A0A087X3L1_POEFO Loading...

Eyes absent homolog

AlphaFold DB , UniProt , Accession A0A087X3L1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 585 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	32.6	Very low	41.3	Very low	222 Å²	222	156.2 Å²	156.2	100%	1.094	81%	0.813	S	S	*	*				0	77.9	0	-71.3	-175	177.1	0	0	111
2	D	34.6	Very low	41	Very low	157 Å²	157	152 Å²	152	84%	0.84	82%	0.818	S	S	*	*			cis	-158.1	159.6	-28.2	-88.5	-40.1	0	0	0	108.3
3	D	47.3	Very low	40.4	Very low	154 Å²	154	153.2 Å²	153.2	82%	0.824	81%	0.811	S	S	*	*			trans	-123.1	174.2	-177.9	-137.9	2.3	0	0	0	106.4
4	P	64.1	Low	39.8	Very low	86 Å²	86	152.9 Å²	152.9	56%	0.558	81%	0.809	S	S	*	*			cis	-142.4	-154.3	0.5	37.5	-13.4	0	0	0	114.2
5	Q	39.2	Very low	39.1	Very low	156 Å²	156	152.7 Å²	152.7	73%	0.729	80%	0.802	S	S	*	*			trans	80.7	146	159.3	-75.7	165.5	-95	0	0	117.7
6	E	37.5	Very low	38.8	Very low	160 Å²	160	147.9 Å²	147.9	75%	0.748	79%	0.791	S	S	*	*			cis	-144.4	161.3	9.8	-153.2	152.6	-121	0	0	115.5
7	L	36.8	Very low	38.3	Very low	154 Å²	154	149 Å²	149	81%	0.806	80%	0.797	S	S	*	*			trans	-142.6	149.1	171.8	-105.7	174.9	0	0	0	106.6
8	P	51.8	Low	37.9	Very low	120 Å²	120	144.2 Å²	144.2	78%	0.779	79%	0.788	S	S	*	*				-157.1	171.1	84.2	40.8	-21.5	0	0	0	117.5
9	A	37.6	Very low	37.8	Very low	90 Å²	90	146.1 Å²	146.1	74%	0.744	79%	0.791	S	S	*	*			trans	-94	169.6	163.2	0	0	0	0	0	112.2
10	K	38.3	Very low	37.8	Very low	210 Å²	210	145.3 Å²	145.3	91%	0.913	78%	0.782	S	S	*	*			trans	-133.1	153.1	164.9	-86.8	-172.3	175.3	177.1	0	112.5
11	K	34.2	Very low	37.8	Very low	209 Å²	209	145.8 Å²	145.8	91%	0.909	78%	0.779	S	S	*	*			trans	-101.4	166.3	-175.2	-79.9	-178.5	171.1	-179	0	112.7
12	A	38.7	Very low	37.9	Very low	106 Å²	106	139.3 Å²	139.3	88%	0.876	76%	0.756	S	S	*	*			trans	-87.9	161.4	175	0	0	0	0	0	114.5
13	K	32	Very low	38	Very low	168 Å²	168	139 Å²	139	73%	0.73	75%	0.75	S	S	*	*			trans	-156.3	129.6	157.6	-157.6	-166.4	175.6	-148.6	0	105.9	E15	K13-E15 VanDerWaalsContact CE-OE2 3.31Å; K13-E15 WeakPolarHBondContact CE-OE2 3.31Å; K13-E15 IonicContact NZ-OE2 2.71Å; K13-E15 PolarHBondContact NZ-OE2 2.75Å
14	L	32.4	Very low	37.7	Very low	148 Å²	148	136.8 Å²	136.8	78%	0.775	74%	0.737	S	S	*	*			cis	91.9	132.2	31.1	-142.2	168.7	0	0	0	112.6
15	E	29.2	Very low	36.4	Very low	151 Å²	151	142 Å²	142	71%	0.706	75%	0.746	S	S	*	*			trans	82.1	149.7	179.9	-53	174.5	130.3	0	0	116	K13	K13-E15 VanDerWaalsContact CE-OE2 3.31Å; K13-E15 WeakPolarHBondContact CE-OE2 3.31Å; K13-E15 IonicContact NZ-OE2 2.71Å; K13-E15 PolarHBondContact NZ-OE2 2.75Å
16	A	33.8	Very low	36.1	Very low	75 Å²	75	138.7 Å²	138.7	62%	0.62	74%	0.74	S	S	*	*			cis	-171.3	171.1	-25.7	0	0	0	0	0	109.3
17	D	30.5	Very low	36	Very low	167 Å²	167	138.8 Å²	138.8	89%	0.893	75%	0.745	S	S	*	*			trans	60.7	146.9	166.6	-50.8	-20	0	0	0	118.8
18	G	32.4	Very low	35.8	Very low	63 Å²	63	135.9 Å²	135.9	65%	0.649	74%	0.737	S	S	*	*			cis	166.3	139.8	-10.1	0	0	0	0	0	113
19	E	34.9	Very low	34.9	Very low	179 Å²	179	134.7 Å²	134.7	84%	0.836	73%	0.732	S	S	*	*			trans	65	151.5	150.5	-61.3	-175	151.1	0	0	118.3
20	Q	37.5	Very low	34.8	Very low	130 Å²	130	138.5 Å²	138.5	61%	0.607	74%	0.74	S	S	*	*			cis	-159.9	148.9	-2.6	-130.4	177.5	-28.4	0	0	111.5
21	E	38.6	Very low	34.3	Very low	156 Å²	156	132.1 Å²	132.1	73%	0.729	73%	0.734	S	S	*	*			trans	59	162	135.4	-84.5	172.6	-145.6	0	0	122.9
22	S	35.3	Very low	34.3	Very low	87 Å²	87	128.9 Å²	128.9	61%	0.608	73%	0.732	S	S	*	*			cis	-159.2	139.7	-12.5	58.2	0	0	0	0	107.8
23	E	36.8	Very low	34.5	Very low	150 Å²	150	129.9 Å²	129.9	70%	0.701	73%	0.729	S	S	*	*				105.9	131.2	80.7	-89.7	-152.9	128.4	0	0	116.8
24	L	39.7	Very low	34.6	Very low	108 Å²	108	126.5 Å²	126.5	57%	0.565	73%	0.733	S	S	*	*			trans	72.6	162.4	131.7	-63.7	178.3	0	0	0	121.2
25	R	36.3	Very low	34.6	Very low	195 Å²	195	124.3 Å²	124.3	74%	0.736	74%	0.735	S	S	*	*			cis	-153.4	135.4	-7.9	-114.1	170.2	-167.3	147.7	14.5	107.2
26	S	33.4	Very low	34.7	Very low	87 Å²	87	121.2 Å²	121.2	61%	0.608	74%	0.736	S	S	*	*				74.3	153.1	78.4	88.2	0	0	0	0	117.7
27	L	36.1	Very low	34.5	Very low	161 Å²	161	126 Å²	126	84%	0.843	75%	0.75	S	S	*	*			trans	89.7	148.9	171.2	-54.7	170.7	0	0	0	116.8
28	S	33.2	Very low	34.4	Very low	93 Å²	93	122.2 Å²	122.2	65%	0.65	74%	0.742	S	S	*	*			cis	-171.9	158.6	-26.2	55.6	0	0	0	0	112.8
29	S	32.8	Very low	34.3	Very low	96 Å²	96	124.5 Å²	124.5	67%	0.671	75%	0.748	S	S	*	*			trans	61.4	125.9	149.5	62.3	0	0	0	0	123.5
30	D	34	Very low	34.2	Very low	170 Å²	170	122 Å²	122	91%	0.909	75%	0.751	S	S	*	*			trans	46.3	137.3	135.4	-56.8	-16.5	0	0	0	123.9
31	G	28.9	Very low	34	Very low	76 Å²	76	125.1 Å²	125.1	78%	0.784	77%	0.765	S	S	*	*			trans	163.4	91.5	159.6	0	0	0	0	0	116.3
32	T	33.4	Very low	33.8	Very low	141 Å²	141	127.3 Å²	127.3	87%	0.865	78%	0.775	S	S	*	*			trans	-78.1	144.5	169.4	-25.7	0	0	0	0	111.3
33	P	43.2	Very low	33.5	Very low	126 Å²	126	130.8 Å²	130.8	82%	0.818	79%	0.787	S	S	*	*				-139	169.5	114.2	38.2	-27.3	0	0	0	113.1
34	A	33.9	Very low	33.2	Very low	98 Å²	98	127.2 Å²	127.2	81%	0.81	79%	0.79	S	S	*	*			trans	-114	143.1	-175.9	0	0	0	0	0	113
35	A	32.7	Very low	32.7	Very low	101 Å²	101	127 Å²	127	84%	0.835	80%	0.798	S	S	*	*			trans	-172.3	140.8	143.4	0	0	0	0	0	113.8
36	A	30.8	Very low	32.4	Very low	87 Å²	87	128 Å²	128	72%	0.719	81%	0.808	S	S	*	*			trans	71.7	103.4	144.5	0	0	0	0	0	123.1
37	L	30.1	Very low	32.3	Very low	174 Å²	174	128.7 Å²	128.7	91%	0.911	81%	0.813	S	S	*	*				91.6	145.8	126.5	-65	169.5	0	0	0	122.8
38	A	28.3	Very low	32.1	Very low	88 Å²	88	125.7 Å²	125.7	73%	0.727	81%	0.812	S	S	*	*			trans	84.3	71.1	155.3	0	0	0	0	0	121.1
39	S	30.7	Very low	32	Very low	112 Å²	112	129.6 Å²	129.6	78%	0.783	82%	0.824	S	S	*	*				37.9	115.7	123.2	61.3	0	0	0	0	122
40	S	32.6	Very low	31.9	Very low	126 Å²	126	130.6 Å²	130.6	88%	0.881	83%	0.832	S	S	*	*				-150.4	137.4	128.6	-41.1	0	0	0	0	109.3
41	E	32.8	Very low	31.8	Very low	195 Å²	195	127.4 Å²	127.4	91%	0.911	83%	0.828	S	S	*	*			trans	-121.4	129.8	167.4	-67.2	173.3	125.6	0	0	107.8
42	E	34.4	Very low	32	Very low	203 Å²	203	128.9 Å²	128.9	95%	0.949	83%	0.833	S	S	*	*			trans	-130.4	116.7	165.4	-73.1	-165.7	140.3	0	0	108.1
43	D	30.5	Very low	31.7	Very low	159 Å²	159	132.9 Å²	132.9	85%	0.85	83%	0.833	S	S	*	*			trans	-115.2	126.8	-178.6	-172	17.9	0	0	0	110.3	S45	D43-S45 PolarHBondContact O-N 3.04Å
44	G	29	Very low	31.1	Very low	75 Å²	75	133.8 Å²	133.8	77%	0.773	83%	0.83	S	S	*	*			trans	-93	56.9	-160.2	0	0	0	0	0	114.7
45	S	29	Very low	31	Very low	104 Å²	104	136 Å²	136	73%	0.727	83%	0.828	S	S	*	*			trans	-83.9	114.6	-177	-170.5	0	0	0	0	113.4	D43	D43-S45 PolarHBondContact O-N 3.04Å
46	F	31.3	Very low	31.2	Very low	215 Å²	215	137.1 Å²	137.1	94%	0.943	83%	0.827	S	S	*	*			trans	-97.9	105.4	171.8	-105.7	-87.3	0	0	0	111.3
47	S	31.4	Very low	31	Very low	103 Å²	103	135.7 Å²	135.7	72%	0.72	82%	0.82	S	S	*	*			trans	-78.5	143.4	175	-68.6	0	0	0	0	112.6
48	A	30.9	Very low	31.1	Very low	98 Å²	98	135.2 Å²	135.2	81%	0.81	81%	0.813	S	S	*	*			trans	-69.9	150.7	172.4	0	0	0	0	0	112.3
49	L	31.6	Very low	31.2	Very low	174 Å²	174	138.4 Å²	138.4	91%	0.911	81%	0.813	S	S	*	*			trans	-131.1	136.4	168	-76.5	176	0	0	0	111
50	S	29.8	Very low	31.2	Very low	118 Å²	118	139 Å²	139	83%	0.825	81%	0.807	S	S	*	*			trans	-122.1	165.1	172.6	-76.6	0	0	0	0	109.9
51	A	32.9	Very low	31.1	Very low	102 Å²	102	140.9 Å²	140.9	84%	0.843	80%	0.802	S	S	*	*			trans	63.6	98.2	171.3	0	0	0	0	0	116.5
52	A	32.3	Very low	30.9	Very low	107 Å²	107	135.7 Å²	135.7	88%	0.884	79%	0.793	S	S	*	*			trans	-72.3	142.4	164.3	0	0	0	0	0	111.5
53	R	27.7	Very low	30.8	Very low	226 Å²	226	132.1 Å²	132.1	85%	0.853	79%	0.791	S	S	*	*			trans	-151.7	111.9	164.1	-159.1	177.5	-167.7	-140.8	1.1	113.6
54	L	30.4	Very low	30.7	Very low	145 Å²	145	128 Å²	128	76%	0.759	79%	0.785	S	S	*	*			trans	45.8	100	150.9	-56.6	173.8	0	0	0	118.3
55	D	31.7	Very low	30.9	Very low	143 Å²	143	129 Å²	129	77%	0.765	79%	0.786	S	S	*	*			trans	-62.5	149	156.1	175	47.9	0	0	0	111.9	G57	D55-G57 PolarHBondContact OD1-N 3.22Å
56	P	36.6	Very low	31	Very low	126 Å²	126	136.2 Å²	136.2	82%	0.818	80%	0.798	S	S	*	*				-149	128.6	115.9	35.2	-17.6	0	0	0	116.8
57	G	26.9	Very low	30.9	Very low	56 Å²	56	129.2 Å²	129.2	58%	0.577	79%	0.786	S	S	*	*			trans	165.7	142.9	157.1	0	0	0	0	0	113.2	D55	D55-G57 PolarHBondContact OD1-N 3.22Å
58	E	31.5	Very low	31	Very low	164 Å²	164	133.2 Å²	133.2	77%	0.766	79%	0.793	S	S	*	*			cis	-161	161	6.6	-110.4	-160.2	100.8	0	0	111.5
59	Q	31.1	Very low	31.1	Very low	156 Å²	156	133.9 Å²	133.9	73%	0.729	79%	0.792	S	S	*	*			trans	66.7	157.7	158	-63.9	163.1	31.1	0	0	117
60	D	30.2	Very low	31.1	Very low	123 Å²	123	132.9 Å²	132.9	66%	0.658	79%	0.787	S	S	*	*			cis	-148.8	173.8	16.8	-167.3	17.8	0	0	0	113.5
61	Q	30.3	Very low	31.4	Very low	166 Å²	166	138 Å²	138	78%	0.776	79%	0.789	S	S	*	*			trans	74.4	106.9	157	-86	163.8	72.8	0	0	121.2
62	A	30	Very low	32.4	Very low	86 Å²	86	138 Å²	138	71%	0.711	78%	0.78	S	S	*	*				142.5	120.9	95.6	0	0	0	0	0	117.1
63	S	31.5	Very low	32.6	Very low	129 Å²	129	140.9 Å²	140.9	90%	0.902	78%	0.779	S	S	*	*			trans	66.4	152	147.8	75.5	0	0	0	0	121.3
64	G	29.1	Very low	32.8	Very low	71 Å²	71	133 Å²	133	73%	0.732	77%	0.768	S	S	*	*			trans	147.3	7.4	138.1	0	0	0	0	0	125.6
65	A	33	Very low	33	Very low	97 Å²	97	134 Å²	134	80%	0.802	77%	0.774	S	S	*	*			trans	66.5	147.4	154.2	0	0	0	0	0	124.1
66	R	31.5	Very low	33.3	Very low	256 Å²	256	130.6 Å²	130.6	97%	0.966	77%	0.766	S	S	*	*			trans	80.4	148.2	150.6	-74.8	176.8	173.3	-165	-3	122.8
67	G	29.6	Very low	33.4	Very low	67 Å²	67	130.8 Å²	130.8	69%	0.691	76%	0.764	S	S	*	*			trans	104.5	87.1	170.6	0	0	0	0	0	113.6
68	E	32.2	Very low	33.7	Very low	187 Å²	187	134.9 Å²	134.9	87%	0.874	77%	0.773	S	S	*	*				79.2	119.6	67.7	-74.8	-168.4	120.1	0	0	116.7
69	S	33.4	Very low	33.8	Very low	113 Å²	113	131 Å²	131	79%	0.79	76%	0.764	S	S	*	*			trans	63.9	151	156.4	66.7	0	0	0	0	118.6
70	D	32.1	Very low	33.7	Very low	152 Å²	152	132.3 Å²	132.3	81%	0.813	77%	0.768	S	S	*	*			cis	-150.5	177.5	-0.8	-141	-28.9	0	0	0	113.2
71	R	36	Very low	33.8	Very low	226 Å²	226	131.6 Å²	131.6	85%	0.853	77%	0.772	S	S	*	*			trans	-103.7	-166.9	163.7	-82.2	-173	164.5	-155.4	-3.1	108.7
72	P	53.2	Low	34.1	Very low	102 Å²	102	132.5 Å²	132.5	66%	0.662	78%	0.776	S	S	*	*			cis	-142.5	-176.7	1.9	45.7	-27.5	0	0	0	117.5
73	I	36.3	Very low	35.4	Very low	168 Å²	168	132.8 Å²	132.8	86%	0.862	77%	0.771	S	S	*	*			trans	62.7	141.5	148.1	-72.2	155.3	0	0	0	119
74	G	31.9	Very low	35.5	Very low	60 Å²	60	134.3 Å²	134.3	62%	0.619	77%	0.769	S	S	*	*			cis	163.9	174	-5.6	0	0	0	0	0	113
75	D	35.6	Very low	35.5	Very low	166 Å²	166	134.3 Å²	134.3	89%	0.888	77%	0.769	S	S	*	*			trans	60.6	151.6	162.9	-68.9	-2.6	0	0	0	121.1
76	A	37.7	Very low	35.4	Very low	72 Å²	72	137.2 Å²	137.2	60%	0.595	77%	0.771	S	S	*	*			cis	-170.4	168.5	-19.6	0	0	0	0	0	111.8
77	V	37.8	Very low	35.5	Very low	130 Å²	130	129.4 Å²	129.4	79%	0.788	76%	0.756	S	S	*	*			trans	56.7	153.9	160.1	-61.2	0	0	0	0	119.5
78	D	33.6	Very low	35.6	Very low	141 Å²	141	130.8 Å²	130.8	75%	0.754	76%	0.76	S	S	*	*			cis	-167	175.7	-14	-113.4	35.3	0	0	0	107.4
79	S	33.3	Very low	35.5	Very low	84 Å²	84	130.4 Å²	130.4	59%	0.587	76%	0.759	S	S	*	*			cis	179.4	179.1	-28.9	-178.2	0	0	0	0	109
80	F	30.4	Very low	35.5	Very low	183 Å²	183	129.6 Å²	129.6	80%	0.803	75%	0.753	S	S	*	*			trans	65.4	148.9	176.9	-65	-95.9	0	0	0	117.7
81	S	31	Very low	35.3	Very low	108 Å²	108	128.7 Å²	128.7	76%	0.755	75%	0.748	S	S	*	*			cis	-163.3	163.5	-26.8	-111.2	0	0	0	0	113.3
82	H	36.1	Very low	35.1	Very low	184 Å²	184	128 Å²	128	85%	0.852	75%	0.747	S	S	*	*			trans	-82.2	-175.9	177.4	-93.5	-80.5	0	0	0	114.2
83	P	57.3	Low	34	Very low	92 Å²	92	127.5 Å²	127.5	60%	0.597	75%	0.746	S	S	*	*			cis	-142.3	-167.6	-18.9	35.1	-12.2	0	0	0	116.3
84	D	33.8	Very low	33.7	Very low	162 Å²	162	129.1 Å²	129.1	87%	0.866	75%	0.75	S	S	*	*			trans	63.3	157	143.9	-63.9	-27.9	0	0	0	124
85	G	30.5	Very low	33.6	Very low	71 Å²	71	134.2 Å²	134.2	73%	0.732	76%	0.757	S	S	*	*			trans	155.6	16.4	148	0	0	0	0	0	126.7
86	N	31	Very low	33.3	Very low	158 Å²	158	133.4 Å²	133.4	85%	0.845	76%	0.758	S	S	*	*			trans	47.9	145.1	153.3	-150	28	0	0	0	125
87	S	32.4	Very low	32.9	Very low	92 Å²	92	138.5 Å²	138.5	64%	0.643	76%	0.763	S	S	*	*			trans	64.6	108.3	146	56.6	0	0	0	0	125.5
88	A	32.5	Very low	32.3	Very low	95 Å²	95	140.6 Å²	140.6	79%	0.785	76%	0.764	S	S	*	*				71.4	131.9	118.3	0	0	0	0	0	126.4
89	Q	30.2	Very low	32	Very low	180 Å²	180	140.9 Å²	140.9	84%	0.841	76%	0.761	S	S	*	*			trans	72.9	95.8	139.9	-81	-175.7	-29.9	0	0	124.8
90	S	32.4	Very low	31.7	Very low	95 Å²	95	141.1 Å²	141.1	66%	0.664	77%	0.768	S	S	*	*				87.7	135.2	114.4	74.7	0	0	0	0	124.6
91	N	28.9	Very low	31.9	Very low	134 Å²	134	137.9 Å²	137.9	72%	0.717	77%	0.768	S	S	*	*			trans	103.5	127	137.5	-83.1	-34.7	0	0	0	123.6
92	Y	31.6	Very low	32.2	Very low	211 Å²	211	139 Å²	139	83%	0.827	77%	0.773	S	S	*	*			trans	64.3	146	156.5	-81.9	-118.8	0	0	0	119.4
93	S	30.6	Very low	32.1	Very low	91 Å²	91	134.4 Å²	134.4	64%	0.636	77%	0.767	S	S	*	*			cis	-177.1	143.2	-19.4	52.1	0	0	0	0	111.8
94	Q	29.6	Very low	31	Very low	203 Å²	203	136.4 Å²	136.4	95%	0.949	78%	0.777	S	S	*	*			trans	-163.6	161.1	140.5	-118.1	179.6	13.9	0	0	112.5
95	Q	29.6	Very low	30.7	Very low	166 Å²	166	135.6 Å²	135.6	78%	0.776	78%	0.778	S	S	*	*			trans	-127	144.3	-174.1	-54.3	163.4	-76.3	0	0	111.2
96	V	29.3	Very low	30.5	Very low	149 Å²	149	137 Å²	137	90%	0.903	78%	0.777	S	S	*	*			trans	-144.3	148	139.2	-177.2	0	0	0	0	107.7
97	Y	29.6	Very low	30.3	Very low	180 Å²	180	139.1 Å²	139.1	71%	0.706	78%	0.779	S	S	*	*			trans	-90.3	150	-175.4	-93.7	-112.6	0	0	0	113.9	E99	Y97-E99 HydrophobicContact CD1-CB 4.37Å
98	Q	25.3	Very low	30	Very low	174 Å²	174	139.2 Å²	139.2	81%	0.813	78%	0.78	S	S	*	*				-170.7	106.6	108.5	-136.9	151.9	13.3	0	0	108.5
99	E	26.5	Very low	29.8	Very low	147 Å²	147	139.6 Å²	139.6	69%	0.687	78%	0.776	S	S	*	*				75.1	125.3	67.2	-173.2	-177.5	-129.7	0	0	113.1	Y97	Y97-E99 HydrophobicContact CD1-CB 4.37Å
100	A	28.1	Very low	29.7	Very low	89 Å²	89	139.9 Å²	139.9	74%	0.736	78%	0.778	S	S	*	*			cis	-161.7	159.6	-18.3	0	0	0	0	0	110.8
101	S	33.3	Very low	29.5	Very low	114 Å²	114	141.4 Å²	141.4	80%	0.797	78%	0.783	S	S	*	*			trans	-86.3	161.5	164	-49	0	0	0	0	110.9
102	P	37.8	Very low	29.4	Very low	132 Å²	132	139.5 Å²	139.5	86%	0.857	79%	0.786	S	S	*	*				-147.7	-171.1	101	39.6	-23.6	0	0	0	113.9
103	A	33.3	Very low	29.3	Very low	88 Å²	88	138.6 Å²	138.6	73%	0.727	79%	0.786	S	S	*	*			trans	-127.3	165.3	-178.5	0	0	0	0	0	113
104	V	34.1	Very low	29	Very low	133 Å²	133	143.4 Å²	143.4	81%	0.806	80%	0.799	S	S	*	*			trans	67.8	115.2	166.3	-171.8	0	0	0	0	117.6
105	T	27.7	Very low	29.3	Very low	146 Å²	146	139.1 Å²	139.1	90%	0.896	79%	0.791	S	S	*	*				-166.4	158.2	128.7	8.9	0	0	0	0	111.5
106	S	27.2	Very low	29.1	Very low	100 Å²	100	136 Å²	136	70%	0.699	79%	0.794	S	S	*	*			trans	-124.1	150.2	177	52.7	0	0	0	0	110.2
107	F	25.5	Very low	29	Very low	203 Å²	203	134.9 Å²	134.9	89%	0.89	79%	0.787	S	S	*	*			trans	-170	166	137.7	-117.9	-80.2	0	0	0	112.8
108	S	26.8	Very low	28.8	Very low	94 Å²	94	136.5 Å²	136.5	66%	0.657	79%	0.793	S	S	*	*			trans	-75.4	177.8	-167.9	-32.6	0	0	0	0	115.2
109	S	28.6	Very low	28.8	Very low	103 Å²	103	133.8 Å²	133.8	72%	0.72	79%	0.794	S	S	*	*				-176.3	134.8	79.4	32.3	0	0	0	0	117.1
110	Q	28.8	Very low	28.8	Very low	185 Å²	185	131.1 Å²	131.1	86%	0.864	79%	0.792	S	S	*	*			trans	69.4	155.3	146.6	-60.2	-177.4	14.3	0	0	118.2
111	V	27.8	Very low	28.7	Very low	128 Å²	128	136.1 Å²	136.1	78%	0.776	80%	0.797	S	S	*	*			cis	-140.3	138.2	27.4	175	0	0	0	0	114.5
112	A	26.2	Very low	28.7	Very low	94 Å²	94	136.1 Å²	136.1	78%	0.777	79%	0.794	S	S	*	*			trans	61.3	142.4	153.3	0	0	0	0	0	124.4
113	F	28.7	Very low	28.2	Very low	191 Å²	191	139 Å²	139	84%	0.838	80%	0.796	S	S	*	*			trans	-87.3	163.6	172.2	-73.7	-119.2	0	0	0	112.7
114	Q	25.9	Very low	28.1	Very low	192 Å²	192	140.6 Å²	140.6	90%	0.897	80%	0.802	S	S	*	*				-159.6	151.5	121.7	-121.1	164.2	97.1	0	0	114.3
115	S	34.4	Very low	28	Very low	114 Å²	114	137 Å²	137	80%	0.797	79%	0.793	S	S	*	*			trans	-110.3	139.7	169	-51.9	0	0	0	0	109.1
116	A	26.2	Very low	28	Very low	100 Å²	100	138 Å²	138	83%	0.826	79%	0.787	S	S	*	*			trans	-146.5	154.7	175.3	0	0	0	0	0	111.6
117	V	28.1	Very low	28	Very low	126 Å²	126	139.5 Å²	139.5	76%	0.764	79%	0.792	S	S	*	*			trans	-134.1	156.7	-178.4	-170.3	0	0	0	0	108.2
118	Y	23.8	Very low	28.1	Very low	213 Å²	213	140.2 Å²	140.2	84%	0.835	79%	0.79	S	S	*	*			trans	71.4	152.7	-172.8	-65.4	-88.2	0	0	0	113.4
119	S	25	Very low	28.1	Very low	118 Å²	118	138.9 Å²	138.9	83%	0.825	79%	0.791	S	S	*	*			cis	-138.4	172.7	24.5	-57.5	0	0	0	0	114.3
120	S	26.4	Very low	28.3	Very low	91 Å²	91	142.1 Å²	142.1	64%	0.636	80%	0.8	S	S	*	*			trans	-103.4	-177	179.9	52.5	0	0	0	0	113.7
121	F	26.8	Very low	28.5	Very low	194 Å²	194	138 Å²	138	85%	0.851	79%	0.788	S	S	*	*			trans	85.9	153.1	173.4	-69.5	-88.8	0	0	0	118.8
122	P	33.6	Very low	28.8	Very low	114 Å²	114	137.8 Å²	137.8	74%	0.74	79%	0.79	S	S	*	*			cis	-115.8	156.8	-9.3	37.7	-26.1	0	0	0	114.2
123	Q	27.2	Very low	29	Very low	191 Å²	191	143.6 Å²	143.6	89%	0.893	80%	0.798	S	S	*	*			trans	-76.8	128.8	161.4	-75.4	179.9	-23.8	0	0	110.3
124	S	30.3	Very low	29.1	Very low	122 Å²	122	137.8 Å²	137.8	85%	0.853	79%	0.792	S	S	*	*			trans	-94.5	107	152.8	42.4	0	0	0	0	108.3
125	G	33.8	Very low	29.4	Very low	59 Å²	59	134 Å²	134	61%	0.608	79%	0.794	S	S	*	*			trans	-74.9	134.9	-174.3	0	0	0	0	0	113.5
126	Q	26.6	Very low	29.2	Very low	166 Å²	166	135.7 Å²	135.7	78%	0.776	79%	0.793	S	S	*	*			trans	-136.2	118.9	148.1	-77.6	-57.2	-26	0	0	109.3
127	T	26.9	Very low	29.6	Very low	132 Å²	132	142 Å²	142	81%	0.81	80%	0.796	S	S	*	*			trans	-96.5	107.7	-177.7	-57.5	0	0	0	0	109.6
128	Y	27.9	Very low	30	Very low	218 Å²	218	141.4 Å²	141.4	86%	0.855	80%	0.795	S	S	*	*			trans	-118.3	80.6	165.4	-84.2	-83.8	0	0	0	109.8
129	G	27.7	Very low	30.2	Very low	65 Å²	65	135 Å²	135	67%	0.67	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-82.6	139	164.9	0	0	0	0	0	110.3
130	L	31.5	Very low	30.5	Very low	172 Å²	172	136.5 Å²	136.5	90%	0.901	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-78.8	148.6	169.7	-70.2	170.9	0	0	0	110.3
131	P	33.8	Very low	30.6	Very low	97 Å²	97	140.3 Å²	140.3	63%	0.63	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-85.9	145.3	-162.6	32.7	-36.1	0	0	0	113.7
132	P	33.7	Very low	30.8	Very low	124 Å²	124	137.8 Å²	137.8	81%	0.805	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-69.5	131.7	160.2	30.3	-32.3	0	0	0	109.7	G134	P132-G134 PolarHBondContact O-N 3.39Å
133	F	30.3	Very low	30.5	Very low	216 Å²	216	139.6 Å²	139.6	95%	0.947	80%	0.801	S	S	*	*			trans	-69.8	111.8	175.3	-94.8	-102.3	0	0	0	110.9
134	G	30.5	Very low	30.6	Very low	70 Å²	70	137.6 Å²	137.6	72%	0.722	80%	0.802	S	S	*	*			trans	-144.5	105.1	171.6	0	0	0	0	0	110.2	P132 L136	P132-G134 PolarHBondContact O-N 3.39Å; G134-L136 PolarHBondContact O-N 3.47Å
135	A	33.5	Very low	30.5	Very low	113 Å²	113	135.3 Å²	135.3	93%	0.934	80%	0.798	S	S	*	*			trans	-77	123.5	-175.6	0	0	0	0	0	111.8
