 HydrophobicContact CB-CG2 4.07Å; V603-I605 HydrophobicContact CG2-CG2 3.91Å; I605-Q607 HydrophobicContact CD1-CG 3.87Å; I605-Q607 HydrophobicContact CG1-CG 4Å; I605-K618 HydrophobicContact CD1-CD 4.13Å; I605-K618 HydrophobicContact CD1-CG 4.16Å; I605-K618 HydrophobicContact CG1-CD 4.23Å; I605-K618 HydrophobicContact CG1-CG 4.08Å
606	V	93.5	Very high	93.4	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	117.2	164.9	-176.6	0	0	0	0	109.4	Y590 V591 V592 E604 V619 F620 L622	Y590-V606 HydrophobicContact CD1-CG1 4.04Å; V591-V606 WeakPolarHBondContact O-CA 3.48Å; V592-V606 HydrophobicContact CB-CG2 4.5Å; V592-V606 HydrophobicContact CG1-CG2 4.13Å; V592-V606 HydrophobicContact CG2-CG1 3.98Å; V592-V606 HydrophobicContact CG2-CG2 4.31Å; E604-V606 PolarHBondContact O-N 3.33Å; V606-V619 PolarHBondContact O-N 3.38Å; V606-F620 HydrophobicContact CB-CD2 3.93Å; V606-F620 HydrophobicContact CB-CE2 3.94Å; V606-F620 VanDerWaalsContact CB-O 3.22Å; V606-F620 WeakPolarHBondContact CB-O 3.42Å; V606-F620 HydrophobicContact CG1-CD2 4.38Å; V606-F620 HydrophobicContact CG1-CE2 3.91Å; V606-F620 HydrophobicContact CG1-CZ 4.28Å; V606-F620 HydrophobicContact CG2-CD2 3.76Å; V606-F620 HydrophobicContact CG2-CE2 3.73Å; V606-F620 PolarHBondContact N-O 3.34Å; V606-L622 HydrophobicContact CG2-CD2 4.49Å; V606-L622 HydrophobicContact CG2-CG 4.19Å
607	Q	95.6	Very high	93.6	Very high	0 Å²	0	59 Å²	59	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	139	176.8	-61.5	-173.4	75.7	0	0	109.7	L574 R575 Q577 Y590 V591 I605 W616 H617	L574-Q607 VanDerWaalsContact CB-OE1 3.22Å; R575-Q607 PolarHBondContact O-NE2 3.18Å; Q577-Q607 VanDerWaalsContact CD-NE2 3.32Å; Y590-Q607 CarbonylContact C-O 3.57Å; Y590-Q607 WeakPolarHBondContact CA-O 3.41Å; V591-Q607 HydrophobicContact CB-CB 4.49Å; V591-Q607 PolarHBondContact N-O 2.8Å; V591-Q607 PolarHBondContact O-N 2.95Å; I605-Q607 HydrophobicContact CD1-CG 3.87Å; I605-Q607 HydrophobicContact CG1-CG 4Å; Q607-W616 HydrophobicContact CB-CE3 3.85Å; Q607-W616 HydrophobicContact CB-CZ3 3.9Å; Q607-H617 CarbonylContact C-O 3.58Å; Q607-H617 WeakPolarHBondContact CA-O 3.48Å
608	K	96.6	Very high	93.7	Very high	41 Å²	41	62 Å²	62	18%	0.178	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	125.7	176.4	178.1	-173.4	78.7	-171.9	0	110	K588 I589 Y590 W616 H617 V619	K588-K608 HydrophobicContact CB-CD 4.17Å; K588-K608 HydrophobicContact CB-CG 3.93Å; K588-K608 HydrophobicContact CD-CD 3.78Å; K588-K608 HydrophobicContact CD-CG 4.32Å; I589-K608 CarbonylContact O-C 3.29Å; I589-K608 VanDerWaalsContact O-CA 3.26Å; I589-K608 WeakPolarHBondContact O-CA 3.29Å; Y590-K608 HydrophobicContact CD1-CB 4.31Å; Y590-K608 HydrophobicContact CD2-CG 4.38Å; Y590-K608 HydrophobicContact CE1-CB 4.21Å; Y590-K608 HydrophobicContact CE1-CD 3.96Å; Y590-K608 HydrophobicContact CE1-CG 4.18Å; Y590-K608 HydrophobicContact CE2-CD 3.97Å; Y590-K608 HydrophobicContact CE2-CG 3.98Å; Y590-K608 VanDerWaalsContact CZ-CD 3.5Å; Y590-K608 WeakPolarHBondContact OH-CD 3.49Å; K608-W616 CarbonylContact O-C 3.55Å; K608-W616 WeakPolarHBondContact O-CA 3.47Å; K608-H617 PolarHBondContact N-O 2.81Å; K608-H617 PolarHBondContact O-N 2.99Å; K608-V619 HydrophobicContact CB-CG2 3.26Å; K608-V619 HydrophobicContact CD-CG2 4.15Å; K608-V619 HydrophobicContact CG-CG2 4.33Å
