A0A087X6X8_POEFO Loading...

dual-specificity kinase

AlphaFold DB , UniProt , Accession A0A087X6X8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 590 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	39.5	Very low	37.6	Very low	239 Å²	239	148 Å²	148	100%	1.177	85%	0.854	S	S	*	*				0	171.2	0	-77.9	-174.8	169.4	0	0	108.9
2	L	33.1	Very low	38.7	Very low	160 Å²	160	144.8 Å²	144.8	84%	0.838	84%	0.842	S	S	*	*			trans	70.4	116.6	-164.1	-51.1	165.2	0	0	0	111.1
3	T	37.8	Very low	38.4	Very low	116 Å²	116	144.5 Å²	144.5	71%	0.712	84%	0.844	S	S	*	*			cis	73.7	134	39.5	77.4	0	0	0	0	113.7
4	K	34.3	Very low	37.9	Very low	200 Å²	200	139.5 Å²	139.5	87%	0.87	84%	0.839	S	S	*	*			cis	-154.3	167.8	10	-132.6	169.3	-175.9	179.7	0	111.4
5	K	44	Very low	37.6	Very low	191 Å²	191	143.9 Å²	143.9	83%	0.83	84%	0.842	S	S	*	*			trans	-122.6	-178.3	170.8	-123.3	-176.6	-177.7	-177.9	0	107.1
6	P	60.4	Low	37.3	Very low	121 Å²	121	143.1 Å²	143.1	79%	0.786	85%	0.847	S	S	*	*			cis	-133.7	-163.7	-14	40.7	-22.1	0	0	0	113
7	G	29	Very low	36.8	Very low	77 Å²	77	139.2 Å²	139.2	79%	0.794	84%	0.844	S	S	*	*			trans	-174.3	124.8	158.3	0	0	0	0	0	111.9
8	A	35.5	Very low	36.6	Very low	106 Å²	106	140.8 Å²	140.8	88%	0.876	84%	0.841	S	S	*	*			trans	-163.7	142.6	-178.9	0	0	0	0	0	113.8
9	S	30.9	Very low	37.2	Very low	117 Å²	117	139.6 Å²	139.6	82%	0.818	84%	0.836	S	S	*	*			trans	-175.9	161.7	170.7	51.4	0	0	0	0	109.7
10	V	34.8	Very low	36.9	Very low	143 Å²	143	138.2 Å²	138.2	87%	0.867	83%	0.828	S	S	*	*			cis	-169.5	153.7	-48.1	132	0	0	0	0	106.5
11	L	34.5	Very low	36.4	Very low	158 Å²	158	137.3 Å²	137.3	83%	0.827	83%	0.827	S	S	*	*			trans	-74.4	162.3	-178.1	-77.7	158.2	0	0	0	113.1
12	P	50.2	Low	36.2	Very low	110 Å²	110	131 Å²	131	71%	0.714	81%	0.807	S	S	*	*				-157.1	152.9	90	42	-22	0	0	0	120
13	T	35.6	Very low	36.8	Very low	140 Å²	140	129.2 Å²	129.2	86%	0.859	81%	0.805	S	S	*	*			trans	32.7	139.8	140.8	64	0	0	0	0	125.2
14	G	30.6	Very low	36.4	Very low	75 Å²	75	126.9 Å²	126.9	77%	0.773	80%	0.804	S	S	*	*			trans	-167.1	159.4	158.1	0	0	0	0	0	113.3
15	K	34.4	Very low	36.4	Very low	206 Å²	206	126.1 Å²	126.1	90%	0.896	80%	0.803	S	S	*	*			trans	-146.2	167.2	-176.2	-92.6	-170	178.2	-177.1	0	113.4
16	S	32.1	Very low	35.7	Very low	131 Å²	131	123.1 Å²	123.1	92%	0.916	81%	0.806	S	S	*	*			trans	74.7	152.3	167.1	73.7	0	0	0	0	117.2
17	G	28.6	Very low	34.2	Very low	77 Å²	77	120.6 Å²	120.6	79%	0.794	80%	0.802	S	S	*	*			cis	-165.5	178.5	1	0	0	0	0	0	114.1
18	E	33.8	Very low	34.1	Very low	168 Å²	168	122.4 Å²	122.4	79%	0.785	80%	0.803	S	S	*	*			trans	-83.4	167.3	175.8	-129.9	-171	-108.9	0	0	111.4	V20	E18-V20 WeakPolarHBondContact OE2-CG2 3.39Å
19	P	47.3	Very low	33.9	Very low	117 Å²	117	125.8 Å²	125.8	76%	0.76	80%	0.8	S	S	*	*				-153.4	155.4	68.2	40.5	-19.7	0	0	0	119.7
20	V	31.9	Very low	33.7	Very low	112 Å²	112	125.9 Å²	125.9	68%	0.679	80%	0.796	S	S	*	*				23.9	126.6	128.7	-171.5	0	0	0	0	120.6	E18	E18-V20 WeakPolarHBondContact OE2-CG2 3.39Å
21	C	26.1	Very low	33.5	Very low	119 Å²	119	124.7 Å²	124.7	80%	0.804	79%	0.789	S	S	*	*				179.5	151.7	101.4	-145.7	0	0	0	0	115.9
22	S	34.8	Very low	33.5	Very low	108 Å²	108	122.6 Å²	122.6	76%	0.755	79%	0.788	S	S	*	*			trans	-124.8	162.4	167.6	-52	0	0	0	0	109.1
23	P	45.7	Very low	33.1	Very low	121 Å²	121	123 Å²	123	79%	0.786	79%	0.79	S	S	*	*				-147.9	-176.2	87.5	35.2	-14.8	0	0	0	112
24	G	30.8	Very low	32.9	Very low	67 Å²	67	122.7 Å²	122.7	69%	0.691	79%	0.788	S	S	*	*			cis	159.6	-178.5	7.7	0	0	0	0	0	108.1
25	H	32.8	Very low	32.8	Very low	185 Å²	185	123.6 Å²	123.6	86%	0.856	79%	0.788	S	S	*	*			cis	-164.3	123	-17.7	-110.8	-63	0	0	0	109.3
26	S	30.3	Very low	32.6	Very low	128 Å²	128	121.7 Å²	121.7	90%	0.895	79%	0.787	S	S	*	*			trans	-163.2	170.3	171.7	63.2	0	0	0	0	109.7
27	G	27.5	Very low	32.8	Very low	67 Å²	67	120.7 Å²	120.7	69%	0.691	78%	0.777	S	S	*	*			cis	-160.1	-114.5	1.4	0	0	0	0	0	112.1
28	S	28.8	Very low	33	Very low	116 Å²	116	123 Å²	123	81%	0.811	78%	0.778	S	S	*	*			trans	-92	139.7	-175.5	58.2	0	0	0	0	112.4
29	Q	29.4	Very low	32.8	Very low	176 Å²	176	123.5 Å²	123.5	82%	0.822	79%	0.785	S	S	*	*			cis	66.1	128.5	44.4	-61.6	-161.4	22.5	0	0	112.9
30	T	28.2	Very low	31.9	Very low	119 Å²	119	129.3 Å²	129.3	73%	0.73	79%	0.792	S	S	*	*			cis	-137.5	-172.8	-3.3	47.1	0	0	0	0	108.6
31	T	29.1	Very low	31.7	Very low	119 Å²	119	131.1 Å²	131.1	73%	0.73	80%	0.798	S	S	*	*			cis	-159.5	169.6	11	-20.1	0	0	0	0	110.5
32	S	35.1	Very low	31.8	Very low	113 Å²	113	132.5 Å²	132.5	79%	0.79	80%	0.798	S	S	*	*			trans	-160.4	144.4	156	-75.3	0	0	0	0	109.5
33	P	42.3	Very low	31.5	Very low	119 Å²	119	134 Å²	134	77%	0.773	80%	0.797	S	S	*	*				-141.3	176.7	98.1	42.1	-26.9	0	0	0	111.6
34	V	30.6	Very low	30.8	Very low	133 Å²	133	136.8 Å²	136.8	81%	0.806	80%	0.799	S	S	*	*				-147.5	145.2	65	168.2	0	0	0	0	111.1
35	A	29.1	Very low	30.7	Very low	94 Å²	94	140.4 Å²	140.4	78%	0.777	80%	0.803	S	S	*	*			trans	-116	156.4	171.6	0	0	0	0	0	111.4
36	L	30.2	Very low	30.9	Very low	167 Å²	167	137.5 Å²	137.5	87%	0.874	80%	0.8	S	S	*	*			trans	-109.2	150.9	176.4	-73.7	171.1	0	0	0	111.5
37	P	35.5	Very low	30.8	Very low	110 Å²	110	138.5 Å²	138.5	71%	0.714	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-85.5	160.1	-164.7	33.8	-37.4	0	0	0	114.8
38	P	34	Very low	30.8	Very low	125 Å²	125	142.4 Å²	142.4	81%	0.812	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-78	148.8	175.7	32.9	-35.4	0	0	0	112.8
39	L	29.3	Very low	30.7	Very low	179 Å²	179	140.8 Å²	140.8	94%	0.937	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-83.4	147.9	174.7	-78.3	168	0	0	0	112.5
40	R	28.3	Very low	30.5	Very low	238 Å²	238	136 Å²	136	90%	0.898	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-75.4	144.3	-177	-90.5	-179.5	168.1	169.4	-5	113.1
41	N	26.9	Very low	30.4	Very low	150 Å²	150	136.3 Å²	136.3	80%	0.802	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-67.3	143.5	156.6	-136.2	17.7	0	0	0	109.5
42	N	29.8	Very low	30.5	Very low	149 Å²	149	140.3 Å²	140.3	80%	0.797	82%	0.819	S	S	*	*			trans	-148.5	123.3	166.6	-142.9	31.3	0	0	0	110.9
43	N	27.7	Very low	30.3	Very low	139 Å²	139	141.2 Å²	141.2	74%	0.743	82%	0.822	S	S	*	*			trans	-84.7	134.9	178.1	-79	-20.6	0	0	0	110.7
44	H	31.3	Very low	29.5	Very low	179 Å²	179	140 Å²	140	83%	0.829	82%	0.822	S	S	*	*			trans	-155.1	119.2	145.9	-95.8	-65.6	0	0	0	111.3
45	N	29.2	Very low	29.2	Very low	143 Å²	143	142 Å²	142	77%	0.765	83%	0.825	S	S	*	*			trans	-85.7	155.4	156.1	-97.2	-6.1	0	0	0	108.6
46	P	35.2	Very low	29	Very low	124 Å²	124	142.4 Å²	142.4	81%	0.805	82%	0.822	S	S	*	*				-127.1	167.6	99.5	37	-32.1	0	0	0	113.9
47	L	28.2	Very low	28.7	Very low	149 Å²	149	141.7 Å²	141.7	78%	0.78	82%	0.819	S	S	*	*			trans	-84.3	152.3	-175.9	-54.5	89.1	0	0	0	112.5
48	T	28.8	Very low	28.1	Very low	149 Å²	149	143.8 Å²	143.8	91%	0.914	82%	0.824	S	S	*	*				-173.2	156	127.3	17.7	0	0	0	0	111.9
49	G	26	Very low	27.6	Very low	82 Å²	82	145 Å²	145	85%	0.845	82%	0.822	S	S	*	*			trans	67.7	93.5	155.6	0	0	0	0	0	118.4
50	G	24.6	Very low	27.3	Very low	75 Å²	75	145.4 Å²	145.4	77%	0.773	82%	0.819	S	S	*	*			trans	-94.7	149.7	170.9	0	0	0	0	0	114.7
51	S	27.4	Very low	27.1	Very low	126 Å²	126	140.2 Å²	140.2	88%	0.881	81%	0.814	S	S	*	*			trans	-159.9	132.8	156.8	-81.6	0	0	0	0	110.1
52	K	30.5	Very low	27	Very low	204 Å²	204	138.3 Å²	138.3	89%	0.887	81%	0.812	S	S	*	*			trans	-84.3	149.8	170.5	-68.4	-179.3	178.4	178.1	0	109.8
53	P	31.1	Very low	26.8	Very low	131 Å²	131	136.1 Å²	136.1	85%	0.851	81%	0.809	S	S	*	*				-131.9	-178.2	112.1	30.5	-17	0	0	0	113.1
54	A	25.6	Very low	26.9	Very low	93 Å²	93	135 Å²	135	77%	0.769	80%	0.799	S	S	*	*			trans	-87.6	165	-168.5	0	0	0	0	0	114.6
55	M	25.3	Very low	26.7	Very low	177 Å²	177	131.6 Å²	131.6	87%	0.872	80%	0.796	S	S	*	*			trans	-61.8	147.7	170.4	-71.8	170.4	155.5	0	0	111.9
56	S	24.8	Very low	26.5	Very low	102 Å²	102	132.5 Å²	132.5	71%	0.713	80%	0.795	S	S	*	*			trans	-157.8	90	169.7	-76.7	0	0	0	0	109.9	N58	S56-N58 VanDerWaalsContact C-N 3.32Å; S56-N58 PolarHBondContact O-N 3.21Å
57	D	23.1	Very low	26.1	Very low	152 Å²	152	130.6 Å²	130.6	81%	0.813	78%	0.781	S	S	*	*			trans	-71.7	78.8	-178.9	-74.9	-41.7	0	0	0	112.6	I59	D57-I59 PolarHBondContact O-N 3.37Å
58	N	22.3	Very low	25.9	Very low	153 Å²	153	132 Å²	132	82%	0.818	78%	0.783	S	S	*	*			trans	-75.8	86.4	169.9	-96.1	-33.7	0	0	0	110.8	S56 Q60	S56-N58 VanDerWaalsContact C-N 3.32Å; S56-N58 PolarHBondContact O-N 3.21Å; N58-Q60 PolarHBondContact O-N 3.44Å
59	I	24	Very low	26	Very low	150 Å²	150	127.9 Å²	127.9	77%	0.769	76%	0.755	S	S	*	*			trans	-66.1	98.5	168.3	-61.2	179.3	0	0	0	108.7	D57 V61	D57-I59 PolarHBondContact O-N 3.37Å; I59-V61 HydrophobicContact CG2-CG2 4.45Å; I59-V61 PolarHBondContact O-N 3.1Å
60	Q	23.2	Very low	26.1	Very low	188 Å²	188	129.9 Å²	129.9	88%	0.879	75%	0.751	S	S	*	*			trans	-75.9	87	-175.1	-160.4	173.2	20.1	0	0	111	N58 S62	N58-Q60 PolarHBondContact O-N 3.44Å; Q60-S62 PolarHBondContact O-N 2.97Å; Q60-S62 VanDerWaalsContact O-N 3.1Å
61	V	24.9	Very low	26.3	Very low	130 Å²	130	130.6 Å²	130.6	79%	0.788	73%	0.734	S	S	*	*			trans	-66.5	107.8	178.8	179.9	0	0	0	0	110.1	I59	I59-V61 HydrophobicContact CG2-CG2 4.45Å; I59-V61 PolarHBondContact O-N 3.1Å
62	S	24.4	Very low	26.3	Very low	109 Å²	109	131.5 Å²	131.5	76%	0.762	73%	0.728	S	S	*	*			trans	-66.8	136.4	177.4	52.1	0	0	0	0	111.8	Q60	Q60-S62 PolarHBondContact O-N 2.97Å; Q60-S62 VanDerWaalsContact O-N 3.1Å
63	S	24.8	Very low	26.1	Very low	104 Å²	104	128.9 Å²	128.9	73%	0.727	72%	0.717	S	S	*	*			trans	-68.7	142.3	-179.1	47.6	0	0	0	0	111.4	S65	S63-S65 PolarHBondContact O-N 3.39Å
64	Q	31.1	Very low	25.8	Very low	114 Å²	114	131.9 Å²	131.9	53%	0.533	72%	0.72	S	S	.	*			trans	-72.6	90.6	173.3	-66.8	-170.3	-64.8	0	0	110.2	Q66 Y364	Q64-Q66 PolarHBondContact O-N 3.26Å; Q64-Y364 PolarHBondContact OE1-OH 3Å; Q64-Y364 VanDerWaalsContact OE1-OH 3.11Å
65	S	25.1	Very low	25.9	Very low	109 Å²	109	135.4 Å²	135.4	76%	0.762	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-53.5	132.1	169.7	-57.8	0	0	0	0	110.7	S63	S63-S65 PolarHBondContact O-N 3.39Å
66	Q	26.2	Very low	25.8	Very low	162 Å²	162	134.7 Å²	134.7	76%	0.757	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-70.8	142.8	177.9	-62.7	-178.7	-80.4	0	0	110.1	Q64 H68	Q64-Q66 PolarHBondContact O-N 3.26Å; Q66-H68 PolarHBondContact O-N 2.89Å
67	V	27	Very low	25.9	Very low	84 Å²	84	133.6 Å²	133.6	51%	0.509	71%	0.713	S	S	.	*	P	Polyproline II helix	trans	-66.6	121.7	178.3	-178.4	0	0	0	0	109.2	I69	V67-I69 HydrophobicContact CG1-CG1 4.03Å
68	H	23.4	Very low	26.2	Very low	177 Å²	177	134 Å²	134	82%	0.819	72%	0.715	S	S	*	*			trans	-113.8	104.2	174.5	-128.2	46.5	0	0	0	109.6	Q66 T70	Q66-H68 PolarHBondContact O-N 2.89Å; H68-T70 PolarHBondContact O-N 3.41Å
69	I	32	Very low	26.4	Very low	63 Å²	63	138 Å²	138	32%	0.323	72%	0.718	S	S	.	*			trans	-87.2	98.6	175.1	-57.4	179.7	0	0	0	107.9	V67 Q71	V67-I69 HydrophobicContact CG1-CG1 4.03Å; I69-Q71 PolarHBondContact O-N 2.95Å
70	T	26.4	Very low	26.5	Very low	125 Å²	125	142 Å²	142	77%	0.767	72%	0.724	S	S	*	*			trans	-68.6	112.8	175	-47.6	0	0	0	0	110	H68	H68-T70 PolarHBondContact O-N 3.41Å
71	Q	30.3	Very low	26.5	Very low	90 Å²	90	138.5 Å²	138.5	42%	0.421	72%	0.72	S	S	.	*			trans	-81.1	147	174.3	-68.4	178.8	-20.8	0	0	111	I69 E292	I69-Q71 PolarHBondContact O-N 2.95Å; Q71-E292 PolarHBondContact NE2-OE2 3.35Å
72	L	26.7	Very low	26.5	Very low	144 Å²	144	138.5 Å²	138.5	75%	0.754	72%	0.72	S	S	*	*			trans	-133.6	124.5	151.2	-76.7	176.1	0	0	0	106.7	K208	L72-K208 PolarHBondContact O-NZ 2.95Å
73	F	25.9	Very low	26.6	Very low	149 Å²	149	141.4 Å²	141.4	65%	0.654	73%	0.726	S	S	*	*			trans	-92.4	143	175.2	-86.3	-92.7	0	0	0	110.2
74	E	25.2	Very low	26.6	Very low	194 Å²	194	142 Å²	142	91%	0.907	73%	0.73	S	S	*	*			trans	-128.3	131.8	151.1	-72.7	-177.8	129.1	0	0	107.5
75	E	26.8	Very low	26.3	Very low	168 Å²	168	141.8 Å²	141.8	79%	0.785	74%	0.737	S	S	*	*			trans	-88.3	109.8	175	-67.4	-165.4	137.9	0	0	109.5	S77	E75-S77 PolarHBondContact O-N 3.15Å
76	N	24.3	Very low	26.3	Very low	161 Å²	161	144.3 Å²	144.3	86%	0.861	74%	0.737	S	S	*	*			trans	-79.9	66.2	174.6	-155.5	4.8	0	0	0	111.1	N78	N76-N78 PolarHBondContact O-N 2.96Å
77	S	26.8	Very low	26.8	Very low	80 Å²	80	141.1 Å²	141.1	56%	0.559	73%	0.73	S	S	*	*			trans	-83.3	90.7	-177.1	-79.4	0	0	0	0	111.4	E75 R79	E75-S77 PolarHBondContact O-N 3.15Å; S77-R79 PolarHBondContact O-N 3.2Å
78	N	29.5	Very low	26.9	Very low	161 Å²	161	144.7 Å²	144.7	86%	0.861	75%	0.746	S	S	*	*			trans	-57.9	95.4	170	-89.4	-16.5	0	0	0	111.4	N76	N76-N78 PolarHBondContact O-N 2.96Å
79	R	26.4	Very low	27.1	Very low	236 Å²	236	139.7 Å²	139.7	89%	0.891	74%	0.742	S	S	*	*			trans	-107.4	97.6	169.2	-83.3	-166.1	169.2	-163.3	-2.4	111.6	S77 S81	S77-R79 PolarHBondContact O-N 3.2Å; R79-S81 PolarHBondContact O-N 3.33Å
80	R	25	Very low	26.9	Very low	234 Å²	234	144.8 Å²	144.8	88%	0.883	77%	0.769	S	S	*	*			trans	-52	123.9	157	-170	-176.5	-159.8	172.7	5	108.6	V82	R80-V82 PolarHBondContact O-N 3.2Å
81	S	24.7	Very low	26.9	Very low	114 Å²	114	143 Å²	143	80%	0.797	77%	0.767	S	S	*	*			trans	-70.1	125.5	178.1	43.5	0	0	0	0	110.9	R79	R79-S81 PolarHBondContact O-N 3.33Å
82	V	24.3	Very low	27.4	Very low	131 Å²	131	144 Å²	144	79%	0.794	78%	0.781	S	S	*	*			trans	-134.4	108.6	165.2	-179	0	0	0	0	105.6	R80	R80-V82 PolarHBondContact O-N 3.2Å
83	L	25.5	Very low	27.3	Very low	170 Å²	170	144.8 Å²	144.8	89%	0.89	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-85.8	148.4	173.9	-79.6	163	0	0	0	109.7
84	S	25.9	Very low	27.3	Very low	115 Å²	115	142.6 Å²	142.6	80%	0.804	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-82.4	151.3	-175.1	50	0	0	0	0	113
85	T	24.3	Very low	27.5	Very low	110 Å²	110	138.7 Å²	138.7	68%	0.675	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-61.3	162.9	160.5	53.5	0	0	0	0	110.2
86	Q	25.7	Very low	27.6	Very low	162 Å²	162	135.6 Å²	135.6	76%	0.757	78%	0.78	S	S	*	*			cis	-156.5	-166	44	-68.9	-72.9	6.1	0	0	109.3
87	P	37	Very low	27.9	Very low	95 Å²	95	139 Å²	139	62%	0.617	78%	0.781	S	S	*	*				-129.5	167.5	-67.8	38.4	-23.8	0	0	0	113.9
88	N	29.2	Very low	28.1	Very low	160 Å²	160	142 Å²	142	86%	0.856	80%	0.795	S	S	*	*			trans	140.3	150.9	141.9	-75.1	-17.5	0	0	0	114.8
89	G	27	Very low	28	Very low	71 Å²	71	137.6 Å²	137.6	73%	0.732	79%	0.789	S	S	*	*			trans	91.1	83.9	140.3	0	0	0	0	0	120
90	L	27.7	Very low	28.1	Very low	170 Å²	170	134.3 Å²	134.3	89%	0.89	79%	0.786	S	S	*	*			trans	22.1	113.7	134.6	-61.9	164.1	0	0	0	120.3
91	A	26	Very low	28.8	Very low	87 Å²	87	128.7 Å²	128.7	72%	0.719	78%	0.779	S	S	*	*				39.7	155.9	112.8	0	0	0	0	0	122.4
92	P	40.7	Very low	29.1	Very low	111 Å²	111	130 Å²	130	72%	0.721	78%	0.777	S	S	*	*			cis	-146.8	-164.8	-23.3	38.5	-16.4	0	0	0	116
93	L	25.8	Very low	30.1	Very low	161 Å²	161	129.6 Å²	129.6	84%	0.843	78%	0.776	S	S	*	*			trans	90.3	156.5	148.5	-77.7	170.2	0	0	0	123.7
94	S	26.3	Very low	30.2	Very low	104 Å²	104	128.5 Å²	128.5	73%	0.727	77%	0.771	S	S	*	*			trans	71.2	115.8	-178.8	69.4	0	0	0	0	116.2
95	S	27.9	Very low	30.4	Very low	111 Å²	111	133.8 Å²	133.8	78%	0.776	77%	0.774	S	S	*	*				77	129.4	51.7	80.5	0	0	0	0	113.2
96	S	29	Very low	30.5	Very low	103 Å²	103	136.5 Å²	136.5	72%	0.72	78%	0.779	S	S	*	*			cis	-167.9	166.3	35.6	59.5	0	0	0	0	114.4
97	R	31.8	Very low	30.6	Very low	233 Å²	233	134 Å²	134	88%	0.879	78%	0.78	S	S	*	*			trans	38.5	148.7	142.8	-68	-177.8	176.6	-173.8	-1.4	120.6
98	T	30.5	Very low	30.1	Very low	142 Å²	142	135.7 Å²	135.7	87%	0.871	79%	0.793	S	S	*	*			cis	-162.8	170.1	7	4.3	0	0	0	0	107.5
99	G	26.9	Very low	30	Very low	70 Å²	70	132.6 Å²	132.6	72%	0.722	79%	0.79	S	S	*	*			cis	-173	-176.6	6	0	0	0	0	0	112.5
100	M	28.8	Very low	30.1	Very low	167 Å²	167	136.1 Å²	136.1	82%	0.823	80%	0.798	S	S	*	*			trans	-92	-178.9	-172.4	-81.8	-74.5	-77.7	0	0	112.6
101	P	40.2	Very low	30.1	Very low	116 Å²	116	136 Å²	136	75%	0.753	80%	0.798	S	S	*	*			cis	-144.2	179.5	17.7	45.3	-25.9	0	0	0	119.6
102	L	31.6	Very low	30.2	Very low	142 Å²	142	136.6 Å²	136.6	74%	0.743	80%	0.803	S	S	*	*			trans	-92.8	175.8	159	-78.5	159.6	0	0	0	111
103	P	44.7	Very low	29.7	Very low	121 Å²	121	136.9 Å²	136.9	79%	0.786	80%	0.803	S	S	*	*				-145.1	167.2	109.7	38.9	-25.3	0	0	0	116.5
104	D	28.1	Very low	30.1	Very low	147 Å²	147	136.3 Å²	136.3	79%	0.786	80%	0.795	S	S	*	*			trans	-68.8	179.6	170.3	-52.5	-85.4	0	0	0	112.4
105	R	30.2	Very low	30.4	Very low	227 Å²	227	139.4 Å²	139.4	86%	0.857	80%	0.798	S	S	*	*			cis	-174.7	170.7	43.1	-150.6	173.5	-177.2	-176.6	1.7	114.8
106	Q	26.1	Very low	30.5	Very low	166 Å²	166	137.7 Å²	137.7	78%	0.776	80%	0.798	S	S	*	*			trans	-49.7	165.5	159.2	-65.3	157.9	-25.8	0	0	113.9
107	S	26.9	Very low	30.6	Very low	111 Å²	111	143.4 Å²	143.4	78%	0.776	80%	0.804	S	S	*	*			cis	179.1	149.6	-14.9	53.7	0	0	0	0	110.1
108	S	25.9	Very low	30.6	Very low	129 Å²	129	139.3 Å²	139.3	90%	0.902	80%	0.795	S	S	*	*			trans	-161.3	168.9	160.1	56.6	0	0	0	0	111.9
109	A	27.6	Very low	30.6	Very low	96 Å²	96	136.8 Å²	136.8	79%	0.793	78%	0.783	S	S	*	*			trans	-145.4	160.6	-174	0	0	0	0	0	112.7
110	T	30	Very low	30.7	Very low	145 Å²	145	139.2 Å²	139.2	89%	0.89	78%	0.784	S	S	*	*			trans	-151.2	152.2	166.1	27.7	0	0	0	0	110.8
111	D	27	Very low	30.7	Very low	168 Å²	168	137.8 Å²	137.8	90%	0.898	79%	0.785	S	S	*	*			trans	-85.2	154.8	-174.2	-69.6	-77	0	0	0	115.4
112	A	29.1	Very low	30.4	Very low	99 Å²	99	139.6 Å²	139.6	82%	0.818	79%	0.787	S	S	*	*			trans	-160.4	146.3	132.1	0	0	0	0	0	112.1
113	T	29.8	Very low	30.5	Very low	117 Å²	117	139.5 Å²	139.5	72%	0.718	79%	0.792	S	S	*	*			trans	-79	171.3	-179.7	50.5	0	0	0	0	112.1
114	H	33.8	Very low	30	Very low	149 Å²	149	141.3 Å²	141.3	69%	0.69	80%	0.795	S	S	*	*			cis	-150	177.2	31.5	-106.4	-69.2	0	0	0	115.1
115	H	32.5	Very low	30.5	Very low	168 Å²	168	143.8 Å²	143.8	78%	0.778	80%	0.799	S	S	*	*			trans	-32.8	157.7	177.7	-53.7	-33.8	0	0	0	119.1
116	G	30.5	Very low	30.9	Very low	76 Å²	76	142.2 Å²	142.2	78%	0.784	80%	0.801	S	S	*	*			cis	-147.4	-159.9	31.1	0	0	0	0	0	119.7
117	R	30	Very low	31.6	Very low	223 Å²	223	137.3 Å²	137.3	84%	0.842	80%	0.796	S	S	*	*			trans	-165.7	142	-137.8	170.6	-179.2	-175.3	-160.9	-1.5	108.7
118	Q	33.4	Very low	32.4	Very low	146 Å²	146	140.1 Å²	140.1	68%	0.682	80%	0.802	S	S	*	*			cis	-153.1	-176.4	-1.7	-124.2	173.1	-41.1	0	0	106.8
119	S	29.4	Very low	33.9	Very low	90 Å²	90	138.4 Å²	138.4	63%	0.629	80%	0.796	S	S	*	*			cis	-152.9	165.3	10.3	-143.4	0	0	0	0	114.7
120	T	28.8	Very low	35.6	Very low	120 Å²	120	142.9 Å²	142.9	74%	0.736	80%	0.797	S	S	*	*			trans	-51.3	148.6	176.2	52.2	0	0	0	0	117.9
121	T	29.3	Very low	37.5	Very low	138 Å²	138	141.8 Å²	141.8	85%	0.847	79%	0.792	S	S	*	*			trans	-133.6	115.2	139.2	-56.5	0	0	0	0	111.5
122	I	33.6	Very low	39.6	Very low	154 Å²	154	143 Å²	143	79%	0.79	79%	0.79	S	S	*	*			trans	9.6	126.5	156.6	-58	171	0	0	0	118.3
123	T	34.5	Very low	42.2	Very low	139 Å²	139	140.5 Å²	140.5	85%	0.853	77%	0.765	S	S	*	*			trans	-64.8	144	169.7	44.8	0	0	0	0	113
124	N	34	Very low	45	Very low	159 Å²	159	140.4 Å²	140.4	85%	0.85	77%	0.768	S	S	*	*			trans	-134.8	142.7	161.9	-154	-7.1	0	0	0	110.2	Q126	N124-Q126 PolarHBondContact O-N 3.17Å
125	K	37.9	Very low	47.9	Very low	199 Å²	199	135.5 Å²	135.5	87%	0.865	75%	0.749	S	S	*	*			trans	-74.5	115.4	-166.4	-65.7	178.5	179.4	179.7	0	110.9	G127	K125-G127 PolarHBondContact O-N 3.49Å
126	Q	39.2	Very low	50.9	Low	194 Å²	194	129.4 Å²	129.4	91%	0.907	72%	0.722	S	S	*	*			trans	-66.6	122.5	156.4	-70.6	-178.4	-10.5	0	0	107.7	N124	N124-Q126 PolarHBondContact O-N 3.17Å
127	G	39.7	Very low	54.1	Low	64 Å²	64	128.2 Å²	128.2	66%	0.66	70%	0.701	S	S	*	*			trans	-84.7	148.9	169.7	0	0	0	0	0	110.4	K125 A129	K125-G127 PolarHBondContact O-N 3.49Å; G127-A129 PolarHBondContact O-N 2.93Å
128	D	44.4	Very low	57.3	Low	169 Å²	169	118.2 Å²	118.2	90%	0.904	67%	0.665	S	S	*	*			trans	-60.4	91.8	-179	-66.2	-70.1	0	0	0	112.7	K130	D128-K130 PolarHBondContact O-N 2.81Å; D128-K130 VanDerWaalsContact O-N 3.14Å
129	A	56.4	Low	60.3	Low	94 Å²	94	116.1 Å²	116.1	78%	0.777	66%	0.659	S	S	*	*			trans	-69.6	104.5	163.3	0	0	0	0	0	107.9	G127	G127-A129 PolarHBondContact O-N 2.93Å
130	K	64	Low	63.5	Low	189 Å²	189	115.1 Å²	115.1	82%	0.822	65%	0.646	S	S	*	*	P	Polyproline II helix	trans	-47.3	135.1	174.8	-70.8	-173	176	-173.2	0	110	D128 K132	D128-K130 PolarHBondContact O-N 2.81Å; D128-K130 VanDerWaalsContact O-N 3.14Å; K130-K132 PolarHBondContact O-N 2.95Å
131	P	69.4	Low	66.8	Low	122 Å²	122	109.4 Å²	109.4	79%	0.792	61%	0.611	S	S	*	*	P	Polyproline II helix	trans	-57.4	135.8	179.3	24.1	-33.7	0	0	0	110
132	K	72.7	Confident	70	Confident	194 Å²	194	104.2 Å²	104.2	84%	0.843	58%	0.577	S	S	*	*	P	Polyproline II helix	trans	-62.9	136.1	176.4	-69.8	-178	178.7	178.1	0	109.2	K130 C134	K130-K132 PolarHBondContact O-N 2.95Å; K132-C134 PolarHBondContact O-N 3.38Å
133	P	82.6	Confident	73	Confident	47 Å²	47	105.9 Å²	105.9	31%	0.305	58%	0.579	S	S	.	*	P	Polyproline II helix	trans	-57.3	127.6	173.8	-24.2	34.3	0	0	0	111	Y164 H224 Q227	P133-Y164 HydrophobicContact CB-CD1 4.45Å; P133-H224 WeakPolarHBondContact CG-O 3.15Å; P133-Q227 HydrophobicContact CG-CG 3.56Å
134	C	88	Confident	76	Confident	115 Å²	115	104 Å²	104	78%	0.777	56%	0.561	S	S	*	*	P	Polyproline II helix	trans	-87.7	128.2	172	-162.9	0	0	0	0	108.6	K132	K132-C134 PolarHBondContact O-N 3.38Å
135	P	94.6	Very high	79	Confident	45 Å²	45	99.9 Å²	99.9	29%	0.292	53%	0.533	S	S	.	.	P	Polyproline II helix	trans	-67.6	150	175.1	27	-32.3	0	0	0	111.7	E162 Y164	P135-E162 HydrophobicContact CB-CB 3.77Å; P135-E162 HydrophobicContact CB-CG 4.17Å; P135-E162 HydrophobicContact CG-CB 4.29Å; P135-E162 HydrophobicContact CG-CG 4.13Å; P135-Y164 HydrophobicContact CB-CD1 4.24Å; P135-Y164 HydrophobicContact CB-CD2 4.41Å; P135-Y164 HydrophobicContact CB-CE1 3.79Å; P135-Y164 HydrophobicContact CB-CE2 4Å; P135-Y164 HydrophobicContact CG-CE1 4.17Å
136	M	96.1	Very high	81.7	Confident	41 Å²	41	95.4 Å²	95.4	20%	0.202	52%	0.517	C	S	.	.	B	Isolated β-bridge	trans	-85	152.4	166.4	-49.1	-172.9	-62.1	0	0	109.7	L140 A141 Y145 V163 I166	M136-L140 HydrophobicContact CB-CD2 4.32Å; M136-A141 HydrophobicContact CE-CB 4.02Å; M136-Y145 HydrophobicContact CE-CD2 4.22Å; M136-Y145 HydrophobicContact CE-CE2 3.87Å; M136-Y145 HydrophobicContact SD-CE2 3.91Å; M136-V163 HydrophobicContact CB-CB 4.26Å; M136-V163 HydrophobicContact CE-CB 4.37Å; M136-V163 HydrophobicContact CE-CG1 3.63Å; M136-V163 PolarHBondContact N-O 3.22Å; M136-V163 PolarHBondContact O-N 2.87Å; M136-I166 HydrophobicContact CE-CG2 4.3Å
137	S	97.6	Very high	84.4	Confident	50 Å²	50	91.5 Å²	91.5	35%	0.35	51%	0.511	S	S	.	.	P	Polyproline II helix	trans	-74.7	156.9	164	70	0	0	0	0	110.7	D139 L140 A141	S137-D139 PolarHBondContact O-N 3.33Å; S137-L140 PolarHBondContact O-N 3.32Å; S137-L140 WeakPolarHBondContact OG-CB 3.45Å; S137-L140 PolarHBondContact OG-N 2.88Å; S137-A141 PolarHBondContact O-N 3.29Å
138	P	97.4	Very high	87.1	Confident	14 Å²	14	93.6 Å²	93.6	9%	0.091	50%	0.502	C	S	.	.	H	α-helix	trans	-58.2	-35.5	173.6	23.2	-34.6	0	0	0	112.7	L140 A141 M142 V157 F158	P138-L140 PolarHBondContact O-N 3.5Å; P138-A141 PolarHBondContact O-N 3.04Å; P138-M142 WeakPolarHBondContact O-CB 3.2Å; P138-M142 WeakPolarHBondContact O-CG 3.23Å; P138-M142 PolarHBondContact O-N 2.86Å; P138-V157 HydrophobicContact CB-CG1 4.34Å; P138-V157 HydrophobicContact CB-CG2 4.04Å; P138-F158 HydrophobicContact CB-CD1 3.81Å; P138-F158 HydrophobicContact CB-CE1 4.13Å; P138-F158 HydrophobicContact CB-CG 4.31Å; P138-F158 HydrophobicContact CG-CD1 4.01Å; P138-F158 HydrophobicContact CG-CE1 4.46Å
139	D	97.4	Very high	89.5	Confident	102 Å²	102	86.2 Å²	86.2	55%	0.545	46%	0.462	S	S	.	.	H	α-helix	trans	-63.2	-41.5	175.9	-46.4	-92.8	0	0	0	112.3	S137 K143	S137-D139 PolarHBondContact O-N 3.33Å; D139-K143 VanDerWaalsContact O-CB 3.25Å; D139-K143 WeakPolarHBondContact O-CB 3.27Å; D139-K143 PolarHBondContact O-N 3.05Å
140	L	96.8	Very high	91.4	Very high	69 Å²	69	82.1 Å²	82.1	36%	0.361	43%	0.428	S	S	.	.	H	α-helix	trans	-70.4	-40.4	177	-174.4	62.6	0	0	0	110.9	M136 S137 P138 M142 K143 Q144	M136-L140 HydrophobicContact CB-CD2 4.32Å; S137-L140 PolarHBondContact O-N 3.32Å; S137-L140 WeakPolarHBondContact OG-CB 3.45Å; S137-L140 PolarHBondContact OG-N 2.88Å; P138-L140 PolarHBondContact O-N 3.5Å; L140-M142 PolarHBondContact O-N 3.04Å; L140-K143 PolarHBondContact O-N 3.14Å; L140-Q144 HydrophobicContact CD1-CG 4.13Å; L140-Q144 HydrophobicContact CG-CG 4.49Å; L140-Q144 WeakPolarHBondContact O-CB 3.35Å; L140-Q144 WeakPolarHBondContact O-CG 3.49Å; L140-Q144 PolarHBondContact O-N 2.89Å
141	A	96.8	Very high	92.8	Very high	0 Å²	0	77.3 Å²	77.3	0%	0	42%	0.418	C	S	.	.	H	α-helix	trans	-60	-44.2	174.8	0	0	0	0	0	111.5	M136 S137 P138 Y145 V157 V163	M136-A141 HydrophobicContact CE-CB 4.02Å; S137-A141 PolarHBondContact O-N 3.29Å; P138-A141 PolarHBondContact O-N 3.04Å; A141-Y145 WeakPolarHBondContact O-CA 3.12Å; A141-Y145 VanDerWaalsContact O-CB 3.3Å; A141-Y145 WeakPolarHBondContact O-CB 3.24Å; A141-Y145 PolarHBondContact O-N 2.94Å; A141-V157 HydrophobicContact CB-CG2 4.37Å; A141-V163 HydrophobicContact CB-CB 4.29Å; A141-V163 HydrophobicContact CB-CG1 3.95Å; A141-V163 HydrophobicContact CB-CG2 4.22Å
142	M	97.6	Very high	94.1	Very high	28 Å²	28	72.8 Å²	72.8	14%	0.138	39%	0.386	C	S	.	.	H	α-helix	trans	-63.6	-51.6	172.7	-75.9	-64.3	-74.8	0	0	111.5	P138 L140 Q144 Y145 M146 L149 H154 V157 F158	P138-M142 WeakPolarHBondContact O-CB 3.2Å; P138-M142 WeakPolarHBondContact O-CG 3.23Å; P138-M142 PolarHBondContact O-N 2.86Å; L140-M142 PolarHBondContact O-N 3.04Å; M142-Q144 PolarHBondContact O-N 3.38Å; M142-Y145 PolarHBondContact O-N 3.34Å; M142-M146 HydrophobicContact CE-CB 4.37Å; M142-M146 HydrophobicContact CE-CE 4.42Å; M142-M146 HydrophobicContact CE-CG 3.96Å; M142-M146 HydrophobicContact CE-SD 4.29Å; M142-M146 VanDerWaalsContact O-CB 3.23Å; M142-M146 WeakPolarHBondContact O-CB 3.47Å; M142-M146 PolarHBondContact O-N 3.12Å; M142-L149 HydrophobicContact SD-CD1 3.74Å; M142-H154 HydrophobicContact CE-CB 3.75Å; M142-H154 HydrophobicContact SD-CB 4.31Å; M142-V157 HydrophobicContact CG-CG1 3.83Å; M142-V157 HydrophobicContact SD-CG1 4.02Å; M142-F158 HydrophobicContact CG-CE2 3.94Å; M142-F158 HydrophobicContact CG-CZ 3.91Å
143	K	96.9	Very high	95.2	Very high	189 Å²	189	63.6 Å²	63.6	82%	0.822	35%	0.346	S	S	*	.	H	α-helix	trans	-57.3	-33.7	-178.7	-175.7	173.8	-179.1	176.5	0	113.5	D139 L140	D139-K143 VanDerWaalsContact O-CB 3.25Å; D139-K143 WeakPolarHBondContact O-CB 3.27Å; D139-K143 PolarHBondContact O-N 3.05Å; L140-K143 PolarHBondContact O-N 3.14Å
144	Q	96.3	Very high	95.9	Very high	101 Å²	101	63.2 Å²	63.2	47%	0.472	34%	0.341	S	S	.	.	H	α-helix	trans	-91.5	-30.8	179.6	-68.8	-178.8	-12.6	0	0	113.8	L140 M142	L140-Q144 HydrophobicContact CD1-CG 4.13Å; L140-Q144 HydrophobicContact CG-CG 4.49Å; L140-Q144 WeakPolarHBondContact O-CB 3.35Å; L140-Q144 WeakPolarHBondContact O-CG 3.49Å; L140-Q144 PolarHBondContact O-N 2.89Å; M142-Q144 PolarHBondContact O-N 3.38Å
145	Y	96.6	Very high	96.2	Very high	71 Å²	71	64 Å²	64	28%	0.278	33%	0.332	S	S	.	.	H	α-helix	trans	-134.5	12.9	-164.2	-53.5	-74	0	0	0	115.7	M136 A141 M142 S147 K148 L149 I166	M136-Y145 HydrophobicContact CE-CD2 4.22Å; M136-Y145 HydrophobicContact CE-CE2 3.87Å; M136-Y145 HydrophobicContact SD-CE2 3.91Å; A141-Y145 WeakPolarHBondContact O-CA 3.12Å; A141-Y145 VanDerWaalsContact O-CB 3.3Å; A141-Y145 WeakPolarHBondContact O-CB 3.24Å; A141-Y145 PolarHBondContact O-N 2.94Å; M142-Y145 PolarHBondContact O-N 3.34Å; Y145-S147 PolarHBondContact O-N 3.4Å; Y145-S147 VanDerWaalsContact O-N 3.07Å; Y145-K148 CarbonylContact O-C 3.59Å; Y145-K148 WeakPolarHBondContact O-CA 3.38Å; Y145-K148 PolarHBondContact O-N 2.88Å; Y145-L149 PolarHBondContact O-N 3.29Å; Y145-L149 VanDerWaalsContact O-N 3.15Å; Y145-I166 HydrophobicContact CD1-CD1 3.53Å; Y145-I166 HydrophobicContact CD2-CD1 3.49Å; Y145-I166 VanDerWaalsContact CD2-CD1 3.49Å; Y145-I166 HydrophobicContact CE1-CD1 4.1Å; Y145-I166 HydrophobicContact CE2-CD1 4.06Å; Y145-I166 HydrophobicContact CG-CD1 3.18Å
146	M	95.8	Very high	96.3	Very high	106 Å²	106	62.9 Å²	62.9	52%	0.522	32%	0.323	S	S	.	.	G	3₁₀ helix	trans	-48.7	-37.9	176.3	-177.8	178.7	-171.7	0	0	113.4	M142 K148 L149 H154	M142-M146 HydrophobicContact CE-CB 4.37Å; M142-M146 HydrophobicContact CE-CE 4.42Å; M142-M146 HydrophobicContact CE-CG 3.96Å; M142-M146 HydrophobicContact CE-SD 4.29Å; M142-M146 VanDerWaalsContact O-CB 3.23Å; M142-M146 WeakPolarHBondContact O-CB 3.47Å; M142-M146 PolarHBondContact O-N 3.12Å; M146-K148 PolarHBondContact O-N 2.73Å; M146-L149 PolarHBondContact O-N 3Å; M146-H154 PolarHBondContact O-NE2 3.07Å
147	S	95.9	Very high	96.4	Very high	111 Å²	111	60.9 Å²	60.9	78%	0.776	31%	0.314	S	S	*	.	G	3₁₀ helix	trans	-75.6	-1	177.2	60.3	0	0	0	0	115.2	Y145	Y145-S147 PolarHBondContact O-N 3.4Å; Y145-S147 VanDerWaalsContact O-N 3.07Å
148	K	96.2	Very high	96.4	Very high	109 Å²	109	63.5 Å²	63.5	47%	0.474	32%	0.319	S	S	.	.	G	3₁₀ helix	trans	-118.8	-6.1	176	-60.7	-61.8	-174.2	176.7	0	113.1	Y145 M146 Q168 K172	Y145-K148 CarbonylContact O-C 3.59Å; Y145-K148 WeakPolarHBondContact O-CA 3.38Å; Y145-K148 PolarHBondContact O-N 2.88Å; M146-K148 PolarHBondContact O-N 2.73Å; K148-Q168 HydrophobicContact CB-CB 4.01Å; K148-Q168 HydrophobicContact CG-CB 4.24Å; K148-K172 WeakPolarHBondContact O-CE 3.48Å
149	L	95.5	Very high	96.4	Very high	13 Å²	13	67.1 Å²	67.1	7%	0.068	34%	0.344	C	S	.	.	S	Bend	trans	-98.1	144.1	173.9	-66.1	174.6	0	0	0	109.5	M142 Y145 M146 E153 H154 I166 Y202	M142-L149 HydrophobicContact SD-CD1 3.74Å; Y145-L149 PolarHBondContact O-N 3.29Å; Y145-L149 VanDerWaalsContact O-N 3.15Å; M146-L149 PolarHBondContact O-N 3Å; L149-E153 HydrophobicContact CB-CB 4.05Å; L149-E153 HydrophobicContact CD2-CB 4.15Å; L149-H154 PolarHBondContact O-NE2 3.27Å; L149-H154 VanDerWaalsContact O-NE2 3.07Å; L149-I166 HydrophobicContact CD2-CB 4.19Å; L149-I166 HydrophobicContact CD2-CG2 4.49Å; L149-Y202 HydrophobicContact CD2-CE1 4.41Å
150	S	95.3	Very high	96.4	Very high	9 Å²	9	64.5 Å²	64.5	6%	0.063	33%	0.327	C	S	.	.			trans	-73.2	159.9	171.6	60.4	0	0	0	0	111.7	F152 E153 H154	S150-F152 PolarHBondContact O-N 3.07Å; S150-F152 VanDerWaalsContact O-N 3.12Å; S150-E153 WeakPolarHBondContact CB-OE2 3.3Å; S150-E153 PolarHBondContact N-OE2 2.93Å; S150-E153 CarbonylContact O-C 3.57Å; S150-E153 WeakPolarHBondContact O-CA 3.38Å; S150-E153 WeakPolarHBondContact O-CB 3.29Å; S150-E153 PolarHBondContact O-N 3.42Å; S150-E153 VanDerWaalsContact OG-CG 3.32Å; S150-E153 WeakPolarHBondContact OG-CG 3.45Å; S150-E153 PolarHBondContact OG-OE2 2.9Å; S150-H154 PolarHBondContact O-CD2 2.81Å; S150-H154 VanDerWaalsContact O-CD2 3.29Å; S150-H154 PolarHBondContact O-N 2.9Å
151	S	93.7	Very high	96.4	Very high	88 Å²	88	66.4 Å²	66.4	62%	0.615	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-24.9	178.8	-42	0	0	0	0	113.7	H155	S151-H155 PolarHBondContact O-ND1 2.99Å
152	F	95.8	Very high	96.4	Very high	27 Å²	27	70.5 Å²	70.5	12%	0.118	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-47.1	170	-166.8	-83.6	0	0	0	110.9	S150 H154 H155 E156 L177 Y185 R276	S150-F152 PolarHBondContact O-N 3.07Å; S150-F152 VanDerWaalsContact O-N 3.12Å; F152-H154 VanDerWaalsContact C-N 3.3Å; F152-H154 PolarHBondContact O-N 3.15Å; F152-H155 PolarHBondContact O-N 3.17Å; F152-H155 VanDerWaalsContact O-N 3.1Å; F152-E156 HydrophobicContact CD1-CB 4.13Å; F152-E156 HydrophobicContact CE1-CB 4.22Å; F152-E156 HydrophobicContact CE1-CG 4.32Å; F152-E156 PolarHBondContact O-N 3.29Å; F152-L177 HydrophobicContact CD2-CD2 4.08Å; F152-L177 HydrophobicContact CD2-CG 3.92Å; F152-L177 HydrophobicContact CE2-CD2 3.47Å; F152-L177 VanDerWaalsContact CE2-CD2 3.47Å; F152-L177 HydrophobicContact CE2-CG 3.82Å; F152-L177 HydrophobicContact CZ-CD2 4.11Å; F152-Y185 WeakPolarHBondContact CB-OH 3.38Å; F152-Y185 AromaticContact CD1-CE2 3.87Å; F152-Y185 HydrophobicContact CD1-CE2 3.87Å; F152-Y185 AromaticContact CD2-CE2 3.89Å; F152-Y185 HydrophobicContact CD2-CE2 3.89Å; F152-Y185 AromaticContact CE1-CE2 3.86Å; F152-Y185 HydrophobicContact CE1-CE2 3.86Å; F152-Y185 AromaticContact CE2-CE2 3.87Å; F152-Y185 HydrophobicContact CE2-CE2 3.87Å; F152-Y185 AromaticContact CG-CE2 3.89Å; F152-Y185 HydrophobicContact CG-CE2 3.89Å; F152-Y185 WeakPolarHBondContact CG-OH 3.43Å; F152-Y185 HydrophobicContact CZ-CD2 4.49Å; F152-Y185 AromaticContact CZ-CE2 3.86Å; F152-Y185 HydrophobicContact CZ-CE2 3.86Å; F152-R276 HydrophobicContact CE1-CG 4.32Å
153	E	97.1	Very high	96.5	Very high	1 Å²	1	69.2 Å²	69.2	1%	0.005	36%	0.356	C	S	.	.	H	α-helix	trans	-68.4	-25	-179.8	-71.1	169.4	131.3	0	0	113.7	L149 S150 H155 V157 K172 Q199 Y202 R276	L149-E153 HydrophobicContact CB-CB 4.05Å; L149-E153 HydrophobicContact CD2-CB 4.15Å; S150-E153 WeakPolarHBondContact CB-OE2 3.3Å; S150-E153 PolarHBondContact N-OE2 2.93Å; S150-E153 CarbonylContact O-C 3.57Å; S150-E153 WeakPolarHBondContact O-CA 3.38Å; S150-E153 WeakPolarHBondContact O-CB 3.29Å; S150-E153 PolarHBondContact O-N 3.42Å; S150-E153 VanDerWaalsContact OG-CG 3.32Å; S150-E153 WeakPolarHBondContact OG-CG 3.45Å; S150-E153 PolarHBondContact OG-OE2 2.9Å; E153-H155 PolarHBondContact O-N 2.98Å; E153-V157 VanDerWaalsContact O-CB 3.3Å; E153-V157 WeakPolarHBondContact O-CB 3.43Å; E153-V157 VanDerWaalsContact O-CG1 3.29Å; E153-V157 WeakPolarHBondContact O-CG1 3.4Å; E153-V157 PolarHBondContact O-N 3.17Å; E153-K172 IonicContact OE1-NZ 3.13Å; E153-K172 PolarHBondContact OE1-NZ 3Å; E153-K172 WeakPolarHBondContact OE2-CD 3.45Å; E153-K172 IonicContact OE2-NZ 2.68Å; E153-K172 PolarHBondContact OE2-NZ 3.08Å; E153-Q199 PolarHBondContact OE1-NE2 2.89Å; E153-Y202 WeakPolarHBondContact CB-OH 3.27Å; E153-Y202 PolarHBondContact O-OH 2.84Å; E153-R276 IonicContact OE1-NH2 3.26Å; E153-R276 PolarHBondContact OE1-NH2 3.26Å; E153-R276 VanDerWaalsContact OE1-NH2 3.13Å
154	H	95.8	Very high	96.5	Very high	39 Å²	39	61.9 Å²	61.9	18%	0.181	32%	0.324	C	S	.	.	H	α-helix	trans	-58.5	-25.1	170.5	-63.5	171.1	0	0	0	112.8	M142 M146 L149 S150 F152 F158	M142-H154 HydrophobicContact CE-CB 3.75Å; M142-H154 HydrophobicContact SD-CB 4.31Å; M146-H154 PolarHBondContact O-NE2 3.07Å; L149-H154 PolarHBondContact O-NE2 3.27Å; L149-H154 VanDerWaalsContact O-NE2 3.07Å; S150-H154 PolarHBondContact O-CD2 2.81Å; S150-H154 VanDerWaalsContact O-CD2 3.29Å; S150-H154 PolarHBondContact O-N 2.9Å; F152-H154 VanDerWaalsContact C-N 3.3Å; F152-H154 PolarHBondContact O-N 3.15Å; H154-F158 WeakPolarHBondContact O-CD2 3.43Å; H154-F158 WeakPolarHBondContact O-CE2 3.25Å
155	H	94.9	Very high	96.6	Very high	130 Å²	130	58.3 Å²	58.3	60%	0.602	31%	0.307	S	S	*	.	H	α-helix	trans	-102.7	-42.5	177.2	-58.5	85.9	0	0	0	111.3	S151 F152 E153 V157	S151-H155 PolarHBondContact O-ND1 2.99Å; F152-H155 PolarHBondContact O-N 3.17Å; F152-H155 VanDerWaalsContact O-N 3.1Å; E153-H155 PolarHBondContact O-N 2.98Å; H155-V157 VanDerWaalsContact C-N 3.32Å; H155-V157 PolarHBondContact O-N 2.97Å
156	E	96.9	Very high	96.6	Very high	22 Å²	22	55.1 Å²	55.1	10%	0.103	30%	0.295	C	S	.	.	H	α-helix	trans	-61.2	-37	-178.8	-171.7	-178.4	-135.3	0	0	112.7	F152 F158 S159 Y160 Y202 R276	F152-E156 HydrophobicContact CD1-CB 4.13Å; F152-E156 HydrophobicContact CE1-CB 4.22Å; F152-E156 HydrophobicContact CE1-CG 4.32Å; F152-E156 PolarHBondContact O-N 3.29Å; E156-F158 VanDerWaalsContact C-N 3.26Å; E156-F158 PolarHBondContact O-N 3.09Å; E156-S159 VanDerWaalsContact O-CB 3.27Å; E156-S159 WeakPolarHBondContact O-CB 3.49Å; E156-S159 PolarHBondContact O-N 2.9Å; E156-S159 PolarHBondContact O-OG 2.89Å; E156-Y160 HydrophobicContact CG-CE2 4.01Å; E156-Y160 WeakPolarHBondContact O-CD2 3.3Å; E156-Y202 HydrophobicContact CG-CE2 4.14Å; E156-R276 WeakPolarHBondContact OE1-CG 3.36Å; E156-R276 IonicContact OE1-NE 3.08Å; E156-R276 PolarHBondContact OE1-NE 2.99Å; E156-R276 VanDerWaalsContact OE1-NE 3.08Å; E156-R276 IonicContact OE2-CZ 2.8Å; E156-R276 VanDerWaalsContact OE2-CZ 3.26Å; E156-R276 IonicContact OE2-NE 3Å; E156-R276 PolarHBondContact OE2-NE 3.28Å; E156-R276 IonicContact OE2-NH2 3.63Å; E156-R276 PolarHBondContact OE2-NH2 3.22Å
157	V	97.4	Very high	96.7	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-59.2	-34	-174.3	70.5	0	0	0	0	113.2	P138 A141 M142 E153 H155 S159 Y160 V163 Y202	P138-V157 HydrophobicContact CB-CG1 4.34Å; P138-V157 HydrophobicContact CB-CG2 4.04Å; A141-V157 HydrophobicContact CB-CG2 4.37Å; M142-V157 HydrophobicContact CG-CG1 3.83Å; M142-V157 HydrophobicContact SD-CG1 4.02Å; E153-V157 VanDerWaalsContact O-CB 3.3Å; E153-V157 WeakPolarHBondContact O-CB 3.43Å; E153-V157 VanDerWaalsContact O-CG1 3.29Å; E153-V157 WeakPolarHBondContact O-CG1 3.4Å; E153-V157 PolarHBondContact O-N 3.17Å; H155-V157 VanDerWaalsContact C-N 3.32Å; H155-V157 PolarHBondContact O-N 2.97Å; V157-S159 PolarHBondContact O-N 2.94Å; V157-S159 VanDerWaalsContact O-N 3.15Å; V157-Y160 PolarHBondContact O-N 2.84Å; V157-V163 HydrophobicContact CG2-CG2 3.77Å; V157-Y202 WeakPolarHBondContact CA-OH 3.3Å; V157-Y202 HydrophobicContact CB-CE1 3.89Å; V157-Y202 HydrophobicContact CB-CE2 4.3Å; V157-Y202 HydrophobicContact CG2-CD1 4.05Å; V157-Y202 HydrophobicContact CG2-CE1 3.67Å; V157-Y202 HydrophobicContact CG2-CE2 4.48Å; V157-Y202 PolarHBondContact N-OH 3.08Å
158	F	97.7	Very high	96.6	Very high	105 Å²	105	48.1 Å²	48.1	46%	0.461	25%	0.249	S	C	.	.	G	3₁₀ helix	trans	-68.9	-10.4	178.3	-67.7	-80.3	0	0	0	113.7	P138 M142 H154 E156 Y160	P138-F158 HydrophobicContact CB-CD1 3.81Å; P138-F158 HydrophobicContact CB-CE1 4.13Å; P138-F158 HydrophobicContact CB-CG 4.31Å; P138-F158 HydrophobicContact CG-CD1 4.01Å; P138-F158 HydrophobicContact CG-CE1 4.46Å; M142-F158 HydrophobicContact CG-CE2 3.94Å; M142-F158 HydrophobicContact CG-CZ 3.91Å; H154-F158 WeakPolarHBondContact O-CD2 3.43Å; H154-F158 WeakPolarHBondContact O-CE2 3.25Å; E156-F158 VanDerWaalsContact C-N 3.26Å; E156-F158 PolarHBondContact O-N 3.09Å; F158-Y160 VanDerWaalsContact C-N 3.26Å