136	L	30.4	Very low	30.3	Very low	148 Å²	148	140.6 Å²	140.6	78%	0.775	81%	0.812	S	S	*	*			trans	-84.7	133.5	169.6	-179.1	77.5	0	0	0	109.9	G134	G134-L136 PolarHBondContact O-N 3.47Å
137	W	33.4	Very low	31.4	Very low	233 Å²	233	137.5 Å²	137.5	88%	0.883	81%	0.806	S	S	*	*			trans	-166.6	170.3	149.4	-95	130.7	0	0	0	110.7
138	P	37.8	Very low	31.4	Very low	114 Å²	114	140 Å²	140	74%	0.74	81%	0.808	S	S	*	*				-97.6	161.4	-126.9	37.7	-37.1	0	0	0	116.4
139	G	27.5	Very low	31.4	Very low	78 Å²	78	133.8 Å²	133.8	80%	0.804	80%	0.802	S	S	*	*			trans	-94.2	-177.8	-175.8	0	0	0	0	0	116.8
140	V	31.2	Very low	32.1	Very low	150 Å²	150	136.5 Å²	136.5	91%	0.909	81%	0.808	S	S	*	*			trans	-129.3	155.3	177.9	179.1	0	0	0	0	109.4
141	K	28.3	Very low	33.2	Very low	171 Å²	171	134.3 Å²	134.3	74%	0.743	80%	0.803	S	S	*	*			trans	-99.9	151.9	-170.9	-50.4	173.4	179.7	-178.4	0	113.8
142	T	29.9	Very low	33	Very low	140 Å²	140	133.6 Å²	133.6	86%	0.859	81%	0.814	S	S	*	*			trans	-177.8	113.2	137.4	31.6	0	0	0	0	106
143	E	28.3	Very low	32.8	Very low	153 Å²	153	131.8 Å²	131.8	72%	0.715	82%	0.818	S	S	*	*				71.5	105.1	58.4	-66.7	-163.9	177.9	0	0	115.9
144	T	29.5	Very low	32.7	Very low	148 Å²	148	130 Å²	130	91%	0.908	81%	0.813	S	S	*	*			trans	63.2	147.1	156.3	65.4	0	0	0	0	119.1
145	G	27.8	Very low	32.7	Very low	74 Å²	74	133.3 Å²	133.3	76%	0.763	82%	0.819	S	S	*	*			cis	-172.9	170.7	-2.1	0	0	0	0	0	112.9
146	L	29.2	Very low	32.6	Very low	171 Å²	171	131.1 Å²	131.1	90%	0.895	81%	0.807	S	S	*	*			trans	-79.9	176	174.1	-76.8	166.1	0	0	0	111.4
147	P	49.6	Very low	32.7	Very low	100 Å²	100	133.8 Å²	133.8	65%	0.649	81%	0.813	S	S	*	*			cis	-142.8	-171.5	14.6	42.2	-21.5	0	0	0	118.2
148	E	26.8	Very low	32.7	Very low	186 Å²	186	129.8 Å²	129.8	87%	0.869	81%	0.808	S	S	*	*			trans	87.9	164.9	145	-93.3	171.8	116	0	0	123.3
149	A	28.7	Very low	32.3	Very low	86 Å²	86	129 Å²	129	71%	0.711	81%	0.805	S	S	*	*			trans	-152.2	-156.6	-157.8	0	0	0	0	0	108.7
150	P	42.2	Very low	32.4	Very low	123 Å²	123	135.6 Å²	135.6	80%	0.799	81%	0.812	S	S	*	*			cis	-124.2	-110.9	-12.6	22.9	4.3	0	0	0	115
151	P	55.6	Low	32.3	Very low	125 Å²	125	133.3 Å²	133.3	81%	0.812	80%	0.803	S	S	*	*				-130.3	178.2	-119.9	42.6	-25	0	0	0	116.9
152	G	28.3	Very low	32.3	Very low	82 Å²	82	131.4 Å²	131.4	85%	0.845	81%	0.805	S	S	*	*			trans	172.4	149.6	159.6	0	0	0	0	0	116.2
153	G	29.4	Very low	32.3	Very low	86 Å²	86	128 Å²	128	89%	0.887	79%	0.791	S	S	*	*			trans	120.1	111.9	167.6	0	0	0	0	0	115.4
154	Q	29.7	Very low	32.5	Very low	180 Å²	180	131.3 Å²	131.3	84%	0.841	80%	0.799	S	S	*	*			trans	-115.6	172	177	-74.6	-170.6	-3.6	0	0	112.8
155	T	30.4	Very low	32.5	Very low	139 Å²	139	130.5 Å²	130.5	85%	0.853	79%	0.794	S	S	*	*			trans	91.7	138.9	156	73.3	0	0	0	0	117.8
156	G	31.7	Very low	32.6	Very low	66 Å²	66	131 Å²	131	68%	0.68	79%	0.786	S	S	*	*			cis	160.8	162.1	-12.3	0	0	0	0	0	114.8
157	F	30.6	Very low	32.9	Very low	205 Å²	205	129.3 Å²	129.3	90%	0.899	78%	0.782	S	S	*	*			trans	66.7	151.5	169.4	-90.2	-133.4	0	0	0	115.7
158	L	34.8	Very low	32	Very low	149 Å²	149	132.2 Å²	132.2	78%	0.78	79%	0.788	S	S	*	*			cis	-131.5	163	9.1	-104.7	172.1	0	0	0	111.8
159	S	28.4	Very low	32.9	Very low	98 Å²	98	129.5 Å²	129.5	69%	0.685	79%	0.786	S	S	*	*			trans	-108.9	160.6	172.8	-51.9	0	0	0	0	112.4
160	F	30	Very low	32.9	Very low	216 Å²	216	127.6 Å²	127.6	95%	0.947	78%	0.775	S	S	*	*			trans	-150.6	146.6	142.3	-108.8	-74.8	0	0	0	111.1
161	S	29.4	Very low	32.3	Very low	102 Å²	102	129.1 Å²	129.1	71%	0.713	77%	0.771	S	S	*	*			trans	-146.9	151.1	-171.9	-49.4	0	0	0	0	111.9
162	T	28.1	Very low	31	Very low	131 Å²	131	130.6 Å²	130.6	80%	0.804	77%	0.772	S	S	*	*			trans	178.8	117.7	155.7	-77	0	0	0	0	106
163	A	29.8	Very low	30.8	Very low	67 Å²	67	133.8 Å²	133.8	55%	0.554	76%	0.764	S	S	*	*			cis	78.2	139.6	43.8	0	0	0	0	0	113.1
164	Y	32.3	Very low	30.6	Very low	223 Å²	223	139.6 Å²	139.6	88%	0.875	76%	0.761	S	S	*	*			cis	-122.1	-161	-1.5	-57.8	-96.4	0	0	0	107.9
165	T	29.9	Very low	30.3	Very low	131 Å²	131	135.7 Å²	135.7	80%	0.804	75%	0.754	S	S	*	*			cis	-157.5	179.7	7.4	-166	0	0	0	0	106.8
166	S	29.7	Very low	30.3	Very low	86 Å²	86	139.6 Å²	139.6	60%	0.601	75%	0.754	S	S	*	*			cis	-159.4	177.1	14.2	-165.2	0	0	0	0	111.9
167	T	34.8	Very low	30.5	Very low	134 Å²	134	142.1 Å²	142.1	82%	0.822	76%	0.759	S	S	*	*			trans	42.1	111.3	158.2	41.3	0	0	0	0	120.9
168	Q	31.6	Very low	30.3	Very low	162 Å²	162	136.9 Å²	136.9	76%	0.757	75%	0.747	S	S	*	*			trans	-113.5	-178	157	-123.1	-163.6	58.9	0	0	108.4
169	P	44.8	Very low	30	Very low	128 Å²	128	138.3 Å²	138.3	83%	0.831	75%	0.75	S	S	*	*			cis	-127.6	171.2	26	40.3	-23.9	0	0	0	115.7
170	G	29.5	Very low	29.8	Very low	47 Å²	47	137.5 Å²	137.5	49%	0.485	75%	0.75	S	S	.	*			cis	155.5	170.6	-7.4	0	0	0	0	0	113.3
171	Q	29.4	Very low	29.6	Very low	154 Å²	154	132.7 Å²	132.7	72%	0.72	74%	0.743	S	S	*	*			trans	62.6	136	171.8	-56.8	-69.1	-37.5	0	0	116
172	L	27.9	Very low	29.5	Very low	157 Å²	157	132.1 Å²	132.1	82%	0.822	74%	0.738	S	S	*	*			cis	-137.1	173.3	26.3	-73.7	165.1	0	0	0	113.6
173	H	24.6	Very low	29.4	Very low	149 Å²	149	134.6 Å²	134.6	69%	0.69	74%	0.738	S	S	*	*			trans	-77.7	-178	176.8	-52.4	133	0	0	0	114.4
174	Y	26.2	Very low	29.2	Very low	207 Å²	207	136.7 Å²	136.7	81%	0.812	75%	0.745	S	S	*	*			cis	-147.8	170.6	9	-133.6	-72.6	0	0	0	112.3
175	S	23	Very low	28.8	Very low	99 Å²	99	132.3 Å²	132.3	69%	0.692	74%	0.741	S	S	*	*			trans	-83	164.4	-167.3	-40.1	0	0	0	0	118.8
176	Y	29.2	Very low	28.6	Very low	220 Å²	220	130.8 Å²	130.8	86%	0.863	74%	0.736	S	S	*	*			trans	-65.1	163.6	155.6	-117.3	-98.1	0	0	0	112.9
177	P	37.4	Very low	28.5	Very low	120 Å²	120	132.6 Å²	132.6	78%	0.779	75%	0.749	S	S	*	*			trans	-135.7	175.2	130.9	39.1	-28.6	0	0	0	114.3
178	S	26.2	Very low	28.2	Very low	94 Å²	94	131.9 Å²	131.9	66%	0.657	74%	0.744	S	S	*	*			trans	-131.8	179.8	-157.3	55.9	0	0	0	0	115.6
179	Q	28.3	Very low	27.9	Very low	179 Å²	179	134.1 Å²	134.1	84%	0.836	75%	0.747	S	S	*	*			trans	107	143.7	153.1	-69.2	174.1	70.5	0	0	121.5
180	A	22.7	Very low	27	Very low	82 Å²	82	132.1 Å²	132.1	68%	0.678	74%	0.736	S	S	*	*			trans	40.2	130.3	148.9	0	0	0	0	0	120.5
181	S	27.6	Very low	26.8	Very low	115 Å²	115	137.4 Å²	137.4	80%	0.804	75%	0.753	S	S	*	*			cis	71.2	145.5	43.1	90.9	0	0	0	0	114.4
182	S	25.7	Very low	27.2	Very low	89 Å²	89	137.3 Å²	137.3	62%	0.622	76%	0.756	S	S	*	*			cis	-156.9	-163.6	9.6	-161	0	0	0	0	112
183	F	26.1	Very low	28	Very low	183 Å²	183	135.4 Å²	135.4	80%	0.803	75%	0.753	S	S	*	*			trans	77.6	150.6	166.2	-47	-75.9	0	0	0	118
184	T	25.2	Very low	28.5	Very low	112 Å²	112	132.7 Å²	132.7	69%	0.687	75%	0.751	S	S	*	*			cis	-164.7	163	-17	20	0	0	0	0	113.4
185	T	24.8	Very low	28.8	Very low	130 Å²	130	128.9 Å²	128.9	80%	0.798	75%	0.754	S	S	*	*			trans	62.4	107.6	147.2	50.9	0	0	0	0	123.3
186	S	25.5	Very low	29.2	Very low	100 Å²	100	128.9 Å²	128.9	70%	0.699	76%	0.76	S	S	*	*			trans	-17.1	147.2	137.8	-177.4	0	0	0	0	119.8
187	S	28.1	Very low	29.4	Very low	124 Å²	124	122.8 Å²	122.8	87%	0.867	76%	0.755	S	S	*	*				-166.3	160.1	123.1	-83.9	0	0	0	0	114.5
188	V	28	Very low	29.1	Very low	118 Å²	118	123.9 Å²	123.9	72%	0.715	76%	0.759	S	S	*	*			trans	-103.5	166.4	-162.2	-169	0	0	0	0	112.5
189	Y	24.6	Very low	29.6	Very low	210 Å²	210	124.2 Å²	124.2	82%	0.824	76%	0.762	S	S	*	*			trans	125.8	128.6	146.5	-90.7	-83.6	0	0	0	120.8
190	S	26.7	Very low	29.9	Very low	85 Å²	85	122 Å²	122	59%	0.594	77%	0.766	S	S	*	*			trans	-30.6	147.9	170.1	-42.4	0	0	0	0	120.4
191	N	25.2	Very low	30.3	Very low	159 Å²	159	121.8 Å²	121.8	85%	0.85	77%	0.772	S	S	*	*				-172.1	163.4	98.4	-101.7	-65.7	0	0	0	114.9
192	I	38.2	Very low	30.9	Very low	151 Å²	151	121.2 Å²	121.2	77%	0.774	77%	0.774	S	S	*	*			trans	-120.5	125.6	174.7	-67	163.5	0	0	0	108
193	P	44.1	Very low	31.2	Very low	118 Å²	118	124.1 Å²	124.1	77%	0.766	79%	0.788	S	S	*	*				-149.6	179.5	113.3	32.2	-12.8	0	0	0	113.6
194	S	34.8	Very low	31.7	Very low	92 Å²	92	120.2 Å²	120.2	64%	0.643	79%	0.79	S	S	*	*			cis	175.7	143.4	-36.1	-84.2	0	0	0	0	107.4
195	S	33.3	Very low	32.1	Very low	126 Å²	126	119.8 Å²	119.8	88%	0.881	80%	0.797	S	S	*	*			trans	65.7	163.2	170	83	0	0	0	0	116.6
196	A	32	Very low	32.4	Very low	99 Å²	99	117.2 Å²	117.2	82%	0.818	80%	0.797	S	S	*	*			cis	-143.5	167	-0.1	0	0	0	0	0	111.9
197	A	33.5	Very low	33.7	Very low	92 Å²	92	118 Å²	118	76%	0.76	80%	0.8	S	S	*	*			trans	-102.2	150	-174.2	0	0	0	0	0	114.4
198	V	31.4	Very low	33.9	Very low	143 Å²	143	121.4 Å²	121.4	87%	0.867	80%	0.802	S	S	*	*			trans	-176	167.8	149.4	-92.2	0	0	0	0	108.7
199	S	36.2	Very low	34	Very low	102 Å²	102	124.5 Å²	124.5	71%	0.713	81%	0.808	S	S	*	*			cis	-179.6	159.7	-45.2	-90.2	0	0	0	0	109.1
200	S	33.6	Very low	34.1	Very low	133 Å²	133	124.3 Å²	124.3	93%	0.93	81%	0.812	S	S	*	*			trans	71.5	154.3	179.2	80.9	0	0	0	0	116.2
201	G	31.1	Very low	34.3	Very low	77 Å²	77	124.5 Å²	124.5	79%	0.794	81%	0.813	S	S	*	*			cis	-148.8	-178.9	2.2	0	0	0	0	0	112.8
202	A	40.1	Very low	34.4	Very low	103 Å²	103	122.2 Å²	122.2	85%	0.851	81%	0.81	S	S	*	*			trans	-137.2	159.8	-169.3	0	0	0	0	0	113.8
203	T	32.3	Very low	33.9	Very low	149 Å²	149	126 Å²	126	91%	0.914	82%	0.816	S	S	*	*			trans	-139.3	156.6	168.9	44.3	0	0	0	0	111.3
204	A	36.7	Very low	33.2	Very low	101 Å²	101	125 Å²	125	84%	0.835	81%	0.812	S	S	*	*			trans	-112.2	-178.2	-172.2	0	0	0	0	0	110.4
205	A	34.1	Very low	32.9	Very low	103 Å²	103	125.5 Å²	125.5	85%	0.851	82%	0.815	S	S	*	*			cis	-164.8	174	-6.2	0	0	0	0	0	108.4
206	G	31.6	Very low	32.8	Very low	76 Å²	76	128.3 Å²	128.3	78%	0.784	82%	0.82	S	S	*	*			trans	138.7	127	154.9	0	0	0	0	0	116.9
207	P	53.1	Low	32.8	Very low	117 Å²	117	126.8 Å²	126.8	76%	0.76	81%	0.814	S	S	*	*			trans	-109.1	160.5	178.8	39.4	-32.6	0	0	0	114.8
208	Q	31.1	Very low	32.8	Very low	195 Å²	195	130.8 Å²	130.8	91%	0.911	82%	0.816	S	S	*	*			trans	-144.8	153.7	166.2	-74.4	-65.4	-90.1	0	0	110.8
209	E	30.3	Very low	32.5	Very low	183 Å²	183	131 Å²	131	86%	0.855	81%	0.813	S	S	*	*			trans	-110.4	155.5	-178.8	-54.9	168.9	113.9	0	0	111.4
210	F	26.9	Very low	32.2	Very low	207 Å²	207	134.2 Å²	134.2	91%	0.908	82%	0.816	S	S	*	*			trans	-160	168	138.4	-140.6	-101.5	0	0	0	113.3
211	S	30	Very low	32	Very low	88 Å²	88	137.4 Å²	137.4	62%	0.615	81%	0.814	S	S	*	*			trans	-127.2	150.4	-161.3	-56.5	0	0	0	0	115.3
212	S	28.3	Very low	31.8	Very low	112 Å²	112	137.9 Å²	137.9	78%	0.783	81%	0.805	S	S	*	*			trans	50.7	129	141.6	-55.6	0	0	0	0	122.7
213	Y	28.4	Very low	31.4	Very low	231 Å²	231	142.5 Å²	142.5	91%	0.906	81%	0.809	S	S	*	*			trans	-152.3	157.4	130.7	-135.7	-93.5	0	0	0	114.2
214	S	27.9	Very low	31.2	Very low	95 Å²	95	144.3 Å²	144.3	66%	0.664	80%	0.801	S	S	*	*			trans	-68.5	158.5	-179.2	-79	0	0	0	0	115
215	S	29.8	Very low	30.9	Very low	103 Å²	103	150.3 Å²	150.3	72%	0.72	80%	0.803	S	S	*	*			cis	109.6	97.8	11.9	82.6	0	0	0	0	116.6
216	L	30.6	Very low	30.7	Very low	186 Å²	186	153.4 Å²	153.4	97%	0.974	80%	0.8	S	S	*	*			trans	-168.1	148.5	159.6	-153.3	64.5	0	0	0	108.5
217	G	31.8	Very low	30.7	Very low	67 Å²	67	157.5 Å²	157.5	69%	0.691	80%	0.803	S	S	*	*			cis	-157	-167.6	-0.2	0	0	0	0	0	112.2
218	Q	32.5	Very low	30.5	Very low	175 Å²	175	157.7 Å²	157.7	82%	0.818	80%	0.804	S	S	*	*			trans	-104.4	151.3	-163.7	-62.7	156.2	-90.7	0	0	115.9
219	N	26.7	Very low	31.2	Very low	148 Å²	148	154.4 Å²	154.4	79%	0.791	80%	0.8	S	S	*	*				175.5	133.2	129.5	-83.9	-35.4	0	0	0	107.4
220	Q	29.6	Very low	31.3	Very low	169 Å²	169	152.6 Å²	152.6	79%	0.79	80%	0.796	S	S	*	*			cis	71.2	89.2	38.1	-70.3	-140.9	1.4	0	0	116.3
221	F	28.5	Very low	31.5	Very low	200 Å²	200	154.1 Å²	154.1	88%	0.877	80%	0.797	S	S	*	*			trans	-167.3	167.6	148.1	-87.1	-67.6	0	0	0	108.1
222	S	28.4	Very low	31.7	Very low	88 Å²	88	155.4 Å²	155.4	62%	0.615	80%	0.802	S	S	*	*				-148.8	132.1	-72.8	-88.8	0	0	0	0	109
223	Q	30	Very low	31.7	Very low	199 Å²	199	155.2 Å²	155.2	93%	0.93	80%	0.8	S	S	*	*			trans	-79.8	125.4	175.8	-75.7	-71.5	3.5	0	0	110.8
224	Y	29	Very low	31.6	Very low	187 Å²	187	150 Å²	150	73%	0.733	80%	0.798	S	S	*	*			trans	-118.6	97.6	-179.8	-106.1	-80.5	0	0	0	111.2
225	Y	30.8	Very low	31.9	Very low	228 Å²	228	151 Å²	151	89%	0.894	80%	0.8	S	S	*	*			trans	-155.6	139.8	142.4	-107.9	-75.7	0	0	0	108.1
226	H	30	Very low	32.4	Very low	168 Å²	168	151.8 Å²	151.8	78%	0.778	80%	0.803	S	S	*	*			trans	-105.3	141.8	-177.5	-81.3	12.8	0	0	0	111.6
227	L	32	Very low	32.8	Very low	162 Å²	162	148.8 Å²	148.8	85%	0.848	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-99.6	140	159.3	-81.5	74.5	0	0	0	109.3
228	P	47	Very low	32.9	Very low	120 Å²	120	151.3 Å²	151.3	78%	0.779	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-78.3	158.8	169.4	32.9	-33.8	0	0	0	112.1
229	P	47.3	Very low	32.9	Very low	127 Å²	127	147.9 Å²	147.9	83%	0.825	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-89.1	167.9	-168.2	35.4	-37.5	0	0	0	115.8
230	N	32.4	Very low	33	Very low	145 Å²	145	148.6 Å²	148.6	78%	0.775	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-51.5	146.9	179.8	-80.7	-21.3	0	0	0	116.1
231	Y	30.2	Very low	33.1	Very low	238 Å²	238	149.1 Å²	149.1	93%	0.933	81%	0.809	S	S	*	*			trans	-125.4	134.8	141.2	-124.3	-94.8	0	0	0	108.4
232	T	33.7	Very low	33.3	Very low	116 Å²	116	149.3 Å²	149.3	71%	0.712	81%	0.812	S	S	*	*			trans	-107	124.9	-172.6	47.1	0	0	0	0	113.2
233	S	28.4	Very low	33.3	Very low	108 Å²	108	148.5 Å²	148.5	76%	0.755	82%	0.818	S	S	*	*			trans	47.2	116.7	155.4	-161.3	0	0	0	0	120
234	S	26.4	Very low	33.3	Very low	121 Å²	121	145.5 Å²	145.5	85%	0.846	82%	0.819	S	S	*	*			trans	-141.5	97.2	142.4	49.8	0	0	0	0	110.6
235	T	34.6	Very low	33.3	Very low	116 Å²	116	139.9 Å²	139.9	71%	0.712	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-70.8	135.6	165.6	46.9	0	0	0	0	109.9	P237	T235-P237 WeakPolarHBondContact O-CD 3.48Å
236	P	41.1	Very low	33.4	Very low	120 Å²	120	136.1 Å²	136.1	78%	0.779	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-70.3	125.5	172.2	29.2	-32.8	0	0	0	110
237	P	39.4	Very low	33.4	Very low	122 Å²	122	132 Å²	132	79%	0.792	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-77.7	127.3	168.8	31	-31.1	0	0	0	109.8	T235	T235-P237 WeakPolarHBondContact O-CD 3.48Å
238	S	32	Very low	33.6	Very low	121 Å²	121	129.6 Å²	129.6	85%	0.846	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-61.3	136.4	159.4	-61.4	0	0	0	0	109
239	A	32.9	Very low	32.8	Very low	103 Å²	103	127.6 Å²	127.6	85%	0.851	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-87.8	116.7	175.3	0	0	0	0	0	109.9
240	D	29.1	Very low	32	Very low	162 Å²	162	126.1 Å²	126.1	87%	0.866	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-101.1	140.3	159	-91.6	-45.3	0	0	0	109.3
241	E	32.8	Very low	32	Very low	181 Å²	181	126 Å²	126	85%	0.846	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-74.6	146.2	-179.7	-61.4	174	78	0	0	112.1
242	H	31.7	Very low	32	Very low	204 Å²	204	118 Å²	118	94%	0.944	82%	0.818	S	S	*	*			trans	-142.3	103	156.2	-98.3	61.2	0	0	0	108.7
243	G	28.1	Very low	31.8	Very low	71 Å²	71	122.8 Å²	122.8	73%	0.732	83%	0.825	S	S	*	*			trans	-148.2	15.4	-159	0	0	0	0	0	119
244	S	30.4	Very low	31.8	Very low	136 Å²	136	122.9 Å²	122.9	95%	0.951	83%	0.826	S	S	*	*			trans	73	139.2	178	-163	0	0	0	0	116.7
245	G	29.7	Very low	32	Very low	69 Å²	69	121.2 Å²	121.2	71%	0.711	82%	0.819	S	S	*	*			trans	161	65.1	178	0	0	0	0	0	117.4
246	T	32.4	Very low	31.8	Very low	149 Å²	149	122.7 Å²	122.7	91%	0.914	83%	0.828	S	S	*	*			trans	-11.2	124.9	162.4	52.1	0	0	0	0	119.2
247	G	30.9	Very low	31.2	Very low	81 Å²	81	124.9 Å²	124.9	84%	0.835	83%	0.825	S	S	*	*			trans	-169.2	129.9	167.6	0	0	0	0	0	114.7
248	A	34.3	Very low	30.8	Very low	111 Å²	111	123 Å²	123	92%	0.917	82%	0.815	S	S	*	*			trans	-92.6	168.7	-170.4	0	0	0	0	0	115.3
249	G	31	Very low	30.8	Very low	78 Å²	78	123.8 Å²	123.8	80%	0.804	81%	0.805	S	S	*	*			trans	99.3	115.2	166.8	0	0	0	0	0	113.9
250	A	30.9	Very low	30.8	Very low	96 Å²	96	127.7 Å²	127.7	79%	0.793	81%	0.806	S	S	*	*			cis	90.4	98.6	22.5	0	0	0	0	0	116.7
251	V	32.2	Very low	30.9	Very low	143 Å²	143	124.4 Å²	124.4	87%	0.867	80%	0.801	S	S	*	*			trans	66.9	129.7	148.2	-170.7	0	0	0	0	119.7	Y253	V251-Y253 HydrophobicContact CG1-CD2 4.48Å
252	G	29.7	Very low	31	Very low	69 Å²	69	120.7 Å²	120.7	71%	0.711	80%	0.801	S	S	*	*			trans	-177	139.1	162.8	0	0	0	0	0	112.4
253	Y	29.8	Very low	30.9	Very low	217 Å²	217	117 Å²	117	85%	0.851	80%	0.799	S	S	*	*			trans	-135.1	156.1	-174.3	-78.4	-97.6	0	0	0	112.8	V251	V251-Y253 HydrophobicContact CG1-CD2 4.48Å
254	S	29	Very low	31.4	Very low	110 Å²	110	118.6 Å²	118.6	77%	0.769	81%	0.805	S	S	*	*			trans	71.4	107.4	150.3	-60.7	0	0	0	0	122.2
255	A	29.9	Very low	31.3	Very low	86 Å²	86	115.6 Å²	115.6	71%	0.711	80%	0.796	S	S	*	*				53.3	164.8	114.4	0	0	0	0	0	123.8
256	V	29.6	Very low	32.8	Very low	148 Å²	148	118.3 Å²	118.3	90%	0.897	80%	0.801	S	S	*	*			trans	67.2	145.9	167.9	-62.6	0	0	0	0	118
257	K	28.5	Very low	34	Very low	165 Å²	165	116.2 Å²	116.2	72%	0.717	79%	0.79	S	S	*	*			cis	-168.6	150.9	-7.7	150	-175.3	173.3	-167.5	0	110.7	E259	K257-E259 VanDerWaalsContact CE-OE1 3.27Å; K257-E259 WeakPolarHBondContact CE-OE1 3.32Å; K257-E259 IonicContact NZ-OE1 3.05Å; K257-E259 PolarHBondContact NZ-OE1 3.28Å
258	S	31.6	Very low	34.2	Very low	82 Å²	82	118.2 Å²	118.2	57%	0.573	79%	0.786	S	S	*	*			trans	68.7	166.9	153.8	-74.9	0	0	0	0	122.7
259	E	32.8	Very low	34.2	Very low	138 Å²	138	120 Å²	120	65%	0.645	78%	0.78	S	S	*	*			cis	-153.9	156.9	-5.6	-122.7	129.3	-138.5	0	0	112.2	K257	K257-E259 VanDerWaalsContact CE-OE1 3.27Å; K257-E259 WeakPolarHBondContact CE-OE1 3.32Å; K257-E259 IonicContact NZ-OE1 3.05Å; K257-E259 PolarHBondContact NZ-OE1 3.28Å
260	E	31.5	Very low	34.4	Very low	185 Å²	185	120.4 Å²	120.4	86%	0.864	78%	0.776	S	S	*	*			trans	55.6	158.6	150.7	-79.6	179.1	100.8	0	0	123
261	A	31.2	Very low	34.6	Very low	93 Å²	93	121.5 Å²	121.5	77%	0.769	78%	0.777	S	S	*	*			cis	-138.6	-178.7	13.6	0	0	0	0	0	114.3
262	A	36.4	Very low	36.1	Very low	103 Å²	103	120.2 Å²	120.2	85%	0.851	77%	0.772	S	S	*	*			trans	-139.4	178	-174.1	0	0	0	0	0	113.6
263	S	28.5	Very low	37	Very low	127 Å²	127	122.4 Å²	122.4	89%	0.888	77%	0.774	S	S	*	*			trans	-162.4	153.7	160.3	-165.9	0	0	0	0	114.2
264	A	38.3	Very low	37.1	Very low	104 Å²	104	120.4 Å²	120.4	86%	0.86	77%	0.772	S	S	*	*			trans	-164.6	152.3	172.5	0	0	0	0	0	111.6
265	G	28.7	Very low	37.3	Very low	74 Å²	74	122 Å²	122	76%	0.763	77%	0.772	S	S	*	*			trans	157.4	133.6	167.3	0	0	0	0	0	119.2
266	P	60.9	Low	38	Very low	125 Å²	125	123.2 Å²	123.2	81%	0.812	77%	0.773	S	S	*	*			trans	-112.8	-154.2	165.6	44.3	-33.7	0	0	0	110.7
267	P	57.8	Low	38.7	Very low	105 Å²	105	122.1 Å²	122.1	68%	0.682	77%	0.769	S	S	*	*			cis	-135.7	-135.1	-7.1	42.9	-21.2	0	0	0	114
268	T	35.2	Very low	38.9	Very low	123 Å²	123	119.4 Å²	119.4	76%	0.755	78%	0.777	S	S	*	*			trans	82.4	154.5	171.5	74.2	0	0	0	0	117
269	D	34.3	Very low	38.8	Very low	150 Å²	150	119.7 Å²	119.7	80%	0.802	79%	0.793	S	S	*	*			cis	-156.9	-162	1	-145.5	-100.4	0	0	0	114.2
270	A	35.6	Very low	38.7	Very low	86 Å²	86	117.2 Å²	117.2	71%	0.711	81%	0.805	S	S	*	*			trans	90.3	149.3	163.1	0	0	0	0	0	120.6
271	S	36.3	Very low	38.7	Very low	118 Å²	118	113.1 Å²	113.1	83%	0.825	80%	0.802	S	S	*	*			trans	-158.2	-149.4	-165.4	-66.5	0	0	0	0	113.6