609	Y	98.3	Very high	93.7	Very high	3 Å²	3	60.5 Å²	60.5	1%	0.012	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	133.5	170.6	178.8	-107.3	0	0	0	110.1	Y538 I570 A571 I589 P611 D614 E615 W616	Y538-Y609 HydrophobicContact CD1-CE1 4.12Å; Y538-Y609 AromaticContact CE1-CE1 3.7Å; Y538-Y609 HydrophobicContact CE1-CE1 3.7Å; I570-Y609 WeakPolarHBondContact CB-OH 3.27Å; I570-Y609 HydrophobicContact CD1-CE1 3.86Å; I570-Y609 HydrophobicContact CD1-CE2 4.02Å; I570-Y609 WeakPolarHBondContact CD1-OH 3.38Å; I570-Y609 WeakPolarHBondContact CG2-OH 3.16Å; A571-Y609 HydrophobicContact CB-CE2 4.41Å; I589-Y609 HydrophobicContact CD1-CD1 3.97Å; I589-Y609 PolarHBondContact N-O 2.71Å; I589-Y609 PolarHBondContact O-N 2.9Å; Y609-P611 HydrophobicContact CD1-CG 3.93Å; Y609-P611 HydrophobicContact CE1-CB 4.06Å; Y609-P611 HydrophobicContact CE1-CG 3.93Å; Y609-P611 WeakPolarHBondContact O-CD 3.27Å; Y609-D614 VanDerWaalsContact CE2-OD1 3.28Å; Y609-D614 WeakPolarHBondContact CE2-OD1 3.17Å; Y609-D614 PolarHBondContact OH-OD1 3.21Å; Y609-E615 WeakPolarHBondContact CA-O 3.38Å; Y609-W616 AromaticContact CD2-CD1 3.76Å; Y609-W616 AromaticContact CD2-CD2 3.92Å; Y609-W616 HydrophobicContact CD2-CD2 3.92Å; Y609-W616 AromaticContact CD2-CE2 3.57Å; Y609-W616 HydrophobicContact CD2-CG 4.05Å; Y609-W616 HydrophobicContact CD2-CZ2 4.07Å; Y609-W616 AromaticContact CD2-NE1 3.45Å; Y609-W616 AromaticContact CE2-NE1 3.99Å; Y609-W616 HydrophobicContact CG-CD2 4.31Å; Y609-W616 AromaticContact CG-CE2 3.97Å; Y609-W616 HydrophobicContact CG-CH2 4.44Å; Y609-W616 HydrophobicContact CG-CZ2 4.05Å
610	D	97.9	Very high	93.7	Very high	10 Å²	10	57.2 Å²	57.2	5%	0.053	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	104.9	173.2	-167.6	-37.9	0	0	0	109.5	K588 E612 K613 D614 E615	K588-D610 WeakPolarHBondContact CE-OD2 3.35Å; K588-D610 IonicContact NZ-OD2 2.8Å; D610-E612 PolarHBondContact O-N 3.41Å; D610-E612 PolarHBondContact OD1-N 3.02Å; D610-K613 HydrophobicContact CB-CB 4.36Å; D610-K613 PolarHBondContact O-N 2.85Å; D610-D614 PolarHBondContact O-N 3.22Å; D610-E615 PolarHBondContact N-O 2.69Å; D610-E615 PolarHBondContact O-N 2.74Å
611	P	97.4	Very high	93.7	Very high	22 Å²	22	51.3 Å²	51.3	14%	0.143	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-22.4	-178.5	-25.9	36.9	0	0	0	115.3	V533 N587 Y609	V533-P611 HydrophobicContact CG1-CG 4.27Å; N587-P611 WeakPolarHBondContact O-CD 3.26Å; Y609-P611 HydrophobicContact CD1-CG 3.93Å; Y609-P611 HydrophobicContact CE1-CB 4.06Å; Y609-P611 HydrophobicContact CE1-CG 3.93Å; Y609-P611 WeakPolarHBondContact O-CD 3.27Å
612	E	96.7	Very high	93.7	Very high	174 Å²	174	49.5 Å²	49.5	81%	0.813	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.8	-33	179.7	-62.8	-172.7	163.2	0	0	111.5	D610	D610-E612 PolarHBondContact O-N 3.41Å; D610-E612 PolarHBondContact OD1-N 3.02Å
613	K	97.4	Very high	93.5	Very high	132 Å²	132	51.7 Å²	51.7	57%	0.574	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.8	-15.9	-178	-62.1	-175.7	-179.6	-176.8	0	114	D610 E615	D610-K613 HydrophobicContact CB-CB 4.36Å; D610-K613 PolarHBondContact O-N 2.85Å; K613-E615 HydrophobicContact CB-CB 4.23Å; K613-E615 HydrophobicContact CB-CG 4.17Å