159	S	97.6	Very high	96.6	Very high	90 Å²	90	49.7 Å²	49.7	63%	0.629	26%	0.262	S	S	*	.	G	3₁₀ helix	trans	-79.6	-5.8	169.2	-53.8	0	0	0	0	113.3	E156 V157	E156-S159 VanDerWaalsContact O-CB 3.27Å; E156-S159 WeakPolarHBondContact O-CB 3.49Å; E156-S159 PolarHBondContact O-N 2.9Å; E156-S159 PolarHBondContact O-OG 2.89Å; V157-S159 PolarHBondContact O-N 2.94Å; V157-S159 VanDerWaalsContact O-N 3.15Å
160	Y	97.8	Very high	96.7	Very high	46 Å²	46	49.9 Å²	49.9	18%	0.18	27%	0.266	C	S	.	.			trans	-123	97.3	-175.4	-63.7	-91.4	0	0	0	110.3	E156 V157 F158 E162 A201 Y202	E156-Y160 HydrophobicContact CG-CE2 4.01Å; E156-Y160 WeakPolarHBondContact O-CD2 3.3Å; V157-Y160 PolarHBondContact O-N 2.84Å; F158-Y160 VanDerWaalsContact C-N 3.26Å; Y160-E162 PolarHBondContact O-N 2.8Å; Y160-A201 HydrophobicContact CD1-CB 4.35Å; Y160-A201 HydrophobicContact CE1-CB 3.7Å; Y160-Y202 HydrophobicContact CD1-CD2 4.2Å; Y160-Y202 AromaticContact CD2-CD2 3.4Å; Y160-Y202 HydrophobicContact CD2-CD2 3.4Å; Y160-Y202 AromaticContact CD2-CE2 3.54Å; Y160-Y202 HydrophobicContact CD2-CE2 3.54Å; Y160-Y202 AromaticContact CE2-CD2 3.94Å; Y160-Y202 HydrophobicContact CE2-CD2 3.94Å; Y160-Y202 AromaticContact CE2-CE2 3.91Å; Y160-Y202 HydrophobicContact CE2-CE2 3.91Å; Y160-Y202 AromaticContact CG-CD2 3.57Å; Y160-Y202 HydrophobicContact CG-CD2 3.57Å; Y160-Y202 HydrophobicContact CG-CE2 4.2Å; Y160-Y202 HydrophobicContact CG-CG 4.47Å
161	P	97.1	Very high	96.7	Very high	110 Å²	110	58.9 Å²	58.9	71%	0.714	30%	0.304	S	S	*	.	S	Bend	trans	-63	-24.4	-178.4	-25.3	35.3	0	0	0	114.6
162	E	97.4	Very high	96.9	Very high	86 Å²	86	56.2 Å²	56.2	40%	0.402	28%	0.281	S	S	.	.			trans	-114.2	110.2	175.9	-61.7	179.5	126.1	0	0	110.4	P135 Y160 Y164 K225	P135-E162 HydrophobicContact CB-CB 3.77Å; P135-E162 HydrophobicContact CB-CG 4.17Å; P135-E162 HydrophobicContact CG-CB 4.29Å; P135-E162 HydrophobicContact CG-CG 4.13Å; Y160-E162 PolarHBondContact O-N 2.8Å; E162-Y164 HydrophobicContact CB-CD2 4.19Å; E162-Y164 HydrophobicContact CB-CE2 3.55Å; E162-Y164 HydrophobicContact CG-CE2 4.28Å; E162-Y164 PolarHBondContact OE1-OH 3.24Å; E162-K225 IonicContact OE1-NZ 2.74Å; E162-K225 PolarHBondContact OE1-NZ 2.81Å; E162-K225 IonicContact OE2-NZ 2.75Å; E162-K225 PolarHBondContact OE2-NZ 2.72Å
163	V	98	Very high	96.8	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	29%	0.292	C	S	.	.	B	Isolated β-bridge	trans	-101.6	113.1	173.6	177.6	0	0	0	0	109.5	M136 A141 V157 I166 Y202	M136-V163 HydrophobicContact CB-CB 4.26Å; M136-V163 HydrophobicContact CE-CB 4.37Å; M136-V163 HydrophobicContact CE-CG1 3.63Å; M136-V163 PolarHBondContact N-O 3.22Å; M136-V163 PolarHBondContact O-N 2.87Å; A141-V163 HydrophobicContact CB-CB 4.29Å; A141-V163 HydrophobicContact CB-CG1 3.95Å; A141-V163 HydrophobicContact CB-CG2 4.22Å; V157-V163 HydrophobicContact CG2-CG2 3.77Å; V163-I166 HydrophobicContact CG1-CG2 3.62Å; V163-Y202 HydrophobicContact CG1-CD1 4.23Å; V163-Y202 HydrophobicContact CG2-CG 4.49Å
164	Y	98.1	Very high	96.6	Very high	35 Å²	35	65.7 Å²	65.7	14%	0.137	33%	0.326	C	S	.	.			trans	-103	-29.9	177.3	-67.1	-87.1	0	0	0	113.1	P133 P135 E162 Y202 R203 K225	P133-Y164 HydrophobicContact CB-CD1 4.45Å; P135-Y164 HydrophobicContact CB-CD1 4.24Å; P135-Y164 HydrophobicContact CB-CD2 4.41Å; P135-Y164 HydrophobicContact CB-CE1 3.79Å; P135-Y164 HydrophobicContact CB-CE2 4Å; P135-Y164 HydrophobicContact CG-CE1 4.17Å; E162-Y164 HydrophobicContact CB-CD2 4.19Å; E162-Y164 HydrophobicContact CB-CE2 3.55Å; E162-Y164 HydrophobicContact CG-CE2 4.28Å; E162-Y164 PolarHBondContact OE1-OH 3.24Å; Y164-Y202 PolarHBondContact N-O 3.11Å; Y164-R203 HydrophobicContact CD2-CB 4.4Å; Y164-R203 HydrophobicContact CD2-CG 4.35Å; Y164-K225 HydrophobicContact CD1-CB 3.96Å; Y164-K225 HydrophobicContact CD1-CG 4.39Å; Y164-K225 HydrophobicContact CD2-CB 4.07Å; Y164-K225 HydrophobicContact CD2-CD 4.48Å; Y164-K225 HydrophobicContact CE1-CB 3.82Å; Y164-K225 HydrophobicContact CE1-CD 4.34Å; Y164-K225 HydrophobicContact CE1-CG 3.75Å; Y164-K225 HydrophobicContact CE2-CB 3.91Å; Y164-K225 HydrophobicContact CE2-CD 3.59Å; Y164-K225 HydrophobicContact CE2-CG 3.87Å; Y164-K225 HydrophobicContact CG-CB 4.09Å; Y164-K225 VanDerWaalsContact CZ-CG 3.45Å; Y164-K225 WeakPolarHBondContact OH-CD 3.43Å; Y164-K225 WeakPolarHBondContact OH-CE 3.37Å; Y164-K225 PolarHBondContact OH-NZ 2.86Å
165	F	98.1	Very high	96.3	Very high	26 Å²	26	64.3 Å²	64.3	11%	0.114	32%	0.322	C	S	.	.			trans	-152.6	142.1	-176.7	-177.4	-106	0	0	0	111.4	G167 H197 Q199 Y202 E205 H224	F165-G167 VanDerWaalsContact CE1-N 3.34Å; F165-H197 WeakPolarHBondContact CZ-O 3.36Å; F165-Q199 HydrophobicContact CD1-CB 3.8Å; F165-Q199 HydrophobicContact CE1-CB 4.24Å; F165-Y202 PolarHBondContact N-O 2.88Å; F165-Y202 CarbonylContact O-C 3.43Å; F165-Y202 WeakPolarHBondContact O-CA 3.38Å; F165-E205 HydrophobicContact CD1-CB 3.93Å; F165-E205 HydrophobicContact CE1-CB 3.55Å; F165-E205 HydrophobicContact CE1-CG 3.67Å; F165-E205 HydrophobicContact CE2-CB 4.37Å; F165-E205 HydrophobicContact CE2-CG 4.34Å; F165-E205 HydrophobicContact CG-CB 4.49Å; F165-E205 HydrophobicContact CZ-CB 3.79Å; F165-E205 HydrophobicContact CZ-CG 3.55Å; F165-H224 HydrophobicContact CB-CB 4.1Å; F165-H224 AromaticContact CD2-CD2 3.59Å; F165-H224 AromaticContact CD2-CE1 3.77Å; F165-H224 AromaticContact CD2-NE2 3.32Å; F165-H224 VanDerWaalsContact CD2-NE2 3.32Å; F165-H224 WeakPolarHBondContact CD2-NE2 3.36Å; F165-H224 AromaticContact CE2-NE2 3.67Å; F165-H224 AromaticContact CG-CD2 3.52Å; F165-H224 AromaticContact CG-NE2 3.72Å
166	I	97.3	Very high	96.1	Very high	4 Å²	4	62.6 Å²	62.6	2%	0.021	32%	0.321	C	S	.	.			trans	-123.1	-10.4	-174.4	59.4	165.2	0	0	0	114.8	M136 Y145 L149 V163 Q168 K172 Y202	M136-I166 HydrophobicContact CE-CG2 4.3Å; Y145-I166 HydrophobicContact CD1-CD1 3.53Å; Y145-I166 HydrophobicContact CD2-CD1 3.49Å; Y145-I166 VanDerWaalsContact CD2-CD1 3.49Å; Y145-I166 HydrophobicContact CE1-CD1 4.1Å; Y145-I166 HydrophobicContact CE2-CD1 4.06Å; Y145-I166 HydrophobicContact CG-CD1 3.18Å; L149-I166 HydrophobicContact CD2-CB 4.19Å; L149-I166 HydrophobicContact CD2-CG2 4.49Å; V163-I166 HydrophobicContact CG1-CG2 3.62Å; I166-Q168 HydrophobicContact CD1-CB 3.81Å; I166-Q168 HydrophobicContact CG1-CB 4.06Å; I166-K172 VanDerWaalsContact O-CE 3.3Å; I166-K172 WeakPolarHBondContact O-CE 3.49Å; I166-K172 PolarHBondContact O-NZ 2.68Å; I166-Y202 HydrophobicContact CG2-CD1 4.29Å
167	G	97	Very high	95.7	Very high	1 Å²	1	67.4 Å²	67.4	1%	0.01	35%	0.347	C	S	.	.			trans	66.3	38.9	-178.2	0	0	0	0	0	114.3	F165 N169 A170 K172 H197	F165-G167 VanDerWaalsContact CE1-N 3.34Å; G167-N169 PolarHBondContact O-N 2.8Å; G167-A170 VanDerWaalsContact O-CB 3.27Å; G167-A170 WeakPolarHBondContact O-CB 3.49Å; G167-A170 PolarHBondContact O-N 3.17Å; G167-K172 WeakPolarHBondContact O-CE 3.32Å; G167-H197 VanDerWaalsContact CA-O 3.31Å; G167-H197 WeakPolarHBondContact CA-O 3.48Å
168	Q	94.8	Very high	95.2	Very high	70 Å²	70	71.3 Å²	71.3	33%	0.327	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-13.3	-170.3	67.3	-84.4	24.1	0	0	116.1	K148 I166	K148-Q168 HydrophobicContact CB-CB 4.01Å; K148-Q168 HydrophobicContact CG-CB 4.24Å; I166-Q168 HydrophobicContact CD1-CB 3.81Å; I166-Q168 HydrophobicContact CG1-CB 4.06Å
169	N	95.3	Very high	94.9	Very high	142 Å²	142	68.4 Å²	68.4	76%	0.759	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.5	-0.3	178.1	-63.8	-23.7	0	0	0	112.8	G167	G167-N169 PolarHBondContact O-N 2.8Å
170	A	96.8	Very high	94.6	Very high	17 Å²	17	67.7 Å²	67.7	14%	0.14	38%	0.381	C	S	.	.	S	Bend	trans	-74.9	150.4	-178.9	0	0	0	0	0	111.9	G167 K172 V195 D198	G167-A170 VanDerWaalsContact O-CB 3.27Å; G167-A170 WeakPolarHBondContact O-CB 3.49Å; G167-A170 PolarHBondContact O-N 3.17Å; A170-K172 HydrophobicContact CB-CG 4.19Å; A170-K172 PolarHBondContact O-N 2.77Å; A170-V195 HydrophobicContact CB-CG1 4.16Å; A170-D198 HydrophobicContact CB-CB 3.69Å
171	K	96.9	Very high	94.5	Very high	198 Å²	198	69.1 Å²	69.1	86%	0.861	39%	0.392	S	S	*	.			trans	-80.8	65.7	169.8	-66.5	-174.3	179	-177.7	0	109.8	V195	K171-V195 WeakPolarHBondContact O-CG1 3.29Å
172	K	96.6	Very high	94.4	Very high	32 Å²	32	65.1 Å²	65.1	14%	0.139	37%	0.365	C	S	.	.			trans	-51	147	-175.6	-70.3	176.3	169.7	-66.6	0	112.4	K148 E153 I166 G167 A170 D198	K148-K172 WeakPolarHBondContact O-CE 3.48Å; E153-K172 IonicContact OE1-NZ 3.13Å; E153-K172 PolarHBondContact OE1-NZ 3Å; E153-K172 WeakPolarHBondContact OE2-CD 3.45Å; E153-K172 IonicContact OE2-NZ 2.68Å; E153-K172 PolarHBondContact OE2-NZ 3.08Å; I166-K172 VanDerWaalsContact O-CE 3.3Å; I166-K172 WeakPolarHBondContact O-CE 3.49Å; I166-K172 PolarHBondContact O-NZ 2.68Å; G167-K172 WeakPolarHBondContact O-CE 3.32Å; A170-K172 HydrophobicContact CB-CG 4.19Å; A170-K172 PolarHBondContact O-N 2.77Å; K172-D198 IonicContact NZ-OD1 3.31Å; K172-D198 PolarHBondContact NZ-OD1 2.89Å
173	R	94.9	Very high	94.4	Very high	92 Å²	92	61.7 Å²	61.7	35%	0.347	35%	0.351	S	S	.	.			trans	-84.5	126.4	169.8	-63.3	-176.7	67.3	77.9	-2.2	109.5	G175 G184 Y185 V195	R173-G175 PolarHBondContact O-N 3Å; R173-G184 VanDerWaalsContact CZ-O 3.23Å; R173-G184 PolarHBondContact NE-O 2.77Å; R173-G184 PolarHBondContact NH2-O 2.84Å; R173-Y185 HydrophobicContact CB-CD1 4.18Å; R173-Y185 HydrophobicContact CB-CE1 3.95Å; R173-Y185 PolarHBondContact O-OH 2.86Å; R173-V195 HydrophobicContact CG-CG2 3.96Å
174	N	91.6	Very high	94.3	Very high	135 Å²	135	62.9 Å²	62.9	72%	0.722	36%	0.362	S	S	*	.			trans	-75	87.7	174.6	-69.1	-18.8	0	0	0	109.4
175	G	90.2	Very high	94.3	Very high	10 Å²	10	61.3 Å²	61.3	10%	0.103	36%	0.356	C	S	.	.			trans	-66	138.3	177.4	0	0	0	0	0	112	R173 S183 Y185	R173-G175 PolarHBondContact O-N 3Å; G175-S183 CarbonylContact C-O 3.59Å; G175-S183 VanDerWaalsContact CA-O 3.26Å; G175-S183 WeakPolarHBondContact CA-O 3.02Å; G175-Y185 WeakPolarHBondContact CA-OH 3.41Å; G175-Y185 PolarHBondContact N-OH 3.21Å
176	V	91.5	Very high	94.2	Very high	93 Å²	93	60.5 Å²	60.5	56%	0.564	35%	0.353	S	S	*	.			trans	-119.6	108.9	177.7	179.8	0	0	0	0	108.7	G178 A179 S183	V176-G178 PolarHBondContact O-N 3.1Å; V176-A179 HydrophobicContact CB-CB 3.97Å; V176-A179 HydrophobicContact CG1-CB 4.19Å; V176-A179 WeakPolarHBondContact O-CB 3.43Å; V176-A179 PolarHBondContact O-N 3.02Å; V176-S183 PolarHBondContact N-O 3.04Å; V176-S183 VanDerWaalsContact O-CA 3.24Å; V176-S183 WeakPolarHBondContact O-CA 3.42Å; V176-S183 WeakPolarHBondContact O-CB 3.42Å; V176-S183 PolarHBondContact O-OG 2.89Å
177	L	87.8	Confident	94.2	Very high	124 Å²	124	62.1 Å²	62.1	65%	0.649	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.9	125.5	-176.4	-79.4	163.8	0	0	0	111.6	F152 A179	F152-L177 HydrophobicContact CD2-CD2 4.08Å; F152-L177 HydrophobicContact CD2-CG 3.92Å; F152-L177 HydrophobicContact CE2-CD2 3.47Å; F152-L177 VanDerWaalsContact CE2-CD2 3.47Å; F152-L177 HydrophobicContact CE2-CG 3.82Å; F152-L177 HydrophobicContact CZ-CD2 4.11Å; L177-A179 VanDerWaalsContact C-N 3.3Å; L177-A179 PolarHBondContact O-N 3.13Å
178	G	86	Confident	94.1	Very high	81 Å²	81	70.3 Å²	70.3	84%	0.835	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.3	-4.3	179.9	0	0	0	0	0	115.3	V176	V176-G178 PolarHBondContact O-N 3.1Å
179	A	91.3	Very high	94	Very high	44 Å²	44	71.4 Å²	71.4	36%	0.364	41%	0.405	S	S	.	.			trans	-69.2	161.2	172.2	0	0	0	0	0	112.2	V176 L177 S183	V176-A179 HydrophobicContact CB-CB 3.97Å; V176-A179 HydrophobicContact CG1-CB 4.19Å; V176-A179 WeakPolarHBondContact O-CB 3.43Å; V176-A179 PolarHBondContact O-N 3.02Å; L177-A179 VanDerWaalsContact C-N 3.3Å; L177-A179 PolarHBondContact O-N 3.13Å; A179-S183 WeakPolarHBondContact O-CA 3.32Å; A179-S183 PolarHBondContact O-N 2.88Å
180	A	93.2	Very high	94	Very high	75 Å²	75	65.3 Å²	65.3	62%	0.62	38%	0.375	S	S	*	.	H	α-helix	trans	-56.2	163.4	176.7	0	0	0	0	0	112.7	N182 G184	A180-N182 PolarHBondContact O-N 2.82Å; A180-G184 PolarHBondContact O-N 3.13Å
181	N	94.6	Very high	94.1	Very high	77 Å²	77	65.1 Å²	65.1	41%	0.412	37%	0.373	S	S	.	.	H	α-helix	trans	51.1	53.5	179.2	-60	75	0	0	0	112.2	G184 Y185 D186 D187	N181-G184 CarbonylContact O-C 3.59Å; N181-G184 WeakPolarHBondContact O-CA 3.49Å; N181-G184 PolarHBondContact O-N 2.94Å; N181-Y185 PolarHBondContact O-N 3.24Å; N181-Y185 VanDerWaalsContact O-N 3.1Å; N181-D186 HydrophobicContact CB-CB 4.43Å; N181-D186 WeakPolarHBondContact CB-O 3.26Å; N181-D186 PolarHBondContact O-N 3.2Å; N181-D187 PolarHBondContact ND2-O 3.28Å
182	N	96.1	Very high	94.1	Very high	26 Å²	26	56.1 Å²	56.1	14%	0.139	33%	0.334	C	S	.	.	H	α-helix	trans	55.6	59	177.7	-171.7	25.2	0	0	0	112.6	A180 G184 Y185 D186 R276 N277	A180-N182 PolarHBondContact O-N 2.82Å; N182-G184 PolarHBondContact O-N 3.31Å; N182-G184 VanDerWaalsContact O-N 3.14Å; N182-Y185 WeakPolarHBondContact O-CB 3.28Å; N182-Y185 WeakPolarHBondContact O-CD2 3.35Å; N182-Y185 PolarHBondContact O-N 2.75Å; N182-D186 HydrophobicContact CB-CB 3.96Å; N182-D186 VanDerWaalsContact CB-OD1 3.27Å; N182-D186 WeakPolarHBondContact CB-OD1 3.39Å; N182-D186 VanDerWaalsContact CB-OD2 3.28Å; N182-D186 WeakPolarHBondContact CB-OD2 3.35Å; N182-D186 PolarHBondContact ND2-OD1 2.74Å; N182-R276 PolarHBondContact ND2-O 2.8Å; N182-N277 PolarHBondContact OD1-ND2 2.85Å
183	S	95.8	Very high	94.1	Very high	14 Å²	14	57 Å²	57	10%	0.098	34%	0.339	C	S	.	.	H	α-helix	trans	59.2	21	-174.3	-51.3	0	0	0	0	114.1	G175 V176 A179	G175-S183 CarbonylContact C-O 3.59Å; G175-S183 VanDerWaalsContact CA-O 3.26Å; G175-S183 WeakPolarHBondContact CA-O 3.02Å; V176-S183 PolarHBondContact N-O 3.04Å; V176-S183 VanDerWaalsContact O-CA 3.24Å; V176-S183 WeakPolarHBondContact O-CA 3.42Å; V176-S183 WeakPolarHBondContact O-CB 3.42Å; V176-S183 PolarHBondContact O-OG 2.89Å; A179-S183 WeakPolarHBondContact O-CA 3.32Å; A179-S183 PolarHBondContact O-N 2.88Å
184	G	95.9	Very high	94.2	Very high	24 Å²	24	54 Å²	54	25%	0.247	33%	0.329	C	S	.	.	H	α-helix	trans	85	9.3	-174.4	0	0	0	0	0	115.7	R173 A180 N181 N182	R173-G184 VanDerWaalsContact CZ-O 3.23Å; R173-G184 PolarHBondContact NE-O 2.77Å; R173-G184 PolarHBondContact NH2-O 2.84Å; A180-G184 PolarHBondContact O-N 3.13Å; N181-G184 CarbonylContact O-C 3.59Å; N181-G184 WeakPolarHBondContact O-CA 3.49Å; N181-G184 PolarHBondContact O-N 2.94Å; N182-G184 PolarHBondContact O-N 3.31Å; N182-G184 VanDerWaalsContact O-N 3.14Å
185	Y	97.7	Very high	94.5	Very high	2 Å²	2	48.2 Å²	48.2	1%	0.008	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-20.4	176.8	-72.3	-67.2	0	0	0	114.7	F152 R173 G175 N181 N182 Y192 I193 R276	F152-Y185 WeakPolarHBondContact CB-OH 3.38Å; F152-Y185 AromaticContact CD1-CE2 3.87Å; F152-Y185 HydrophobicContact CD1-CE2 3.87Å; F152-Y185 AromaticContact CD2-CE2 3.89Å; F152-Y185 HydrophobicContact CD2-CE2 3.89Å; F152-Y185 AromaticContact CE1-CE2 3.86Å; F152-Y185 HydrophobicContact CE1-CE2 3.86Å; F152-Y185 AromaticContact CE2-CE2 3.87Å; F152-Y185 HydrophobicContact CE2-CE2 3.87Å; F152-Y185 AromaticContact CG-CE2 3.89Å; F152-Y185 HydrophobicContact CG-CE2 3.89Å; F152-Y185 WeakPolarHBondContact CG-OH 3.43Å; F152-Y185 HydrophobicContact CZ-CD2 4.49Å; F152-Y185 AromaticContact CZ-CE2 3.86Å; F152-Y185 HydrophobicContact CZ-CE2 3.86Å; R173-Y185 HydrophobicContact CB-CD1 4.18Å; R173-Y185 HydrophobicContact CB-CE1 3.95Å; R173-Y185 PolarHBondContact O-OH 2.86Å; G175-Y185 WeakPolarHBondContact CA-OH 3.41Å; G175-Y185 PolarHBondContact N-OH 3.21Å; N181-Y185 PolarHBondContact O-N 3.24Å; N181-Y185 VanDerWaalsContact O-N 3.1Å; N182-Y185 WeakPolarHBondContact O-CB 3.28Å; N182-Y185 WeakPolarHBondContact O-CD2 3.35Å; N182-Y185 PolarHBondContact O-N 2.75Å; Y185-Y192 AromaticContact CD1-CE2 3.99Å; Y185-Y192 HydrophobicContact CD1-CE2 3.99Å; Y185-Y192 HydrophobicContact CG-CE2 4.12Å; Y185-I193 WeakPolarHBondContact O-CB 3.28Å; Y185-I193 WeakPolarHBondContact O-CG1 3.27Å; Y185-I193 PolarHBondContact O-N 2.62Å; Y185-R276 VanDerWaalsContact CE1-NH1 3.3Å
186	D	97.8	Very high	94.9	Very high	9 Å²	9	51.5 Å²	51.5	5%	0.048	32%	0.318	C	S	.	.	B	Isolated β-bridge	trans	-100.3	156.3	-176.6	-66.1	10.5	0	0	0	112	N181 N182 S191 I193 N237 H278	N181-D186 HydrophobicContact CB-CB 4.43Å; N181-D186 WeakPolarHBondContact CB-O 3.26Å; N181-D186 PolarHBondContact O-N 3.2Å; N182-D186 HydrophobicContact CB-CB 3.96Å; N182-D186 VanDerWaalsContact CB-OD1 3.27Å; N182-D186 WeakPolarHBondContact CB-OD1 3.39Å; N182-D186 VanDerWaalsContact CB-OD2 3.28Å; N182-D186 WeakPolarHBondContact CB-OD2 3.35Å; N182-D186 PolarHBondContact ND2-OD1 2.74Å; D186-S191 WeakPolarHBondContact CA-O 3.35Å; D186-I193 VanDerWaalsContact C-CD1 3.49Å; D186-I193 VanDerWaalsContact O-CD1 3.29Å; D186-I193 WeakPolarHBondContact O-CD1 3.3Å; D186-N237 VanDerWaalsContact OD2-CB 3.32Å; D186-N237 WeakPolarHBondContact OD2-CB 3.37Å; D186-N237 PolarHBondContact OD2-ND2 2.74Å; D186-H278 IonicContact OD1-CE1 2.7Å; D186-H278 PolarHBondContact OD1-CE1 3.01Å; D186-H278 IonicContact OD1-NE2 2.86Å; D186-H278 PolarHBondContact OD1-NE2 2.94Å; D186-H278 IonicContact OD2-CE1 3.11Å; D186-H278 IonicContact OD2-NE2 2.62Å
187	D	95.8	Very high	95.2	Very high	39 Å²	39	51.5 Å²	51.5	21%	0.209	31%	0.312	C	S	.	.			trans	-74.4	178.5	161.3	59.9	30.4	0	0	0	111.8	N181 Q189 G190 S191 I193	N181-D187 PolarHBondContact ND2-O 3.28Å; D187-Q189 PolarHBondContact O-N 3.45Å; D187-Q189 VanDerWaalsContact O-N 3.13Å; D187-Q189 VanDerWaalsContact OD1-CA 3.3Å; D187-Q189 WeakPolarHBondContact OD1-CA 3.36Å; D187-Q189 VanDerWaalsContact OD1-CB 3.32Å; D187-Q189 WeakPolarHBondContact OD1-CB 3.49Å; D187-Q189 PolarHBondContact OD1-N 3.07Å; D187-G190 PolarHBondContact O-N 3.47Å; D187-G190 VanDerWaalsContact O-N 3.11Å; D187-G190 PolarHBondContact OD1-N 2.83Å; D187-S191 PolarHBondContact N-O 2.94Å; D187-S191 PolarHBondContact OD1-N 2.94Å; D187-S191 PolarHBondContact OD1-OG 3.3Å; D187-S191 WeakPolarHBondContact OD2-CB 3.48Å; D187-S191 PolarHBondContact OD2-OG 3.03Å; D187-S191 VanDerWaalsContact OD2-OG 3.05Å; D187-I193 HydrophobicContact CB-CG1 4.32Å
188	E	95.1	Very high	95.7	Very high	172 Å²	172	45.8 Å²	45.8	80%	0.804	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-18	174.4	-69.4	173.9	179.9	0	0	113.5
189	Q	93.8	Very high	96.3	Very high	94 Å²	94	41.9 Å²	41.9	44%	0.439	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95	-6.3	179.6	-67.2	80.3	52.6	0	0	112.6	D187 R236	D187-Q189 PolarHBondContact O-N 3.45Å; D187-Q189 VanDerWaalsContact O-N 3.13Å; D187-Q189 VanDerWaalsContact OD1-CA 3.3Å; D187-Q189 WeakPolarHBondContact OD1-CA 3.36Å; D187-Q189 VanDerWaalsContact OD1-CB 3.32Å; D187-Q189 WeakPolarHBondContact OD1-CB 3.49Å; D187-Q189 PolarHBondContact OD1-N 3.07Å; Q189-R236 PolarHBondContact O-NE 3.09Å; Q189-R236 PolarHBondContact O-NH2 2.83Å; Q189-R236 VanDerWaalsContact O-NH2 3.12Å
190	G	95.7	Very high	96.6	Very high	13 Å²	13	39.9 Å²	39.9	13%	0.134	23%	0.225	C	C	.	.	S	Bend	trans	82.9	21.1	-176	0	0	0	0	0	114	D187 R236 N237	D187-G190 PolarHBondContact O-N 3.47Å; D187-G190 VanDerWaalsContact O-N 3.11Å; D187-G190 PolarHBondContact OD1-N 2.83Å; G190-R236 WeakPolarHBondContact O-CG 3.45Å; G190-N237 WeakPolarHBondContact O-CB 3.45Å; G190-N237 PolarHBondContact O-N 2.71Å
191	S	97.1	Very high	96.9	Very high	13 Å²	13	36.9 Å²	36.9	9%	0.091	20%	0.2	C	C	.	.			trans	-95.3	137.4	173.7	-22.9	0	0	0	0	110.4	D186 D187 I193	D186-S191 WeakPolarHBondContact CA-O 3.35Å; D187-S191 PolarHBondContact N-O 2.94Å; D187-S191 PolarHBondContact OD1-N 2.94Å; D187-S191 PolarHBondContact OD1-OG 3.3Å; D187-S191 WeakPolarHBondContact OD2-CB 3.48Å; D187-S191 PolarHBondContact OD2-OG 3.03Å; D187-S191 VanDerWaalsContact OD2-OG 3.05Å; S191-I193 PolarHBondContact O-N 2.99Å
192	Y	98	Very high	97	Very high	9 Å²	9	33.2 Å²	33.2	4%	0.035	18%	0.181	C	C	.	.	B	Isolated β-bridge	trans	-59.8	128.4	178.3	-167.7	-106	0	0	0	112.1	Y185 Q194 I200 M234 F275 R276 H278	Y185-Y192 AromaticContact CD1-CE2 3.99Å; Y185-Y192 HydrophobicContact CD1-CE2 3.99Å; Y185-Y192 HydrophobicContact CG-CE2 4.12Å; Y192-Q194 PolarHBondContact O-N 3.46Å; Y192-I200 HydrophobicContact CD1-CD1 4.42Å; Y192-I200 HydrophobicContact CE1-CD1 3.74Å; Y192-M234 HydrophobicContact CD1-CE 3.6Å; Y192-M234 HydrophobicContact CD1-SD 3.86Å; Y192-M234 HydrophobicContact CD2-CE 4.03Å; Y192-M234 HydrophobicContact CE1-CE 4.13Å; Y192-M234 HydrophobicContact CE1-SD 4.45Å; Y192-M234 HydrophobicContact CG-CE 3.54Å; Y192-M234 HydrophobicContact CG-SD 4.29Å; Y192-F275 HydrophobicContact CE2-CE1 4.38Å; Y192-R276 HydrophobicContact CE2-CB 4.22Å; Y192-R276 PolarHBondContact OH-NH1 3.05Å; Y192-H278 WeakPolarHBondContact CB-NE2 3.33Å; Y192-H278 AromaticContact CD2-CD2 3.51Å; Y192-H278 AromaticContact CD2-NE2 3.47Å; Y192-H278 WeakPolarHBondContact CD2-NE2 3.47Å; Y192-H278 AromaticContact CG-CD2 3.98Å; Y192-H278 AromaticContact CG-NE2 3.91Å; Y192-H278 PolarHBondContact N-CE1 3.24Å
193	I	97.4	Very high	97.2	Very high	50 Å²	50	33.4 Å²	33.4	26%	0.256	18%	0.18	S	C	.	.			trans	-78.2	93.4	176.4	-60.1	171.6	0	0	0	109	Y185 D186 D187 S191 V195	Y185-I193 WeakPolarHBondContact O-CB 3.28Å; Y185-I193 WeakPolarHBondContact O-CG1 3.27Å; Y185-I193 PolarHBondContact O-N 2.62Å; D186-I193 VanDerWaalsContact C-CD1 3.49Å; D186-I193 VanDerWaalsContact O-CD1 3.29Å; D186-I193 WeakPolarHBondContact O-CD1 3.3Å; D187-I193 HydrophobicContact CB-CG1 4.32Å; S191-I193 PolarHBondContact O-N 2.99Å; I193-V195 PolarHBondContact O-N 3.38Å
194	Q	97.1	Very high	97.3	Very high	29 Å²	29	32.9 Å²	32.9	14%	0.136	18%	0.176	C	C	.	.			trans	-57.6	126.9	178.6	-60.9	-64.6	-24.7	0	0	112.2	Y192 V209 V219 M234	Y192-Q194 PolarHBondContact O-N 3.46Å; Q194-V209 HydrophobicContact CG-CG2 4.39Å; Q194-V219 HydrophobicContact CG-CG1 4.05Å; Q194-M234 PolarHBondContact NE2-SD 2.87Å
195	V	97.9	Very high	97.4	Very high	15 Å²	15	33.4 Å²	33.4	9%	0.091	17%	0.171	C	C	.	.			trans	-111.1	119	171.4	178.7	0	0	0	0	108.5	A170 K171 R173 I193 D198	A170-V195 HydrophobicContact CB-CG1 4.16Å; K171-V195 WeakPolarHBondContact O-CG1 3.29Å; R173-V195 HydrophobicContact CG-CG2 3.96Å; I193-V195 PolarHBondContact O-N 3.38Å; V195-D198 HydrophobicContact CB-CB 3.76Å; V195-D198 HydrophobicContact CG1-CB 3.89Å; V195-D198 WeakPolarHBondContact O-CB 3.45Å; V195-D198 PolarHBondContact O-N 2.94Å
196	P	97.6	Very high	97.5	Very high	78 Å²	78	33.5 Å²	33.5	51%	0.506	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	139.7	175.4	-25.1	35.2	0	0	0	112.5	D198	P196-D198 PolarHBondContact O-N 3.47Å
197	H	98.2	Very high	97.5	Very high	93 Å²	93	35.2 Å²	35.2	43%	0.431	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.5	8.4	-174.6	-52.2	-74.9	0	0	0	115.8	F165 G167 E205 V206	F165-H197 WeakPolarHBondContact CZ-O 3.36Å; G167-H197 VanDerWaalsContact CA-O 3.31Å; G167-H197 WeakPolarHBondContact CA-O 3.48Å; H197-E205 IonicContact CE1-OE1 3.55Å; H197-E205 IonicContact CG-OE1 3.36Å; H197-E205 IonicContact ND1-OE1 2.82Å; H197-E205 PolarHBondContact ND1-OE1 2.8Å; H197-V206 PolarHBondContact N-O 2.89Å
198	D	98.4	Very high	97.5	Very high	4 Å²	4	38.4 Å²	38.4	2%	0.021	19%	0.193	C	C	.	.			trans	-80.9	163.4	171.7	-154.3	0.9	0	0	0	111.5	A170 K172 V195 P196 V206	A170-D198 HydrophobicContact CB-CB 3.69Å; K172-D198 IonicContact NZ-OD1 3.31Å; K172-D198 PolarHBondContact NZ-OD1 2.89Å; V195-D198 HydrophobicContact CB-CB 3.76Å; V195-D198 HydrophobicContact CG1-CB 3.89Å; V195-D198 WeakPolarHBondContact O-CB 3.45Å; V195-D198 PolarHBondContact O-N 2.94Å; P196-D198 PolarHBondContact O-N 3.47Å; D198-V206 PolarHBondContact O-N 3.21Å; D198-V206 VanDerWaalsContact O-N 3.09Å
199	Q	97.7	Very high	97.6	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	144	179.1	65	85	7.4	0	0	112.2	E153 F165 Y202 Y204 R276	E153-Q199 PolarHBondContact OE1-NE2 2.89Å; F165-Q199 HydrophobicContact CD1-CB 3.8Å; F165-Q199 HydrophobicContact CE1-CB 4.24Å; Q199-Y202 HydrophobicContact CG-CD1 4.39Å; Q199-Y204 CarbonylContact C-O 3.59Å; Q199-Y204 WeakPolarHBondContact CA-O 3.04Å; Q199-R276 VanDerWaalsContact NE2-NH2 3.19Å
200	I	98.5	Very high	97.7	Very high	2 Å²	2	31.7 Å²	31.7	1%	0.01	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	130.3	158.8	-57.1	-64.3	0	0	0	107.9	Y192 Y202 R203 Y204 V206 L232 M234 F273 F275	Y192-I200 HydrophobicContact CD1-CD1 4.42Å; Y192-I200 HydrophobicContact CE1-CD1 3.74Å; I200-Y202 PolarHBondContact O-N 2.99Å; I200-Y202 VanDerWaalsContact O-N 3.08Å; I200-R203 PolarHBondContact O-N 2.7Å; I200-R203 VanDerWaalsContact O-N 3.11Å; I200-Y204 PolarHBondContact N-O 3.48Å; I200-Y204 PolarHBondContact O-N 2.93Å; I200-V206 HydrophobicContact CD1-CG2 4.24Å; I200-V206 HydrophobicContact CG1-CG2 3.63Å; I200-L232 HydrophobicContact CB-CD2 4.08Å; I200-L232 HydrophobicContact CG1-CD2 3.97Å; I200-L232 HydrophobicContact CG2-CD2 4.05Å; I200-M234 HydrophobicContact CD1-CE 3.9Å; I200-M234 HydrophobicContact CD1-SD 3.74Å; I200-M234 HydrophobicContact CG1-SD 4.19Å; I200-F273 HydrophobicContact CG2-CE2 3.83Å; I200-F273 HydrophobicContact CG2-CZ 4.06Å; I200-F275 HydrophobicContact CB-CD1 4.48Å; I200-F275 HydrophobicContact CB-CE1 4.43Å; I200-F275 HydrophobicContact CD1-CD1 3.81Å; I200-F275 HydrophobicContact CD1-CE1 3.45Å; I200-F275 VanDerWaalsContact CD1-CE1 3.45Å; I200-F275 HydrophobicContact CD1-CZ 4.29Å; I200-F275 HydrophobicContact CG1-CE1 4.5Å; I200-F275 HydrophobicContact CG2-CB 4.18Å; I200-F275 HydrophobicContact CG2-CD1 3.78Å; I200-F275 HydrophobicContact CG2-CE1 4.22Å; I200-F275 HydrophobicContact CG2-CG 3.91Å
201	A	98.3	Very high	97.5	Very high	11 Å²	11	32 Å²	32	9%	0.091	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.4	34.1	-179.7	0	0	0	0	0	113.9	Y160 R203 F273 F275	Y160-A201 HydrophobicContact CD1-CB 4.35Å; Y160-A201 HydrophobicContact CE1-CB 3.7Å; A201-R203 PolarHBondContact O-N 2.84Å; A201-F273 HydrophobicContact CB-CD2 3.87Å; A201-F273 HydrophobicContact CB-CE2 3.5Å; A201-F273 HydrophobicContact CB-CZ 4.07Å; A201-F275 HydrophobicContact CB-CD2 4.13Å
202	Y	98.4	Very high	97.2	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.2	25	-177.9	-62.3	-90.4	0	0	0	115.2	L149 E153 E156 V157 Y160 V163 Y164 F165 I166 Q199 I200	L149-Y202 HydrophobicContact CD2-CE1 4.41Å; E153-Y202 WeakPolarHBondContact CB-OH 3.27Å; E153-Y202 PolarHBondContact O-OH 2.84Å; E156-Y202 HydrophobicContact CG-CE2 4.14Å; V157-Y202 WeakPolarHBondContact CA-OH 3.3Å; V157-Y202 HydrophobicContact CB-CE1 3.89Å; V157-Y202 HydrophobicContact CB-CE2 4.3Å; V157-Y202 HydrophobicContact CG2-CD1 4.05Å; V157-Y202 HydrophobicContact CG2-CE1 3.67Å; V157-Y202 HydrophobicContact CG2-CE2 4.48Å; V157-Y202 PolarHBondContact N-OH 3.08Å; Y160-Y202 HydrophobicContact CD1-CD2 4.2Å; Y160-Y202 AromaticContact CD2-CD2 3.4Å; Y160-Y202 HydrophobicContact CD2-CD2 3.4Å; Y160-Y202 AromaticContact CD2-CE2 3.54Å; Y160-Y202 HydrophobicContact CD2-CE2 3.54Å; Y160-Y202 AromaticContact CE2-CD2 3.94Å; Y160-Y202 HydrophobicContact CE2-CD2 3.94Å; Y160-Y202 AromaticContact CE2-CE2 3.91Å; Y160-Y202 HydrophobicContact CE2-CE2 3.91Å; Y160-Y202 AromaticContact CG-CD2 3.57Å; Y160-Y202 HydrophobicContact CG-CD2 3.57Å; Y160-Y202 HydrophobicContact CG-CE2 4.2Å; Y160-Y202 HydrophobicContact CG-CG 4.47Å; V163-Y202 HydrophobicContact CG1-CD1 4.23Å; V163-Y202 HydrophobicContact CG2-CG 4.49Å; Y164-Y202 PolarHBondContact N-O 3.11Å; F165-Y202 PolarHBondContact N-O 2.88Å; F165-Y202 CarbonylContact O-C 3.43Å; F165-Y202 WeakPolarHBondContact O-CA 3.38Å; I166-Y202 HydrophobicContact CG2-CD1 4.29Å; Q199-Y202 HydrophobicContact CG-CD1 4.39Å; I200-Y202 PolarHBondContact O-N 2.99Å; I200-Y202 VanDerWaalsContact O-N 3.08Å
203	R	98.4	Very high	96.7	Very high	31 Å²	31	38.7 Å²	38.7	12%	0.117	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-136.6	-37.4	-173.9	175.6	175.2	168.1	-174.7	-6.5	114.3	Y164 I200 A201 D223 H224 K225 E271	Y164-R203 HydrophobicContact CD2-CB 4.4Å; Y164-R203 HydrophobicContact CD2-CG 4.35Å; I200-R203 PolarHBondContact O-N 2.7Å; I200-R203 VanDerWaalsContact O-N 3.11Å; A201-R203 PolarHBondContact O-N 2.84Å; R203-D223 WeakPolarHBondContact CG-OD1 3.32Å; R203-D223 IonicContact CZ-OD1 2.72Å; R203-D223 IonicContact CZ-OD2 2.71Å; R203-D223 VanDerWaalsContact CZ-OD2 3.3Å; R203-D223 VanDerWaalsContact NE-CG 3.34Å; R203-D223 IonicContact NE-OD1 3.17Å; R203-D223 PolarHBondContact NE-OD1 2.88Å; R203-D223 IonicContact NE-OD2 3.77Å; R203-D223 PolarHBondContact NE-OD2 2.95Å; R203-D223 VanDerWaalsContact NE-OD2 3.09Å; R203-D223 IonicContact NH2-OD1 2.86Å; R203-D223 IonicContact NH2-OD2 3.55Å; R203-D223 PolarHBondContact NH2-OD2 2.98Å; R203-H224 PolarHBondContact O-N 2.8Å; R203-K225 HydrophobicContact CG-CB 4.14Å; R203-E271 IonicContact CZ-OE1 2.67Å; R203-E271 VanDerWaalsContact CZ-OE1 3.23Å; R203-E271 IonicContact NH1-OE1 2.75Å; R203-E271 PolarHBondContact NH1-OE1 3.3Å; R203-E271 IonicContact NH2-OE1 3.8Å; R203-E271 PolarHBondContact NH2-OE1 3Å
204	Y	98.8	Very high	96.2	Very high	3 Å²	3	40.3 Å²	40.3	1%	0.012	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	126.7	-173.9	-53.5	-82.9	0	0	0	110.8	Q199 I200 F222 D223 V230 F273 T282	Q199-Y204 CarbonylContact C-O 3.59Å; Q199-Y204 WeakPolarHBondContact CA-O 3.04Å; I200-Y204 PolarHBondContact N-O 3.48Å; I200-Y204 PolarHBondContact O-N 2.93Å; Y204-F222 WeakPolarHBondContact CA-O 3.46Å; Y204-D223 HydrophobicContact CD1-CB 3.79Å; Y204-D223 HydrophobicContact CE1-CB 3.72Å; Y204-D223 VanDerWaalsContact CE1-CG 3.46Å; Y204-D223 VanDerWaalsContact CE1-OD2 3.24Å; Y204-D223 WeakPolarHBondContact CE1-OD2 3.3Å; Y204-V230 HydrophobicContact CD1-CG2 4.01Å; Y204-V230 HydrophobicContact CE1-CG2 4.23Å; Y204-F273 HydrophobicContact CD2-CE1 4.19Å; Y204-F273 AromaticContact CD2-CZ 3.82Å; Y204-F273 HydrophobicContact CD2-CZ 3.82Å; Y204-F273 HydrophobicContact CE2-CD1 4.48Å; Y204-F273 AromaticContact CE2-CE1 3.44Å; Y204-F273 HydrophobicContact CE2-CE1 3.44Å; Y204-F273 VanDerWaalsContact CE2-CE1 3.44Å; Y204-F273 AromaticContact CE2-CZ 3.53Å; Y204-F273 HydrophobicContact CE2-CZ 3.53Å; Y204-T282 HydrophobicContact CD1-CG2 4.34Å; Y204-T282 HydrophobicContact CE1-CG2 3.75Å; Y204-T282 HydrophobicContact CE2-CG2 4.33Å
205	E	98.7	Very high	95.8	Very high	34 Å²	34	41.1 Å²	41.1	16%	0.159	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	124	170.7	-179.8	-178.4	163.6	0	0	110.2	F165 H197 L207 A221 F222 H224	F165-E205 HydrophobicContact CD1-CB 3.93Å; F165-E205 HydrophobicContact CE1-CB 3.55Å; F165-E205 HydrophobicContact CE1-CG 3.67Å; F165-E205 HydrophobicContact CE2-CB 4.37Å; F165-E205 HydrophobicContact CE2-CG 4.34Å; F165-E205 HydrophobicContact CG-CB 4.49Å; F165-E205 HydrophobicContact CZ-CB 3.79Å; F165-E205 HydrophobicContact CZ-CG 3.55Å; H197-E205 IonicContact CE1-OE1 3.55Å; H197-E205 IonicContact CG-OE1 3.36Å; H197-E205 IonicContact ND1-OE1 2.82Å; H197-E205 PolarHBondContact ND1-OE1 2.8Å; E205-L207 HydrophobicContact CG-CD2 4Å; E205-L207 PolarHBondContact O-N 3.42Å; E205-L207 WeakPolarHBondContact OE1-CD2 3.35Å; E205-A221 CarbonylContact O-C 3.44Å; E205-A221 WeakPolarHBondContact O-CA 3.42Å; E205-A221 VanDerWaalsContact O-CB 3.26Å; E205-A221 WeakPolarHBondContact O-CB 3.19Å; E205-F222 HydrophobicContact CB-CB 4.47Å; E205-F222 PolarHBondContact N-O 3.05Å; E205-F222 PolarHBondContact O-N 3.46Å; E205-H224 IonicContact OE2-CE1 2.79Å; E205-H224 IonicContact OE2-NE2 3.85Å; E205-H224 PolarHBondContact OE2-NE2 2.93Å
206	V	98.4	Very high	95.5	Very high	5 Å²	5	40.6 Å²	40.6	3%	0.03	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	114.5	177.7	179.4	0	0	0	0	110.5	H197 D198 I200 V219	H197-V206 PolarHBondContact N-O 2.89Å; D198-V206 PolarHBondContact O-N 3.21Å; D198-V206 VanDerWaalsContact O-N 3.09Å; I200-V206 HydrophobicContact CD1-CG2 4.24Å; I200-V206 HydrophobicContact CG1-CG2 3.63Å; V206-V219 HydrophobicContact CG1-CB 4.27Å; V206-V219 HydrophobicContact CG1-CG1 4.17Å; V206-V219 HydrophobicContact CG1-CG2 4.29Å
207	L	98.1	Very high	95.4	Very high	45 Å²	45	37.7 Å²	37.7	24%	0.236	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	-54.6	-178.8	-58.6	177.5	0	0	0	113.3	E205 K220 F222	E205-L207 HydrophobicContact CG-CD2 4Å; E205-L207 PolarHBondContact O-N 3.42Å; E205-L207 WeakPolarHBondContact OE1-CD2 3.35Å; L207-K220 WeakPolarHBondContact CB-O 3.47Å; L207-K220 HydrophobicContact CD1-CD 4.4Å; L207-K220 HydrophobicContact CD1-CG 4.46Å; L207-K220 PolarHBondContact N-O 2.96Å; L207-F222 HydrophobicContact CD1-CB 4.23Å
208	K	96.6	Very high	95.4	Very high	106 Å²	106	34.5 Å²	34.5	46%	0.461	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.2	136.5	-173.9	-177	170.6	-178.8	172.6	0	111.2	L72 I210 V219 K220	L72-K208 PolarHBondContact O-NZ 2.95Å; K208-I210 PolarHBondContact O-N 3.04Å; K208-V219 CarbonylContact O-C 3.43Å; K208-V219 WeakPolarHBondContact O-CA 3.42Å; K208-K220 PolarHBondContact N-O 3.33Å; K208-K220 PolarHBondContact O-N 3.11Å
209	V	96.5	Very high	95.4	Very high	52 Å²	52	34.3 Å²	34.3	32%	0.315	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67	125.6	169.5	-171.5	0	0	0	0	109.4	Q194 G211 K212 V219	Q194-V209 HydrophobicContact CG-CG2 4.39Å; V209-G211 WeakPolarHBondContact CG1-O 3.3Å; V209-K212 HydrophobicContact CG1-CD 4.38Å; V209-K212 HydrophobicContact CG1-CG 3.69Å; V209-V219 HydrophobicContact CG2-CG1 4.13Å
210	I	95.2	Very high	95.5	Very high	73 Å²	73	37.3 Å²	37.3	37%	0.374	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	-12.9	179	59.8	176.3	0	0	0	113	K208 V218 K220 A231 L285	K208-I210 PolarHBondContact O-N 3.04Å; I210-V218 HydrophobicContact CD1-CG1 4.03Å; I210-V218 HydrophobicContact CG1-CB 4.19Å; I210-V218 HydrophobicContact CG1-CG1 3.9Å; I210-V218 WeakPolarHBondContact CG1-O 3.44Å; I210-V218 PolarHBondContact N-O 3.05Å; I210-K220 HydrophobicContact CD1-CB 4.4Å; I210-K220 HydrophobicContact CG2-CB 3.81Å; I210-A231 HydrophobicContact CD1-CB 4.02Å; I210-L285 HydrophobicContact CD1-CD1 4.01Å
211	G	92.5	Very high	95.5	Very high	20 Å²	20	37.2 Å²	37.2	21%	0.206	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	149.6	170.5	0	0	0	0	0	112.3	V209 V218	V209-G211 WeakPolarHBondContact CG1-O 3.3Å; G211-V218 PolarHBondContact N-O 2.8Å; G211-V218 PolarHBondContact O-N 3.14Å
212	K	90.9	Very high	95.5	Very high	128 Å²	128	38.5 Å²	38.5	56%	0.557	21%	0.205	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-136.6	144.1	169.2	-63	-164.2	178	-164	0	108.9	V209 Q217	V209-K212 HydrophobicContact CG1-CD 4.38Å; V209-K212 HydrophobicContact CG1-CG 3.69Å; K212-Q217 HydrophobicContact CD-CG 4.39Å; K212-Q217 VanDerWaalsContact CE-OE1 3.24Å; K212-Q217 HydrophobicContact CG-CG 4.07Å
213	G	87.6	Confident	95.5	Very high	34 Å²	34	38.6 Å²	38.6	35%	0.351	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.5	-176.5	179.4	0	0	0	0	0	112.1	F215 G216	G213-F215 PolarHBondContact O-N 3.1Å; G213-G216 PolarHBondContact N-O 2.77Å; G213-G216 PolarHBondContact O-N 3.12Å; G213-G216 VanDerWaalsContact O-N 3.16Å; G213-G216 VanDerWaalsContact O-O 3.07Å
214	S	87.2	Confident	95.5	Very high	84 Å²	84	38.8 Å²	38.8	59%	0.587	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-33.6	177.5	48.3	0	0	0	0	112.9	G216 R236 F241	S214-G216 VanDerWaalsContact C-N 3.27Å; S214-G216 PolarHBondContact O-N 2.95Å; S214-R236 VanDerWaalsContact O-CD 3.3Å; S214-R236 WeakPolarHBondContact O-CD 3.5Å; S214-F241 WeakPolarHBondContact O-CE2 3.25Å; S214-F241 WeakPolarHBondContact O-CZ 3.34Å
215	F	87.4	Confident	95.4	Very high	46 Å²	46	41.9 Å²	41.9	20%	0.202	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-10.4	179.5	61.9	-106.6	0	0	0	115	G213 V218 K233 V235 R236 F241	G213-F215 PolarHBondContact O-N 3.1Å; F215-V218 HydrophobicContact CE2-CG2 3.95Å; F215-V218 HydrophobicContact CZ-CG2 4.23Å; F215-K233 HydrophobicContact CD2-CG 4.47Å; F215-K233 HydrophobicContact CE2-CG 4.28Å; F215-V235 WeakPolarHBondContact O-CA 3.35Å; F215-R236 WeakPolarHBondContact O-CB 3.27Å; F215-R236 PolarHBondContact O-N 3.16Å; F215-F241 HydrophobicContact CB-CD1 4.3Å; F215-F241 HydrophobicContact CB-CE1 4.48Å
216	G	92.7	Very high	95.3	Very high	3 Å²	3	43.6 Å²	43.6	3%	0.031	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	124.5	-141.1	-171.5	0	0	0	0	0	112.7	G213 S214	G213-G216 PolarHBondContact N-O 2.77Å; G213-G216 PolarHBondContact O-N 3.12Å; G213-G216 VanDerWaalsContact O-N 3.16Å; G213-G216 VanDerWaalsContact O-O 3.07Å; S214-G216 VanDerWaalsContact C-N 3.27Å; S214-G216 PolarHBondContact O-N 2.95Å
217	Q	95.7	Very high	95.3	Very high	17 Å²	17	48 Å²	48	8%	0.079	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	152.2	-172.1	-53.5	-170.6	30.9	0	0	111.8	K212 M234	K212-Q217 HydrophobicContact CD-CG 4.39Å; K212-Q217 VanDerWaalsContact CE-OE1 3.24Å; K212-Q217 HydrophobicContact CG-CG 4.07Å; Q217-M234 PolarHBondContact N-O 2.85Å; Q217-M234 VanDerWaalsContact N-O 3.13Å; Q217-M234 PolarHBondContact O-N 2.93Å
218	V	97.9	Very high	95.2	Very high	26 Å²	26	49.2 Å²	49.2	16%	0.158	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	126.5	171.1	-168.9	0	0	0	0	108.7	I210 G211 F215 A231 L232 K233	I210-V218 HydrophobicContact CD1-CG1 4.03Å; I210-V218 HydrophobicContact CG1-CB 4.19Å; I210-V218 HydrophobicContact CG1-CG1 3.9Å; I210-V218 WeakPolarHBondContact CG1-O 3.44Å; I210-V218 PolarHBondContact N-O 3.05Å; G211-V218 PolarHBondContact N-O 2.8Å; G211-V218 PolarHBondContact O-N 3.14Å; F215-V218 HydrophobicContact CE2-CG2 3.95Å; F215-V218 HydrophobicContact CZ-CG2 4.23Å; V218-A231 HydrophobicContact CG1-CB 4.21Å; V218-L232 CarbonylContact C-O 3.57Å; V218-L232 WeakPolarHBondContact CA-O 3.38Å; V218-K233 HydrophobicContact CG2-CB 4.23Å; V218-K233 HydrophobicContact CG2-CG 4.11Å