272	P	61.6	Low	38.8	Very low	116 Å²	116	119.7 Å²	119.7	75%	0.753	81%	0.807	S	S	*	*				-118.4	-168	-92	40.5	-24.8	0	0	0	113.7
273	P	49.7	Very low	38.7	Very low	115 Å²	115	121.2 Å²	121.2	75%	0.747	80%	0.801	S	S	*	*				-147	-170.2	96.9	46	-30.7	0	0	0	112.4
274	E	31.6	Very low	39	Very low	176 Å²	176	123.6 Å²	123.6	82%	0.822	80%	0.798	S	S	*	*			cis	-140.6	-109.8	-1.6	-155.4	-173.8	117.1	0	0	113.6
275	N	34.4	Very low	38.6	Very low	142 Å²	142	124.8 Å²	124.8	76%	0.759	79%	0.79	S	S	*	*			trans	-169.2	-177.7	-170.5	-106.5	-41.5	0	0	0	109.8
276	P	44.5	Very low	38.8	Very low	112 Å²	112	129.4 Å²	129.4	73%	0.727	79%	0.792	S	S	*	*			cis	-120.4	-176.7	-1.9	43.8	-30.5	0	0	0	113
277	P	43.5	Very low	37.3	Very low	126 Å²	126	129.6 Å²	129.6	82%	0.818	79%	0.79	S	S	*	*				-146.5	170	92.6	39.8	-24.8	0	0	0	114.9
278	A	33.3	Very low	35.9	Very low	108 Å²	108	128 Å²	128	89%	0.893	79%	0.792	S	S	*	*			trans	-148.5	130.7	168.5	0	0	0	0	0	113
279	G	29.5	Very low	35.7	Very low	87 Å²	87	134.1 Å²	134.1	90%	0.897	80%	0.802	S	S	*	*			trans	110.5	139.8	162.7	0	0	0	0	0	117
280	G	29	Very low	35.7	Very low	87 Å²	87	138.3 Å²	138.3	90%	0.897	81%	0.806	S	S	*	*			trans	114.8	90	163.5	0	0	0	0	0	115.9
281	A	32.8	Very low	35.4	Very low	98 Å²	98	142 Å²	142	81%	0.81	81%	0.814	S	S	*	*			trans	-83.1	146.2	178.2	0	0	0	0	0	113.8
282	R	33.7	Very low	35.2	Very low	231 Å²	231	142.2 Å²	142.2	87%	0.872	82%	0.815	S	S	*	*				-177.4	152.8	117.4	-100.6	-179.1	175.6	153.7	-0.1	114.6
283	D	34.1	Very low	34.1	Very low	135 Å²	135	144.1 Å²	144.1	72%	0.722	83%	0.825	S	S	*	*			trans	17.5	112.6	155.7	-51.6	-66	0	0	0	120.7
284	Q	33.5	Very low	33.2	Very low	177 Å²	177	142 Å²	142	83%	0.827	82%	0.824	S	S	*	*				-167.6	145.1	112.8	-110.7	-177.5	-41.6	0	0	115.5
285	D	31.4	Very low	33.6	Very low	129 Å²	129	144 Å²	144	69%	0.69	83%	0.83	S	S	*	*			trans	51.7	129.5	149.7	-58.4	-37.1	0	0	0	126
286	E	31.4	Very low	33.6	Very low	172 Å²	172	143 Å²	143	80%	0.804	83%	0.834	S	S	*	*			trans	51.8	117.5	141.9	-66.9	-121.2	94.6	0	0	124.2
287	V	31.1	Very low	33.6	Very low	129 Å²	129	148 Å²	148	78%	0.782	84%	0.844	S	S	*	*			trans	68.6	110.3	130.9	-178.4	0	0	0	0	119.6
288	G	27.4	Very low	33.1	Very low	70 Å²	70	146.7 Å²	146.7	72%	0.722	84%	0.844	S	S	*	*				131.6	94.3	117.7	0	0	0	0	0	118
289	R	30.7	Very low	33.8	Very low	253 Å²	253	151.6 Å²	151.6	96%	0.955	85%	0.845	S	S	*	*			trans	-128.7	124.9	148	-78	-166.9	171.8	-168.6	-2.3	111
290	R	34.5	Very low	34	Very low	237 Å²	237	152 Å²	152	89%	0.894	84%	0.84	S	S	*	*			trans	-69.1	147.2	172.3	-69.6	172.9	169.4	160.7	-3.6	110.2
291	N	30.1	Very low	34.8	Very low	163 Å²	163	157.6 Å²	157.6	87%	0.872	84%	0.84	S	S	*	*				-177.3	120.1	117.2	-93.5	-13	0	0	0	112.6
292	S	31.4	Very low	34.9	Very low	123 Å²	123	162.2 Å²	162.2	86%	0.86	84%	0.842	S	S	*	*			trans	-168.6	150.8	148.8	47.2	0	0	0	0	110.2
293	V	39	Very low	34.7	Very low	157 Å²	157	156.7 Å²	156.7	95%	0.952	84%	0.838	S	S	*	*			trans	-85.9	132.4	177.6	170.5	0	0	0	0	109.7
294	G	30.8	Very low	34.7	Very low	71 Å²	71	156.6 Å²	156.6	73%	0.732	84%	0.838	S	S	*	*			trans	-161.2	140	176.5	0	0	0	0	0	113.2
295	K	39.4	Very low	34.9	Very low	217 Å²	217	151.9 Å²	151.9	94%	0.943	84%	0.837	S	S	*	*			trans	-86.3	124.3	176.1	-70.3	174.1	176.2	174	0	110.7
296	S	34.3	Very low	35.2	Very low	120 Å²	120	149.9 Å²	149.9	84%	0.839	83%	0.833	S	S	*	*			trans	-157.3	144.2	157.1	50.3	0	0	0	0	113.3
297	K	45.3	Very low	35.6	Very low	219 Å²	219	147 Å²	147	95%	0.952	83%	0.829	S	S	*	*			trans	-89	115.4	-173.4	171.3	-174.1	178.1	-178.9	0	110.7
298	A	33.4	Very low	35.9	Very low	98 Å²	98	146.9 Å²	146.9	81%	0.81	83%	0.831	S	S	*	*			trans	-137.3	144.4	176.3	0	0	0	0	0	113	A300	A298-A300 PolarHBondContact O-N 2.88Å
299	K	47.1	Very low	36.7	Very low	211 Å²	211	146.4 Å²	146.4	92%	0.917	82%	0.82	S	S	*	*			trans	-82.1	106.9	-168.3	-178.2	-179.5	-178.1	179.4	0	111.6	K301	K299-K301 PolarHBondContact O-N 3.34Å
300	A	33.4	Very low	37.7	Very low	96 Å²	96	137.9 Å²	137.9	79%	0.793	80%	0.8	S	S	*	*			trans	-79.2	104	178	0	0	0	0	0	112	A298 K302	A298-A300 PolarHBondContact O-N 2.88Å; A300-K302 PolarHBondContact O-N 3.24Å
301	K	46.4	Very low	38.7	Very low	203 Å²	203	132 Å²	132	88%	0.883	79%	0.794	S	S	*	*			trans	-80.7	97.5	162.3	-177.6	-175.5	179.4	-173.7	0	107.3	K299	K299-K301 PolarHBondContact O-N 3.34Å
302	K	33.9	Very low	41.3	Very low	196 Å²	196	129.6 Å²	129.6	85%	0.852	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-65.5	135	172	-79.5	-170.2	172.4	-173.2	0	109.3	A300	A300-K302 PolarHBondContact O-N 3.24Å
303	S	30.2	Very low	44.2	Very low	115 Å²	115	124.8 Å²	124.8	80%	0.804	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-78.9	158.9	173.7	49.9	0	0	0	0	111.3
304	D	34.7	Very low	46.9	Very low	132 Å²	132	122.5 Å²	122.5	71%	0.706	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-51.5	152.2	176.8	-151.4	-66.7	0	0	0	113.6	S306	D304-S306 WeakPolarHBondContact OD1-CB 3.22Å; D304-S306 PolarHBondContact OD1-N 2.93Å; D304-S306 PolarHBondContact OD1-OG 2.88Å
305	G	36.9	Very low	50	Low	79 Å²	79	122 Å²	122	81%	0.814	70%	0.701	S	S	*	*			trans	-97.7	4.2	178.8	0	0	0	0	0	114.5
306	S	37.2	Very low	52.8	Low	87 Å²	87	111.7 Å²	111.7	61%	0.608	66%	0.656	S	S	*	*			trans	-56.1	130.8	176.8	-64.2	0	0	0	0	111.8	D304	D304-S306 WeakPolarHBondContact OD1-CB 3.22Å; D304-S306 PolarHBondContact OD1-N 2.93Å; D304-S306 PolarHBondContact OD1-OG 2.88Å
307	P	39.9	Very low	55.9	Low	111 Å²	111	106 Å²	106	72%	0.721	62%	0.616	S	S	*	*			trans	-63.6	148.3	169.3	28.9	-34.2	0	0	0	109.4	A309	P307-A309 PolarHBondContact O-N 2.92Å
308	P	37.1	Very low	58.5	Low	127 Å²	127	95.6 Å²	95.6	83%	0.825	57%	0.571	S	S	*	*			trans	-62.5	113.7	174.9	26.6	-32.9	0	0	0	109	S310	P308-S310 PolarHBondContact O-N 3.48Å
309	A	45.6	Very low	61.6	Low	59 Å²	59	91 Å²	91	49%	0.488	53%	0.533	S	S	.	.			trans	-55.9	136.7	169.3	0	0	0	0	0	108.7	P307 S311	P307-A309 PolarHBondContact O-N 2.92Å; A309-S311 PolarHBondContact O-N 2.73Å
310	S	51.6	Low	64.1	Low	75 Å²	75	81.4 Å²	81.4	52%	0.524	49%	0.492	S	S	.	.			trans	-54.5	114.3	-176.1	31.1	0	0	0	0	110.5	P308 D312	P308-S310 PolarHBondContact O-N 3.48Å; S310-D312 PolarHBondContact O-N 3.27Å
311	S	55.6	Low	67.2	Low	112 Å²	112	76.8 Å²	76.8	78%	0.783	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-5.3	-174.7	44.9	0	0	0	0	114.6	A309	A309-S311 PolarHBondContact O-N 2.73Å
312	D	84.3	Confident	69.6	Low	113 Å²	113	68 Å²	68	60%	0.604	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.8	8.2	-161.3	-49.2	-8.3	0	0	0	111.5	S310 E314 K487	S310-D312 PolarHBondContact O-N 3.27Å; D312-E314 PolarHBondContact O-N 2.96Å; D312-K487 WeakPolarHBondContact O-CG 3.18Å
313	L	92.6	Very high	72.7	Confident	23 Å²	23	60.1 Å²	60.1	12%	0.12	38%	0.383	C	S	.	.			trans	-67.3	125.1	173.6	-70.5	166.2	0	0	0	110.5	K487 M489 F538 V542	L313-K487 WeakPolarHBondContact CA-O 3.34Å; L313-M489 HydrophobicContact CD1-CE 3.41Å; L313-M489 VanDerWaalsContact CD1-CE 3.41Å; L313-M489 HydrophobicContact CD2-CB 4.36Å; L313-M489 HydrophobicContact CD2-CE 3.93Å; L313-M489 HydrophobicContact CG-CE 4.34Å; L313-F538 HydrophobicContact CD1-CD1 4.11Å; L313-V542 HydrophobicContact CB-CG2 4.2Å
314	E	94.6	Very high	76	Confident	109 Å²	109	54.7 Å²	54.7	51%	0.509	34%	0.344	S	S	.	.			trans	-98.4	-32.7	177.9	-77.8	170	177.6	0	0	111.6	D312 K487 T543	D312-E314 PolarHBondContact O-N 2.96Å; E314-K487 HydrophobicContact CB-CB 4.32Å; E314-K487 HydrophobicContact CG-CD 3.94Å; E314-K487 PolarHBondContact N-O 2.96Å; E314-K487 IonicContact OE1-NZ 2.63Å; E314-K487 PolarHBondContact OE1-NZ 3.34Å; E314-K487 WeakPolarHBondContact OE2-CD 3.45Å; E314-K487 IonicContact OE2-NZ 3.04Å; E314-K487 PolarHBondContact OE2-NZ 3.4Å; E314-T543 WeakPolarHBondContact O-CB 3.46Å; E314-T543 PolarHBondContact O-N 3.02Å; E314-T543 PolarHBondContact O-OG1 2.95Å
315	R	97.2	Very high	79	Confident	61 Å²	61	48.4 Å²	48.4	23%	0.23	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	142.3	-175.3	-159.6	169.3	-70.7	131.8	-0.2	113.8	F317 K487 C488 M489 T543 V545 L585	R315-F317 HydrophobicContact CB-CE2 4.28Å; R315-F317 HydrophobicContact CG-CD2 4.42Å; R315-F317 HydrophobicContact CG-CE2 3.87Å; R315-F317 HydrophobicContact CG-CZ 4.02Å; R315-K487 PolarHBondContact N-O 2.96Å; R315-C488 VanDerWaalsContact O-CA 3.28Å; R315-C488 WeakPolarHBondContact O-CA 3.45Å; R315-M489 PolarHBondContact O-N 3.04Å; R315-T543 CarbonylContact C-O 3.57Å; R315-T543 VanDerWaalsContact CA-O 3.23Å; R315-T543 WeakPolarHBondContact CA-O 3.22Å; R315-T543 HydrophobicContact CG-CG2 4.36Å; R315-T543 WeakPolarHBondContact CG-O 3.4Å; R315-V545 HydrophobicContact CG-CG2 4.14Å; R315-L585 WeakPolarHBondContact CD-OXT 3.43Å; R315-L585 PolarHBondContact NE-OXT 2.45Å; R315-L585 PolarHBondContact NH1-O 3.23Å; R315-L585 VanDerWaalsContact NH1-O 3.11Å; R315-L585 PolarHBondContact NH1-OXT 3.31Å
316	V	98.4	Very high	82	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	130.5	173.8	163	0	0	0	0	108.7	L318 M489 V491 F538 V542 T543 Y544 V545	V316-L318 HydrophobicContact CG1-CD2 3.49Å; V316-L318 VanDerWaalsContact CG1-CD2 3.49Å; V316-L318 HydrophobicContact CG1-CG 4.44Å; V316-M489 WeakPolarHBondContact CA-O 3.16Å; V316-M489 HydrophobicContact CG2-CB 4.27Å; V316-M489 HydrophobicContact CG2-CE 4.05Å; V316-V491 HydrophobicContact CG1-CB 4.39Å; V316-V491 HydrophobicContact CG1-CG2 3.79Å; V316-F538 HydrophobicContact CG2-CD2 4.28Å; V316-F538 HydrophobicContact CG2-CG 4.39Å; V316-V542 HydrophobicContact CB-CG1 3.96Å; V316-V542 HydrophobicContact CG2-CG1 3.71Å; V316-T543 PolarHBondContact N-O 3.41Å; V316-Y544 HydrophobicContact CB-CD1 3.89Å; V316-Y544 HydrophobicContact CB-CE1 4.01Å; V316-Y544 HydrophobicContact CG1-CD1 3.9Å; V316-Y544 HydrophobicContact CG1-CE1 4.06Å; V316-Y544 WeakPolarHBondContact O-CA 3.27Å; V316-V545 PolarHBondContact O-N 3.41Å
317	F	98.8	Very high	84.9	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	117.4	-179.6	-64.5	-94.8	0	0	0	109.5	R315 I482 C488 M489 V491 V545 I547 L580 L585	R315-F317 HydrophobicContact CB-CE2 4.28Å; R315-F317 HydrophobicContact CG-CD2 4.42Å; R315-F317 HydrophobicContact CG-CE2 3.87Å; R315-F317 HydrophobicContact CG-CZ 4.02Å; F317-I482 HydrophobicContact CB-CD1 4.19Å; F317-I482 HydrophobicContact CD1-CD1 3.78Å; F317-I482 HydrophobicContact CD1-CG1 4.48Å; F317-I482 HydrophobicContact CD2-CB 4.32Å; F317-I482 HydrophobicContact CD2-CD1 3.85Å; F317-I482 HydrophobicContact CD2-CG1 3.94Å; F317-I482 HydrophobicContact CD2-CG2 3.4Å; F317-I482 HydrophobicContact CE1-CD1 4Å; F317-I482 HydrophobicContact CE1-CG1 4.32Å; F317-I482 HydrophobicContact CE2-CB 4.35Å; F317-I482 HydrophobicContact CE2-CD1 4.07Å; F317-I482 HydrophobicContact CE2-CG1 3.76Å; F317-I482 HydrophobicContact CE2-CG2 3.68Å; F317-I482 HydrophobicContact CG-CD1 3.67Å; F317-I482 HydrophobicContact CG-CG1 4.27Å; F317-I482 HydrophobicContact CG-CG2 4.2Å; F317-I482 HydrophobicContact CZ-CD1 4.11Å; F317-I482 HydrophobicContact CZ-CG1 3.93Å; F317-C488 HydrophobicContact CE2-CB 4.02Å; F317-M489 PolarHBondContact N-O 3.09Å; F317-V491 PolarHBondContact O-N 2.83Å; F317-V491 VanDerWaalsContact O-O 3.12Å; F317-V545 CarbonylContact C-O 3.56Å; F317-V545 WeakPolarHBondContact CA-O 3.44Å; F317-V545 HydrophobicContact CD1-CB 3.84Å; F317-V545 HydrophobicContact CD1-CG1 4.2Å; F317-V545 HydrophobicContact CD1-CG2 4.42Å; F317-V545 HydrophobicContact CE1-CB 4.1Å; F317-V545 HydrophobicContact CE1-CG1 4.37Å; F317-V545 HydrophobicContact CE1-CG2 4.23Å; F317-I547 HydrophobicContact CB-CD1 4.4Å; F317-I547 HydrophobicContact CD1-CD1 3.9Å; F317-L580 HydrophobicContact CE1-CD2 3.79Å; F317-L580 HydrophobicContact CZ-CD2 3.65Å; F317-L585 WeakPolarHBondContact CZ-OXT 3.42Å
318	L	98.9	Very high	87.7	Confident	1 Å²	1	36.1 Å²	36.1	1%	0.005	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	98	-178.7	-51.2	-171.1	0	0	0	108.7	V316 V491 F531 I534 Y544 V545 V546 I547 M562	V316-L318 HydrophobicContact CG1-CD2 3.49Å; V316-L318 VanDerWaalsContact CG1-CD2 3.49Å; V316-L318 HydrophobicContact CG1-CG 4.44Å; L318-V491 HydrophobicContact CD2-CB 3.86Å; L318-V491 HydrophobicContact CD2-CG1 4.08Å; L318-V491 HydrophobicContact CD2-CG2 4.45Å; L318-F531 HydrophobicContact CB-CE1 4.18Å; L318-F531 HydrophobicContact CB-CZ 4.42Å; L318-F531 HydrophobicContact CD1-CD1 3.72Å; L318-F531 HydrophobicContact CD1-CD2 4.29Å; L318-F531 HydrophobicContact CD1-CE1 3.94Å; L318-F531 HydrophobicContact CD1-CE2 4.49Å; L318-F531 HydrophobicContact CD1-CG 3.92Å; L318-F531 HydrophobicContact CD1-CZ 4.33Å; L318-I534 HydrophobicContact CD2-CD1 4.33Å; L318-I534 HydrophobicContact CD2-CG2 3.73Å; L318-Y544 HydrophobicContact CD1-CD1 4.28Å; L318-Y544 HydrophobicContact CD2-CD1 4.42Å; L318-Y544 HydrophobicContact CG-CD1 4.48Å; L318-V545 PolarHBondContact N-O 3.32Å; L318-V546 HydrophobicContact CB-CG2 4.2Å; L318-V546 HydrophobicContact CD1-CG2 4.16Å; L318-V546 HydrophobicContact CG-CG2 4.48Å; L318-V546 CarbonylContact O-C 3.57Å; L318-V546 WeakPolarHBondContact O-CA 3.36Å; L318-I547 PolarHBondContact O-N 2.98Å; L318-M562 HydrophobicContact CD1-CE 4.36Å; L318-M562 HydrophobicContact CD1-SD 3.96Å
319	W	98.9	Very high	90.5	Very high	2 Å²	2	35.4 Å²	35.4	1%	0.008	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	140.6	-178.1	-67.1	86	0	0	0	111.6	T324 I325 L479 I482 N490 V491 L492 V493 F514 I547 L576	W319-T324 HydrophobicContact CE3-CG2 4.16Å; W319-I325 HydrophobicContact CB-CD1 3.79Å; W319-I325 HydrophobicContact CD2-CD1 4.01Å; W319-I325 HydrophobicContact CD2-CG1 4.22Å; W319-I325 HydrophobicContact CE3-CD1 3.84Å; W319-I325 HydrophobicContact CE3-CG1 3.53Å; W319-I325 HydrophobicContact CG-CD1 4.05Å; W319-I325 HydrophobicContact CZ3-CG1 3.99Å; W319-L479 HydrophobicContact CD2-CD2 3.87Å; W319-L479 HydrophobicContact CE3-CD2 4.49Å; W319-L479 HydrophobicContact CG-CD2 4.26Å; W319-L479 HydrophobicContact CH2-CD2 4.19Å; W319-L479 HydrophobicContact CH2-CG 4.15Å; W319-L479 HydrophobicContact CZ2-CD2 3.53Å; W319-L479 HydrophobicContact CZ2-CG 3.87Å; W319-I482 HydrophobicContact CZ2-CD1 3.8Å; W319-N490 PolarHBondContact NE1-OD1 2.92Å; W319-V491 PolarHBondContact N-O 3.3Å; W319-L492 HydrophobicContact CB-CD1 4.15Å; W319-V493 PolarHBondContact O-N 3.4Å; W319-F514 HydrophobicContact CB-CZ 4.43Å; W319-F514 HydrophobicContact CG-CZ 4.38Å; W319-I547 CarbonylContact C-O 3.51Å; W319-I547 WeakPolarHBondContact CA-O 2.88Å; W319-I547 HydrophobicContact CD2-CB 4.17Å; W319-I547 HydrophobicContact CD2-CD1 3.85Å; W319-I547 HydrophobicContact CD2-CG2 4.32Å; W319-I547 HydrophobicContact CE3-CB 3.98Å; W319-I547 HydrophobicContact CE3-CD1 4.16Å; W319-I547 HydrophobicContact CE3-CG2 3.65Å; W319-I547 HydrophobicContact CH2-CD1 4.01Å; W319-I547 HydrophobicContact CH2-CG2 4.42Å; W319-I547 HydrophobicContact CZ2-CD1 3.65Å; W319-I547 HydrophobicContact CZ3-CB 4.43Å; W319-I547 HydrophobicContact CZ3-CD1 4.24Å; W319-I547 HydrophobicContact CZ3-CG2 3.71Å; W319-L576 HydrophobicContact CH2-CD2 3.57Å; W319-L576 HydrophobicContact CZ2-CD2 4.34Å; W319-L576 HydrophobicContact CZ3-CD2 4.02Å
320	D	98.9	Very high	93	Very high	8 Å²	8	33 Å²	33	4%	0.043	18%	0.178	C	C	.	.			trans	-77	164	150.7	-165.1	78.6	0	0	0	110.9	D322 T324 I325 K527 I547	D320-D322 PolarHBondContact OD2-N 3.36Å; D320-T324 HydrophobicContact CB-CG2 4.4Å; D320-I325 WeakPolarHBondContact O-CD1 3.01Å; D320-I325 WeakPolarHBondContact O-CG1 3.37Å; D320-K527 VanDerWaalsContact OD1-CE 3.29Å; D320-K527 WeakPolarHBondContact OD1-CE 3.34Å; D320-K527 IonicContact OD1-NZ 2.79Å; D320-K527 PolarHBondContact OD1-NZ 3.42Å; D320-I547 PolarHBondContact N-O 3.22Å
321	L	98.8	Very high	95.2	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.153	C	C	.	.			trans	-95.6	-60.3	179	-179.6	58.9	0	0	0	112.2	I325 I326 L492 T494 K504 V505 L510	L321-I325 PolarHBondContact O-N 3.02Å; L321-I326 HydrophobicContact CD1-CD1 4.03Å; L321-I326 HydrophobicContact CD1-CG1 4.1Å; L321-I326 HydrophobicContact CD1-CG2 3.93Å; L321-I326 HydrophobicContact CD2-CD1 4.37Å; L321-I326 HydrophobicContact CG-CD1 3.9Å; L321-I326 HydrophobicContact CG-CG1 4.08Å; L321-I326 WeakPolarHBondContact O-CG1 3.47Å; L321-I326 PolarHBondContact O-N 3.46Å; L321-L492 HydrophobicContact CB-CD1 3.98Å; L321-L492 HydrophobicContact CB-CD2 4.38Å; L321-L492 HydrophobicContact CB-CG 4.43Å; L321-L492 HydrophobicContact CD1-CD1 4.38Å; L321-L492 HydrophobicContact CD1-CD2 4.21Å; L321-L492 HydrophobicContact CD2-CD2 4.42Å; L321-T494 HydrophobicContact CD2-CG2 4.36Å; L321-K504 HydrophobicContact CD2-CB 3.98Å; L321-K504 HydrophobicContact CD2-CD 3.7Å; L321-V505 HydrophobicContact CD1-CG2 4.39Å; L321-L510 HydrophobicContact CD1-CD1 3.8Å
322	D	98.3	Very high	97.3	Very high	18 Å²	18	25.7 Å²	25.7	10%	0.096	12%	0.124	C	C	.	.	B	Isolated β-bridge	trans	-86.8	129.4	-163	-71.3	-86.7	0	0	0	109.6	D320 T324 T494 T496 K504	D320-D322 PolarHBondContact OD2-N 3.36Å; D322-T324 PolarHBondContact O-N 3.04Å; D322-T494 PolarHBondContact OD2-OG1 2.95Å; D322-T496 PolarHBondContact OD2-OG1 2.86Å; D322-K504 IonicContact OD1-NZ 2.6Å; D322-K504 PolarHBondContact OD1-NZ 3.08Å; D322-K504 IonicContact OD2-NZ 3.63Å; D322-K504 PolarHBondContact OD2-NZ 2.83Å
323	E	98.1	Very high	97.9	Very high	31 Å²	31	23.7 Å²	23.7	15%	0.145	12%	0.116	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.2	5.6	-172.5	-43.8	-46.5	142.3	0	0	115.4	I326 I327 F328 H329 S330 W471	E323-I326 VanDerWaalsContact CA-O 3.3Å; E323-I326 WeakPolarHBondContact CA-O 3.46Å; E323-I326 PolarHBondContact N-O 2.64Å; E323-I327 WeakPolarHBondContact OE2-CD1 3.49Å; E323-F328 PolarHBondContact OE1-N 3.11Å; E323-H329 PolarHBondContact OE1-N 3.15Å; E323-S330 PolarHBondContact OE1-N 3.41Å; E323-S330 PolarHBondContact OE1-OG 2.63Å; E323-S330 WeakPolarHBondContact OE2-CB 3.47Å; E323-S330 PolarHBondContact OE2-OG 3.36Å; E323-W471 WeakPolarHBondContact O-CZ2 3.49Å
324	T	98.8	Very high	98.1	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.7	-65.3	175.3	-63.6	0	0	0	0	111.2	W319 D320 D322 W471 I547 G548 D549 I567	W319-T324 HydrophobicContact CE3-CG2 4.16Å; D320-T324 HydrophobicContact CB-CG2 4.4Å; D322-T324 PolarHBondContact O-N 3.04Å; T324-W471 PolarHBondContact O-NE1 3.02Å; T324-I547 HydrophobicContact CG2-CG2 4.19Å; T324-G548 WeakPolarHBondContact OG1-CA 3.36Å; T324-D549 PolarHBondContact OG1-N 2.97Å; T324-D549 PolarHBondContact OG1-OD1 3.26Å; T324-I567 HydrophobicContact CG2-CG1 4.23Å
325	I	98.9	Very high	98.3	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.6	-44.5	175.3	-63.6	169.7	0	0	0	110.6	W319 D320 L321 L472 A475 L479 L492 L510 F514	W319-I325 HydrophobicContact CB-CD1 3.79Å; W319-I325 HydrophobicContact CD2-CD1 4.01Å; W319-I325 HydrophobicContact CD2-CG1 4.22Å; W319-I325 HydrophobicContact CE3-CD1 3.84Å; W319-I325 HydrophobicContact CE3-CG1 3.53Å; W319-I325 HydrophobicContact CG-CD1 4.05Å; W319-I325 HydrophobicContact CZ3-CG1 3.99Å; D320-I325 WeakPolarHBondContact O-CD1 3.01Å; D320-I325 WeakPolarHBondContact O-CG1 3.37Å; L321-I325 PolarHBondContact O-N 3.02Å; I325-L472 HydrophobicContact CG2-CD1 4.16Å; I325-A475 HydrophobicContact CG2-CB 4.16Å; I325-L479 HydrophobicContact CD1-CD1 4.1Å; I325-L479 HydrophobicContact CD1-CD2 4.27Å; I325-L479 HydrophobicContact CG1-CD1 4.3Å; I325-L479 HydrophobicContact CG2-CD1 3.86Å; I325-L492 HydrophobicContact CD1-CD1 3.83Å; I325-L510 HydrophobicContact CG2-CD1 3.69Å; I325-L510 HydrophobicContact CG2-CD2 3.72Å; I325-L510 HydrophobicContact CG2-CG 4.37Å; I325-F514 HydrophobicContact CD1-CE2 3.91Å; I325-F514 HydrophobicContact CD1-CZ 3.7Å