614	D	98	Very high	93.3	Very high	67 Å²	67	54.2 Å²	54.2	36%	0.358	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.9	48.8	-169.6	-168.3	28.1	0	0	0	112.5	I570 A571 Y609 D610	I570-D614 VanDerWaalsContact CB-OD1 3.26Å; I570-D614 WeakPolarHBondContact CB-OD1 2.94Å; A571-D614 WeakPolarHBondContact CB-O 3.45Å; A571-D614 WeakPolarHBondContact CB-OD1 3.47Å; A571-D614 PolarHBondContact N-OD1 2.77Å; A571-D614 PolarHBondContact N-OD2 2.63Å; Y609-D614 VanDerWaalsContact CE2-OD1 3.28Å; Y609-D614 WeakPolarHBondContact CE2-OD1 3.17Å; Y609-D614 PolarHBondContact OH-OD1 3.21Å; D610-D614 PolarHBondContact O-N 3.22Å
615	E	97.8	Very high	93.2	Very high	94 Å²	94	52.8 Å²	52.8	44%	0.439	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	142.1	-174	-73.4	177.3	169.5	0	0	113	Y609 D610 K613 H617	Y609-E615 WeakPolarHBondContact CA-O 3.38Å; D610-E615 PolarHBondContact N-O 2.69Å; D610-E615 PolarHBondContact O-N 2.74Å; K613-E615 HydrophobicContact CB-CB 4.23Å; K613-E615 HydrophobicContact CB-CG 4.17Å; E615-H617 IonicContact OE2-CE1 3.9Å
616	W	97.9	Very high	93	Very high	21 Å²	21	52.5 Å²	52.5	8%	0.08	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	139.9	174.3	-72.2	92.9	0	0	0	112.2	I540 A571 M573 L574 V591 Q607 K608 Y609	I540-W616 HydrophobicContact CD1-CH2 4.06Å; I540-W616 HydrophobicContact CD1-CZ2 4.36Å; I540-W616 HydrophobicContact CG1-CH2 4.44Å; I540-W616 HydrophobicContact CG1-CZ2 4.42Å; I540-W616 HydrophobicContact CG2-CH2 3.65Å; I540-W616 HydrophobicContact CG2-CZ2 3.99Å; A571-W616 PolarHBondContact O-NE1 3.11Å; M573-W616 HydrophobicContact CE-CH2 4.44Å; M573-W616 HydrophobicContact CG-CH2 4.2Å; M573-W616 HydrophobicContact CG-CZ2 3.87Å; L574-W616 HydrophobicContact CD1-CB 4.2Å; L574-W616 HydrophobicContact CD2-CB 4Å; L574-W616 HydrophobicContact CG-CB 3.74Å; V591-W616 HydrophobicContact CG2-CH2 3.82Å; V591-W616 HydrophobicContact CG2-CZ3 3.87Å; Q607-W616 HydrophobicContact CB-CE3 3.85Å; Q607-W616 HydrophobicContact CB-CZ3 3.9Å; K608-W616 CarbonylContact O-C 3.55Å; K608-W616 WeakPolarHBondContact O-CA 3.47Å; Y609-W616 AromaticContact CD2-CD1 3.76Å; Y609-W616 AromaticContact CD2-CD2 3.92Å; Y609-W616 HydrophobicContact CD2-CD2 3.92Å; Y609-W616 AromaticContact CD2-CE2 3.57Å; Y609-W616 HydrophobicContact CD2-CG 4.05Å; Y609-W616 HydrophobicContact CD2-CZ2 4.07Å; Y609-W616 AromaticContact CD2-NE1 3.45Å; Y609-W616 AromaticContact CE2-NE1 3.99Å; Y609-W616 HydrophobicContact CG-CD2 4.31Å; Y609-W616 AromaticContact CG-CE2 3.97Å; Y609-W616 HydrophobicContact CG-CH2 4.44Å; Y609-W616 HydrophobicContact CG-CZ2 4.05Å
617	H	96.4	Very high	92.6	Very high	76 Å²	76	52.5 Å²	52.5	35%	0.352	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	137.3	178.1	-62.1	77.7	0	0	0	110.1	Q607 K608 E615	Q607-H617 CarbonylContact C-O 3.58Å; Q607-H617 WeakPolarHBondContact CA-O 3.48Å; K608-H617 PolarHBondContact N-O 2.81Å; K608-H617 PolarHBondContact O-N 2.99Å; E615-H617 IonicContact OE2-CE1 3.9Å