219	V	98.3	Very high	95.3	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	144.4	176.4	-55.9	0	0	0	0	110.9	Q194 V206 K208 V209 A221 L232	Q194-V219 HydrophobicContact CG-CG1 4.05Å; V206-V219 HydrophobicContact CG1-CB 4.27Å; V206-V219 HydrophobicContact CG1-CG1 4.17Å; V206-V219 HydrophobicContact CG1-CG2 4.29Å; K208-V219 CarbonylContact O-C 3.43Å; K208-V219 WeakPolarHBondContact O-CA 3.42Å; V209-V219 HydrophobicContact CG2-CG1 4.13Å; V219-A221 HydrophobicContact CG2-CB 4.41Å; V219-A221 PolarHBondContact O-N 3Å; V219-L232 HydrophobicContact CG2-CB 3.83Å; V219-L232 HydrophobicContact CG2-CD2 3.97Å; V219-L232 HydrophobicContact CG2-CG 4.13Å; V219-L232 PolarHBondContact N-O 3.27Å; V219-L232 PolarHBondContact O-N 3.11Å
220	K	98.5	Very high	95.4	Very high	63 Å²	63	45.8 Å²	45.8	27%	0.274	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	123.6	156	-179.7	-171.8	174.1	-155.5	0	106.5	L207 K208 I210 H229 L285	L207-K220 WeakPolarHBondContact CB-O 3.47Å; L207-K220 HydrophobicContact CD1-CD 4.4Å; L207-K220 HydrophobicContact CD1-CG 4.46Å; L207-K220 PolarHBondContact N-O 2.96Å; K208-K220 PolarHBondContact N-O 3.33Å; K208-K220 PolarHBondContact O-N 3.11Å; I210-K220 HydrophobicContact CD1-CB 4.4Å; I210-K220 HydrophobicContact CG2-CB 3.81Å; K220-H229 WeakPolarHBondContact CE-CD2 3.35Å; K220-H229 WeakPolarHBondContact CE-NE2 3.36Å; K220-H229 PolarHBondContact NZ-CD2 3.33Å; K220-H229 PolarHBondContact NZ-NE2 3.44Å; K220-L285 HydrophobicContact CD-CD2 4.14Å; K220-L285 HydrophobicContact CG-CD2 3.95Å
221	A	98.8	Very high	95.6	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	163.9	174.1	0	0	0	0	0	111.1	E205 V219 H229 V230 L232	E205-A221 CarbonylContact O-C 3.44Å; E205-A221 WeakPolarHBondContact O-CA 3.42Å; E205-A221 VanDerWaalsContact O-CB 3.26Å; E205-A221 WeakPolarHBondContact O-CB 3.19Å; V219-A221 HydrophobicContact CG2-CB 4.41Å; V219-A221 PolarHBondContact O-N 3Å; A221-H229 WeakPolarHBondContact O-CA 3.5Å; A221-V230 HydrophobicContact CB-CG2 4.03Å; A221-V230 PolarHBondContact N-O 3.27Å; A221-V230 PolarHBondContact O-N 3.28Å; A221-L232 HydrophobicContact CB-CB 4.28Å; A221-L232 HydrophobicContact CB-CD2 4.48Å
222	F	98.6	Very high	95.9	Very high	38 Å²	38	41.9 Å²	41.9	17%	0.167	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	124.2	165.6	-172.1	-101	0	0	0	109.1	Y204 E205 L207 H224 Q227 H229	Y204-F222 WeakPolarHBondContact CA-O 3.46Å; E205-F222 HydrophobicContact CB-CB 4.47Å; E205-F222 PolarHBondContact N-O 3.05Å; E205-F222 PolarHBondContact O-N 3.46Å; L207-F222 HydrophobicContact CD1-CB 4.23Å; F222-H224 AromaticContact CD1-CD2 3.83Å; F222-H224 AromaticContact CD1-CE1 3.72Å; F222-H224 AromaticContact CD1-CG 3.96Å; F222-H224 AromaticContact CD1-ND1 3.88Å; F222-H224 AromaticContact CD1-NE2 3.68Å; F222-H224 AromaticContact CE1-CE1 3.99Å; F222-H224 AromaticContact CE1-ND1 3.86Å; F222-Q227 HydrophobicContact CZ-CB 4.13Å; F222-H229 AromaticContact CD2-CD2 3.83Å; F222-H229 AromaticContact CD2-NE2 3.98Å
223	D	98.6	Very high	96.3	Very high	3 Å²	3	36.2 Å²	36.2	2%	0.016	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	108	176.3	-177.1	-18.4	0	0	0	108.7	R203 Y204 K225 T226 Q227 T228 V230	R203-D223 WeakPolarHBondContact CG-OD1 3.32Å; R203-D223 IonicContact CZ-OD1 2.72Å; R203-D223 IonicContact CZ-OD2 2.71Å; R203-D223 VanDerWaalsContact CZ-OD2 3.3Å; R203-D223 VanDerWaalsContact NE-CG 3.34Å; R203-D223 IonicContact NE-OD1 3.17Å; R203-D223 PolarHBondContact NE-OD1 2.88Å; R203-D223 IonicContact NE-OD2 3.77Å; R203-D223 PolarHBondContact NE-OD2 2.95Å; R203-D223 VanDerWaalsContact NE-OD2 3.09Å; R203-D223 IonicContact NH2-OD1 2.86Å; R203-D223 IonicContact NH2-OD2 3.55Å; R203-D223 PolarHBondContact NH2-OD2 2.98Å; Y204-D223 HydrophobicContact CD1-CB 3.79Å; Y204-D223 HydrophobicContact CE1-CB 3.72Å; Y204-D223 VanDerWaalsContact CE1-CG 3.46Å; Y204-D223 VanDerWaalsContact CE1-OD2 3.24Å; Y204-D223 WeakPolarHBondContact CE1-OD2 3.3Å; D223-K225 PolarHBondContact O-N 3.21Å; D223-K225 WeakPolarHBondContact OD1-CA 3.27Å; D223-K225 VanDerWaalsContact OD1-CB 3.28Å; D223-K225 WeakPolarHBondContact OD1-CB 3.31Å; D223-K225 PolarHBondContact OD1-N 2.94Å; D223-T226 WeakPolarHBondContact CB-OG1 3.49Å; D223-T226 PolarHBondContact O-N 2.88Å; D223-T226 PolarHBondContact OD1-N 3.42Å; D223-T226 PolarHBondContact OD2-OG1 3.41Å; D223-Q227 VanDerWaalsContact O-CA 3.3Å; D223-Q227 WeakPolarHBondContact O-CA 3.36Å; D223-Q227 PolarHBondContact O-N 2.79Å; D223-T228 PolarHBondContact N-O 3.33Å; D223-T228 PolarHBondContact O-N 3.32Å; D223-V230 HydrophobicContact CB-CG1 4.28Å
224	H	98.2	Very high	96.8	Very high	35 Å²	35	34.8 Å²	34.8	16%	0.162	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-14.4	-178	-77.6	-88.1	0	0	0	113.2	P133 F165 R203 E205 F222 Q227	P133-H224 WeakPolarHBondContact CG-O 3.15Å; F165-H224 HydrophobicContact CB-CB 4.1Å; F165-H224 AromaticContact CD2-CD2 3.59Å; F165-H224 AromaticContact CD2-CE1 3.77Å; F165-H224 AromaticContact CD2-NE2 3.32Å; F165-H224 VanDerWaalsContact CD2-NE2 3.32Å; F165-H224 WeakPolarHBondContact CD2-NE2 3.36Å; F165-H224 AromaticContact CE2-NE2 3.67Å; F165-H224 AromaticContact CG-CD2 3.52Å; F165-H224 AromaticContact CG-NE2 3.72Å; R203-H224 PolarHBondContact O-N 2.8Å; E205-H224 IonicContact OE2-CE1 2.79Å; E205-H224 IonicContact OE2-NE2 3.85Å; E205-H224 PolarHBondContact OE2-NE2 2.93Å; F222-H224 AromaticContact CD1-CD2 3.83Å; F222-H224 AromaticContact CD1-CE1 3.72Å; F222-H224 AromaticContact CD1-CG 3.96Å; F222-H224 AromaticContact CD1-ND1 3.88Å; F222-H224 AromaticContact CD1-NE2 3.68Å; F222-H224 AromaticContact CE1-CE1 3.99Å; F222-H224 AromaticContact CE1-ND1 3.86Å; H224-Q227 PolarHBondContact O-NE2 3.24Å
225	K	97.1	Very high	97.3	Very high	67 Å²	67	31 Å²	31	29%	0.291	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-44.4	172.8	-177.7	169.4	-166.9	153.4	0	111.8	E162 Y164 R203 D223	E162-K225 IonicContact OE1-NZ 2.74Å; E162-K225 PolarHBondContact OE1-NZ 2.81Å; E162-K225 IonicContact OE2-NZ 2.75Å; E162-K225 PolarHBondContact OE2-NZ 2.72Å; Y164-K225 HydrophobicContact CD1-CB 3.96Å; Y164-K225 HydrophobicContact CD1-CG 4.39Å; Y164-K225 HydrophobicContact CD2-CB 4.07Å; Y164-K225 HydrophobicContact CD2-CD 4.48Å; Y164-K225 HydrophobicContact CE1-CB 3.82Å; Y164-K225 HydrophobicContact CE1-CD 4.34Å; Y164-K225 HydrophobicContact CE1-CG 3.75Å; Y164-K225 HydrophobicContact CE2-CB 3.91Å; Y164-K225 HydrophobicContact CE2-CD 3.59Å; Y164-K225 HydrophobicContact CE2-CG 3.87Å; Y164-K225 HydrophobicContact CG-CB 4.09Å; Y164-K225 VanDerWaalsContact CZ-CG 3.45Å; Y164-K225 WeakPolarHBondContact OH-CD 3.43Å; Y164-K225 WeakPolarHBondContact OH-CE 3.37Å; Y164-K225 PolarHBondContact OH-NZ 2.86Å; R203-K225 HydrophobicContact CG-CB 4.14Å; D223-K225 PolarHBondContact O-N 3.21Å; D223-K225 WeakPolarHBondContact OD1-CA 3.27Å; D223-K225 VanDerWaalsContact OD1-CB 3.28Å; D223-K225 WeakPolarHBondContact OD1-CB 3.31Å; D223-K225 PolarHBondContact OD1-N 2.94Å
226	T	96.9	Very high	97.8	Very high	71 Å²	71	31.3 Å²	31.3	44%	0.436	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.1	-11.3	-177.2	58.4	0	0	0	0	114	D223 T228	D223-T226 WeakPolarHBondContact CB-OG1 3.49Å; D223-T226 PolarHBondContact O-N 2.88Å; D223-T226 PolarHBondContact OD1-N 3.42Å; D223-T226 PolarHBondContact OD2-OG1 3.41Å; T226-T228 VanDerWaalsContact C-N 3.26Å; T226-T228 PolarHBondContact O-N 3.38Å; T226-T228 PolarHBondContact OG1-OG1 2.89Å
227	Q	97.3	Very high	98	Very high	96 Å²	96	33.6 Å²	33.6	45%	0.449	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.3	35.9	-174.1	-62.1	-70.9	-56	0	0	112.9	P133 F222 D223 H224	P133-Q227 HydrophobicContact CG-CG 3.56Å; F222-Q227 HydrophobicContact CZ-CB 4.13Å; D223-Q227 VanDerWaalsContact O-CA 3.3Å; D223-Q227 WeakPolarHBondContact O-CA 3.36Å; D223-Q227 PolarHBondContact O-N 2.79Å; H224-Q227 PolarHBondContact O-NE2 3.24Å
228	T	97.5	Very high	98	Very high	71 Å²	71	35.8 Å²	35.8	44%	0.436	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	154.7	-179.3	54.4	0	0	0	0	112.2	D223 T226	D223-T228 PolarHBondContact N-O 3.33Å; D223-T228 PolarHBondContact O-N 3.32Å; T226-T228 VanDerWaalsContact C-N 3.26Å; T226-T228 PolarHBondContact O-N 3.38Å; T226-T228 PolarHBondContact OG1-OG1 2.89Å
229	H	98.4	Very high	97.8	Very high	86 Å²	86	43.3 Å²	43.3	40%	0.398	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	137.5	171	-70.3	109.4	0	0	0	111.1	K220 A221 F222 L285	K220-H229 WeakPolarHBondContact CE-CD2 3.35Å; K220-H229 WeakPolarHBondContact CE-NE2 3.36Å; K220-H229 PolarHBondContact NZ-CD2 3.33Å; K220-H229 PolarHBondContact NZ-NE2 3.44Å; A221-H229 WeakPolarHBondContact O-CA 3.5Å; F222-H229 AromaticContact CD2-CD2 3.83Å; F222-H229 AromaticContact CD2-NE2 3.98Å; H229-L285 HydrophobicContact CB-CD2 3.72Å
230	V	98.7	Very high	97.5	Very high	1 Å²	1	49.4 Å²	49.4	1%	0.006	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	161.4	179.6	-60.8	0	0	0	0	111	Y204 A221 D223 L270 T282	Y204-V230 HydrophobicContact CD1-CG2 4.01Å; Y204-V230 HydrophobicContact CE1-CG2 4.23Å; A221-V230 HydrophobicContact CB-CG2 4.03Å; A221-V230 PolarHBondContact N-O 3.27Å; A221-V230 PolarHBondContact O-N 3.28Å; D223-V230 HydrophobicContact CB-CG1 4.28Å; V230-L270 HydrophobicContact CG1-CD1 3.79Å; V230-T282 HydrophobicContact CG2-CG2 4.36Å
231	A	98.7	Very high	97.4	Very high	11 Å²	11	47.3 Å²	47.3	9%	0.091	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	121	162.1	0	0	0	0	0	108.8	I210 V218 T282 F283 L285	I210-A231 HydrophobicContact CD1-CB 4.02Å; V218-A231 HydrophobicContact CG1-CB 4.21Å; A231-T282 CarbonylContact O-C 3.5Å; A231-T282 WeakPolarHBondContact O-CA 3.32Å; A231-F283 HydrophobicContact CB-CB 4.39Å; A231-F283 PolarHBondContact N-O 2.76Å; A231-F283 PolarHBondContact O-N 3.13Å; A231-L285 HydrophobicContact CB-CD1 4.1Å
232	L	98.8	Very high	97.3	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	111.9	-179.9	169	65.5	0	0	0	109.2	I200 V218 V219 A221 M234 F273 C280 M281 T282	I200-L232 HydrophobicContact CB-CD2 4.08Å; I200-L232 HydrophobicContact CG1-CD2 3.97Å; I200-L232 HydrophobicContact CG2-CD2 4.05Å; V218-L232 CarbonylContact C-O 3.57Å; V218-L232 WeakPolarHBondContact CA-O 3.38Å; V219-L232 HydrophobicContact CG2-CB 3.83Å; V219-L232 HydrophobicContact CG2-CD2 3.97Å; V219-L232 HydrophobicContact CG2-CG 4.13Å; V219-L232 PolarHBondContact N-O 3.27Å; V219-L232 PolarHBondContact O-N 3.11Å; A221-L232 HydrophobicContact CB-CB 4.28Å; A221-L232 HydrophobicContact CB-CD2 4.48Å; L232-M234 HydrophobicContact CD2-CG 4.48Å; L232-M234 HydrophobicContact CG-CG 4.2Å; L232-F273 HydrophobicContact CD1-CZ 4.06Å; L232-C280 HydrophobicContact CD1-CB 4.13Å; L232-M281 CarbonylContact C-O 3.58Å; L232-M281 WeakPolarHBondContact CA-O 3.35Å; L232-T282 HydrophobicContact CB-CG2 4.36Å; L232-T282 HydrophobicContact CD1-CG2 3.7Å
233	K	98.6	Very high	97.1	Very high	9 Å²	9	57.2 Å²	57.2	4%	0.039	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	116.4	173.2	-172.7	177.2	-166.6	-175.5	0	108.2	F215 V218 E248 C280 M281 F283 D350	F215-K233 HydrophobicContact CD2-CG 4.47Å; F215-K233 HydrophobicContact CE2-CG 4.28Å; V218-K233 HydrophobicContact CG2-CB 4.23Å; V218-K233 HydrophobicContact CG2-CG 4.11Å; K233-E248 IonicContact NZ-OE1 3.57Å; K233-E248 PolarHBondContact NZ-OE1 3.09Å; K233-E248 IonicContact NZ-OE2 2.72Å; K233-E248 PolarHBondContact NZ-OE2 3.23Å; K233-C280 WeakPolarHBondContact O-CA 3.4Å; K233-M281 HydrophobicContact CB-CB 4.49Å; K233-M281 HydrophobicContact CD-CE 3.98Å; K233-M281 HydrophobicContact CG-CE 4.46Å; K233-M281 PolarHBondContact N-O 2.95Å; K233-M281 PolarHBondContact O-N 2.88Å; K233-F283 HydrophobicContact CB-CD2 4.47Å; K233-F283 HydrophobicContact CB-CE2 3.76Å; K233-F283 HydrophobicContact CD-CE2 4.2Å; K233-F283 HydrophobicContact CD-CZ 4.5Å; K233-D350 IonicContact NZ-OD1 3.56Å; K233-D350 PolarHBondContact NZ-OD1 3.32Å
234	M	98.4	Very high	96.9	Very high	4 Å²	4	58.6 Å²	58.6	2%	0.02	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	116.5	170.7	-65.8	-171.9	70.9	0	0	108.6	Y192 Q194 I200 Q217 L232 F275 H278	Y192-M234 HydrophobicContact CD1-CE 3.6Å; Y192-M234 HydrophobicContact CD1-SD 3.86Å; Y192-M234 HydrophobicContact CD2-CE 4.03Å; Y192-M234 HydrophobicContact CE1-CE 4.13Å; Y192-M234 HydrophobicContact CE1-SD 4.45Å; Y192-M234 HydrophobicContact CG-CE 3.54Å; Y192-M234 HydrophobicContact CG-SD 4.29Å; Q194-M234 PolarHBondContact NE2-SD 2.87Å; I200-M234 HydrophobicContact CD1-CE 3.9Å; I200-M234 HydrophobicContact CD1-SD 3.74Å; I200-M234 HydrophobicContact CG1-SD 4.19Å; Q217-M234 PolarHBondContact N-O 2.85Å; Q217-M234 VanDerWaalsContact N-O 3.13Å; Q217-M234 PolarHBondContact O-N 2.93Å; L232-M234 HydrophobicContact CD2-CG 4.48Å; L232-M234 HydrophobicContact CG-CG 4.2Å; M234-F275 HydrophobicContact CE-CD1 4.18Å; M234-H278 HydrophobicContact CE-CB 4.13Å
235	V	98.2	Very high	96.9	Very high	4 Å²	4	57 Å²	57	2%	0.024	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	136	-175.9	-179.1	0	0	0	0	109.7	F215 F241 A245 H278 I279 M281	F215-V235 WeakPolarHBondContact O-CA 3.35Å; V235-F241 HydrophobicContact CG1-CB 3.68Å; V235-A245 HydrophobicContact CB-CB 4.44Å; V235-A245 HydrophobicContact CG1-CB 4.09Å; V235-A245 HydrophobicContact CG2-CB 3.8Å; V235-H278 PolarHBondContact O-ND1 2.87Å; V235-I279 HydrophobicContact CB-CB 4.2Å; V235-I279 VanDerWaalsContact CB-O 3.27Å; V235-I279 WeakPolarHBondContact CB-O 3.19Å; V235-I279 HydrophobicContact CG2-CB 4.32Å; V235-I279 VanDerWaalsContact CG2-O 3.3Å; V235-I279 WeakPolarHBondContact CG2-O 3.49Å; V235-I279 PolarHBondContact N-O 3.19Å; V235-M281 HydrophobicContact CG2-CE 3.49Å; V235-M281 VanDerWaalsContact CG2-CE 3.49Å
236	R	97.4	Very high	96.9	Very high	53 Å²	53	56.4 Å²	56.4	20%	0.2	27%	0.267	C	S	.	.	P	Polyproline II helix	trans	-59.3	136.1	177.1	-173.1	173.7	160.8	168.1	-6.8	111.2	Q189 G190 S214 F215 E238 F241 H242	Q189-R236 PolarHBondContact O-NE 3.09Å; Q189-R236 PolarHBondContact O-NH2 2.83Å; Q189-R236 VanDerWaalsContact O-NH2 3.12Å; G190-R236 WeakPolarHBondContact O-CG 3.45Å; S214-R236 VanDerWaalsContact O-CD 3.3Å; S214-R236 WeakPolarHBondContact O-CD 3.5Å; F215-R236 WeakPolarHBondContact O-CB 3.27Å; F215-R236 PolarHBondContact O-N 3.16Å; R236-E238 HydrophobicContact CG-CG 4.38Å; R236-E238 IonicContact CZ-OE1 2.81Å; R236-E238 IonicContact NE-OE1 3.56Å; R236-E238 PolarHBondContact NE-OE1 3.46Å; R236-E238 IonicContact NH2-OE1 3.41Å; R236-E238 PolarHBondContact NH2-OE1 3.35Å; R236-E238 PolarHBondContact O-N 3.09Å; R236-F241 HydrophobicContact CB-CD2 3.91Å; R236-F241 HydrophobicContact CB-CG 4.46Å; R236-F241 HydrophobicContact CG-CD2 4.17Å; R236-F241 HydrophobicContact CG-CE2 4.47Å; R236-H242 PolarHBondContact O-CD2 3.03Å
237	N	96.9	Very high	96.9	Very high	51 Å²	51	54.8 Å²	54.8	27%	0.273	26%	0.255	S	S	.	.	S	Bend	trans	-73.6	60.9	-171.4	-171.6	8.7	0	0	0	112.4	D186 G190	D186-N237 VanDerWaalsContact OD2-CB 3.32Å; D186-N237 WeakPolarHBondContact OD2-CB 3.37Å; D186-N237 PolarHBondContact OD2-ND2 2.74Å; G190-N237 WeakPolarHBondContact O-CB 3.45Å; G190-N237 PolarHBondContact O-N 2.71Å
238	E	95.6	Very high	97	Very high	63 Å²	63	50.4 Å²	50.4	29%	0.294	23%	0.234	S	C	.	.	S	Bend	trans	-132	142.2	176.5	-61.6	-178.7	-168.1	0	0	111.2	R236 R240 F241 H242	R236-E238 HydrophobicContact CG-CG 4.38Å; R236-E238 IonicContact CZ-OE1 2.81Å; R236-E238 IonicContact NE-OE1 3.56Å; R236-E238 PolarHBondContact NE-OE1 3.46Å; R236-E238 IonicContact NH2-OE1 3.41Å; R236-E238 PolarHBondContact NH2-OE1 3.35Å; R236-E238 PolarHBondContact O-N 3.09Å; E238-R240 PolarHBondContact O-N 3.37Å; E238-F241 HydrophobicContact CB-CD2 3.94Å; E238-F241 HydrophobicContact CG-CD2 4.23Å; E238-F241 PolarHBondContact O-N 2.97Å; E238-F241 WeakPolarHBondContact OE2-CE2 3.42Å; E238-H242 PolarHBondContact O-CD2 2.9Å; E238-H242 PolarHBondContact O-N 3.31Å
239	K	94.1	Very high	97	Very high	183 Å²	183	47.9 Å²	47.9	80%	0.796	22%	0.218	S	C	*	.	H	α-helix	trans	-54	-26.3	177.6	-65.5	177.2	179.5	174.7	0	113.7	R243	K239-R243 WeakPolarHBondContact O-CG 3.24Å
240	R	93.1	Very high	97	Very high	129 Å²	129	48.6 Å²	48.6	49%	0.487	22%	0.217	S	C	.	.	H	α-helix	trans	-71.5	-54.2	174.2	-177	-175.3	178.2	-174.6	-0.1	111.7	E238 H242 R243 Q244	E238-R240 PolarHBondContact O-N 3.37Å; R240-H242 VanDerWaalsContact C-N 3.31Å; R240-H242 PolarHBondContact O-N 2.81Å; R240-R243 PolarHBondContact O-N 2.9Å; R240-Q244 PolarHBondContact O-N 3.36Å
241	F	95.3	Very high	97	Very high	18 Å²	18	48.5 Å²	48.5	8%	0.079	22%	0.217	C	C	.	.	H	α-helix	trans	-69.4	-30.6	-177.2	-64.4	-60.2	0	0	0	111.9	S214 F215 V235 R236 E238 R243 Q244 A245	S214-F241 WeakPolarHBondContact O-CE2 3.25Å; S214-F241 WeakPolarHBondContact O-CZ 3.34Å; F215-F241 HydrophobicContact CB-CD1 4.3Å; F215-F241 HydrophobicContact CB-CE1 4.48Å; V235-F241 HydrophobicContact CG1-CB 3.68Å; R236-F241 HydrophobicContact CB-CD2 3.91Å; R236-F241 HydrophobicContact CB-CG 4.46Å; R236-F241 HydrophobicContact CG-CD2 4.17Å; R236-F241 HydrophobicContact CG-CE2 4.47Å; E238-F241 HydrophobicContact CB-CD2 3.94Å; E238-F241 HydrophobicContact CG-CD2 4.23Å; E238-F241 PolarHBondContact O-N 2.97Å; E238-F241 WeakPolarHBondContact OE2-CE2 3.42Å; F241-R243 PolarHBondContact O-N 3.35Å; F241-Q244 PolarHBondContact O-N 2.97Å; F241-A245 WeakPolarHBondContact O-CB 3.47Å; F241-A245 PolarHBondContact O-N 3.16Å
242	H	96.6	Very high	97	Very high	50 Å²	50	48.2 Å²	48.2	23%	0.231	21%	0.214	C	C	.	.	H	α-helix	trans	-63	-39.1	173.3	-72.8	-157.4	0	0	0	112.6	R236 E238 R240 A245 A246 N277 I279	R236-H242 PolarHBondContact O-CD2 3.03Å; E238-H242 PolarHBondContact O-CD2 2.9Å; E238-H242 PolarHBondContact O-N 3.31Å; R240-H242 VanDerWaalsContact C-N 3.31Å; R240-H242 PolarHBondContact O-N 2.81Å; H242-A245 PolarHBondContact O-N 2.9Å; H242-A246 PolarHBondContact O-N 3.26Å; H242-A246 VanDerWaalsContact O-N 3.07Å; H242-N277 PolarHBondContact CE1-O 2.99Å; H242-I279 HydrophobicContact CB-CD1 3.89Å
243	R	95.2	Very high	97	Very high	197 Å²	197	51.8 Å²	51.8	74%	0.743	23%	0.231	S	C	*	.	H	α-helix	trans	-65.6	-39.1	173.1	-71	172.9	-178.1	-178.6	0.5	112.2	K239 R240 F241 E247	K239-R243 WeakPolarHBondContact O-CG 3.24Å; R240-R243 PolarHBondContact O-N 2.9Å; F241-R243 PolarHBondContact O-N 3.35Å; R243-E247 PolarHBondContact O-N 2.87Å
244	Q	94.8	Very high	96.9	Very high	31 Å²	31	54.4 Å²	54.4	15%	0.145	24%	0.243	C	C	.	.	H	α-helix	trans	-66.5	-41.5	176.2	-73.8	-174.5	-78.6	0	0	112.1	R240 F241 E247 E248 G352 Y362	R240-Q244 PolarHBondContact O-N 3.36Å; F241-Q244 PolarHBondContact O-N 2.97Å; Q244-E247 PolarHBondContact O-N 2.92Å; Q244-E248 WeakPolarHBondContact O-CB 3.37Å; Q244-E248 PolarHBondContact O-N 2.97Å; Q244-G352 WeakPolarHBondContact CB-O 3.28Å; Q244-G352 WeakPolarHBondContact CG-O 3.49Å; Q244-G352 PolarHBondContact NE2-O 2.97Å; Q244-Y362 HydrophobicContact CG-CE2 4.46Å
245	A	97.4	Very high	96.9	Very high	2 Å²	2	54.3 Å²	54.3	2%	0.017	24%	0.242	C	C	.	.	H	α-helix	trans	-65.7	-39.3	177.6	0	0	0	0	0	112.9	V235 F241 H242 E247 E248 I249 I279 M281	V235-A245 HydrophobicContact CB-CB 4.44Å; V235-A245 HydrophobicContact CG1-CB 4.09Å; V235-A245 HydrophobicContact CG2-CB 3.8Å; F241-A245 WeakPolarHBondContact O-CB 3.47Å; F241-A245 PolarHBondContact O-N 3.16Å; H242-A245 PolarHBondContact O-N 2.9Å; A245-E247 VanDerWaalsContact C-N 3.3Å; A245-E247 PolarHBondContact O-N 3.02Å; A245-E248 PolarHBondContact O-N 2.77Å; A245-I249 WeakPolarHBondContact O-CB 3.2Å; A245-I249 WeakPolarHBondContact O-CD1 3.38Å; A245-I249 VanDerWaalsContact O-CG1 3.27Å; A245-I249 WeakPolarHBondContact O-CG1 3.38Å; A245-I249 PolarHBondContact O-N 2.8Å; A245-I279 HydrophobicContact CB-CB 4.31Å; A245-I279 HydrophobicContact CB-CD1 4.18Å; A245-I279 HydrophobicContact CB-CG2 3.97Å; A245-M281 HydrophobicContact CB-CE 3.93Å
246	A	97.4	Very high	96.9	Very high	55 Å²	55	59.8 Å²	59.8	46%	0.455	26%	0.262	S	S	.	.	H	α-helix	trans	-62	-37.9	174.1	0	0	0	0	0	112.4	H242 R250	H242-A246 PolarHBondContact O-N 3.26Å; H242-A246 VanDerWaalsContact O-N 3.07Å; A246-R250 WeakPolarHBondContact O-CB 3.26Å; A246-R250 PolarHBondContact O-N 3.13Å; A246-R250 VanDerWaalsContact O-N 3.11Å
247	E	96.8	Very high	96.8	Very high	36 Å²	36	63.8 Å²	63.8	17%	0.168	28%	0.281	C	S	.	.	H	α-helix	trans	-72.1	-39.4	175.2	-176.2	66.5	171	0	0	112.2	R243 Q244 A245 R250 I251 Y356	R243-E247 PolarHBondContact O-N 2.87Å; Q244-E247 PolarHBondContact O-N 2.92Å; A245-E247 VanDerWaalsContact C-N 3.3Å; A245-E247 PolarHBondContact O-N 3.02Å; E247-R250 PolarHBondContact O-N 3.4Å; E247-R250 IonicContact OE1-CZ 3.46Å; E247-R250 IonicContact OE1-NH2 2.93Å; E247-R250 PolarHBondContact OE1-NH2 3.32Å; E247-R250 IonicContact OE2-CZ 3.85Å; E247-R250 IonicContact OE2-NE 3.21Å; E247-R250 PolarHBondContact OE2-NE 2.77Å; E247-R250 IonicContact OE2-NH2 3.99Å; E247-R250 PolarHBondContact OE2-NH2 3.38Å; E247-I251 HydrophobicContact CG-CD1 3.89Å; E247-I251 WeakPolarHBondContact O-CB 3.49Å; E247-I251 WeakPolarHBondContact O-CG1 3.38Å; E247-I251 PolarHBondContact O-N 3.02Å; E247-Y356 WeakPolarHBondContact OE1-CD2 3.4Å
248	E	98.2	Very high	96.7	Very high	4 Å²	4	65 Å²	65	2%	0.019	29%	0.285	C	S	.	.	H	α-helix	trans	-59.1	-48.6	173.7	176.6	163.9	-148.1	0	0	111.6	K233 Q244 A245 I251 L252 M281 F351 G352	K233-E248 IonicContact NZ-OE1 3.57Å; K233-E248 PolarHBondContact NZ-OE1 3.09Å; K233-E248 IonicContact NZ-OE2 2.72Å; K233-E248 PolarHBondContact NZ-OE2 3.23Å; Q244-E248 WeakPolarHBondContact O-CB 3.37Å; Q244-E248 PolarHBondContact O-N 2.97Å; A245-E248 PolarHBondContact O-N 2.77Å; E248-I251 PolarHBondContact O-N 3.28Å; E248-L252 HydrophobicContact CG-CD1 3.83Å; E248-L252 WeakPolarHBondContact O-CB 3.49Å; E248-L252 VanDerWaalsContact O-CG 3.25Å; E248-L252 WeakPolarHBondContact O-CG 3.34Å; E248-L252 PolarHBondContact O-N 2.71Å; E248-M281 HydrophobicContact CG-SD 4.07Å; E248-F351 HydrophobicContact CG-CB 3.98Å; E248-F351 PolarHBondContact OE1-N 3.25Å; E248-G352 VanDerWaalsContact CD-N 3.28Å; E248-G352 PolarHBondContact OE1-N 2.72Å; E248-G352 WeakPolarHBondContact OE2-CA 3.1Å
249	I	98.6	Very high	96.7	Very high	19 Å²	19	62 Å²	62	10%	0.097	27%	0.272	C	S	.	.	H	α-helix	trans	-55.2	-53.3	173.6	-72.8	163.3	0	0	0	110.2	A245 I251 L252 E253 M269 H272 I279 M281	A245-I249 WeakPolarHBondContact O-CB 3.2Å; A245-I249 WeakPolarHBondContact O-CD1 3.38Å; A245-I249 VanDerWaalsContact O-CG1 3.27Å; A245-I249 WeakPolarHBondContact O-CG1 3.38Å; A245-I249 PolarHBondContact O-N 2.8Å; I249-I251 PolarHBondContact O-N 3.11Å; I249-L252 PolarHBondContact O-N 3.25Å; I249-E253 WeakPolarHBondContact O-CG 3.3Å; I249-E253 PolarHBondContact O-N 2.77Å; I249-M269 HydrophobicContact CB-CE 4.45Å; I249-M269 HydrophobicContact CG1-CE 4.38Å; I249-M269 HydrophobicContact CG1-SD 4.03Å; I249-M269 HydrophobicContact CG2-CE 4.15Å; I249-H272 HydrophobicContact CD1-CB 3.91Å; I249-H272 HydrophobicContact CG1-CB 4.18Å; I249-I279 HydrophobicContact CD1-CG2 4.07Å; I249-M281 HydrophobicContact CD1-CG 4.12Å; I249-M281 HydrophobicContact CD1-SD 4.21Å; I249-M281 HydrophobicContact CG1-CG 3.92Å; I249-M281 HydrophobicContact CG1-SD 3.67Å
250	R	98.4	Very high	96.5	Very high	100 Å²	100	62.3 Å²	62.3	38%	0.377	27%	0.273	S	S	.	.	H	α-helix	trans	-61.1	-40.3	-177.6	-171.7	179.2	73.4	106.2	-11.1	113	A246 E247 H254 Y356	A246-R250 WeakPolarHBondContact O-CB 3.26Å; A246-R250 PolarHBondContact O-N 3.13Å; A246-R250 VanDerWaalsContact O-N 3.11Å; E247-R250 PolarHBondContact O-N 3.4Å; E247-R250 IonicContact OE1-CZ 3.46Å; E247-R250 IonicContact OE1-NH2 2.93Å; E247-R250 PolarHBondContact OE1-NH2 3.32Å; E247-R250 IonicContact OE2-CZ 3.85Å; E247-R250 IonicContact OE2-NE 3.21Å; E247-R250 PolarHBondContact OE2-NE 2.77Å; E247-R250 IonicContact OE2-NH2 3.99Å; E247-R250 PolarHBondContact OE2-NH2 3.38Å; R250-H254 WeakPolarHBondContact O-CB 3.11Å; R250-H254 PolarHBondContact O-N 3.34Å; R250-Y356 VanDerWaalsContact CZ-CE2 3.49Å
251	I	98.5	Very high	96.4	Very high	0 Å²	0	61.8 Å²	61.8	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-67.3	-47	176.8	-78.1	172.7	0	0	0	110.8	E247 E248 I249 H254 L255 I326 F351 Y356	E247-I251 HydrophobicContact CG-CD1 3.89Å; E247-I251 WeakPolarHBondContact O-CB 3.49Å; E247-I251 WeakPolarHBondContact O-CG1 3.38Å; E247-I251 PolarHBondContact O-N 3.02Å; E248-I251 PolarHBondContact O-N 3.28Å; I249-I251 PolarHBondContact O-N 3.11Å; I251-H254 PolarHBondContact O-N 3.07Å; I251-L255 HydrophobicContact CG2-CD1 3.9Å; I251-L255 WeakPolarHBondContact O-CG 3.32Å; I251-L255 PolarHBondContact O-N 3.48Å; I251-I326 HydrophobicContact CD1-CG2 4.3Å; I251-I326 HydrophobicContact CG2-CD1 4.16Å; I251-I326 HydrophobicContact CG2-CG2 4.22Å; I251-F351 HydrophobicContact CG2-CD1 3.73Å; I251-F351 HydrophobicContact CG2-CE1 4.35Å; I251-F351 HydrophobicContact CG2-CG 4.43Å; I251-Y356 HydrophobicContact CD1-CE2 4.33Å; I251-Y356 HydrophobicContact CG1-CD2 4.28Å; I251-Y356 HydrophobicContact CG1-CE2 3.64Å
252	L	98.5	Very high	96.1	Very high	5 Å²	5	62.9 Å²	62.9	3%	0.026	29%	0.29	C	S	.	.	H	α-helix	trans	-67.7	-39.5	-177.4	-71.4	171.9	0	0	0	112.3	E248 I249 H254 L255 R256 V266 I267 M269 F283 F351	E248-L252 HydrophobicContact CG-CD1 3.83Å; E248-L252 WeakPolarHBondContact O-CB 3.49Å; E248-L252 VanDerWaalsContact O-CG 3.25Å; E248-L252 WeakPolarHBondContact O-CG 3.34Å; E248-L252 PolarHBondContact O-N 2.71Å; I249-L252 PolarHBondContact O-N 3.25Å; L252-H254 PolarHBondContact O-N 3Å; L252-L255 PolarHBondContact O-N 3.05Å; L252-R256 WeakPolarHBondContact O-CB 3.46Å; L252-R256 PolarHBondContact O-N 3.27Å; L252-V266 HydrophobicContact CD2-CG1 3.81Å; L252-I267 HydrophobicContact CD2-CG2 3.89Å; L252-M269 HydrophobicContact CD1-CB 4.39Å; L252-F283 HydrophobicContact CD1-CE1 3.79Å; L252-F283 HydrophobicContact CD1-CZ 4.42Å; L252-F351 HydrophobicContact CD2-CB 4.46Å; L252-F351 HydrophobicContact CD2-CD2 3.74Å; L252-F351 HydrophobicContact CD2-CE2 4.1Å; L252-F351 HydrophobicContact CD2-CG 4.04Å; L252-F351 HydrophobicContact CG-CB 4.4Å; L252-F351 HydrophobicContact CG-CG 4.48Å
253	E	98.1	Very high	96	Very high	75 Å²	75	63 Å²	63	35%	0.35	30%	0.296	S	S	.	.	H	α-helix	trans	-60.3	-43.6	171.4	-76.7	-165.2	178.6	0	0	113	I249 L255 R256 K257 M269	I249-E253 WeakPolarHBondContact O-CG 3.3Å; I249-E253 PolarHBondContact O-N 2.77Å; E253-L255 VanDerWaalsContact C-N 3.34Å; E253-L255 PolarHBondContact O-N 3.5Å; E253-R256 PolarHBondContact O-N 2.94Å; E253-K257 WeakPolarHBondContact O-CD 3.35Å; E253-K257 VanDerWaalsContact O-CG 3.3Å; E253-K257 WeakPolarHBondContact O-CG 3.45Å; E253-K257 PolarHBondContact O-N 3.19Å; E253-K257 VanDerWaalsContact O-N 3.11Å; E253-K257 IonicContact OE2-NZ 2.84Å; E253-K257 PolarHBondContact OE2-NZ 2.88Å; E253-M269 HydrophobicContact CG-CE 4.24Å
254	H	98.2	Very high	96.1	Very high	64 Å²	64	55 Å²	55	30%	0.296	27%	0.267	S	S	.	.	H	α-helix	trans	-63.4	-40.4	-178.7	179.8	68.2	0	0	0	112	R250 I251 L252 Q258 N324 Y356	R250-H254 WeakPolarHBondContact O-CB 3.11Å; R250-H254 PolarHBondContact O-N 3.34Å; I251-H254 PolarHBondContact O-N 3.07Å; L252-H254 PolarHBondContact O-N 3Å; H254-Q258 PolarHBondContact NE2-NE2 2.85Å; H254-Q258 PolarHBondContact O-NE2 2.78Å; H254-N324 PolarHBondContact NE2-OD1 3.5Å; H254-Y356 PolarHBondContact CD2-OH 3.3Å
255	L	97.9	Very high	96.2	Very high	2 Å²	2	54.2 Å²	54.2	1%	0.01	26%	0.264	C	S	.	.	H	α-helix	trans	-71.4	-40.5	173.5	-66	168.8	0	0	0	111.7	I251 L252 E253 K257 Q258 D259 V266 L321 N324 I326 F351	I251-L255 HydrophobicContact CG2-CD1 3.9Å; I251-L255 WeakPolarHBondContact O-CG 3.32Å; I251-L255 PolarHBondContact O-N 3.48Å; L252-L255 PolarHBondContact O-N 3.05Å; E253-L255 VanDerWaalsContact C-N 3.34Å; E253-L255 PolarHBondContact O-N 3.5Å; L255-K257 VanDerWaalsContact C-N 3.27Å; L255-K257 PolarHBondContact O-N 3.15Å; L255-Q258 WeakPolarHBondContact O-CA 3.16Å; L255-Q258 WeakPolarHBondContact O-CB 3.38Å; L255-Q258 PolarHBondContact O-N 3.29Å; L255-D259 PolarHBondContact O-N 3.47Å; L255-V266 HydrophobicContact CD1-CG1 4.21Å; L255-V266 HydrophobicContact CD1-CG2 4.46Å; L255-L321 HydrophobicContact CD1-CD2 3.51Å; L255-L321 HydrophobicContact CD2-CD2 3.98Å; L255-L321 HydrophobicContact CG-CD2 4.41Å; L255-N324 HydrophobicContact CD2-CB 4.43Å; L255-I326 HydrophobicContact CD1-CD1 4.31Å; L255-I326 HydrophobicContact CD2-CD1 4.02Å; L255-I326 HydrophobicContact CG-CD1 4.14Å; L255-F351 HydrophobicContact CD1-CE1 4.11Å
256	R	97	Very high	96.3	Very high	118 Å²	118	54.3 Å²	54.3	45%	0.445	26%	0.264	S	S	.	.	H	α-helix	trans	-62.5	-31	-179.2	-175.9	54.1	167.3	150	-6.6	113.3	L252 E253 Q258 D259 H268	L252-R256 WeakPolarHBondContact O-CB 3.46Å; L252-R256 PolarHBondContact O-N 3.27Å; E253-R256 PolarHBondContact O-N 2.94Å; R256-Q258 PolarHBondContact O-N 2.95Å; R256-D259 PolarHBondContact NH1-O 2.93Å; R256-H268 PolarHBondContact NH1-CE1 3.34Å
257	K	96.3	Very high	96.3	Very high	138 Å²	138	52.2 Å²	52.2	60%	0.6	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-19.8	172.8	-71.3	156.9	-168.8	162.6	0	112.9	E253 L255	E253-K257 WeakPolarHBondContact O-CD 3.35Å; E253-K257 VanDerWaalsContact O-CG 3.3Å; E253-K257 WeakPolarHBondContact O-CG 3.45Å; E253-K257 PolarHBondContact O-N 3.19Å; E253-K257 VanDerWaalsContact O-N 3.11Å; E253-K257 IonicContact OE2-NZ 2.84Å; E253-K257 PolarHBondContact OE2-NZ 2.88Å; L255-K257 VanDerWaalsContact C-N 3.27Å; L255-K257 PolarHBondContact O-N 3.15Å
258	Q	95.8	Very high	96.4	Very high	75 Å²	75	51.3 Å²	51.3	35%	0.35	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.8	-36.3	-178.3	-56.8	169.9	51	0	0	112.6	H254 L255 R256 K260 M264 N324	H254-Q258 PolarHBondContact NE2-NE2 2.85Å; H254-Q258 PolarHBondContact O-NE2 2.78Å; L255-Q258 WeakPolarHBondContact O-CA 3.16Å; L255-Q258 WeakPolarHBondContact O-CB 3.38Å; L255-Q258 PolarHBondContact O-N 3.29Å; R256-Q258 PolarHBondContact O-N 2.95Å; Q258-K260 PolarHBondContact O-N 2.87Å; Q258-M264 HydrophobicContact CB-CE 3.47Å; Q258-M264 VanDerWaalsContact CB-CE 3.47Å; Q258-M264 HydrophobicContact CB-SD 4.38Å; Q258-N324 PolarHBondContact NE2-ND2 3.3Å; Q258-N324 PolarHBondContact NE2-OD1 3.36Å; Q258-N324 PolarHBondContact OE1-ND2 3.23Å; Q258-N324 PolarHBondContact OE1-OD1 3.06Å
259	D	94.9	Very high	96.4	Very high	2 Å²	2	52.5 Å²	52.5	1%	0.011	25%	0.247	C	C	.	.			trans	-77.2	61.2	-178.3	-165.2	29.1	0	0	0	113.1	L255 R256 D261 S262 S263 M264 H268	L255-D259 PolarHBondContact O-N 3.47Å; R256-D259 PolarHBondContact NH1-O 2.93Å; D259-D261 VanDerWaalsContact C-N 3.33Å; D259-D261 PolarHBondContact O-N 3.3Å; D259-S262 VanDerWaalsContact OD1-C 3.29Å; D259-S262 WeakPolarHBondContact OD1-CA 3.47Å; D259-S262 PolarHBondContact OD1-N 2.79Å; D259-S263 PolarHBondContact OD1-N 2.8Å; D259-M264 HydrophobicContact CB-CB 4.17Å; D259-M264 HydrophobicContact CB-CG 3.9Å; D259-M264 HydrophobicContact CB-SD 3.8Å; D259-M264 WeakPolarHBondContact OD1-CB 3.43Å; D259-M264 WeakPolarHBondContact OD1-CG 3.45Å; D259-M264 PolarHBondContact OD1-N 2.71Å; D259-H268 IonicContact OD2-CD2 3.47Å; D259-H268 IonicContact OD2-CE1 3.65Å; D259-H268 IonicContact OD2-NE2 2.62Å; D259-H268 PolarHBondContact OD2-NE2 3.16Å
260	K	90.1	Very high	96.3	Very high	188 Å²	188	55.7 Å²	55.7	82%	0.817	26%	0.264	S	S	*	.	S	Bend	trans	-69	-27.7	-178.1	-68	-174.4	178.9	-178.7	0	113.5	Q258	Q258-K260 PolarHBondContact O-N 2.87Å
261	D	90.4	Very high	96.3	Very high	119 Å²	119	54.7 Å²	54.7	64%	0.636	26%	0.264	S	S	*	.	S	Bend	trans	-108.9	2.4	-175.8	67.5	-18.7	0	0	0	113.8	D259 S263	D259-D261 VanDerWaalsContact C-N 3.33Å; D259-D261 PolarHBondContact O-N 3.3Å; D261-S263 VanDerWaalsContact CG-OG 3.27Å; D261-S263 PolarHBondContact O-N 2.74Å; D261-S263 WeakPolarHBondContact OD1-CB 3.48Å; D261-S263 PolarHBondContact OD1-N 3.32Å; D261-S263 PolarHBondContact OD1-OG 3.02Å; D261-S263 WeakPolarHBondContact OD2-CB 3.44Å; D261-S263 PolarHBondContact OD2-OG 2.69Å
262	S	89.6	Confident	96.3	Very high	41 Å²	41	59 Å²	59	29%	0.287	28%	0.283	S	S	.	.	S	Bend	trans	63.9	23.9	-177	-153	0	0	0	0	113.7	D259 H268 K339	D259-S262 VanDerWaalsContact OD1-C 3.29Å; D259-S262 WeakPolarHBondContact OD1-CA 3.47Å; D259-S262 PolarHBondContact OD1-N 2.79Å; S262-H268 PolarHBondContact OG-CE1 2.87Å; S262-H268 VanDerWaalsContact OG-CE1 3.29Å; S262-K339 PolarHBondContact O-NZ 2.82Å
263	S	93.3	Very high	96.3	Very high	53 Å²	53	60.7 Å²	60.7	37%	0.371	29%	0.291	S	S	.	.			trans	-79.6	-28.8	-179.9	63.5	0	0	0	0	113.7	D259 D261 N265	D259-S263 PolarHBondContact OD1-N 2.8Å; D261-S263 VanDerWaalsContact CG-OG 3.27Å; D261-S263 PolarHBondContact O-N 2.74Å; D261-S263 WeakPolarHBondContact OD1-CB 3.48Å; D261-S263 PolarHBondContact OD1-N 3.32Å; D261-S263 PolarHBondContact OD1-OG 3.02Å; D261-S263 WeakPolarHBondContact OD2-CB 3.44Å; D261-S263 PolarHBondContact OD2-OG 2.69Å; S263-N265 PolarHBondContact O-N 3.42Å; S263-N265 VanDerWaalsContact O-N 3.09Å; S263-N265 PolarHBondContact O-ND2 2.71Å
264	M	96.9	Very high	96.3	Very high	28 Å²	28	61.1 Å²	61.1	14%	0.138	30%	0.299	C	S	.	.	S	Bend	trans	-66	-15.1	-175.9	-64.1	-168.3	171.9	0	0	113.4	Q258 D259 V266 Q316 C317 A320	Q258-M264 HydrophobicContact CB-CE 3.47Å; Q258-M264 VanDerWaalsContact CB-CE 3.47Å; Q258-M264 HydrophobicContact CB-SD 4.38Å; D259-M264 HydrophobicContact CB-CB 4.17Å; D259-M264 HydrophobicContact CB-CG 3.9Å; D259-M264 HydrophobicContact CB-SD 3.8Å; D259-M264 WeakPolarHBondContact OD1-CB 3.43Å; D259-M264 WeakPolarHBondContact OD1-CG 3.45Å; D259-M264 PolarHBondContact OD1-N 2.71Å; M264-V266 HydrophobicContact CB-CG2 4.12Å; M264-V266 PolarHBondContact O-N 3.45Å; M264-Q316 CarbonylContact O-C 3.37Å; M264-C317 WeakPolarHBondContact O-CA 3.14Å; M264-C317 WeakPolarHBondContact O-CB 3.42Å; M264-C317 PolarHBondContact O-N 3.42Å; M264-C317 VanDerWaalsContact O-N 3.12Å; M264-A320 HydrophobicContact CB-CB 4.27Å; M264-A320 HydrophobicContact CE-CB 4.09Å; M264-A320 HydrophobicContact CG-CB 3.94Å; M264-A320 HydrophobicContact SD-CB 3.64Å
265	N	98.2	Very high	96.3	Very high	14 Å²	14	58.1 Å²	58.1	8%	0.075	29%	0.285	C	S	.	.			trans	54.7	34.6	-175.4	-57.7	-47.7	0	0	0	113.5	S263 S313 K339 I346 K347 V348	S263-N265 PolarHBondContact O-N 3.42Å; S263-N265 VanDerWaalsContact O-N 3.09Å; S263-N265 PolarHBondContact O-ND2 2.71Å; N265-S313 PolarHBondContact ND2-O 2.77Å; N265-S313 VanDerWaalsContact ND2-O 3.08Å; N265-K339 VanDerWaalsContact OD1-CE 3.28Å; N265-K339 WeakPolarHBondContact OD1-CE 3.41Å; N265-K339 PolarHBondContact OD1-NZ 3.48Å; N265-I346 HydrophobicContact CB-CD1 4.14Å; N265-I346 WeakPolarHBondContact CB-O 3.4Å; N265-I346 PolarHBondContact OD1-O 3.01Å; N265-K347 CarbonylContact O-C 3.21Å; N265-K347 WeakPolarHBondContact O-CA 3.36Å; N265-K347 WeakPolarHBondContact O-CB 3.37Å; N265-V348 PolarHBondContact O-N 2.84Å
266	V	98.4	Very high	96.3	Very high	4 Å²	4	58.7 Å²	58.7	2%	0.024	29%	0.287	C	S	.	.	B	Isolated β-bridge	trans	-95.5	143.8	169.6	177.1	0	0	0	0	109.1	L252 L255 M264 H268 C317 K347 F351	L252-V266 HydrophobicContact CD2-CG1 3.81Å; L255-V266 HydrophobicContact CD1-CG1 4.21Å; L255-V266 HydrophobicContact CD1-CG2 4.46Å; M264-V266 HydrophobicContact CB-CG2 4.12Å; M264-V266 PolarHBondContact O-N 3.45Å; V266-H268 PolarHBondContact O-CD2 3.47Å; V266-C317 HydrophobicContact CG2-CB 4.37Å; V266-K347 VanDerWaalsContact O-CD 3.29Å; V266-K347 WeakPolarHBondContact O-CD 3.22Å; V266-K347 VanDerWaalsContact O-CE 3.29Å; V266-K347 WeakPolarHBondContact O-CE 3.35Å; V266-K347 PolarHBondContact O-NZ 2.87Å; V266-F351 HydrophobicContact CG1-CE2 3.9Å; V266-F351 HydrophobicContact CG1-CZ 3.87Å; V266-F351 HydrophobicContact CG2-CZ 4.36Å
267	I	98.3	Very high	96.3	Very high	11 Å²	11	57.5 Å²	57.5	6%	0.056	29%	0.29	C	S	.	.			trans	-56.8	134.7	173.5	-169.1	71.8	0	0	0	111.8	L252 F283 E284 L286 V348 I349 F351	L252-I267 HydrophobicContact CD2-CG2 3.89Å; I267-F283 HydrophobicContact CD1-CB 4.24Å; I267-F283 HydrophobicContact CG1-CB 4.02Å; I267-F283 HydrophobicContact CG1-CD1 3.58Å; I267-F283 HydrophobicContact CG1-CE1 4.4Å; I267-F283 HydrophobicContact CG1-CG 4.09Å; I267-F283 HydrophobicContact CG2-CD1 4.26Å; I267-F283 HydrophobicContact CG2-CE1 4.3Å; I267-E284 HydrophobicContact CD1-CG 3.67Å; I267-L286 HydrophobicContact CD1-CD1 3.51Å; I267-L286 HydrophobicContact CD1-CG 3.9Å; I267-V348 PolarHBondContact N-O 2.96Å; I267-V348 VanDerWaalsContact N-O 3.09Å; I267-I349 HydrophobicContact CB-CG2 4.14Å; I267-I349 HydrophobicContact CD1-CG2 4.1Å; I267-I349 HydrophobicContact CG1-CG2 4.33Å; I267-F351 HydrophobicContact CG2-CD2 4.36Å; I267-F351 HydrophobicContact CG2-CE2 4.39Å
268	H	98.1	Very high	96.4	Very high	17 Å²	17	51 Å²	51	8%	0.079	26%	0.261	C	S	.	.			trans	-92.6	106.9	174.4	-65.3	170.6	0	0	0	109.4	R256 D259 S262 V266 F283 E284 K347	R256-H268 PolarHBondContact NH1-CE1 3.34Å; D259-H268 IonicContact OD2-CD2 3.47Å; D259-H268 IonicContact OD2-CE1 3.65Å; D259-H268 IonicContact OD2-NE2 2.62Å; D259-H268 PolarHBondContact OD2-NE2 3.16Å; S262-H268 PolarHBondContact OG-CE1 2.87Å; S262-H268 VanDerWaalsContact OG-CE1 3.29Å; V266-H268 PolarHBondContact O-CD2 3.47Å; H268-F283 WeakPolarHBondContact O-CA 3.32Å; H268-E284 WeakPolarHBondContact CB-OE1 3.22Å; H268-E284 IonicContact CG-OE1 2.74Å; H268-E284 PolarHBondContact N-OE1 2.97Å; H268-E284 PolarHBondContact O-N 2.87Å; H268-E284 VanDerWaalsContact O-N 3.17Å; H268-K347 PolarHBondContact CD2-NZ 2.83Å; H268-K347 PolarHBondContact CE1-NZ 3.5Å; H268-K347 VanDerWaalsContact CG-NZ 3.26Å; H268-K347 PolarHBondContact ND1-NZ 2.84Å; H268-K347 PolarHBondContact NE2-NZ 2.82Å
269	M	98.4	Very high	96.6	Very high	29 Å²	29	48.6 Å²	48.6	14%	0.143	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	141	160.2	-170.1	174.8	68.5	0	0	108.9	I249 L252 E253 H272 M281 T282 F283	I249-M269 HydrophobicContact CB-CE 4.45Å; I249-M269 HydrophobicContact CG1-CE 4.38Å; I249-M269 HydrophobicContact CG1-SD 4.03Å; I249-M269 HydrophobicContact CG2-CE 4.15Å; L252-M269 HydrophobicContact CD1-CB 4.39Å; E253-M269 HydrophobicContact CG-CE 4.24Å; M269-H272 HydrophobicContact SD-CB 4.19Å; M269-M281 HydrophobicContact SD-CB 4.28Å; M269-M281 HydrophobicContact SD-CG 3.94Å; M269-M281 HydrophobicContact SD-SD 4.29Å; M269-T282 CarbonylContact C-O 3.49Å; M269-T282 WeakPolarHBondContact CA-O 3.19Å; M269-T282 WeakPolarHBondContact CG-O 3.38Å; M269-F283 HydrophobicContact CB-CD1 3.95Å; M269-F283 HydrophobicContact CB-CE1 3.84Å; M269-F283 HydrophobicContact CG-CD1 4.39Å; M269-F283 HydrophobicContact CG-CE1 4.1Å