326	I	98.7	Very high	98.3	Very high	1 Å²	1	18.8 Å²	18.8	1%	0.005	11%	0.105	C	C	.	.	B	Isolated β-bridge	trans	-111.7	147.8	-179.1	73.3	173	0	0	0	110	L321 E323 F328 L472 K504 Y508 L510	L321-I326 HydrophobicContact CD1-CD1 4.03Å; L321-I326 HydrophobicContact CD1-CG1 4.1Å; L321-I326 HydrophobicContact CD1-CG2 3.93Å; L321-I326 HydrophobicContact CD2-CD1 4.37Å; L321-I326 HydrophobicContact CG-CD1 3.9Å; L321-I326 HydrophobicContact CG-CG1 4.08Å; L321-I326 WeakPolarHBondContact O-CG1 3.47Å; L321-I326 PolarHBondContact O-N 3.46Å; E323-I326 VanDerWaalsContact CA-O 3.3Å; E323-I326 WeakPolarHBondContact CA-O 3.46Å; E323-I326 PolarHBondContact N-O 2.64Å; I326-F328 HydrophobicContact CD1-CB 3.98Å; I326-F328 HydrophobicContact CG1-CB 4.26Å; I326-L472 HydrophobicContact CG2-CD1 4.12Å; I326-K504 HydrophobicContact CD1-CB 4.41Å; I326-K504 HydrophobicContact CD1-CD 4.14Å; I326-K504 HydrophobicContact CD1-CG 4.45Å; I326-Y508 HydrophobicContact CB-CD1 3.66Å; I326-Y508 HydrophobicContact CB-CE1 3.64Å; I326-Y508 HydrophobicContact CB-CG 4.21Å; I326-Y508 HydrophobicContact CD1-CD2 4.11Å; I326-Y508 HydrophobicContact CD1-CE1 4.35Å; I326-Y508 HydrophobicContact CD1-CE2 3.92Å; I326-Y508 HydrophobicContact CD1-CG 4.4Å; I326-Y508 HydrophobicContact CG1-CE1 4.49Å; I326-Y508 HydrophobicContact CG2-CD1 3.41Å; I326-Y508 VanDerWaalsContact CG2-CD1 3.41Å; I326-Y508 HydrophobicContact CG2-CD2 4.37Å; I326-Y508 HydrophobicContact CG2-CE1 3.96Å; I326-Y508 HydrophobicContact CG2-CG 3.63Å; I326-L510 HydrophobicContact CG2-CD1 3.81Å
327	I	98.6	Very high	98.2	Very high	6 Å²	6	19 Å²	19	3%	0.031	11%	0.106	C	C	.	.			trans	-95.6	123.9	163	-58.1	-53.9	0	0	0	107	E323 S330 L331 Y336 T468 W471 Y508	E323-I327 WeakPolarHBondContact OE2-CD1 3.49Å; I327-S330 VanDerWaalsContact CG2-OG 3.27Å; I327-S330 WeakPolarHBondContact CG2-OG 3.38Å; I327-L331 HydrophobicContact CG2-CD2 3.6Å; I327-L331 HydrophobicContact CG2-CG 3.92Å; I327-Y336 HydrophobicContact CD1-CD2 3.95Å; I327-Y336 HydrophobicContact CD1-CE2 3.75Å; I327-Y336 HydrophobicContact CG1-CD2 4.11Å; I327-Y336 HydrophobicContact CG1-CE2 3.75Å; I327-Y336 HydrophobicContact CG2-CD2 3.56Å; I327-Y336 HydrophobicContact CG2-CE2 3.98Å; I327-Y336 HydrophobicContact CG2-CG 4.11Å; I327-T468 HydrophobicContact CB-CG2 3.77Å; I327-T468 HydrophobicContact CG1-CG2 3.93Å; I327-T468 HydrophobicContact CG2-CG2 3.75Å; I327-W471 HydrophobicContact CD1-CD2 3.56Å; I327-W471 HydrophobicContact CD1-CE3 4.01Å; I327-W471 HydrophobicContact CD1-CG 3.87Å; I327-W471 HydrophobicContact CD1-CH2 4.39Å; I327-W471 HydrophobicContact CD1-CZ2 3.96Å; I327-W471 HydrophobicContact CD1-CZ3 4.41Å; I327-W471 HydrophobicContact CG1-CB 4.02Å; I327-W471 HydrophobicContact CG1-CD2 3.88Å; I327-W471 HydrophobicContact CG1-CE3 4.44Å; I327-W471 HydrophobicContact CG1-CG 3.66Å; I327-Y508 PolarHBondContact O-OH 3.43Å
328	F	98.4	Very high	98.2	Very high	12 Å²	12	27 Å²	27	5%	0.053	14%	0.144	C	C	.	.			trans	-151.9	-63.1	-178.3	178.4	-113.5	0	0	0	113.2	E323 I326 S330 L331 L332 M354 E355 I358	E323-F328 PolarHBondContact OE1-N 3.11Å; I326-F328 HydrophobicContact CD1-CB 3.98Å; I326-F328 HydrophobicContact CG1-CB 4.26Å; F328-S330 VanDerWaalsContact C-N 3.26Å; F328-S330 PolarHBondContact O-N 2.95Å; F328-L331 VanDerWaalsContact O-CB 3.22Å; F328-L331 WeakPolarHBondContact O-CB 3.49Å; F328-L331 PolarHBondContact O-N 3.39Å; F328-L331 VanDerWaalsContact O-N 3.09Å; F328-L332 HydrophobicContact CE1-CD1 4.15Å; F328-L332 HydrophobicContact CE2-CD1 4.31Å; F328-L332 HydrophobicContact CZ-CD1 3.88Å; F328-L332 PolarHBondContact O-N 3.49Å; F328-M354 HydrophobicContact CD2-CB 4.46Å; F328-M354 HydrophobicContact CD2-CG 4.07Å; F328-M354 HydrophobicContact CE2-CB 4.16Å; F328-M354 HydrophobicContact CE2-CG 4Å; F328-E355 HydrophobicContact CE2-CB 4.18Å; F328-E355 HydrophobicContact CZ-CB 3.9Å; F328-E355 HydrophobicContact CZ-CG 4.26Å; F328-I358 HydrophobicContact CD2-CD1 4.1Å; F328-I358 HydrophobicContact CE1-CD1 4.07Å; F328-I358 HydrophobicContact CE2-CD1 3.55Å; F328-I358 HydrophobicContact CZ-CD1 3.53Å
329	H	97.1	Very high	98.1	Very high	113 Å²	113	33 Å²	33	52%	0.523	17%	0.169	S	C	.	.	H	α-helix	trans	-67.7	-29.5	-178.2	-173.7	65.6	0	0	0	112.2	E323 L331 L332 T333	E323-H329 PolarHBondContact OE1-N 3.15Å; H329-L331 VanDerWaalsContact C-N 3.29Å; H329-L331 PolarHBondContact O-N 3.02Å; H329-L332 PolarHBondContact O-N 2.86Å; H329-T333 WeakPolarHBondContact NE2-CG2 3.46Å; H329-T333 WeakPolarHBondContact O-CG2 3.1Å; H329-T333 PolarHBondContact O-N 3.21Å; H329-T333 PolarHBondContact O-OG1 3.21Å
330	S	97.9	Very high	97.9	Very high	7 Å²	7	35.5 Å²	35.5	5%	0.049	18%	0.181	C	C	.	.	H	α-helix	trans	-73.9	-16.3	174.4	69.8	0	0	0	0	114.2	E323 I327 F328 T333 G334 T335 Y336	E323-S330 PolarHBondContact OE1-N 3.41Å; E323-S330 PolarHBondContact OE1-OG 2.63Å; E323-S330 WeakPolarHBondContact OE2-CB 3.47Å; E323-S330 PolarHBondContact OE2-OG 3.36Å; I327-S330 VanDerWaalsContact CG2-OG 3.27Å; I327-S330 WeakPolarHBondContact CG2-OG 3.38Å; F328-S330 VanDerWaalsContact C-N 3.26Å; F328-S330 PolarHBondContact O-N 2.95Å; S330-T333 WeakPolarHBondContact CA-OG1 3.47Å; S330-G334 CarbonylContact O-C 3.56Å; S330-G334 PolarHBondContact O-N 3.21Å; S330-T335 WeakPolarHBondContact CA-OG1 3.23Å; S330-T335 WeakPolarHBondContact CB-OG1 3.41Å; S330-T335 PolarHBondContact O-N 3.02Å; S330-T335 VanDerWaalsContact O-N 3.14Å; S330-Y336 PolarHBondContact O-N 3.23Å; S330-Y336 VanDerWaalsContact O-N 3.13Å; S330-Y336 WeakPolarHBondContact OG-CB 3.47Å
331	L	98.3	Very high	97.8	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-70.2	-53.3	167.5	-54	179.8	0	0	0	109.6	I327 F328 H329 T333 G334 M347 I464 T468	I327-L331 HydrophobicContact CG2-CD2 3.6Å; I327-L331 HydrophobicContact CG2-CG 3.92Å; F328-L331 VanDerWaalsContact O-CB 3.22Å; F328-L331 WeakPolarHBondContact O-CB 3.49Å; F328-L331 PolarHBondContact O-N 3.39Å; F328-L331 VanDerWaalsContact O-N 3.09Å; H329-L331 VanDerWaalsContact C-N 3.29Å; H329-L331 PolarHBondContact O-N 3.02Å; L331-T333 PolarHBondContact O-N 2.67Å; L331-G334 PolarHBondContact O-N 3.41Å; L331-G334 VanDerWaalsContact O-N 3.15Å; L331-M347 HydrophobicContact CD2-CB 4.41Å; L331-M347 HydrophobicContact CD2-CE 3.35Å; L331-M347 HydrophobicContact CD2-SD 4.12Å; L331-I464 HydrophobicContact CD1-CD1 4.31Å; L331-I464 HydrophobicContact CD1-CG1 4.34Å; L331-T468 HydrophobicContact CD2-CG2 4.48Å
332	L	98.4	Very high	97.8	Very high	35 Å²	35	41 Å²	41	18%	0.183	22%	0.224	C	C	.	.	H	α-helix	trans	-64	-38.5	-177.9	-65.6	170.8	0	0	0	112.7	F328 H329 G334 L348 G351 L352 E355	F328-L332 HydrophobicContact CE1-CD1 4.15Å; F328-L332 HydrophobicContact CE2-CD1 4.31Å; F328-L332 HydrophobicContact CZ-CD1 3.88Å; F328-L332 PolarHBondContact O-N 3.49Å; H329-L332 PolarHBondContact O-N 2.86Å; L332-G334 VanDerWaalsContact C-N 3.33Å; L332-L348 HydrophobicContact CD2-CD1 4.45Å; L332-G351 VanDerWaalsContact CD2-C 3.46Å; L332-L352 HydrophobicContact CD2-CD2 3.84Å; L332-L352 HydrophobicContact CD2-CG 3.96Å; L332-E355 WeakPolarHBondContact CD1-OE1 3.39Å
333	T	97.9	Very high	97.8	Very high	70 Å²	70	44.1 Å²	44.1	43%	0.429	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-5.6	176.8	56.6	0	0	0	0	113.8	H329 S330 L331 T335	H329-T333 WeakPolarHBondContact NE2-CG2 3.46Å; H329-T333 WeakPolarHBondContact O-CG2 3.1Å; H329-T333 PolarHBondContact O-N 3.21Å; H329-T333 PolarHBondContact O-OG1 3.21Å; S330-T333 WeakPolarHBondContact CA-OG1 3.47Å; L331-T333 PolarHBondContact O-N 2.67Å; T333-T335 PolarHBondContact O-N 3.11Å; T333-T335 VanDerWaalsContact O-N 3.11Å; T333-T335 PolarHBondContact OG1-OG1 2.68Å
334	G	97.2	Very high	97.8	Very high	19 Å²	19	46.3 Å²	46.3	20%	0.196	26%	0.258	C	S	.	.	S	Bend	trans	66	3.7	-174.9	0	0	0	0	0	115	S330 L331 L332 Y336 A337 Q338	S330-G334 CarbonylContact O-C 3.56Å; S330-G334 PolarHBondContact O-N 3.21Å; L331-G334 PolarHBondContact O-N 3.41Å; L331-G334 VanDerWaalsContact O-N 3.15Å; L332-G334 VanDerWaalsContact C-N 3.33Å; G334-Y336 VanDerWaalsContact C-N 3.34Å; G334-Y336 PolarHBondContact O-N 3.43Å; G334-A337 WeakPolarHBondContact O-CB 3.4Å; G334-A337 PolarHBondContact O-N 3.36Å; G334-A337 VanDerWaalsContact O-N 3.15Å; G334-Q338 PolarHBondContact O-N 3.23Å
335	T	97.6	Very high	97.7	Very high	67 Å²	67	49.4 Å²	49.4	41%	0.411	28%	0.284	S	S	.	.	H	α-helix	trans	-67.8	-32.5	-175.8	51.3	0	0	0	0	112.4	S330 T333 K339	S330-T335 WeakPolarHBondContact CA-OG1 3.23Å; S330-T335 WeakPolarHBondContact CB-OG1 3.41Å; S330-T335 PolarHBondContact O-N 3.02Å; S330-T335 VanDerWaalsContact O-N 3.14Å; T333-T335 PolarHBondContact O-N 3.11Å; T333-T335 VanDerWaalsContact O-N 3.11Å; T333-T335 PolarHBondContact OG1-OG1 2.68Å; T335-K339 WeakPolarHBondContact O-CB 3.28Å; T335-K339 PolarHBondContact O-N 3.16Å
336	Y	97.2	Very high	97.7	Very high	5 Å²	5	52.5 Å²	52.5	2%	0.02	30%	0.303	C	S	.	.	H	α-helix	trans	-65.1	-44.7	170.5	-166.5	-78	0	0	0	111.1	I327 S330 G334 Q338 K339 F340 K342 M347 T468 W471 H570	I327-Y336 HydrophobicContact CD1-CD2 3.95Å; I327-Y336 HydrophobicContact CD1-CE2 3.75Å; I327-Y336 HydrophobicContact CG1-CD2 4.11Å; I327-Y336 HydrophobicContact CG1-CE2 3.75Å; I327-Y336 HydrophobicContact CG2-CD2 3.56Å; I327-Y336 HydrophobicContact CG2-CE2 3.98Å; I327-Y336 HydrophobicContact CG2-CG 4.11Å; S330-Y336 PolarHBondContact O-N 3.23Å; S330-Y336 VanDerWaalsContact O-N 3.13Å; S330-Y336 WeakPolarHBondContact OG-CB 3.47Å; G334-Y336 VanDerWaalsContact C-N 3.34Å; G334-Y336 PolarHBondContact O-N 3.43Å; Y336-Q338 VanDerWaalsContact C-N 3.33Å; Y336-Q338 PolarHBondContact O-N 3.5Å; Y336-K339 PolarHBondContact O-N 2.84Å; Y336-K339 VanDerWaalsContact O-N 3.15Å; Y336-F340 HydrophobicContact CD1-CB 4.14Å; Y336-F340 AromaticContact CD1-CD2 3.65Å; Y336-F340 HydrophobicContact CD1-CD2 3.65Å; Y336-F340 HydrophobicContact CD1-CG 4.29Å; Y336-F340 AromaticContact CD2-CD2 3.63Å; Y336-F340 HydrophobicContact CD2-CD2 3.63Å; Y336-F340 AromaticContact CD2-CE2 3.68Å; Y336-F340 HydrophobicContact CD2-CE2 3.68Å; Y336-F340 HydrophobicContact CE1-CB 3.8Å; Y336-F340 AromaticContact CE1-CD2 3.54Å; Y336-F340 HydrophobicContact CE1-CD2 3.54Å; Y336-F340 HydrophobicContact CE1-CE2 4.34Å; Y336-F340 AromaticContact CE1-CG 3.9Å; Y336-F340 HydrophobicContact CE1-CG 3.9Å; Y336-F340 AromaticContact CE2-CD2 3.51Å; Y336-F340 HydrophobicContact CE2-CD2 3.51Å; Y336-F340 AromaticContact CE2-CE2 3.45Å; Y336-F340 HydrophobicContact CE2-CE2 3.45Å; Y336-F340 VanDerWaalsContact CE2-CE2 3.45Å; Y336-F340 HydrophobicContact CE2-CG 4.43Å; Y336-F340 HydrophobicContact CE2-CZ 4.36Å; Y336-F340 AromaticContact CG-CD2 3.7Å; Y336-F340 HydrophobicContact CG-CD2 3.7Å; Y336-F340 HydrophobicContact CG-CE2 4.21Å; Y336-F340 AromaticContact CZ-CD2 3.45Å; Y336-F340 VanDerWaalsContact CZ-CD2 3.45Å; Y336-F340 AromaticContact CZ-CE2 3.81Å; Y336-F340 AromaticContact CZ-CG 3.96Å; Y336-F340 PolarHBondContact O-N 3.17Å; Y336-K342 HydrophobicContact CD1-CG 4.12Å; Y336-K342 HydrophobicContact CE1-CG 4.02Å; Y336-M347 HydrophobicContact CD1-CE 3.32Å; Y336-M347 HydrophobicContact CE1-CE 3.79Å; Y336-M347 HydrophobicContact CG-CE 4.02Å; Y336-T468 HydrophobicContact CE1-CG2 4.4Å; Y336-T468 HydrophobicContact CE2-CG2 4.44Å; Y336-T468 WeakPolarHBondContact OH-CA 3.41Å; Y336-T468 PolarHBondContact OH-O 2.97Å; Y336-T468 VanDerWaalsContact OH-O 3.08Å; Y336-W471 HydrophobicContact CE2-CE3 4.45Å; Y336-H570 PolarHBondContact OH-CE1 2.85Å; Y336-H570 PolarHBondContact OH-NE2 2.96Å
337	A	97.6	Very high	97.7	Very high	3 Å²	3	52.5 Å²	52.5	3%	0.025	30%	0.303	C	S	.	.	H	α-helix	trans	-59.9	-45.1	-179.2	0	0	0	0	0	111.4	G334 G341 K342 P344 M347	G334-A337 WeakPolarHBondContact O-CB 3.4Å; G334-A337 PolarHBondContact O-N 3.36Å; G334-A337 VanDerWaalsContact O-N 3.15Å; A337-G341 WeakPolarHBondContact O-CA 3.28Å; A337-G341 PolarHBondContact O-N 3.25Å; A337-K342 HydrophobicContact CB-CB 4.37Å; A337-K342 PolarHBondContact O-N 2.94Å; A337-P344 HydrophobicContact CB-CB 4.08Å; A337-P344 HydrophobicContact CB-CG 3.99Å; A337-M347 HydrophobicContact CB-CB 4.25Å; A337-M347 HydrophobicContact CB-CG 3.92Å
338	Q	97.6	Very high	97.7	Very high	170 Å²	170	55.7 Å²	55.7	79%	0.794	32%	0.32	S	S	*	.	H	α-helix	trans	-62.3	-42.3	173.9	-173	-177.8	13	0	0	112.8	G334 Y336	G334-Q338 PolarHBondContact O-N 3.23Å; Y336-Q338 VanDerWaalsContact C-N 3.33Å; Y336-Q338 PolarHBondContact O-N 3.5Å
339	K	96.6	Very high	97.7	Very high	126 Å²	126	59.4 Å²	59.4	55%	0.548	34%	0.34	S	S	.	.	H	α-helix	trans	-74.8	-36.3	-174	-179.8	175.7	171.9	-174.2	0	113.7	T335 Y336 S568	T335-K339 WeakPolarHBondContact O-CB 3.28Å; T335-K339 PolarHBondContact O-N 3.16Å; Y336-K339 PolarHBondContact O-N 2.84Å; Y336-K339 VanDerWaalsContact O-N 3.15Å; K339-S568 VanDerWaalsContact CE-O 3.28Å; K339-S568 WeakPolarHBondContact CE-O 3.47Å; K339-S568 PolarHBondContact NZ-O 3.47Å
340	F	96.2	Very high	97.7	Very high	55 Å²	55	54.1 Å²	54.1	24%	0.241	32%	0.316	C	S	.	.	H	α-helix	trans	-114	10.5	-174.8	-62.4	-78.7	0	0	0	113.9	Y336 K342 W471 H570	Y336-F340 HydrophobicContact CD1-CB 4.14Å; Y336-F340 AromaticContact CD1-CD2 3.65Å; Y336-F340 HydrophobicContact CD1-CD2 3.65Å; Y336-F340 HydrophobicContact CD1-CG 4.29Å; Y336-F340 AromaticContact CD2-CD2 3.63Å; Y336-F340 HydrophobicContact CD2-CD2 3.63Å; Y336-F340 AromaticContact CD2-CE2 3.68Å; Y336-F340 HydrophobicContact CD2-CE2 3.68Å; Y336-F340 HydrophobicContact CE1-CB 3.8Å; Y336-F340 AromaticContact CE1-CD2 3.54Å; Y336-F340 HydrophobicContact CE1-CD2 3.54Å; Y336-F340 HydrophobicContact CE1-CE2 4.34Å; Y336-F340 AromaticContact CE1-CG 3.9Å; Y336-F340 HydrophobicContact CE1-CG 3.9Å; Y336-F340 AromaticContact CE2-CD2 3.51Å; Y336-F340 HydrophobicContact CE2-CD2 3.51Å; Y336-F340 AromaticContact CE2-CE2 3.45Å; Y336-F340 HydrophobicContact CE2-CE2 3.45Å; Y336-F340 VanDerWaalsContact CE2-CE2 3.45Å; Y336-F340 HydrophobicContact CE2-CG 4.43Å; Y336-F340 HydrophobicContact CE2-CZ 4.36Å; Y336-F340 AromaticContact CG-CD2 3.7Å; Y336-F340 HydrophobicContact CG-CD2 3.7Å; Y336-F340 HydrophobicContact CG-CE2 4.21Å; Y336-F340 AromaticContact CZ-CD2 3.45Å; Y336-F340 VanDerWaalsContact CZ-CD2 3.45Å; Y336-F340 AromaticContact CZ-CE2 3.81Å; Y336-F340 AromaticContact CZ-CG 3.96Å; Y336-F340 PolarHBondContact O-N 3.17Å; F340-K342 HydrophobicContact CB-CG 4.33Å; F340-K342 PolarHBondContact O-N 3.26Å; F340-W471 HydrophobicContact CZ-CZ3 4.28Å; F340-H570 AromaticContact CE1-CE1 3.87Å; F340-H570 AromaticContact CE1-ND1 3.77Å
341	G	96.9	Very high	97.8	Very high	72 Å²	72	53.8 Å²	53.8	74%	0.742	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.7	30.3	174.2	0	0	0	0	0	114.8	A337	A337-G341 WeakPolarHBondContact O-CA 3.28Å; A337-G341 PolarHBondContact O-N 3.25Å
342	K	97.8	Very high	97.8	Very high	50 Å²	50	57.8 Å²	57.8	22%	0.217	33%	0.334	C	S	.	.			trans	-89.1	160.6	177.5	-48.6	-65.9	177.2	150.2	0	110.6	Y336 A337 F340 P344 M347 V467 D469	Y336-K342 HydrophobicContact CD1-CG 4.12Å; Y336-K342 HydrophobicContact CE1-CG 4.02Å; A337-K342 HydrophobicContact CB-CB 4.37Å; A337-K342 PolarHBondContact O-N 2.94Å; F340-K342 HydrophobicContact CB-CG 4.33Å; F340-K342 PolarHBondContact O-N 3.26Å; K342-P344 VanDerWaalsContact O-CD 3.28Å; K342-P344 WeakPolarHBondContact O-CD 3.47Å; K342-M347 HydrophobicContact CB-CE 4.38Å; K342-M347 HydrophobicContact CB-CG 3.93Å; K342-M347 HydrophobicContact CB-SD 4.19Å; K342-M347 HydrophobicContact CG-CE 4.28Å; K342-V467 WeakPolarHBondContact CD-O 3.41Å; K342-V467 WeakPolarHBondContact CE-O 3.38Å; K342-V467 PolarHBondContact NZ-O 3.41Å; K342-D469 WeakPolarHBondContact CE-OD2 3.44Å; K342-D469 IonicContact NZ-OD1 2.76Å; K342-D469 PolarHBondContact NZ-OD1 3.44Å; K342-D469 IonicContact NZ-OD2 3.95Å; K342-D469 PolarHBondContact NZ-OD2 3.48Å
343	D	97.9	Very high	97.8	Very high	85 Å²	85	57.9 Å²	57.9	46%	0.455	33%	0.333	S	S	.	.			trans	-67.9	117.6	174.4	170.2	46.2	0	0	0	111.4	A345 T346 M347	D343-A345 VanDerWaalsContact C-N 3.28Å; D343-A345 PolarHBondContact O-N 3.48Å; D343-A345 PolarHBondContact OD1-N 3.45Å; D343-T346 PolarHBondContact O-N 3.29Å; D343-T346 VanDerWaalsContact OD2-CB 3.24Å; D343-T346 WeakPolarHBondContact OD2-CB 3.36Å; D343-T346 PolarHBondContact OD2-N 2.96Å; D343-T346 PolarHBondContact OD2-OG1 3.15Å; D343-M347 VanDerWaalsContact O-CG 3.32Å; D343-M347 WeakPolarHBondContact O-CG 2.85Å; D343-M347 PolarHBondContact O-N 2.9Å; D343-M347 VanDerWaalsContact O-N 3.11Å
344	P	97.8	Very high	97.8	Very high	76 Å²	76	54.6 Å²	54.6	49%	0.494	31%	0.313	S	S	.	.	H	α-helix	trans	-63.2	-30.5	-177.8	-22.5	34.4	0	0	0	114	A337 K342 L348	A337-P344 HydrophobicContact CB-CB 4.08Å; A337-P344 HydrophobicContact CB-CG 3.99Å; K342-P344 VanDerWaalsContact O-CD 3.28Å; K342-P344 WeakPolarHBondContact O-CD 3.47Å; P344-L348 VanDerWaalsContact O-CB 3.3Å; P344-L348 WeakPolarHBondContact O-CB 3.16Å; P344-L348 PolarHBondContact O-N 3.17Å
345	A	98.3	Very high	97.9	Very high	66 Å²	66	56.6 Å²	56.6	55%	0.545	32%	0.318	S	S	.	.	H	α-helix	trans	-69.7	-45.1	-179.1	0	0	0	0	0	111.5	D343 N349	D343-A345 VanDerWaalsContact C-N 3.28Å; D343-A345 PolarHBondContact O-N 3.48Å; D343-A345 PolarHBondContact OD1-N 3.45Å; A345-N349 VanDerWaalsContact O-CB 3.24Å; A345-N349 WeakPolarHBondContact O-CB 3.34Å; A345-N349 PolarHBondContact O-N 3.35Å
346	T	98	Very high	97.9	Very high	65 Å²	65	58.4 Å²	58.4	40%	0.399	32%	0.321	S	S	.	.	H	α-helix	trans	-61.1	-46.8	173.6	-59.3	0	0	0	0	111.1	D343 N349 L350 V467	D343-T346 PolarHBondContact O-N 3.29Å; D343-T346 VanDerWaalsContact OD2-CB 3.24Å; D343-T346 WeakPolarHBondContact OD2-CB 3.36Å; D343-T346 PolarHBondContact OD2-N 2.96Å; D343-T346 PolarHBondContact OD2-OG1 3.15Å; T346-N349 PolarHBondContact O-N 2.81Å; T346-L350 HydrophobicContact CG2-CD1 4.06Å; T346-L350 WeakPolarHBondContact O-CG 3.25Å; T346-L350 PolarHBondContact O-N 3.47Å; T346-V467 HydrophobicContact CG2-CG1 4.42Å
347	M	97.9	Very high	98	Very high	1 Å²	1	58.2 Å²	58.2	1%	0.005	32%	0.321	C	S	.	.	H	α-helix	trans	-62.1	-47.1	-180	-63.6	-55.8	-96.2	0	0	112.2	L331 Y336 A337 K342 D343 N349 L350 G351 V467 T468	L331-M347 HydrophobicContact CD2-CB 4.41Å; L331-M347 HydrophobicContact CD2-CE 3.35Å; L331-M347 HydrophobicContact CD2-SD 4.12Å; Y336-M347 HydrophobicContact CD1-CE 3.32Å; Y336-M347 HydrophobicContact CE1-CE 3.79Å; Y336-M347 HydrophobicContact CG-CE 4.02Å; A337-M347 HydrophobicContact CB-CB 4.25Å; A337-M347 HydrophobicContact CB-CG 3.92Å; K342-M347 HydrophobicContact CB-CE 4.38Å; K342-M347 HydrophobicContact CB-CG 3.93Å; K342-M347 HydrophobicContact CB-SD 4.19Å; K342-M347 HydrophobicContact CG-CE 4.28Å; D343-M347 VanDerWaalsContact O-CG 3.32Å; D343-M347 WeakPolarHBondContact O-CG 2.85Å; D343-M347 PolarHBondContact O-N 2.9Å; D343-M347 VanDerWaalsContact O-N 3.11Å; M347-N349 PolarHBondContact O-N 2.94Å; M347-L350 PolarHBondContact O-N 2.81Å; M347-G351 PolarHBondContact O-N 3.47Å; M347-V467 HydrophobicContact CE-CB 4.23Å; M347-V467 HydrophobicContact CE-CG2 3.78Å; M347-V467 HydrophobicContact SD-CB 3.6Å; M347-V467 VanDerWaalsContact SD-CB 3.6Å; M347-V467 HydrophobicContact SD-CG1 4.35Å; M347-V467 HydrophobicContact SD-CG2 3.3Å; M347-V467 WeakPolarHBondContact SD-CG2 3.39Å; M347-T468 HydrophobicContact CE-CG2 4.22Å