618	K	94	Very high	92.3	Very high	116 Å²	116	52.5 Å²	52.5	50%	0.504	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	130.5	161.5	179.3	177.8	176	177.4	0	107.9	I605 D621	I605-K618 HydrophobicContact CD1-CD 4.13Å; I605-K618 HydrophobicContact CD1-CG 4.16Å; I605-K618 HydrophobicContact CG1-CD 4.23Å; I605-K618 HydrophobicContact CG1-CG 4.08Å; K618-D621 WeakPolarHBondContact CE-OD1 3.45Å; K618-D621 VanDerWaalsContact NZ-CG 3.29Å; K618-D621 IonicContact NZ-OD1 3.52Å; K618-D621 PolarHBondContact NZ-OD1 2.8Å; K618-D621 IonicContact NZ-OD2 2.78Å; K618-D621 PolarHBondContact NZ-OD2 2.81Å
619	V	88.9	Confident	92.1	Very high	54 Å²	54	50.7 Å²	50.7	33%	0.327	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	-65.2	-179.2	-159.8	0	0	0	0	111.3	Y590 V606 K608	Y590-V619 HydrophobicContact CE1-CG2 4.16Å; V606-V619 PolarHBondContact O-N 3.38Å; K608-V619 HydrophobicContact CB-CG2 3.26Å; K608-V619 HydrophobicContact CD-CG2 4.15Å; K608-V619 HydrophobicContact CG-CG2 4.33Å
620	F	86.3	Confident	91.9	Very high	32 Å²	32	52.4 Å²	52.4	14%	0.14	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.5	175.5	179.7	43.1	-104	0	0	0	109.4	L342 Y362 W369 V606	L342-F620 HydrophobicContact CD2-CE2 4.43Å; L342-F620 HydrophobicContact CD2-CZ 4.12Å; Y362-F620 AromaticContact CD1-CE1 3.9Å; Y362-F620 HydrophobicContact CD1-CE1 3.9Å; Y362-F620 AromaticContact CD1-CZ 3.8Å; Y362-F620 HydrophobicContact CD1-CZ 3.8Å; Y362-F620 HydrophobicContact CD2-CE1 4.34Å; Y362-F620 HydrophobicContact CD2-CE2 4.15Å; Y362-F620 HydrophobicContact CD2-CZ 4.01Å; Y362-F620 HydrophobicContact CE1-CD1 4.04Å; Y362-F620 AromaticContact CE1-CE1 3.33Å; Y362-F620 HydrophobicContact CE1-CE1 3.33Å; Y362-F620 AromaticContact CE1-CZ 3.73Å; Y362-F620 HydrophobicContact CE1-CZ 3.73Å; Y362-F620 AromaticContact CE2-CD1 3.93Å; Y362-F620 HydrophobicContact CE2-CD1 3.93Å; Y362-F620 HydrophobicContact CE2-CD2 4.27Å; Y362-F620 AromaticContact CE2-CE1 3.83Å; Y362-F620 HydrophobicContact CE2-CE1 3.83Å; Y362-F620 HydrophobicContact CE2-CE2 4.16Å; Y362-F620 HydrophobicContact CE2-CG 4.18Å; Y362-F620 AromaticContact CE2-CZ 3.95Å; Y362-F620 HydrophobicContact CE2-CZ 3.95Å; Y362-F620 HydrophobicContact CG-CE1 4.37Å; Y362-F620 HydrophobicContact CG-CE2 4.42Å; Y362-F620 AromaticContact CG-CZ 3.94Å; Y362-F620 HydrophobicContact CG-CZ 3.94Å; Y362-F620 AromaticContact CZ-CD1 3.51Å; Y362-F620 AromaticContact CZ-CE1 3.29Å; Y362-F620 AromaticContact CZ-CZ 3.81Å; Y362-F620 WeakPolarHBondContact OH-CD1 3.42Å; W369-F620 HydrophobicContact CZ2-CD2 4.42Å; W369-F620 AromaticContact CZ2-CE2 3.73Å; W369-F620 HydrophobicContact CZ2-CE2 3.73Å; V606-F620 HydrophobicContact CB-CD2 3.93Å; V606-F620 HydrophobicContact CB-CE2 3.94Å; V606-F620 VanDerWaalsContact CB-O 3.22Å; V606-F620 WeakPolarHBondContact CB-O 3.42Å; V606-F620 HydrophobicContact CG1-CD2 4.38Å; V606-F620 HydrophobicContact CG1-CE2 3.91Å; V606-F620 HydrophobicContact CG1-CZ 4.28Å; V606-F620 HydrophobicContact CG2-CD2 3.76Å; V606-F620 HydrophobicContact CG2-CE2 3.73Å; V606-F620 PolarHBondContact N-O 3.34Å
621	D	88.4	Confident	91.8	Very high	66 Å²	66	52.1 Å²	52.1	35%	0.353	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	146.9	176.3	-64.7	-38.6	0	0	0	109.9	E604 K618	E604-D621 HydrophobicContact CB-CB 4.33Å; E604-D621 HydrophobicContact CG-CB 3.77Å; E604-D621 CarbonylContact O-C 3.48Å; E604-D621 WeakPolarHBondContact O-CA 3.33Å; K618-D621 WeakPolarHBondContact CE-OD1 3.45Å; K618-D621 VanDerWaalsContact NZ-CG 3.29Å; K618-D621 IonicContact NZ-OD1 3.52Å; K618-D621 PolarHBondContact NZ-OD1 2.8Å; K618-D621 IonicContact NZ-OD2 2.78Å; K618-D621 PolarHBondContact NZ-OD2 2.81Å