270	L	97.9	Very high	96.7	Very high	87 Å²	87	48.5 Å²	48.5	46%	0.455	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	-50.4	-176.5	-53.6	177.7	0	0	0	110.8	V230 T282	V230-L270 HydrophobicContact CG1-CD1 3.79Å; L270-T282 PolarHBondContact N-O 3.25Å
271	E	97.8	Very high	97.2	Very high	79 Å²	79	39.5 Å²	39.5	37%	0.369	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	149.9	-178.1	-51.6	-91.2	-151.9	0	0	108.8	R203 T282	R203-E271 IonicContact CZ-OE1 2.67Å; R203-E271 VanDerWaalsContact CZ-OE1 3.23Å; R203-E271 IonicContact NH1-OE1 2.75Å; R203-E271 PolarHBondContact NH1-OE1 3.3Å; R203-E271 IonicContact NH2-OE1 3.8Å; R203-E271 PolarHBondContact NH2-OE1 3Å; E271-T282 WeakPolarHBondContact CB-OG1 3.3Å; E271-T282 PolarHBondContact N-OG1 3.28Å; E271-T282 VanDerWaalsContact N-OG1 3.09Å; E271-T282 PolarHBondContact O-N 3.21Å; E271-T282 PolarHBondContact O-OG1 3.04Å
272	H	98.6	Very high	97.6	Very high	89 Å²	89	33.9 Å²	33.9	41%	0.412	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	147.7	164.6	77.5	82.2	0	0	0	110.8	I249 M269 C280 M281	I249-H272 HydrophobicContact CD1-CB 3.91Å; I249-H272 HydrophobicContact CG1-CB 4.18Å; M269-H272 HydrophobicContact SD-CB 4.19Å; H272-C280 CarbonylContact C-O 3.38Å; H272-C280 VanDerWaalsContact CA-O 3.25Å; H272-C280 WeakPolarHBondContact CA-O 3.44Å; H272-M281 HydrophobicContact CB-CG 4.07Å
273	F	98.6	Very high	98	Very high	42 Å²	42	32.7 Å²	32.7	18%	0.184	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.4	-178.8	-177.6	54.3	-88.5	0	0	0	110.6	I200 A201 Y204 L232 F275 C280 T282	I200-F273 HydrophobicContact CG2-CE2 3.83Å; I200-F273 HydrophobicContact CG2-CZ 4.06Å; A201-F273 HydrophobicContact CB-CD2 3.87Å; A201-F273 HydrophobicContact CB-CE2 3.5Å; A201-F273 HydrophobicContact CB-CZ 4.07Å; Y204-F273 HydrophobicContact CD2-CE1 4.19Å; Y204-F273 AromaticContact CD2-CZ 3.82Å; Y204-F273 HydrophobicContact CD2-CZ 3.82Å; Y204-F273 HydrophobicContact CE2-CD1 4.48Å; Y204-F273 AromaticContact CE2-CE1 3.44Å; Y204-F273 HydrophobicContact CE2-CE1 3.44Å; Y204-F273 VanDerWaalsContact CE2-CE1 3.44Å; Y204-F273 AromaticContact CE2-CZ 3.53Å; Y204-F273 HydrophobicContact CE2-CZ 3.53Å; L232-F273 HydrophobicContact CD1-CZ 4.06Å; F273-F275 HydrophobicContact CD2-CB 4.17Å; F273-F275 HydrophobicContact CE2-CB 4.01Å; F273-C280 HydrophobicContact CD1-CB 4.32Å; F273-C280 HydrophobicContact CD2-CB 3.62Å; F273-C280 HydrophobicContact CE1-CB 4.07Å; F273-C280 HydrophobicContact CE2-CB 3.32Å; F273-C280 HydrophobicContact CG-CB 4.11Å; F273-C280 HydrophobicContact CZ-CB 3.57Å; F273-C280 PolarHBondContact N-O 2.78Å; F273-C280 PolarHBondContact O-N 2.93Å; F273-T282 HydrophobicContact CE1-CG2 4.23Å
274	T	98.4	Very high	98.2	Very high	84 Å²	84	32.5 Å²	32.5	52%	0.515	16%	0.164	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	136.3	168.4	-59.4	0	0	0	0	109	H278	T274-H278 CarbonylContact C-O 3.53Å; T274-H278 VanDerWaalsContact CA-O 3.28Å; T274-H278 WeakPolarHBondContact CA-O 3.45Å; T274-H278 WeakPolarHBondContact CG2-O 3.25Å
275	F	98.4	Very high	98.3	Very high	1 Å²	1	34.3 Å²	34.3	0%	0.004	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	128.1	176.2	175.5	-99.2	0	0	0	109.3	Y192 I200 A201 M234 F273 N277 H278	Y192-F275 HydrophobicContact CE2-CE1 4.38Å; I200-F275 HydrophobicContact CB-CD1 4.48Å; I200-F275 HydrophobicContact CB-CE1 4.43Å; I200-F275 HydrophobicContact CD1-CD1 3.81Å; I200-F275 HydrophobicContact CD1-CE1 3.45Å; I200-F275 VanDerWaalsContact CD1-CE1 3.45Å; I200-F275 HydrophobicContact CD1-CZ 4.29Å; I200-F275 HydrophobicContact CG1-CE1 4.5Å; I200-F275 HydrophobicContact CG2-CB 4.18Å; I200-F275 HydrophobicContact CG2-CD1 3.78Å; I200-F275 HydrophobicContact CG2-CE1 4.22Å; I200-F275 HydrophobicContact CG2-CG 3.91Å; A201-F275 HydrophobicContact CB-CD2 4.13Å; M234-F275 HydrophobicContact CE-CD1 4.18Å; F273-F275 HydrophobicContact CD2-CB 4.17Å; F273-F275 HydrophobicContact CE2-CB 4.01Å; F275-N277 VanDerWaalsContact C-N 3.29Å; F275-N277 PolarHBondContact O-N 3.4Å; F275-H278 PolarHBondContact N-O 3.37Å; F275-H278 PolarHBondContact O-N 2.86Å
276	R	97.4	Very high	98.2	Very high	13 Å²	13	34.9 Å²	34.9	5%	0.049	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	43.3	53.4	-177.1	-62	-179.3	-176.6	161.3	-0.2	112.4	F152 E153 E156 N182 Y185 Y192 Q199 H278	F152-R276 HydrophobicContact CE1-CG 4.32Å; E153-R276 IonicContact OE1-NH2 3.26Å; E153-R276 PolarHBondContact OE1-NH2 3.26Å; E153-R276 VanDerWaalsContact OE1-NH2 3.13Å; E156-R276 WeakPolarHBondContact OE1-CG 3.36Å; E156-R276 IonicContact OE1-NE 3.08Å; E156-R276 PolarHBondContact OE1-NE 2.99Å; E156-R276 VanDerWaalsContact OE1-NE 3.08Å; E156-R276 IonicContact OE2-CZ 2.8Å; E156-R276 VanDerWaalsContact OE2-CZ 3.26Å; E156-R276 IonicContact OE2-NE 3Å; E156-R276 PolarHBondContact OE2-NE 3.28Å; E156-R276 IonicContact OE2-NH2 3.63Å; E156-R276 PolarHBondContact OE2-NH2 3.22Å; N182-R276 PolarHBondContact ND2-O 2.8Å; Y185-R276 VanDerWaalsContact CE1-NH1 3.3Å; Y192-R276 HydrophobicContact CE2-CB 4.22Å; Y192-R276 PolarHBondContact OH-NH1 3.05Å; Q199-R276 VanDerWaalsContact NE2-NH2 3.19Å; R276-H278 PolarHBondContact O-CD2 3.18Å; R276-H278 PolarHBondContact O-N 2.91Å; R276-H278 VanDerWaalsContact O-N 3.09Å
277	N	97.1	Very high	98.2	Very high	94 Å²	94	36.2 Å²	36.2	50%	0.503	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.1	-5	-175.7	-62.3	-52.9	0	0	0	117.7	N182 H242 F275	N182-N277 PolarHBondContact OD1-ND2 2.85Å; H242-N277 PolarHBondContact CE1-O 2.99Å; F275-N277 VanDerWaalsContact C-N 3.29Å; F275-N277 PolarHBondContact O-N 3.4Å
278	H	98.5	Very high	98.1	Very high	1 Å²	1	38 Å²	38	1%	0.005	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	133.8	173.1	-61.3	-78	0	0	0	112	D186 Y192 M234 V235 T274 F275 R276 C280	D186-H278 IonicContact OD1-CE1 2.7Å; D186-H278 PolarHBondContact OD1-CE1 3.01Å; D186-H278 IonicContact OD1-NE2 2.86Å; D186-H278 PolarHBondContact OD1-NE2 2.94Å; D186-H278 IonicContact OD2-CE1 3.11Å; D186-H278 IonicContact OD2-NE2 2.62Å; Y192-H278 WeakPolarHBondContact CB-NE2 3.33Å; Y192-H278 AromaticContact CD2-CD2 3.51Å; Y192-H278 AromaticContact CD2-NE2 3.47Å; Y192-H278 WeakPolarHBondContact CD2-NE2 3.47Å; Y192-H278 AromaticContact CG-CD2 3.98Å; Y192-H278 AromaticContact CG-NE2 3.91Å; Y192-H278 PolarHBondContact N-CE1 3.24Å; M234-H278 HydrophobicContact CE-CB 4.13Å; V235-H278 PolarHBondContact O-ND1 2.87Å; T274-H278 CarbonylContact C-O 3.53Å; T274-H278 VanDerWaalsContact CA-O 3.28Å; T274-H278 WeakPolarHBondContact CA-O 3.45Å; T274-H278 WeakPolarHBondContact CG2-O 3.25Å; F275-H278 PolarHBondContact N-O 3.37Å; F275-H278 PolarHBondContact O-N 2.86Å; R276-H278 PolarHBondContact O-CD2 3.18Å; R276-H278 PolarHBondContact O-N 2.91Å; R276-H278 VanDerWaalsContact O-N 3.09Å; H278-C280 PolarHBondContact O-N 3.46Å
279	I	98.6	Very high	98.1	Very high	24 Å²	24	38 Å²	38	12%	0.123	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	128.6	162.9	-59.5	-177.7	0	0	0	108.3	V235 H242 A245 I249	V235-I279 HydrophobicContact CB-CB 4.2Å; V235-I279 VanDerWaalsContact CB-O 3.27Å; V235-I279 WeakPolarHBondContact CB-O 3.19Å; V235-I279 HydrophobicContact CG2-CB 4.32Å; V235-I279 VanDerWaalsContact CG2-O 3.3Å; V235-I279 WeakPolarHBondContact CG2-O 3.49Å; V235-I279 PolarHBondContact N-O 3.19Å; H242-I279 HydrophobicContact CB-CD1 3.89Å; A245-I279 HydrophobicContact CB-CB 4.31Å; A245-I279 HydrophobicContact CB-CD1 4.18Å; A245-I279 HydrophobicContact CB-CG2 3.97Å; I249-I279 HydrophobicContact CD1-CG2 4.07Å
280	C	98.7	Very high	98.1	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	135.4	-176.1	-68.7	0	0	0	0	110	L232 K233 H272 F273 H278	L232-C280 HydrophobicContact CD1-CB 4.13Å; K233-C280 WeakPolarHBondContact O-CA 3.4Å; H272-C280 CarbonylContact C-O 3.38Å; H272-C280 VanDerWaalsContact CA-O 3.25Å; H272-C280 WeakPolarHBondContact CA-O 3.44Å; F273-C280 HydrophobicContact CD1-CB 4.32Å; F273-C280 HydrophobicContact CD2-CB 3.62Å; F273-C280 HydrophobicContact CE1-CB 4.07Å; F273-C280 HydrophobicContact CE2-CB 3.32Å; F273-C280 HydrophobicContact CG-CB 4.11Å; F273-C280 HydrophobicContact CZ-CB 3.57Å; F273-C280 PolarHBondContact N-O 2.78Å; F273-C280 PolarHBondContact O-N 2.93Å; H278-C280 PolarHBondContact O-N 3.46Å
281	M	98.8	Very high	98.1	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	133.6	175.2	-69.5	167.8	-86	0	0	109.5	L232 K233 V235 A245 E248 I249 M269 H272 F283	L232-M281 CarbonylContact C-O 3.58Å; L232-M281 WeakPolarHBondContact CA-O 3.35Å; K233-M281 HydrophobicContact CB-CB 4.49Å; K233-M281 HydrophobicContact CD-CE 3.98Å; K233-M281 HydrophobicContact CG-CE 4.46Å; K233-M281 PolarHBondContact N-O 2.95Å; K233-M281 PolarHBondContact O-N 2.88Å; V235-M281 HydrophobicContact CG2-CE 3.49Å; V235-M281 VanDerWaalsContact CG2-CE 3.49Å; A245-M281 HydrophobicContact CB-CE 3.93Å; E248-M281 HydrophobicContact CG-SD 4.07Å; I249-M281 HydrophobicContact CD1-CG 4.12Å; I249-M281 HydrophobicContact CD1-SD 4.21Å; I249-M281 HydrophobicContact CG1-CG 3.92Å; I249-M281 HydrophobicContact CG1-SD 3.67Å; M269-M281 HydrophobicContact SD-CB 4.28Å; M269-M281 HydrophobicContact SD-CG 3.94Å; M269-M281 HydrophobicContact SD-SD 4.29Å; H272-M281 HydrophobicContact CB-CG 4.07Å; M281-F283 HydrophobicContact CB-CE2 3.55Å; M281-F283 HydrophobicContact CB-CZ 3.68Å; M281-F283 HydrophobicContact CG-CZ 4.48Å; M281-F283 HydrophobicContact SD-CZ 4.15Å
282	T	98.8	Very high	98.1	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	146.1	173.9	58.3	0	0	0	0	111.3	Y204 V230 A231 L232 M269 L270 E271 F273	Y204-T282 HydrophobicContact CD1-CG2 4.34Å; Y204-T282 HydrophobicContact CE1-CG2 3.75Å; Y204-T282 HydrophobicContact CE2-CG2 4.33Å; V230-T282 HydrophobicContact CG2-CG2 4.36Å; A231-T282 CarbonylContact O-C 3.5Å; A231-T282 WeakPolarHBondContact O-CA 3.32Å; L232-T282 HydrophobicContact CB-CG2 4.36Å; L232-T282 HydrophobicContact CD1-CG2 3.7Å; M269-T282 CarbonylContact C-O 3.49Å; M269-T282 WeakPolarHBondContact CA-O 3.19Å; M269-T282 WeakPolarHBondContact CG-O 3.38Å; L270-T282 PolarHBondContact N-O 3.25Å; E271-T282 WeakPolarHBondContact CB-OG1 3.3Å; E271-T282 PolarHBondContact N-OG1 3.28Å; E271-T282 VanDerWaalsContact N-OG1 3.09Å; E271-T282 PolarHBondContact O-N 3.21Å; E271-T282 PolarHBondContact O-OG1 3.04Å; F273-T282 HydrophobicContact CE1-CG2 4.23Å
283	F	98.8	Very high	98.1	Very high	16 Å²	16	30.9 Å²	30.9	7%	0.07	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	158.9	-176	-55.8	-89.5	0	0	0	110.9	A231 K233 L252 I267 H268 M269 M281 L285	A231-F283 HydrophobicContact CB-CB 4.39Å; A231-F283 PolarHBondContact N-O 2.76Å; A231-F283 PolarHBondContact O-N 3.13Å; K233-F283 HydrophobicContact CB-CD2 4.47Å; K233-F283 HydrophobicContact CB-CE2 3.76Å; K233-F283 HydrophobicContact CD-CE2 4.2Å; K233-F283 HydrophobicContact CD-CZ 4.5Å; L252-F283 HydrophobicContact CD1-CE1 3.79Å; L252-F283 HydrophobicContact CD1-CZ 4.42Å; I267-F283 HydrophobicContact CD1-CB 4.24Å; I267-F283 HydrophobicContact CG1-CB 4.02Å; I267-F283 HydrophobicContact CG1-CD1 3.58Å; I267-F283 HydrophobicContact CG1-CE1 4.4Å; I267-F283 HydrophobicContact CG1-CG 4.09Å; I267-F283 HydrophobicContact CG2-CD1 4.26Å; I267-F283 HydrophobicContact CG2-CE1 4.3Å; H268-F283 WeakPolarHBondContact O-CA 3.32Å; M269-F283 HydrophobicContact CB-CD1 3.95Å; M269-F283 HydrophobicContact CB-CE1 3.84Å; M269-F283 HydrophobicContact CG-CD1 4.39Å; M269-F283 HydrophobicContact CG-CE1 4.1Å; M281-F283 HydrophobicContact CB-CE2 3.55Å; M281-F283 HydrophobicContact CB-CZ 3.68Å; M281-F283 HydrophobicContact CG-CZ 4.48Å; M281-F283 HydrophobicContact SD-CZ 4.15Å; F283-L285 PolarHBondContact O-N 2.63Å
284	E	97.8	Very high	98.1	Very high	50 Å²	50	29 Å²	29	23%	0.234	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-51.8	135.3	164.7	71.4	-168.8	124.5	0	0	110.9	I267 H268 L286 K347	I267-E284 HydrophobicContact CD1-CG 3.67Å; H268-E284 WeakPolarHBondContact CB-OE1 3.22Å; H268-E284 IonicContact CG-OE1 2.74Å; H268-E284 PolarHBondContact N-OE1 2.97Å; H268-E284 PolarHBondContact O-N 2.87Å; H268-E284 VanDerWaalsContact O-N 3.17Å; E284-L286 HydrophobicContact CG-CD2 3.73Å; E284-L286 HydrophobicContact CG-CG 4.12Å; E284-L286 PolarHBondContact O-N 3.47Å; E284-K347 WeakPolarHBondContact OE1-CD 3.36Å; E284-K347 WeakPolarHBondContact OE1-CE 3.33Å; E284-K347 IonicContact OE1-NZ 2.97Å; E284-K347 PolarHBondContact OE1-NZ 2.86Å; E284-K347 IonicContact OE2-NZ 3.65Å; E284-K347 PolarHBondContact OE2-NZ 2.65Å
285	L	98	Very high	98.1	Very high	65 Å²	65	28.1 Å²	28.1	34%	0.34	14%	0.138	S	C	.	.			trans	-81.8	104.8	179.6	-175.8	64	0	0	0	110.8	I210 K220 H229 A231 F283	I210-L285 HydrophobicContact CD1-CD1 4.01Å; K220-L285 HydrophobicContact CD-CD2 4.14Å; K220-L285 HydrophobicContact CG-CD2 3.95Å; H229-L285 HydrophobicContact CB-CD2 3.72Å; A231-L285 HydrophobicContact CB-CD1 4.1Å; F283-L285 PolarHBondContact O-N 2.63Å
286	L	97.8	Very high	98.1	Very high	27 Å²	27	33.8 Å²	33.8	14%	0.141	16%	0.163	C	C	.	.			trans	-85.6	179.2	175.3	-56.3	-175.7	0	0	0	112.5	I267 E284 L337 K347 I349	I267-L286 HydrophobicContact CD1-CD1 3.51Å; I267-L286 HydrophobicContact CD1-CG 3.9Å; E284-L286 HydrophobicContact CG-CD2 3.73Å; E284-L286 HydrophobicContact CG-CG 4.12Å; E284-L286 PolarHBondContact O-N 3.47Å; L286-L337 HydrophobicContact CB-CB 4Å; L286-L337 HydrophobicContact CB-CD2 3.95Å; L286-L337 HydrophobicContact CD1-CB 3.78Å; L286-L337 HydrophobicContact CD1-CD2 4.36Å; L286-K347 HydrophobicContact CD1-CB 3.85Å; L286-K347 HydrophobicContact CD1-CD 4.43Å; L286-K347 HydrophobicContact CD1-CG 4.47Å; L286-K347 HydrophobicContact CD2-CD 4.41Å; L286-I349 HydrophobicContact CD1-CG2 4.16Å
287	S	97	Very high	98.1	Very high	32 Å²	32	36.1 Å²	36.1	22%	0.224	18%	0.176	C	C	.	.			trans	-96	-163.5	175.3	-162.9	0	0	0	0	111.8	L337 L338	S287-L337 WeakPolarHBondContact O-CD2 3.37Å; S287-L337 WeakPolarHBondContact O-CG 3.21Å; S287-L338 VanDerWaalsContact CB-O 3.32Å; S287-L338 WeakPolarHBondContact CB-O 3.45Å; S287-L338 PolarHBondContact N-O 3.43Å
288	M	96.5	Very high	98.1	Very high	48 Å²	48	39.3 Å²	39.3	24%	0.236	19%	0.186	C	C	.	.			trans	-58.2	151.3	-176.9	65.6	-167.8	64.2	0	0	113.7	E292 L293 K296 L338 Q341	M288-E292 HydrophobicContact CB-CB 4.4Å; M288-L293 HydrophobicContact SD-CD1 4.01Å; M288-K296 HydrophobicContact CE-CD 4.42Å; M288-K296 HydrophobicContact SD-CD 4.18Å; M288-L338 HydrophobicContact CG-CD1 4Å; M288-L338 PolarHBondContact O-N 3.2Å; M288-Q341 HydrophobicContact CE-CG 4.48Å
289	N	98.1	Very high	98.1	Very high	17 Å²	17	42.3 Å²	42.3	9%	0.091	20%	0.199	C	C	.	.	B	Isolated β-bridge	trans	-76.4	166.8	172.5	69.5	29.1	0	0	0	112.5	Y291 E292 L293 E334 I336 L337	N289-Y291 VanDerWaalsContact C-N 3.32Å; N289-Y291 PolarHBondContact O-N 3.21Å; N289-Y291 PolarHBondContact OD1-N 2.85Å; N289-E292 PolarHBondContact O-N 3.29Å; N289-E292 WeakPolarHBondContact OD1-CB 3.4Å; N289-E292 WeakPolarHBondContact OD1-CG 3.39Å; N289-E292 PolarHBondContact OD1-N 3.28Å; N289-L293 PolarHBondContact O-N 2.82Å; N289-E334 VanDerWaalsContact CB-O 3.23Å; N289-E334 WeakPolarHBondContact CB-O 3.47Å; N289-E334 WeakPolarHBondContact ND2-CA 3.47Å; N289-E334 PolarHBondContact ND2-O 2.82Å; N289-I336 CarbonylContact C-O 3.59Å; N289-I336 VanDerWaalsContact CA-O 3.25Å; N289-I336 WeakPolarHBondContact CA-O 3.49Å; N289-L337 HydrophobicContact CB-CD1 3.61Å; N289-L337 HydrophobicContact CB-CG 4.01Å
290	L	98.6	Very high	98.1	Very high	0 Å²	0	48 Å²	48	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-69.1	-27.1	-177.2	-65.5	-174.1	0	0	0	113.1	L293 I294 F310 P333 I336 L338 I346 L397	L290-L293 HydrophobicContact CD2-CD2 3.91Å; L290-L293 WeakPolarHBondContact O-CB 3.35Å; L290-L293 PolarHBondContact O-N 2.76Å; L290-I294 VanDerWaalsContact O-CG1 3.31Å; L290-I294 WeakPolarHBondContact O-CG1 3.45Å; L290-I294 PolarHBondContact O-N 3.09Å; L290-F310 HydrophobicContact CD1-CD1 4.46Å; L290-F310 HydrophobicContact CD1-CG 4.43Å; L290-F310 HydrophobicContact CD2-CD1 4.28Å; L290-F310 HydrophobicContact CD2-CE1 3.82Å; L290-F310 HydrophobicContact CD2-CE2 4.23Å; L290-F310 HydrophobicContact CD2-CZ 3.79Å; L290-P333 HydrophobicContact CB-CB 4.12Å; L290-P333 PolarHBondContact N-O 3.45Å; L290-I336 HydrophobicContact CD1-CB 3.91Å; L290-I336 HydrophobicContact CD1-CD1 4.37Å; L290-I336 HydrophobicContact CD1-CG2 3.55Å; L290-I336 HydrophobicContact CG-CB 4.11Å; L290-I336 HydrophobicContact CG-CG2 3.94Å; L290-I336 PolarHBondContact N-O 2.72Å; L290-L338 HydrophobicContact CD2-CD2 3.97Å; L290-I346 HydrophobicContact CD2-CG2 4.23Å; L290-L397 HydrophobicContact CB-CD2 4.19Å; L290-L397 HydrophobicContact CD1-CD1 4.13Å; L290-L397 HydrophobicContact CD1-CD2 4.1Å
291	Y	98.3	Very high	98.1	Very high	81 Å²	81	48.5 Å²	48.5	32%	0.318	23%	0.231	S	C	.	.	H	α-helix	trans	-64	-49.6	172.9	-177	-102	0	0	0	112.1	N289 L293 I294 K295 P333 E334	N289-Y291 VanDerWaalsContact C-N 3.32Å; N289-Y291 PolarHBondContact O-N 3.21Å; N289-Y291 PolarHBondContact OD1-N 2.85Å; Y291-L293 PolarHBondContact O-N 3.14Å; Y291-I294 PolarHBondContact O-N 2.85Å; Y291-I294 VanDerWaalsContact O-N 3.13Å; Y291-K295 WeakPolarHBondContact O-CB 3.49Å; Y291-K295 PolarHBondContact O-N 3.24Å; Y291-P333 PolarHBondContact N-O 3.28Å; Y291-E334 HydrophobicContact CG-CG 4.38Å
292	E	97.9	Very high	98.1	Very high	21 Å²	21	49.4 Å²	49.4	10%	0.098	24%	0.235	C	C	.	.	H	α-helix	trans	-64.9	-26.3	175.5	-69.7	-67.3	124.6	0	0	111.7	Q71 M288 N289 K295 K296	Q71-E292 PolarHBondContact NE2-OE2 3.35Å; M288-E292 HydrophobicContact CB-CB 4.4Å; N289-E292 PolarHBondContact O-N 3.29Å; N289-E292 WeakPolarHBondContact OD1-CB 3.4Å; N289-E292 WeakPolarHBondContact OD1-CG 3.39Å; N289-E292 PolarHBondContact OD1-N 3.28Å; E292-K295 VanDerWaalsContact OE1-CD 3.27Å; E292-K295 WeakPolarHBondContact OE1-CD 3.4Å; E292-K295 IonicContact OE1-NZ 3.57Å; E292-K295 PolarHBondContact OE1-NZ 3.23Å; E292-K295 IonicContact OE2-NZ 3.91Å; E292-K295 PolarHBondContact OE2-NZ 2.75Å; E292-K296 WeakPolarHBondContact O-CB 3.4Å; E292-K296 PolarHBondContact O-N 3.26Å
293	L	98.3	Very high	98	Very high	33 Å²	33	53.2 Å²	53.2	17%	0.173	26%	0.261	C	S	.	.	H	α-helix	trans	-69	-43.4	170.1	-167.4	68.5	0	0	0	112.6	M288 N289 L290 Y291 K296 N297 F302 F310 L338	M288-L293 HydrophobicContact SD-CD1 4.01Å; N289-L293 PolarHBondContact O-N 2.82Å; L290-L293 HydrophobicContact CD2-CD2 3.91Å; L290-L293 WeakPolarHBondContact O-CB 3.35Å; L290-L293 PolarHBondContact O-N 2.76Å; Y291-L293 PolarHBondContact O-N 3.14Å; L293-K296 PolarHBondContact O-N 3.03Å; L293-N297 WeakPolarHBondContact O-CB 3.47Å; L293-N297 PolarHBondContact O-N 3.05Å; L293-F302 HydrophobicContact CB-CZ 4.29Å; L293-F302 HydrophobicContact CD2-CE2 4.35Å; L293-F302 HydrophobicContact CD2-CZ 3.92Å; L293-F302 HydrophobicContact CG-CE1 4.34Å; L293-F302 HydrophobicContact CG-CZ 3.73Å; L293-F310 HydrophobicContact CD2-CE2 4.33Å; L293-F310 HydrophobicContact CD2-CZ 3.88Å; L293-L338 HydrophobicContact CD1-CD1 4.08Å; L293-L338 HydrophobicContact CD2-CD1 4.2Å; L293-L338 HydrophobicContact CD2-CD2 4.29Å
294	I	98.6	Very high	98	Very high	1 Å²	1	53.9 Å²	53.9	1%	0.005	27%	0.265	C	S	.	.	H	α-helix	trans	-60.8	-47	174.9	-67	160.2	0	0	0	110.1	L290 Y291 N297 K298 F299 F302 E396 L397	L290-I294 VanDerWaalsContact O-CG1 3.31Å; L290-I294 WeakPolarHBondContact O-CG1 3.45Å; L290-I294 PolarHBondContact O-N 3.09Å; Y291-I294 PolarHBondContact O-N 2.85Å; Y291-I294 VanDerWaalsContact O-N 3.13Å; I294-N297 CarbonylContact O-C 3.54Å; I294-N297 WeakPolarHBondContact O-CA 3.43Å; I294-N297 PolarHBondContact O-N 3.4Å; I294-N297 VanDerWaalsContact O-N 3.13Å; I294-K298 PolarHBondContact O-N 3.31Å; I294-F299 HydrophobicContact CG2-CD1 3.71Å; I294-F299 HydrophobicContact CG2-CE1 4.3Å; I294-F299 HydrophobicContact CG2-CG 4.45Å; I294-F299 PolarHBondContact O-N 3.1Å; I294-F302 HydrophobicContact CG1-CE2 3.61Å; I294-F302 HydrophobicContact CG1-CZ 4.05Å; I294-E396 HydrophobicContact CD1-CG 3.97Å; I294-L397 HydrophobicContact CD1-CD2 4.08Å; I294-L397 HydrophobicContact CG1-CD2 4.24Å
295	K	98.3	Very high	97.9	Very high	67 Å²	67	54.7 Å²	54.7	29%	0.291	28%	0.275	S	S	.	.	H	α-helix	trans	-61.1	-43.4	176.3	178	-172.5	173.1	-162.1	0	112.1	Y291 E292 N297 K298 F299	Y291-K295 WeakPolarHBondContact O-CB 3.49Å; Y291-K295 PolarHBondContact O-N 3.24Å; E292-K295 VanDerWaalsContact OE1-CD 3.27Å; E292-K295 WeakPolarHBondContact OE1-CD 3.4Å; E292-K295 IonicContact OE1-NZ 3.57Å; E292-K295 PolarHBondContact OE1-NZ 3.23Å; E292-K295 IonicContact OE2-NZ 3.91Å; E292-K295 PolarHBondContact OE2-NZ 2.75Å; K295-N297 VanDerWaalsContact C-N 3.26Å; K295-N297 PolarHBondContact O-N 3.16Å; K295-K298 WeakPolarHBondContact O-CA 3.3Å; K295-K298 PolarHBondContact O-N 3.3Å; K295-F299 HydrophobicContact CB-CE1 4.23Å; K295-F299 HydrophobicContact CB-CE2 4.39Å; K295-F299 HydrophobicContact CB-CZ 3.83Å; K295-F299 HydrophobicContact CG-CE2 4.29Å; K295-F299 HydrophobicContact CG-CZ 3.94Å
296	K	97.5	Very high	97.9	Very high	119 Å²	119	53.9 Å²	53.9	52%	0.517	27%	0.27	S	S	.	.	H	α-helix	trans	-62.8	-33.5	173.1	-177	169	-177.4	168.6	0	112.1	M288 E292 L293 K298	M288-K296 HydrophobicContact CE-CD 4.42Å; M288-K296 HydrophobicContact SD-CD 4.18Å; E292-K296 WeakPolarHBondContact O-CB 3.4Å; E292-K296 PolarHBondContact O-N 3.26Å; L293-K296 PolarHBondContact O-N 3.03Å; K296-K298 PolarHBondContact O-N 2.86Å
297	N	97.7	Very high	98	Very high	62 Å²	62	52.6 Å²	52.6	33%	0.332	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	21.1	170.5	-163.6	45.1	0	0	0	113.4	L293 I294 K295 F299 Q300 G301 F302	L293-N297 WeakPolarHBondContact O-CB 3.47Å; L293-N297 PolarHBondContact O-N 3.05Å; I294-N297 CarbonylContact O-C 3.54Å; I294-N297 WeakPolarHBondContact O-CA 3.43Å; I294-N297 PolarHBondContact O-N 3.4Å; I294-N297 VanDerWaalsContact O-N 3.13Å; K295-N297 VanDerWaalsContact C-N 3.26Å; K295-N297 PolarHBondContact O-N 3.16Å; N297-F299 PolarHBondContact O-N 3.25Å; N297-Q300 WeakPolarHBondContact O-CB 3.44Å; N297-Q300 WeakPolarHBondContact O-CG 3.24Å; N297-Q300 PolarHBondContact O-N 3.13Å; N297-G301 PolarHBondContact ND2-O 3.19Å; N297-F302 HydrophobicContact CB-CE1 3.69Å; N297-F302 HydrophobicContact CB-CZ 4.23Å; N297-F302 WeakPolarHBondContact ND2-CE1 3.28Å
298	K	98.4	Very high	98	Very high	162 Å²	162	52.7 Å²	52.7	70%	0.704	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.3	35.8	174.2	-56.2	-178.8	-178.9	179.8	0	114	I294 K295 K296 Q300	I294-K298 PolarHBondContact O-N 3.31Å; K295-K298 WeakPolarHBondContact O-CA 3.3Å; K295-K298 PolarHBondContact O-N 3.3Å; K296-K298 PolarHBondContact O-N 2.86Å; K298-Q300 HydrophobicContact CB-CG 4.34Å; K298-Q300 PolarHBondContact O-N 2.92Å; K298-Q300 VanDerWaalsContact O-N 3.08Å; K298-Q300 PolarHBondContact O-NE2 3.45Å
299	F	98.3	Very high	98	Very high	63 Å²	63	55.1 Å²	55.1	28%	0.276	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.4	23.4	-179	-50.5	-85.9	0	0	0	114.4	I294 K295 N297 G301 G400 Y401	I294-F299 HydrophobicContact CG2-CD1 3.71Å; I294-F299 HydrophobicContact CG2-CE1 4.3Å; I294-F299 HydrophobicContact CG2-CG 4.45Å; I294-F299 PolarHBondContact O-N 3.1Å; K295-F299 HydrophobicContact CB-CE1 4.23Å; K295-F299 HydrophobicContact CB-CE2 4.39Å; K295-F299 HydrophobicContact CB-CZ 3.83Å; K295-F299 HydrophobicContact CG-CE2 4.29Å; K295-F299 HydrophobicContact CG-CZ 3.94Å; N297-F299 PolarHBondContact O-N 3.25Å; F299-G301 PolarHBondContact O-N 3.03Å; F299-G400 WeakPolarHBondContact CD1-O 3.36Å; F299-Y401 HydrophobicContact CB-CE2 3.78Å; F299-Y401 VanDerWaalsContact O-CE2 3.3Å; F299-Y401 WeakPolarHBondContact O-CE2 3.37Å
300	Q	98.3	Very high	98.1	Very high	143 Å²	143	54.5 Å²	54.5	67%	0.668	27%	0.265	S	S	*	.			trans	-75.9	-11.8	179.2	-59.7	-55.3	-71.7	0	0	113.5	N297 K298	N297-Q300 WeakPolarHBondContact O-CB 3.44Å; N297-Q300 WeakPolarHBondContact O-CG 3.24Å; N297-Q300 PolarHBondContact O-N 3.13Å; K298-Q300 HydrophobicContact CB-CG 4.34Å; K298-Q300 PolarHBondContact O-N 2.92Å; K298-Q300 VanDerWaalsContact O-N 3.08Å; K298-Q300 PolarHBondContact O-NE2 3.45Å
301	G	98.3	Very high	98.1	Very high	12 Å²	12	54.5 Å²	54.5	12%	0.124	27%	0.265	C	S	.	.			trans	80.7	168.1	-174.1	0	0	0	0	0	113.7	N297 F299 L398	N297-G301 PolarHBondContact ND2-O 3.19Å; F299-G301 PolarHBondContact O-N 3.03Å; G301-L398 WeakPolarHBondContact CA-O 3.32Å
302	F	98.4	Very high	98.1	Very high	19 Å²	19	54.6 Å²	54.6	8%	0.083	27%	0.268	C	S	.	.			trans	-112.9	147.7	-178.8	-59.2	-54.7	0	0	0	111.8	L293 I294 N297 L306 V307 F310 L397 L398	L293-F302 HydrophobicContact CB-CZ 4.29Å; L293-F302 HydrophobicContact CD2-CE2 4.35Å; L293-F302 HydrophobicContact CD2-CZ 3.92Å; L293-F302 HydrophobicContact CG-CE1 4.34Å; L293-F302 HydrophobicContact CG-CZ 3.73Å; I294-F302 HydrophobicContact CG1-CE2 3.61Å; I294-F302 HydrophobicContact CG1-CZ 4.05Å; N297-F302 HydrophobicContact CB-CE1 3.69Å; N297-F302 HydrophobicContact CB-CZ 4.23Å; N297-F302 WeakPolarHBondContact ND2-CE1 3.28Å; F302-L306 HydrophobicContact CB-CB 4.49Å; F302-L306 HydrophobicContact CB-CD2 4.13Å; F302-L306 HydrophobicContact CB-CG 4.43Å; F302-L306 HydrophobicContact CD1-CD2 4.02Å; F302-L306 HydrophobicContact CG-CD2 4.11Å; F302-V307 HydrophobicContact CB-CG2 4.02Å; F302-F310 HydrophobicContact CD2-CE2 4.45Å; F302-L397 WeakPolarHBondContact CB-O 3.15Å; F302-L397 HydrophobicContact CD2-CB 4.18Å; F302-L397 HydrophobicContact CD2-CD2 3.77Å; F302-L397 WeakPolarHBondContact CD2-O 3.44Å; F302-L397 HydrophobicContact CE2-CD2 3.65Å; F302-L397 PolarHBondContact N-O 3.34Å; F302-L398 PolarHBondContact N-O 2.99Å; F302-L398 WeakPolarHBondContact O-CD1 3.37Å
303	S	98.1	Very high	98.1	Very high	79 Å²	79	54.6 Å²	54.6	55%	0.552	27%	0.271	S	S	*	.			trans	-62.2	142.6	176.6	64.4	0	0	0	0	111.7	P305 L306 V307	S303-P305 VanDerWaalsContact C-N 3.27Å; S303-P305 VanDerWaalsContact O-N 3.09Å; S303-L306 WeakPolarHBondContact O-CA 3.42Å; S303-L306 WeakPolarHBondContact O-CB 3.49Å; S303-L306 PolarHBondContact O-N 3.23Å; S303-V307 PolarHBondContact O-N 2.93Å; S303-V307 VanDerWaalsContact O-N 3.09Å
304	L	97	Very high	98.1	Very high	30 Å²	30	53 Å²	53	16%	0.157	26%	0.262	C	S	.	.	H	α-helix	trans	-47.9	-37.7	179.8	-79.3	172	0	0	0	114.7	L306 V307 R308 L398 D487 F490 W516	L304-L306 VanDerWaalsContact C-N 3.29Å; L304-L306 PolarHBondContact O-N 3.48Å; L304-V307 PolarHBondContact O-N 3.17Å; L304-R308 WeakPolarHBondContact O-CB 3.32Å; L304-R308 PolarHBondContact O-N 3.14Å; L304-L398 HydrophobicContact CD2-CD1 3.94Å; L304-L398 HydrophobicContact CD2-CD2 4.27Å; L304-L398 HydrophobicContact CG-CD1 4Å; L304-D487 HydrophobicContact CD1-CB 3.59Å; L304-F490 HydrophobicContact CD2-CB 4.13Å; L304-F490 HydrophobicContact CD2-CD1 3.76Å; L304-F490 HydrophobicContact CD2-CD2 4.17Å; L304-F490 HydrophobicContact CD2-CE1 4.21Å; L304-F490 HydrophobicContact CD2-CG 3.73Å; L304-W516 HydrophobicContact CD2-CZ2 4.49Å
305	P	97.2	Very high	98.1	Very high	67 Å²	67	53 Å²	53	44%	0.435	26%	0.262	S	S	.	.	H	α-helix	trans	-63.1	-27.9	174	-24.8	36.3	0	0	0	115	S303 K309	S303-P305 VanDerWaalsContact C-N 3.27Å; S303-P305 VanDerWaalsContact O-N 3.09Å; P305-K309 WeakPolarHBondContact O-CG 3.37Å; P305-K309 PolarHBondContact O-N 2.98Å
306	L	97.8	Very high	98.1	Very high	48 Å²	48	52.6 Å²	52.6	25%	0.251	26%	0.261	S	S	.	.	H	α-helix	trans	-82.1	-42.6	174	-179.5	56.4	0	0	0	111.3	F302 S303 L304 R308 K309 F310	F302-L306 HydrophobicContact CB-CB 4.49Å; F302-L306 HydrophobicContact CB-CD2 4.13Å; F302-L306 HydrophobicContact CB-CG 4.43Å; F302-L306 HydrophobicContact CD1-CD2 4.02Å; F302-L306 HydrophobicContact CG-CD2 4.11Å; S303-L306 WeakPolarHBondContact O-CA 3.42Å; S303-L306 WeakPolarHBondContact O-CB 3.49Å; S303-L306 PolarHBondContact O-N 3.23Å; L304-L306 VanDerWaalsContact C-N 3.29Å; L304-L306 PolarHBondContact O-N 3.48Å; L306-R308 VanDerWaalsContact C-N 3.26Å; L306-R308 PolarHBondContact O-N 2.86Å; L306-K309 WeakPolarHBondContact O-CB 3.49Å; L306-K309 PolarHBondContact O-N 3.09Å; L306-F310 HydrophobicContact CD1-CD2 4.24Å; L306-F310 HydrophobicContact CD1-CE1 4.48Å; L306-F310 HydrophobicContact CD1-CE2 3.72Å; L306-F310 HydrophobicContact CD1-CZ 3.85Å; L306-F310 HydrophobicContact CD2-CE2 4.12Å; L306-F310 HydrophobicContact CG-CD2 4.12Å; L306-F310 HydrophobicContact CG-CE2 3.63Å; L306-F310 HydrophobicContact CG-CZ 4.24Å; L306-F310 PolarHBondContact O-N 2.92Å
307	V	98.6	Very high	98.2	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-56.5	-42.3	172.5	-176.6	0	0	0	0	110.7	F302 S303 L304 K309 F310 A311 L394 L397 L398 F490 W516	F302-V307 HydrophobicContact CB-CG2 4.02Å; S303-V307 PolarHBondContact O-N 2.93Å; S303-V307 VanDerWaalsContact O-N 3.09Å; L304-V307 PolarHBondContact O-N 3.17Å; V307-K309 PolarHBondContact O-N 2.95Å; V307-F310 PolarHBondContact O-N 2.86Å; V307-A311 WeakPolarHBondContact O-CB 3.32Å; V307-A311 PolarHBondContact O-N 2.81Å; V307-L394 HydrophobicContact CG1-CB 4.17Å; V307-L394 HydrophobicContact CG1-CD2 4.03Å; V307-L397 HydrophobicContact CG1-CB 4.35Å; V307-L397 HydrophobicContact CG2-CB 4.22Å; V307-L398 HydrophobicContact CG2-CB 4.22Å; V307-F490 HydrophobicContact CG1-CE2 4.3Å; V307-F490 HydrophobicContact CG1-CZ 4.41Å; V307-W516 HydrophobicContact CG1-CH2 4.25Å; V307-W516 HydrophobicContact CG1-CZ2 4.46Å
308	R	97.9	Very high	98.3	Very high	34 Å²	34	44.3 Å²	44.3	13%	0.128	22%	0.223	C	C	.	.	H	α-helix	trans	-60	-38.3	174.3	-175.3	178.8	-68.7	110	2.4	113.3	L304 L306 H312 D487 W516 L517	L304-R308 WeakPolarHBondContact O-CB 3.32Å; L304-R308 PolarHBondContact O-N 3.14Å; L306-R308 VanDerWaalsContact C-N 3.26Å; L306-R308 PolarHBondContact O-N 2.86Å; R308-H312 PolarHBondContact O-N 3.41Å; R308-H312 VanDerWaalsContact O-N 3.09Å; R308-D487 IonicContact NH2-OD2 2.71Å; R308-W516 HydrophobicContact CB-CH2 4.19Å; R308-W516 HydrophobicContact CB-CZ2 3.87Å; R308-W516 WeakPolarHBondContact CD-O 3.14Å; R308-W516 HydrophobicContact CG-CZ2 4.44Å; R308-W516 PolarHBondContact NE-O 3.26Å; R308-W516 VanDerWaalsContact NH2-CD1 3.26Å; R308-L517 HydrophobicContact CG-CD2 3.75Å
309	K	97.5	Very high	98.3	Very high	100 Å²	100	37.1 Å²	37.1	44%	0.435	19%	0.192	S	C	.	.	H	α-helix	trans	-67.1	-47.2	175.5	-76.6	176.6	179	-177.3	0	111.3	P305 L306 V307 H312 S313	P305-K309 WeakPolarHBondContact O-CG 3.37Å; P305-K309 PolarHBondContact O-N 2.98Å; L306-K309 WeakPolarHBondContact O-CB 3.49Å; L306-K309 PolarHBondContact O-N 3.09Å; V307-K309 PolarHBondContact O-N 2.95Å; K309-H312 PolarHBondContact O-N 3.36Å; K309-S313 PolarHBondContact O-N 2.77Å; K309-S313 PolarHBondContact O-OG 3.31Å
310	F	98.7	Very high	98.3	Very high	3 Å²	3	34.3 Å²	34.3	1%	0.013	18%	0.18	C	C	.	.	H	α-helix	trans	-61.4	-46	175.8	-67	-47.1	0	0	0	111.6	L290 L293 F302 L306 V307 H312 S313 I314 L338 S344 I346 L397	L290-F310 HydrophobicContact CD1-CD1 4.46Å; L290-F310 HydrophobicContact CD1-CG 4.43Å; L290-F310 HydrophobicContact CD2-CD1 4.28Å; L290-F310 HydrophobicContact CD2-CE1 3.82Å; L290-F310 HydrophobicContact CD2-CE2 4.23Å; L290-F310 HydrophobicContact CD2-CZ 3.79Å; L293-F310 HydrophobicContact CD2-CE2 4.33Å; L293-F310 HydrophobicContact CD2-CZ 3.88Å; F302-F310 HydrophobicContact CD2-CE2 4.45Å; L306-F310 HydrophobicContact CD1-CD2 4.24Å; L306-F310 HydrophobicContact CD1-CE1 4.48Å; L306-F310 HydrophobicContact CD1-CE2 3.72Å; L306-F310 HydrophobicContact CD1-CZ 3.85Å; L306-F310 HydrophobicContact CD2-CE2 4.12Å; L306-F310 HydrophobicContact CG-CD2 4.12Å; L306-F310 HydrophobicContact CG-CE2 3.63Å; L306-F310 HydrophobicContact CG-CZ 4.24Å; L306-F310 PolarHBondContact O-N 2.92Å; V307-F310 PolarHBondContact O-N 2.86Å; F310-H312 PolarHBondContact O-N 3.43Å; F310-S313 PolarHBondContact O-N 3.31Å; F310-S313 VanDerWaalsContact O-N 3.17Å; F310-I314 HydrophobicContact CB-CD1 4.35Å; F310-I314 WeakPolarHBondContact O-CD1 3.35Å; F310-I314 WeakPolarHBondContact O-CG1 3.44Å; F310-I314 PolarHBondContact O-N 2.76Å; F310-L338 HydrophobicContact CE1-CD2 3.88Å; F310-L338 HydrophobicContact CZ-CD2 4.18Å; F310-S344 WeakPolarHBondContact CE1-O 3.36Å; F310-I346 HydrophobicContact CD1-CG2 3.85Å; F310-I346 HydrophobicContact CE1-CG2 3.83Å; F310-L397 HydrophobicContact CB-CD1 4.13Å; F310-L397 HydrophobicContact CD2-CD1 4.18Å; F310-L397 HydrophobicContact CD2-CD2 4.4Å; F310-L397 HydrophobicContact CG-CD1 4.49Å
311	A	98.8	Very high	98.3	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-53	-50.4	175.7	0	0	0	0	0	112.4	V307 S313 I314 L315 L394 W516 L517	V307-A311 WeakPolarHBondContact O-CB 3.32Å; V307-A311 PolarHBondContact O-N 2.81Å; A311-S313 PolarHBondContact O-N 2.9Å; A311-I314 PolarHBondContact O-N 3.4Å; A311-L315 WeakPolarHBondContact O-CB 3.29Å; A311-L315 WeakPolarHBondContact O-CD1 3.18Å; A311-L315 VanDerWaalsContact O-CG 3.26Å; A311-L315 WeakPolarHBondContact O-CG 3.47Å; A311-L315 PolarHBondContact O-N 2.63Å; A311-L394 HydrophobicContact CB-CD1 3.62Å; A311-L394 HydrophobicContact CB-CD2 3.64Å; A311-L394 HydrophobicContact CB-CG 4.29Å; A311-W516 HydrophobicContact CB-CH2 3.73Å; A311-W516 HydrophobicContact CB-CZ3 3.59Å; A311-L517 HydrophobicContact CB-CD2 4.19Å
312	H	98.4	Very high	98.3	Very high	83 Å²	83	29.3 Å²	29.3	38%	0.384	15%	0.154	S	C	.	.	H	α-helix	trans	-61.1	-45.5	177.4	-177.7	82.9	0	0	0	112.3	R308 K309 F310 L315 Q316	R308-H312 PolarHBondContact O-N 3.41Å; R308-H312 VanDerWaalsContact O-N 3.09Å; K309-H312 PolarHBondContact O-N 3.36Å; F310-H312 PolarHBondContact O-N 3.43Å; H312-L315 PolarHBondContact O-N 3.17Å; H312-Q316 PolarHBondContact CE1-NE2 3.11Å; H312-Q316 VanDerWaalsContact CE1-NE2 3.26Å; H312-Q316 PolarHBondContact NE2-NE2 3.09Å; H312-Q316 PolarHBondContact O-N 2.67Å
313	S	98.3	Very high	98.3	Very high	22 Å²	22	35.4 Å²	35.4	15%	0.154	18%	0.18	C	C	.	.	H	α-helix	trans	-66.5	-37.1	179.8	-65.8	0	0	0	0	113.7	N265 K309 F310 A311 Q316	N265-S313 PolarHBondContact ND2-O 2.77Å; N265-S313 VanDerWaalsContact ND2-O 3.08Å; K309-S313 PolarHBondContact O-N 2.77Å; K309-S313 PolarHBondContact O-OG 3.31Å; F310-S313 PolarHBondContact O-N 3.31Å; F310-S313 VanDerWaalsContact O-N 3.17Å; A311-S313 PolarHBondContact O-N 2.9Å; S313-Q316 PolarHBondContact O-N 3.01Å
314	I	98.9	Very high	98.3	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-68.3	-39.6	175.6	-62.3	157.9	0	0	0	110	F310 A311 Q316 C317 L318 L331 I336 I346 L390	F310-I314 HydrophobicContact CB-CD1 4.35Å; F310-I314 WeakPolarHBondContact O-CD1 3.35Å; F310-I314 WeakPolarHBondContact O-CG1 3.44Å; F310-I314 PolarHBondContact O-N 2.76Å; A311-I314 PolarHBondContact O-N 3.4Å; I314-Q316 VanDerWaalsContact C-N 3.3Å; I314-Q316 PolarHBondContact O-N 3.24Å; I314-C317 WeakPolarHBondContact O-CB 3.16Å; I314-C317 PolarHBondContact O-N 2.75Å; I314-C317 VanDerWaalsContact O-N 3.07Å; I314-L318 HydrophobicContact CG2-CD1 4.19Å; I314-L318 HydrophobicContact CG2-CG 4.27Å; I314-L318 PolarHBondContact O-N 3.44Å; I314-L331 HydrophobicContact CG2-CD2 4.34Å; I314-I336 HydrophobicContact CD1-CD1 3.79Å; I314-I336 HydrophobicContact CG1-CD1 4.08Å; I314-I336 HydrophobicContact CG1-CG2 4.31Å; I314-I346 HydrophobicContact CG1-CD1 4.11Å; I314-I346 HydrophobicContact CG1-CG1 4.39Å; I314-L390 HydrophobicContact CB-CD1 4.19Å; I314-L390 HydrophobicContact CD1-CD1 4.18Å; I314-L390 HydrophobicContact CG2-CD1 3.87Å
315	L	98.8	Very high	98.4	Very high	0 Å²	0	38 Å²	38	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-64.8	-27.5	177.8	-78.2	167.7	0	0	0	114.1	A311 H312 C317 L318 D319 I387 L390 F493 P508 A511 L512 L517	A311-L315 WeakPolarHBondContact O-CB 3.29Å; A311-L315 WeakPolarHBondContact O-CD1 3.18Å; A311-L315 VanDerWaalsContact O-CG 3.26Å; A311-L315 WeakPolarHBondContact O-CG 3.47Å; A311-L315 PolarHBondContact O-N 2.63Å; H312-L315 PolarHBondContact O-N 3.17Å; L315-C317 VanDerWaalsContact C-N 3.26Å; L315-C317 PolarHBondContact O-N 3.18Å; L315-L318 PolarHBondContact O-N 3.27Å; L315-D319 WeakPolarHBondContact O-CB 3.27Å; L315-D319 PolarHBondContact O-N 3.46Å; L315-I387 HydrophobicContact CD2-CD1 4.25Å; L315-L390 HydrophobicContact CD1-CD2 4.49Å; L315-L390 HydrophobicContact CD2-CD2 3.63Å; L315-L390 HydrophobicContact CG-CD2 3.91Å; L315-F493 HydrophobicContact CD1-CZ 4.18Å; L315-P508 HydrophobicContact CD2-CB 4.05Å; L315-A511 HydrophobicContact CD1-CB 3.74Å; L315-A511 HydrophobicContact CD2-CB 3.68Å; L315-A511 HydrophobicContact CG-CB 4.39Å; L315-L512 HydrophobicContact CB-CD1 4.47Å; L315-L512 HydrophobicContact CB-CD2 3.64Å; L315-L512 HydrophobicContact CB-CG 3.9Å; L315-L512 HydrophobicContact CD1-CD2 4.14Å; L315-L512 HydrophobicContact CD1-CG 4.3Å; L315-L517 HydrophobicContact CD1-CD1 3.4Å
316	Q	98.4	Very high	98.5	Very high	59 Å²	59	34.9 Å²	34.9	28%	0.276	16%	0.158	S	C	.	.	H	α-helix	trans	-61.4	-37.3	171.4	-61.3	-60.3	-11.9	0	0	111.7	M264 H312 S313 I314 A320	M264-Q316 CarbonylContact O-C 3.37Å; H312-Q316 PolarHBondContact CE1-NE2 3.11Å; H312-Q316 VanDerWaalsContact CE1-NE2 3.26Å; H312-Q316 PolarHBondContact NE2-NE2 3.09Å; H312-Q316 PolarHBondContact O-N 2.67Å; S313-Q316 PolarHBondContact O-N 3.01Å; I314-Q316 VanDerWaalsContact C-N 3.3Å; I314-Q316 PolarHBondContact O-N 3.24Å; Q316-A320 WeakPolarHBondContact O-CB 3.46Å; Q316-A320 PolarHBondContact O-N 2.61Å
317	C	98.8	Very high	98.5	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-68	-55	172.5	174.3	0	0	0	0	110.3	M264 V266 I314 L315 D319 A320 L321 V348	M264-C317 WeakPolarHBondContact O-CA 3.14Å; M264-C317 WeakPolarHBondContact O-CB 3.42Å; M264-C317 PolarHBondContact O-N 3.42Å; M264-C317 VanDerWaalsContact O-N 3.12Å; V266-C317 HydrophobicContact CG2-CB 4.37Å; I314-C317 WeakPolarHBondContact O-CB 3.16Å; I314-C317 PolarHBondContact O-N 2.75Å; I314-C317 VanDerWaalsContact O-N 3.07Å; L315-C317 VanDerWaalsContact C-N 3.26Å; L315-C317 PolarHBondContact O-N 3.18Å; C317-D319 VanDerWaalsContact C-N 3.28Å; C317-D319 PolarHBondContact O-N 3.01Å; C317-A320 WeakPolarHBondContact O-CA 3.35Å; C317-A320 WeakPolarHBondContact O-CB 3.23Å; C317-A320 PolarHBondContact O-N 3.23Å; C317-L321 WeakPolarHBondContact O-CG 3.28Å; C317-L321 PolarHBondContact O-N 3.5Å; C317-V348 HydrophobicContact CB-CB 4.44Å; C317-V348 HydrophobicContact CB-CG2 3.77Å