348	L	98.6	Very high	98.1	Very high	73 Å²	73	58.2 Å²	58.2	38%	0.382	32%	0.32	S	S	.	.	H	α-helix	trans	-60.9	-44.6	176.7	176.4	59.9	0	0	0	111.7	L332 P344 L350 G351 L352	L332-L348 HydrophobicContact CD2-CD1 4.45Å; P344-L348 VanDerWaalsContact O-CB 3.3Å; P344-L348 WeakPolarHBondContact O-CB 3.16Å; P344-L348 PolarHBondContact O-N 3.17Å; L348-L350 VanDerWaalsContact C-N 3.32Å; L348-L350 PolarHBondContact O-N 3.48Å; L348-G351 PolarHBondContact O-N 2.89Å; L348-L352 HydrophobicContact CD1-CD1 3.91Å; L348-L352 HydrophobicContact CD1-CG 4.01Å; L348-L352 HydrophobicContact CG-CD1 3.92Å; L348-L352 HydrophobicContact CG-CG 4.45Å; L348-L352 WeakPolarHBondContact O-CG 3.5Å; L348-L352 PolarHBondContact O-N 3.49Å
349	N	98.6	Very high	98.1	Very high	90 Å²	90	54 Å²	54	48%	0.481	30%	0.3	S	S	.	.	H	α-helix	trans	-62.3	-37.5	179	-177.2	61.8	0	0	0	112.5	A345 T346 M347 Q353	A345-N349 VanDerWaalsContact O-CB 3.24Å; A345-N349 WeakPolarHBondContact O-CB 3.34Å; A345-N349 PolarHBondContact O-N 3.35Å; T346-N349 PolarHBondContact O-N 2.81Å; M347-N349 PolarHBondContact O-N 2.94Å; N349-Q353 PolarHBondContact ND2-NE2 2.82Å; N349-Q353 VanDerWaalsContact ND2-NE2 3.15Å; N349-Q353 WeakPolarHBondContact O-CG 3.49Å; N349-Q353 PolarHBondContact O-N 2.92Å; N349-Q353 PolarHBondContact O-NE2 2.72Å
350	L	98.7	Very high	98.1	Very high	2 Å²	2	51.3 Å²	51.3	1%	0.01	29%	0.289	C	S	.	.	H	α-helix	trans	-69	-44	173.9	-71.2	171	0	0	0	112.2	T346 M347 L348 L352 Q353 M354 L460 E463 I464 V467	T346-L350 HydrophobicContact CG2-CD1 4.06Å; T346-L350 WeakPolarHBondContact O-CG 3.25Å; T346-L350 PolarHBondContact O-N 3.47Å; M347-L350 PolarHBondContact O-N 2.81Å; L348-L350 VanDerWaalsContact C-N 3.32Å; L348-L350 PolarHBondContact O-N 3.48Å; L350-L352 PolarHBondContact O-N 2.91Å; L350-Q353 PolarHBondContact O-N 3.43Å; L350-M354 PolarHBondContact O-N 2.82Å; L350-L460 HydrophobicContact CD2-CD2 3.84Å; L350-E463 HydrophobicContact CD1-CB 4.3Å; L350-E463 HydrophobicContact CD2-CB 3.63Å; L350-E463 VanDerWaalsContact CD2-OE2 3.3Å; L350-E463 WeakPolarHBondContact CD2-OE2 3.33Å; L350-I464 HydrophobicContact CB-CG1 4.02Å; L350-I464 HydrophobicContact CD1-CG1 4.37Å; L350-I464 HydrophobicContact CD2-CG1 4.43Å; L350-V467 HydrophobicContact CD1-CG1 4.12Å; L350-V467 HydrophobicContact CD1-CG2 3.69Å
351	G	98.6	Very high	98.3	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-56.9	-49	176.2	0	0	0	0	0	112.2	L332 M347 L348 Q353 M354 E355	L332-G351 VanDerWaalsContact CD2-C 3.46Å; M347-G351 PolarHBondContact O-N 3.47Å; L348-G351 PolarHBondContact O-N 2.89Å; G351-Q353 PolarHBondContact O-N 2.73Å; G351-M354 PolarHBondContact O-N 2.79Å; G351-E355 WeakPolarHBondContact O-CB 3.46Å; G351-E355 PolarHBondContact O-N 2.9Å
352	L	98.7	Very high	98.3	Very high	84 Å²	84	45.3 Å²	45.3	44%	0.44	24%	0.242	S	C	.	.	H	α-helix	trans	-63.6	-40.9	-178.9	-70.8	168.9	0	0	0	113	L332 L348 L350 E355 E356	L332-L352 HydrophobicContact CD2-CD2 3.84Å; L332-L352 HydrophobicContact CD2-CG 3.96Å; L348-L352 HydrophobicContact CD1-CD1 3.91Å; L348-L352 HydrophobicContact CD1-CG 4.01Å; L348-L352 HydrophobicContact CG-CD1 3.92Å; L348-L352 HydrophobicContact CG-CG 4.45Å; L348-L352 WeakPolarHBondContact O-CG 3.5Å; L348-L352 PolarHBondContact O-N 3.49Å; L350-L352 PolarHBondContact O-N 2.91Å; L352-E355 PolarHBondContact O-N 2.66Å; L352-E356 PolarHBondContact O-N 2.88Å
353	Q	98.7	Very high	98.3	Very high	36 Å²	36	45.9 Å²	45.9	17%	0.168	25%	0.248	C	C	.	.	H	α-helix	trans	-69.1	-32.8	176.7	-73.1	168.4	93	0	0	112.5	N349 L350 G351 L357 L460	N349-Q353 PolarHBondContact ND2-NE2 2.82Å; N349-Q353 VanDerWaalsContact ND2-NE2 3.15Å; N349-Q353 WeakPolarHBondContact O-CG 3.49Å; N349-Q353 PolarHBondContact O-N 2.92Å; N349-Q353 PolarHBondContact O-NE2 2.72Å; L350-Q353 PolarHBondContact O-N 3.43Å; G351-Q353 PolarHBondContact O-N 2.73Å; Q353-L357 PolarHBondContact O-N 3.25Å; Q353-L460 HydrophobicContact CB-CD1 3.78Å; Q353-L460 HydrophobicContact CB-CD2 3.61Å; Q353-L460 HydrophobicContact CB-CG 4.34Å; Q353-L460 HydrophobicContact CG-CD2 4.39Å
354	M	98.8	Very high	98.2	Very high	1 Å²	1	46 Å²	46	1%	0.005	25%	0.252	C	S	.	.	H	α-helix	trans	-72.7	-37.5	172.8	-177.2	59.4	75.8	0	0	111.3	F328 L350 G351 L357 I358 L457 L460 I464 L507 Y508	F328-M354 HydrophobicContact CD2-CB 4.46Å; F328-M354 HydrophobicContact CD2-CG 4.07Å; F328-M354 HydrophobicContact CE2-CB 4.16Å; F328-M354 HydrophobicContact CE2-CG 4Å; L350-M354 PolarHBondContact O-N 2.82Å; G351-M354 PolarHBondContact O-N 2.79Å; M354-L357 PolarHBondContact O-N 3.23Å; M354-I358 HydrophobicContact CG-CD1 3.89Å; M354-I358 HydrophobicContact CG-CG1 4.46Å; M354-I358 WeakPolarHBondContact O-CD1 3.3Å; M354-I358 VanDerWaalsContact O-CG1 3.27Å; M354-I358 WeakPolarHBondContact O-CG1 3.41Å; M354-I358 PolarHBondContact O-N 2.89Å; M354-I358 HydrophobicContact SD-CD1 4.49Å; M354-L457 HydrophobicContact CE-CD1 4.15Å; M354-L457 HydrophobicContact SD-CD1 4.49Å; M354-L460 HydrophobicContact CE-CB 4.15Å; M354-I464 HydrophobicContact CB-CD1 4.07Å; M354-I464 HydrophobicContact CE-CD1 3.71Å; M354-I464 HydrophobicContact CG-CD1 4.33Å; M354-L507 HydrophobicContact SD-CB 4.38Å; M354-Y508 HydrophobicContact CE-CE2 4.22Å; M354-Y508 HydrophobicContact CG-CE2 3.85Å; M354-Y508 HydrophobicContact SD-CE2 3.92Å
355	E	98.6	Very high	98.2	Very high	62 Å²	62	44.9 Å²	44.9	29%	0.29	24%	0.24	S	C	.	.	H	α-helix	trans	-60.5	-45.1	173.8	-173.8	168.9	-120.9	0	0	111.7	F328 L332 G351 L352 L357 I358 F359	F328-E355 HydrophobicContact CE2-CB 4.18Å; F328-E355 HydrophobicContact CZ-CB 3.9Å; F328-E355 HydrophobicContact CZ-CG 4.26Å; L332-E355 WeakPolarHBondContact CD1-OE1 3.39Å; G351-E355 WeakPolarHBondContact O-CB 3.46Å; G351-E355 PolarHBondContact O-N 2.9Å; L352-E355 PolarHBondContact O-N 2.66Å; E355-L357 VanDerWaalsContact C-N 3.34Å; E355-L357 PolarHBondContact O-N 3.18Å; E355-I358 PolarHBondContact O-N 2.82Å; E355-F359 HydrophobicContact CG-CD2 3.78Å; E355-F359 HydrophobicContact CG-CE2 3.69Å; E355-F359 WeakPolarHBondContact O-CD2 3.47Å; E355-F359 PolarHBondContact O-N 2.7Å
356	E	98.3	Very high	98.2	Very high	104 Å²	104	41.8 Å²	41.8	49%	0.486	21%	0.214	S	C	.	.	H	α-helix	trans	-56.2	-45.5	172.9	-171.1	-168.7	152.3	0	0	111.7	L352 E360 K453	L352-E356 PolarHBondContact O-N 2.88Å; E356-E360 WeakPolarHBondContact O-CB 3.28Å; E356-E360 PolarHBondContact O-N 3.11Å; E356-K453 IonicContact OE1-NZ 2.64Å
357	L	98.4	Very high	98.1	Very high	1 Å²	1	40.1 Å²	40.1	1%	0.005	20%	0.201	C	C	.	.	H	α-helix	trans	-67.5	-37.1	177	-74	-173.1	0	0	0	113.3	Q353 M354 E355 L361 K453 L456 L457 L460 L507	Q353-L357 PolarHBondContact O-N 3.25Å; M354-L357 PolarHBondContact O-N 3.23Å; E355-L357 VanDerWaalsContact C-N 3.34Å; E355-L357 PolarHBondContact O-N 3.18Å; L357-L361 VanDerWaalsContact O-CB 3.23Å; L357-L361 WeakPolarHBondContact O-CB 3.5Å; L357-L361 PolarHBondContact O-N 3.46Å; L357-K453 HydrophobicContact CD2-CB 4.08Å; L357-K453 HydrophobicContact CD2-CD 3.63Å; L357-K453 HydrophobicContact CD2-CG 3.86Å; L357-L456 HydrophobicContact CD1-CD2 4.5Å; L357-L456 HydrophobicContact CD1-CG 4.28Å; L357-L456 HydrophobicContact CD2-CD2 4.2Å; L357-L456 HydrophobicContact CG-CD2 4.41Å; L357-L457 HydrophobicContact CD1-CB 3.94Å; L357-L457 HydrophobicContact CD1-CD1 4.04Å; L357-L460 HydrophobicContact CD1-CD1 3.71Å; L357-L460 HydrophobicContact CG-CD1 4.41Å; L357-L507 HydrophobicContact CB-CD1 4.2Å
358	I	98.7	Very high	98.1	Very high	3 Å²	3	40.7 Å²	40.7	2%	0.015	20%	0.204	C	C	.	.	H	α-helix	trans	-62.2	-50.5	177.3	-73.3	159.7	0	0	0	110.1	F328 M354 E355 A362 P500 A503 K504 L507	F328-I358 HydrophobicContact CD2-CD1 4.1Å; F328-I358 HydrophobicContact CE1-CD1 4.07Å; F328-I358 HydrophobicContact CE2-CD1 3.55Å; F328-I358 HydrophobicContact CZ-CD1 3.53Å; M354-I358 HydrophobicContact CG-CD1 3.89Å; M354-I358 HydrophobicContact CG-CG1 4.46Å; M354-I358 WeakPolarHBondContact O-CD1 3.3Å; M354-I358 VanDerWaalsContact O-CG1 3.27Å; M354-I358 WeakPolarHBondContact O-CG1 3.41Å; M354-I358 PolarHBondContact O-N 2.89Å; M354-I358 HydrophobicContact SD-CD1 4.49Å; E355-I358 PolarHBondContact O-N 2.82Å; I358-A362 VanDerWaalsContact O-CB 3.29Å; I358-A362 WeakPolarHBondContact O-CB 3.28Å; I358-A362 PolarHBondContact O-N 2.82Å; I358-P500 HydrophobicContact CG2-CB 4.46Å; I358-A503 HydrophobicContact CG2-CB 4.14Å; I358-A503 WeakPolarHBondContact O-CB 3.4Å; I358-K504 HydrophobicContact CD1-CG 3.77Å; I358-K504 HydrophobicContact CG1-CG 4.14Å; I358-K504 HydrophobicContact CG2-CG 4.24Å; I358-L507 HydrophobicContact CB-CD1 4.25Å; I358-L507 HydrophobicContact CG1-CD1 3.68Å
359	F	98.3	Very high	98	Very high	83 Å²	83	42.9 Å²	42.9	36%	0.364	22%	0.216	S	C	.	.	H	α-helix	trans	-70.7	-41.8	-179.6	-74.7	-67.8	0	0	0	112.5	E355 L361 A362 D363 F368	E355-F359 HydrophobicContact CG-CD2 3.78Å; E355-F359 HydrophobicContact CG-CE2 3.69Å; E355-F359 WeakPolarHBondContact O-CD2 3.47Å; E355-F359 PolarHBondContact O-N 2.7Å; F359-L361 VanDerWaalsContact C-N 3.34Å; F359-L361 PolarHBondContact O-N 2.72Å; F359-A362 WeakPolarHBondContact O-CB 3.34Å; F359-A362 PolarHBondContact O-N 2.89Å; F359-A362 VanDerWaalsContact O-N 3.12Å; F359-D363 WeakPolarHBondContact O-CB 3.18Å; F359-D363 PolarHBondContact O-N 2.81Å; F359-F368 HydrophobicContact CD1-CD1 4.29Å; F359-F368 AromaticContact CD1-CE1 3.94Å; F359-F368 HydrophobicContact CD1-CE1 3.94Å; F359-F368 AromaticContact CE1-CE1 3.89Å; F359-F368 HydrophobicContact CE1-CE1 3.89Å; F359-F368 HydrophobicContact CE1-CZ 4.39Å
360	E	97.7	Very high	97.9	Very high	68 Å²	68	40 Å²	40	32%	0.318	20%	0.2	S	C	.	.	H	α-helix	trans	-64.7	-37.1	177.2	-173.9	170.8	125.4	0	0	112.5	E356 T364 K453	E356-E360 WeakPolarHBondContact O-CB 3.28Å; E356-E360 PolarHBondContact O-N 3.11Å; E360-T364 WeakPolarHBondContact CG-OG1 3.43Å; E360-T364 WeakPolarHBondContact O-CB 3.35Å; E360-T364 PolarHBondContact O-N 2.88Å; E360-T364 PolarHBondContact O-OG1 3.32Å; E360-K453 VanDerWaalsContact CD-CE 3.41Å; E360-K453 WeakPolarHBondContact OE1-CD 3.27Å; E360-K453 WeakPolarHBondContact OE1-CE 3.41Å; E360-K453 IonicContact OE1-NZ 2.71Å; E360-K453 PolarHBondContact OE1-NZ 2.97Å; E360-K453 VanDerWaalsContact OE2-CE 3.32Å; E360-K453 WeakPolarHBondContact OE2-CE 3.47Å; E360-K453 IonicContact OE2-NZ 3.34Å; E360-K453 PolarHBondContact OE2-NZ 3.37Å
361	L	98.4	Very high	97.8	Very high	1 Å²	1	39.9 Å²	39.9	1%	0.005	20%	0.2	C	C	.	.	H	α-helix	trans	-62.6	-45.4	172.4	178.4	62.9	0	0	0	110.8	L357 F359 H365 L366 V445 L448 L449 A503 L506 L507	L357-L361 VanDerWaalsContact O-CB 3.23Å; L357-L361 WeakPolarHBondContact O-CB 3.5Å; L357-L361 PolarHBondContact O-N 3.46Å; F359-L361 VanDerWaalsContact C-N 3.34Å; F359-L361 PolarHBondContact O-N 2.72Å; L361-H365 HydrophobicContact CD1-CB 4.16Å; L361-H365 WeakPolarHBondContact O-CB 3.31Å; L361-H365 PolarHBondContact O-N 3.21Å; L361-H365 VanDerWaalsContact O-N 3.11Å; L361-L366 HydrophobicContact CG-CD1 4.29Å; L361-L366 PolarHBondContact O-N 3.01Å; L361-V445 HydrophobicContact CD2-CG2 3.99Å; L361-L448 HydrophobicContact CD1-CB 4.23Å; L361-L448 HydrophobicContact CD1-CD1 3.92Å; L361-L449 HydrophobicContact CD1-CD2 4.33Å; L361-A503 HydrophobicContact CB-CB 4.42Å; L361-A503 HydrophobicContact CD2-CB 4.05Å; L361-A503 HydrophobicContact CG-CB 4.31Å; L361-L506 HydrophobicContact CD2-CB 4.22Å; L361-L506 HydrophobicContact CD2-CD1 4.37Å; L361-L507 HydrophobicContact CB-CD1 4.3Å; L361-L507 HydrophobicContact CD2-CD1 3.86Å; L361-L507 HydrophobicContact CD2-CD2 3.87Å; L361-L507 HydrophobicContact CD2-CG 3.6Å
362	A	98.5	Very high	97.7	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-61.3	-46	-179.5	0	0	0	0	0	112.1	I358 F359 L366 F367 F368 V499 A503	I358-A362 VanDerWaalsContact O-CB 3.29Å; I358-A362 WeakPolarHBondContact O-CB 3.28Å; I358-A362 PolarHBondContact O-N 2.82Å; F359-A362 WeakPolarHBondContact O-CB 3.34Å; F359-A362 PolarHBondContact O-N 2.89Å; F359-A362 VanDerWaalsContact O-N 3.12Å; A362-L366 CarbonylContact O-C 3.26Å; A362-L366 VanDerWaalsContact O-C 3.26Å; A362-L366 WeakPolarHBondContact O-CA 3.21Å; A362-L366 WeakPolarHBondContact O-CB 3.45Å; A362-L366 PolarHBondContact O-N 3.29Å; A362-L366 VanDerWaalsContact O-N 3.08Å; A362-F367 PolarHBondContact O-N 2.84Å; A362-F368 HydrophobicContact CB-CB 3.76Å; A362-F368 HydrophobicContact CB-CD1 4.38Å; A362-F368 HydrophobicContact CB-CG 4.13Å; A362-F368 WeakPolarHBondContact O-CB 3.32Å; A362-F368 PolarHBondContact O-N 2.92Å; A362-V499 HydrophobicContact CB-CG1 4.27Å; A362-A503 HydrophobicContact CB-CB 4.22Å
363	D	96.8	Very high	97.5	Very high	62 Å²	62	49 Å²	49	33%	0.332	24%	0.24	S	C	.	.	H	α-helix	trans	-72.3	-49.9	-179.9	-75.8	-31.9	0	0	0	113	F359 F368 N369	F359-D363 WeakPolarHBondContact O-CB 3.18Å; F359-D363 PolarHBondContact O-N 2.81Å; D363-F368 WeakPolarHBondContact OD1-CB 3.45Å; D363-F368 WeakPolarHBondContact OD1-CD1 3.32Å; D363-N369 PolarHBondContact OD1-N 3.48Å; D363-N369 PolarHBondContact OD1-ND2 2.94Å
364	T	96.4	Very high	97.3	Very high	89 Å²	89	48.2 Å²	48.2	55%	0.546	24%	0.238	S	C	.	.	H	α-helix	trans	-74.8	-30.3	-170.7	-50.9	0	0	0	0	112.4	E360	E360-T364 WeakPolarHBondContact CG-OG1 3.43Å; E360-T364 WeakPolarHBondContact O-CB 3.35Å; E360-T364 PolarHBondContact O-N 2.88Å; E360-T364 PolarHBondContact O-OG1 3.32Å
365	H	96.9	Very high	97.2	Very high	51 Å²	51	48.3 Å²	48.3	24%	0.236	24%	0.239	C	C	.	.	H	α-helix	trans	-126.8	-22.8	-170.8	-56.7	-80.8	0	0	0	115.1	L361 I437 L448	L361-H365 HydrophobicContact CD1-CB 4.16Å; L361-H365 WeakPolarHBondContact O-CB 3.31Å; L361-H365 PolarHBondContact O-N 3.21Å; L361-H365 VanDerWaalsContact O-N 3.11Å; H365-I437 VanDerWaalsContact O-CD1 3.27Å; H365-I437 WeakPolarHBondContact O-CD1 3.47Å; H365-L448 HydrophobicContact CB-CD2 4.41Å; H365-L448 PolarHBondContact CE1-O 2.99Å; H365-L448 PolarHBondContact NE2-O 3.45Å
366	L	98.1	Very high	97.2	Very high	1 Å²	1	47.3 Å²	47.3	1%	0.005	23%	0.234	C	C	.	.	S	Bend	trans	-112.9	10.7	-171.7	-47.5	-177.2	0	0	0	113.9	L361 A362 F368 L434 I437 V499 L502 A503	L361-L366 HydrophobicContact CG-CD1 4.29Å; L361-L366 PolarHBondContact O-N 3.01Å; A362-L366 CarbonylContact O-C 3.26Å; A362-L366 VanDerWaalsContact O-C 3.26Å; A362-L366 WeakPolarHBondContact O-CA 3.21Å; A362-L366 WeakPolarHBondContact O-CB 3.45Å; A362-L366 PolarHBondContact O-N 3.29Å; A362-L366 VanDerWaalsContact O-N 3.08Å; L366-F368 PolarHBondContact O-N 2.86Å; L366-L434 HydrophobicContact CB-CD1 3.65Å; L366-L434 HydrophobicContact CD1-CD1 4.41Å; L366-L434 HydrophobicContact CD2-CD1 3.75Å; L366-L434 HydrophobicContact CG-CD1 4.12Å; L366-I437 HydrophobicContact CD2-CG2 3.86Å; L366-V499 HydrophobicContact CB-CG1 3.67Å; L366-V499 WeakPolarHBondContact O-CG1 3.37Å; L366-L502 HydrophobicContact CD1-CB 4.49Å; L366-A503 HydrophobicContact CD1-CB 3.92Å
367	F	97.6	Very high	97.2	Very high	30 Å²	30	42.9 Å²	42.9	13%	0.132	21%	0.214	C	C	.	.			trans	63.4	27.8	177.3	-51.8	-88.3	0	0	0	115.3	A362 N369 D370 L371 F396 R430 R433 I437	A362-F367 PolarHBondContact O-N 2.84Å; F367-N369 PolarHBondContact O-N 3.35Å; F367-D370 HydrophobicContact CB-CB 4.43Å; F367-D370 PolarHBondContact O-N 3.42Å; F367-L371 HydrophobicContact CB-CD1 4.01Å; F367-L371 HydrophobicContact CB-CG 4.11Å; F367-L371 WeakPolarHBondContact O-CB 3.46Å; F367-L371 WeakPolarHBondContact O-CG 3.48Å; F367-L371 PolarHBondContact O-N 2.8Å; F367-F396 HydrophobicContact CE1-CB 3.73Å; F367-F396 AromaticContact CE1-CD1 3.89Å; F367-F396 HydrophobicContact CE1-CD1 3.89Å; F367-F396 HydrophobicContact CE1-CD2 4.03Å; F367-F396 AromaticContact CE1-CG 3.6Å; F367-F396 HydrophobicContact CE1-CG 3.6Å; F367-F396 HydrophobicContact CZ-CD1 4.1Å; F367-F396 AromaticContact CZ-CD2 3.97Å; F367-F396 HydrophobicContact CZ-CD2 3.97Å; F367-F396 HydrophobicContact CZ-CE1 4.32Å; F367-F396 HydrophobicContact CZ-CE2 4.22Å; F367-F396 AromaticContact CZ-CG 3.93Å; F367-F396 HydrophobicContact CZ-CG 3.93Å; F367-F396 HydrophobicContact CZ-CZ 4.39Å; F367-R430 HydrophobicContact CD1-CG 4.38Å; F367-R430 HydrophobicContact CG-CG 4.34Å; F367-R433 HydrophobicContact CE2-CB 4.05Å; F367-R433 HydrophobicContact CE2-CG 3.7Å; F367-R433 HydrophobicContact CZ-CB 4.43Å; F367-R433 HydrophobicContact CZ-CG 3.86Å; F367-I437 HydrophobicContact CE2-CD1 4.27Å
368	F	97.9	Very high	97.2	Very high	14 Å²	14	43.9 Å²	43.9	6%	0.061	22%	0.219	C	C	.	.	H	α-helix	trans	-58.9	-43	-174	-175.2	-123.7	0	0	0	114	F359 A362 D363 L366 D370 L371 E372 V499 P500	F359-F368 HydrophobicContact CD1-CD1 4.29Å; F359-F368 AromaticContact CD1-CE1 3.94Å; F359-F368 HydrophobicContact CD1-CE1 3.94Å; F359-F368 AromaticContact CE1-CE1 3.89Å; F359-F368 HydrophobicContact CE1-CE1 3.89Å; F359-F368 HydrophobicContact CE1-CZ 4.39Å; A362-F368 HydrophobicContact CB-CB 3.76Å; A362-F368 HydrophobicContact CB-CD1 4.38Å; A362-F368 HydrophobicContact CB-CG 4.13Å; A362-F368 WeakPolarHBondContact O-CB 3.32Å; A362-F368 PolarHBondContact O-N 2.92Å; D363-F368 WeakPolarHBondContact OD1-CB 3.45Å; D363-F368 WeakPolarHBondContact OD1-CD1 3.32Å; L366-F368 PolarHBondContact O-N 2.86Å; F368-D370 PolarHBondContact O-N 3.3Å; F368-D370 VanDerWaalsContact O-N 3.1Å; F368-L371 PolarHBondContact O-N 3.14Å; F368-E372 HydrophobicContact CD2-CB 4.25Å; F368-E372 HydrophobicContact CE2-CB 3.79Å; F368-E372 HydrophobicContact CE2-CG 3.95Å; F368-E372 HydrophobicContact CZ-CB 4.01Å; F368-E372 HydrophobicContact CZ-CG 3.82Å; F368-E372 PolarHBondContact O-N 2.72Å; F368-V499 HydrophobicContact CB-CG1 3.78Å; F368-V499 HydrophobicContact CD2-CB 3.99Å; F368-V499 HydrophobicContact CD2-CG1 4.01Å; F368-V499 HydrophobicContact CG-CG1 4.28Å; F368-P500 HydrophobicContact CD2-CG 3.93Å; F368-P500 HydrophobicContact CE1-CG 4.38Å; F368-P500 HydrophobicContact CE2-CG 3.58Å; F368-P500 HydrophobicContact CG-CG 4.48Å; F368-P500 HydrophobicContact CZ-CG 3.84Å
369	N	95.6	Very high	97.2	Very high	119 Å²	119	44 Å²	44	64%	0.636	22%	0.219	S	C	*	.	H	α-helix	trans	-49.8	-31.4	170	-90.1	-98.2	0	0	0	115	D363 F367	D363-N369 PolarHBondContact OD1-N 3.48Å; D363-N369 PolarHBondContact OD1-ND2 2.94Å; F367-N369 PolarHBondContact O-N 3.35Å
370	D	96.2	Very high	97.2	Very high	29 Å²	29	43.5 Å²	43.5	16%	0.155	22%	0.218	C	C	.	.	H	α-helix	trans	-90.2	-30.6	176.6	-76.1	1.5	0	0	0	111.5	F367 F368 C374 F401 N402 R430	F367-D370 HydrophobicContact CB-CB 4.43Å; F367-D370 PolarHBondContact O-N 3.42Å; F368-D370 PolarHBondContact O-N 3.3Å; F368-D370 VanDerWaalsContact O-N 3.1Å; D370-C374 PolarHBondContact O-SG 2.91Å; D370-C374 VanDerWaalsContact O-SG 3.38Å; D370-F401 HydrophobicContact CB-CD1 3.96Å; D370-F401 HydrophobicContact CB-CE1 3.98Å; D370-F401 WeakPolarHBondContact O-CE1 3.45Å; D370-N402 PolarHBondContact OD1-ND2 3.03Å; D370-N402 PolarHBondContact OD1-OD1 3.47Å; D370-R430 IonicContact OD2-CZ 3.23Å; D370-R430 IonicContact OD2-NE 3.48Å; D370-R430 PolarHBondContact OD2-NE 2.73Å; D370-R430 IonicContact OD2-NH2 2.73Å; D370-R430 PolarHBondContact OD2-NH2 2.64Å