622	L	87.2	Confident	91.8	Very high	11 Å²	11	51.8 Å²	51.8	6%	0.058	26%	0.257	C	S	.	.			trans	-66.3	154.1	168.5	-72.6	172.6	0	0	0	110.1	T344 W369 V592 E604 V606 E624 I629	T344-L622 HydrophobicContact CG2-CD2 4.39Å; W369-L622 HydrophobicContact CH2-CD2 4.1Å; W369-L622 HydrophobicContact CZ2-CD2 3.5Å; V592-L622 HydrophobicContact CG1-CD1 3.7Å; V592-L622 HydrophobicContact CG1-CD2 3.71Å; V592-L622 HydrophobicContact CG1-CG 3.95Å; E604-L622 HydrophobicContact CB-CB 4.13Å; E604-L622 PolarHBondContact O-N 3.25Å; V606-L622 HydrophobicContact CG2-CD2 4.49Å; V606-L622 HydrophobicContact CG2-CG 4.19Å; L622-E624 WeakPolarHBondContact CB-O 3.44Å; L622-E624 PolarHBondContact O-N 3.38Å; L622-I629 HydrophobicContact CD1-CD1 3.78Å; L622-I629 HydrophobicContact CD2-CD1 4.3Å
623	P	84.5	Confident	91.8	Very high	75 Å²	75	45.6 Å²	45.6	49%	0.487	23%	0.231	S	C	.	.	S	Bend	trans	-60.7	-27.9	174.5	-21.9	33.2	0	0	0	113	W369	W369-P623 HydrophobicContact CB-CG 3.98Å; W369-P623 HydrophobicContact CG-CG 3.91Å
624	E	85.5	Confident	91.7	Very high	61 Å²	61	39.3 Å²	39.3	29%	0.285	20%	0.204	S	C	.	.	S	Bend	trans	-139.1	142.9	-178	-69.8	161.4	-131.1	0	0	110.2	L349 R360 L622 L626	L349-E624 HydrophobicContact CD2-CB 4.44Å; L349-E624 HydrophobicContact CD2-CG 4.48Å; R360-E624 IonicContact CZ-OE1 2.83Å; R360-E624 IonicContact NH1-OE1 3.88Å; R360-E624 PolarHBondContact NH1-OE1 2.79Å; R360-E624 IonicContact NH2-OE1 3.37Å; R360-E624 PolarHBondContact NH2-OE1 3.01Å; L622-E624 WeakPolarHBondContact CB-O 3.44Å; L622-E624 PolarHBondContact O-N 3.38Å; E624-L626 HydrophobicContact CB-CD1 4.27Å; E624-L626 HydrophobicContact CB-CG 4.09Å; E624-L626 PolarHBondContact O-N 2.54Å; E624-L626 VanDerWaalsContact O-N 3.13Å
625	S	86.6	Confident	91.6	Very high	42 Å²	42	37.4 Å²	37.4	29%	0.294	20%	0.195	S	C	.	.			trans	-79.1	94.3	175.8	-38.5	0	0	0	0	109.8	M602 E604	M602-S625 VanDerWaalsContact CB-O 3.29Å; M602-S625 WeakPolarHBondContact CB-O 3.5Å; E604-S625 PolarHBondContact OE2-OG 3.46Å
626	L	87.2	Confident	91.3	Very high	5 Å²	5	33 Å²	33	3%	0.026	17%	0.174	C	C	.	.			trans	-109.3	129.5	-174.3	-70.5	165.7	0	0	0	111.7	L349 G594 E624 I629	L349-L626 HydrophobicContact CD1-CD2 3.36Å; L349-L626 HydrophobicContact CG-CD2 3.67Å; G594-L626 PolarHBondContact N-O 2.85Å; E624-L626 HydrophobicContact CB-CD1 4.27Å; E624-L626 HydrophobicContact CB-CG 4.09Å; E624-L626 PolarHBondContact O-N 2.54Å; E624-L626 VanDerWaalsContact O-N 3.13Å; L626-I629 HydrophobicContact CB-CB 4.26Å; L626-I629 HydrophobicContact CB-CD1 4.36Å; L626-I629 HydrophobicContact CD1-CD1 4.08Å
627	G	86.9	Confident	90.6	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.191	C	C	.	.	B	Isolated β-bridge	trans	-91.2	145.7	167.5	0	0	0	0	0	111.8	G347 V348 M602 I629	G347-G627 CarbonylContact C-O 3.58Å; G347-G627 WeakPolarHBondContact CA-O 3.41Å; V348-G627 PolarHBondContact N-O 3.4Å; V348-G627 PolarHBondContact O-N 3.05Å; M602-G627 WeakPolarHBondContact SD-CA 3.22Å; M602-G627 PolarHBondContact SD-N 2.99Å; G627-I629 PolarHBondContact O-N 2.64Å