318	L	98.9	Very high	98.5	Very high	6 Å²	6	32.6 Å²	32.6	3%	0.031	15%	0.146	C	C	.	.	H	α-helix	trans	-61.7	-33.6	-175.6	-60.4	-176	0	0	0	113.3	I314 L315 L321 H322 L331 D386 I387 L390 P508	I314-L318 HydrophobicContact CG2-CD1 4.19Å; I314-L318 HydrophobicContact CG2-CG 4.27Å; I314-L318 PolarHBondContact O-N 3.44Å; L315-L318 PolarHBondContact O-N 3.27Å; L318-L321 HydrophobicContact CD2-CD1 4.37Å; L318-L321 PolarHBondContact O-N 3.39Å; L318-H322 WeakPolarHBondContact O-CB 3.37Å; L318-H322 PolarHBondContact O-N 3.17Å; L318-L331 HydrophobicContact CD1-CD2 4.1Å; L318-L331 HydrophobicContact CD2-CD2 4.19Å; L318-D386 HydrophobicContact CD2-CB 3.98Å; L318-I387 HydrophobicContact CD1-CD1 4.36Å; L318-L390 HydrophobicContact CD1-CB 4.23Å; L318-L390 HydrophobicContact CD1-CD2 4.2Å; L318-P508 HydrophobicContact CB-CB 4.14Å; L318-P508 HydrophobicContact CB-CG 3.87Å
319	D	98.6	Very high	98.6	Very high	12 Å²	12	31 Å²	31	6%	0.064	14%	0.139	C	C	.	.	H	α-helix	trans	-68.4	-38.3	174.2	-170.9	77	0	0	0	112.1	L315 C317 K323 P508 S509 L512	L315-D319 WeakPolarHBondContact O-CB 3.27Å; L315-D319 PolarHBondContact O-N 3.46Å; C317-D319 VanDerWaalsContact C-N 3.28Å; C317-D319 PolarHBondContact O-N 3.01Å; D319-K323 WeakPolarHBondContact O-CB 3.37Å; D319-K323 WeakPolarHBondContact O-CD 3.4Å; D319-K323 VanDerWaalsContact O-CG 3.27Å; D319-K323 WeakPolarHBondContact O-CG 3.33Å; D319-K323 PolarHBondContact O-N 2.86Å; D319-K323 WeakPolarHBondContact OD2-CE 3.09Å; D319-K323 IonicContact OD2-NZ 3.76Å; D319-K323 PolarHBondContact OD2-NZ 3.1Å; D319-P508 HydrophobicContact CB-CB 3.87Å; D319-S509 WeakPolarHBondContact OD1-CA 3.39Å; D319-S509 WeakPolarHBondContact OD1-CB 3.38Å; D319-S509 PolarHBondContact OD1-N 3.05Å; D319-S509 PolarHBondContact OD1-OG 3.42Å; D319-L512 HydrophobicContact CB-CD1 3.92Å
320	A	98.4	Very high	98.6	Very high	4 Å²	4	26.9 Å²	26.9	3%	0.033	12%	0.122	C	C	.	.	H	α-helix	trans	-66.9	-40.7	171.9	0	0	0	0	0	112.8	M264 Q316 C317 N324	M264-A320 HydrophobicContact CB-CB 4.27Å; M264-A320 HydrophobicContact CE-CB 4.09Å; M264-A320 HydrophobicContact CG-CB 3.94Å; M264-A320 HydrophobicContact SD-CB 3.64Å; Q316-A320 WeakPolarHBondContact O-CB 3.46Å; Q316-A320 PolarHBondContact O-N 2.61Å; C317-A320 WeakPolarHBondContact O-CA 3.35Å; C317-A320 WeakPolarHBondContact O-CB 3.23Å; C317-A320 PolarHBondContact O-N 3.23Å; A320-N324 PolarHBondContact O-N 2.89Å; A320-N324 PolarHBondContact O-ND2 2.84Å
321	L	98.8	Very high	98.6	Very high	2 Å²	2	26.8 Å²	26.8	1%	0.01	12%	0.122	C	C	.	.	H	α-helix	trans	-64.3	-44	174.3	-58.6	-168.4	0	0	0	111.3	L255 C317 L318 N324 R325 I326 H328 F351	L255-L321 HydrophobicContact CD1-CD2 3.51Å; L255-L321 HydrophobicContact CD2-CD2 3.98Å; L255-L321 HydrophobicContact CG-CD2 4.41Å; C317-L321 WeakPolarHBondContact O-CG 3.28Å; C317-L321 PolarHBondContact O-N 3.5Å; L318-L321 HydrophobicContact CD2-CD1 4.37Å; L318-L321 PolarHBondContact O-N 3.39Å; L321-N324 CarbonylContact O-C 3.54Å; L321-N324 WeakPolarHBondContact O-CA 3.32Å; L321-N324 PolarHBondContact O-N 3.47Å; L321-R325 PolarHBondContact O-N 2.97Å; L321-I326 HydrophobicContact CB-CB 4.26Å; L321-I326 HydrophobicContact CD2-CB 4.38Å; L321-I326 HydrophobicContact CD2-CG2 4.15Å; L321-I326 PolarHBondContact O-N 3.37Å; L321-H328 HydrophobicContact CD1-CB 3.98Å; L321-F351 HydrophobicContact CD1-CE1 3.95Å; L321-F351 HydrophobicContact CD1-CZ 4.42Å; L321-F351 HydrophobicContact CD2-CE1 3.75Å; L321-F351 HydrophobicContact CD2-CZ 4.27Å
322	H	98.7	Very high	98.6	Very high	48 Å²	48	27.7 Å²	27.7	22%	0.222	13%	0.126	C	C	.	.	H	α-helix	trans	-62.5	-44	179.8	-177.5	-92.8	0	0	0	112.4	L318 N324 R325 M383 P508	L318-H322 WeakPolarHBondContact O-CB 3.37Å; L318-H322 PolarHBondContact O-N 3.17Å; H322-N324 PolarHBondContact O-N 2.88Å; H322-R325 PolarHBondContact O-N 2.97Å; H322-M383 HydrophobicContact CB-SD 4.28Å; H322-M383 WeakPolarHBondContact CD2-CE 3.42Å; H322-P508 HydrophobicContact CB-CG 4.04Å
323	K	98.4	Very high	98.6	Very high	147 Å²	147	23.8 Å²	23.8	64%	0.639	11%	0.108	S	C	*	.	H	α-helix	trans	-56.8	-34.7	171.6	-77	163.2	174.2	162.2	0	112.8	D319	D319-K323 WeakPolarHBondContact O-CB 3.37Å; D319-K323 WeakPolarHBondContact O-CD 3.4Å; D319-K323 VanDerWaalsContact O-CG 3.27Å; D319-K323 WeakPolarHBondContact O-CG 3.33Å; D319-K323 PolarHBondContact O-N 2.86Å; D319-K323 WeakPolarHBondContact OD2-CE 3.09Å; D319-K323 IonicContact OD2-NZ 3.76Å; D319-K323 PolarHBondContact OD2-NZ 3.1Å
324	N	98.5	Very high	98.6	Very high	26 Å²	26	24.9 Å²	24.9	14%	0.139	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.5	3.6	-178.8	-76.3	-76.6	0	0	0	114.5	H254 L255 Q258 A320 L321 H322 I326	H254-N324 PolarHBondContact NE2-OD1 3.5Å; L255-N324 HydrophobicContact CD2-CB 4.43Å; Q258-N324 PolarHBondContact NE2-ND2 3.3Å; Q258-N324 PolarHBondContact NE2-OD1 3.36Å; Q258-N324 PolarHBondContact OE1-ND2 3.23Å; Q258-N324 PolarHBondContact OE1-OD1 3.06Å; A320-N324 PolarHBondContact O-N 2.89Å; A320-N324 PolarHBondContact O-ND2 2.84Å; L321-N324 CarbonylContact O-C 3.54Å; L321-N324 WeakPolarHBondContact O-CA 3.32Å; L321-N324 PolarHBondContact O-N 3.47Å; H322-N324 PolarHBondContact O-N 2.88Å; N324-I326 HydrophobicContact CB-CD1 3.74Å; N324-I326 HydrophobicContact CB-CG1 4.22Å; N324-I326 PolarHBondContact O-N 3.02Å
325	R	98.5	Very high	98.6	Very high	137 Å²	137	25.4 Å²	25.4	52%	0.517	11%	0.113	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.5	36.9	-175.4	-58.9	-59.9	-171.6	143	-6.6	113.7	L321 H322 Y356 E357	L321-R325 PolarHBondContact O-N 2.97Å; H322-R325 PolarHBondContact O-N 2.97Å; R325-Y356 CarbonylContact O-C 3.57Å; R325-Y356 WeakPolarHBondContact O-CA 3.49Å; R325-E357 HydrophobicContact CB-CB 4.34Å; R325-E357 IonicContact CZ-OE2 2.65Å; R325-E357 IonicContact NH1-OE2 3.35Å; R325-E357 PolarHBondContact NH1-OE2 3.03Å; R325-E357 PolarHBondContact O-N 2.84Å
326	I	98.8	Very high	98.6	Very high	2 Å²	2	25.4 Å²	25.4	1%	0.01	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	140.6	175.3	-66.1	159.5	0	0	0	109.1	I251 L255 L321 N324 Y356	I251-I326 HydrophobicContact CD1-CG2 4.3Å; I251-I326 HydrophobicContact CG2-CD1 4.16Å; I251-I326 HydrophobicContact CG2-CG2 4.22Å; L255-I326 HydrophobicContact CD1-CD1 4.31Å; L255-I326 HydrophobicContact CD2-CD1 4.02Å; L255-I326 HydrophobicContact CG-CD1 4.14Å; L321-I326 HydrophobicContact CB-CB 4.26Å; L321-I326 HydrophobicContact CD2-CB 4.38Å; L321-I326 HydrophobicContact CD2-CG2 4.15Å; L321-I326 PolarHBondContact O-N 3.37Å; N324-I326 HydrophobicContact CB-CD1 3.74Å; N324-I326 HydrophobicContact CB-CG1 4.22Å; N324-I326 PolarHBondContact O-N 3.02Å; I326-Y356 HydrophobicContact CD1-CE1 4.02Å; I326-Y356 HydrophobicContact CG1-CD1 3.85Å; I326-Y356 HydrophobicContact CG1-CE1 3.67Å; I326-Y356 HydrophobicContact CG1-CE2 4.5Å; I326-Y356 HydrophobicContact CG1-CG 4.36Å
327	I	98.8	Very high	98.6	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	128.7	172.6	-44.1	172.9	0	0	0	107.3	C329 S354 C355 E357 R360 Y381 M383 I385 D386	I327-C329 WeakPolarHBondContact CG2-SG 3.19Å; I327-S354 WeakPolarHBondContact O-CA 3.17Å; I327-S354 VanDerWaalsContact O-CB 3.22Å; I327-S354 WeakPolarHBondContact O-CB 3.35Å; I327-C355 PolarHBondContact N-O 3.47Å; I327-C355 PolarHBondContact O-N 3.14Å; I327-C355 VanDerWaalsContact O-N 3.15Å; I327-E357 HydrophobicContact CD1-CB 4.22Å; I327-E357 HydrophobicContact CD1-CG 4.43Å; I327-E357 HydrophobicContact CG1-CB 4.31Å; I327-R360 HydrophobicContact CD1-CG 4.39Å; I327-Y381 HydrophobicContact CD1-CD2 4.2Å; I327-Y381 HydrophobicContact CD1-CE2 3.99Å; I327-M383 HydrophobicContact CG1-CG 3.99Å; I327-I385 HydrophobicContact CG2-CD1 3.6Å; I327-I385 HydrophobicContact CG2-CG1 3.65Å; I327-D386 WeakPolarHBondContact CG2-OD2 3.13Å
328	H	98.8	Very high	98.6	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	11%	0.108	C	C	.	.			trans	-70.6	-39	-179.4	-169.7	-97.9	0	0	0	111.8	L321 D330 L331 V348 I349 F351 S354 D386	L321-H328 HydrophobicContact CD1-CB 3.98Å; H328-D330 PolarHBondContact CE1-O 3.28Å; H328-D330 VanDerWaalsContact ND1-C 3.33Å; H328-D330 PolarHBondContact O-N 2.99Å; H328-L331 PolarHBondContact ND1-N 2.71Å; H328-L331 VanDerWaalsContact ND1-N 3.19Å; H328-V348 WeakPolarHBondContact NE2-CG1 3.27Å; H328-I349 PolarHBondContact NE2-O 3.38Å; H328-F351 AromaticContact CD2-CD1 3.9Å; H328-F351 AromaticContact CD2-CE1 3.65Å; H328-F351 AromaticContact CD2-CZ 3.75Å; H328-F351 AromaticContact NE2-CE2 3.99Å; H328-S354 WeakPolarHBondContact CA-OG 3.31Å; H328-S354 WeakPolarHBondContact O-CA 3.29Å; H328-S354 PolarHBondContact O-N 3.26Å; H328-S354 PolarHBondContact O-OG 3.19Å; H328-D386 WeakPolarHBondContact CB-OD1 3.41Å; H328-D386 PolarHBondContact N-OD2 3.27Å
329	C	98.4	Very high	98.5	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	12%	0.121	C	C	.	.	S	Bend	trans	65.9	-8.6	174.6	-62.9	0	0	0	0	117	I327 S353 I365 Q366 D386	I327-C329 WeakPolarHBondContact CG2-SG 3.19Å; C329-S353 WeakPolarHBondContact CB-O 3.5Å; C329-I365 HydrophobicContact CB-CD1 4.29Å; C329-Q366 WeakPolarHBondContact O-CA 3.47Å; C329-Q366 WeakPolarHBondContact O-CG 3.38Å; C329-Q366 PolarHBondContact O-N 2.84Å; C329-D386 PolarHBondContact N-OD1 3.42Å
330	D	98.1	Very high	98.3	Very high	14 Å²	14	32.5 Å²	32.5	8%	0.075	15%	0.146	C	C	.	.			trans	-147.6	52.7	169.2	-162.9	30.8	0	0	0	113	H328 K332 N335 S367	H328-D330 PolarHBondContact CE1-O 3.28Å; H328-D330 VanDerWaalsContact ND1-C 3.33Å; H328-D330 PolarHBondContact O-N 2.99Å; D330-K332 IonicContact OD1-NZ 3.62Å; D330-K332 IonicContact OD2-NZ 2.82Å; D330-K332 PolarHBondContact OD2-NZ 3.27Å; D330-N335 PolarHBondContact O-ND2 3.21Å; D330-S367 VanDerWaalsContact OD1-CB 3.23Å; D330-S367 WeakPolarHBondContact OD1-CB 3.32Å; D330-S367 PolarHBondContact OD1-N 3.17Å; D330-S367 PolarHBondContact OD1-OG 3.31Å; D330-S367 PolarHBondContact OD2-OG 3.19Å
331	L	98.8	Very high	98	Very high	1 Å²	1	38.6 Å²	38.6	1%	0.005	17%	0.174	C	C	.	.			trans	-75.2	124.7	174.9	-168.9	77.2	0	0	0	110.3	I314 L318 H328 I336 V348 D386 S389 L390 I393	I314-L331 HydrophobicContact CG2-CD2 4.34Å; L318-L331 HydrophobicContact CD1-CD2 4.1Å; L318-L331 HydrophobicContact CD2-CD2 4.19Å; H328-L331 PolarHBondContact ND1-N 2.71Å; H328-L331 VanDerWaalsContact ND1-N 3.19Å; L331-I336 HydrophobicContact CD1-CD1 4.34Å; L331-I336 HydrophobicContact CD1-CG1 4.36Å; L331-V348 HydrophobicContact CD1-CG1 3.8Å; L331-V348 HydrophobicContact CD1-CG2 4.38Å; L331-D386 WeakPolarHBondContact CD2-O 3.32Å; L331-S389 WeakPolarHBondContact O-CB 3.36Å; L331-L390 HydrophobicContact CD2-CB 4.47Å; L331-I393 HydrophobicContact CD2-CD1 3.95Å; L331-I393 HydrophobicContact CG-CD1 3.78Å
332	K	98.7	Very high	97.6	Very high	19 Å²	19	42.2 Å²	42.2	8%	0.083	21%	0.211	C	C	.	.			trans	-160.8	163.7	-176.8	64.3	-166.8	-172.7	-149.6	0	111.4	D330 E334 N335 S367 Y370	D330-K332 IonicContact OD1-NZ 3.62Å; D330-K332 IonicContact OD2-NZ 2.82Å; D330-K332 PolarHBondContact OD2-NZ 3.27Å; K332-E334 WeakPolarHBondContact CB-OE2 3.2Å; K332-E334 HydrophobicContact CD-CB 4.45Å; K332-E334 HydrophobicContact CG-CB 4.19Å; K332-E334 VanDerWaalsContact CG-OE2 3.31Å; K332-E334 WeakPolarHBondContact CG-OE2 3.49Å; K332-E334 PolarHBondContact O-N 3.04Å; K332-N335 WeakPolarHBondContact CE-OD1 3.18Å; K332-N335 HydrophobicContact CG-CB 3.93Å; K332-N335 PolarHBondContact O-N 3.36Å; K332-S367 VanDerWaalsContact CD-OG 3.28Å; K332-S367 WeakPolarHBondContact CD-OG 3.31Å; K332-S367 PolarHBondContact NZ-OG 2.91Å; K332-S367 VanDerWaalsContact NZ-OG 3.17Å; K332-Y370 HydrophobicContact CB-CD2 3.53Å; K332-Y370 HydrophobicContact CB-CE2 3.46Å; K332-Y370 VanDerWaalsContact CB-CE2 3.46Å; K332-Y370 HydrophobicContact CB-CG 4.27Å
333	P	98.8	Very high	97.5	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-60.1	-26.6	-179.6	-21.9	34.5	0	0	0	113.9	L290 Y291 N335 Y370 I393	L290-P333 HydrophobicContact CB-CB 4.12Å; L290-P333 PolarHBondContact N-O 3.45Å; Y291-P333 PolarHBondContact N-O 3.28Å; P333-N335 VanDerWaalsContact C-N 3.34Å; P333-Y370 WeakPolarHBondContact CD-OH 3.42Å; P333-Y370 HydrophobicContact CG-CE1 4.07Å; P333-I393 HydrophobicContact CG-CG1 4.17Å; P333-I393 HydrophobicContact CG-CG2 4.42Å
334	E	97.9	Very high	97.3	Very high	45 Å²	45	43.2 Å²	43.2	21%	0.21	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-70.3	-28.6	174.3	-52.4	96.2	116.1	0	0	113.2	N289 Y291 K332 L337	N289-E334 VanDerWaalsContact CB-O 3.23Å; N289-E334 WeakPolarHBondContact CB-O 3.47Å; N289-E334 WeakPolarHBondContact ND2-CA 3.47Å; N289-E334 PolarHBondContact ND2-O 2.82Å; Y291-E334 HydrophobicContact CG-CG 4.38Å; K332-E334 WeakPolarHBondContact CB-OE2 3.2Å; K332-E334 HydrophobicContact CD-CB 4.45Å; K332-E334 HydrophobicContact CG-CB 4.19Å; K332-E334 VanDerWaalsContact CG-OE2 3.31Å; K332-E334 WeakPolarHBondContact CG-OE2 3.49Å; K332-E334 PolarHBondContact O-N 3.04Å; E334-L337 WeakPolarHBondContact O-CD1 3.45Å
335	N	98.6	Very high	97.3	Very high	11 Å²	11	43.4 Å²	43.4	6%	0.059	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-97	16.8	-177.8	-71.9	3.2	0	0	0	112.8	D330 K332 P333 I349	D330-N335 PolarHBondContact O-ND2 3.21Å; K332-N335 WeakPolarHBondContact CE-OD1 3.18Å; K332-N335 HydrophobicContact CG-CB 3.93Å; K332-N335 PolarHBondContact O-N 3.36Å; P333-N335 VanDerWaalsContact C-N 3.34Å; N335-I349 HydrophobicContact CB-CG1 4.18Å; N335-I349 PolarHBondContact O-N 3.35Å
336	I	98.8	Very high	97.3	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	113.9	173.9	-56.7	162.1	0	0	0	107.8	N289 L290 I314 L331 I346 K347 V348 I393	N289-I336 CarbonylContact C-O 3.59Å; N289-I336 VanDerWaalsContact CA-O 3.25Å; N289-I336 WeakPolarHBondContact CA-O 3.49Å; L290-I336 HydrophobicContact CD1-CB 3.91Å; L290-I336 HydrophobicContact CD1-CD1 4.37Å; L290-I336 HydrophobicContact CD1-CG2 3.55Å; L290-I336 HydrophobicContact CG-CB 4.11Å; L290-I336 HydrophobicContact CG-CG2 3.94Å; L290-I336 PolarHBondContact N-O 2.72Å; I314-I336 HydrophobicContact CD1-CD1 3.79Å; I314-I336 HydrophobicContact CG1-CD1 4.08Å; I314-I336 HydrophobicContact CG1-CG2 4.31Å; L331-I336 HydrophobicContact CD1-CD1 4.34Å; L331-I336 HydrophobicContact CD1-CG1 4.36Å; I336-I346 HydrophobicContact CG2-CB 3.8Å; I336-I346 HydrophobicContact CG2-CD1 4.17Å; I336-I346 HydrophobicContact CG2-CG1 3.9Å; I336-I346 HydrophobicContact CG2-CG2 4.04Å; I336-K347 WeakPolarHBondContact CA-O 3.4Å; I336-V348 HydrophobicContact CG1-CG2 4.5Å; I336-I393 HydrophobicContact CD1-CD1 4.1Å; I336-I393 HydrophobicContact CD1-CG2 4.28Å
337	L	98.6	Very high	97.3	Very high	28 Å²	28	36.8 Å²	36.8	15%	0.147	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	141.6	-173.1	-83.7	63.6	0	0	0	111.8	L286 S287 N289 E334 I346 K347 I349	L286-L337 HydrophobicContact CB-CB 4Å; L286-L337 HydrophobicContact CB-CD2 3.95Å; L286-L337 HydrophobicContact CD1-CB 3.78Å; L286-L337 HydrophobicContact CD1-CD2 4.36Å; S287-L337 WeakPolarHBondContact O-CD2 3.37Å; S287-L337 WeakPolarHBondContact O-CG 3.21Å; N289-L337 HydrophobicContact CB-CD1 3.61Å; N289-L337 HydrophobicContact CB-CG 4.01Å; E334-L337 WeakPolarHBondContact O-CD1 3.45Å; L337-I346 CarbonylContact O-C 3.57Å; L337-I346 WeakPolarHBondContact O-CA 3.48Å; L337-I346 WeakPolarHBondContact O-CB 3.38Å; L337-K347 PolarHBondContact N-O 3.25Å; L337-K347 PolarHBondContact O-N 3.04Å; L337-I349 HydrophobicContact CB-CG2 4.46Å; L337-I349 HydrophobicContact CD1-CD1 3.45Å; L337-I349 VanDerWaalsContact CD1-CD1 3.45Å; L337-I349 HydrophobicContact CD1-CG1 3.75Å; L337-I349 HydrophobicContact CD1-CG2 4.06Å; L337-I349 HydrophobicContact CD2-CD1 4.13Å; L337-I349 HydrophobicContact CD2-CG2 4.36Å; L337-I349 HydrophobicContact CG-CD1 4.46Å
338	L	98.5	Very high	97.3	Very high	5 Å²	5	36.8 Å²	36.8	3%	0.026	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	131.6	170	-63.3	-178	0	0	0	109.9	S287 M288 L290 L293 F310 Q340 I346	S287-L338 VanDerWaalsContact CB-O 3.32Å; S287-L338 WeakPolarHBondContact CB-O 3.45Å; S287-L338 PolarHBondContact N-O 3.43Å; M288-L338 HydrophobicContact CG-CD1 4Å; M288-L338 PolarHBondContact O-N 3.2Å; L290-L338 HydrophobicContact CD2-CD2 3.97Å; L293-L338 HydrophobicContact CD1-CD1 4.08Å; L293-L338 HydrophobicContact CD2-CD1 4.2Å; L293-L338 HydrophobicContact CD2-CD2 4.29Å; F310-L338 HydrophobicContact CE1-CD2 3.88Å; F310-L338 HydrophobicContact CZ-CD2 4.18Å; L338-Q340 PolarHBondContact O-N 2.91Å; L338-I346 HydrophobicContact CD2-CG2 3.83Å
339	K	96.9	Very high	97.2	Very high	68 Å²	68	38.6 Å²	38.6	30%	0.296	21%	0.207	S	C	.	.	S	Bend	trans	-58.8	-37.6	173.3	-66	-171.6	-168.7	-173.2	0	111.4	S262 N265 G345 I346 K347	S262-K339 PolarHBondContact O-NZ 2.82Å; N265-K339 VanDerWaalsContact OD1-CE 3.28Å; N265-K339 WeakPolarHBondContact OD1-CE 3.41Å; N265-K339 PolarHBondContact OD1-NZ 3.48Å; K339-G345 PolarHBondContact N-O 3.49Å; K339-I346 WeakPolarHBondContact CE-O 3.4Å; K339-K347 HydrophobicContact CD-CG 4.31Å; K339-K347 HydrophobicContact CG-CG 4.06Å
340	Q	95.5	Very high	97.2	Very high	125 Å²	125	39.5 Å²	39.5	58%	0.584	21%	0.212	S	C	*	.	S	Bend	trans	-149.2	146.5	179	-67.4	179.8	-19	0	0	110.7	L338 G342 R343	L338-Q340 PolarHBondContact O-N 2.91Å; Q340-G342 PolarHBondContact O-N 3.22Å; Q340-R343 HydrophobicContact CB-CB 4.29Å; Q340-R343 HydrophobicContact CB-CG 4.07Å; Q340-R343 PolarHBondContact O-N 3.02Å
341	Q	91.7	Very high	97.1	Very high	133 Å²	133	38.9 Å²	38.9	62%	0.621	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.7	135.8	175.2	-179	167.2	-44.5	0	0	111.1	M288 R343	M288-Q341 HydrophobicContact CE-CG 4.48Å; Q341-R343 PolarHBondContact O-N 3.27Å
342	G	90.9	Very high	97	Very high	77 Å²	77	39.3 Å²	39.3	79%	0.794	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	75.6	1.4	-179.3	0	0	0	0	0	115.1	Q340	Q340-G342 PolarHBondContact O-N 3.22Å
343	R	95.3	Very high	96.8	Very high	176 Å²	176	40.4 Å²	40.4	66%	0.664	22%	0.223	S	C	*	.			trans	-109.2	160.1	170.5	-57	-61.7	-174.4	154.7	0.5	109.8	Q340 Q341	Q340-R343 HydrophobicContact CB-CB 4.29Å; Q340-R343 HydrophobicContact CB-CG 4.07Å; Q340-R343 PolarHBondContact O-N 3.02Å; Q341-R343 PolarHBondContact O-N 3.27Å
344	S	94.6	Very high	96.8	Very high	40 Å²	40	40.7 Å²	40.7	28%	0.28	23%	0.226	S	C	.	.			trans	-104.9	-0.2	-177.3	31.5	0	0	0	0	114.7	F310	F310-S344 WeakPolarHBondContact CE1-O 3.36Å
345	G	97.6	Very high	96.8	Very high	30 Å²	30	39.2 Å²	39.2	31%	0.309	22%	0.22	S	C	.	.			trans	-70.3	133	170.6	0	0	0	0	0	110.4	K339	K339-G345 PolarHBondContact N-O 3.49Å
346	I	98.6	Very high	96.7	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	168.6	-179.1	54.7	68.5	0	0	0	112.6	N265 L290 F310 I314 I336 L337 L338 K339	N265-I346 HydrophobicContact CB-CD1 4.14Å; N265-I346 WeakPolarHBondContact CB-O 3.4Å; N265-I346 PolarHBondContact OD1-O 3.01Å; L290-I346 HydrophobicContact CD2-CG2 4.23Å; F310-I346 HydrophobicContact CD1-CG2 3.85Å; F310-I346 HydrophobicContact CE1-CG2 3.83Å; I314-I346 HydrophobicContact CG1-CD1 4.11Å; I314-I346 HydrophobicContact CG1-CG1 4.39Å; I336-I346 HydrophobicContact CG2-CB 3.8Å; I336-I346 HydrophobicContact CG2-CD1 4.17Å; I336-I346 HydrophobicContact CG2-CG1 3.9Å; I336-I346 HydrophobicContact CG2-CG2 4.04Å; L337-I346 CarbonylContact O-C 3.57Å; L337-I346 WeakPolarHBondContact O-CA 3.48Å; L337-I346 WeakPolarHBondContact O-CB 3.38Å; L338-I346 HydrophobicContact CD2-CG2 3.83Å; K339-I346 WeakPolarHBondContact CE-O 3.4Å
347	K	98.8	Very high	96.6	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	151.4	155.3	-67.5	-171.7	158.2	-154.6	0	110.8	N265 V266 H268 E284 L286 I336 L337 K339	N265-K347 CarbonylContact O-C 3.21Å; N265-K347 WeakPolarHBondContact O-CA 3.36Å; N265-K347 WeakPolarHBondContact O-CB 3.37Å; V266-K347 VanDerWaalsContact O-CD 3.29Å; V266-K347 WeakPolarHBondContact O-CD 3.22Å; V266-K347 VanDerWaalsContact O-CE 3.29Å; V266-K347 WeakPolarHBondContact O-CE 3.35Å; V266-K347 PolarHBondContact O-NZ 2.87Å; H268-K347 PolarHBondContact CD2-NZ 2.83Å; H268-K347 PolarHBondContact CE1-NZ 3.5Å; H268-K347 VanDerWaalsContact CG-NZ 3.26Å; H268-K347 PolarHBondContact ND1-NZ 2.84Å; H268-K347 PolarHBondContact NE2-NZ 2.82Å; E284-K347 WeakPolarHBondContact OE1-CD 3.36Å; E284-K347 WeakPolarHBondContact OE1-CE 3.33Å; E284-K347 IonicContact OE1-NZ 2.97Å; E284-K347 PolarHBondContact OE1-NZ 2.86Å; E284-K347 IonicContact OE2-NZ 3.65Å; E284-K347 PolarHBondContact OE2-NZ 2.65Å; L286-K347 HydrophobicContact CD1-CB 3.85Å; L286-K347 HydrophobicContact CD1-CD 4.43Å; L286-K347 HydrophobicContact CD1-CG 4.47Å; L286-K347 HydrophobicContact CD2-CD 4.41Å; I336-K347 WeakPolarHBondContact CA-O 3.4Å; L337-K347 PolarHBondContact N-O 3.25Å; L337-K347 PolarHBondContact O-N 3.04Å; K339-K347 HydrophobicContact CD-CG 4.31Å; K339-K347 HydrophobicContact CG-CG 4.06Å
348	V	98.8	Very high	96.4	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	140.1	169.7	-175.4	0	0	0	0	109.2	N265 I267 C317 H328 L331 I336 F351	N265-V348 PolarHBondContact O-N 2.84Å; I267-V348 PolarHBondContact N-O 2.96Å; I267-V348 VanDerWaalsContact N-O 3.09Å; C317-V348 HydrophobicContact CB-CB 4.44Å; C317-V348 HydrophobicContact CB-CG2 3.77Å; H328-V348 WeakPolarHBondContact NE2-CG1 3.27Å; L331-V348 HydrophobicContact CD1-CG1 3.8Å; L331-V348 HydrophobicContact CD1-CG2 4.38Å; I336-V348 HydrophobicContact CG1-CG2 4.5Å; V348-F351 HydrophobicContact CG1-CE2 4.4Å
349	I	98.5	Very high	96.2	Very high	38 Å²	38	50 Å²	50	20%	0.195	27%	0.268	C	S	.	.			trans	-129.4	172.4	-176.2	75.7	157.1	0	0	0	112.1	I267 L286 H328 N335 L337	I267-I349 HydrophobicContact CB-CG2 4.14Å; I267-I349 HydrophobicContact CD1-CG2 4.1Å; I267-I349 HydrophobicContact CG1-CG2 4.33Å; L286-I349 HydrophobicContact CD1-CG2 4.16Å; H328-I349 PolarHBondContact NE2-O 3.38Å; N335-I349 HydrophobicContact CB-CG1 4.18Å; N335-I349 PolarHBondContact O-N 3.35Å; L337-I349 HydrophobicContact CB-CG2 4.46Å; L337-I349 HydrophobicContact CD1-CD1 3.45Å; L337-I349 VanDerWaalsContact CD1-CD1 3.45Å; L337-I349 HydrophobicContact CD1-CG1 3.75Å; L337-I349 HydrophobicContact CD1-CG2 4.06Å; L337-I349 HydrophobicContact CD2-CD1 4.13Å; L337-I349 HydrophobicContact CD2-CG2 4.36Å; L337-I349 HydrophobicContact CG-CD1 4.46Å
350	D	96.4	Very high	96	Very high	20 Å²	20	50.2 Å²	50.2	11%	0.107	27%	0.267	C	S	.	.			trans	64.6	69.5	171.2	-167.2	32.9	0	0	0	114.6	K233 G352	K233-D350 IonicContact NZ-OD1 3.56Å; K233-D350 PolarHBondContact NZ-OD1 3.32Å; D350-G352 PolarHBondContact O-N 2.85Å
351	F	97.8	Very high	95.5	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-83.3	9.1	178.8	-76.2	-104.1	0	0	0	112.6	E248 I251 L252 L255 V266 I267 L321 H328 V348 S353 S354	E248-F351 HydrophobicContact CG-CB 3.98Å; E248-F351 PolarHBondContact OE1-N 3.25Å; I251-F351 HydrophobicContact CG2-CD1 3.73Å; I251-F351 HydrophobicContact CG2-CE1 4.35Å; I251-F351 HydrophobicContact CG2-CG 4.43Å; L252-F351 HydrophobicContact CD2-CB 4.46Å; L252-F351 HydrophobicContact CD2-CD2 3.74Å; L252-F351 HydrophobicContact CD2-CE2 4.1Å; L252-F351 HydrophobicContact CD2-CG 4.04Å; L252-F351 HydrophobicContact CG-CB 4.4Å; L252-F351 HydrophobicContact CG-CG 4.48Å; L255-F351 HydrophobicContact CD1-CE1 4.11Å; V266-F351 HydrophobicContact CG1-CE2 3.9Å; V266-F351 HydrophobicContact CG1-CZ 3.87Å; V266-F351 HydrophobicContact CG2-CZ 4.36Å; I267-F351 HydrophobicContact CG2-CD2 4.36Å; I267-F351 HydrophobicContact CG2-CE2 4.39Å; L321-F351 HydrophobicContact CD1-CE1 3.95Å; L321-F351 HydrophobicContact CD1-CZ 4.42Å; L321-F351 HydrophobicContact CD2-CE1 3.75Å; L321-F351 HydrophobicContact CD2-CZ 4.27Å; H328-F351 AromaticContact CD2-CD1 3.9Å; H328-F351 AromaticContact CD2-CE1 3.65Å; H328-F351 AromaticContact CD2-CZ 3.75Å; H328-F351 AromaticContact NE2-CE2 3.99Å; V348-F351 HydrophobicContact CG1-CE2 4.4Å; F351-S353 PolarHBondContact O-N 3.07Å; F351-S353 VanDerWaalsContact O-N 3.16Å; F351-S354 WeakPolarHBondContact CA-OG 3.45Å; F351-S354 WeakPolarHBondContact CD1-OG 3.4Å; F351-S354 VanDerWaalsContact O-CB 3.22Å; F351-S354 WeakPolarHBondContact O-CB 3.29Å; F351-S354 PolarHBondContact O-N 2.9Å; F351-S354 PolarHBondContact O-OG 2.86Å
352	G	95.3	Very high	95.5	Very high	11 Å²	11	46.8 Å²	46.8	11%	0.113	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-64.6	-14.7	178.7	0	0	0	0	0	115.2	Q244 E248 D350	Q244-G352 WeakPolarHBondContact CB-O 3.28Å; Q244-G352 WeakPolarHBondContact CG-O 3.49Å; Q244-G352 PolarHBondContact NE2-O 2.97Å; E248-G352 VanDerWaalsContact CD-N 3.28Å; E248-G352 PolarHBondContact OE1-N 2.72Å; E248-G352 WeakPolarHBondContact OE2-CA 3.1Å; D350-G352 PolarHBondContact O-N 2.85Å
353	S	95.8	Very high	95.6	Very high	41 Å²	41	49 Å²	49	29%	0.287	25%	0.254	S	S	.	.	G	3₁₀ helix	trans	-98.1	-9.5	169.9	-64.3	0	0	0	0	113.5	C329 F351	C329-S353 WeakPolarHBondContact CB-O 3.5Å; F351-S353 PolarHBondContact O-N 3.07Å; F351-S353 VanDerWaalsContact O-N 3.16Å
354	S	97.6	Very high	95.6	Very high	7 Å²	7	45 Å²	45	5%	0.049	24%	0.24	C	C	.	.			trans	-73.8	155.8	-171.7	-54.2	0	0	0	0	112.6	I327 H328 F351	I327-S354 WeakPolarHBondContact O-CA 3.17Å; I327-S354 VanDerWaalsContact O-CB 3.22Å; I327-S354 WeakPolarHBondContact O-CB 3.35Å; H328-S354 WeakPolarHBondContact CA-OG 3.31Å; H328-S354 WeakPolarHBondContact O-CA 3.29Å; H328-S354 PolarHBondContact O-N 3.26Å; H328-S354 PolarHBondContact O-OG 3.19Å; F351-S354 WeakPolarHBondContact CA-OG 3.45Å; F351-S354 WeakPolarHBondContact CD1-OG 3.4Å; F351-S354 VanDerWaalsContact O-CB 3.22Å; F351-S354 WeakPolarHBondContact O-CB 3.29Å; F351-S354 PolarHBondContact O-N 2.9Å; F351-S354 PolarHBondContact O-OG 2.86Å
355	C	97.4	Very high	95.7	Very high	13 Å²	13	43.9 Å²	43.9	9%	0.088	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.5	162	172.3	54.2	0	0	0	0	110.9	I327	I327-C355 PolarHBondContact N-O 3.47Å; I327-C355 PolarHBondContact O-N 3.14Å; I327-C355 VanDerWaalsContact O-N 3.15Å
356	Y	98	Very high	95.8	Very high	20 Å²	20	42.9 Å²	42.9	8%	0.078	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	146.3	166.6	-69.5	-96.8	0	0	0	110.8	E247 R250 I251 H254 R325 I326 H358 Q359	E247-Y356 WeakPolarHBondContact OE1-CD2 3.4Å; R250-Y356 VanDerWaalsContact CZ-CE2 3.49Å; I251-Y356 HydrophobicContact CD1-CE2 4.33Å; I251-Y356 HydrophobicContact CG1-CD2 4.28Å; I251-Y356 HydrophobicContact CG1-CE2 3.64Å; H254-Y356 PolarHBondContact CD2-OH 3.3Å; R325-Y356 CarbonylContact O-C 3.57Å; R325-Y356 WeakPolarHBondContact O-CA 3.49Å; I326-Y356 HydrophobicContact CD1-CE1 4.02Å; I326-Y356 HydrophobicContact CG1-CD1 3.85Å; I326-Y356 HydrophobicContact CG1-CE1 3.67Å; I326-Y356 HydrophobicContact CG1-CE2 4.5Å; I326-Y356 HydrophobicContact CG1-CG 4.36Å; Y356-H358 PolarHBondContact O-N 2.82Å; Y356-Q359 WeakPolarHBondContact O-CA 3.21Å; Y356-Q359 PolarHBondContact O-N 3.17Å
357	E	96.3	Very high	95.7	Very high	38 Å²	38	44.3 Å²	44.3	18%	0.178	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-19.1	-175.5	179	166.9	-113.5	0	0	113.9	R325 I327 R360 M383	R325-E357 HydrophobicContact CB-CB 4.34Å; R325-E357 IonicContact CZ-OE2 2.65Å; R325-E357 IonicContact NH1-OE2 3.35Å; R325-E357 PolarHBondContact NH1-OE2 3.03Å; R325-E357 PolarHBondContact O-N 2.84Å; I327-E357 HydrophobicContact CD1-CB 4.22Å; I327-E357 HydrophobicContact CD1-CG 4.43Å; I327-E357 HydrophobicContact CG1-CB 4.31Å; E357-R360 PolarHBondContact O-NH1 3.36Å; E357-R360 PolarHBondContact O-NH2 3.48Å; E357-M383 PolarHBondContact OE1-N 2.89Å; E357-M383 WeakPolarHBondContact OE2-CE 3.42Å
358	H	94.9	Very high	95.7	Very high	138 Å²	138	47.1 Å²	47.1	64%	0.639	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.1	-7.4	173.8	66.4	-80.5	0	0	0	113.8	Y356	Y356-H358 PolarHBondContact O-N 2.82Å
359	Q	94.1	Very high	95.7	Very high	75 Å²	75	50 Å²	50	35%	0.35	25%	0.251	S	S	.	.			trans	-117.6	33.7	-172.8	-52.5	-171.3	-5.3	0	0	112.4	Y356 V361	Y356-Q359 WeakPolarHBondContact O-CA 3.21Å; Y356-Q359 PolarHBondContact O-N 3.17Å; Q359-V361 PolarHBondContact O-N 3.17Å
360	R	91.4	Very high	95.7	Very high	73 Å²	73	48.5 Å²	48.5	28%	0.275	24%	0.243	S	C	.	.			trans	-63.9	118.8	177.7	-69.4	177.2	-71.8	-98.6	-31.9	111.6	I327 E357 Y381	I327-R360 HydrophobicContact CD1-CG 4.39Å; E357-R360 PolarHBondContact O-NH1 3.36Å; E357-R360 PolarHBondContact O-NH2 3.48Å; R360-Y381 HydrophobicContact CB-CE1 4.37Å; R360-Y381 WeakPolarHBondContact CB-OH 3.39Å; R360-Y381 VanDerWaalsContact CD-O 3.3Å; R360-Y381 WeakPolarHBondContact CD-O 3.42Å; R360-Y381 HydrophobicContact CG-CE1 4.27Å; R360-Y381 HydrophobicContact CG-CE2 3.72Å; R360-Y381 WeakPolarHBondContact CG-OH 3.26Å; R360-Y381 PolarHBondContact NH1-O 3.33Å
361	V	86.7	Confident	95.9	Very high	112 Å²	112	47.7 Å²	47.7	68%	0.679	24%	0.238	S	C	*	.			trans	-105.2	-39.5	179.9	-177.7	0	0	0	0	113.7	Q359	Q359-V361 PolarHBondContact O-N 3.17Å
362	Y	90.6	Very high	95.9	Very high	74 Å²	74	47.7 Å²	47.7	29%	0.29	24%	0.238	S	C	.	.			trans	-107.2	137.2	-167.9	-58.2	-70.7	0	0	0	112.4	Q244 Y381	Q244-Y362 HydrophobicContact CG-CE2 4.46Å; Y362-Y381 WeakPolarHBondContact O-CE1 3.44Å; Y362-Y381 PolarHBondContact O-OH 3.03Å
363	T	93.3	Very high	96.1	Very high	123 Å²	123	47.1 Å²	47.1	76%	0.755	23%	0.233	S	C	*	.	S	Bend	trans	-89.1	-26.7	175.4	50.1	0	0	0	0	113.4	V375	T363-V375 WeakPolarHBondContact O-CG1 3.44Å
364	Y	95.6	Very high	96.2	Very high	93 Å²	93	45.3 Å²	45.3	37%	0.365	22%	0.219	S	C	.	.	S	Bend	trans	-104.5	97.7	176.8	-168	-84.5	0	0	0	109.6	Q64 R371 E409	Q64-Y364 PolarHBondContact OE1-OH 3Å; Q64-Y364 VanDerWaalsContact OE1-OH 3.11Å; Y364-R371 VanDerWaalsContact CZ-NH2 3.29Å; Y364-R371 PolarHBondContact OH-NH1 3.32Å; Y364-R371 PolarHBondContact OH-NH2 2.82Å; Y364-E409 HydrophobicContact CE2-CG 3.98Å
365	I	96.9	Very high	96.3	Very high	16 Å²	16	45.1 Å²	45.1	8%	0.082	22%	0.218	C	C	.	.			trans	-132.8	175	-176.3	59.5	170.7	0	0	0	111	C329 R371 V375 Y381 I385	C329-I365 HydrophobicContact CB-CD1 4.29Å; I365-R371 PolarHBondContact O-NE 3.06Å; I365-R371 PolarHBondContact O-NH2 2.78Å; I365-V375 HydrophobicContact CD1-CG2 4.27Å; I365-V375 HydrophobicContact CG1-CG1 3.74Å; I365-V375 HydrophobicContact CG1-CG2 4.13Å; I365-Y381 HydrophobicContact CD1-CD1 4.37Å; I365-Y381 HydrophobicContact CD1-CD2 3.83Å; I365-Y381 HydrophobicContact CD1-CE1 4.03Å; I365-Y381 HydrophobicContact CD1-CE2 3.43Å; I365-Y381 VanDerWaalsContact CD1-CE2 3.43Å; I365-Y381 HydrophobicContact CD1-CG 4.29Å; I365-I385 HydrophobicContact CD1-CD1 3.47Å; I365-I385 VanDerWaalsContact CD1-CD1 3.47Å
366	Q	98.4	Very high	96.3	Very high	9 Å²	9	44.5 Å²	44.5	4%	0.042	21%	0.214	C	C	.	.	S	Bend	trans	60.8	141.9	-174.8	-56.2	173.1	-69.8	0	0	115.2	C329 Y370 R371 I385 S389	C329-Q366 WeakPolarHBondContact O-CA 3.47Å; C329-Q366 WeakPolarHBondContact O-CG 3.38Å; C329-Q366 PolarHBondContact O-N 2.84Å; Q366-Y370 PolarHBondContact NE2-O 3.02Å; Q366-R371 HydrophobicContact CB-CB 3.96Å; Q366-R371 HydrophobicContact CB-CG 4.16Å; Q366-R371 PolarHBondContact O-NE 2.87Å; Q366-R371 PolarHBondContact O-NH2 2.99Å; Q366-I385 HydrophobicContact CG-CD1 4.16Å; Q366-I385 PolarHBondContact NE2-O 3.23Å; Q366-S389 PolarHBondContact NE2-OG 2.98Å
367	S	97.9	Very high	96.3	Very high	30 Å²	30	43.6 Å²	43.6	21%	0.21	21%	0.211	C	C	.	.			trans	-65.9	132.9	167.3	-64.8	0	0	0	0	110.3	D330 K332 F369 Y370 R371	D330-S367 VanDerWaalsContact OD1-CB 3.23Å; D330-S367 WeakPolarHBondContact OD1-CB 3.32Å; D330-S367 PolarHBondContact OD1-N 3.17Å; D330-S367 PolarHBondContact OD1-OG 3.31Å; D330-S367 PolarHBondContact OD2-OG 3.19Å; K332-S367 VanDerWaalsContact CD-OG 3.28Å; K332-S367 WeakPolarHBondContact CD-OG 3.31Å; K332-S367 PolarHBondContact NZ-OG 2.91Å; K332-S367 VanDerWaalsContact NZ-OG 3.17Å; S367-F369 PolarHBondContact O-N 2.98Å; S367-F369 VanDerWaalsContact O-N 3.17Å; S367-Y370 PolarHBondContact O-N 2.86Å; S367-R371 PolarHBondContact O-N 3.41Å
368	R	98.5	Very high	96.4	Very high	59 Å²	59	42.8 Å²	42.8	22%	0.223	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-52.8	-46.1	-155.3	-169.2	-177.6	-58	113.9	13.3	115.8	Y370 R371 G406 E407 Q412	R368-Y370 PolarHBondContact O-N 2.89Å; R368-R371 VanDerWaalsContact O-CB 3.32Å; R368-R371 WeakPolarHBondContact O-CB 3.45Å; R368-R371 PolarHBondContact O-N 2.96Å; R368-R371 VanDerWaalsContact O-N 3.17Å; R368-G406 VanDerWaalsContact CD-O 3.3Å; R368-G406 WeakPolarHBondContact CD-O 3.44Å; R368-E407 PolarHBondContact NH1-O 3.16Å; R368-Q412 HydrophobicContact CG-CB 4.12Å; R368-Q412 HydrophobicContact CG-CG 4.09Å; R368-Q412 PolarHBondContact O-NE2 3.25Å; R368-Q412 PolarHBondContact O-OE1 3.47Å
369	F	98.8	Very high	96.4	Very high	59 Å²	59	37.2 Å²	37.2	26%	0.259	19%	0.189	S	C	.	.	G	3₁₀ helix	trans	-63.7	-21.8	-176.8	-55.6	-29.1	0	0	0	113.5	S367 P402 P405 G406 Q412	S367-F369 PolarHBondContact O-N 2.98Å; S367-F369 VanDerWaalsContact O-N 3.17Å; F369-P402 HydrophobicContact CB-CB 4.31Å; F369-P402 HydrophobicContact CD2-CB 3.86Å; F369-P402 HydrophobicContact CD2-CG 3.82Å; F369-P402 HydrophobicContact CE2-CB 4.41Å; F369-P402 HydrophobicContact CE2-CG 4.03Å; F369-P402 HydrophobicContact CG-CB 4.17Å; F369-P405 HydrophobicContact CE1-CB 4.41Å; F369-G406 WeakPolarHBondContact CE1-O 3.32Å; F369-Q412 PolarHBondContact O-NE2 2.94Å
370	Y	98.9	Very high	96.5	Very high	8 Å²	8	43.4 Å²	43.4	3%	0.031	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-110.3	9.5	-177	-34.8	-76.1	0	0	0	112	K332 P333 Q366 S367 R368 S389 C392 I393 E396	K332-Y370 HydrophobicContact CB-CD2 3.53Å; K332-Y370 HydrophobicContact CB-CE2 3.46Å; K332-Y370 VanDerWaalsContact CB-CE2 3.46Å; K332-Y370 HydrophobicContact CB-CG 4.27Å; P333-Y370 WeakPolarHBondContact CD-OH 3.42Å; P333-Y370 HydrophobicContact CG-CE1 4.07Å; Q366-Y370 PolarHBondContact NE2-O 3.02Å; S367-Y370 PolarHBondContact O-N 2.86Å; R368-Y370 PolarHBondContact O-N 2.89Å; Y370-S389 PolarHBondContact O-OG 3.45Å; Y370-C392 HydrophobicContact CD1-CB 3.85Å; Y370-I393 HydrophobicContact CD1-CG1 3.96Å; Y370-I393 HydrophobicContact CE1-CG1 4.25Å; Y370-E396 WeakPolarHBondContact CE1-OE2 3.23Å; Y370-E396 PolarHBondContact OH-OE2 3.36Å
371	R	98.9	Very high	96.8	Very high	2 Å²	2	40.8 Å²	40.8	1%	0.008	20%	0.199	C	C	.	.			trans	-80.2	132.3	-176.7	-177.6	-179.9	-64.2	163.9	4.4	111.7	Y364 I365 Q366 S367 R368 V375 I376 W388 E409	Y364-R371 VanDerWaalsContact CZ-NH2 3.29Å; Y364-R371 PolarHBondContact OH-NH1 3.32Å; Y364-R371 PolarHBondContact OH-NH2 2.82Å; I365-R371 PolarHBondContact O-NE 3.06Å; I365-R371 PolarHBondContact O-NH2 2.78Å; Q366-R371 HydrophobicContact CB-CB 3.96Å; Q366-R371 HydrophobicContact CB-CG 4.16Å; Q366-R371 PolarHBondContact O-NE 2.87Å; Q366-R371 PolarHBondContact O-NH2 2.99Å; S367-R371 PolarHBondContact O-N 3.41Å; R368-R371 VanDerWaalsContact O-CB 3.32Å; R368-R371 WeakPolarHBondContact O-CB 3.45Å; R368-R371 PolarHBondContact O-N 2.96Å; R368-R371 VanDerWaalsContact O-N 3.17Å; R371-V375 HydrophobicContact CG-CB 4.01Å; R371-V375 HydrophobicContact CG-CG1 4.05Å; R371-I376 HydrophobicContact CG-CD1 4.48Å; R371-I376 HydrophobicContact CG-CG1 4.02Å; R371-W388 PolarHBondContact O-NE1 2.9Å; R371-E409 IonicContact NH1-OE1 3.21Å
372	A	98.9	Very high	97.3	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	17%	0.17	C	C	.	.			trans	-73.8	148	-178.8	0	0	0	0	0	112.8	E374 V375 I376 I385 W388	A372-E374 VanDerWaalsContact C-N 3.31Å; A372-E374 HydrophobicContact CB-CG 4.47Å; A372-E374 WeakPolarHBondContact CB-OE2 3.44Å; A372-E374 PolarHBondContact O-N 3.33Å; A372-V375 HydrophobicContact CB-CG2 4.44Å; A372-V375 WeakPolarHBondContact O-CB 3.46Å; A372-V375 PolarHBondContact O-N 3.16Å; A372-V375 VanDerWaalsContact O-N 3.13Å; A372-I376 PolarHBondContact O-N 2.66Å; A372-I385 HydrophobicContact CB-CB 3.85Å; A372-I385 HydrophobicContact CB-CG2 3.77Å; A372-W388 HydrophobicContact CB-CB 3.87Å; A372-W388 HydrophobicContact CB-CD2 4.38Å; A372-W388 HydrophobicContact CB-CG 3.81Å
373	P	98.7	Very high	97.7	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-61.3	-36.8	-175.6	22.5	-32.6	0	0	0	112.8	V375 I376 L377 W388 L413 I416 W500	P373-V375 PolarHBondContact O-N 3.22Å; P373-I376 PolarHBondContact O-N 3.38Å; P373-I376 VanDerWaalsContact O-N 3.16Å; P373-L377 HydrophobicContact CB-CD1 4.47Å; P373-L377 VanDerWaalsContact O-CB 3.29Å; P373-L377 WeakPolarHBondContact O-CB 3.47Å; P373-L377 VanDerWaalsContact O-CG 3.31Å; P373-L377 WeakPolarHBondContact O-CG 3.3Å; P373-L377 PolarHBondContact O-N 2.56Å; P373-W388 VanDerWaalsContact CD-CE3 3.44Å; P373-W388 HydrophobicContact CG-CE3 4.06Å; P373-W388 HydrophobicContact CG-CH2 4.01Å; P373-W388 HydrophobicContact CG-CZ3 3.74Å; P373-L413 HydrophobicContact CB-CD1 4.47Å; P373-I416 HydrophobicContact CB-CD1 4.43Å; P373-W500 HydrophobicContact CB-CE3 3.59Å; P373-W500 HydrophobicContact CB-CH2 4.44Å; P373-W500 HydrophobicContact CB-CZ3 3.37Å; P373-W500 HydrophobicContact CG-CE3 3.82Å; P373-W500 HydrophobicContact CG-CZ3 4.1Å
374	E	98.6	Very high	98	Very high	2 Å²	2	28.8 Å²	28.8	1%	0.009	14%	0.135	C	C	.	.	H	α-helix	trans	-62.2	-27.8	178.5	62.8	-89.6	-152.6	0	0	113.3	A372 G378 S379 I385 P502 R505	A372-E374 VanDerWaalsContact C-N 3.31Å; A372-E374 HydrophobicContact CB-CG 4.47Å; A372-E374 WeakPolarHBondContact CB-OE2 3.44Å; A372-E374 PolarHBondContact O-N 3.33Å; E374-G378 PolarHBondContact O-N 3.41Å; E374-G378 VanDerWaalsContact O-N 3.1Å; E374-S379 PolarHBondContact O-N 2.98Å; E374-I385 HydrophobicContact CG-CG2 4.24Å; E374-I385 WeakPolarHBondContact OE1-CG2 3.33Å; E374-P502 HydrophobicContact CG-CG 4.41Å; E374-R505 IonicContact OE1-CZ 2.77Å; E374-R505 IonicContact OE1-NH1 2.9Å; E374-R505 PolarHBondContact OE1-NH1 2.74Å; E374-R505 IonicContact OE1-NH2 2.8Å; E374-R505 IonicContact OE2-CZ 2.73Å; E374-R505 IonicContact OE2-NH1 3.74Å; E374-R505 PolarHBondContact OE2-NH1 3.25Å; E374-R505 IonicContact OE2-NH2 3.32Å; E374-R505 PolarHBondContact OE2-NH2 3.37Å