371	L	97.4	Very high	97.2	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-98.8	-17.3	-166.8	-66.4	-177.1	0	0	0	115.2	F367 F368 E373 C374 D375 L427 R430 Y431 L434 V499	F367-L371 HydrophobicContact CB-CD1 4.01Å; F367-L371 HydrophobicContact CB-CG 4.11Å; F367-L371 WeakPolarHBondContact O-CB 3.46Å; F367-L371 WeakPolarHBondContact O-CG 3.48Å; F367-L371 PolarHBondContact O-N 2.8Å; F368-L371 PolarHBondContact O-N 3.14Å; L371-E373 PolarHBondContact O-N 2.95Å; L371-C374 CarbonylContact O-C 3.16Å; L371-C374 VanDerWaalsContact O-C 3.24Å; L371-C374 PolarHBondContact O-N 2.6Å; L371-D375 WeakPolarHBondContact O-CA 3.49Å; L371-D375 PolarHBondContact O-N 3.32Å; L371-L427 HydrophobicContact CD2-CD1 3.63Å; L371-R430 HydrophobicContact CD1-CB 4.3Å; L371-R430 HydrophobicContact CD2-CB 3.96Å; L371-R430 HydrophobicContact CG-CB 4.48Å; L371-Y431 HydrophobicContact CD1-CE1 4.37Å; L371-Y431 HydrophobicContact CD1-CE2 4.1Å; L371-Y431 HydrophobicContact CD2-CD2 4.24Å; L371-Y431 HydrophobicContact CD2-CE2 3.68Å; L371-Y431 HydrophobicContact CG-CE2 4.43Å; L371-L434 HydrophobicContact CD1-CD2 4.44Å; L371-V499 HydrophobicContact CB-CG2 4.07Å; L371-V499 HydrophobicContact CD1-CG2 3.73Å
372	E	96	Very high	97.2	Very high	103 Å²	103	42.8 Å²	42.8	48%	0.481	22%	0.217	S	C	.	.	S	Bend	trans	-53.1	-55.3	-175.2	-177.2	174.9	-149.9	0	0	113.3	F368 C374 D375	F368-E372 HydrophobicContact CD2-CB 4.25Å; F368-E372 HydrophobicContact CE2-CB 3.79Å; F368-E372 HydrophobicContact CE2-CG 3.95Å; F368-E372 HydrophobicContact CZ-CB 4.01Å; F368-E372 HydrophobicContact CZ-CG 3.82Å; F368-E372 PolarHBondContact O-N 2.72Å; E372-C374 PolarHBondContact O-N 3.39Å; E372-D375 PolarHBondContact O-N 3.46Å
373	E	93.8	Very high	97.1	Very high	173 Å²	173	44.9 Å²	44.9	81%	0.808	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-31.7	178.9	-64.5	-165.8	161.6	0	0	112.3	L371 K524	L371-E373 PolarHBondContact O-N 2.95Å; E373-K524 PolarHBondContact O-NZ 2.92Å
374	C	95.6	Very high	97.1	Very high	18 Å²	18	46.7 Å²	46.7	12%	0.122	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.4	20.9	-173.9	64	0	0	0	0	114.8	D370 L371 E372 Q376 W423 L427	D370-C374 PolarHBondContact O-SG 2.91Å; D370-C374 VanDerWaalsContact O-SG 3.38Å; L371-C374 CarbonylContact O-C 3.16Å; L371-C374 VanDerWaalsContact O-C 3.24Å; L371-C374 PolarHBondContact O-N 2.6Å; E372-C374 PolarHBondContact O-N 3.39Å; C374-Q376 PolarHBondContact O-NE2 2.84Å; C374-W423 HydrophobicContact CB-CH2 3.78Å; C374-W423 HydrophobicContact CB-CZ2 3.97Å; C374-L427 HydrophobicContact CB-CD1 4.25Å; C374-L427 VanDerWaalsContact SG-CD1 3.51Å
375	D	96.5	Very high	97.2	Very high	3 Å²	3	45.1 Å²	45.1	2%	0.016	24%	0.24	C	C	.	.			trans	-53.6	148.1	-177.1	-174.5	46.2	0	0	0	113.9	L371 E372 Y431 Q497 L498 K524	L371-D375 WeakPolarHBondContact O-CA 3.49Å; L371-D375 PolarHBondContact O-N 3.32Å; E372-D375 PolarHBondContact O-N 3.46Å; D375-Y431 WeakPolarHBondContact CA-OH 3.15Å; D375-Y431 PolarHBondContact OD1-OH 3.48Å; D375-Q497 WeakPolarHBondContact OD2-CA 3.39Å; D375-Q497 WeakPolarHBondContact OD2-CB 3.36Å; D375-L498 WeakPolarHBondContact OD1-CB 3.28Å; D375-L498 PolarHBondContact OD1-N 2.7Å; D375-L498 PolarHBondContact OD2-N 2.77Å; D375-K524 WeakPolarHBondContact O-CD 3.32Å; D375-K524 WeakPolarHBondContact O-CE 3.49Å; D375-K524 PolarHBondContact O-NZ 3.13Å
376	Q	98.4	Very high	97.1	Very high	42 Å²	42	44.2 Å²	44.2	20%	0.196	24%	0.237	C	C	.	.			trans	-117.2	152.8	-171.6	-62.2	-59.9	-47.9	0	0	111.6	C374 H378 D381 V382 Y431 L498	C374-Q376 PolarHBondContact O-NE2 2.84Å; Q376-H378 VanDerWaalsContact C-N 3.34Å; Q376-D381 HydrophobicContact CB-CB 4.3Å; Q376-V382 HydrophobicContact CG-CG1 4.13Å; Q376-Y431 HydrophobicContact CB-CE1 4.09Å; Q376-Y431 HydrophobicContact CB-CE2 4.24Å; Q376-Y431 HydrophobicContact CG-CD2 4.09Å; Q376-Y431 HydrophobicContact CG-CE1 4.19Å; Q376-Y431 HydrophobicContact CG-CE2 3.45Å; Q376-Y431 VanDerWaalsContact CG-CE2 3.45Å; Q376-Y431 PolarHBondContact N-OH 2.9Å; Q376-L498 VanDerWaalsContact O-CB 3.24Å; Q376-L498 WeakPolarHBondContact O-CB 3.11Å; Q376-L498 WeakPolarHBondContact O-CD2 3.21Å
377	V	98.7	Very high	97	Very high	11 Å²	11	48.2 Å²	48.2	7%	0.067	26%	0.258	C	S	.	.	S	Bend	trans	-71.4	-34.3	177.4	166.5	0	0	0	0	110.9	D381 Y520 S521 I525 R533	V377-D381 WeakPolarHBondContact CB-OD2 3.19Å; V377-D381 PolarHBondContact N-OD2 3.49Å; V377-Y520 HydrophobicContact CG1-CD1 4.48Å; V377-Y520 CarbonylContact O-C 3.24Å; V377-Y520 WeakPolarHBondContact O-CA 3.29Å; V377-S521 WeakPolarHBondContact CG1-O 3.25Å; V377-S521 PolarHBondContact O-N 3.05Å; V377-I525 HydrophobicContact CB-CD1 4.38Å; V377-I525 HydrophobicContact CG1-CD1 3.68Å; V377-I525 HydrophobicContact CG1-CG1 4.23Å; V377-I525 HydrophobicContact CG2-CB 4.45Å; V377-I525 HydrophobicContact CG2-CD1 3.87Å; V377-I525 HydrophobicContact CG2-CG1 3.81Å; V377-I525 HydrophobicContact CG2-CG2 3.9Å; V377-R533 VanDerWaalsContact CG1-NH1 3.35Å
378	H	98.8	Very high	96.9	Very high	22 Å²	22	49.6 Å²	49.6	10%	0.102	28%	0.281	C	S	.	.	B	Isolated β-bridge	trans	-143.4	149.3	-174.7	-171.9	-102.5	0	0	0	111.9	Q376 E380 D381 E517 I519 Y520 R537	Q376-H378 VanDerWaalsContact C-N 3.34Å; H378-E380 WeakPolarHBondContact CE1-CG 3.35Å; H378-E380 PolarHBondContact ND1-N 3.47Å; H378-E380 PolarHBondContact O-N 3.2Å; H378-E380 VanDerWaalsContact O-N 3.12Å; H378-D381 WeakPolarHBondContact CB-OD2 3.39Å; H378-D381 PolarHBondContact N-OD2 3.32Å; H378-D381 WeakPolarHBondContact O-CB 3.25Å; H378-D381 PolarHBondContact O-N 3.38Å; H378-D381 VanDerWaalsContact O-N 3.09Å; H378-E517 WeakPolarHBondContact NE2-CA 3.26Å; H378-E517 CovalentContact NE2-O 1.76Å; H378-E517 PolarHBondContact NE2-O 2.89Å; H378-I519 PolarHBondContact CD2-O 3.07Å; H378-Y520 HydrophobicContact CB-CD1 4.23Å; H378-Y520 HydrophobicContact CB-CE1 4.36Å; H378-Y520 AromaticContact CD2-CD1 3.68Å; H378-Y520 AromaticContact CD2-CE1 3.43Å; H378-Y520 VanDerWaalsContact CD2-CE1 3.43Å; H378-Y520 WeakPolarHBondContact CD2-CE1 3.39Å; H378-Y520 AromaticContact CD2-CZ 3.72Å; H378-Y520 AromaticContact NE2-CZ 3.89Å; H378-R537 PolarHBondContact NE2-NH1 3.35Å
379	I	98.4	Very high	96.9	Very high	5 Å²	5	52.2 Å²	52.2	3%	0.026	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-24.7	-176.9	-171.5	60	0	0	0	114.2	Y431 L434 K435 I516	I379-Y431 HydrophobicContact CD1-CD1 3.88Å; I379-Y431 VanDerWaalsContact CD1-O 3.28Å; I379-Y431 WeakPolarHBondContact CD1-O 3.3Å; I379-L434 HydrophobicContact CD1-CD2 4.17Å; I379-L434 HydrophobicContact CD1-CG 4.27Å; I379-K435 HydrophobicContact CD1-CB 4.02Å; I379-K435 HydrophobicContact CG1-CB 3.92Å; I379-K435 HydrophobicContact CG1-CD 4.18Å; I379-K435 HydrophobicContact CG1-CG 4.37Å; I379-I516 HydrophobicContact CB-CD1 4.29Å; I379-I516 HydrophobicContact CB-CG1 4Å; I379-I516 HydrophobicContact CD1-CD1 3.67Å; I379-I516 HydrophobicContact CD1-CG1 4.33Å; I379-I516 HydrophobicContact CG1-CD1 3.68Å; I379-I516 HydrophobicContact CG1-CG1 3.86Å; I379-I516 HydrophobicContact CG2-CG1 4.15Å
380	E	97.6	Very high	96.8	Very high	72 Å²	72	51 Å²	51	34%	0.336	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.9	-1.2	179.4	-51.5	-61.9	135.2	0	0	114.2	H378 V382 A383 K435	H378-E380 WeakPolarHBondContact CE1-CG 3.35Å; H378-E380 PolarHBondContact ND1-N 3.47Å; H378-E380 PolarHBondContact O-N 3.2Å; H378-E380 VanDerWaalsContact O-N 3.12Å; E380-V382 PolarHBondContact O-N 2.93Å; E380-A383 HydrophobicContact CB-CB 4.28Å; E380-A383 VanDerWaalsContact O-CB 3.31Å; E380-A383 WeakPolarHBondContact O-CB 3.23Å; E380-A383 PolarHBondContact O-N 3.49Å; E380-K435 WeakPolarHBondContact OE1-CD 3.37Å; E380-K435 IonicContact OE1-NZ 2.89Å; E380-K435 PolarHBondContact OE1-NZ 3.11Å
381	D	98.3	Very high	96.8	Very high	49 Å²	49	49.8 Å²	49.8	26%	0.262	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-25.6	-172.9	-91.7	-44.1	0	0	0	113.9	Q376 V377 H378 R533	Q376-D381 HydrophobicContact CB-CB 4.3Å; V377-D381 WeakPolarHBondContact CB-OD2 3.19Å; V377-D381 PolarHBondContact N-OD2 3.49Å; H378-D381 WeakPolarHBondContact CB-OD2 3.39Å; H378-D381 PolarHBondContact N-OD2 3.32Å; H378-D381 WeakPolarHBondContact O-CB 3.25Å; H378-D381 PolarHBondContact O-N 3.38Å; H378-D381 VanDerWaalsContact O-N 3.09Å; D381-R533 VanDerWaalsContact CG-NH1 3.28Å; D381-R533 IonicContact OD1-CZ 3.33Å; D381-R533 IonicContact OD1-NH1 3.5Å; D381-R533 PolarHBondContact OD1-NH1 2.76Å; D381-R533 IonicContact OD1-NH2 3.36Å; D381-R533 PolarHBondContact OD1-NH2 3.01Å; D381-R533 IonicContact OD2-CZ 2.68Å; D381-R533 IonicContact OD2-NH1 3.21Å; D381-R533 PolarHBondContact OD2-NH1 2.69Å; D381-R533 IonicContact OD2-NH2 2.73Å
382	V	97.8	Very high	96.7	Very high	5 Å²	5	53.8 Å²	53.8	3%	0.03	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.2	5.6	179.7	-64.8	0	0	0	0	113.5	Q376 E380 S384 D385 M424 L427 A428 Y431	Q376-V382 HydrophobicContact CG-CG1 4.13Å; E380-V382 PolarHBondContact O-N 2.93Å; V382-S384 PolarHBondContact O-N 3.13Å; V382-S384 VanDerWaalsContact O-N 3.13Å; V382-D385 PolarHBondContact O-N 2.98Å; V382-M424 HydrophobicContact CG1-CE 4.13Å; V382-L427 HydrophobicContact CG1-CD2 3.8Å; V382-L427 HydrophobicContact CG1-CG 4.13Å; V382-L427 HydrophobicContact CG2-CG 4.42Å; V382-A428 HydrophobicContact CB-CB 4.42Å; V382-A428 HydrophobicContact CG2-CB 4.31Å; V382-A428 VanDerWaalsContact O-CB 3.23Å; V382-A428 WeakPolarHBondContact O-CB 3.44Å; V382-Y431 HydrophobicContact CG2-CD2 3.74Å; V382-Y431 HydrophobicContact CG2-CG 4Å
383	A	96.6	Very high	96.6	Very high	44 Å²	44	56.3 Å²	56.3	36%	0.364	33%	0.325	S	S	.	.	G	3₁₀ helix	trans	-65.1	-18.3	-174.9	0	0	0	0	0	113.7	E380 D385 D386	E380-A383 HydrophobicContact CB-CB 4.28Å; E380-A383 VanDerWaalsContact O-CB 3.31Å; E380-A383 WeakPolarHBondContact O-CB 3.23Å; E380-A383 PolarHBondContact O-N 3.49Å; A383-D385 VanDerWaalsContact C-N 3.25Å; A383-D385 PolarHBondContact O-N 2.98Å; A383-D386 PolarHBondContact O-N 3.19Å
384	S	97	Very high	96.8	Very high	101 Å²	101	50.5 Å²	50.5	71%	0.706	30%	0.296	S	S	*	.	G	3₁₀ helix	trans	-63.2	-26.4	174.6	46	0	0	0	0	114.7	V382	V382-S384 PolarHBondContact O-N 3.13Å; V382-S384 VanDerWaalsContact O-N 3.13Å
385	D	97.5	Very high	96.8	Very high	56 Å²	56	54.4 Å²	54.4	30%	0.299	32%	0.315	S	S	.	.	G	3₁₀ helix	trans	-96.3	-6.7	-173.3	-67	-101.3	0	0	0	112.1	V382 A383 M424 R425 A428	V382-D385 PolarHBondContact O-N 2.98Å; A383-D385 VanDerWaalsContact C-N 3.25Å; A383-D385 PolarHBondContact O-N 2.98Å; D385-M424 HydrophobicContact CB-CB 4.03Å; D385-R425 WeakPolarHBondContact O-CG 3.4Å; D385-A428 HydrophobicContact CB-CB 4.39Å
386	D	96.4	Very high	96.8	Very high	31 Å²	31	55.2 Å²	55.2	17%	0.166	32%	0.319	C	S	.	.			trans	-74.8	140.3	174.4	-152.9	-52.1	0	0	0	111.8	A383 G388 A428 F429 R432	A383-D386 PolarHBondContact O-N 3.19Å; D386-G388 PolarHBondContact OD1-N 2.83Å; D386-A428 HydrophobicContact CB-CB 3.9Å; D386-F429 WeakPolarHBondContact OD1-CE1 3.31Å; D386-F429 WeakPolarHBondContact OD2-CD1 2.97Å; D386-R432 VanDerWaalsContact CG-NE 3.28Å; D386-R432 IonicContact OD1-CZ 2.63Å; D386-R432 IonicContact OD1-NE 3.67Å; D386-R432 PolarHBondContact OD1-NE 3Å; D386-R432 IonicContact OD1-NH2 3Å; D386-R432 PolarHBondContact OD1-NH2 3.09Å; D386-R432 IonicContact OD2-CZ 3.43Å; D386-R432 IonicContact OD2-NE 2.79Å; D386-R432 PolarHBondContact OD2-NE 3.12Å; D386-R432 IonicContact OD2-NH2 3.16Å; D386-R432 PolarHBondContact OD2-NH2 3.21Å
387	N	95.9	Very high	96.5	Very high	86 Å²	86	61.3 Å²	61.3	46%	0.46	35%	0.35	S	S	.	.			trans	-94.1	-1.5	176.1	70.3	-1.3	0	0	0	113.5	Q389 F429	N387-Q389 VanDerWaalsContact C-N 3.31Å; N387-Q389 PolarHBondContact ND2-OE1 3.13Å; N387-Q389 PolarHBondContact O-N 1.76Å; N387-Q389 VanDerWaalsContact OD1-CB 3.24Å; N387-Q389 WeakPolarHBondContact OD1-CB 3.42Å; N387-Q389 WeakPolarHBondContact OD1-CG 3.01Å; N387-Q389 PolarHBondContact OD1-N 3.26Å; N387-F429 VanDerWaalsContact OD1-CE1 3.29Å; N387-F429 WeakPolarHBondContact OD1-CE1 3.41Å
388	G	95.4	Very high	96.3	Very high	58 Å²	58	64.3 Å²	64.3	60%	0.598	38%	0.375	S	S	*	.			trans	75.5	9.6	-178.4	0	0	0	0	0	115.2	D386	D386-G388 PolarHBondContact OD1-N 2.83Å
389	Q	96.1	Very high	96.1	Very high	70 Å²	70	64.5 Å²	64.5	33%	0.327	38%	0.377	S	S	.	.			trans	-62.1	152.4	-179.3	75.8	-175.8	24.9	0	0	112.3	N387 L391 F429 R432	N387-Q389 VanDerWaalsContact C-N 3.31Å; N387-Q389 PolarHBondContact ND2-OE1 3.13Å; N387-Q389 PolarHBondContact O-N 1.76Å; N387-Q389 VanDerWaalsContact OD1-CB 3.24Å; N387-Q389 WeakPolarHBondContact OD1-CB 3.42Å; N387-Q389 WeakPolarHBondContact OD1-CG 3.01Å; N387-Q389 PolarHBondContact OD1-N 3.26Å; Q389-L391 HydrophobicContact CG-CD2 4.13Å; Q389-L391 PolarHBondContact O-N 3Å; Q389-F429 HydrophobicContact CG-CE1 3.84Å; Q389-F429 HydrophobicContact CG-CZ 3.74Å; Q389-R432 VanDerWaalsContact O-CZ 3.26Å; Q389-R432 PolarHBondContact O-NH1 2.91Å; Q389-R432 PolarHBondContact O-NH2 2.97Å
390	D	95.3	Very high	95.8	Very high	94 Å²	94	66.1 Å²	66.1	50%	0.503	40%	0.395	S	S	.	.			trans	-60.5	138.2	169.5	174.6	43.7	0	0	0	110.9	S392	D390-S392 VanDerWaalsContact OD1-CB 3.31Å; D390-S392 WeakPolarHBondContact OD1-CB 3.47Å; D390-S392 PolarHBondContact OD1-N 3.23Å; D390-S392 PolarHBondContact OD1-OG 3.4Å; D390-S392 VanDerWaalsContact OD2-CB 3.31Å; D390-S392 WeakPolarHBondContact OD2-CB 3.21Å; D390-S392 PolarHBondContact OD2-N 2.94Å; D390-S392 PolarHBondContact OD2-OG 3.39Å
391	L	96.1	Very high	95.6	Very high	3 Å²	3	62.9 Å²	62.9	2%	0.016	38%	0.38	C	S	.	.			trans	-109.4	-0.9	178.8	-60.8	176.7	0	0	0	112.5	Q389 N393 Y394 F396 F429 R432 R433	Q389-L391 HydrophobicContact CG-CD2 4.13Å; Q389-L391 PolarHBondContact O-N 3Å; L391-N393 PolarHBondContact O-N 3.02Å; L391-Y394 HydrophobicContact CD2-CD1 4.37Å; L391-Y394 HydrophobicContact CD2-CD2 4.24Å; L391-Y394 HydrophobicContact CD2-CG 3.93Å; L391-Y394 WeakPolarHBondContact O-CB 3.38Å; L391-Y394 PolarHBondContact O-N 3.2Å; L391-Y394 VanDerWaalsContact O-N 3.07Å; L391-F396 HydrophobicContact CB-CZ 4.31Å; L391-F396 HydrophobicContact CD1-CZ 4.28Å; L391-F396 HydrophobicContact CD2-CZ 4.46Å; L391-F429 HydrophobicContact CD1-CB 4.13Å; L391-F429 HydrophobicContact CD1-CD1 4.48Å; L391-F429 WeakPolarHBondContact CD1-O 3.26Å; L391-F429 HydrophobicContact CD2-CB 4.01Å; L391-F429 HydrophobicContact CD2-CD1 3.9Å; L391-F429 HydrophobicContact CD2-CD2 4.23Å; L391-F429 HydrophobicContact CD2-CE1 4.38Å; L391-F429 HydrophobicContact CD2-CG 3.8Å; L391-R432 HydrophobicContact CD1-CB 4.43Å; L391-R432 HydrophobicContact CD1-CG 4.45Å; L391-R433 HydrophobicContact CD1-CB 4.3Å
392	S	93.6	Very high	94.9	Very high	84 Å²	84	65.2 Å²	65.2	59%	0.587	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-30.4	-177.1	-51.7	0	0	0	0	112.9	D390	D390-S392 VanDerWaalsContact OD1-CB 3.31Å; D390-S392 WeakPolarHBondContact OD1-CB 3.47Å; D390-S392 PolarHBondContact OD1-N 3.23Å; D390-S392 PolarHBondContact OD1-OG 3.4Å; D390-S392 VanDerWaalsContact OD2-CB 3.31Å; D390-S392 WeakPolarHBondContact OD2-CB 3.21Å; D390-S392 PolarHBondContact OD2-N 2.94Å; D390-S392 PolarHBondContact OD2-OG 3.39Å
393	N	94.9	Very high	93.2	Very high	155 Å²	155	68.5 Å²	68.5	83%	0.829	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.9	13.9	175	-62.1	-62.9	0	0	0	113.2	L391	L391-N393 PolarHBondContact O-N 3.02Å
394	Y	96.9	Very high	91.2	Very high	52 Å²	52	70.2 Å²	70.2	20%	0.204	44%	0.436	C	S	.	.			trans	-85.1	124.1	-176.7	-172.9	-91.5	0	0	0	111.5	L391 F396 D399 F429	L391-Y394 HydrophobicContact CD2-CD1 4.37Å; L391-Y394 HydrophobicContact CD2-CD2 4.24Å; L391-Y394 HydrophobicContact CD2-CG 3.93Å; L391-Y394 WeakPolarHBondContact O-CB 3.38Å; L391-Y394 PolarHBondContact O-N 3.2Å; L391-Y394 VanDerWaalsContact O-N 3.07Å; Y394-F396 AromaticContact CD1-CD1 3.77Å; Y394-F396 HydrophobicContact CD1-CD1 3.77Å; Y394-F396 AromaticContact CD1-CD2 3.84Å; Y394-F396 HydrophobicContact CD1-CD2 3.84Å; Y394-F396 AromaticContact CD1-CE1 3.71Å; Y394-F396 HydrophobicContact CD1-CE1 3.71Å; Y394-F396 AromaticContact CD1-CE2 3.76Å; Y394-F396 HydrophobicContact CD1-CE2 3.76Å; Y394-F396 AromaticContact CD1-CG 3.82Å; Y394-F396 HydrophobicContact CD1-CG 3.82Å; Y394-F396 AromaticContact CD1-CZ 3.7Å; Y394-F396 HydrophobicContact CD1-CZ 3.7Å; Y394-F396 AromaticContact CE1-CD1 3.79Å; Y394-F396 HydrophobicContact CE1-CD1 3.79Å; Y394-F396 AromaticContact CE1-CE1 3.95Å; Y394-F396 HydrophobicContact CE1-CE1 3.95Å; Y394-F396 HydrophobicContact CE1-CG 4.12Å; Y394-F396 HydrophobicContact CE1-CZ 4.4Å; Y394-F396 WeakPolarHBondContact O-CD2 3.41Å; Y394-F396 PolarHBondContact O-N 3.34Å; Y394-D399 HydrophobicContact CE1-CB 4.06Å; Y394-D399 VanDerWaalsContact OH-CB 3.31Å; Y394-D399 WeakPolarHBondContact OH-CB 3.45Å; Y394-D399 PolarHBondContact OH-OD2 3.43Å; Y394-D399 VanDerWaalsContact OH-OD2 3.08Å; Y394-F429 HydrophobicContact CE1-CD2 4.15Å; Y394-F429 AromaticContact CE2-CD2 3.89Å; Y394-F429 HydrophobicContact CE2-CD2 3.89Å; Y394-F429 AromaticContact CE2-CE2 3.86Å; Y394-F429 HydrophobicContact CE2-CE2 3.86Å; Y394-F429 AromaticContact CZ-CD2 3.64Å
395	N	96.3	Very high	89	Confident	99 Å²	99	67.5 Å²	67.5	53%	0.529	43%	0.425	S	S	.	.			trans	-92.6	85.8	-177.8	-171.9	-6	0	0	0	111.9	M397 A398 D399	N395-M397 PolarHBondContact O-N 3.28Å; N395-M397 PolarHBondContact OD1-N 2.91Å; N395-A398 HydrophobicContact CB-CB 4.32Å; N395-A398 WeakPolarHBondContact ND2-CB 3.45Å; N395-A398 PolarHBondContact O-N 3.16Å; N395-A398 VanDerWaalsContact O-N 3.09Å; N395-A398 PolarHBondContact OD1-N 2.81Å; N395-D399 PolarHBondContact O-N 3.36Å
396	F	96.3	Very high	86.4	Confident	20 Å²	20	67.2 Å²	67.2	9%	0.088	44%	0.435	C	S	.	.	G	3₁₀ helix	trans	-54.1	-35.3	176.6	-62.8	-89.4	0	0	0	113.5	F367 L391 Y394 A398 D399 F429 R430 R433	F367-F396 HydrophobicContact CE1-CB 3.73Å; F367-F396 AromaticContact CE1-CD1 3.89Å; F367-F396 HydrophobicContact CE1-CD1 3.89Å; F367-F396 HydrophobicContact CE1-CD2 4.03Å; F367-F396 AromaticContact CE1-CG 3.6Å; F367-F396 HydrophobicContact CE1-CG 3.6Å; F367-F396 HydrophobicContact CZ-CD1 4.1Å; F367-F396 AromaticContact CZ-CD2 3.97Å; F367-F396 HydrophobicContact CZ-CD2 3.97Å; F367-F396 HydrophobicContact CZ-CE1 4.32Å; F367-F396 HydrophobicContact CZ-CE2 4.22Å; F367-F396 AromaticContact CZ-CG 3.93Å; F367-F396 HydrophobicContact CZ-CG 3.93Å; F367-F396 HydrophobicContact CZ-CZ 4.39Å; L391-F396 HydrophobicContact CB-CZ 4.31Å; L391-F396 HydrophobicContact CD1-CZ 4.28Å; L391-F396 HydrophobicContact CD2-CZ 4.46Å; Y394-F396 AromaticContact CD1-CD1 3.77Å; Y394-F396 HydrophobicContact CD1-CD1 3.77Å; Y394-F396 AromaticContact CD1-CD2 3.84Å; Y394-F396 HydrophobicContact CD1-CD2 3.84Å; Y394-F396 AromaticContact CD1-CE1 3.71Å; Y394-F396 HydrophobicContact CD1-CE1 3.71Å; Y394-F396 AromaticContact CD1-CE2 3.76Å; Y394-F396 HydrophobicContact CD1-CE2 3.76Å; Y394-F396 AromaticContact CD1-CG 3.82Å; Y394-F396 HydrophobicContact CD1-CG 3.82Å; Y394-F396 AromaticContact CD1-CZ 3.7Å; Y394-F396 HydrophobicContact CD1-CZ 3.7Å; Y394-F396 AromaticContact CE1-CD1 3.79Å; Y394-F396 HydrophobicContact CE1-CD1 3.79Å; Y394-F396 AromaticContact CE1-CE1 3.95Å; Y394-F396 HydrophobicContact CE1-CE1 3.95Å; Y394-F396 HydrophobicContact CE1-CG 4.12Å; Y394-F396 HydrophobicContact CE1-CZ 4.4Å; Y394-F396 WeakPolarHBondContact O-CD2 3.41Å; Y394-F396 PolarHBondContact O-N 3.34Å; F396-A398 VanDerWaalsContact C-N 3.26Å; F396-A398 PolarHBondContact O-N 3.43Å; F396-D399 VanDerWaalsContact O-OD1 3.07Å; F396-F429 HydrophobicContact CE1-CB 4.12Å; F396-R430 HydrophobicContact CD1-CG 3.94Å; F396-R430 HydrophobicContact CE1-CG 4.16Å; F396-R430 PolarHBondContact O-NH2 3.48Å; F396-R433 HydrophobicContact CE1-CB 4.19Å; F396-R433 HydrophobicContact CE2-CB 4.41Å; F396-R433 HydrophobicContact CE2-CG 3.97Å; F396-R433 HydrophobicContact CZ-CB 3.68Å; F396-R433 HydrophobicContact CZ-CG 3.75Å