628	G	87.9	Confident	89.7	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.192	C	C	.	.	S	Bend	trans	66.8	21.5	178.4	0	0	0	0	0	114	D579	D579-G628 VanDerWaalsContact CG-N 3.32Å; D579-G628 WeakPolarHBondContact O-CA 3.18Å; D579-G628 PolarHBondContact O-N 2.87Å; D579-G628 VanDerWaalsContact OD1-CA 3.27Å; D579-G628 WeakPolarHBondContact OD1-CA 3.25Å; D579-G628 WeakPolarHBondContact OD2-CA 3.5Å; D579-G628 PolarHBondContact OD2-N 2.86Å
629	I	92	Very high	88.8	Confident	3 Å²	3	32.5 Å²	32.5	2%	0.015	18%	0.182	C	C	.	.			trans	-63.7	146.8	166	-165.3	169.1	0	0	0	108.5	T344 V580 G581 V592 L622 L626 G627	T344-I629 HydrophobicContact CG2-CD1 4.08Å; V580-I629 CarbonylContact C-O 3.58Å; V580-I629 VanDerWaalsContact C-O 3.29Å; G581-I629 WeakPolarHBondContact CA-O 3.29Å; G581-I629 PolarHBondContact N-O 3.32Å; V592-I629 HydrophobicContact CG1-CD1 4.37Å; V592-I629 HydrophobicContact CG1-CG2 4.44Å; V592-I629 WeakPolarHBondContact O-CG2 3.22Å; L622-I629 HydrophobicContact CD1-CD1 3.78Å; L622-I629 HydrophobicContact CD2-CD1 4.3Å; L626-I629 HydrophobicContact CB-CB 4.26Å; L626-I629 HydrophobicContact CB-CD1 4.36Å; L626-I629 HydrophobicContact CD1-CD1 4.08Å; G627-I629 PolarHBondContact O-N 2.64Å
630	R	95.1	Very high	87.7	Confident	39 Å²	39	37 Å²	37	15%	0.147	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	148.1	172.9	-62.6	-60.3	-174.8	-125.1	-2.2	109.7	T344 L345 Q381 H382 I384 D579 V580	T344-R630 CarbonylContact C-O 3.51Å; T344-R630 VanDerWaalsContact CA-O 3.25Å; T344-R630 WeakPolarHBondContact CA-O 3.23Å; L345-R630 PolarHBondContact N-O 3.26Å; L345-R630 PolarHBondContact O-N 3.19Å; Q381-R630 VanDerWaalsContact OE1-NH2 3.09Å; H382-R630 WeakPolarHBondContact NE2-CG 3.21Å; H382-R630 PolarHBondContact O-NE 3.13Å; I384-R630 HydrophobicContact CB-CB 4.43Å; I384-R630 HydrophobicContact CD1-CB 3.57Å; I384-R630 HydrophobicContact CG1-CB 3.8Å; I384-R630 HydrophobicContact CG1-CG 4.32Å; I384-R630 HydrophobicContact CG2-CB 3.78Å; I384-R630 HydrophobicContact CG2-CG 4.12Å; D579-R630 IonicContact OD1-CZ 3.72Å; D579-R630 IonicContact OD1-NH1 2.68Å; D579-R630 PolarHBondContact OD1-NH1 2.86Å; D579-R630 VanDerWaalsContact OD1-NH1 3.09Å; D579-R630 IonicContact OD1-NH2 3.72Å; V580-R630 PolarHBondContact O-NH1 2.78Å
631	A	95.9	Very high	85.9	Confident	5 Å²	5	41.3 Å²	41.3	4%	0.041	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	144	-178	0	0	0	0	0	110.8	L342 V343 T344 I384 A583 V592	L342-A631 HydrophobicContact CD1-CB 4.38Å; V343-A631 CarbonylContact O-C 3.51Å; V343-A631 WeakPolarHBondContact O-CA 3.34Å; T344-A631 HydrophobicContact CG2-CB 4.23Å; I384-A631 VanDerWaalsContact CD1-O 3.23Å; I384-A631 WeakPolarHBondContact CD1-O 3.42Å; A583-A631 HydrophobicContact CB-CB 4.13Å; V592-A631 HydrophobicContact CB-CB 4.31Å; V592-A631 HydrophobicContact CG2-CB 4.15Å
632	C	97.1	Very high	83.3	Confident	15 Å²	15	42.6 Å²	42.6	10%	0.101	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	-178.1	173	62.2	0	0	0	0	109.9	V343 I384 V386	V343-C632 PolarHBondContact N-O 2.99Å; V343-C632 PolarHBondContact O-N 2.93Å; I384-C632 HydrophobicContact CD1-CB 3.92Å; V386-C632 HydrophobicContact CG2-CB 4.16Å