375	V	98.6	Very high	98.2	Very high	4 Å²	4	24.3 Å²	24.3	2%	0.024	12%	0.117	C	C	.	.	H	α-helix	trans	-72.7	-45.6	174.7	179.4	0	0	0	0	110.2	T363 I365 R371 A372 P373 G378 Y381 I385	T363-V375 WeakPolarHBondContact O-CG1 3.44Å; I365-V375 HydrophobicContact CD1-CG2 4.27Å; I365-V375 HydrophobicContact CG1-CG1 3.74Å; I365-V375 HydrophobicContact CG1-CG2 4.13Å; R371-V375 HydrophobicContact CG-CB 4.01Å; R371-V375 HydrophobicContact CG-CG1 4.05Å; A372-V375 HydrophobicContact CB-CG2 4.44Å; A372-V375 WeakPolarHBondContact O-CB 3.46Å; A372-V375 PolarHBondContact O-N 3.16Å; A372-V375 VanDerWaalsContact O-N 3.13Å; P373-V375 PolarHBondContact O-N 3.22Å; V375-G378 PolarHBondContact O-N 3.22Å; V375-Y381 HydrophobicContact CG2-CG 4.37Å; V375-I385 HydrophobicContact CG2-CG2 3.95Å
376	I	98.6	Very high	98.2	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-62.6	-47.4	177.4	-59.4	171.4	0	0	0	110.2	R371 A372 P373 G378 E409 Q412 L413 I416 R433 F437	R371-I376 HydrophobicContact CG-CD1 4.48Å; R371-I376 HydrophobicContact CG-CG1 4.02Å; A372-I376 PolarHBondContact O-N 2.66Å; P373-I376 PolarHBondContact O-N 3.38Å; P373-I376 VanDerWaalsContact O-N 3.16Å; I376-G378 PolarHBondContact O-N 2.62Å; I376-E409 HydrophobicContact CG2-CB 4.25Å; I376-Q412 HydrophobicContact CD1-CB 4.14Å; I376-Q412 HydrophobicContact CD1-CG 3.77Å; I376-L413 HydrophobicContact CG2-CB 4.28Å; I376-L413 HydrophobicContact CG2-CD2 4.46Å; I376-I416 HydrophobicContact CD1-CD1 4.27Å; I376-R433 WeakPolarHBondContact O-CD 3.18Å; I376-R433 PolarHBondContact O-NH1 2.95Å; I376-F437 HydrophobicContact CG2-CE1 4.15Å; I376-F437 HydrophobicContact CG2-CE2 3.95Å; I376-F437 HydrophobicContact CG2-CZ 3.65Å; I376-F437 WeakPolarHBondContact O-CE2 3.38Å
377	L	98.4	Very high	98.3	Very high	1 Å²	1	23.6 Å²	23.6	1%	0.005	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73	-9.1	-179.1	-69	173.3	0	0	0	113.9	P373 S379 L413 L428 S431 K432 R433 A434 F437 W500	P373-L377 HydrophobicContact CB-CD1 4.47Å; P373-L377 VanDerWaalsContact O-CB 3.29Å; P373-L377 WeakPolarHBondContact O-CB 3.47Å; P373-L377 VanDerWaalsContact O-CG 3.31Å; P373-L377 WeakPolarHBondContact O-CG 3.3Å; P373-L377 PolarHBondContact O-N 2.56Å; L377-S379 VanDerWaalsContact C-N 3.34Å; L377-L413 HydrophobicContact CD2-CD2 3.81Å; L377-L413 HydrophobicContact CG-CD2 4.46Å; L377-L428 HydrophobicContact CD2-CD2 4.28Å; L377-S431 CarbonylContact O-C 3.52Å; L377-S431 WeakPolarHBondContact O-CB 3.49Å; L377-K432 PolarHBondContact O-N 3.22Å; L377-R433 WeakPolarHBondContact O-CA 3.48Å; L377-R433 WeakPolarHBondContact O-CB 3.17Å; L377-R433 PolarHBondContact O-N 3.04Å; L377-A434 HydrophobicContact CD2-CB 4.48Å; L377-F437 HydrophobicContact CD2-CD2 4.06Å; L377-W500 HydrophobicContact CD1-CZ3 4.25Å
378	G	97.2	Very high	98.3	Very high	20 Å²	20	22.2 Å²	22.2	21%	0.206	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.9	32.6	179.7	0	0	0	0	0	113.8	E374 V375 I376 K432	E374-G378 PolarHBondContact O-N 3.41Å; E374-G378 VanDerWaalsContact O-N 3.1Å; V375-G378 PolarHBondContact O-N 3.22Å; I376-G378 PolarHBondContact O-N 2.62Å; G378-K432 WeakPolarHBondContact O-CB 3.5Å; G378-K432 WeakPolarHBondContact O-CG 3.5Å; G378-K432 PolarHBondContact O-N 3.26Å
379	S	95.9	Very high	98.3	Very high	22 Å²	22	19.4 Å²	19.4	15%	0.154	9%	0.093	C	C	.	.			trans	-80.7	173.9	169.6	-110.5	0	0	0	0	111.4	E374 L377 Y381 A430 S431	E374-S379 PolarHBondContact O-N 2.98Å; L377-S379 VanDerWaalsContact C-N 3.34Å; S379-Y381 PolarHBondContact O-N 3.03Å; S379-A430 PolarHBondContact OG-O 3.26Å; S379-S431 PolarHBondContact OG-OG 2.94Å
380	R	95.6	Very high	98.4	Very high	205 Å²	205	16.6 Å²	16.6	77%	0.774	8%	0.081	S	C	*	.			trans	-74	106.3	172.9	-178.8	-179.1	179	177.3	-0.2	110
381	Y	97.8	Very high	98.4	Very high	18 Å²	18	16.2 Å²	16.2	7%	0.071	8%	0.079	C	C	.	.			trans	-83.4	162.5	175.2	77.6	-94.5	0	0	0	113	I327 R360 Y362 I365 V375 S379 I385	I327-Y381 HydrophobicContact CD1-CD2 4.2Å; I327-Y381 HydrophobicContact CD1-CE2 3.99Å; R360-Y381 HydrophobicContact CB-CE1 4.37Å; R360-Y381 WeakPolarHBondContact CB-OH 3.39Å; R360-Y381 VanDerWaalsContact CD-O 3.3Å; R360-Y381 WeakPolarHBondContact CD-O 3.42Å; R360-Y381 HydrophobicContact CG-CE1 4.27Å; R360-Y381 HydrophobicContact CG-CE2 3.72Å; R360-Y381 WeakPolarHBondContact CG-OH 3.26Å; R360-Y381 PolarHBondContact NH1-O 3.33Å; Y362-Y381 WeakPolarHBondContact O-CE1 3.44Å; Y362-Y381 PolarHBondContact O-OH 3.03Å; I365-Y381 HydrophobicContact CD1-CD1 4.37Å; I365-Y381 HydrophobicContact CD1-CD2 3.83Å; I365-Y381 HydrophobicContact CD1-CE1 4.03Å; I365-Y381 HydrophobicContact CD1-CE2 3.43Å; I365-Y381 VanDerWaalsContact CD1-CE2 3.43Å; I365-Y381 HydrophobicContact CD1-CG 4.29Å; V375-Y381 HydrophobicContact CG2-CG 4.37Å; S379-Y381 PolarHBondContact O-N 3.03Å; Y381-I385 HydrophobicContact CD2-CD1 3.93Å; Y381-I385 HydrophobicContact CD2-CG2 4.36Å; Y381-I385 HydrophobicContact CE2-CD1 4.3Å
382	G	98.4	Very high	98.4	Very high	7 Å²	7	16.2 Å²	16.2	7%	0.072	8%	0.08	C	C	.	.			trans	-156.4	-159.3	177.6	0	0	0	0	0	111.2	P384 I385	G382-P384 VanDerWaalsContact C-N 3.27Å; G382-I385 PolarHBondContact O-N 3.43Å
383	M	98.6	Very high	98.4	Very high	17 Å²	17	16.2 Å²	16.2	8%	0.084	8%	0.08	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.7	-30.1	176.5	-58.4	173.3	-61.6	0	0	115.7	H322 I327 E357 I385 D386	H322-M383 HydrophobicContact CB-SD 4.28Å; H322-M383 WeakPolarHBondContact CD2-CE 3.42Å; I327-M383 HydrophobicContact CG1-CG 3.99Å; E357-M383 PolarHBondContact OE1-N 2.89Å; E357-M383 WeakPolarHBondContact OE2-CE 3.42Å; M383-I385 PolarHBondContact O-N 3.12Å; M383-D386 PolarHBondContact O-N 3.49Å
384	P	98.9	Very high	98.4	Very high	32 Å²	32	16.2 Å²	16.2	21%	0.208	8%	0.08	C	C	.	.	H	α-helix	trans	-59.8	-12	177.9	-28.7	37.6	0	0	0	116.4	G382 D386 I387 W388 P502 R505	G382-P384 VanDerWaalsContact C-N 3.27Å; P384-D386 VanDerWaalsContact C-N 3.31Å; P384-D386 PolarHBondContact O-N 3.37Å; P384-I387 PolarHBondContact O-N 3.42Å; P384-W388 PolarHBondContact O-N 3.07Å; P384-P502 HydrophobicContact CB-CB 3.78Å; P384-P502 WeakPolarHBondContact CB-O 3.37Å; P384-P502 HydrophobicContact CG-CB 4.14Å; P384-P502 WeakPolarHBondContact CG-O 3.47Å; P384-R505 WeakPolarHBondContact O-CD 3.34Å; P384-R505 PolarHBondContact O-NH1 3.36Å
385	I	98.9	Very high	98.4	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-67.2	-31.9	175.7	73	177.4	0	0	0	112.5	I327 I365 Q366 A372 E374 V375 Y381 G382 M383 W388 S389	I327-I385 HydrophobicContact CG2-CD1 3.6Å; I327-I385 HydrophobicContact CG2-CG1 3.65Å; I365-I385 HydrophobicContact CD1-CD1 3.47Å; I365-I385 VanDerWaalsContact CD1-CD1 3.47Å; Q366-I385 HydrophobicContact CG-CD1 4.16Å; Q366-I385 PolarHBondContact NE2-O 3.23Å; A372-I385 HydrophobicContact CB-CB 3.85Å; A372-I385 HydrophobicContact CB-CG2 3.77Å; E374-I385 HydrophobicContact CG-CG2 4.24Å; E374-I385 WeakPolarHBondContact OE1-CG2 3.33Å; V375-I385 HydrophobicContact CG2-CG2 3.95Å; Y381-I385 HydrophobicContact CD2-CD1 3.93Å; Y381-I385 HydrophobicContact CD2-CG2 4.36Å; Y381-I385 HydrophobicContact CE2-CD1 4.3Å; G382-I385 PolarHBondContact O-N 3.43Å; M383-I385 PolarHBondContact O-N 3.12Å; I385-W388 WeakPolarHBondContact O-CB 3.45Å; I385-W388 PolarHBondContact O-N 3.32Å; I385-S389 PolarHBondContact O-N 3.35Å; I385-S389 VanDerWaalsContact O-N 3.07Å; I385-S389 PolarHBondContact O-OG 2.87Å
386	D	98.9	Very high	98.4	Very high	5 Å²	5	16 Å²	16	3%	0.027	8%	0.079	C	C	.	.	H	α-helix	trans	-78	-25.7	-177.8	-59.2	-44	0	0	0	111.5	L318 I327 H328 C329 L331 M383 P384 S389 L390	L318-D386 HydrophobicContact CD2-CB 3.98Å; I327-D386 WeakPolarHBondContact CG2-OD2 3.13Å; H328-D386 WeakPolarHBondContact CB-OD1 3.41Å; H328-D386 PolarHBondContact N-OD2 3.27Å; C329-D386 PolarHBondContact N-OD1 3.42Å; L331-D386 WeakPolarHBondContact CD2-O 3.32Å; M383-D386 PolarHBondContact O-N 3.49Å; P384-D386 VanDerWaalsContact C-N 3.31Å; P384-D386 PolarHBondContact O-N 3.37Å; D386-S389 PolarHBondContact O-N 3.09Å; D386-L390 PolarHBondContact O-N 3.41Å
387	I	98.9	Very high	98.4	Very high	4 Å²	4	16 Å²	16	2%	0.021	8%	0.079	C	C	.	.	H	α-helix	trans	-68.5	-39.9	168.5	-72.7	-70.2	0	0	0	111.3	L315 L318 P384 S389 L390 G391 C497 R505 M506 P508	L315-I387 HydrophobicContact CD2-CD1 4.25Å; L318-I387 HydrophobicContact CD1-CD1 4.36Å; P384-I387 PolarHBondContact O-N 3.42Å; I387-S389 VanDerWaalsContact C-N 3.33Å; I387-L390 HydrophobicContact CD1-CD2 4.23Å; I387-L390 WeakPolarHBondContact O-CB 3.35Å; I387-L390 PolarHBondContact O-N 2.92Å; I387-G391 PolarHBondContact O-N 2.88Å; I387-C497 HydrophobicContact CG2-CB 4.01Å; I387-R505 HydrophobicContact CG2-CG 3.88Å; I387-M506 WeakPolarHBondContact CG1-O 3.16Å; I387-M506 WeakPolarHBondContact CG2-O 3.4Å; I387-P508 HydrophobicContact CD1-CG 3.99Å; I387-P508 HydrophobicContact CG1-CG 4.37Å
388	W	98.9	Very high	98.4	Very high	1 Å²	1	17.1 Å²	17.1	0%	0.004	8%	0.084	C	C	.	.	H	α-helix	trans	-59.8	-47.1	172.8	177.7	-78.8	0	0	0	110.5	R371 A372 P373 P384 I385 L390 G391 C392 L404 I416 I420 L498	R371-W388 PolarHBondContact O-NE1 2.9Å; A372-W388 HydrophobicContact CB-CB 3.87Å; A372-W388 HydrophobicContact CB-CD2 4.38Å; A372-W388 HydrophobicContact CB-CG 3.81Å; P373-W388 VanDerWaalsContact CD-CE3 3.44Å; P373-W388 HydrophobicContact CG-CE3 4.06Å; P373-W388 HydrophobicContact CG-CH2 4.01Å; P373-W388 HydrophobicContact CG-CZ3 3.74Å; P384-W388 PolarHBondContact O-N 3.07Å; I385-W388 WeakPolarHBondContact O-CB 3.45Å; I385-W388 PolarHBondContact O-N 3.32Å; W388-L390 VanDerWaalsContact C-N 3.33Å; W388-L390 PolarHBondContact O-N 3.08Å; W388-G391 PolarHBondContact O-N 3.39Å; W388-G391 VanDerWaalsContact O-N 3.15Å; W388-C392 PolarHBondContact O-N 2.95Å; W388-C392 VanDerWaalsContact O-N 3.13Å; W388-C392 PolarHBondContact O-SG 3.22Å; W388-C392 VanDerWaalsContact O-SG 3.38Å; W388-L404 HydrophobicContact CZ2-CD1 3.79Å; W388-I416 HydrophobicContact CH2-CD1 4.17Å; W388-I416 HydrophobicContact CH2-CG1 4.25Å; W388-I416 HydrophobicContact CH2-CG2 3.79Å; W388-I416 HydrophobicContact CZ2-CD1 3.62Å; W388-I416 HydrophobicContact CZ2-CG1 3.82Å; W388-I416 HydrophobicContact CZ2-CG2 4.24Å; W388-I420 HydrophobicContact CH2-CD1 3.86Å; W388-I420 HydrophobicContact CZ3-CD1 4.17Å; W388-L498 HydrophobicContact CD2-CD2 3.7Å; W388-L498 HydrophobicContact CE3-CB 4.39Å; W388-L498 HydrophobicContact CE3-CD2 3.89Å; W388-L498 HydrophobicContact CG-CD2 4.2Å; W388-L498 HydrophobicContact CH2-CB 4.43Å; W388-L498 HydrophobicContact CH2-CD2 4.19Å; W388-L498 HydrophobicContact CZ2-CD2 4.01Å; W388-L498 HydrophobicContact CZ3-CB 4.11Å; W388-L498 HydrophobicContact CZ3-CD2 4.15Å; W388-L498 VanDerWaalsContact CZ3-O 3.27Å; W388-L498 WeakPolarHBondContact CZ3-O 3.17Å
389	S	98.9	Very high	98.5	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-57.5	-43.5	173.6	-56.9	0	0	0	0	112.2	L331 Q366 Y370 I385 D386 I387 G391 C392 I393	L331-S389 WeakPolarHBondContact O-CB 3.36Å; Q366-S389 PolarHBondContact NE2-OG 2.98Å; Y370-S389 PolarHBondContact O-OG 3.45Å; I385-S389 PolarHBondContact O-N 3.35Å; I385-S389 VanDerWaalsContact O-N 3.07Å; I385-S389 PolarHBondContact O-OG 2.87Å; D386-S389 PolarHBondContact O-N 3.09Å; I387-S389 VanDerWaalsContact C-N 3.33Å; S389-G391 PolarHBondContact O-N 3.31Å; S389-C392 PolarHBondContact O-N 3.48Å; S389-I393 WeakPolarHBondContact O-CB 3.25Å; S389-I393 VanDerWaalsContact O-CD1 3.32Å; S389-I393 WeakPolarHBondContact O-CD1 3.39Å; S389-I393 WeakPolarHBondContact O-CG1 3.45Å; S389-I393 PolarHBondContact O-N 3.34Å
390	L	98.9	Very high	98.6	Very high	0 Å²	0	15.6 Å²	15.6	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-56.1	-47.5	174.1	176.2	67.9	0	0	0	111.6	I314 L315 L318 L331 D386 I387 W388 C392 I393 L394 F493	I314-L390 HydrophobicContact CB-CD1 4.19Å; I314-L390 HydrophobicContact CD1-CD1 4.18Å; I314-L390 HydrophobicContact CG2-CD1 3.87Å; L315-L390 HydrophobicContact CD1-CD2 4.49Å; L315-L390 HydrophobicContact CD2-CD2 3.63Å; L315-L390 HydrophobicContact CG-CD2 3.91Å; L318-L390 HydrophobicContact CD1-CB 4.23Å; L318-L390 HydrophobicContact CD1-CD2 4.2Å; L331-L390 HydrophobicContact CD2-CB 4.47Å; D386-L390 PolarHBondContact O-N 3.41Å; I387-L390 HydrophobicContact CD1-CD2 4.23Å; I387-L390 WeakPolarHBondContact O-CB 3.35Å; I387-L390 PolarHBondContact O-N 2.92Å; W388-L390 VanDerWaalsContact C-N 3.33Å; W388-L390 PolarHBondContact O-N 3.08Å; L390-C392 PolarHBondContact O-N 3.15Å; L390-I393 PolarHBondContact O-N 2.8Å; L390-L394 HydrophobicContact CD1-CD1 4.06Å; L390-L394 HydrophobicContact CD1-CD2 4.05Å; L390-L394 HydrophobicContact CD1-CG 3.87Å; L390-L394 HydrophobicContact CG-CD1 4.12Å; L390-L394 HydrophobicContact CG-CG 4.24Å; L390-L394 WeakPolarHBondContact O-CG 3.28Å; L390-L394 PolarHBondContact O-N 2.91Å; L390-F493 HydrophobicContact CD2-CZ 4.45Å
391	G	98.9	Very high	98.8	Very high	0 Å²	0	11.7 Å²	11.7	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-55.5	-48.6	177.3	0	0	0	0	0	112.4	I387 W388 S389 I393 L394 A395 L494	I387-G391 PolarHBondContact O-N 2.88Å; W388-G391 PolarHBondContact O-N 3.39Å; W388-G391 VanDerWaalsContact O-N 3.15Å; S389-G391 PolarHBondContact O-N 3.31Å; G391-I393 PolarHBondContact O-N 3.02Å; G391-L394 PolarHBondContact O-N 2.99Å; G391-A395 PolarHBondContact O-N 3.45Å; G391-L494 VanDerWaalsContact O-CD2 3.25Å; G391-L494 WeakPolarHBondContact O-CD2 3.38Å
392	C	98.9	Very high	98.8	Very high	2 Å²	2	12.5 Å²	12.5	1%	0.014	6%	0.064	C	C	.	.	H	α-helix	trans	-60.5	-45	175.5	-58.7	0	0	0	0	112.4	Y370 W388 S389 L390 A395 E396	Y370-C392 HydrophobicContact CD1-CB 3.85Å; W388-C392 PolarHBondContact O-N 2.95Å; W388-C392 VanDerWaalsContact O-N 3.13Å; W388-C392 PolarHBondContact O-SG 3.22Å; W388-C392 VanDerWaalsContact O-SG 3.38Å; S389-C392 PolarHBondContact O-N 3.48Å; L390-C392 PolarHBondContact O-N 3.15Å; C392-A395 PolarHBondContact O-N 3.4Å; C392-E396 PolarHBondContact O-N 3.3Å
393	I	98.9	Very high	98.8	Very high	0 Å²	0	12.6 Å²	12.6	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-62.5	-42.9	179.8	-69.3	161.1	0	0	0	111.5	L331 P333 I336 Y370 S389 L390 G391 E396 L397	L331-I393 HydrophobicContact CD2-CD1 3.95Å; L331-I393 HydrophobicContact CG-CD1 3.78Å; P333-I393 HydrophobicContact CG-CG1 4.17Å; P333-I393 HydrophobicContact CG-CG2 4.42Å; I336-I393 HydrophobicContact CD1-CD1 4.1Å; I336-I393 HydrophobicContact CD1-CG2 4.28Å; Y370-I393 HydrophobicContact CD1-CG1 3.96Å; Y370-I393 HydrophobicContact CE1-CG1 4.25Å; S389-I393 WeakPolarHBondContact O-CB 3.25Å; S389-I393 VanDerWaalsContact O-CD1 3.32Å; S389-I393 WeakPolarHBondContact O-CD1 3.39Å; S389-I393 WeakPolarHBondContact O-CG1 3.45Å; S389-I393 PolarHBondContact O-N 3.34Å; L390-I393 PolarHBondContact O-N 2.8Å; G391-I393 PolarHBondContact O-N 3.02Å; I393-E396 PolarHBondContact O-N 2.86Å; I393-L397 HydrophobicContact CG2-CD1 3.8Å; I393-L397 HydrophobicContact CG2-CG 4.24Å; I393-L397 WeakPolarHBondContact O-CB 3.5Å; I393-L397 VanDerWaalsContact O-CG 3.26Å; I393-L397 WeakPolarHBondContact O-CG 3.46Å; I393-L397 PolarHBondContact O-N 3.22Å
394	L	98.9	Very high	98.8	Very high	0 Å²	0	12 Å²	12	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-69	-36.2	-178.4	-64.7	-175.1	0	0	0	112.5	V307 A311 L390 G391 L397 L398 F490 F493 L494 W516	V307-L394 HydrophobicContact CG1-CB 4.17Å; V307-L394 HydrophobicContact CG1-CD2 4.03Å; A311-L394 HydrophobicContact CB-CD1 3.62Å; A311-L394 HydrophobicContact CB-CD2 3.64Å; A311-L394 HydrophobicContact CB-CG 4.29Å; L390-L394 HydrophobicContact CD1-CD1 4.06Å; L390-L394 HydrophobicContact CD1-CD2 4.05Å; L390-L394 HydrophobicContact CD1-CG 3.87Å; L390-L394 HydrophobicContact CG-CD1 4.12Å; L390-L394 HydrophobicContact CG-CG 4.24Å; L390-L394 WeakPolarHBondContact O-CG 3.28Å; L390-L394 PolarHBondContact O-N 2.91Å; G391-L394 PolarHBondContact O-N 2.99Å; L394-L397 HydrophobicContact CD2-CD1 4.14Å; L394-L397 PolarHBondContact O-N 3.2Å; L394-L398 PolarHBondContact O-N 2.95Å; L394-F490 HydrophobicContact CB-CE2 4.13Å; L394-F490 HydrophobicContact CB-CZ 4.18Å; L394-F493 HydrophobicContact CD1-CD1 4.12Å; L394-F493 HydrophobicContact CD1-CE1 3.52Å; L394-F493 HydrophobicContact CD1-CZ 4.35Å; L394-L494 HydrophobicContact CB-CD2 4.17Å; L394-W516 HydrophobicContact CD1-CH2 4.16Å; L394-W516 HydrophobicContact CD1-CZ3 4Å
395	A	98.9	Very high	98.8	Very high	0 Å²	0	12.2 Å²	12.2	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-66.9	-37.6	173	0	0	0	0	0	112.2	G391 C392 L398 T399 L403 L482 L494	G391-A395 PolarHBondContact O-N 3.45Å; C392-A395 PolarHBondContact O-N 3.4Å; A395-L398 PolarHBondContact O-N 3.49Å; A395-T399 WeakPolarHBondContact O-CB 2.97Å; A395-T399 WeakPolarHBondContact O-CG2 3.26Å; A395-T399 PolarHBondContact O-N 3.13Å; A395-T399 PolarHBondContact O-OG1 3.38Å; A395-L403 HydrophobicContact CB-CB 3.93Å; A395-L403 HydrophobicContact CB-CD1 4.16Å; A395-L403 HydrophobicContact CB-CD2 3.83Å; A395-L403 HydrophobicContact CB-CG 4.19Å; A395-L482 HydrophobicContact CB-CD2 3.89Å; A395-L494 HydrophobicContact CB-CD1 4.12Å; A395-L494 HydrophobicContact CB-CD2 4.43Å
396	E	98.9	Very high	98.8	Very high	3 Å²	3	12.3 Å²	12.3	1%	0.014	6%	0.062	C	C	.	.	H	α-helix	trans	-70.1	-38.6	174.3	178.5	163.1	178.6	0	0	112.7	I294 Y370 C392 I393 L398 T399 G400 Y401 P402	I294-E396 HydrophobicContact CD1-CG 3.97Å; Y370-E396 WeakPolarHBondContact CE1-OE2 3.23Å; Y370-E396 PolarHBondContact OH-OE2 3.36Å; C392-E396 PolarHBondContact O-N 3.3Å; I393-E396 PolarHBondContact O-N 2.86Å; E396-L398 VanDerWaalsContact C-N 3.33Å; E396-L398 PolarHBondContact O-N 3.34Å; E396-T399 PolarHBondContact O-N 2.82Å; E396-G400 WeakPolarHBondContact O-CA 3.25Å; E396-G400 PolarHBondContact O-N 2.94Å; E396-Y401 WeakPolarHBondContact CA-O 3.13Å; E396-P402 WeakPolarHBondContact OE2-CA 3.27Å; E396-P402 WeakPolarHBondContact OE2-CB 3.48Å; E396-P402 WeakPolarHBondContact OE2-CG 3.38Å
397	L	98.9	Very high	98.7	Very high	0 Å²	0	12.8 Å²	12.8	0%	0	6%	0.064	C	C	.	.	H	α-helix	trans	-62.7	-38.1	172.1	-73.3	170.5	0	0	0	112	L290 I294 F302 V307 F310 I393 L394	L290-L397 HydrophobicContact CB-CD2 4.19Å; L290-L397 HydrophobicContact CD1-CD1 4.13Å; L290-L397 HydrophobicContact CD1-CD2 4.1Å; I294-L397 HydrophobicContact CD1-CD2 4.08Å; I294-L397 HydrophobicContact CG1-CD2 4.24Å; F302-L397 WeakPolarHBondContact CB-O 3.15Å; F302-L397 HydrophobicContact CD2-CB 4.18Å; F302-L397 HydrophobicContact CD2-CD2 3.77Å; F302-L397 WeakPolarHBondContact CD2-O 3.44Å; F302-L397 HydrophobicContact CE2-CD2 3.65Å; F302-L397 PolarHBondContact N-O 3.34Å; V307-L397 HydrophobicContact CG1-CB 4.35Å; V307-L397 HydrophobicContact CG2-CB 4.22Å; F310-L397 HydrophobicContact CB-CD1 4.13Å; F310-L397 HydrophobicContact CD2-CD1 4.18Å; F310-L397 HydrophobicContact CD2-CD2 4.4Å; F310-L397 HydrophobicContact CG-CD1 4.49Å; I393-L397 HydrophobicContact CG2-CD1 3.8Å; I393-L397 HydrophobicContact CG2-CG 4.24Å; I393-L397 WeakPolarHBondContact O-CB 3.5Å; I393-L397 VanDerWaalsContact O-CG 3.26Å; I393-L397 WeakPolarHBondContact O-CG 3.46Å; I393-L397 PolarHBondContact O-N 3.22Å; L394-L397 HydrophobicContact CD2-CD1 4.14Å; L394-L397 PolarHBondContact O-N 3.2Å
398	L	98.8	Very high	98.7	Very high	24 Å²	24	14.3 Å²	14.3	13%	0.126	7%	0.073	C	C	.	.	H	α-helix	trans	-69.1	-49.5	175.6	175.7	64.4	0	0	0	112.2	G301 F302 L304 V307 L394 A395 E396 C485 F490	G301-L398 WeakPolarHBondContact CA-O 3.32Å; F302-L398 PolarHBondContact N-O 2.99Å; F302-L398 WeakPolarHBondContact O-CD1 3.37Å; L304-L398 HydrophobicContact CD2-CD1 3.94Å; L304-L398 HydrophobicContact CD2-CD2 4.27Å; L304-L398 HydrophobicContact CG-CD1 4Å; V307-L398 HydrophobicContact CG2-CB 4.22Å; L394-L398 PolarHBondContact O-N 2.95Å; A395-L398 PolarHBondContact O-N 3.49Å; E396-L398 VanDerWaalsContact C-N 3.33Å; E396-L398 PolarHBondContact O-N 3.34Å; L398-C485 HydrophobicContact CD2-CB 3.78Å; L398-F490 HydrophobicContact CB-CE1 4.36Å; L398-F490 HydrophobicContact CB-CZ 4.48Å; L398-F490 HydrophobicContact CD2-CD1 3.9Å; L398-F490 HydrophobicContact CD2-CE1 3.38Å; L398-F490 HydrophobicContact CD2-CZ 4.26Å; L398-F490 HydrophobicContact CG-CE1 4.45Å
399	T	98.7	Very high	98.6	Very high	9 Å²	9	15.9 Å²	15.9	6%	0.055	8%	0.08	C	C	.	.	H	α-helix	trans	-92.1	-21.3	-168.5	61.5	0	0	0	0	114.1	A395 E396 Y401 L482 K483	A395-T399 WeakPolarHBondContact O-CB 2.97Å; A395-T399 WeakPolarHBondContact O-CG2 3.26Å; A395-T399 PolarHBondContact O-N 3.13Å; A395-T399 PolarHBondContact O-OG1 3.38Å; E396-T399 PolarHBondContact O-N 2.82Å; T399-Y401 PolarHBondContact OG1-N 2.97Å; T399-Y401 PolarHBondContact OG1-O 3.33Å; T399-Y401 VanDerWaalsContact OG1-O 3.09Å; T399-L482 HydrophobicContact CG2-CD2 4.49Å; T399-K483 HydrophobicContact CG2-CB 4.49Å; T399-K483 HydrophobicContact CG2-CD 4.43Å; T399-K483 HydrophobicContact CG2-CG 4.14Å; T399-K483 VanDerWaalsContact O-CE 3.31Å; T399-K483 WeakPolarHBondContact O-CE 3.2Å; T399-K483 PolarHBondContact O-NZ 2.96Å
400	G	98.6	Very high	98.5	Very high	1 Å²	1	18.3 Å²	18.3	1%	0.01	10%	0.097	C	C	.	.	S	Bend	trans	82.4	5.4	-170.1	0	0	0	0	0	115.3	F299 E396	F299-G400 WeakPolarHBondContact CD1-O 3.36Å; E396-G400 WeakPolarHBondContact O-CA 3.25Å; E396-G400 PolarHBondContact O-N 2.94Å
401	Y	98.6	Very high	98.5	Very high	122 Å²	122	18.8 Å²	18.8	48%	0.478	10%	0.099	S	C	.	.	S	Bend	trans	-141.1	146	-175.4	-68	-101.6	0	0	0	111.7	F299 E396 T399 L403	F299-Y401 HydrophobicContact CB-CE2 3.78Å; F299-Y401 VanDerWaalsContact O-CE2 3.3Å; F299-Y401 WeakPolarHBondContact O-CE2 3.37Å; E396-Y401 WeakPolarHBondContact CA-O 3.13Å; T399-Y401 PolarHBondContact OG1-N 2.97Å; T399-Y401 PolarHBondContact OG1-O 3.33Å; T399-Y401 VanDerWaalsContact OG1-O 3.09Å; Y401-L403 PolarHBondContact O-N 3.23Å
402	P	98.7	Very high	98.5	Very high	36 Å²	36	18.8 Å²	18.8	23%	0.234	10%	0.099	C	C	.	.			trans	-59.3	127.2	177.3	-21.8	29.5	0	0	0	112.7	F369 E396 L404 P405	F369-P402 HydrophobicContact CB-CB 4.31Å; F369-P402 HydrophobicContact CD2-CB 3.86Å; F369-P402 HydrophobicContact CD2-CG 3.82Å; F369-P402 HydrophobicContact CE2-CB 4.41Å; F369-P402 HydrophobicContact CE2-CG 4.03Å; F369-P402 HydrophobicContact CG-CB 4.17Å; E396-P402 WeakPolarHBondContact OE2-CA 3.27Å; E396-P402 WeakPolarHBondContact OE2-CB 3.48Å; E396-P402 WeakPolarHBondContact OE2-CG 3.38Å; P402-L404 VanDerWaalsContact C-N 3.29Å; P402-L404 PolarHBondContact O-N 3.49Å; P402-P405 HydrophobicContact CB-CB 4.42Å; P402-P405 WeakPolarHBondContact O-CD 3.41Å
403	L	98.7	Very high	98.5	Very high	9 Å²	9	18.9 Å²	18.9	5%	0.047	10%	0.1	C	C	.	.	S	Bend	trans	-60.3	-37.6	-178.5	-179	67	0	0	0	112.9	A395 Y401 P405 L419 K476 A481 L482 L498	A395-L403 HydrophobicContact CB-CB 3.93Å; A395-L403 HydrophobicContact CB-CD1 4.16Å; A395-L403 HydrophobicContact CB-CD2 3.83Å; A395-L403 HydrophobicContact CB-CG 4.19Å; Y401-L403 PolarHBondContact O-N 3.23Å; L403-P405 WeakPolarHBondContact O-CD 3.21Å; L403-L419 HydrophobicContact CD1-CD2 3.99Å; L403-L419 HydrophobicContact CD2-CD2 3.98Å; L403-L419 HydrophobicContact CG-CD2 3.95Å; L403-K476 PolarHBondContact O-NZ 2.85Å; L403-A481 HydrophobicContact CD1-CB 4.02Å; L403-L482 HydrophobicContact CD1-CD2 4.34Å; L403-L498 HydrophobicContact CD2-CD1 3.62Å
404	L	98.6	Very high	98.5	Very high	3 Å²	3	19 Å²	19	2%	0.016	10%	0.1	C	C	.	.	S	Bend	trans	-126	74.6	-173.6	-58.9	172.1	0	0	0	110.3	W388 P402 G406 Q412 C415 I416 L419	W388-L404 HydrophobicContact CZ2-CD1 3.79Å; P402-L404 VanDerWaalsContact C-N 3.29Å; P402-L404 PolarHBondContact O-N 3.49Å; L404-G406 PolarHBondContact O-N 3.1Å; L404-G406 VanDerWaalsContact O-N 3.09Å; L404-Q412 VanDerWaalsContact CB-NE2 3.32Å; L404-Q412 PolarHBondContact O-NE2 3.3Å; L404-Q412 PolarHBondContact O-OE1 3.07Å; L404-Q412 VanDerWaalsContact O-OE1 3.06Å; L404-C415 HydrophobicContact CB-CB 4.24Å; L404-C415 HydrophobicContact CD2-CB 4.01Å; L404-C415 WeakPolarHBondContact CD2-O 3.49Å; L404-I416 HydrophobicContact CD1-CG1 3.85Å; L404-I416 HydrophobicContact CD2-CG1 4.33Å; L404-L419 HydrophobicContact CD2-CD2 4Å
405	P	98.3	Very high	98.5	Very high	38 Å²	38	19 Å²	19	25%	0.247	10%	0.1	C	C	.	.			trans	-87.5	73.2	-172.8	35.3	-34.6	0	0	0	111.6	F369 P402 L403 R470	F369-P405 HydrophobicContact CE1-CB 4.41Å; P402-P405 HydrophobicContact CB-CB 4.42Å; P402-P405 WeakPolarHBondContact O-CD 3.41Å; L403-P405 WeakPolarHBondContact O-CD 3.21Å; P405-R470 PolarHBondContact O-NH2 3.38Å
406	G	98.2	Very high	98.5	Very high	1 Å²	1	19 Å²	19	1%	0.01	10%	0.101	C	C	.	.			trans	-82.1	138.8	178.3	0	0	0	0	0	114.3	R368 F369 L404 D411	R368-G406 VanDerWaalsContact CD-O 3.3Å; R368-G406 WeakPolarHBondContact CD-O 3.44Å; F369-G406 WeakPolarHBondContact CE1-O 3.32Å; L404-G406 PolarHBondContact O-N 3.1Å; L404-G406 VanDerWaalsContact O-N 3.09Å; G406-D411 WeakPolarHBondContact CA-OD2 3.25Å
407	E	97.6	Very high	98.5	Very high	15 Å²	15	19 Å²	19	7%	0.07	10%	0.101	C	C	.	.	S	Bend	trans	-78.4	-31.1	-177.8	-68.8	170.1	-160.9	0	0	113.2	R368 D411 S464 R465 R466	R368-E407 PolarHBondContact NH1-O 3.16Å; E407-D411 HydrophobicContact CB-CB 4.34Å; E407-D411 PolarHBondContact N-OD2 3.18Å; E407-S464 VanDerWaalsContact CD-CB 3.46Å; E407-S464 WeakPolarHBondContact OE1-CB 3.44Å; E407-S464 PolarHBondContact OE1-OG 2.92Å; E407-S464 WeakPolarHBondContact OE2-CB 3.24Å; E407-S464 PolarHBondContact OE2-OG 3.42Å; E407-R465 PolarHBondContact OE2-N 2.85Å; E407-R466 WeakPolarHBondContact OE1-CB 3.32Å; E407-R466 VanDerWaalsContact OE2-CG 3.26Å; E407-R466 WeakPolarHBondContact OE2-CG 3.45Å; E407-R466 PolarHBondContact OE2-N 2.7Å; E407-R466 IonicContact OE2-NE 3.27Å
408	D	97.9	Very high	98.5	Very high	37 Å²	37	20 Å²	20	20%	0.198	11%	0.105	C	C	.	.	S	Bend	trans	-149	-172.7	175	54.5	60.6	0	0	0	110.2	S410 D411 Q412 R465	D408-S410 VanDerWaalsContact C-N 3.32Å; D408-S410 PolarHBondContact O-N 3.29Å; D408-S410 WeakPolarHBondContact OD1-CB 3.18Å; D408-S410 PolarHBondContact OD1-N 3.34Å; D408-D411 PolarHBondContact OD1-N 3.31Å; D408-Q412 WeakPolarHBondContact O-CB 3.15Å; D408-Q412 PolarHBondContact O-N 3.43Å; D408-R465 IonicContact OD2-CZ 2.71Å; D408-R465 IonicContact OD2-NE 3.16Å; D408-R465 PolarHBondContact OD2-NE 3.12Å; D408-R465 IonicContact OD2-NH2 3.79Å; D408-R465 PolarHBondContact OD2-NH2 3.11Å
409	E	97.5	Very high	98.5	Very high	33 Å²	33	19 Å²	19	15%	0.154	10%	0.1	C	C	.	.	H	α-helix	trans	-62.9	-34.1	-178.6	-68.8	-169.9	111.7	0	0	114.1	Y364 R371 I376 L413 R433 F437	Y364-E409 HydrophobicContact CE2-CG 3.98Å; R371-E409 IonicContact NH1-OE1 3.21Å; I376-E409 HydrophobicContact CG2-CB 4.25Å; E409-L413 PolarHBondContact O-N 3.29Å; E409-L413 VanDerWaalsContact O-N 3.16Å; E409-R433 IonicContact OE1-CZ 3.23Å; E409-R433 IonicContact OE1-NH1 3.09Å; E409-R433 PolarHBondContact OE1-NH1 3.48Å; E409-R433 IonicContact OE1-NH2 2.71Å; E409-R433 IonicContact OE2-CZ 2.83Å; E409-R433 IonicContact OE2-NH1 3.77Å; E409-R433 PolarHBondContact OE2-NH1 3.41Å; E409-R433 IonicContact OE2-NH2 3.3Å; E409-R433 PolarHBondContact OE2-NH2 3.09Å; E409-F437 HydrophobicContact CB-CE1 4.47Å; E409-F437 HydrophobicContact CB-CZ 4.5Å
410	S	97.8	Very high	98.4	Very high	51 Å²	51	20.4 Å²	20.4	36%	0.357	11%	0.107	S	C	.	.	H	α-helix	trans	-76.6	-45	-178.7	-163.5	0	0	0	0	110.4	D408 Q412 L413 A414	D408-S410 VanDerWaalsContact C-N 3.32Å; D408-S410 PolarHBondContact O-N 3.29Å; D408-S410 WeakPolarHBondContact OD1-CB 3.18Å; D408-S410 PolarHBondContact OD1-N 3.34Å; S410-Q412 VanDerWaalsContact C-N 3.33Å; S410-Q412 PolarHBondContact O-N 3.29Å; S410-L413 PolarHBondContact O-N 2.99Å; S410-A414 PolarHBondContact O-N 3.09Å
411	D	98.6	Very high	98.4	Very high	10 Å²	10	21.1 Å²	21.1	5%	0.053	11%	0.114	C	C	.	.	H	α-helix	trans	-68.4	-30.1	175.5	-172.7	58.7	0	0	0	112.5	G406 E407 D408 A414 C415 S464 R470	G406-D411 WeakPolarHBondContact CA-OD2 3.25Å; E407-D411 HydrophobicContact CB-CB 4.34Å; E407-D411 PolarHBondContact N-OD2 3.18Å; D408-D411 PolarHBondContact OD1-N 3.31Å; D411-A414 PolarHBondContact O-N 2.93Å; D411-C415 PolarHBondContact O-N 2.73Å; D411-C415 PolarHBondContact O-SG 2.98Å; D411-S464 WeakPolarHBondContact OD1-CB 3.25Å; D411-R470 IonicContact OD1-CZ 3.76Å; D411-R470 IonicContact OD1-NE 3.51Å; D411-R470 PolarHBondContact OD1-NE 2.94Å; D411-R470 IonicContact OD1-NH2 2.79Å; D411-R470 PolarHBondContact OD1-NH2 3.1Å; D411-R470 IonicContact OD2-CZ 2.8Å; D411-R470 IonicContact OD2-NE 3.69Å; D411-R470 IonicContact OD2-NH2 2.69Å; D411-R470 PolarHBondContact OD2-NH2 2.87Å
412	Q	98.8	Very high	98.4	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-63.7	-45.6	170	-171.7	67.2	31.8	0	0	111.4	R368 F369 I376 L404 D408 S410 A414 C415 I416	R368-Q412 HydrophobicContact CG-CB 4.12Å; R368-Q412 HydrophobicContact CG-CG 4.09Å; R368-Q412 PolarHBondContact O-NE2 3.25Å; R368-Q412 PolarHBondContact O-OE1 3.47Å; F369-Q412 PolarHBondContact O-NE2 2.94Å; I376-Q412 HydrophobicContact CD1-CB 4.14Å; I376-Q412 HydrophobicContact CD1-CG 3.77Å; L404-Q412 VanDerWaalsContact CB-NE2 3.32Å; L404-Q412 PolarHBondContact O-NE2 3.3Å; L404-Q412 PolarHBondContact O-OE1 3.07Å; L404-Q412 VanDerWaalsContact O-OE1 3.06Å; D408-Q412 WeakPolarHBondContact O-CB 3.15Å; D408-Q412 PolarHBondContact O-N 3.43Å; S410-Q412 VanDerWaalsContact C-N 3.33Å; S410-Q412 PolarHBondContact O-N 3.29Å; Q412-A414 VanDerWaalsContact C-N 3.32Å; Q412-C415 WeakPolarHBondContact O-CB 3.44Å; Q412-C415 PolarHBondContact O-N 3.32Å; Q412-I416 WeakPolarHBondContact O-CG1 3.32Å; Q412-I416 PolarHBondContact O-N 2.8Å
413	L	98.7	Very high	98.3	Very high	4 Å²	4	17.1 Å²	17.1	2%	0.021	10%	0.098	C	C	.	.	H	α-helix	trans	-68.8	-32.3	176.6	-166.6	67.4	0	0	0	112	P373 I376 L377 E409 S410 I416 I417 F437 W500	P373-L413 HydrophobicContact CB-CD1 4.47Å; I376-L413 HydrophobicContact CG2-CB 4.28Å; I376-L413 HydrophobicContact CG2-CD2 4.46Å; L377-L413 HydrophobicContact CD2-CD2 3.81Å; L377-L413 HydrophobicContact CG-CD2 4.46Å; E409-L413 PolarHBondContact O-N 3.29Å; E409-L413 VanDerWaalsContact O-N 3.16Å; S410-L413 PolarHBondContact O-N 2.99Å; L413-I416 HydrophobicContact CD1-CD1 4.27Å; L413-I416 WeakPolarHBondContact O-CB 3.42Å; L413-I416 PolarHBondContact O-N 3.43Å; L413-I417 HydrophobicContact CD2-CD1 4.43Å; L413-I417 HydrophobicContact CG-CD1 4.01Å; L413-I417 WeakPolarHBondContact O-CG1 3.31Å; L413-I417 PolarHBondContact O-N 2.71Å; L413-F437 HydrophobicContact CD2-CB 3.56Å; L413-F437 HydrophobicContact CD2-CD1 4.05Å; L413-F437 HydrophobicContact CD2-CD2 4.03Å; L413-F437 HydrophobicContact CD2-CG 3.62Å; L413-W500 HydrophobicContact CD1-CH2 3.81Å; L413-W500 HydrophobicContact CD1-CZ3 3.95Å
414	A	98.8	Very high	98.2	Very high	2 Å²	2	19.3 Å²	19.3	2%	0.017	12%	0.115	C	C	.	.	H	α-helix	trans	-61.8	-42.8	171.1	0	0	0	0	0	112	S410 D411 Q412 I416 I417 E418 Y446 R470	S410-A414 PolarHBondContact O-N 3.09Å; D411-A414 PolarHBondContact O-N 2.93Å; Q412-A414 VanDerWaalsContact C-N 3.32Å; A414-I416 PolarHBondContact O-N 2.68Å; A414-I417 PolarHBondContact O-N 2.86Å; A414-E418 WeakPolarHBondContact O-CB 3.37Å; A414-E418 PolarHBondContact O-N 3.05Å; A414-Y446 HydrophobicContact CB-CD1 3.65Å; A414-Y446 HydrophobicContact CB-CD2 3.89Å; A414-Y446 HydrophobicContact CB-CE1 3.97Å; A414-Y446 HydrophobicContact CB-CE2 4.18Å; A414-Y446 HydrophobicContact CB-CG 3.63Å; A414-R470 HydrophobicContact CB-CB 4.41Å; A414-R470 HydrophobicContact CB-CG 4.17Å
415	C	98.8	Very high	98.1	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-59.9	-35.3	173.8	-65.1	0	0	0	0	112.7	L404 D411 Q412 L419 R470	L404-C415 HydrophobicContact CB-CB 4.24Å; L404-C415 HydrophobicContact CD2-CB 4.01Å; L404-C415 WeakPolarHBondContact CD2-O 3.49Å; D411-C415 PolarHBondContact O-N 2.73Å; D411-C415 PolarHBondContact O-SG 2.98Å; Q412-C415 WeakPolarHBondContact O-CB 3.44Å; Q412-C415 PolarHBondContact O-N 3.32Å; C415-L419 PolarHBondContact O-N 2.85Å; C415-R470 PolarHBondContact SG-NH1 2.77Å; C415-R470 PolarHBondContact SG-NH2 2.96Å
416	I	98.8	Very high	97.9	Very high	1 Å²	1	29.1 Å²	29.1	1%	0.005	16%	0.162	C	C	.	.	H	α-helix	trans	-69.3	-54.3	177.5	-64.6	170.1	0	0	0	109.4	P373 I376 W388 L404 Q412 L413 A414 E418 L419 I420 W500	P373-I416 HydrophobicContact CB-CD1 4.43Å; I376-I416 HydrophobicContact CD1-CD1 4.27Å; W388-I416 HydrophobicContact CH2-CD1 4.17Å; W388-I416 HydrophobicContact CH2-CG1 4.25Å; W388-I416 HydrophobicContact CH2-CG2 3.79Å; W388-I416 HydrophobicContact CZ2-CD1 3.62Å; W388-I416 HydrophobicContact CZ2-CG1 3.82Å; W388-I416 HydrophobicContact CZ2-CG2 4.24Å; L404-I416 HydrophobicContact CD1-CG1 3.85Å; L404-I416 HydrophobicContact CD2-CG1 4.33Å; Q412-I416 WeakPolarHBondContact O-CG1 3.32Å; Q412-I416 PolarHBondContact O-N 2.8Å; L413-I416 HydrophobicContact CD1-CD1 4.27Å; L413-I416 WeakPolarHBondContact O-CB 3.42Å; L413-I416 PolarHBondContact O-N 3.43Å; A414-I416 PolarHBondContact O-N 2.68Å; I416-E418 VanDerWaalsContact C-N 3.29Å; I416-E418 PolarHBondContact O-N 3.38Å; I416-L419 PolarHBondContact O-N 3.21Å; I416-I420 HydrophobicContact CG2-CD1 3.64Å; I416-I420 HydrophobicContact CG2-CG1 3.61Å; I416-I420 VanDerWaalsContact O-CG1 3.3Å; I416-I420 WeakPolarHBondContact O-CG1 3.35Å; I416-I420 PolarHBondContact O-N 2.77Å; I416-W500 HydrophobicContact CB-CH2 4.32Å; I416-W500 HydrophobicContact CG2-CH2 3.47Å; I416-W500 VanDerWaalsContact CG2-CH2 3.47Å; I416-W500 HydrophobicContact CG2-CZ2 3.49Å; I416-W500 VanDerWaalsContact CG2-CZ2 3.49Å; I416-W500 HydrophobicContact CG2-CZ3 4.1Å
417	I	98.8	Very high	97.7	Very high	3 Å²	3	29.8 Å²	29.8	2%	0.015	17%	0.166	C	C	.	.	H	α-helix	trans	-61.4	-38.6	-177.3	-67.2	168.5	0	0	0	111.5	L413 A414 L419 G421 M422 P444 Y446 P473 G474 W500	L413-I417 HydrophobicContact CD2-CD1 4.43Å; L413-I417 HydrophobicContact CG-CD1 4.01Å; L413-I417 WeakPolarHBondContact O-CG1 3.31Å; L413-I417 PolarHBondContact O-N 2.71Å; A414-I417 PolarHBondContact O-N 2.86Å; I417-L419 VanDerWaalsContact C-N 3.28Å; I417-L419 PolarHBondContact O-N 2.81Å; I417-G421 WeakPolarHBondContact CA-O 3.43Å; I417-G421 WeakPolarHBondContact O-CA 3.27Å; I417-G421 PolarHBondContact O-N 2.89Å; I417-M422 HydrophobicContact CD1-SD 4.15Å; I417-M422 HydrophobicContact CG1-SD 4.43Å; I417-M422 HydrophobicContact CG2-SD 3.68Å; I417-P444 HydrophobicContact CD1-CB 4.14Å; I417-Y446 HydrophobicContact CB-CE1 4.02Å; I417-Y446 HydrophobicContact CD1-CE1 4.32Å; I417-Y446 HydrophobicContact CG2-CE1 3.9Å; I417-P473 HydrophobicContact CG2-CB 3.67Å; I417-P473 HydrophobicContact CG2-CG 3.63Å; I417-P473 CarbonylContact O-C 3.51Å; I417-P473 WeakPolarHBondContact O-CA 3.02Å; I417-G474 PolarHBondContact O-N 2.87Å; I417-W500 HydrophobicContact CG1-CH2 3.78Å; I417-W500 HydrophobicContact CG1-CZ2 3.79Å
418	E	98.8	Very high	97.6	Very high	20 Å²	20	30.4 Å²	30.4	9%	0.093	17%	0.169	C	C	.	.	H	α-helix	trans	-55.4	-37.4	172.8	169.8	179.9	-111	0	0	113.1	A414 I416 R470 G471 G474 S475 K476	A414-E418 WeakPolarHBondContact O-CB 3.37Å; A414-E418 PolarHBondContact O-N 3.05Å; I416-E418 VanDerWaalsContact C-N 3.29Å; I416-E418 PolarHBondContact O-N 3.38Å; E418-R470 WeakPolarHBondContact OE1-CA 3.17Å; E418-G471 PolarHBondContact OE1-N 2.65Å; E418-G474 CarbonylContact O-C 3.42Å; E418-G474 VanDerWaalsContact O-C 3.31Å; E418-G474 WeakPolarHBondContact O-CA 3.39Å; E418-G474 PolarHBondContact O-N 3.13Å; E418-S475 PolarHBondContact O-N 2.94Å; E418-S475 VanDerWaalsContact O-N 3.15Å; E418-K476 HydrophobicContact CG-CB 3.57Å; E418-K476 HydrophobicContact CG-CD 3.92Å; E418-K476 HydrophobicContact CG-CG 4.42Å; E418-K476 WeakPolarHBondContact O-CB 3.42Å; E418-K476 PolarHBondContact O-N 3.44Å
419	L	98.6	Very high	97.5	Very high	5 Å²	5	36.2 Å²	36.2	3%	0.026	20%	0.195	C	C	.	.	H	α-helix	trans	-95.2	-38.6	-175.2	-178.6	65.6	0	0	0	114.2	L403 L404 C415 I416 I417 K476 W478 A481	L403-L419 HydrophobicContact CD1-CD2 3.99Å; L403-L419 HydrophobicContact CD2-CD2 3.98Å; L403-L419 HydrophobicContact CG-CD2 3.95Å; L404-L419 HydrophobicContact CD2-CD2 4Å; C415-L419 PolarHBondContact O-N 2.85Å; I416-L419 PolarHBondContact O-N 3.21Å; I417-L419 VanDerWaalsContact C-N 3.28Å; I417-L419 PolarHBondContact O-N 2.81Å; L419-K476 HydrophobicContact CD1-CD 4.25Å; L419-K476 HydrophobicContact CD1-CG 4.2Å; L419-W478 HydrophobicContact CD1-CD2 4.17Å; L419-W478 HydrophobicContact CD1-CE3 4.49Å; L419-W478 HydrophobicContact CD1-CG 4.48Å; L419-W478 HydrophobicContact CD2-CH2 4.31Å; L419-W478 HydrophobicContact CD2-CZ3 4.43Å; L419-W478 HydrophobicContact CG-CZ2 4.28Å; L419-A481 HydrophobicContact CD1-CB 3.76Å
420	I	98.1	Very high	97.4	Very high	38 Å²	38	37.9 Å²	37.9	20%	0.195	22%	0.215	C	C	.	.	H	α-helix	trans	-121.8	15.9	-170.8	68.9	162.9	0	0	0	114.2	W388 I416 W478 L498 W500	W388-I420 HydrophobicContact CH2-CD1 3.86Å; W388-I420 HydrophobicContact CZ3-CD1 4.17Å; I416-I420 HydrophobicContact CG2-CD1 3.64Å; I416-I420 HydrophobicContact CG2-CG1 3.61Å; I416-I420 VanDerWaalsContact O-CG1 3.3Å; I416-I420 WeakPolarHBondContact O-CG1 3.35Å; I416-I420 PolarHBondContact O-N 2.77Å; I420-W478 HydrophobicContact CG2-CH2 4.25Å; I420-W478 HydrophobicContact CG2-CZ2 3.6Å; I420-L498 VanDerWaalsContact CD1-O 3.26Å; I420-L498 WeakPolarHBondContact CD1-O 3.44Å; I420-W500 HydrophobicContact CD1-CD2 4.03Å; I420-W500 HydrophobicContact CD1-CG 4.08Å; I420-W500 HydrophobicContact CD1-CZ2 4.21Å; I420-W500 HydrophobicContact CG1-CZ2 4.08Å; I420-W500 PolarHBondContact O-NE1 2.85Å
421	G	98.3	Very high	97.3	Very high	16 Å²	16	35.9 Å²	35.9	17%	0.165	20%	0.2	C	C	.	.			trans	71.8	-169.8	177.3	0	0	0	0	0	113.5	I417 W500	I417-G421 WeakPolarHBondContact CA-O 3.43Å; I417-G421 WeakPolarHBondContact O-CA 3.27Å; I417-G421 PolarHBondContact O-N 2.89Å; G421-W500 VanDerWaalsContact O-CZ2 3.25Å; G421-W500 WeakPolarHBondContact O-CZ2 3.21Å; G421-W500 PolarHBondContact O-NE1 3.17Å