397	M	93.5	Very high	83.8	Confident	171 Å²	171	70.8 Å²	70.8	84%	0.842	47%	0.469	S	S	*	.	G	3₁₀ helix	trans	-72.3	-17.7	-179	-65.8	-67.7	170.3	0	0	113.5	N395	N395-M397 PolarHBondContact O-N 3.28Å; N395-M397 PolarHBondContact OD1-N 2.91Å
398	A	94	Very high	81.3	Confident	73 Å²	73	70.9 Å²	70.9	60%	0.603	49%	0.49	S	S	*	.	G	3₁₀ helix	trans	-114.8	4.1	-179.1	0	0	0	0	0	113.6	N395 F396 G400	N395-A398 HydrophobicContact CB-CB 4.32Å; N395-A398 WeakPolarHBondContact ND2-CB 3.45Å; N395-A398 PolarHBondContact O-N 3.16Å; N395-A398 VanDerWaalsContact O-N 3.09Å; N395-A398 PolarHBondContact OD1-N 2.81Å; F396-A398 VanDerWaalsContact C-N 3.26Å; F396-A398 PolarHBondContact O-N 3.43Å; A398-G400 VanDerWaalsContact C-N 3.29Å; A398-G400 PolarHBondContact O-N 2.88Å
399	D	94.3	Very high	78.7	Confident	26 Å²	26	71.4 Å²	71.4	14%	0.139	50%	0.495	C	S	.	.	S	Bend	trans	-78.1	-11.5	-176.6	79.2	-4.4	0	0	0	114	Y394 N395 F396 F401 K426 R430	Y394-D399 HydrophobicContact CE1-CB 4.06Å; Y394-D399 VanDerWaalsContact OH-CB 3.31Å; Y394-D399 WeakPolarHBondContact OH-CB 3.45Å; Y394-D399 PolarHBondContact OH-OD2 3.43Å; Y394-D399 VanDerWaalsContact OH-OD2 3.08Å; N395-D399 PolarHBondContact O-N 3.36Å; F396-D399 VanDerWaalsContact O-OD1 3.07Å; D399-F401 WeakPolarHBondContact OD1-CB 3.42Å; D399-F401 PolarHBondContact OD1-N 2.97Å; D399-K426 HydrophobicContact CB-CD 4.41Å; D399-K426 VanDerWaalsContact O-CE 3.32Å; D399-K426 WeakPolarHBondContact O-CE 3.43Å; D399-K426 PolarHBondContact O-NZ 3.17Å; D399-R430 IonicContact OD1-CZ 3.39Å; D399-R430 IonicContact OD1-NH1 3.44Å; D399-R430 IonicContact OD1-NH2 3.39Å; D399-R430 PolarHBondContact OD1-NH2 3.02Å; D399-R430 VanDerWaalsContact OD1-NH2 3.16Å; D399-R430 IonicContact OD2-CZ 2.67Å; D399-R430 IonicContact OD2-NH1 3.92Å; D399-R430 PolarHBondContact OD2-NH1 3.34Å; D399-R430 IonicContact OD2-NH2 2.71Å; D399-R430 PolarHBondContact OD2-NH2 3.12Å
400	G	92.2	Very high	76.2	Confident	39 Å²	39	73.4 Å²	73.4	40%	0.402	52%	0.524	S	S	.	.			trans	71.5	24.4	177.7	0	0	0	0	0	114.7	A398 G403 S404	A398-G400 VanDerWaalsContact C-N 3.29Å; A398-G400 PolarHBondContact O-N 2.88Å; G400-G403 PolarHBondContact O-N 2.82Å; G400-S404 PolarHBondContact O-N 2.87Å; G400-S404 PolarHBondContact O-OG 2.77Å
401	F	92.3	Very high	73.6	Confident	4 Å²	4	73.1 Å²	73.1	2%	0.018	54%	0.535	C	S	.	.	S	Bend	trans	-50.7	-59.3	176.1	-176.4	-120.3	0	0	0	112.3	D370 D399 G403 S404 W423 K426 L427 R430	D370-F401 HydrophobicContact CB-CD1 3.96Å; D370-F401 HydrophobicContact CB-CE1 3.98Å; D370-F401 WeakPolarHBondContact O-CE1 3.45Å; D399-F401 WeakPolarHBondContact OD1-CB 3.42Å; D399-F401 PolarHBondContact OD1-N 2.97Å; F401-G403 PolarHBondContact O-N 3.32Å; F401-S404 PolarHBondContact O-N 2.81Å; F401-S404 PolarHBondContact O-OG 2.85Å; F401-W423 AromaticContact CD2-CD1 3.56Å; F401-W423 HydrophobicContact CD2-CG 4.26Å; F401-W423 AromaticContact CD2-NE1 3.52Å; F401-W423 AromaticContact CE2-CD1 3.54Å; F401-W423 AromaticContact CE2-CD2 3.93Å; F401-W423 HydrophobicContact CE2-CD2 3.93Å; F401-W423 AromaticContact CE2-CE2 3.42Å; F401-W423 VanDerWaalsContact CE2-CE2 3.42Å; F401-W423 AromaticContact CE2-CG 3.99Å; F401-W423 HydrophobicContact CE2-CG 3.99Å; F401-W423 AromaticContact CE2-CZ2 3.95Å; F401-W423 HydrophobicContact CE2-CZ2 3.95Å; F401-W423 AromaticContact CE2-NE1 3.15Å; F401-W423 AromaticContact CZ-CE2 3.72Å; F401-W423 AromaticContact CZ-CZ2 3.77Å; F401-W423 HydrophobicContact CZ-CZ2 3.77Å; F401-W423 AromaticContact CZ-NE1 3.62Å; F401-K426 HydrophobicContact CB-CD 4.41Å; F401-K426 HydrophobicContact CD2-CB 3.52Å; F401-K426 HydrophobicContact CD2-CD 4.37Å; F401-K426 HydrophobicContact CE2-CB 4.09Å; F401-K426 HydrophobicContact CG-CB 4.37Å; F401-L427 HydrophobicContact CE2-CB 3.98Å; F401-L427 HydrophobicContact CZ-CB 4.16Å; F401-L427 HydrophobicContact CZ-CD1 4.06Å; F401-R430 VanDerWaalsContact CB-NH2 3.33Å
402	N	83.5	Confident	70.8	Confident	98 Å²	98	75.9 Å²	75.9	52%	0.524	56%	0.564	S	S	.	*	H	α-helix	trans	-67.8	-26.1	-179.6	-55.7	-6.1	0	0	0	112.3	D370 S404	D370-N402 PolarHBondContact OD1-ND2 3.03Å; D370-N402 PolarHBondContact OD1-OD1 3.47Å; N402-S404 VanDerWaalsContact C-N 3.28Å; N402-S404 PolarHBondContact O-N 3.2Å
403	G	62.9	Low	68.2	Low	75 Å²	75	77.8 Å²	77.8	77%	0.773	59%	0.585	S	S	*	*	H	α-helix	trans	-79.8	4.9	-179.1	0	0	0	0	0	115.7	G400 F401	G400-G403 PolarHBondContact O-N 2.82Å; F401-G403 PolarHBondContact O-N 3.32Å
404	S	54.3	Low	65.8	Low	79 Å²	79	75.2 Å²	75.2	55%	0.552	59%	0.585	S	S	*	*	H	α-helix	trans	-141.7	-4.4	-174.8	55.2	0	0	0	0	116.7	G400 F401 N402	G400-S404 PolarHBondContact O-N 2.87Å; G400-S404 PolarHBondContact O-OG 2.77Å; F401-S404 PolarHBondContact O-N 2.81Å; F401-S404 PolarHBondContact O-OG 2.85Å; N402-S404 VanDerWaalsContact C-N 3.28Å; N402-S404 PolarHBondContact O-N 3.2Å
405	G	50.7	Low	63.7	Low	45 Å²	45	75.2 Å²	75.2	46%	0.464	60%	0.596	S	S	.	*	H	α-helix	trans	-122.8	-25.9	-177.8	0	0	0	0	0	116.6	A407	G405-A407 PolarHBondContact O-N 3.22Å
406	G	42.8	Very low	61.6	Low	50 Å²	50	73.8 Å²	73.8	52%	0.515	60%	0.604	S	S	.	*	S	Bend	trans	-73.6	123.5	-174.1	0	0	0	0	0	114.3	G408	G406-G408 PolarHBondContact O-N 2.82Å
407	A	41.6	Very low	59.7	Low	105 Å²	105	78.9 Å²	78.9	87%	0.868	64%	0.637	S	S	*	*	S	Bend	trans	35.8	70.9	157.5	0	0	0	0	0	119	G405	G405-A407 PolarHBondContact O-N 3.22Å
408	G	44.8	Very low	58	Low	88 Å²	88	78 Å²	78	91%	0.907	63%	0.631	S	S	*	*			trans	73	46.7	143.4	0	0	0	0	0	118.9	G406	G406-G408 PolarHBondContact O-N 2.82Å
409	G	39.5	Very low	57.1	Low	69 Å²	69	76.2 Å²	76.2	71%	0.711	62%	0.619	S	S	*	*			trans	-123.6	97.1	177.4	0	0	0	0	0	115.2	A411	G409-A411 PolarHBondContact O-N 2.93Å
410	A	44.7	Very low	56.8	Low	113 Å²	113	76.7 Å²	76.7	93%	0.934	63%	0.631	S	S	*	*			trans	-10.6	104.9	172.2	0	0	0	0	0	119.6
411	A	41.4	Very low	56.6	Low	88 Å²	88	78.6 Å²	78.6	73%	0.727	63%	0.634	S	S	*	*			trans	-140.7	110.8	162	0	0	0	0	0	112.3	G409	G409-A411 PolarHBondContact O-N 2.93Å
412	G	37	Very low	56.6	Low	60 Å²	60	81.5 Å²	81.5	62%	0.619	65%	0.648	S	S	*	*			trans	46.1	107.7	161.4	0	0	0	0	0	119.1	A414 A415	G412-A414 PolarHBondContact O-N 2.95Å; G412-A415 PolarHBondContact O-N 3.49Å
413	A	39	Very low	57.1	Low	125 Å²	125	79.8 Å²	79.8	100%	1.033	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.1	17.3	-178.2	0	0	0	0	0	117.5
414	A	44.5	Very low	58.7	Low	101 Å²	101	78.9 Å²	78.9	84%	0.835	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.4	-14.9	169.1	0	0	0	0	0	113.3	G412	G412-A414 PolarHBondContact O-N 2.95Å
415	A	52.1	Low	60.7	Low	52 Å²	52	77.8 Å²	77.8	43%	0.43	59%	0.594	S	S	.	*	S	Bend	trans	-85.9	-20.9	-171.3	0	0	0	0	0	114.6	G412 V417 Q418 G419	G412-A415 PolarHBondContact O-N 3.49Å; A415-V417 PolarHBondContact O-N 2.98Å; A415-V417 VanDerWaalsContact O-N 3.16Å; A415-Q418 PolarHBondContact O-N 2.65Å; A415-G419 PolarHBondContact O-N 3.26Å
416	G	52	Low	63	Low	68 Å²	68	77 Å²	77	70%	0.701	58%	0.578	S	S	*	*	H	α-helix	trans	-55.3	-39.8	-161.9	0	0	0	0	0	116.7
417	V	56.6	Low	65.6	Low	128 Å²	128	74.7 Å²	74.7	78%	0.776	55%	0.554	S	S	*	*	H	α-helix	trans	-80.6	-42.8	179.7	-177.5	0	0	0	0	111.6	A415 G420 V421	A415-V417 PolarHBondContact O-N 2.98Å; A415-V417 VanDerWaalsContact O-N 3.16Å; V417-G420 PolarHBondContact O-N 3.47Å; V417-V421 PolarHBondContact O-N 2.93Å
418	Q	58.9	Low	68.3	Low	152 Å²	152	69.8 Å²	69.8	71%	0.71	51%	0.513	S	S	*	.	H	α-helix	trans	-72.5	-33.8	-177.4	-171.5	171.6	-12.3	0	0	112	A415 V421 E422	A415-Q418 PolarHBondContact O-N 2.65Å; Q418-V421 PolarHBondContact O-N 3.14Å; Q418-E422 WeakPolarHBondContact O-CB 3.29Å; Q418-E422 PolarHBondContact O-N 3.16Å
419	G	74.9	Confident	70.9	Confident	35 Å²	35	65.7 Å²	65.7	36%	0.361	47%	0.47	S	S	.	.	H	α-helix	trans	-62.3	-43.2	172.6	0	0	0	0	0	112.4	A415 E422 W423	A415-G419 PolarHBondContact O-N 3.26Å; G419-E422 PolarHBondContact O-N 2.87Å; G419-W423 VanDerWaalsContact O-CB 3.32Å; G419-W423 WeakPolarHBondContact O-CB 3.38Å; G419-W423 PolarHBondContact O-N 2.91Å
420	G	86.2	Confident	73.7	Confident	37 Å²	37	62.5 Å²	62.5	38%	0.381	44%	0.437	S	S	.	.	H	α-helix	trans	-61	-45	175.8	0	0	0	0	0	113.1	V417 E422 W423 M424	V417-G420 PolarHBondContact O-N 3.47Å; G420-E422 VanDerWaalsContact C-N 3.34Å; G420-E422 PolarHBondContact O-N 3.44Å; G420-W423 PolarHBondContact O-N 3.3Å; G420-M424 WeakPolarHBondContact O-CG 3.45Å; G420-M424 PolarHBondContact O-N 2.79Å
421	V	89.7	Confident	76.2	Confident	78 Å²	78	57.2 Å²	57.2	47%	0.473	39%	0.393	S	S	.	.	H	α-helix	trans	-65.9	-35.9	176.9	175.2	0	0	0	0	112.1	V417 Q418 R425	V417-V421 PolarHBondContact O-N 2.93Å; Q418-V421 PolarHBondContact O-N 3.14Å; V421-R425 PolarHBondContact O-N 2.74Å
422	E	91.4	Very high	78.9	Confident	66 Å²	66	55.8 Å²	55.8	31%	0.308	37%	0.368	S	S	.	.	H	α-helix	trans	-72.3	-37.3	176.3	-164.9	59.9	-140.2	0	0	112.2	Q418 G419 G420 R425 K426	Q418-E422 WeakPolarHBondContact O-CB 3.29Å; Q418-E422 PolarHBondContact O-N 3.16Å; G419-E422 PolarHBondContact O-N 2.87Å; G420-E422 VanDerWaalsContact C-N 3.34Å; G420-E422 PolarHBondContact O-N 3.44Å; E422-R425 PolarHBondContact O-N 3.06Å; E422-R425 IonicContact OE1-NH1 3.85Å; E422-R425 PolarHBondContact OE1-NH1 2.71Å; E422-R425 IonicContact OE2-CZ 3.84Å; E422-R425 IonicContact OE2-NH1 2.82Å; E422-R425 PolarHBondContact OE2-NH1 2.93Å; E422-R425 IonicContact OE2-NH2 2.72Å; E422-R425 PolarHBondContact OE2-NH2 2.76Å; E422-K426 WeakPolarHBondContact O-CG 3.24Å; E422-K426 PolarHBondContact O-N 2.9Å; E422-K426 VanDerWaalsContact O-N 3.12Å
423	W	94.6	Very high	81.8	Confident	62 Å²	62	56.7 Å²	56.7	24%	0.235	35%	0.353	C	S	.	.	H	α-helix	trans	-66.1	-44.6	174.7	-177.7	90.6	0	0	0	111.6	C374 F401 G419 G420 R425 K426 L427	C374-W423 HydrophobicContact CB-CH2 3.78Å; C374-W423 HydrophobicContact CB-CZ2 3.97Å; F401-W423 AromaticContact CD2-CD1 3.56Å; F401-W423 HydrophobicContact CD2-CG 4.26Å; F401-W423 AromaticContact CD2-NE1 3.52Å; F401-W423 AromaticContact CE2-CD1 3.54Å; F401-W423 AromaticContact CE2-CD2 3.93Å; F401-W423 HydrophobicContact CE2-CD2 3.93Å; F401-W423 AromaticContact CE2-CE2 3.42Å; F401-W423 VanDerWaalsContact CE2-CE2 3.42Å; F401-W423 AromaticContact CE2-CG 3.99Å; F401-W423 HydrophobicContact CE2-CG 3.99Å; F401-W423 AromaticContact CE2-CZ2 3.95Å; F401-W423 HydrophobicContact CE2-CZ2 3.95Å; F401-W423 AromaticContact CE2-NE1 3.15Å; F401-W423 AromaticContact CZ-CE2 3.72Å; F401-W423 AromaticContact CZ-CZ2 3.77Å; F401-W423 HydrophobicContact CZ-CZ2 3.77Å; F401-W423 AromaticContact CZ-NE1 3.62Å; G419-W423 VanDerWaalsContact O-CB 3.32Å; G419-W423 WeakPolarHBondContact O-CB 3.38Å; G419-W423 PolarHBondContact O-N 2.91Å; G420-W423 PolarHBondContact O-N 3.3Å; W423-R425 VanDerWaalsContact C-N 3.28Å; W423-R425 PolarHBondContact O-N 3.45Å; W423-K426 PolarHBondContact O-N 3.31Å; W423-K426 VanDerWaalsContact O-N 3.08Å; W423-L427 HydrophobicContact CH2-CD2 3.79Å; W423-L427 HydrophobicContact CZ3-CD2 3.73Å; W423-L427 PolarHBondContact O-N 3.45Å
424	M	96.7	Very high	84.7	Confident	55 Å²	55	50.8 Å²	50.8	27%	0.271	30%	0.304	S	S	.	.	H	α-helix	trans	-57.3	-39.4	173.5	-76.9	-61.4	-58.7	0	0	112.4	V382 D385 G420 L427 A428	V382-M424 HydrophobicContact CG1-CE 4.13Å; D385-M424 HydrophobicContact CB-CB 4.03Å; G420-M424 WeakPolarHBondContact O-CG 3.45Å; G420-M424 PolarHBondContact O-N 2.79Å; M424-L427 WeakPolarHBondContact O-CB 3.45Å; M424-L427 PolarHBondContact O-N 3.23Å; M424-L427 HydrophobicContact SD-CD2 4.23Å; M424-A428 WeakPolarHBondContact O-CB 3.4Å; M424-A428 PolarHBondContact O-N 3.33Å
425	R	96.5	Very high	87.2	Confident	57 Å²	57	48.2 Å²	48.2	22%	0.215	27%	0.274	C	S	.	.	H	α-helix	trans	-66.3	-39.5	175.1	-168.5	-178.6	-46	117.8	20.7	112.7	D385 V421 E422 W423 L427 A428 F429	D385-R425 WeakPolarHBondContact O-CG 3.4Å; V421-R425 PolarHBondContact O-N 2.74Å; E422-R425 PolarHBondContact O-N 3.06Å; E422-R425 IonicContact OE1-NH1 3.85Å; E422-R425 PolarHBondContact OE1-NH1 2.71Å; E422-R425 IonicContact OE2-CZ 3.84Å; E422-R425 IonicContact OE2-NH1 2.82Å; E422-R425 PolarHBondContact OE2-NH1 2.93Å; E422-R425 IonicContact OE2-NH2 2.72Å; E422-R425 PolarHBondContact OE2-NH2 2.76Å; W423-R425 VanDerWaalsContact C-N 3.28Å; W423-R425 PolarHBondContact O-N 3.45Å; R425-L427 VanDerWaalsContact C-N 3.33Å; R425-A428 PolarHBondContact O-N 3.02Å; R425-F429 HydrophobicContact CG-CD1 4.28Å; R425-F429 HydrophobicContact CG-CD2 4.41Å; R425-F429 HydrophobicContact CG-CE1 3.66Å; R425-F429 HydrophobicContact CG-CE2 3.8Å; R425-F429 HydrophobicContact CG-CZ 3.39Å; R425-F429 WeakPolarHBondContact O-CD1 3.33Å; R425-F429 WeakPolarHBondContact O-CD2 3.44Å; R425-F429 WeakPolarHBondContact O-CG 3.33Å; R425-F429 PolarHBondContact O-N 2.7Å
426	K	97.5	Very high	89.4	Confident	27 Å²	27	48.6 Å²	48.6	12%	0.117	27%	0.267	C	S	.	.	H	α-helix	trans	-68.3	-31.8	176.3	-70.7	172.6	-172.8	173.2	0	113	D399 F401 E422 W423 R430	D399-K426 HydrophobicContact CB-CD 4.41Å; D399-K426 VanDerWaalsContact O-CE 3.32Å; D399-K426 WeakPolarHBondContact O-CE 3.43Å; D399-K426 PolarHBondContact O-NZ 3.17Å; F401-K426 HydrophobicContact CB-CD 4.41Å; F401-K426 HydrophobicContact CD2-CB 3.52Å; F401-K426 HydrophobicContact CD2-CD 4.37Å; F401-K426 HydrophobicContact CE2-CB 4.09Å; F401-K426 HydrophobicContact CG-CB 4.37Å; E422-K426 WeakPolarHBondContact O-CG 3.24Å; E422-K426 PolarHBondContact O-N 2.9Å; E422-K426 VanDerWaalsContact O-N 3.12Å; W423-K426 PolarHBondContact O-N 3.31Å; W423-K426 VanDerWaalsContact O-N 3.08Å; K426-R430 WeakPolarHBondContact O-CG 3.47Å; K426-R430 PolarHBondContact O-N 3.23Å; K426-R430 PolarHBondContact O-NH1 2.71Å
427	L	98	Very high	91.6	Very high	3 Å²	3	46.1 Å²	46.1	2%	0.016	24%	0.238	C	C	.	.	H	α-helix	trans	-65.1	-48.8	169	179.9	61.8	0	0	0	110.5	L371 C374 V382 F401 W423 M424 R425 F429 R430 Y431	L371-L427 HydrophobicContact CD2-CD1 3.63Å; C374-L427 HydrophobicContact CB-CD1 4.25Å; C374-L427 VanDerWaalsContact SG-CD1 3.51Å; V382-L427 HydrophobicContact CG1-CD2 3.8Å; V382-L427 HydrophobicContact CG1-CG 4.13Å; V382-L427 HydrophobicContact CG2-CG 4.42Å; F401-L427 HydrophobicContact CE2-CB 3.98Å; F401-L427 HydrophobicContact CZ-CB 4.16Å; F401-L427 HydrophobicContact CZ-CD1 4.06Å; W423-L427 HydrophobicContact CH2-CD2 3.79Å; W423-L427 HydrophobicContact CZ3-CD2 3.73Å; W423-L427 PolarHBondContact O-N 3.45Å; M424-L427 WeakPolarHBondContact O-CB 3.45Å; M424-L427 PolarHBondContact O-N 3.23Å; M424-L427 HydrophobicContact SD-CD2 4.23Å; R425-L427 VanDerWaalsContact C-N 3.33Å; L427-F429 PolarHBondContact O-N 2.67Å; L427-R430 WeakPolarHBondContact O-CB 3.5Å; L427-R430 PolarHBondContact O-N 2.71Å; L427-R430 VanDerWaalsContact O-N 3.11Å; L427-Y431 HydrophobicContact CD1-CD2 3.88Å; L427-Y431 HydrophobicContact CD1-CE2 3.63Å; L427-Y431 HydrophobicContact CG-CD2 4.26Å; L427-Y431 HydrophobicContact CG-CE2 4.37Å; L427-Y431 PolarHBondContact O-N 3.4Å
428	A	98.4	Very high	93.6	Very high	2 Å²	2	40.1 Å²	40.1	2%	0.017	20%	0.201	C	C	.	.	H	α-helix	trans	-59.4	-42.3	176.4	0	0	0	0	0	112.6	V382 D385 D386 M424 R425 R430 Y431 R432	V382-A428 HydrophobicContact CB-CB 4.42Å; V382-A428 HydrophobicContact CG2-CB 4.31Å; V382-A428 VanDerWaalsContact O-CB 3.23Å; V382-A428 WeakPolarHBondContact O-CB 3.44Å; D385-A428 HydrophobicContact CB-CB 4.39Å; D386-A428 HydrophobicContact CB-CB 3.9Å; M424-A428 WeakPolarHBondContact O-CB 3.4Å; M424-A428 PolarHBondContact O-N 3.33Å; R425-A428 PolarHBondContact O-N 3.02Å; A428-R430 VanDerWaalsContact C-N 3.31Å; A428-R430 PolarHBondContact O-N 2.8Å; A428-Y431 PolarHBondContact O-N 3.48Å; A428-R432 WeakPolarHBondContact O-CB 3.41Å; A428-R432 PolarHBondContact O-N 3.05Å
429	F	98.4	Very high	95.4	Very high	2 Å²	2	35.7 Å²	35.7	1%	0.009	19%	0.187	C	C	.	.	H	α-helix	trans	-59.5	-38.7	173.9	-65.5	-21.9	0	0	0	112.9	D386 N387 Q389 L391 Y394 F396 R425 L427 R433	D386-F429 WeakPolarHBondContact OD1-CE1 3.31Å; D386-F429 WeakPolarHBondContact OD2-CD1 2.97Å; N387-F429 VanDerWaalsContact OD1-CE1 3.29Å; N387-F429 WeakPolarHBondContact OD1-CE1 3.41Å; Q389-F429 HydrophobicContact CG-CE1 3.84Å; Q389-F429 HydrophobicContact CG-CZ 3.74Å; L391-F429 HydrophobicContact CD1-CB 4.13Å; L391-F429 HydrophobicContact CD1-CD1 4.48Å; L391-F429 WeakPolarHBondContact CD1-O 3.26Å; L391-F429 HydrophobicContact CD2-CB 4.01Å; L391-F429 HydrophobicContact CD2-CD1 3.9Å; L391-F429 HydrophobicContact CD2-CD2 4.23Å; L391-F429 HydrophobicContact CD2-CE1 4.38Å; L391-F429 HydrophobicContact CD2-CG 3.8Å; Y394-F429 HydrophobicContact CE1-CD2 4.15Å; Y394-F429 AromaticContact CE2-CD2 3.89Å; Y394-F429 HydrophobicContact CE2-CD2 3.89Å; Y394-F429 AromaticContact CE2-CE2 3.86Å; Y394-F429 HydrophobicContact CE2-CE2 3.86Å; Y394-F429 AromaticContact CZ-CD2 3.64Å; F396-F429 HydrophobicContact CE1-CB 4.12Å; R425-F429 HydrophobicContact CG-CD1 4.28Å; R425-F429 HydrophobicContact CG-CD2 4.41Å; R425-F429 HydrophobicContact CG-CE1 3.66Å; R425-F429 HydrophobicContact CG-CE2 3.8Å; R425-F429 HydrophobicContact CG-CZ 3.39Å; R425-F429 WeakPolarHBondContact O-CD1 3.33Å; R425-F429 WeakPolarHBondContact O-CD2 3.44Å; R425-F429 WeakPolarHBondContact O-CG 3.33Å; R425-F429 PolarHBondContact O-N 2.7Å; L427-F429 PolarHBondContact O-N 2.67Å; F429-R433 VanDerWaalsContact O-CB 3.23Å; F429-R433 WeakPolarHBondContact O-CB 3.37Å; F429-R433 PolarHBondContact O-N 3.04Å
430	R	98.4	Very high	96.5	Very high	2 Å²	2	38.3 Å²	38.3	1%	0.008	20%	0.2	C	C	.	.	H	α-helix	trans	-66.3	-47.2	176	-76.3	168	172.5	68.5	0.8	111.3	F367 D370 L371 F396 D399 F401 K426 L427 A428 R433 L434	F367-R430 HydrophobicContact CD1-CG 4.38Å; F367-R430 HydrophobicContact CG-CG 4.34Å; D370-R430 IonicContact OD2-CZ 3.23Å; D370-R430 IonicContact OD2-NE 3.48Å; D370-R430 PolarHBondContact OD2-NE 2.73Å; D370-R430 IonicContact OD2-NH2 2.73Å; D370-R430 PolarHBondContact OD2-NH2 2.64Å; L371-R430 HydrophobicContact CD1-CB 4.3Å; L371-R430 HydrophobicContact CD2-CB 3.96Å; L371-R430 HydrophobicContact CG-CB 4.48Å; F396-R430 HydrophobicContact CD1-CG 3.94Å; F396-R430 HydrophobicContact CE1-CG 4.16Å; F396-R430 PolarHBondContact O-NH2 3.48Å; D399-R430 IonicContact OD1-CZ 3.39Å; D399-R430 IonicContact OD1-NH1 3.44Å; D399-R430 IonicContact OD1-NH2 3.39Å; D399-R430 PolarHBondContact OD1-NH2 3.02Å; D399-R430 VanDerWaalsContact OD1-NH2 3.16Å; D399-R430 IonicContact OD2-CZ 2.67Å; D399-R430 IonicContact OD2-NH1 3.92Å; D399-R430 PolarHBondContact OD2-NH1 3.34Å; D399-R430 IonicContact OD2-NH2 2.71Å; D399-R430 PolarHBondContact OD2-NH2 3.12Å; F401-R430 VanDerWaalsContact CB-NH2 3.33Å; K426-R430 WeakPolarHBondContact O-CG 3.47Å; K426-R430 PolarHBondContact O-N 3.23Å; K426-R430 PolarHBondContact O-NH1 2.71Å; L427-R430 WeakPolarHBondContact O-CB 3.5Å; L427-R430 PolarHBondContact O-N 2.71Å; L427-R430 VanDerWaalsContact O-N 3.11Å; A428-R430 VanDerWaalsContact C-N 3.31Å; A428-R430 PolarHBondContact O-N 2.8Å; R430-R433 PolarHBondContact O-N 2.87Å; R430-L434 VanDerWaalsContact O-CB 3.26Å; R430-L434 WeakPolarHBondContact O-CB 3.38Å; R430-L434 PolarHBondContact O-N 3.29Å