633	T	96.4	Very high	80.4	Confident	43 Å²	43	47.1 Å²	47.1	26%	0.264	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	134.5	171.5	54.7	0	0	0	0	110.3	T340 H341 A583 V584 F585	T340-T633 HydrophobicContact CG2-CG2 4.49Å; H341-T633 VanDerWaalsContact O-CA 3.27Å; H341-T633 WeakPolarHBondContact O-CA 3.44Å; A583-T633 HydrophobicContact CB-CG2 4.41Å; V584-T633 WeakPolarHBondContact O-CG2 3.37Å; F585-T633 HydrophobicContact CB-CG2 3.9Å; F585-T633 HydrophobicContact CD2-CG2 3.76Å; F585-T633 HydrophobicContact CG-CG2 4.3Å
634	L	96.3	Very high	77.7	Confident	1 Å²	1	49 Å²	49	1%	0.005	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	145.6	175.1	-65.5	174.6	0	0	0	110.9	H341 V343 V386 L391 F414 V636	H341-L634 PolarHBondContact N-O 2.91Å; H341-L634 PolarHBondContact O-N 3.16Å; V343-L634 HydrophobicContact CB-CD1 4.37Å; V343-L634 HydrophobicContact CG1-CD1 4.25Å; V343-L634 HydrophobicContact CG2-CB 4Å; V343-L634 HydrophobicContact CG2-CD1 4.17Å; V343-L634 HydrophobicContact CG2-CG 4.29Å; V386-L634 HydrophobicContact CG1-CD2 3.84Å; V386-L634 HydrophobicContact CG2-CD2 3.83Å; L391-L634 HydrophobicContact CB-CD1 3.85Å; L391-L634 HydrophobicContact CB-CD2 4.24Å; L391-L634 HydrophobicContact CD2-CD1 4.17Å; F414-L634 HydrophobicContact CD1-CD1 4.27Å; L634-V636 HydrophobicContact CB-CG1 4.06Å
635	T	94.6	Very high	75.1	Confident	27 Å²	27	50.7 Å²	50.7	17%	0.166	31%	0.307	C	S	.	.			trans	-84	116.9	160.7	-55.1	0	0	0	0	107.4	I335 T340 N389 P416	I335-T635 HydrophobicContact CB-CG2 3.96Å; I335-T635 VanDerWaalsContact CD1-O 3.31Å; I335-T635 WeakPolarHBondContact CD1-O 3.47Å; I335-T635 HydrophobicContact CG2-CG2 3.87Å; T340-T635 PolarHBondContact OG1-OG1 3.44Å; N389-T635 PolarHBondContact ND2-O 3.49Å; N389-T635 PolarHBondContact OD1-N 3.19Å; P416-T635 WeakPolarHBondContact CB-O 3.44Å
636	V	91.5	Very high	72.4	Confident	2 Å²	2	54.5 Å²	54.5	1%	0.012	33%	0.33	C	S	.	.			trans	-132.1	152.2	-179.9	-73.7	0	0	0	0	108.9	H341 M361 L372 F414 P416 L634 P638	H341-V636 HydrophobicContact CB-CG2 4.39Å; M361-V636 HydrophobicContact CB-CG2 4.48Å; M361-V636 HydrophobicContact CE-CG2 3.53Å; M361-V636 HydrophobicContact SD-CG2 3.64Å; L372-V636 HydrophobicContact CD1-CG1 4.11Å; F414-V636 HydrophobicContact CE1-CG1 4.28Å; P416-V636 HydrophobicContact CB-CB 4.37Å; P416-V636 HydrophobicContact CB-CG1 3.44Å; P416-V636 VanDerWaalsContact CB-CG1 3.44Å; L634-V636 HydrophobicContact CB-CG1 4.06Å; V636-P638 WeakPolarHBondContact O-CD 3.32Å
637	F	84.3	Confident	69.8	Low	98 Å²	98	58 Å²	58	43%	0.43	36%	0.355	S	S	.	.	P	Polyproline II helix	trans	-73.5	120.3	163.8	-68.6	-65.6	0	0	0	108.1	I335	I335-F637 HydrophobicContact CD1-CE2 4.49Å; I335-F637 HydrophobicContact CG1-CE2 4.19Å; I335-F637 HydrophobicContact CG2-CD1 4.21Å; I335-F637 HydrophobicContact CG2-CD2 4.36Å; I335-F637 HydrophobicContact CG2-CE1 3.73Å; I335-F637 HydrophobicContact CG2-CE2 3.9Å; I335-F637 HydrophobicContact CG2-CZ 3.58Å
638	P	76.8	Confident	67.5	Low	59 Å²	59	70.4 Å²	70.4	38%	0.383	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-58.6	134.2	174.9	-20	31.5	0	0	0	108.8	M361 V636 E640	M361-P638 HydrophobicContact CE-CB 4.32Å; M361-P638 HydrophobicContact CE-CG 4.34Å; M361-P638 HydrophobicContact SD-CB 4.5Å; V636-P638 WeakPolarHBondContact O-CD 3.32Å; P638-E640 PolarHBondContact O-N 3.49Å