422	M	98.1	Very high	97.3	Very high	64 Å²	64	44.6 Å²	44.6	32%	0.315	24%	0.238	S	C	.	.	P	Polyproline II helix	trans	-77.4	145.5	179.7	-72.9	-64.8	-69.8	0	0	112.3	I417 V438 G442 P444 P473	I417-M422 HydrophobicContact CD1-SD 4.15Å; I417-M422 HydrophobicContact CG1-SD 4.43Å; I417-M422 HydrophobicContact CG2-SD 3.68Å; M422-V438 HydrophobicContact CE-CG1 4.39Å; M422-V438 HydrophobicContact CE-CG2 4.42Å; M422-G442 VanDerWaalsContact CE-O 3.26Å; M422-G442 WeakPolarHBondContact CE-O 3.18Å; M422-P444 HydrophobicContact CE-CB 4.33Å; M422-P444 HydrophobicContact CE-CG 4.45Å; M422-P444 HydrophobicContact SD-CB 3.95Å; M422-P444 HydrophobicContact SD-CG 3.76Å; M422-P473 HydrophobicContact CG-CB 3.88Å; M422-P473 HydrophobicContact CG-CG 3.87Å; M422-P473 HydrophobicContact SD-CB 4.41Å; M422-P473 HydrophobicContact SD-CG 3.95Å
423	P	97.4	Very high	97.2	Very high	9 Å²	9	48.1 Å²	48.1	6%	0.058	25%	0.251	C	S	.	.	P	Polyproline II helix	trans	-65.1	157.7	165.9	28.2	-33.4	0	0	0	111.4	L427 L428 W500	P423-L427 HydrophobicContact CB-CD2 4.02Å; P423-L428 HydrophobicContact CB-CD2 4.48Å; P423-L428 HydrophobicContact CB-CG 4.44Å; P423-L428 HydrophobicContact CG-CD1 4.15Å; P423-L428 HydrophobicContact CG-CD2 3.66Å; P423-L428 HydrophobicContact CG-CG 3.89Å; P423-W500 HydrophobicContact CB-CD2 3.72Å; P423-W500 HydrophobicContact CB-CE3 3.67Å; P423-W500 HydrophobicContact CB-CG 4.24Å; P423-W500 HydrophobicContact CB-CH2 4.26Å; P423-W500 HydrophobicContact CB-CZ2 4.32Å; P423-W500 HydrophobicContact CB-CZ3 3.92Å; P423-W500 HydrophobicContact CG-CE3 4.34Å; P423-W500 HydrophobicContact CG-CH2 4.08Å; P423-W500 HydrophobicContact CG-CZ2 4.3Å; P423-W500 HydrophobicContact CG-CZ3 4.08Å
424	S	96.6	Very high	97.2	Very high	56 Å²	56	48.2 Å²	48.2	39%	0.392	25%	0.253	S	S	.	.	P	Polyproline II helix	trans	-65.7	149.6	175.2	69.5	0	0	0	0	112.2	K426 L427 L428	S424-K426 VanDerWaalsContact C-N 3.28Å; S424-K426 PolarHBondContact O-N 3.16Å; S424-L427 PolarHBondContact O-N 3.36Å; S424-L427 PolarHBondContact OG-N 3.43Å; S424-L428 PolarHBondContact O-N 3.45Å
425	P	95.3	Very high	97.1	Very high	90 Å²	90	56.4 Å²	56.4	58%	0.584	29%	0.288	S	S	*	.	H	α-helix	trans	-54.5	-42.4	177.1	-27.9	35.7	0	0	0	113.1	L427 L428 E429	P425-L427 VanDerWaalsContact C-N 3.29Å; P425-L427 PolarHBondContact O-N 3Å; P425-L428 CarbonylContact O-C 3.45Å; P425-L428 WeakPolarHBondContact O-CA 3.45Å; P425-L428 WeakPolarHBondContact O-CB 3.25Å; P425-L428 PolarHBondContact O-N 2.92Å; P425-E429 WeakPolarHBondContact O-CG 3.47Å; P425-E429 PolarHBondContact O-N 3.25Å
426	K	94.4	Very high	97.1	Very high	156 Å²	156	61.4 Å²	61.4	68%	0.678	31%	0.314	S	S	*	.	H	α-helix	trans	-55	-39.3	175.4	-175.4	-174.7	176.9	-168.8	0	113.2	S424 A430	S424-K426 VanDerWaalsContact C-N 3.28Å; S424-K426 PolarHBondContact O-N 3.16Å; K426-A430 PolarHBondContact O-N 3.09Å
427	L	94.5	Very high	97	Very high	15 Å²	15	62.1 Å²	62.1	8%	0.079	32%	0.318	C	S	.	.	H	α-helix	trans	-72.3	-33.3	177	-177.5	61	0	0	0	111.7	P423 S424 P425 S431 W500	P423-L427 HydrophobicContact CB-CD2 4.02Å; S424-L427 PolarHBondContact O-N 3.36Å; S424-L427 PolarHBondContact OG-N 3.43Å; P425-L427 VanDerWaalsContact C-N 3.29Å; P425-L427 PolarHBondContact O-N 3Å; L427-S431 VanDerWaalsContact O-CB 3.24Å; L427-S431 WeakPolarHBondContact O-CB 3.38Å; L427-S431 PolarHBondContact O-N 3.11Å; L427-S431 PolarHBondContact O-OG 3.34Å; L427-W500 HydrophobicContact CD2-CB 3.93Å; L427-W500 HydrophobicContact CD2-CE3 4.2Å; L427-W500 WeakPolarHBondContact CD2-O 3.45Å
428	L	96.1	Very high	97	Very high	28 Å²	28	62.4 Å²	62.4	15%	0.147	32%	0.319	C	S	.	.	H	α-helix	trans	-71.2	-39.4	174.1	-66.2	173.7	0	0	0	112.2	L377 P423 S424 P425 S431 A434 V438	L377-L428 HydrophobicContact CD2-CD2 4.28Å; P423-L428 HydrophobicContact CB-CD2 4.48Å; P423-L428 HydrophobicContact CB-CG 4.44Å; P423-L428 HydrophobicContact CG-CD1 4.15Å; P423-L428 HydrophobicContact CG-CD2 3.66Å; P423-L428 HydrophobicContact CG-CG 3.89Å; S424-L428 PolarHBondContact O-N 3.45Å; P425-L428 CarbonylContact O-C 3.45Å; P425-L428 WeakPolarHBondContact O-CA 3.45Å; P425-L428 WeakPolarHBondContact O-CB 3.25Å; P425-L428 PolarHBondContact O-N 2.92Å; L428-S431 WeakPolarHBondContact O-CB 3.39Å; L428-S431 PolarHBondContact O-N 3Å; L428-S431 VanDerWaalsContact O-N 3.13Å; L428-A434 HydrophobicContact CB-CB 4.21Å; L428-A434 HydrophobicContact CD2-CB 3.95Å; L428-A434 VanDerWaalsContact O-CB 3.28Å; L428-A434 WeakPolarHBondContact O-CB 3.34Å; L428-V438 HydrophobicContact CD1-CG1 4.22Å; L428-V438 HydrophobicContact CD1-CG2 4.18Å; L428-V438 HydrophobicContact CD2-CG2 3.82Å
429	E	94.6	Very high	96.9	Very high	160 Å²	160	63 Å²	63	75%	0.748	33%	0.326	S	S	*	.	H	α-helix	trans	-63.3	-40.7	176.2	-73.3	160.9	-161.3	0	0	112.2	P425 S431	P425-E429 WeakPolarHBondContact O-CG 3.47Å; P425-E429 PolarHBondContact O-N 3.25Å; E429-S431 PolarHBondContact O-N 3.03Å
430	A	94.8	Very high	96.6	Very high	68 Å²	68	68.9 Å²	68.9	56%	0.562	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-11.3	174.7	0	0	0	0	0	114.1	S379 K426	S379-A430 PolarHBondContact OG-O 3.26Å; K426-A430 PolarHBondContact O-N 3.09Å
431	S	97.2	Very high	96.3	Very high	8 Å²	8	74.9 Å²	74.9	6%	0.056	39%	0.392	C	S	.	.			trans	-104.2	109.4	-166.1	-75.7	0	0	0	0	113.5	L377 S379 L427 L428 E429 R433 A434	L377-S431 CarbonylContact O-C 3.52Å; L377-S431 WeakPolarHBondContact O-CB 3.49Å; S379-S431 PolarHBondContact OG-OG 2.94Å; L427-S431 VanDerWaalsContact O-CB 3.24Å; L427-S431 WeakPolarHBondContact O-CB 3.38Å; L427-S431 PolarHBondContact O-N 3.11Å; L427-S431 PolarHBondContact O-OG 3.34Å; L428-S431 WeakPolarHBondContact O-CB 3.39Å; L428-S431 PolarHBondContact O-N 3Å; L428-S431 VanDerWaalsContact O-N 3.13Å; E429-S431 PolarHBondContact O-N 3.03Å; S431-R433 PolarHBondContact O-N 3.05Å; S431-A434 WeakPolarHBondContact O-CB 3.38Å; S431-A434 PolarHBondContact O-N 3.37Å
432	K	97.4	Very high	96.2	Very high	194 Å²	194	76 Å²	76	84%	0.843	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-28.2	-172.2	-62.7	-178.3	178.4	-175.7	0	115	L377 G378	L377-K432 PolarHBondContact O-N 3.22Å; G378-K432 WeakPolarHBondContact O-CB 3.5Å; G378-K432 WeakPolarHBondContact O-CG 3.5Å; G378-K432 PolarHBondContact O-N 3.26Å
433	R	97.8	Very high	96.1	Very high	73 Å²	73	76.1 Å²	76.1	28%	0.275	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.8	0.5	-178.5	-54.3	172.6	71.4	-161.5	10.3	113.4	I376 L377 E409 S431 K435 N436 F437	I376-R433 WeakPolarHBondContact O-CD 3.18Å; I376-R433 PolarHBondContact O-NH1 2.95Å; L377-R433 WeakPolarHBondContact O-CA 3.48Å; L377-R433 WeakPolarHBondContact O-CB 3.17Å; L377-R433 PolarHBondContact O-N 3.04Å; E409-R433 IonicContact OE1-CZ 3.23Å; E409-R433 IonicContact OE1-NH1 3.09Å; E409-R433 PolarHBondContact OE1-NH1 3.48Å; E409-R433 IonicContact OE1-NH2 2.71Å; E409-R433 IonicContact OE2-CZ 2.83Å; E409-R433 IonicContact OE2-NH1 3.77Å; E409-R433 PolarHBondContact OE2-NH1 3.41Å; E409-R433 IonicContact OE2-NH2 3.3Å; E409-R433 PolarHBondContact OE2-NH2 3.09Å; S431-R433 PolarHBondContact O-N 3.05Å; R433-K435 VanDerWaalsContact C-N 3.25Å; R433-K435 PolarHBondContact O-N 3.5Å; R433-K435 VanDerWaalsContact O-N 3.14Å; R433-N436 VanDerWaalsContact O-CB 3.27Å; R433-N436 WeakPolarHBondContact O-CB 3.5Å; R433-N436 PolarHBondContact O-N 3.03Å; R433-F437 HydrophobicContact CB-CE2 4Å; R433-F437 WeakPolarHBondContact O-CD2 3.49Å
434	A	97.8	Very high	96.1	Very high	6 Å²	6	75.8 Å²	75.8	5%	0.05	40%	0.399	C	S	.	.	G	3₁₀ helix	trans	-53.6	-39.7	-173.8	0	0	0	0	0	113.5	L377 L428 S431 N436 F437 V438	L377-A434 HydrophobicContact CD2-CB 4.48Å; L428-A434 HydrophobicContact CB-CB 4.21Å; L428-A434 HydrophobicContact CD2-CB 3.95Å; L428-A434 VanDerWaalsContact O-CB 3.28Å; L428-A434 WeakPolarHBondContact O-CB 3.34Å; S431-A434 WeakPolarHBondContact O-CB 3.38Å; S431-A434 PolarHBondContact O-N 3.37Å; A434-N436 PolarHBondContact O-N 3.17Å; A434-N436 VanDerWaalsContact O-N 3.09Å; A434-F437 PolarHBondContact O-N 3.32Å; A434-V438 PolarHBondContact O-N 3.4Å
435	K	97.3	Very high	96.2	Very high	175 Å²	175	80 Å²	80	76%	0.761	41%	0.406	S	S	*	.	G	3₁₀ helix	trans	-59.8	-19.9	178.3	-64.2	-178.9	179.9	179	0	114.1	R433 V438 R445	R433-K435 VanDerWaalsContact C-N 3.25Å; R433-K435 PolarHBondContact O-N 3.5Å; R433-K435 VanDerWaalsContact O-N 3.14Å; K435-V438 CarbonylContact C-O 3.49Å; K435-V438 VanDerWaalsContact O-O 3.13Å; K435-R445 VanDerWaalsContact O-CZ 3.29Å; K435-R445 PolarHBondContact O-NE 3.31Å; K435-R445 PolarHBondContact O-NH2 2.86Å
436	N	97.8	Very high	96.3	Very high	104 Å²	104	77.6 Å²	77.6	56%	0.556	39%	0.386	S	S	*	.	G	3₁₀ helix	trans	-77.8	-22.9	176.9	-59.8	16.3	0	0	0	112.2	R433 A434 R445	R433-N436 VanDerWaalsContact O-CB 3.27Å; R433-N436 WeakPolarHBondContact O-CB 3.5Å; R433-N436 PolarHBondContact O-N 3.03Å; A434-N436 PolarHBondContact O-N 3.17Å; A434-N436 VanDerWaalsContact O-N 3.09Å; N436-R445 WeakPolarHBondContact O-CD 3.44Å
437	F	97.9	Very high	96.4	Very high	17 Å²	17	70.8 Å²	70.8	8%	0.075	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.1	-23.3	-174.1	-51.8	-76.2	0	0	0	113.2	I376 L377 E409 L413 R433 A434 R445	I376-F437 HydrophobicContact CG2-CE1 4.15Å; I376-F437 HydrophobicContact CG2-CE2 3.95Å; I376-F437 HydrophobicContact CG2-CZ 3.65Å; I376-F437 WeakPolarHBondContact O-CE2 3.38Å; L377-F437 HydrophobicContact CD2-CD2 4.06Å; E409-F437 HydrophobicContact CB-CE1 4.47Å; E409-F437 HydrophobicContact CB-CZ 4.5Å; L413-F437 HydrophobicContact CD2-CB 3.56Å; L413-F437 HydrophobicContact CD2-CD1 4.05Å; L413-F437 HydrophobicContact CD2-CD2 4.03Å; L413-F437 HydrophobicContact CD2-CG 3.62Å; R433-F437 HydrophobicContact CB-CE2 4Å; R433-F437 WeakPolarHBondContact O-CD2 3.49Å; A434-F437 PolarHBondContact O-N 3.32Å; F437-R445 WeakPolarHBondContact O-CB 3.48Å; F437-R445 WeakPolarHBondContact O-CG 3.26Å; F437-R445 PolarHBondContact O-N 3.32Å
438	V	97.8	Very high	96.5	Very high	8 Å²	8	74.2 Å²	74.2	5%	0.048	38%	0.379	C	S	.	.	B	Isolated β-bridge	trans	-119.9	142.6	179.1	-171.9	0	0	0	0	109.5	M422 L428 A434 K435 G442 R445	M422-V438 HydrophobicContact CE-CG1 4.39Å; M422-V438 HydrophobicContact CE-CG2 4.42Å; L428-V438 HydrophobicContact CD1-CG1 4.22Å; L428-V438 HydrophobicContact CD1-CG2 4.18Å; L428-V438 HydrophobicContact CD2-CG2 3.82Å; A434-V438 PolarHBondContact O-N 3.4Å; K435-V438 CarbonylContact C-O 3.49Å; K435-V438 VanDerWaalsContact O-O 3.13Å; V438-G442 VanDerWaalsContact CG1-C 3.46Å; V438-G442 WeakPolarHBondContact CG1-O 3.43Å; V438-R445 PolarHBondContact O-NE 3.04Å
439	S	96.4	Very high	96.5	Very high	32 Å²	32	76 Å²	76	22%	0.224	39%	0.391	C	S	.	.			trans	-78.6	167	177.4	66.8	0	0	0	0	112.2	K441 G442 Y443	S439-K441 PolarHBondContact O-N 3.45Å; S439-G442 PolarHBondContact O-N 3.19Å; S439-Y443 WeakPolarHBondContact CB-O 3.37Å; S439-Y443 PolarHBondContact N-O 3.42Å; S439-Y443 PolarHBondContact OG-N 3.26Å; S439-Y443 VanDerWaalsContact OG-N 3.14Å; S439-Y443 PolarHBondContact OG-O 3.49Å
440	S	93.1	Very high	96.5	Very high	130 Å²	130	70.8 Å²	70.8	91%	0.909	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-18.8	174	47.2	0	0	0	0	114.1
441	K	92.7	Very high	96.4	Very high	164 Å²	164	72.2 Å²	72.2	71%	0.713	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.8	7.7	173.8	-63.2	-171.3	177.4	-173.9	0	113.4	S439 Y443	S439-K441 PolarHBondContact O-N 3.45Å; K441-Y443 VanDerWaalsContact C-N 3.27Å; K441-Y443 HydrophobicContact CB-CD2 3.66Å; K441-Y443 HydrophobicContact CB-CE2 3.56Å; K441-Y443 HydrophobicContact CD-CD2 4.47Å; K441-Y443 HydrophobicContact CD-CE2 3.94Å; K441-Y443 HydrophobicContact CG-CE2 4.41Å; K441-Y443 PolarHBondContact O-N 2.9Å
442	G	94.3	Very high	96.3	Very high	38 Å²	38	75.9 Å²	75.9	39%	0.392	39%	0.389	S	S	.	.	S	Bend	trans	81	-9.4	-178.5	0	0	0	0	0	115.4	M422 V438 S439	M422-G442 VanDerWaalsContact CE-O 3.26Å; M422-G442 WeakPolarHBondContact CE-O 3.18Å; V438-G442 VanDerWaalsContact CG1-C 3.46Å; V438-G442 WeakPolarHBondContact CG1-O 3.43Å; S439-G442 PolarHBondContact O-N 3.19Å
443	Y	96.9	Very high	96.1	Very high	67 Å²	67	73.2 Å²	73.2	26%	0.263	39%	0.392	S	S	.	.			trans	-74.1	141.6	177.9	-48.7	-52.2	0	0	0	112.2	S439 K441 V449 V457 L459	S439-Y443 WeakPolarHBondContact CB-O 3.37Å; S439-Y443 PolarHBondContact N-O 3.42Å; S439-Y443 PolarHBondContact OG-N 3.26Å; S439-Y443 VanDerWaalsContact OG-N 3.14Å; S439-Y443 PolarHBondContact OG-O 3.49Å; K441-Y443 VanDerWaalsContact C-N 3.27Å; K441-Y443 HydrophobicContact CB-CD2 3.66Å; K441-Y443 HydrophobicContact CB-CE2 3.56Å; K441-Y443 HydrophobicContact CD-CD2 4.47Å; K441-Y443 HydrophobicContact CD-CE2 3.94Å; K441-Y443 HydrophobicContact CG-CE2 4.41Å; K441-Y443 PolarHBondContact O-N 2.9Å; Y443-V449 HydrophobicContact CD2-CG1 3.97Å; Y443-V449 HydrophobicContact CD2-CG2 3.83Å; Y443-V449 HydrophobicContact CE2-CG1 3.99Å; Y443-V449 HydrophobicContact CG-CG2 4.07Å; Y443-V457 HydrophobicContact CE1-CG1 4.26Å; Y443-V457 HydrophobicContact CE2-CG1 4.36Å; Y443-L459 HydrophobicContact CD1-CD1 4.33Å; Y443-L459 HydrophobicContact CD1-CD2 3.86Å; Y443-L459 HydrophobicContact CG-CD2 4Å
444	P	97.6	Very high	95.9	Very high	3 Å²	3	75.8 Å²	75.8	2%	0.019	41%	0.411	C	S	.	.	B	Isolated β-bridge	trans	-72	135.5	178.2	31.2	-35.1	0	0	0	111.2	I417 M422 Y446 C447 P473	I417-P444 HydrophobicContact CD1-CB 4.14Å; M422-P444 HydrophobicContact CE-CB 4.33Å; M422-P444 HydrophobicContact CE-CG 4.45Å; M422-P444 HydrophobicContact SD-CB 3.95Å; M422-P444 HydrophobicContact SD-CG 3.76Å; P444-Y446 HydrophobicContact CB-CD1 3.88Å; P444-Y446 HydrophobicContact CB-CE1 3.83Å; P444-Y446 HydrophobicContact CG-CD1 4.41Å; P444-Y446 HydrophobicContact CG-CE1 4.03Å; P444-Y446 PolarHBondContact O-N 3.05Å; P444-C447 HydrophobicContact CG-CB 4.22Å; P444-C447 PolarHBondContact O-N 3.31Å; P444-C447 VanDerWaalsContact O-N 3.1Å; P444-P473 HydrophobicContact CG-CG 4.01Å
445	R	97.8	Very high	95.6	Very high	145 Å²	145	78 Å²	78	55%	0.547	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-9.1	-171.2	-68	176.5	-179.4	-88.2	9.8	115.3	K435 N436 F437 V438 C447	K435-R445 VanDerWaalsContact O-CZ 3.29Å; K435-R445 PolarHBondContact O-NE 3.31Å; K435-R445 PolarHBondContact O-NH2 2.86Å; N436-R445 WeakPolarHBondContact O-CD 3.44Å; F437-R445 WeakPolarHBondContact O-CB 3.48Å; F437-R445 WeakPolarHBondContact O-CG 3.26Å; F437-R445 PolarHBondContact O-N 3.32Å; V438-R445 PolarHBondContact O-NE 3.04Å; R445-C447 VanDerWaalsContact C-N 3.35Å
446	Y	97.5	Very high	95.4	Very high	39 Å²	39	72 Å²	72	15%	0.153	41%	0.414	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-16.1	172.5	83.5	-92.6	0	0	0	112.4	A414 I417 P444 G462 R470 G471	A414-Y446 HydrophobicContact CB-CD1 3.65Å; A414-Y446 HydrophobicContact CB-CD2 3.89Å; A414-Y446 HydrophobicContact CB-CE1 3.97Å; A414-Y446 HydrophobicContact CB-CE2 4.18Å; A414-Y446 HydrophobicContact CB-CG 3.63Å; I417-Y446 HydrophobicContact CB-CE1 4.02Å; I417-Y446 HydrophobicContact CD1-CE1 4.32Å; I417-Y446 HydrophobicContact CG2-CE1 3.9Å; P444-Y446 HydrophobicContact CB-CD1 3.88Å; P444-Y446 HydrophobicContact CB-CE1 3.83Å; P444-Y446 HydrophobicContact CG-CD1 4.41Å; P444-Y446 HydrophobicContact CG-CE1 4.03Å; P444-Y446 PolarHBondContact O-N 3.05Å; Y446-G462 WeakPolarHBondContact O-CA 3.26Å; Y446-R470 HydrophobicContact CD2-CB 3.95Å; Y446-R470 HydrophobicContact CE2-CB 3.79Å; Y446-G471 VanDerWaalsContact CE2-O 3.25Å; Y446-G471 WeakPolarHBondContact CE2-O 3.26Å; Y446-G471 PolarHBondContact OH-O 2.86Å
447	C	97.6	Very high	95.2	Very high	12 Å²	12	69.9 Å²	69.9	8%	0.081	41%	0.405	C	S	.	.	S	Bend	trans	-91.3	145.6	177.3	-71.2	0	0	0	0	111.6	P444 R445 N460	P444-C447 HydrophobicContact CG-CB 4.22Å; P444-C447 PolarHBondContact O-N 3.31Å; P444-C447 VanDerWaalsContact O-N 3.1Å; R445-C447 VanDerWaalsContact C-N 3.35Å; C447-N460 CarbonylContact C-O 3.35Å; C447-N460 WeakPolarHBondContact CA-O 3.3Å; C447-N460 VanDerWaalsContact CB-O 3.24Å; C447-N460 WeakPolarHBondContact CB-O 3.34Å
448	T	95.9	Very high	95	Very high	88 Å²	88	71.9 Å²	71.9	54%	0.54	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	132.1	165.3	-60.7	0	0	0	0	108.7	N460	T448-N460 PolarHBondContact N-O 2.9Å; T448-N460 PolarHBondContact O-N 3.31Å
449	V	95.5	Very high	95	Very high	64 Å²	64	73.4 Å²	73.4	39%	0.388	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	119.1	-179.9	-171.9	0	0	0	0	109	Y443 V457 L459	Y443-V449 HydrophobicContact CD2-CG1 3.97Å; Y443-V449 HydrophobicContact CD2-CG2 3.83Å; Y443-V449 HydrophobicContact CE2-CG1 3.99Å; Y443-V449 HydrophobicContact CG-CG2 4.07Å; V449-V457 HydrophobicContact CG1-CG1 3.48Å; V449-V457 VanDerWaalsContact CG1-CG1 3.48Å; V449-L459 HydrophobicContact CB-CD2 4.42Å; V449-L459 HydrophobicContact CG1-CD2 4.29Å; V449-L459 HydrophobicContact CG2-CD2 3.84Å
450	T	94.5	Very high	94.9	Very high	52 Å²	52	75.4 Å²	75.4	32%	0.319	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	123.9	176.9	-54.8	0	0	0	0	109	M452 V458 N460	T450-M452 HydrophobicContact CG2-SD 4.26Å; T450-V458 PolarHBondContact N-O 3.33Å; T450-V458 PolarHBondContact O-N 2.85Å; T450-N460 PolarHBondContact OG1-ND2 3.34Å; T450-N460 VanDerWaalsContact OG1-ND2 3.1Å
451	T	94.2	Very high	95	Very high	97 Å²	97	70.7 Å²	70.7	60%	0.595	41%	0.406	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.8	127.3	169.4	-51.4	0	0	0	0	108.6	S456	T451-S456 WeakPolarHBondContact CA-O 3.35Å
452	M	94.1	Very high	95.1	Very high	85 Å²	85	63.5 Å²	63.5	42%	0.419	38%	0.378	S	S	.	.			trans	-86.7	163.6	-179.4	-62.4	-63	-72.5	0	0	111	T450 D454 G455 S456 V458	T450-M452 HydrophobicContact CG2-SD 4.26Å; M452-D454 WeakPolarHBondContact CB-OD1 3.34Å; M452-D454 PolarHBondContact O-N 2.89Å; M452-D454 VanDerWaalsContact O-N 3.17Å; M452-G455 PolarHBondContact O-N 3.06Å; M452-S456 WeakPolarHBondContact CB-OG 3.25Å; M452-S456 PolarHBondContact N-O 2.84Å; M452-V458 HydrophobicContact CG-CG2 3.8Å; M452-V458 HydrophobicContact SD-CG2 4.3Å
453	P	93.8	Very high	95.2	Very high	138 Å²	138	70.4 Å²	70.4	90%	0.896	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-20.8	-178.8	-24.9	35.8	0	0	0	115.2	G455	P453-G455 VanDerWaalsContact C-N 3.27Å
454	D	93.8	Very high	95.1	Very high	127 Å²	127	67.8 Å²	67.8	68%	0.679	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	1	173.7	64.8	-2.8	0	0	0	113.5	M452 S456	M452-D454 WeakPolarHBondContact CB-OD1 3.34Å; M452-D454 PolarHBondContact O-N 2.89Å; M452-D454 VanDerWaalsContact O-N 3.17Å; D454-S456 VanDerWaalsContact C-N 3.3Å; D454-S456 PolarHBondContact O-N 3.03Å; D454-S456 WeakPolarHBondContact OD1-CB 3.49Å; D454-S456 PolarHBondContact OD1-N 3.45Å; D454-S456 PolarHBondContact OD1-OG 3.49Å; D454-S456 PolarHBondContact OD2-OG 3.5Å
455	G	90.9	Very high	95	Very high	52 Å²	52	76.9 Å²	76.9	54%	0.536	42%	0.418	S	S	.	.	S	Bend	trans	82.4	-2.5	-175.7	0	0	0	0	0	114.8	M452 P453	M452-G455 PolarHBondContact O-N 3.06Å; P453-G455 VanDerWaalsContact C-N 3.27Å
456	S	93.2	Very high	94.8	Very high	49 Å²	49	78.7 Å²	78.7	34%	0.343	43%	0.425	S	S	.	.			trans	-68.6	151.8	175.7	71.1	0	0	0	0	111.6	T451 M452 D454	T451-S456 WeakPolarHBondContact CA-O 3.35Å; M452-S456 WeakPolarHBondContact CB-OG 3.25Å; M452-S456 PolarHBondContact N-O 2.84Å; D454-S456 VanDerWaalsContact C-N 3.3Å; D454-S456 PolarHBondContact O-N 3.03Å; D454-S456 WeakPolarHBondContact OD1-CB 3.49Å; D454-S456 PolarHBondContact OD1-N 3.45Å; D454-S456 PolarHBondContact OD1-OG 3.49Å; D454-S456 PolarHBondContact OD2-OG 3.5Å
457	V	93.7	Very high	94.7	Very high	61 Å²	61	78.5 Å²	78.5	37%	0.37	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	115.4	-177.3	-179.3	0	0	0	0	110.1	Y443 V449	Y443-V457 HydrophobicContact CE1-CG1 4.26Å; Y443-V457 HydrophobicContact CE2-CG1 4.36Å; V449-V457 HydrophobicContact CG1-CG1 3.48Å; V449-V457 VanDerWaalsContact CG1-CG1 3.48Å
458	V	94.6	Very high	94.6	Very high	58 Å²	58	82.9 Å²	82.9	35%	0.352	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	127	176.6	-179.4	0	0	0	0	109.3	T450 M452	T450-V458 PolarHBondContact N-O 3.33Å; T450-V458 PolarHBondContact O-N 2.85Å; M452-V458 HydrophobicContact CG-CG2 3.8Å; M452-V458 HydrophobicContact SD-CG2 4.3Å
459	L	96.2	Very high	94.7	Very high	41 Å²	41	82.8 Å²	82.8	22%	0.215	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	116	169.4	-64.3	-177	0	0	0	109.4	Y443 V449 P472 P473	Y443-L459 HydrophobicContact CD1-CD1 4.33Å; Y443-L459 HydrophobicContact CD1-CD2 3.86Å; Y443-L459 HydrophobicContact CG-CD2 4Å; V449-L459 HydrophobicContact CB-CD2 4.42Å; V449-L459 HydrophobicContact CG1-CD2 4.29Å; V449-L459 HydrophobicContact CG2-CD2 3.84Å; L459-P472 HydrophobicContact CB-CB 4.17Å; L459-P472 WeakPolarHBondContact O-CB 3.35Å; L459-P473 HydrophobicContact CD1-CG 4.07Å
460	N	95.6	Very high	94.8	Very high	74 Å²	74	80.5 Å²	80.5	40%	0.396	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	142.8	173.8	-76.8	-67	0	0	0	110.6	C447 T448 T450	C447-N460 CarbonylContact C-O 3.35Å; C447-N460 WeakPolarHBondContact CA-O 3.3Å; C447-N460 VanDerWaalsContact CB-O 3.24Å; C447-N460 WeakPolarHBondContact CB-O 3.34Å; T448-N460 PolarHBondContact N-O 2.9Å; T448-N460 PolarHBondContact O-N 3.31Å; T450-N460 PolarHBondContact OG1-ND2 3.34Å; T450-N460 VanDerWaalsContact OG1-ND2 3.1Å
461	G	94.9	Very high	94.9	Very high	31 Å²	31	78.7 Å²	78.7	32%	0.32	43%	0.427	S	S	.	.			trans	-63.4	160.7	-179.8	0	0	0	0	0	114.2	R470	G461-R470 CarbonylContact C-O 3.21Å; G461-R470 WeakPolarHBondContact CA-O 3.34Å
462	G	95.6	Very high	95.1	Very high	12 Å²	12	76 Å²	76	12%	0.124	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	-172.8	178.7	0	0	0	0	0	113.8	Y446 T469 R470	Y446-G462 WeakPolarHBondContact O-CA 3.26Å; G462-T469 CarbonylContact O-C 3.31Å; G462-T469 WeakPolarHBondContact O-CA 3.43Å; G462-R470 PolarHBondContact N-O 3.31Å; G462-R470 PolarHBondContact O-N 3.13Å
463	R	96	Very high	95.3	Very high	184 Å²	184	73.7 Å²	73.7	69%	0.694	40%	0.403	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.8	144.2	166.4	-70.2	-176.8	-178	-93.4	3.1	111.3	G467 K468	R463-G467 PolarHBondContact NH1-O 3.32Å; R463-K468 CarbonylContact C-O 3.6Å; R463-K468 VanDerWaalsContact CA-O 3.25Å; R463-K468 WeakPolarHBondContact CA-O 3.48Å
464	S	95.4	Very high	95.5	Very high	12 Å²	12	69 Å²	69	8%	0.084	38%	0.38	C	S	.	.			trans	-67.3	170.6	169.8	80	0	0	0	0	111.5	E407 D411 R466 G467 K468	E407-S464 VanDerWaalsContact CD-CB 3.46Å; E407-S464 WeakPolarHBondContact OE1-CB 3.44Å; E407-S464 PolarHBondContact OE1-OG 2.92Å; E407-S464 WeakPolarHBondContact OE2-CB 3.24Å; E407-S464 PolarHBondContact OE2-OG 3.42Å; D411-S464 WeakPolarHBondContact OD1-CB 3.25Å; S464-R466 PolarHBondContact O-N 2.8Å; S464-R466 PolarHBondContact OG-N 3.39Å; S464-G467 WeakPolarHBondContact O-CA 3.34Å; S464-G467 PolarHBondContact O-N 2.84Å; S464-G467 PolarHBondContact OG-N 3.34Å; S464-K468 PolarHBondContact N-O 2.78Å; S464-K468 WeakPolarHBondContact OG-CB 3.35Å; S464-K468 PolarHBondContact OG-N 3.09Å
465	R	94.3	Very high	95.7	Very high	194 Å²	194	66.2 Å²	66.2	73%	0.732	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-21.2	176.9	-70.1	-173.4	-68.2	129.6	1.4	113.2	E407 D408 G467	E407-R465 PolarHBondContact OE2-N 2.85Å; D408-R465 IonicContact OD2-CZ 2.71Å; D408-R465 IonicContact OD2-NE 3.16Å; D408-R465 PolarHBondContact OD2-NE 3.12Å; D408-R465 IonicContact OD2-NH2 3.79Å; D408-R465 PolarHBondContact OD2-NH2 3.11Å; R465-G467 VanDerWaalsContact C-N 3.35Å
466	R	94.5	Very high	96	Very high	183 Å²	183	66.3 Å²	66.3	69%	0.691	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.5	17.3	168.5	-54	169.7	-150	-150.8	4.1	113.1	E407 S464 K468	E407-R466 WeakPolarHBondContact OE1-CB 3.32Å; E407-R466 VanDerWaalsContact OE2-CG 3.26Å; E407-R466 WeakPolarHBondContact OE2-CG 3.45Å; E407-R466 PolarHBondContact OE2-N 2.7Å; E407-R466 IonicContact OE2-NE 3.27Å; S464-R466 PolarHBondContact O-N 2.8Å; S464-R466 PolarHBondContact OG-N 3.39Å; R466-K468 PolarHBondContact O-N 3.28Å
467	G	94.4	Very high	96.2	Very high	34 Å²	34	68.4 Å²	68.4	35%	0.351	36%	0.364	S	S	.	.			trans	79.8	2.7	172.9	0	0	0	0	0	116.3	R463 S464 R465 T469	R463-G467 PolarHBondContact NH1-O 3.32Å; S464-G467 WeakPolarHBondContact O-CA 3.34Å; S464-G467 PolarHBondContact O-N 2.84Å; S464-G467 PolarHBondContact OG-N 3.34Å; R465-G467 VanDerWaalsContact C-N 3.35Å; G467-T469 PolarHBondContact O-N 3.49Å
468	K	95.8	Very high	96.3	Very high	104 Å²	104	67 Å²	67	45%	0.452	35%	0.352	S	S	.	.			trans	-68.2	126.6	179.5	-61.1	-177.7	179.8	178.6	0	110.4	R463 S464 R466	R463-K468 CarbonylContact C-O 3.6Å; R463-K468 VanDerWaalsContact CA-O 3.25Å; R463-K468 WeakPolarHBondContact CA-O 3.48Å; S464-K468 PolarHBondContact N-O 2.78Å; S464-K468 WeakPolarHBondContact OG-CB 3.35Å; S464-K468 PolarHBondContact OG-N 3.09Å; R466-K468 PolarHBondContact O-N 3.28Å
469	T	97	Very high	96.4	Very high	87 Å²	87	66.8 Å²	66.8	53%	0.534	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	141.5	175.8	-46	0	0	0	0	111.2	G462 G467	G462-T469 CarbonylContact O-C 3.31Å; G462-T469 WeakPolarHBondContact O-CA 3.43Å; G467-T469 PolarHBondContact O-N 3.49Å
470	R	98	Very high	96.3	Very high	16 Å²	16	68.3 Å²	68.3	6%	0.06	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	119.9	168.3	-58.1	-59.3	-178.2	-171	4.1	108.7	P405 D411 A414 C415 E418 Y446 G461 G462	P405-R470 PolarHBondContact O-NH2 3.38Å; D411-R470 IonicContact OD1-CZ 3.76Å; D411-R470 IonicContact OD1-NE 3.51Å; D411-R470 PolarHBondContact OD1-NE 2.94Å; D411-R470 IonicContact OD1-NH2 2.79Å; D411-R470 PolarHBondContact OD1-NH2 3.1Å; D411-R470 IonicContact OD2-CZ 2.8Å; D411-R470 IonicContact OD2-NE 3.69Å; D411-R470 IonicContact OD2-NH2 2.69Å; D411-R470 PolarHBondContact OD2-NH2 2.87Å; A414-R470 HydrophobicContact CB-CB 4.41Å; A414-R470 HydrophobicContact CB-CG 4.17Å; C415-R470 PolarHBondContact SG-NH1 2.77Å; C415-R470 PolarHBondContact SG-NH2 2.96Å; E418-R470 WeakPolarHBondContact OE1-CA 3.17Å; Y446-R470 HydrophobicContact CD2-CB 3.95Å; Y446-R470 HydrophobicContact CE2-CB 3.79Å; G461-R470 CarbonylContact C-O 3.21Å; G461-R470 WeakPolarHBondContact CA-O 3.34Å; G462-R470 PolarHBondContact N-O 3.31Å; G462-R470 PolarHBondContact O-N 3.13Å
471	G	98	Very high	96.4	Very high	13 Å²	13	65.6 Å²	65.6	13%	0.134	36%	0.359	C	S	.	.	P	Polyproline II helix	trans	-68.9	165.3	179.7	0	0	0	0	0	113.7	E418 Y446 S475	E418-G471 PolarHBondContact OE1-N 2.65Å; Y446-G471 VanDerWaalsContact CE2-O 3.25Å; Y446-G471 WeakPolarHBondContact CE2-O 3.26Å; Y446-G471 PolarHBondContact OH-O 2.86Å; G471-S475 WeakPolarHBondContact CA-OG 3.35Å
472	P	98.2	Very high	96.5	Very high	40 Å²	40	64.3 Å²	64.3	26%	0.26	35%	0.345	S	S	.	.	S	Bend	trans	-64.5	171.7	174.8	27.3	-32.9	0	0	0	112.4	L459 G474 S475	L459-P472 HydrophobicContact CB-CB 4.17Å; L459-P472 WeakPolarHBondContact O-CB 3.35Å; P472-G474 PolarHBondContact O-N 3.4Å; P472-S475 WeakPolarHBondContact CD-OG 3.4Å; P472-S475 WeakPolarHBondContact O-CB 3.21Å; P472-S475 PolarHBondContact O-N 3.41Å; P472-S475 VanDerWaalsContact O-N 3.1Å; P472-S475 PolarHBondContact O-OG 3.02Å; P472-S475 VanDerWaalsContact O-OG 3.11Å
473	P	98.4	Very high	96.6	Very high	37 Å²	37	69.6 Å²	69.6	24%	0.24	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.5	124.8	-173.4	-27.5	34.9	0	0	0	114	I417 M422 P444 L459 S475	I417-P473 HydrophobicContact CG2-CB 3.67Å; I417-P473 HydrophobicContact CG2-CG 3.63Å; I417-P473 CarbonylContact O-C 3.51Å; I417-P473 WeakPolarHBondContact O-CA 3.02Å; M422-P473 HydrophobicContact CG-CB 3.88Å; M422-P473 HydrophobicContact CG-CG 3.87Å; M422-P473 HydrophobicContact SD-CB 4.41Å; M422-P473 HydrophobicContact SD-CG 3.95Å; P444-P473 HydrophobicContact CG-CG 4.01Å; L459-P473 HydrophobicContact CD1-CG 4.07Å; P473-S475 VanDerWaalsContact C-N 3.26Å; P473-S475 PolarHBondContact O-N 3.22Å
474	G	97.9	Very high	96.5	Very high	41 Å²	41	63.2 Å²	63.2	42%	0.423	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.6	10.4	178.6	0	0	0	0	0	115.6	I417 E418 P472 K476	I417-G474 PolarHBondContact O-N 2.87Å; E418-G474 CarbonylContact O-C 3.42Å; E418-G474 VanDerWaalsContact O-C 3.31Å; E418-G474 WeakPolarHBondContact O-CA 3.39Å; E418-G474 PolarHBondContact O-N 3.13Å; P472-G474 PolarHBondContact O-N 3.4Å; G474-K476 VanDerWaalsContact C-N 3.29Å; G474-K476 PolarHBondContact O-N 3.33Å
475	S	98.1	Very high	96.4	Very high	68 Å²	68	64 Å²	64	48%	0.476	36%	0.361	S	S	.	.			trans	-75.1	-13.6	-176.8	75.9	0	0	0	0	114.6	E418 G471 P472 P473	E418-S475 PolarHBondContact O-N 2.94Å; E418-S475 VanDerWaalsContact O-N 3.15Å; G471-S475 WeakPolarHBondContact CA-OG 3.35Å; P472-S475 WeakPolarHBondContact CD-OG 3.4Å; P472-S475 WeakPolarHBondContact O-CB 3.21Å; P472-S475 PolarHBondContact O-N 3.41Å; P472-S475 VanDerWaalsContact O-N 3.1Å; P472-S475 PolarHBondContact O-OG 3.02Å; P472-S475 VanDerWaalsContact O-OG 3.11Å; P473-S475 VanDerWaalsContact C-N 3.26Å; P473-S475 PolarHBondContact O-N 3.22Å
476	K	97.1	Very high	96.4	Very high	53 Å²	53	61.5 Å²	61.5	23%	0.23	36%	0.362	C	S	.	.	S	Bend	trans	-93.9	109.6	-179.2	178.3	-178.7	175.9	-172.3	0	110.1	L403 E418 L419 G474	L403-K476 PolarHBondContact O-NZ 2.85Å; E418-K476 HydrophobicContact CG-CB 3.57Å; E418-K476 HydrophobicContact CG-CD 3.92Å; E418-K476 HydrophobicContact CG-CG 4.42Å; E418-K476 WeakPolarHBondContact O-CB 3.42Å; E418-K476 PolarHBondContact O-N 3.44Å; L419-K476 HydrophobicContact CD1-CD 4.25Å; L419-K476 HydrophobicContact CD1-CG 4.2Å; G474-K476 VanDerWaalsContact C-N 3.29Å; G474-K476 PolarHBondContact O-N 3.33Å
477	D	95.9	Very high	96.5	Very high	94 Å²	94	53.6 Å²	53.6	50%	0.503	33%	0.333	S	S	.	.			trans	-60.3	147.9	175.9	168.9	-109.4	0	0	0	113.1	S479 A480 A481	D477-S479 VanDerWaalsContact OD1-CA 3.28Å; D477-S479 WeakPolarHBondContact OD1-CA 3.44Å; D477-S479 WeakPolarHBondContact OD1-CB 3.4Å; D477-S479 PolarHBondContact OD1-N 3.28Å; D477-S479 PolarHBondContact OD2-N 2.76Å; D477-A480 HydrophobicContact CB-CB 4.25Å; D477-A480 PolarHBondContact OD1-N 3.38Å; D477-A481 WeakPolarHBondContact O-CB 3.46Å; D477-A481 PolarHBondContact O-N 2.86Å
478	W	97.2	Very high	96.6	Very high	31 Å²	31	56.3 Å²	56.3	12%	0.117	35%	0.345	C	S	.	.	H	α-helix	trans	-74	-34.3	179.9	-80	87.5	0	0	0	113.6	L419 I420 A481 L482 L491 L494 K495 L498	L419-W478 HydrophobicContact CD1-CD2 4.17Å; L419-W478 HydrophobicContact CD1-CE3 4.49Å; L419-W478 HydrophobicContact CD1-CG 4.48Å; L419-W478 HydrophobicContact CD2-CH2 4.31Å; L419-W478 HydrophobicContact CD2-CZ3 4.43Å; L419-W478 HydrophobicContact CG-CZ2 4.28Å; I420-W478 HydrophobicContact CG2-CH2 4.25Å; I420-W478 HydrophobicContact CG2-CZ2 3.6Å; W478-A481 PolarHBondContact O-N 3.26Å; W478-L482 HydrophobicContact CE3-CD1 4.18Å; W478-L482 WeakPolarHBondContact O-CB 3.44Å; W478-L482 VanDerWaalsContact O-CG 3.31Å; W478-L482 WeakPolarHBondContact O-CG 3.37Å; W478-L482 PolarHBondContact O-N 2.99Å; W478-L491 HydrophobicContact CB-CD1 3.72Å; W478-L491 HydrophobicContact CB-CD2 4.48Å; W478-L491 HydrophobicContact CD2-CD1 3.57Å; W478-L491 HydrophobicContact CE3-CD1 3.42Å; W478-L491 VanDerWaalsContact CE3-CD1 3.42Å; W478-L491 HydrophobicContact CG-CD1 3.74Å; W478-L491 HydrophobicContact CZ3-CD1 4.18Å; W478-L494 HydrophobicContact CZ3-CB 4.18Å; W478-L494 HydrophobicContact CZ3-CD1 4.45Å; W478-K495 HydrophobicContact CH2-CG 3.96Å; W478-K495 HydrophobicContact CZ2-CG 3.67Å; W478-L498 HydrophobicContact CH2-CD1 4.02Å; W478-L498 HydrophobicContact CZ3-CD1 4.43Å
479	S	95.1	Very high	96.7	Very high	54 Å²	54	53.9 Å²	53.9	38%	0.378	34%	0.337	S	S	.	.	H	α-helix	trans	-66.4	-44.2	174.3	-169.2	0	0	0	0	110	D477 A481 L482 K483 G484	D477-S479 VanDerWaalsContact OD1-CA 3.28Å; D477-S479 WeakPolarHBondContact OD1-CA 3.44Å; D477-S479 WeakPolarHBondContact OD1-CB 3.4Å; D477-S479 PolarHBondContact OD1-N 3.28Å; D477-S479 PolarHBondContact OD2-N 2.76Å; S479-A481 PolarHBondContact O-N 2.99Å; S479-L482 CarbonylContact O-C 3.52Å; S479-L482 PolarHBondContact O-N 3.33Å; S479-K483 PolarHBondContact O-N 3.16Å; S479-G484 PolarHBondContact O-N 3.27Å; S479-G484 WeakPolarHBondContact OG-CA 3.01Å
480	A	95.6	Very high	96.8	Very high	73 Å²	73	49.8 Å²	49.8	60%	0.603	31%	0.311	S	S	*	.	H	α-helix	trans	-58.4	-44	170.9	0	0	0	0	0	112.4	D477 L482 K483	D477-A480 HydrophobicContact CB-CB 4.25Å; D477-A480 PolarHBondContact OD1-N 3.38Å; A480-L482 VanDerWaalsContact C-N 3.31Å; A480-L482 PolarHBondContact O-N 3.13Å; A480-K483 PolarHBondContact O-N 3.45Å
481	A	97	Very high	96.8	Very high	16 Å²	16	51.2 Å²	51.2	13%	0.132	32%	0.32	C	S	.	.	H	α-helix	trans	-65.6	-29.6	177.1	0	0	0	0	0	113.8	L403 L419 D477 W478 S479	L403-A481 HydrophobicContact CD1-CB 4.02Å; L419-A481 HydrophobicContact CD1-CB 3.76Å; D477-A481 WeakPolarHBondContact O-CB 3.46Å; D477-A481 PolarHBondContact O-N 2.86Å; W478-A481 PolarHBondContact O-N 3.26Å; S479-A481 PolarHBondContact O-N 2.99Å
482	L	97.9	Very high	96.8	Very high	5 Å²	5	53.7 Å²	53.7	3%	0.026	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.2	20.1	-178.3	-58.5	176.7	0	0	0	113.5	A395 T399 L403 W478 S479 A480 G484 C485 L491 L494	A395-L482 HydrophobicContact CB-CD2 3.89Å; T399-L482 HydrophobicContact CG2-CD2 4.49Å; L403-L482 HydrophobicContact CD1-CD2 4.34Å; W478-L482 HydrophobicContact CE3-CD1 4.18Å; W478-L482 WeakPolarHBondContact O-CB 3.44Å; W478-L482 VanDerWaalsContact O-CG 3.31Å; W478-L482 WeakPolarHBondContact O-CG 3.37Å; W478-L482 PolarHBondContact O-N 2.99Å; S479-L482 CarbonylContact O-C 3.52Å; S479-L482 PolarHBondContact O-N 3.33Å; A480-L482 VanDerWaalsContact C-N 3.31Å; A480-L482 PolarHBondContact O-N 3.13Å; L482-G484 PolarHBondContact O-N 2.98Å; L482-C485 HydrophobicContact CB-CB 3.92Å; L482-C485 WeakPolarHBondContact O-CB 3.33Å; L482-C485 PolarHBondContact O-N 3.36Å; L482-L491 HydrophobicContact CD1-CD1 4.09Å; L482-L494 HydrophobicContact CD1-CD1 3.8Å; L482-L494 HydrophobicContact CD2-CD1 3.73Å; L482-L494 HydrophobicContact CG-CD1 4.43Å
483	K	95.8	Very high	96.9	Very high	123 Å²	123	51.8 Å²	51.8	54%	0.535	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.5	43.2	178.3	-63.2	-174.5	173.4	-179.5	0	114.6	T399 S479 A480	T399-K483 HydrophobicContact CG2-CB 4.49Å; T399-K483 HydrophobicContact CG2-CD 4.43Å; T399-K483 HydrophobicContact CG2-CG 4.14Å; T399-K483 VanDerWaalsContact O-CE 3.31Å; T399-K483 WeakPolarHBondContact O-CE 3.2Å; T399-K483 PolarHBondContact O-NZ 2.96Å; S479-K483 PolarHBondContact O-N 3.16Å; A480-K483 PolarHBondContact O-N 3.45Å
484	G	94.1	Very high	96.9	Very high	50 Å²	50	50 Å²	50	52%	0.515	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.1	10.8	177.9	0	0	0	0	0	114.9	S479 L482	S479-G484 PolarHBondContact O-N 3.27Å; S479-G484 WeakPolarHBondContact OG-CA 3.01Å; L482-G484 PolarHBondContact O-N 2.98Å
485	C	94.8	Very high	96.9	Very high	27 Å²	27	52.5 Å²	52.5	18%	0.182	31%	0.306	C	S	.	.			trans	-69.8	129.2	177.7	-177.9	0	0	0	0	112.1	L398 L482	L398-C485 HydrophobicContact CD2-CB 3.78Å; L482-C485 HydrophobicContact CB-CB 3.92Å; L482-C485 WeakPolarHBondContact O-CB 3.33Å; L482-C485 PolarHBondContact O-N 3.36Å
486	D	92.6	Very high	96.9	Very high	142 Å²	142	52.5 Å²	52.5	76%	0.759	30%	0.298	S	S	*	.			trans	-115.5	-7.3	-169.2	65.9	-25.2	0	0	0	115	P488	D486-P488 WeakPolarHBondContact O-CD 3.2Å
487	D	97	Very high	97	Very high	17 Å²	17	50 Å²	50	9%	0.091	29%	0.287	C	S	.	.			trans	-59.8	107.1	177.7	-175	-34.3	0	0	0	110.3	L304 R308 L489 F490 L491 R519	L304-D487 HydrophobicContact CD1-CB 3.59Å; R308-D487 IonicContact NH2-OD2 2.71Å; D487-L489 PolarHBondContact O-N 2.97Å; D487-L489 WeakPolarHBondContact OD1-CB 3.45Å; D487-L489 PolarHBondContact OD1-N 3.35Å; D487-F490 HydrophobicContact CB-CB 4.15Å; D487-F490 PolarHBondContact O-N 3.39Å; D487-F490 VanDerWaalsContact O-N 3.12Å; D487-F490 PolarHBondContact OD1-N 2.89Å; D487-L491 PolarHBondContact O-N 3.09Å; D487-L491 VanDerWaalsContact O-N 3.13Å; D487-R519 IonicContact OD1-NH1 3.33Å; D487-R519 IonicContact OD2-NH1 3.84Å; D487-R519 PolarHBondContact OD2-NH1 3.38Å
488	P	97.3	Very high	97.2	Very high	91 Å²	91	45.7 Å²	45.7	59%	0.591	26%	0.264	S	S	*	.	H	α-helix	trans	-70.7	-24.5	-170.7	29.5	-35.2	0	0	0	111.6	D486 L491 D492	D486-P488 WeakPolarHBondContact O-CD 3.2Å; P488-L491 PolarHBondContact O-N 3.21Å; P488-D492 WeakPolarHBondContact O-CB 3.22Å; P488-D492 PolarHBondContact O-N 3.43Å
489	L	98	Very high	97.2	Very high	54 Å²	54	47.7 Å²	47.7	28%	0.283	28%	0.275	S	S	.	.	H	α-helix	trans	-74.7	-30.2	177.9	-51.8	179.9	0	0	0	111	D487 F493 P515 W516	D487-L489 PolarHBondContact O-N 2.97Å; D487-L489 WeakPolarHBondContact OD1-CB 3.45Å; D487-L489 PolarHBondContact OD1-N 3.35Å; L489-F493 WeakPolarHBondContact O-CB 3.34Å; L489-F493 PolarHBondContact O-N 2.86Å; L489-F493 VanDerWaalsContact O-N 3.09Å; L489-P515 HydrophobicContact CD1-CB 4.35Å; L489-P515 HydrophobicContact CD2-CB 4.28Å; L489-W516 HydrophobicContact CB-CB 3.83Å; L489-W516 HydrophobicContact CB-CG 4.39Å; L489-W516 WeakPolarHBondContact O-CB 3.45Å