639	P	75.4	Confident	64.7	Low	45 Å²	45	77.3 Å²	77.3	29%	0.292	44%	0.435	S	S	.	.	P	Polyproline II helix	trans	-57.8	135.3	173.6	20.2	-27.4	0	0	0	109.2	K370	K370-P639 HydrophobicContact CB-CG 4.16Å; K370-P639 HydrophobicContact CD-CG 4.47Å
640	E	65.4	Low	61.9	Low	148 Å²	148	80.9 Å²	80.9	69%	0.692	46%	0.46	S	S	*	.	P	Polyproline II helix	trans	-58.2	141.2	174.7	-67.7	-173.8	170.4	0	0	109.3	P638 S642	P638-E640 PolarHBondContact O-N 3.49Å; E640-S642 PolarHBondContact O-N 3.46Å
641	S	48.6	Very low	59	Low	123 Å²	123	84.2 Å²	84.2	86%	0.86	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	29.3	-178.1	56.2	0	0	0	0	113.8
642	S	33.7	Very low	56.4	Low	92 Å²	92	91 Å²	91	64%	0.643	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.9	3.6	-174.6	57.2	0	0	0	0	114.3	E640	E640-S642 PolarHBondContact O-N 3.46Å
643	T	27.3	Very low	53.2	Low	107 Å²	107	94.8 Å²	94.8	66%	0.656	55%	0.548	S	S	*	.	S	Bend	trans	-110.9	119.6	158.3	46.4	0	0	0	0	108.3	S645	T643-S645 PolarHBondContact O-N 2.85Å
644	P	27.5	Very low	50.2	Low	114 Å²	114	97 Å²	97	74%	0.74	57%	0.57	S	S	*	*			trans	-52.6	134.8	161.4	25.6	-30.6	0	0	0	105.8	P646	P644-P646 VanDerWaalsContact O-N 3.15Å
645	S	30.2	Very low	47.4	Very low	96 Å²	96	106.8 Å²	106.8	67%	0.671	63%	0.634	S	S	*	*			trans	-38.9	129.4	158.9	50.7	0	0	0	0	106.5	T643 S647	T643-S645 PolarHBondContact O-N 2.85Å; S645-S647 PolarHBondContact O-N 3.16Å
646	P	30.8	Very low	45	Very low	122 Å²	122	110.8 Å²	110.8	79%	0.792	66%	0.657	S	S	*	*			trans	-49.3	121.1	164.1	22.6	-29.5	0	0	0	103.9	P644 R648	P644-P646 VanDerWaalsContact O-N 3.15Å; P646-R648 PolarHBondContact O-N 3.03Å
647	S	33.3	Very low	42.6	Very low	78 Å²	78	116.5 Å²	116.5	55%	0.545	69%	0.691	S	S	.	*			trans	-40.1	146.1	173.4	39.4	0	0	0	0	107.9	S645 E649	S645-S647 PolarHBondContact O-N 3.16Å; S647-E649 PolarHBondContact O-N 3.42Å
648	R	37.9	Very low	40.2	Very low	261 Å²	261	117.5 Å²	117.5	99%	0.985	71%	0.706	S	S	*	*	S	Bend	trans	-40.7	53.8	172.3	-139.1	176.1	161	-161.7	-5.5	114.7	P646 S650	P646-R648 PolarHBondContact O-N 3.03Å; R648-S650 PolarHBondContact O-N 3.42Å
649	E	29.3	Very low	38.1	Very low	146 Å²	146	120.9 Å²	120.9	68%	0.682	73%	0.725	S	S	*	*			trans	-86.3	106.4	172.9	-73.4	-167.2	170.7	0	0	103.9	S647	S647-E649 PolarHBondContact O-N 3.42Å
650	S	33.7	Very low	35.8	Very low	78 Å²	78	125.7 Å²	125.7	55%	0.545	75%	0.752	S	S	.	*			trans	-37.1	147.4	160.4	-70.4	0	0	0	0	109.9	R648 L652	R648-S650 PolarHBondContact O-N 3.42Å; S650-L652 PolarHBondContact O-N 2.69Å
651	P	33.2	Very low	33.8	Very low	108 Å²	108	124.2 Å²	124.2	70%	0.701	76%	0.756	S	S	*	*	S	Bend	trans	-66.9	27.9	174.1	28.3	-33.7	0	0	0	113.6
652	L	41.4	Very low	32.7	Very low	148 Å²	148	124.3 Å²	124.3	78%	0.775	75%	0.748	S	S	*	*			trans	-117.9	74	-178.4	-69.9	168.8	0	0	0	109.5	S650	S650-L652 PolarHBondContact O-N 2.69Å
653	S	29	Very low	32.6	Very low	95 Å²	95	126.8 Å²	126.8	66%	0.664	76%	0.756	S	S	*	*			trans	-157.8	73.6	156.6	45	0	0	0	0	109.4
654	A	34	Very low	33.1	Very low	89 Å²	89	128.4 Å²	128.4	74%	0.736	77%	0.765	S	S	*	*			trans	-109.5	145.9	144.5	0	0	0	0	0	107
655	P	37	Very low	33.6	Very low	206 Å²	206	129.7 Å²	129.7	100%	1.338	77%	0.767	S	S	*	*			trans	-62.5	0	174.7	27.6	-33.1	0	0	0	112.3

Retrieved 655 of 655 residues in 190.4 ms (Link to these results)

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