490	F	98.4	Very high	97.4	Very high	0 Å²	0	46 Å²	46	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-72.4	-43.1	171.7	-176	-119.8	0	0	0	111.6	L304 V307 L394 L398 D487 D492 F493 L494 W516	L304-F490 HydrophobicContact CD2-CB 4.13Å; L304-F490 HydrophobicContact CD2-CD1 3.76Å; L304-F490 HydrophobicContact CD2-CD2 4.17Å; L304-F490 HydrophobicContact CD2-CE1 4.21Å; L304-F490 HydrophobicContact CD2-CG 3.73Å; V307-F490 HydrophobicContact CG1-CE2 4.3Å; V307-F490 HydrophobicContact CG1-CZ 4.41Å; L394-F490 HydrophobicContact CB-CE2 4.13Å; L394-F490 HydrophobicContact CB-CZ 4.18Å; L398-F490 HydrophobicContact CB-CE1 4.36Å; L398-F490 HydrophobicContact CB-CZ 4.48Å; L398-F490 HydrophobicContact CD2-CD1 3.9Å; L398-F490 HydrophobicContact CD2-CE1 3.38Å; L398-F490 HydrophobicContact CD2-CZ 4.26Å; L398-F490 HydrophobicContact CG-CE1 4.45Å; D487-F490 HydrophobicContact CB-CB 4.15Å; D487-F490 PolarHBondContact O-N 3.39Å; D487-F490 VanDerWaalsContact O-N 3.12Å; D487-F490 PolarHBondContact OD1-N 2.89Å; F490-D492 VanDerWaalsContact C-N 3.35Å; F490-D492 PolarHBondContact O-N 3.05Å; F490-F493 PolarHBondContact O-N 3.34Å; F490-L494 HydrophobicContact CD1-CD1 4.03Å; F490-L494 HydrophobicContact CD1-CG 4.42Å; F490-L494 HydrophobicContact CD2-CG 4.42Å; F490-L494 HydrophobicContact CE1-CD1 3.38Å; F490-L494 HydrophobicContact CE1-CG 3.95Å; F490-L494 HydrophobicContact CE2-CD1 4.31Å; F490-L494 HydrophobicContact CE2-CD2 4.16Å; F490-L494 HydrophobicContact CE2-CG 3.98Å; F490-L494 HydrophobicContact CZ-CD1 3.58Å; F490-L494 HydrophobicContact CZ-CD2 3.94Å; F490-L494 HydrophobicContact CZ-CG 3.73Å; F490-L494 PolarHBondContact O-N 3.4Å; F490-W516 HydrophobicContact CB-CG 4.49Å; F490-W516 AromaticContact CD2-CD2 3.96Å; F490-W516 HydrophobicContact CD2-CD2 3.96Å; F490-W516 AromaticContact CD2-CE2 3.39Å; F490-W516 HydrophobicContact CD2-CE3 4.3Å; F490-W516 AromaticContact CD2-CH2 3.73Å; F490-W516 HydrophobicContact CD2-CH2 3.73Å; F490-W516 AromaticContact CD2-CZ2 3.3Å; F490-W516 HydrophobicContact CD2-CZ2 3.3Å; F490-W516 HydrophobicContact CD2-CZ3 4.19Å; F490-W516 AromaticContact CD2-NE1 3.71Å; F490-W516 AromaticContact CE2-CH2 3.73Å; F490-W516 HydrophobicContact CE2-CH2 3.73Å; F490-W516 AromaticContact CE2-CZ2 3.67Å; F490-W516 HydrophobicContact CE2-CZ2 3.67Å; F490-W516 HydrophobicContact CE2-CZ3 4.32Å; F490-W516 HydrophobicContact CG-CZ2 4.27Å; F490-W516 AromaticContact CG-NE1 3.97Å
491	L	98.4	Very high	97.5	Very high	47 Å²	47	44.5 Å²	44.5	25%	0.246	24%	0.242	C	C	.	.	H	α-helix	trans	-61.6	-43.3	177	179.9	57.7	0	0	0	111.9	W478 L482 D487 P488 L494 K495	W478-L491 HydrophobicContact CB-CD1 3.72Å; W478-L491 HydrophobicContact CB-CD2 4.48Å; W478-L491 HydrophobicContact CD2-CD1 3.57Å; W478-L491 HydrophobicContact CE3-CD1 3.42Å; W478-L491 VanDerWaalsContact CE3-CD1 3.42Å; W478-L491 HydrophobicContact CG-CD1 3.74Å; W478-L491 HydrophobicContact CZ3-CD1 4.18Å; L482-L491 HydrophobicContact CD1-CD1 4.09Å; D487-L491 PolarHBondContact O-N 3.09Å; D487-L491 VanDerWaalsContact O-N 3.13Å; P488-L491 PolarHBondContact O-N 3.21Å; L491-L494 PolarHBondContact O-N 3.3Å; L491-K495 HydrophobicContact CD1-CD 4.44Å; L491-K495 HydrophobicContact CG-CD 4.38Å; L491-K495 WeakPolarHBondContact O-CG 3.46Å; L491-K495 PolarHBondContact O-N 3.09Å
492	D	98.6	Very high	97.6	Very high	64 Å²	64	45 Å²	45	34%	0.342	24%	0.244	S	C	.	.	H	α-helix	trans	-59.9	-48.8	172.9	179.6	34.3	0	0	0	111.9	P488 F490 L494 K495 Q496 H514	P488-D492 WeakPolarHBondContact O-CB 3.22Å; P488-D492 PolarHBondContact O-N 3.43Å; F490-D492 VanDerWaalsContact C-N 3.35Å; F490-D492 PolarHBondContact O-N 3.05Å; D492-L494 VanDerWaalsContact C-N 3.33Å; D492-L494 PolarHBondContact O-N 3.43Å; D492-K495 PolarHBondContact O-N 3.37Å; D492-Q496 WeakPolarHBondContact O-CG 3.37Å; D492-Q496 PolarHBondContact O-N 2.82Å; D492-Q496 PolarHBondContact OD1-NE2 2.88Å; D492-Q496 PolarHBondContact OD2-NE2 3.35Å; D492-H514 IonicContact OD2-CE1 2.71Å; D492-H514 PolarHBondContact OD2-CE1 2.85Å; D492-H514 VanDerWaalsContact OD2-CE1 3.27Å; D492-H514 IonicContact OD2-NE2 3.64Å; D492-H514 PolarHBondContact OD2-NE2 2.95Å; D492-H514 VanDerWaalsContact OD2-NE2 3.16Å
493	F	98.8	Very high	97.6	Very high	0 Å²	0	49 Å²	49	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-57.1	-44.2	175.2	-174.3	-79.9	0	0	0	112.2	L315 L390 L394 L489 F490 Q496 C497 M506 A511 H514 W516 L517	L315-F493 HydrophobicContact CD1-CZ 4.18Å; L390-F493 HydrophobicContact CD2-CZ 4.45Å; L394-F493 HydrophobicContact CD1-CD1 4.12Å; L394-F493 HydrophobicContact CD1-CE1 3.52Å; L394-F493 HydrophobicContact CD1-CZ 4.35Å; L489-F493 WeakPolarHBondContact O-CB 3.34Å; L489-F493 PolarHBondContact O-N 2.86Å; L489-F493 VanDerWaalsContact O-N 3.09Å; F490-F493 PolarHBondContact O-N 3.34Å; F493-Q496 PolarHBondContact O-N 3.5Å; F493-C497 VanDerWaalsContact CE1-SG 3.5Å; F493-C497 PolarHBondContact O-N 3.1Å; F493-C497 PolarHBondContact O-SG 3.23Å; F493-C497 VanDerWaalsContact O-SG 3.41Å; F493-M506 HydrophobicContact CD1-CE 4.28Å; F493-M506 HydrophobicContact CD2-CE 3.71Å; F493-M506 HydrophobicContact CE1-CE 4.23Å; F493-M506 HydrophobicContact CE2-CE 3.71Å; F493-M506 HydrophobicContact CE2-SD 4.49Å; F493-M506 HydrophobicContact CG-CE 4.01Å; F493-M506 HydrophobicContact CZ-CE 3.96Å; F493-A511 HydrophobicContact CE2-CB 3.78Å; F493-A511 HydrophobicContact CZ-CB 3.93Å; F493-H514 HydrophobicContact CD2-CB 3.81Å; F493-H514 AromaticContact CD2-CG 3.67Å; F493-H514 AromaticContact CD2-ND1 3.61Å; F493-H514 HydrophobicContact CE2-CB 4.15Å; F493-W516 HydrophobicContact CB-CB 4.4Å; F493-W516 HydrophobicContact CB-CE3 4.18Å; F493-W516 HydrophobicContact CD1-CE3 4.01Å; F493-W516 HydrophobicContact CD1-CZ3 4.05Å; F493-W516 AromaticContact CD2-CE3 3.7Å; F493-W516 HydrophobicContact CD2-CE3 3.7Å; F493-W516 HydrophobicContact CD2-CZ3 4.36Å; F493-W516 HydrophobicContact CE1-CE3 4.37Å; F493-W516 HydrophobicContact CE1-CZ3 4.11Å; F493-W516 HydrophobicContact CE2-CE3 4.05Å; F493-W516 HydrophobicContact CE2-CZ3 4.38Å; F493-W516 HydrophobicContact CG-CD2 4.49Å; F493-W516 AromaticContact CG-CE3 3.69Å; F493-W516 HydrophobicContact CG-CE3 3.69Å; F493-W516 HydrophobicContact CG-CZ3 4.2Å; F493-W516 HydrophobicContact CZ-CE3 4.38Å; F493-W516 HydrophobicContact CZ-CZ3 4.27Å; F493-L517 HydrophobicContact CE2-CD1 4.15Å; F493-L517 HydrophobicContact CE2-CG 4.23Å
494	L	98.8	Very high	97.7	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-64.7	-43.1	177.5	-77.8	-175.6	0	0	0	112.3	G391 L394 A395 W478 L482 F490 L491 D492 C497 L498	G391-L494 VanDerWaalsContact O-CD2 3.25Å; G391-L494 WeakPolarHBondContact O-CD2 3.38Å; L394-L494 HydrophobicContact CB-CD2 4.17Å; A395-L494 HydrophobicContact CB-CD1 4.12Å; A395-L494 HydrophobicContact CB-CD2 4.43Å; W478-L494 HydrophobicContact CZ3-CB 4.18Å; W478-L494 HydrophobicContact CZ3-CD1 4.45Å; L482-L494 HydrophobicContact CD1-CD1 3.8Å; L482-L494 HydrophobicContact CD2-CD1 3.73Å; L482-L494 HydrophobicContact CG-CD1 4.43Å; F490-L494 HydrophobicContact CD1-CD1 4.03Å; F490-L494 HydrophobicContact CD1-CG 4.42Å; F490-L494 HydrophobicContact CD2-CG 4.42Å; F490-L494 HydrophobicContact CE1-CD1 3.38Å; F490-L494 HydrophobicContact CE1-CG 3.95Å; F490-L494 HydrophobicContact CE2-CD1 4.31Å; F490-L494 HydrophobicContact CE2-CD2 4.16Å; F490-L494 HydrophobicContact CE2-CG 3.98Å; F490-L494 HydrophobicContact CZ-CD1 3.58Å; F490-L494 HydrophobicContact CZ-CD2 3.94Å; F490-L494 HydrophobicContact CZ-CG 3.73Å; F490-L494 PolarHBondContact O-N 3.4Å; L491-L494 PolarHBondContact O-N 3.3Å; D492-L494 VanDerWaalsContact C-N 3.33Å; D492-L494 PolarHBondContact O-N 3.43Å; L494-C497 PolarHBondContact O-N 3.39Å; L494-L498 WeakPolarHBondContact O-CB 3.31Å; L494-L498 WeakPolarHBondContact O-CG 3.37Å; L494-L498 PolarHBondContact O-N 3Å
495	K	98.7	Very high	97.9	Very high	94 Å²	94	47.2 Å²	47.2	41%	0.409	26%	0.261	S	S	.	.	H	α-helix	trans	-61.1	-45.3	176.4	-75.5	175	177.2	-178.1	0	111.4	W478 L491 D492 C497 L498 E499	W478-K495 HydrophobicContact CH2-CG 3.96Å; W478-K495 HydrophobicContact CZ2-CG 3.67Å; L491-K495 HydrophobicContact CD1-CD 4.44Å; L491-K495 HydrophobicContact CG-CD 4.38Å; L491-K495 WeakPolarHBondContact O-CG 3.46Å; L491-K495 PolarHBondContact O-N 3.09Å; D492-K495 PolarHBondContact O-N 3.37Å; K495-C497 VanDerWaalsContact C-N 3.28Å; K495-C497 PolarHBondContact O-N 3.38Å; K495-L498 CarbonylContact O-C 3.58Å; K495-L498 PolarHBondContact O-N 3.43Å; K495-E499 PolarHBondContact O-N 3Å; K495-E499 VanDerWaalsContact O-N 3.11Å
496	Q	98.8	Very high	98.1	Very high	67 Å²	67	46.2 Å²	46.2	31%	0.313	25%	0.254	S	S	.	.	H	α-helix	trans	-65.2	-27.1	176.1	-70.9	178.7	44	0	0	113.8	D492 F493 M506 H514	D492-Q496 WeakPolarHBondContact O-CG 3.37Å; D492-Q496 PolarHBondContact O-N 2.82Å; D492-Q496 PolarHBondContact OD1-NE2 2.88Å; D492-Q496 PolarHBondContact OD2-NE2 3.35Å; F493-Q496 PolarHBondContact O-N 3.5Å; Q496-M506 HydrophobicContact CB-CB 3.95Å; Q496-M506 HydrophobicContact CB-CE 3.8Å; Q496-M506 HydrophobicContact CB-SD 4.17Å; Q496-M506 WeakPolarHBondContact O-CB 3.31Å; Q496-M506 PolarHBondContact O-N 2.82Å; Q496-M506 PolarHBondContact OE1-SD 3.39Å; Q496-H514 PolarHBondContact NE2-NE2 3.15Å
497	C	98.9	Very high	98.4	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-78	-26.8	169.8	-74	0	0	0	0	113.8	I387 F493 L494 K495 R505 M506	I387-C497 HydrophobicContact CG2-CB 4.01Å; F493-C497 VanDerWaalsContact CE1-SG 3.5Å; F493-C497 PolarHBondContact O-N 3.1Å; F493-C497 PolarHBondContact O-SG 3.23Å; F493-C497 VanDerWaalsContact O-SG 3.41Å; L494-C497 PolarHBondContact O-N 3.39Å; K495-C497 VanDerWaalsContact C-N 3.28Å; K495-C497 PolarHBondContact O-N 3.38Å; C497-R505 VanDerWaalsContact O-CD 3.25Å; C497-R505 WeakPolarHBondContact O-CD 3.46Å; C497-R505 WeakPolarHBondContact O-CG 3.34Å; C497-M506 WeakPolarHBondContact SG-CE 3.4Å
498	L	98.8	Very high	98.5	Very high	5 Å²	5	40.9 Å²	40.9	3%	0.026	23%	0.227	C	C	.	.	S	Bend	trans	-109	25.8	-174.2	-62.4	171.9	0	0	0	112.5	W388 L403 I420 W478 L494 K495	W388-L498 HydrophobicContact CD2-CD2 3.7Å; W388-L498 HydrophobicContact CE3-CB 4.39Å; W388-L498 HydrophobicContact CE3-CD2 3.89Å; W388-L498 HydrophobicContact CG-CD2 4.2Å; W388-L498 HydrophobicContact CH2-CB 4.43Å; W388-L498 HydrophobicContact CH2-CD2 4.19Å; W388-L498 HydrophobicContact CZ2-CD2 4.01Å; W388-L498 HydrophobicContact CZ3-CB 4.11Å; W388-L498 HydrophobicContact CZ3-CD2 4.15Å; W388-L498 VanDerWaalsContact CZ3-O 3.27Å; W388-L498 WeakPolarHBondContact CZ3-O 3.17Å; L403-L498 HydrophobicContact CD2-CD1 3.62Å; I420-L498 VanDerWaalsContact CD1-O 3.26Å; I420-L498 WeakPolarHBondContact CD1-O 3.44Å; W478-L498 HydrophobicContact CH2-CD1 4.02Å; W478-L498 HydrophobicContact CZ3-CD1 4.43Å; L494-L498 WeakPolarHBondContact O-CB 3.31Å; L494-L498 WeakPolarHBondContact O-CG 3.37Å; L494-L498 PolarHBondContact O-N 3Å; K495-L498 CarbonylContact O-C 3.58Å; K495-L498 PolarHBondContact O-N 3.43Å
499	E	98.7	Very high	98.5	Very high	73 Å²	73	38.3 Å²	38.3	34%	0.341	21%	0.211	S	C	.	.			trans	-65.2	139.6	172.9	-179.3	48.3	-109.7	0	0	111.1	K495 D501 L504 R505	K495-E499 PolarHBondContact O-N 3Å; K495-E499 VanDerWaalsContact O-N 3.11Å; E499-D501 PolarHBondContact OE1-N 2.86Å; E499-L504 HydrophobicContact CG-CB 3.81Å; E499-R505 HydrophobicContact CB-CB 4.04Å; E499-R505 HydrophobicContact CB-CG 4.2Å; E499-R505 VanDerWaalsContact O-CZ 3.32Å; E499-R505 PolarHBondContact O-NE 3.46Å; E499-R505 PolarHBondContact O-NH2 2.95Å
500	W	98.6	Very high	98.5	Very high	19 Å²	19	40.2 Å²	40.2	7%	0.072	22%	0.218	C	C	.	.	S	Bend	trans	-65.4	-48.3	-179.2	-86.6	112.4	0	0	0	111.9	P373 L377 L413 I416 I417 I420 G421 P423 L427 P502 R505	P373-W500 HydrophobicContact CB-CE3 3.59Å; P373-W500 HydrophobicContact CB-CH2 4.44Å; P373-W500 HydrophobicContact CB-CZ3 3.37Å; P373-W500 HydrophobicContact CG-CE3 3.82Å; P373-W500 HydrophobicContact CG-CZ3 4.1Å; L377-W500 HydrophobicContact CD1-CZ3 4.25Å; L413-W500 HydrophobicContact CD1-CH2 3.81Å; L413-W500 HydrophobicContact CD1-CZ3 3.95Å; I416-W500 HydrophobicContact CB-CH2 4.32Å; I416-W500 HydrophobicContact CG2-CH2 3.47Å; I416-W500 VanDerWaalsContact CG2-CH2 3.47Å; I416-W500 HydrophobicContact CG2-CZ2 3.49Å; I416-W500 VanDerWaalsContact CG2-CZ2 3.49Å; I416-W500 HydrophobicContact CG2-CZ3 4.1Å; I417-W500 HydrophobicContact CG1-CH2 3.78Å; I417-W500 HydrophobicContact CG1-CZ2 3.79Å; I420-W500 HydrophobicContact CD1-CD2 4.03Å; I420-W500 HydrophobicContact CD1-CG 4.08Å; I420-W500 HydrophobicContact CD1-CZ2 4.21Å; I420-W500 HydrophobicContact CG1-CZ2 4.08Å; I420-W500 PolarHBondContact O-NE1 2.85Å; G421-W500 VanDerWaalsContact O-CZ2 3.25Å; G421-W500 WeakPolarHBondContact O-CZ2 3.21Å; G421-W500 PolarHBondContact O-NE1 3.17Å; P423-W500 HydrophobicContact CB-CD2 3.72Å; P423-W500 HydrophobicContact CB-CE3 3.67Å; P423-W500 HydrophobicContact CB-CG 4.24Å; P423-W500 HydrophobicContact CB-CH2 4.26Å; P423-W500 HydrophobicContact CB-CZ2 4.32Å; P423-W500 HydrophobicContact CB-CZ3 3.92Å; P423-W500 HydrophobicContact CG-CE3 4.34Å; P423-W500 HydrophobicContact CG-CH2 4.08Å; P423-W500 HydrophobicContact CG-CZ2 4.3Å; P423-W500 HydrophobicContact CG-CZ3 4.08Å; L427-W500 HydrophobicContact CD2-CB 3.93Å; L427-W500 HydrophobicContact CD2-CE3 4.2Å; L427-W500 WeakPolarHBondContact CD2-O 3.45Å; W500-P502 WeakPolarHBondContact O-CD 3.2Å; W500-R505 PolarHBondContact O-NH2 2.81Å
501	D	98.3	Very high	98.5	Very high	41 Å²	41	40.2 Å²	40.2	22%	0.219	22%	0.218	C	C	.	.	S	Bend	trans	-80.9	115.1	179.7	-167.6	-33.4	0	0	0	110.3	E499 A503 L504 R505	E499-D501 PolarHBondContact OE1-N 2.86Å; D501-A503 PolarHBondContact O-N 2.66Å; D501-A503 VanDerWaalsContact O-N 3.1Å; D501-A503 WeakPolarHBondContact OD1-CB 3.41Å; D501-A503 PolarHBondContact OD1-N 3.33Å; D501-L504 HydrophobicContact CB-CB 4.24Å; D501-L504 HydrophobicContact CB-CD1 4.05Å; D501-L504 HydrophobicContact CB-CG 4.02Å; D501-L504 PolarHBondContact O-N 3.41Å; D501-R505 PolarHBondContact O-N 2.94Å
502	P	98.3	Very high	98.5	Very high	26 Å²	26	39.7 Å²	39.7	17%	0.169	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-14.6	179.9	27.2	-35	0	0	0	113.9	E374 P384 W500	E374-P502 HydrophobicContact CG-CG 4.41Å; P384-P502 HydrophobicContact CB-CB 3.78Å; P384-P502 WeakPolarHBondContact CB-O 3.37Å; P384-P502 HydrophobicContact CG-CB 4.14Å; P384-P502 WeakPolarHBondContact CG-O 3.47Å; W500-P502 WeakPolarHBondContact O-CD 3.2Å
503	A	97.6	Very high	98.4	Very high	89 Å²	89	44.3 Å²	44.3	74%	0.736	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.6	-19.6	172.6	0	0	0	0	0	113.5	D501	D501-A503 PolarHBondContact O-N 2.66Å; D501-A503 VanDerWaalsContact O-N 3.1Å; D501-A503 WeakPolarHBondContact OD1-CB 3.41Å; D501-A503 PolarHBondContact OD1-N 3.33Å
504	L	98.1	Very high	98.4	Very high	129 Å²	129	44.9 Å²	44.9	68%	0.675	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.1	-24.3	174.6	-60	-178.7	0	0	0	112.4	E499 D501	E499-L504 HydrophobicContact CG-CB 3.81Å; D501-L504 HydrophobicContact CB-CB 4.24Å; D501-L504 HydrophobicContact CB-CD1 4.05Å; D501-L504 HydrophobicContact CB-CG 4.02Å; D501-L504 PolarHBondContact O-N 3.41Å
505	R	98.6	Very high	98.3	Very high	7 Å²	7	48.2 Å²	48.2	3%	0.026	25%	0.253	C	S	.	.	S	Bend	trans	-58.2	135.9	178.4	-162.3	-177.3	-62.3	147.3	6.9	112.4	E374 P384 I387 C497 E499 W500 D501 T507	E374-R505 IonicContact OE1-CZ 2.77Å; E374-R505 IonicContact OE1-NH1 2.9Å; E374-R505 PolarHBondContact OE1-NH1 2.74Å; E374-R505 IonicContact OE1-NH2 2.8Å; E374-R505 IonicContact OE2-CZ 2.73Å; E374-R505 IonicContact OE2-NH1 3.74Å; E374-R505 PolarHBondContact OE2-NH1 3.25Å; E374-R505 IonicContact OE2-NH2 3.32Å; E374-R505 PolarHBondContact OE2-NH2 3.37Å; P384-R505 WeakPolarHBondContact O-CD 3.34Å; P384-R505 PolarHBondContact O-NH1 3.36Å; I387-R505 HydrophobicContact CG2-CG 3.88Å; C497-R505 VanDerWaalsContact O-CD 3.25Å; C497-R505 WeakPolarHBondContact O-CD 3.46Å; C497-R505 WeakPolarHBondContact O-CG 3.34Å; E499-R505 HydrophobicContact CB-CB 4.04Å; E499-R505 HydrophobicContact CB-CG 4.2Å; E499-R505 VanDerWaalsContact O-CZ 3.32Å; E499-R505 PolarHBondContact O-NE 3.46Å; E499-R505 PolarHBondContact O-NH2 2.95Å; W500-R505 PolarHBondContact O-NH2 2.81Å; D501-R505 PolarHBondContact O-N 2.94Å; R505-T507 PolarHBondContact O-N 3.21Å
506	M	98.6	Very high	98.3	Very high	6 Å²	6	43.8 Å²	43.8	3%	0.03	23%	0.233	C	C	.	.	P	Polyproline II helix	trans	-62.1	125.9	-171.8	172.1	171.6	57.9	0	0	113.9	I387 F493 Q496 C497 Q510 A511	I387-M506 WeakPolarHBondContact CG1-O 3.16Å; I387-M506 WeakPolarHBondContact CG2-O 3.4Å; F493-M506 HydrophobicContact CD1-CE 4.28Å; F493-M506 HydrophobicContact CD2-CE 3.71Å; F493-M506 HydrophobicContact CE1-CE 4.23Å; F493-M506 HydrophobicContact CE2-CE 3.71Å; F493-M506 HydrophobicContact CE2-SD 4.49Å; F493-M506 HydrophobicContact CG-CE 4.01Å; F493-M506 HydrophobicContact CZ-CE 3.96Å; Q496-M506 HydrophobicContact CB-CB 3.95Å; Q496-M506 HydrophobicContact CB-CE 3.8Å; Q496-M506 HydrophobicContact CB-SD 4.17Å; Q496-M506 WeakPolarHBondContact O-CB 3.31Å; Q496-M506 PolarHBondContact O-N 2.82Å; Q496-M506 PolarHBondContact OE1-SD 3.39Å; C497-M506 WeakPolarHBondContact SG-CE 3.4Å; M506-Q510 HydrophobicContact CG-CB 3.73Å; M506-A511 HydrophobicContact CE-CB 3.96Å; M506-A511 HydrophobicContact CG-CB 4Å; M506-A511 WeakPolarHBondContact SD-CA 3.3Å; M506-A511 HydrophobicContact SD-CB 3.8Å
507	T	98.9	Very high	98.1	Very high	41 Å²	41	41.8 Å²	41.8	25%	0.252	23%	0.225	S	C	.	.	P	Polyproline II helix	trans	-72	158.9	174.8	62.6	0	0	0	0	112.6	R505 S509 Q510 A511	R505-T507 PolarHBondContact O-N 3.21Å; T507-S509 VanDerWaalsContact C-N 3.25Å; T507-S509 PolarHBondContact O-N 2.9Å; T507-Q510 WeakPolarHBondContact O-CB 3.47Å; T507-Q510 PolarHBondContact O-N 3.02Å; T507-Q510 WeakPolarHBondContact OG1-CG 3.46Å; T507-Q510 PolarHBondContact OG1-N 3.04Å; T507-Q510 PolarHBondContact OG1-OE1 2.94Å; T507-A511 PolarHBondContact O-N 3.08Å
508	P	98.7	Very high	97.5	Very high	6 Å²	6	50.6 Å²	50.6	4%	0.039	26%	0.258	C	S	.	.	H	α-helix	trans	-54.9	-39.7	177.1	-25.3	33.1	0	0	0	113.5	L315 L318 D319 H322 I387 Q510 A511 L512	L315-P508 HydrophobicContact CD2-CB 4.05Å; L318-P508 HydrophobicContact CB-CB 4.14Å; L318-P508 HydrophobicContact CB-CG 3.87Å; D319-P508 HydrophobicContact CB-CB 3.87Å; H322-P508 HydrophobicContact CB-CG 4.04Å; I387-P508 HydrophobicContact CD1-CG 3.99Å; I387-P508 HydrophobicContact CG1-CG 4.37Å; P508-Q510 VanDerWaalsContact C-N 3.31Å; P508-Q510 PolarHBondContact O-N 3.3Å; P508-A511 WeakPolarHBondContact O-CB 3.33Å; P508-A511 PolarHBondContact O-N 3.49Å; P508-L512 WeakPolarHBondContact O-CG 3.19Å; P508-L512 PolarHBondContact O-N 3.21Å
509	S	98.1	Very high	96.3	Very high	36 Å²	36	57 Å²	57	25%	0.252	28%	0.282	S	S	.	.	H	α-helix	trans	-72.3	-22.3	179.3	-33.8	0	0	0	0	112.9	D319 T507 R513	D319-S509 WeakPolarHBondContact OD1-CA 3.39Å; D319-S509 WeakPolarHBondContact OD1-CB 3.38Å; D319-S509 PolarHBondContact OD1-N 3.05Å; D319-S509 PolarHBondContact OD1-OG 3.42Å; T507-S509 VanDerWaalsContact C-N 3.25Å; T507-S509 PolarHBondContact O-N 2.9Å; S509-R513 PolarHBondContact O-NE 3.49Å; S509-R513 PolarHBondContact O-NH2 2.79Å
510	Q	98.4	Very high	94.3	Very high	94 Å²	94	64.7 Å²	64.7	44%	0.439	31%	0.308	S	S	.	.	H	α-helix	trans	-78.4	-45.3	167.3	-76	161.3	-53.8	0	0	110.3	M506 T507 P508 L512 R513 H514	M506-Q510 HydrophobicContact CG-CB 3.73Å; T507-Q510 WeakPolarHBondContact O-CB 3.47Å; T507-Q510 PolarHBondContact O-N 3.02Å; T507-Q510 WeakPolarHBondContact OG1-CG 3.46Å; T507-Q510 PolarHBondContact OG1-N 3.04Å; T507-Q510 PolarHBondContact OG1-OE1 2.94Å; P508-Q510 VanDerWaalsContact C-N 3.31Å; P508-Q510 PolarHBondContact O-N 3.3Å; Q510-L512 PolarHBondContact O-N 2.93Å; Q510-R513 CarbonylContact O-C 3.55Å; Q510-R513 WeakPolarHBondContact O-CA 3.13Å; Q510-R513 WeakPolarHBondContact O-CB 3.28Å; Q510-R513 PolarHBondContact O-N 3.25Å; Q510-H514 PolarHBondContact O-N 3.27Å; Q510-H514 VanDerWaalsContact O-N 3.09Å
511	A	98.5	Very high	92.3	Very high	0 Å²	0	69.3 Å²	69.3	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-56.4	-45	178.4	0	0	0	0	0	112.8	L315 F493 M506 T507 P508 R513 H514 L517	L315-A511 HydrophobicContact CD1-CB 3.74Å; L315-A511 HydrophobicContact CD2-CB 3.68Å; L315-A511 HydrophobicContact CG-CB 4.39Å; F493-A511 HydrophobicContact CE2-CB 3.78Å; F493-A511 HydrophobicContact CZ-CB 3.93Å; M506-A511 HydrophobicContact CE-CB 3.96Å; M506-A511 HydrophobicContact CG-CB 4Å; M506-A511 WeakPolarHBondContact SD-CA 3.3Å; M506-A511 HydrophobicContact SD-CB 3.8Å; T507-A511 PolarHBondContact O-N 3.08Å; P508-A511 WeakPolarHBondContact O-CB 3.33Å; P508-A511 PolarHBondContact O-N 3.49Å; A511-R513 PolarHBondContact O-N 3.01Å; A511-R513 VanDerWaalsContact O-N 3.16Å; A511-H514 WeakPolarHBondContact O-CB 3.32Å; A511-H514 PolarHBondContact O-N 3.12Å; A511-L517 WeakPolarHBondContact O-CD1 3.46Å
512	L	97.6	Very high	89.9	Confident	37 Å²	37	73.1 Å²	73.1	19%	0.194	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-21.9	173.9	-74.6	170.9	0	0	0	113.9	L315 D319 P508 Q510	L315-L512 HydrophobicContact CB-CD1 4.47Å; L315-L512 HydrophobicContact CB-CD2 3.64Å; L315-L512 HydrophobicContact CB-CG 3.9Å; L315-L512 HydrophobicContact CD1-CD2 4.14Å; L315-L512 HydrophobicContact CD1-CG 4.3Å; D319-L512 HydrophobicContact CB-CD1 3.92Å; P508-L512 WeakPolarHBondContact O-CG 3.19Å; P508-L512 PolarHBondContact O-N 3.21Å; Q510-L512 PolarHBondContact O-N 2.93Å
513	R	97.3	Very high	87	Confident	161 Å²	161	81 Å²	81	61%	0.608	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.2	-3.1	175.8	-70.4	179.7	-72.2	170.6	-0.2	113.4	S509 Q510 A511 R518	S509-R513 PolarHBondContact O-NE 3.49Å; S509-R513 PolarHBondContact O-NH2 2.79Å; Q510-R513 CarbonylContact O-C 3.55Å; Q510-R513 WeakPolarHBondContact O-CA 3.13Å; Q510-R513 WeakPolarHBondContact O-CB 3.28Å; Q510-R513 PolarHBondContact O-N 3.25Å; A511-R513 PolarHBondContact O-N 3.01Å; A511-R513 VanDerWaalsContact O-N 3.16Å; R513-R518 WeakPolarHBondContact O-CD 3.42Å
514	H	98.3	Very high	84.4	Confident	11 Å²	11	81.9 Å²	81.9	5%	0.051	39%	0.39	C	S	.	.	S	Bend	trans	-63.1	142	-176.9	-161.2	-98.8	0	0	0	112.2	D492 F493 Q496 Q510 A511 W516 L517 R518	D492-H514 IonicContact OD2-CE1 2.71Å; D492-H514 PolarHBondContact OD2-CE1 2.85Å; D492-H514 VanDerWaalsContact OD2-CE1 3.27Å; D492-H514 IonicContact OD2-NE2 3.64Å; D492-H514 PolarHBondContact OD2-NE2 2.95Å; D492-H514 VanDerWaalsContact OD2-NE2 3.16Å; F493-H514 HydrophobicContact CD2-CB 3.81Å; F493-H514 AromaticContact CD2-CG 3.67Å; F493-H514 AromaticContact CD2-ND1 3.61Å; F493-H514 HydrophobicContact CE2-CB 4.15Å; Q496-H514 PolarHBondContact NE2-NE2 3.15Å; Q510-H514 PolarHBondContact O-N 3.27Å; Q510-H514 VanDerWaalsContact O-N 3.09Å; A511-H514 WeakPolarHBondContact O-CB 3.32Å; A511-H514 PolarHBondContact O-N 3.12Å; H514-W516 PolarHBondContact ND1-N 2.86Å; H514-W516 PolarHBondContact O-N 3.13Å; H514-W516 VanDerWaalsContact O-N 3.13Å; H514-L517 PolarHBondContact O-N 3.44Å; H514-R518 PolarHBondContact O-N 3.43Å
515	P	97.3	Very high	82.3	Confident	71 Å²	71	81.9 Å²	81.9	46%	0.461	40%	0.398	S	S	.	.	H	α-helix	trans	-52	-37.5	179.6	-30.1	36.7	0	0	0	114.2	L489 L517 R518 R519	L489-P515 HydrophobicContact CD1-CB 4.35Å; L489-P515 HydrophobicContact CD2-CB 4.28Å; P515-L517 VanDerWaalsContact C-N 3.3Å; P515-L517 PolarHBondContact O-N 3.48Å; P515-R518 PolarHBondContact O-N 3.33Å; P515-R519 PolarHBondContact O-N 2.9Å
516	W	97.6	Very high	80	Confident	0 Å²	0	87 Å²	87	0%	0	44%	0.435	C	S	.	.	H	α-helix	trans	-58.3	-36.4	176.8	-178	69.9	0	0	0	114	L304 V307 R308 A311 L394 L489 F490 F493 H514	L304-W516 HydrophobicContact CD2-CZ2 4.49Å; V307-W516 HydrophobicContact CG1-CH2 4.25Å; V307-W516 HydrophobicContact CG1-CZ2 4.46Å; R308-W516 HydrophobicContact CB-CH2 4.19Å; R308-W516 HydrophobicContact CB-CZ2 3.87Å; R308-W516 WeakPolarHBondContact CD-O 3.14Å; R308-W516 HydrophobicContact CG-CZ2 4.44Å; R308-W516 PolarHBondContact NE-O 3.26Å; R308-W516 VanDerWaalsContact NH2-CD1 3.26Å; A311-W516 HydrophobicContact CB-CH2 3.73Å; A311-W516 HydrophobicContact CB-CZ3 3.59Å; L394-W516 HydrophobicContact CD1-CH2 4.16Å; L394-W516 HydrophobicContact CD1-CZ3 4Å; L489-W516 HydrophobicContact CB-CB 3.83Å; L489-W516 HydrophobicContact CB-CG 4.39Å; L489-W516 WeakPolarHBondContact O-CB 3.45Å; F490-W516 HydrophobicContact CB-CG 4.49Å; F490-W516 AromaticContact CD2-CD2 3.96Å; F490-W516 HydrophobicContact CD2-CD2 3.96Å; F490-W516 AromaticContact CD2-CE2 3.39Å; F490-W516 HydrophobicContact CD2-CE3 4.3Å; F490-W516 AromaticContact CD2-CH2 3.73Å; F490-W516 HydrophobicContact CD2-CH2 3.73Å; F490-W516 AromaticContact CD2-CZ2 3.3Å; F490-W516 HydrophobicContact CD2-CZ2 3.3Å; F490-W516 HydrophobicContact CD2-CZ3 4.19Å; F490-W516 AromaticContact CD2-NE1 3.71Å; F490-W516 AromaticContact CE2-CH2 3.73Å; F490-W516 HydrophobicContact CE2-CH2 3.73Å; F490-W516 AromaticContact CE2-CZ2 3.67Å; F490-W516 HydrophobicContact CE2-CZ2 3.67Å; F490-W516 HydrophobicContact CE2-CZ3 4.32Å; F490-W516 HydrophobicContact CG-CZ2 4.27Å; F490-W516 AromaticContact CG-NE1 3.97Å; F493-W516 HydrophobicContact CB-CB 4.4Å; F493-W516 HydrophobicContact CB-CE3 4.18Å; F493-W516 HydrophobicContact CD1-CE3 4.01Å; F493-W516 HydrophobicContact CD1-CZ3 4.05Å; F493-W516 AromaticContact CD2-CE3 3.7Å; F493-W516 HydrophobicContact CD2-CE3 3.7Å; F493-W516 HydrophobicContact CD2-CZ3 4.36Å; F493-W516 HydrophobicContact CE1-CE3 4.37Å; F493-W516 HydrophobicContact CE1-CZ3 4.11Å; F493-W516 HydrophobicContact CE2-CE3 4.05Å; F493-W516 HydrophobicContact CE2-CZ3 4.38Å; F493-W516 HydrophobicContact CG-CD2 4.49Å; F493-W516 AromaticContact CG-CE3 3.69Å; F493-W516 HydrophobicContact CG-CE3 3.69Å; F493-W516 HydrophobicContact CG-CZ3 4.2Å; F493-W516 HydrophobicContact CZ-CE3 4.38Å; F493-W516 HydrophobicContact CZ-CZ3 4.27Å; H514-W516 PolarHBondContact ND1-N 2.86Å; H514-W516 PolarHBondContact O-N 3.13Å; H514-W516 VanDerWaalsContact O-N 3.13Å
517	L	95	Very high	77.3	Confident	25 Å²	25	89.8 Å²	89.8	13%	0.131	47%	0.465	C	S	.	.	H	α-helix	trans	-88.1	-32.6	176.4	-64.1	-168.4	0	0	0	112.5	R308 A311 L315 F493 A511 H514 P515 R519	R308-L517 HydrophobicContact CG-CD2 3.75Å; A311-L517 HydrophobicContact CB-CD2 4.19Å; L315-L517 HydrophobicContact CD1-CD1 3.4Å; F493-L517 HydrophobicContact CE2-CD1 4.15Å; F493-L517 HydrophobicContact CE2-CG 4.23Å; A511-L517 WeakPolarHBondContact O-CD1 3.46Å; H514-L517 PolarHBondContact O-N 3.44Å; P515-L517 VanDerWaalsContact C-N 3.3Å; P515-L517 PolarHBondContact O-N 3.48Å; L517-R519 PolarHBondContact O-N 2.82Å
518	R	86.3	Confident	74.8	Confident	185 Å²	185	94.9 Å²	94.9	70%	0.698	50%	0.497	S	S	*	.	H	α-helix	trans	-73.3	-11.4	177.5	-68.1	-171.4	72	-169.5	4.1	114.1	R513 H514 P515 R520	R513-R518 WeakPolarHBondContact O-CD 3.42Å; H514-R518 PolarHBondContact O-N 3.43Å; P515-R518 PolarHBondContact O-N 3.33Å; R518-R520 PolarHBondContact O-N 3.28Å
519	R	73.1	Confident	72.1	Confident	141 Å²	141	100.9 Å²	100.9	53%	0.532	53%	0.533	S	S	.	.	S	Bend	trans	-57.3	101.2	175.5	-161.6	172.6	-165.7	165.5	6.1	109.7	D487 P515 L517 L521	D487-R519 IonicContact OD1-NH1 3.33Å; D487-R519 IonicContact OD2-NH1 3.84Å; D487-R519 PolarHBondContact OD2-NH1 3.38Å; P515-R519 PolarHBondContact O-N 2.9Å; L517-R519 PolarHBondContact O-N 2.82Å; R519-L521 PolarHBondContact O-N 3.03Å
520	R	58	Low	69.5	Low	233 Å²	233	102.7 Å²	102.7	88%	0.879	56%	0.558	S	S	*	*	P	Polyproline II helix	trans	-50.5	128	-177.5	-72.5	-178.8	174.3	173.3	-1.3	109.7	R518	R518-R520 PolarHBondContact O-N 3.28Å
521	L	55.8	Low	66.5	Low	116 Å²	116	107.5 Å²	107.5	61%	0.607	58%	0.58	S	S	*	*	P	Polyproline II helix	trans	-56.3	137.5	163.3	-69.4	169.8	0	0	0	107.9	R519 K523	R519-L521 PolarHBondContact O-N 3.03Å; L521-K523 PolarHBondContact O-N 3.33Å
522	P	47.2	Very low	63.6	Low	122 Å²	122	117.3 Å²	117.3	79%	0.792	62%	0.623	S	S	*	*	P	Polyproline II helix	trans	-52.7	131.7	174.4	-26.3	34.9	0	0	0	110.1
523	K	39.1	Very low	60.9	Low	190 Å²	190	122.4 Å²	122.4	83%	0.826	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-60.4	141.5	167.7	-71.6	-173.8	175.9	-174.8	0	107.8	L521	L521-K523 PolarHBondContact O-N 3.33Å
524	P	42.3	Very low	57.9	Low	109 Å²	109	118.9 Å²	118.9	71%	0.708	66%	0.66	S	S	*	*	P	Polyproline II helix	trans	-56.7	148	163.2	28.3	-34.3	0	0	0	108.6	S526	P524-S526 PolarHBondContact O-N 3.11Å
525	P	53.5	Low	55.1	Low	129 Å²	129	124.3 Å²	124.3	84%	0.838	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-58.4	118.1	179.2	24.3	-33.2	0	0	0	109.4	G527	P525-G527 PolarHBondContact O-N 3.06Å; P525-G527 VanDerWaalsContact O-N 3.11Å
526	S	51.3	Low	52	Low	113 Å²	113	127.3 Å²	127.3	79%	0.79	71%	0.714	S	S	*	*			trans	-66.2	108.6	171.5	46.2	0	0	0	0	108	P524 T528	P524-S526 PolarHBondContact O-N 3.11Å; S526-T528 PolarHBondContact O-N 3.34Å
527	G	41.7	Very low	49	Very low	65 Å²	65	137.3 Å²	137.3	67%	0.67	76%	0.757	S	S	*	*			trans	-56	132.4	179.3	0	0	0	0	0	111	P525 T529	P525-G527 PolarHBondContact O-N 3.06Å; P525-G527 VanDerWaalsContact O-N 3.11Å; G527-T529 PolarHBondContact O-N 3.34Å
528	T	46.3	Very low	45.9	Very low	149 Å²	149	147.1 Å²	147.1	91%	0.914	79%	0.792	S	S	*	*			trans	-71.4	87.6	178.6	46.4	0	0	0	0	110.5	S526	S526-T528 PolarHBondContact O-N 3.34Å
529	T	40.5	Very low	43.3	Very low	132 Å²	132	145.2 Å²	145.2	81%	0.81	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-92	124.4	161	47.9	0	0	0	0	108.8	G527	G527-T529 PolarHBondContact O-N 3.34Å
530	G	44.7	Very low	41.4	Very low	74 Å²	74	144.3 Å²	144.3	76%	0.763	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-66.5	139.3	-158.5	0	0	0	0	0	115.7	K532	G530-K532 PolarHBondContact O-N 2.94Å
531	E	35.8	Very low	40.2	Very low	195 Å²	195	138 Å²	138	91%	0.911	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-69	117.1	167.8	-65.7	-176	132	0	0	109.8
532	K	36.9	Very low	39	Very low	206 Å²	206	140.1 Å²	140.1	90%	0.896	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-77.4	126.8	164.4	-78.6	-172.4	173.9	-176.3	0	108.8	G530	G530-K532 PolarHBondContact O-N 2.94Å
533	V	40.5	Very low	38.2	Very low	143 Å²	143	137.7 Å²	137.7	87%	0.867	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-59.4	135.3	178	178.3	0	0	0	0	111.2
534	A	34.4	Very low	37.7	Very low	87 Å²	87	136.6 Å²	136.6	72%	0.719	82%	0.816	S	S	*	*			trans	-113.7	140.1	162.2	0	0	0	0	0	109.1
535	P	39.8	Very low	37.2	Very low	125 Å²	125	135.9 Å²	135.9	81%	0.812	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-81.8	144.2	-164.8	31.2	-35.9	0	0	0	114.2
536	T	33	Very low	36.3	Very low	134 Å²	134	134.9 Å²	134.9	82%	0.822	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-70.6	136.3	171.2	35.9	0	0	0	0	112.2
537	K	33.2	Very low	35.6	Very low	210 Å²	210	137.7 Å²	137.7	91%	0.913	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-81.9	138.5	157.8	-79.1	-171	174.2	-176.5	0	109.4
538	R	30.6	Very low	35.1	Very low	231 Å²	231	139.6 Å²	139.6	87%	0.872	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-88.2	144.2	177	-65	176.2	176.2	170.4	-3.3	111.2
539	T	31.2	Very low	34.2	Very low	146 Å²	146	137.6 Å²	137.6	90%	0.896	81%	0.809	S	S	*	*			trans	-134.2	153.6	149.5	21.3	0	0	0	0	107.6
540	V	33.2	Very low	33.9	Very low	122 Å²	122	138.2 Å²	138.2	74%	0.739	81%	0.806	S	S	*	*			trans	-139.9	161.3	-162.4	179.4	0	0	0	0	109.4
541	S	32.6	Very low	33.3	Very low	101 Å²	101	139.4 Å²	139.4	71%	0.706	80%	0.802	S	S	*	*			trans	70.6	139.5	177.6	72.9	0	0	0	0	115
542	N	30.9	Very low	33.2	Very low	159 Å²	159	139.1 Å²	139.1	85%	0.85	80%	0.798	S	S	*	*			cis	-136.3	164.6	-17.1	-81.2	-28.8	0	0	0	106.2
543	G	29.8	Very low	32.9	Very low	71 Å²	71	136.7 Å²	136.7	73%	0.732	79%	0.794	S	S	*	*			cis	113.3	88	12.5	0	0	0	0	0	110.8
544	D	29.9	Very low	32.4	Very low	168 Å²	168	134.1 Å²	134.1	90%	0.898	79%	0.788	S	S	*	*			trans	-158.2	177.7	158.2	-139.4	-31.3	0	0	0	112.6
545	A	32	Very low	32.2	Very low	93 Å²	93	134.6 Å²	134.6	77%	0.769	79%	0.785	S	S	*	*			trans	-84.8	164.8	-147.5	0	0	0	0	0	119.3
546	S	33.9	Very low	31.7	Very low	108 Å²	108	135.8 Å²	135.8	76%	0.755	79%	0.791	S	S	*	*			trans	-90.7	152.3	176.8	55.9	0	0	0	0	114.3
547	I	35.8	Very low	31.6	Very low	172 Å²	172	134.8 Å²	134.8	88%	0.882	79%	0.789	S	S	*	*			trans	-132.8	137.5	156.8	-68.9	-174.7	0	0	0	110.4
548	T	31.5	Very low	31.5	Very low	105 Å²	105	131.4 Å²	131.4	64%	0.644	79%	0.787	S	S	*	*			trans	-86.2	162.2	177.5	46.6	0	0	0	0	112.2
549	C	28.6	Very low	31.6	Very low	108 Å²	108	124.5 Å²	124.5	73%	0.73	78%	0.778	S	S	*	*				-174.2	150.5	83.5	-79.1	0	0	0	0	108.5
550	I	33	Very low	31.6	Very low	145 Å²	145	123.7 Å²	123.7	74%	0.744	77%	0.774	S	S	*	*			cis	66.3	118.3	49.5	-56.6	173	0	0	0	110.8
551	S	33.2	Very low	31.5	Very low	98 Å²	98	124.3 Å²	124.3	69%	0.685	78%	0.778	S	S	*	*			cis	-151.7	-151.1	-3.8	49.5	0	0	0	0	108.5
552	K	32.5	Very low	31.5	Very low	190 Å²	190	124.6 Å²	124.6	83%	0.826	78%	0.78	S	S	*	*			cis	-161.2	-154.1	13.8	-145.2	170.7	-174.7	177.6	0	111.2
553	L	30.9	Very low	31.5	Very low	155 Å²	155	124.1 Å²	124.1	81%	0.812	78%	0.783	S	S	*	*			trans	-99.4	176.8	177	-86.3	59.2	0	0	0	110.1
554	A	30.5	Very low	31.8	Very low	89 Å²	89	130.6 Å²	130.6	74%	0.736	79%	0.791	S	S	*	*			cis	-154.5	158.4	33.7	0	0	0	0	0	110.7
555	S	30.3	Very low	31.8	Very low	96 Å²	96	129.4 Å²	129.4	67%	0.671	79%	0.79	S	S	*	*			cis	93.4	111.7	19.8	85.4	0	0	0	0	116.9
556	T	29.6	Very low	31.7	Very low	150 Å²	150	136.3 Å²	136.3	92%	0.92	80%	0.796	S	S	*	*			trans	-145.6	154.4	164.9	14.9	0	0	0	0	108.5
557	S	31.5	Very low	31.5	Very low	114 Å²	114	137.3 Å²	137.3	80%	0.797	80%	0.798	S	S	*	*			trans	-156.3	129.8	-157.6	56.9	0	0	0	0	116.5
558	T	29.3	Very low	31.2	Very low	139 Å²	139	136.3 Å²	136.3	85%	0.853	80%	0.795	S	S	*	*			trans	-139.6	123.7	157.1	41.8	0	0	0	0	107.6
559	A	33.5	Very low	31.3	Very low	85 Å²	85	139.6 Å²	139.6	70%	0.702	81%	0.807	S	S	*	*			cis	68.5	127.9	38.3	0	0	0	0	0	112.6
560	T	31.6	Very low	31.5	Very low	129 Å²	129	138.8 Å²	138.8	79%	0.791	81%	0.809	S	S	*	*			cis	-150.7	-167.7	-5.3	-3.1	0	0	0	0	107.9
561	T	30.3	Very low	31.5	Very low	135 Å²	135	136.3 Å²	136.3	83%	0.828	81%	0.809	S	S	*	*			cis	-152.9	-162.2	19.1	-28.4	0	0	0	0	109.2
562	S	33.5	Very low	31.7	Very low	108 Å²	108	140 Å²	140	76%	0.755	82%	0.819	S	S	*	*			trans	-145.6	145.8	172.6	63.7	0	0	0	0	113.4
563	T	29.5	Very low	32	Very low	149 Å²	149	137 Å²	137	91%	0.914	82%	0.817	S	S	*	*			trans	-146.3	156.9	170.6	42.3	0	0	0	0	111.9
564	K	37.8	Very low	33.1	Very low	206 Å²	206	134.9 Å²	134.9	90%	0.896	81%	0.807	S	S	*	*			trans	-109	145.8	177.7	-63.2	172.1	179.5	171.2	0	110.4
565	T	28.3	Very low	33.9	Very low	144 Å²	144	135.7 Å²	135.7	88%	0.883	81%	0.814	S	S	*	*			trans	-141.1	139	160.7	38.8	0	0	0	0	112.3
566	R	30.3	Very low	34.9	Very low	237 Å²	237	138 Å²	138	89%	0.894	82%	0.819	S	S	*	*			trans	-85	162.7	151.3	-80.7	171.1	153	169.5	-9.3	107.8
567	T	29.5	Very low	35.9	Very low	130 Å²	130	133.8 Å²	133.8	80%	0.798	81%	0.805	S	S	*	*				177.3	160.1	117.5	-73.4	0	0	0	0	112
568	N	30.3	Very low	36.4	Very low	151 Å²	151	134.7 Å²	134.7	81%	0.807	80%	0.801	S	S	*	*			trans	-58.2	171.2	-163.3	-57.1	-25.7	0	0	0	120.2
569	L	33.6	Very low	37	Very low	173 Å²	173	135.9 Å²	135.9	91%	0.906	80%	0.8	S	S	*	*			trans	-49.3	142.1	156.8	-99.9	59.1	0	0	0	114.5
570	A	32	Very low	37	Very low	92 Å²	92	139.8 Å²	139.8	76%	0.76	80%	0.804	S	S	*	*			trans	-147.2	117	147	0	0	0	0	0	106.4
571	A	33.8	Very low	37.2	Very low	92 Å²	92	139.1 Å²	139.1	76%	0.76	80%	0.802	S	S	*	*				84.3	116.3	88.3	0	0	0	0	0	112.9
572	I	36.4	Very low	37.4	Very low	175 Å²	175	143.8 Å²	143.8	90%	0.897	80%	0.804	S	S	*	*			trans	-127.6	111	173.8	-61.3	173.2	0	0	0	107.2
573	T	40.3	Very low	37.2	Very low	127 Å²	127	144.6 Å²	144.6	78%	0.779	81%	0.805	S	S	*	*			trans	-149.5	142.3	175.5	44.9	0	0	0	0	108.3
574	D	53.4	Low	37.2	Very low	111 Å²	111	143.7 Å²	143.7	59%	0.594	80%	0.799	S	S	*	*			trans	-91.3	172.7	174.7	63.9	17.3	0	0	0	112.3	N576 G577	D574-N576 PolarHBondContact O-N 3.39Å; D574-G577 PolarHBondContact O-N 3.05Å
575	A	47.6	Very low	37	Very low	107 Å²	107	141.4 Å²	141.4	88%	0.884	80%	0.796	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.6	-6.2	-163.3	0	0	0	0	0	115.8
576	N	50.2	Low	37.2	Very low	144 Å²	144	140.2 Å²	140.2	77%	0.77	79%	0.791	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.2	9.1	179.4	-75.6	-19.8	0	0	0	113.8	D574 N578	D574-N576 PolarHBondContact O-N 3.39Å; N576-N578 VanDerWaalsContact C-N 3.28Å; N576-N578 PolarHBondContact O-N 3.2Å
577	G	50.3	Low	37.2	Very low	61 Å²	61	138.5 Å²	138.5	63%	0.629	79%	0.79	S	S	*	*			trans	67.6	9.7	160.6	0	0	0	0	0	117.9	D574	D574-G577 PolarHBondContact O-N 3.05Å
578	N	43.3	Very low	37.1	Very low	133 Å²	133	140.9 Å²	140.9	71%	0.711	80%	0.797	S	S	*	*			trans	-96.8	128.1	-176.7	-87.8	-45.6	0	0	0	112.8	N576 Q580	N576-N578 VanDerWaalsContact C-N 3.28Å; N576-N578 PolarHBondContact O-N 3.2Å; N578-Q580 PolarHBondContact O-N 3Å
579	I	40.7	Very low	37.3	Very low	165 Å²	165	139.8 Å²	139.8	85%	0.846	80%	0.795	S	S	*	*			trans	-79.6	111.2	-179.9	-59.7	171	0	0	0	109.7	P581	I579-P581 WeakPolarHBondContact O-CD 3.44Å
580	Q	33.5	Very low	37.5	Very low	166 Å²	166	140.6 Å²	140.6	78%	0.776	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-66.9	121.8	176.9	-75.1	-72.5	-6	0	0	112	N578	N578-Q580 PolarHBondContact O-N 3Å
581	P	36.7	Very low	37.8	Very low	116 Å²	116	143.1 Å²	143.1	75%	0.753	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-75.2	162.2	175.2	31.6	-34.4	0	0	0	112.3	I579	I579-P581 WeakPolarHBondContact O-CD 3.44Å
582	R	33.9	Very low	38	Very low	232 Å²	232	145.7 Å²	145.7	88%	0.875	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-99	161.2	-173	-149.2	178.5	-168	177.5	4.9	111.5
583	T	30.3	Very low	38	Very low	126 Å²	126	144.1 Å²	144.1	77%	0.773	82%	0.817	S	S	*	*			trans	77.5	157.5	177.8	76.7	0	0	0	0	113.6
584	V	29.7	Very low	37.9	Very low	130 Å²	130	145.1 Å²	145.1	79%	0.788	82%	0.819	S	S	*	*			cis	-138.1	151.1	27.4	176.7	0	0	0	0	112.3
585	L	32.8	Very low	36.9	Very low	157 Å²	157	147.3 Å²	147.3	82%	0.822	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-90.4	139.1	167.4	-88.3	163.9	0	0	0	110.9
586	P	32	Very low	36.2	Very low	120 Å²	120	149.9 Å²	149.9	78%	0.779	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-67.9	147.9	-177.5	28.4	-34.8	0	0	0	112.8
587	K	29.9	Very low	35.2	Very low	201 Å²	201	150.4 Å²	150.4	87%	0.874	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-72.1	132.6	174.1	-62.7	177	-178.9	175.9	0	110.1
588	L	28.1	Very low	34.1	Very low	180 Å²	180	157.2 Å²	157.2	94%	0.942	85%	0.85	S	S	*	*	P	Polyproline II helix	trans	-84.1	143.6	155.9	-81	162.4	0	0	0	109
589	V	34.1	Very low	33.3	Very low	127 Å²	127	159.3 Å²	159.3	77%	0.77	86%	0.861	S	S	*	*	P	Polyproline II helix	trans	-100.2	139.2	-179.5	176.1	0	0	0	0	109.2
590	S	38.2	Very low	32.7	Very low	191 Å²	191	158.7 Å²	158.7	100%	1.336	86%	0.863	S	S	*	*			trans	21	0	163.6	-53.8	0	0	0	0	118.3

Retrieved 590 of 590 residues in 536.3 ms (Link to these results)

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