431	Y	98.6	Very high	97.1	Very high	2 Å²	2	40.2 Å²	40.2	1%	0.008	20%	0.196	C	C	.	.	H	α-helix	trans	-65.6	-38.4	176.4	-82.3	-77.2	0	0	0	113.2	L371 D375 Q376 I379 V382 L427 A428 R433 L434 K435 L498	L371-Y431 HydrophobicContact CD1-CE1 4.37Å; L371-Y431 HydrophobicContact CD1-CE2 4.1Å; L371-Y431 HydrophobicContact CD2-CD2 4.24Å; L371-Y431 HydrophobicContact CD2-CE2 3.68Å; L371-Y431 HydrophobicContact CG-CE2 4.43Å; D375-Y431 WeakPolarHBondContact CA-OH 3.15Å; D375-Y431 PolarHBondContact OD1-OH 3.48Å; Q376-Y431 HydrophobicContact CB-CE1 4.09Å; Q376-Y431 HydrophobicContact CB-CE2 4.24Å; Q376-Y431 HydrophobicContact CG-CD2 4.09Å; Q376-Y431 HydrophobicContact CG-CE1 4.19Å; Q376-Y431 HydrophobicContact CG-CE2 3.45Å; Q376-Y431 VanDerWaalsContact CG-CE2 3.45Å; Q376-Y431 PolarHBondContact N-OH 2.9Å; I379-Y431 HydrophobicContact CD1-CD1 3.88Å; I379-Y431 VanDerWaalsContact CD1-O 3.28Å; I379-Y431 WeakPolarHBondContact CD1-O 3.3Å; V382-Y431 HydrophobicContact CG2-CD2 3.74Å; V382-Y431 HydrophobicContact CG2-CG 4Å; L427-Y431 HydrophobicContact CD1-CD2 3.88Å; L427-Y431 HydrophobicContact CD1-CE2 3.63Å; L427-Y431 HydrophobicContact CG-CD2 4.26Å; L427-Y431 HydrophobicContact CG-CE2 4.37Å; L427-Y431 PolarHBondContact O-N 3.4Å; A428-Y431 PolarHBondContact O-N 3.48Å; Y431-R433 PolarHBondContact O-N 3.29Å; Y431-L434 HydrophobicContact CD1-CD2 3.79Å; Y431-L434 HydrophobicContact CE1-CD2 3.89Å; Y431-L434 WeakPolarHBondContact O-CB 3.37Å; Y431-L434 PolarHBondContact O-N 3.37Å; Y431-K435 WeakPolarHBondContact O-CB 3.42Å; Y431-K435 PolarHBondContact O-N 3.3Å; Y431-L498 HydrophobicContact CE1-CD2 4.04Å
432	R	98.3	Very high	97.4	Very high	57 Å²	57	39.7 Å²	39.7	22%	0.215	19%	0.187	C	C	.	.	H	α-helix	trans	-66.8	-34.6	171.7	-178.3	163.5	56	100.5	-5.8	112.5	D386 Q389 L391 A428 K435 Q436	D386-R432 VanDerWaalsContact CG-NE 3.28Å; D386-R432 IonicContact OD1-CZ 2.63Å; D386-R432 IonicContact OD1-NE 3.67Å; D386-R432 PolarHBondContact OD1-NE 3Å; D386-R432 IonicContact OD1-NH2 3Å; D386-R432 PolarHBondContact OD1-NH2 3.09Å; D386-R432 IonicContact OD2-CZ 3.43Å; D386-R432 IonicContact OD2-NE 2.79Å; D386-R432 PolarHBondContact OD2-NE 3.12Å; D386-R432 IonicContact OD2-NH2 3.16Å; D386-R432 PolarHBondContact OD2-NH2 3.21Å; Q389-R432 VanDerWaalsContact O-CZ 3.26Å; Q389-R432 PolarHBondContact O-NH1 2.91Å; Q389-R432 PolarHBondContact O-NH2 2.97Å; L391-R432 HydrophobicContact CD1-CB 4.43Å; L391-R432 HydrophobicContact CD1-CG 4.45Å; A428-R432 WeakPolarHBondContact O-CB 3.41Å; A428-R432 PolarHBondContact O-N 3.05Å; R432-K435 WeakPolarHBondContact O-CB 3.5Å; R432-K435 PolarHBondContact O-N 3.21Å; R432-Q436 WeakPolarHBondContact O-CG 3.48Å; R432-Q436 PolarHBondContact O-N 3.08Å
433	R	98.1	Very high	97.6	Very high	80 Å²	80	39.2 Å²	39.2	30%	0.302	20%	0.201	S	C	.	.	H	α-helix	trans	-71.7	-41.1	175.4	-174.6	57.5	-179.8	170.3	1.4	112	F367 L391 F396 F429 R430 Y431 K435 Q436 I437	F367-R433 HydrophobicContact CE2-CB 4.05Å; F367-R433 HydrophobicContact CE2-CG 3.7Å; F367-R433 HydrophobicContact CZ-CB 4.43Å; F367-R433 HydrophobicContact CZ-CG 3.86Å; L391-R433 HydrophobicContact CD1-CB 4.3Å; F396-R433 HydrophobicContact CE1-CB 4.19Å; F396-R433 HydrophobicContact CE2-CB 4.41Å; F396-R433 HydrophobicContact CE2-CG 3.97Å; F396-R433 HydrophobicContact CZ-CB 3.68Å; F396-R433 HydrophobicContact CZ-CG 3.75Å; F429-R433 VanDerWaalsContact O-CB 3.23Å; F429-R433 WeakPolarHBondContact O-CB 3.37Å; F429-R433 PolarHBondContact O-N 3.04Å; R430-R433 PolarHBondContact O-N 2.87Å; Y431-R433 PolarHBondContact O-N 3.29Å; R433-K435 VanDerWaalsContact C-N 3.29Å; R433-K435 PolarHBondContact O-N 3.32Å; R433-Q436 VanDerWaalsContact CD-OE1 3.25Å; R433-Q436 WeakPolarHBondContact O-CB 3.29Å; R433-Q436 PolarHBondContact O-N 3.4Å; R433-Q436 VanDerWaalsContact O-N 3.17Å; R433-I437 HydrophobicContact CG-CD1 4.07Å; R433-I437 WeakPolarHBondContact O-CG1 3.28Å; R433-I437 PolarHBondContact O-N 2.92Å
434	L	98.2	Very high	97.6	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-54.3	-46	170.3	175.8	61.5	0	0	0	111	L366 L371 I379 R430 Y431 I437 Y438 V499 L502	L366-L434 HydrophobicContact CB-CD1 3.65Å; L366-L434 HydrophobicContact CD1-CD1 4.41Å; L366-L434 HydrophobicContact CD2-CD1 3.75Å; L366-L434 HydrophobicContact CG-CD1 4.12Å; L371-L434 HydrophobicContact CD1-CD2 4.44Å; I379-L434 HydrophobicContact CD1-CD2 4.17Å; I379-L434 HydrophobicContact CD1-CG 4.27Å; R430-L434 VanDerWaalsContact O-CB 3.26Å; R430-L434 WeakPolarHBondContact O-CB 3.38Å; R430-L434 PolarHBondContact O-N 3.29Å; Y431-L434 HydrophobicContact CD1-CD2 3.79Å; Y431-L434 HydrophobicContact CE1-CD2 3.89Å; Y431-L434 WeakPolarHBondContact O-CB 3.37Å; Y431-L434 PolarHBondContact O-N 3.37Å; L434-I437 PolarHBondContact O-N 2.83Å; L434-Y438 PolarHBondContact O-N 2.73Å; L434-V499 HydrophobicContact CD2-CG2 3.92Å; L434-L502 HydrophobicContact CD1-CD1 4.11Å; L434-L502 HydrophobicContact CD2-CD1 3.81Å; L434-L502 HydrophobicContact CG-CD1 3.97Å
435	K	98.4	Very high	97.5	Very high	47 Å²	47	38.4 Å²	38.4	20%	0.204	20%	0.203	C	C	.	.	H	α-helix	trans	-57.4	-49.8	172.3	-179.6	165.8	-174.5	169.5	0	112.9	I379 E380 Y431 R432 R433 I437 Y438 S439 I516 E517	I379-K435 HydrophobicContact CD1-CB 4.02Å; I379-K435 HydrophobicContact CG1-CB 3.92Å; I379-K435 HydrophobicContact CG1-CD 4.18Å; I379-K435 HydrophobicContact CG1-CG 4.37Å; E380-K435 WeakPolarHBondContact OE1-CD 3.37Å; E380-K435 IonicContact OE1-NZ 2.89Å; E380-K435 PolarHBondContact OE1-NZ 3.11Å; Y431-K435 WeakPolarHBondContact O-CB 3.42Å; Y431-K435 PolarHBondContact O-N 3.3Å; R432-K435 WeakPolarHBondContact O-CB 3.5Å; R432-K435 PolarHBondContact O-N 3.21Å; R433-K435 VanDerWaalsContact C-N 3.29Å; R433-K435 PolarHBondContact O-N 3.32Å; K435-I437 VanDerWaalsContact C-N 3.32Å; K435-I437 PolarHBondContact O-N 3.15Å; K435-Y438 PolarHBondContact O-N 2.83Å; K435-S439 WeakPolarHBondContact O-CB 3.38Å; K435-S439 PolarHBondContact O-N 2.66Å; K435-S439 PolarHBondContact O-OG 2.86Å; K435-S439 VanDerWaalsContact O-OG 3.08Å; K435-I516 HydrophobicContact CD-CG2 4.43Å; K435-I516 HydrophobicContact CG-CG2 3.98Å; K435-E517 WeakPolarHBondContact CE-OE1 3.27Å; K435-E517 IonicContact NZ-OE1 3.9Å; K435-E517 PolarHBondContact NZ-OE1 3.46Å
436	Q	97.8	Very high	97.3	Very high	60 Å²	60	36.3 Å²	36.3	28%	0.28	20%	0.198	S	C	.	.	H	α-helix	trans	-58.1	-43.1	176.1	-71.7	173.3	-8	0	0	112.5	R432 R433 S440	R432-Q436 WeakPolarHBondContact O-CG 3.48Å; R432-Q436 PolarHBondContact O-N 3.08Å; R433-Q436 VanDerWaalsContact CD-OE1 3.25Å; R433-Q436 WeakPolarHBondContact O-CB 3.29Å; R433-Q436 PolarHBondContact O-N 3.4Å; R433-Q436 VanDerWaalsContact O-N 3.17Å; Q436-S440 WeakPolarHBondContact O-CB 3.21Å; Q436-S440 PolarHBondContact O-N 3.07Å; Q436-S440 PolarHBondContact O-OG 3.47Å
437	I	98	Very high	97.2	Very high	16 Å²	16	36.7 Å²	36.7	8%	0.082	21%	0.21	C	C	.	.	H	α-helix	trans	-65.1	-52.3	-179.7	-70.2	170.4	0	0	0	109.8	H365 L366 F367 R433 L434 K435 S439 S440 Y441 L448	H365-I437 VanDerWaalsContact O-CD1 3.27Å; H365-I437 WeakPolarHBondContact O-CD1 3.47Å; L366-I437 HydrophobicContact CD2-CG2 3.86Å; F367-I437 HydrophobicContact CE2-CD1 4.27Å; R433-I437 HydrophobicContact CG-CD1 4.07Å; R433-I437 WeakPolarHBondContact O-CG1 3.28Å; R433-I437 PolarHBondContact O-N 2.92Å; L434-I437 PolarHBondContact O-N 2.83Å; K435-I437 VanDerWaalsContact C-N 3.32Å; K435-I437 PolarHBondContact O-N 3.15Å; I437-S439 PolarHBondContact O-N 2.91Å; I437-S440 PolarHBondContact O-N 3.33Å; I437-S440 VanDerWaalsContact O-N 3.14Å; I437-Y441 HydrophobicContact CG2-CD2 4.24Å; I437-Y441 WeakPolarHBondContact O-CD2 3.4Å; I437-Y441 PolarHBondContact O-N 2.84Å; I437-L448 HydrophobicContact CG2-CD1 3.96Å; I437-L448 HydrophobicContact CG2-CD2 4.11Å
438	Y	98.6	Very high	97.1	Very high	2 Å²	2	37.7 Å²	37.7	1%	0.008	22%	0.215	C	C	.	.	H	α-helix	trans	-54.7	-53.2	176	-175.5	-82.1	0	0	0	111.4	L434 K435 S440 Y441 K442 L502 V505 L506 G511 F514 I516 I519	L434-Y438 PolarHBondContact O-N 2.73Å; K435-Y438 PolarHBondContact O-N 2.83Å; Y438-S440 PolarHBondContact O-N 3.18Å; Y438-S440 VanDerWaalsContact O-N 3.13Å; Y438-Y441 PolarHBondContact O-N 2.97Å; Y438-Y441 VanDerWaalsContact O-N 3.14Å; Y438-K442 HydrophobicContact CD1-CB 4.24Å; Y438-K442 HydrophobicContact CE1-CB 4.06Å; Y438-K442 HydrophobicContact CE1-CD 4.39Å; Y438-K442 VanDerWaalsContact O-CB 3.28Å; Y438-K442 WeakPolarHBondContact O-CB 2.97Å; Y438-K442 PolarHBondContact O-N 2.85Å; Y438-L502 HydrophobicContact CD2-CB 4.36Å; Y438-L502 HydrophobicContact CD2-CD2 3.75Å; Y438-L502 HydrophobicContact CE2-CD2 3.69Å; Y438-V505 HydrophobicContact CE2-CG1 3.92Å; Y438-V505 WeakPolarHBondContact OH-CG1 3.42Å; Y438-L506 HydrophobicContact CD2-CD1 4.09Å; Y438-L506 HydrophobicContact CD2-CD2 3.73Å; Y438-L506 HydrophobicContact CD2-CG 3.83Å; Y438-L506 HydrophobicContact CE2-CD2 3.88Å; Y438-L506 HydrophobicContact CE2-CG 4.01Å; Y438-L506 HydrophobicContact CG-CD2 4.35Å; Y438-G511 WeakPolarHBondContact OH-CA 3.43Å; Y438-F514 PolarHBondContact OH-O 3.15Å; Y438-I516 HydrophobicContact CD1-CB 3.62Å; Y438-I516 HydrophobicContact CD1-CD1 4.35Å; Y438-I516 HydrophobicContact CD1-CG1 4.43Å; Y438-I516 HydrophobicContact CD1-CG2 4.17Å; Y438-I516 HydrophobicContact CD2-CD1 4.37Å; Y438-I516 HydrophobicContact CE1-CB 3.8Å; Y438-I516 HydrophobicContact CG-CB 4.09Å; Y438-I516 HydrophobicContact CG-CD1 3.95Å; Y438-I516 HydrophobicContact CG-CG1 4.42Å; Y438-I519 HydrophobicContact CE2-CD1 4.22Å; Y438-I519 WeakPolarHBondContact OH-CD1 3.46Å
439	S	97.7	Very high	96.9	Very high	60 Å²	60	38.4 Å²	38.4	42%	0.42	22%	0.219	S	C	.	.	H	α-helix	trans	-58.6	-29.4	-179.5	-63.7	0	0	0	0	113.8	K435 I437	K435-S439 WeakPolarHBondContact O-CB 3.38Å; K435-S439 PolarHBondContact O-N 2.66Å; K435-S439 PolarHBondContact O-OG 2.86Å; K435-S439 VanDerWaalsContact O-OG 3.08Å; I437-S439 PolarHBondContact O-N 2.91Å
440	S	97.6	Very high	96.8	Very high	90 Å²	90	41.7 Å²	41.7	63%	0.629	24%	0.236	S	C	*	.	H	α-helix	trans	-82.7	-28.2	179.5	-55.9	0	0	0	0	113.7	Q436 I437 Y438	Q436-S440 WeakPolarHBondContact O-CB 3.21Å; Q436-S440 PolarHBondContact O-N 3.07Å; Q436-S440 PolarHBondContact O-OG 3.47Å; I437-S440 PolarHBondContact O-N 3.33Å; I437-S440 VanDerWaalsContact O-N 3.14Å; Y438-S440 PolarHBondContact O-N 3.18Å; Y438-S440 VanDerWaalsContact O-N 3.13Å
441	Y	98	Very high	96.7	Very high	76 Å²	76	46.9 Å²	46.9	30%	0.298	27%	0.27	S	S	.	.	H	α-helix	trans	-118.7	2.6	-170.8	-67.9	-81.3	0	0	0	114.5	I437 Y438 G443 N444 V445 G447 L448	I437-Y441 HydrophobicContact CG2-CD2 4.24Å; I437-Y441 WeakPolarHBondContact O-CD2 3.4Å; I437-Y441 PolarHBondContact O-N 2.84Å; Y438-Y441 PolarHBondContact O-N 2.97Å; Y438-Y441 VanDerWaalsContact O-N 3.14Å; Y441-G443 VanDerWaalsContact C-N 3.25Å; Y441-G443 PolarHBondContact O-N 3.48Å; Y441-G443 VanDerWaalsContact O-N 3.14Å; Y441-N444 CarbonylContact O-C 3.59Å; Y441-N444 PolarHBondContact O-N 3.38Å; Y441-V445 PolarHBondContact O-N 3.19Å; Y441-V445 VanDerWaalsContact O-N 3.07Å; Y441-G447 VanDerWaalsContact CE1-C 3.44Å; Y441-G447 WeakPolarHBondContact CE1-O 3.49Å; Y441-L448 HydrophobicContact CD1-CD2 4.25Å; Y441-L448 HydrophobicContact CD1-CG 3.79Å; Y441-L448 HydrophobicContact CD2-CD1 4.07Å; Y441-L448 HydrophobicContact CD2-CD2 3.57Å; Y441-L448 HydrophobicContact CD2-CG 3.75Å; Y441-L448 HydrophobicContact CE1-CD2 4.14Å; Y441-L448 HydrophobicContact CE1-CG 4.08Å; Y441-L448 HydrophobicContact CE2-CD2 3.47Å; Y441-L448 VanDerWaalsContact CE2-CD2 3.47Å; Y441-L448 HydrophobicContact CE2-CG 4.07Å; Y441-L448 HydrophobicContact CG-CD1 3.94Å; Y441-L448 HydrophobicContact CG-CD2 3.97Å; Y441-L448 HydrophobicContact CG-CG 3.6Å
442	K	96.6	Very high	96.6	Very high	67 Å²	67	53 Å²	53	29%	0.291	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-30.6	-176.8	68.6	-171.7	-167.9	76.1	0	116.2	Y438 L506 D512	Y438-K442 HydrophobicContact CD1-CB 4.24Å; Y438-K442 HydrophobicContact CE1-CB 4.06Å; Y438-K442 HydrophobicContact CE1-CD 4.39Å; Y438-K442 VanDerWaalsContact O-CB 3.28Å; Y438-K442 WeakPolarHBondContact O-CB 2.97Å; Y438-K442 PolarHBondContact O-N 2.85Å; K442-L506 HydrophobicContact CB-CD2 4.29Å; K442-D512 IonicContact NZ-OD1 2.72Å; K442-D512 PolarHBondContact NZ-OD1 2.81Å
443	G	95.3	Very high	96.5	Very high	57 Å²	57	51.7 Å²	51.7	59%	0.588	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.7	8.7	172.6	0	0	0	0	0	114.6	Y441 D512	Y441-G443 VanDerWaalsContact C-N 3.25Å; Y441-G443 PolarHBondContact O-N 3.48Å; Y441-G443 VanDerWaalsContact O-N 3.14Å; G443-D512 WeakPolarHBondContact CA-OD2 3.05Å
444	N	93.7	Very high	96.4	Very high	84 Å²	84	53.7 Å²	53.7	45%	0.449	31%	0.305	S	S	.	.			trans	-156.7	55.7	-176.9	-173.4	24	0	0	0	112.2	Y441 G446 G447	Y441-N444 CarbonylContact O-C 3.59Å; Y441-N444 PolarHBondContact O-N 3.38Å; N444-G446 PolarHBondContact O-N 3.05Å; N444-G446 VanDerWaalsContact O-N 3.14Å; N444-G447 PolarHBondContact O-N 3.41Å
445	V	95.4	Very high	96.4	Very high	16 Å²	16	60.6 Å²	60.6	10%	0.097	34%	0.338	C	S	.	.	G	3₁₀ helix	trans	-57.1	-29.1	178.3	65.7	0	0	0	0	112.7	L361 Y441 G447 L448 L449 L457 L506 L507	L361-V445 HydrophobicContact CD2-CG2 3.99Å; Y441-V445 PolarHBondContact O-N 3.19Å; Y441-V445 VanDerWaalsContact O-N 3.07Å; V445-G447 PolarHBondContact O-N 3.29Å; V445-L448 PolarHBondContact O-N 3.25Å; V445-L449 PolarHBondContact O-N 3.3Å; V445-L457 HydrophobicContact CG1-CD2 3.65Å; V445-L506 HydrophobicContact CB-CB 4.25Å; V445-L506 WeakPolarHBondContact CG1-O 3.43Å; V445-L506 HydrophobicContact CG2-CB 3.84Å; V445-L507 HydrophobicContact CG2-CD2 3.96Å
446	G	93	Very high	96.4	Very high	12 Å²	12	60.2 Å²	60.2	12%	0.124	34%	0.337	C	S	.	.	G	3₁₀ helix	trans	-65	-1.1	172	0	0	0	0	0	115.4	N444 R454	N444-G446 PolarHBondContact O-N 3.05Å; N444-G446 VanDerWaalsContact O-N 3.14Å; G446-R454 WeakPolarHBondContact O-CD 3.46Å
447	G	94.8	Very high	96.4	Very high	36 Å²	36	57.6 Å²	57.6	37%	0.371	33%	0.325	S	S	.	.	G	3₁₀ helix	trans	-91.6	-10.5	167.2	0	0	0	0	0	114.7	Y441 N444 V445	Y441-G447 VanDerWaalsContact CE1-C 3.44Å; Y441-G447 WeakPolarHBondContact CE1-O 3.49Å; N444-G447 PolarHBondContact O-N 3.41Å; V445-G447 PolarHBondContact O-N 3.29Å
448	L	94.8	Very high	96.4	Very high	23 Å²	23	61.6 Å²	61.6	12%	0.12	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.6	-43.1	167.5	-70.9	170.3	0	0	0	110.9	L361 H365 I437 Y441 V445	L361-L448 HydrophobicContact CD1-CB 4.23Å; L361-L448 HydrophobicContact CD1-CD1 3.92Å; H365-L448 HydrophobicContact CB-CD2 4.41Å; H365-L448 PolarHBondContact CE1-O 2.99Å; H365-L448 PolarHBondContact NE2-O 3.45Å; I437-L448 HydrophobicContact CG2-CD1 3.96Å; I437-L448 HydrophobicContact CG2-CD2 4.11Å; Y441-L448 HydrophobicContact CD1-CD2 4.25Å; Y441-L448 HydrophobicContact CD1-CG 3.79Å; Y441-L448 HydrophobicContact CD2-CD1 4.07Å; Y441-L448 HydrophobicContact CD2-CD2 3.57Å; Y441-L448 HydrophobicContact CD2-CG 3.75Å; Y441-L448 HydrophobicContact CE1-CD2 4.14Å; Y441-L448 HydrophobicContact CE1-CG 4.08Å; Y441-L448 HydrophobicContact CE2-CD2 3.47Å; Y441-L448 VanDerWaalsContact CE2-CD2 3.47Å; Y441-L448 HydrophobicContact CE2-CG 4.07Å; Y441-L448 HydrophobicContact CG-CD1 3.94Å; Y441-L448 HydrophobicContact CG-CD2 3.97Å; Y441-L448 HydrophobicContact CG-CG 3.6Å; V445-L448 PolarHBondContact O-N 3.25Å
449	L	96.2	Very high	96.4	Very high	17 Å²	17	66 Å²	66	9%	0.089	36%	0.363	C	S	.	.	S	Bend	trans	-69.5	146.2	-176.3	-58.3	-179.7	0	0	0	112.6	L361 V445 K453 R454 L457 L507	L361-L449 HydrophobicContact CD1-CD2 4.33Å; V445-L449 PolarHBondContact O-N 3.3Å; L449-K453 HydrophobicContact CB-CB 4.27Å; L449-R454 HydrophobicContact CB-CB 4.4Å; L449-L457 HydrophobicContact CD1-CB 4.08Å; L449-L457 HydrophobicContact CD1-CD2 3.73Å; L449-L507 HydrophobicContact CD1-CD2 4.18Å
450	N	94.6	Very high	96.4	Very high	71 Å²	71	63.2 Å²	63.2	38%	0.38	34%	0.343	S	S	.	.			trans	-64.2	159	166.8	73.6	65	0	0	0	110.9	I452 K453 R454	N450-I452 VanDerWaalsContact C-N 3.31Å; N450-I452 PolarHBondContact O-N 3.39Å; N450-I452 PolarHBondContact OD1-N 3.05Å; N450-I452 VanDerWaalsContact OD1-N 3.17Å; N450-K453 PolarHBondContact O-N 2.81Å; N450-K453 VanDerWaalsContact O-N 3.1Å; N450-K453 PolarHBondContact OD1-N 3.25Å; N450-R454 PolarHBondContact O-N 3Å
451	P	96.3	Very high	96.4	Very high	111 Å²	111	61.7 Å²	61.7	72%	0.721	33%	0.326	S	S	*	.	H	α-helix	trans	-56.2	-38.9	-172.7	-28.5	36.3	0	0	0	114.8	R454 E455	P451-R454 PolarHBondContact O-N 3.48Å; P451-E455 PolarHBondContact O-N 3.26Å
452	I	96.4	Very high	96.4	Very high	132 Å²	132	61.1 Å²	61.1	68%	0.677	33%	0.334	S	S	*	.	H	α-helix	trans	-67.3	-44.2	179.7	-57.4	172.9	0	0	0	109.9	N450 R454 E455 L456	N450-I452 VanDerWaalsContact C-N 3.31Å; N450-I452 PolarHBondContact O-N 3.39Å; N450-I452 PolarHBondContact OD1-N 3.05Å; N450-I452 VanDerWaalsContact OD1-N 3.17Å; I452-R454 VanDerWaalsContact C-N 3.35Å; I452-E455 PolarHBondContact O-N 2.9Å; I452-L456 WeakPolarHBondContact O-CB 3.18Å; I452-L456 PolarHBondContact O-N 2.87Å
453	K	96.7	Very high	96.5	Very high	29 Å²	29	61.2 Å²	61.2	13%	0.126	34%	0.335	C	S	.	.	H	α-helix	trans	-71.6	-27	177	-81	-166.5	150.1	96.3	0	113.7	E356 L357 E360 L449 N450 L457	E356-K453 IonicContact OE1-NZ 2.64Å; L357-K453 HydrophobicContact CD2-CB 4.08Å; L357-K453 HydrophobicContact CD2-CD 3.63Å; L357-K453 HydrophobicContact CD2-CG 3.86Å; E360-K453 VanDerWaalsContact CD-CE 3.41Å; E360-K453 WeakPolarHBondContact OE1-CD 3.27Å; E360-K453 WeakPolarHBondContact OE1-CE 3.41Å; E360-K453 IonicContact OE1-NZ 2.71Å; E360-K453 PolarHBondContact OE1-NZ 2.97Å; E360-K453 VanDerWaalsContact OE2-CE 3.32Å; E360-K453 WeakPolarHBondContact OE2-CE 3.47Å; E360-K453 IonicContact OE2-NZ 3.34Å; E360-K453 PolarHBondContact OE2-NZ 3.37Å; L449-K453 HydrophobicContact CB-CB 4.27Å; N450-K453 PolarHBondContact O-N 2.81Å; N450-K453 VanDerWaalsContact O-N 3.1Å; N450-K453 PolarHBondContact OD1-N 3.25Å; K453-L457 WeakPolarHBondContact O-CB 3.47Å; K453-L457 PolarHBondContact O-N 2.7Å
454	R	97.3	Very high	96.7	Very high	122 Å²	122	58.8 Å²	58.8	46%	0.46	31%	0.308	S	S	.	.	H	α-helix	trans	-65.8	-43.9	169.1	-179.4	-175.8	176.5	165.8	-3.7	111.8	G446 L449 N450 P451 I452 L457 L458	G446-R454 WeakPolarHBondContact O-CD 3.46Å; L449-R454 HydrophobicContact CB-CB 4.4Å; N450-R454 PolarHBondContact O-N 3Å; P451-R454 PolarHBondContact O-N 3.48Å; I452-R454 VanDerWaalsContact C-N 3.35Å; R454-L457 PolarHBondContact O-N 3.23Å; R454-L458 HydrophobicContact CG-CD1 4.42Å; R454-L458 WeakPolarHBondContact O-CG 3.43Å; R454-L458 PolarHBondContact O-N 2.95Å; R454-L458 VanDerWaalsContact O-N 3.12Å
455	E	97.6	Very high	96.9	Very high	145 Å²	145	56.1 Å²	56.1	68%	0.678	29%	0.293	S	S	*	.	H	α-helix	trans	-64.6	-44.2	175.1	-175.2	174.2	-173.5	0	0	111.2	P451 I452 L457 L458 R459	P451-E455 PolarHBondContact O-N 3.26Å; I452-E455 PolarHBondContact O-N 2.9Å; E455-L457 PolarHBondContact O-N 3.19Å; E455-L458 PolarHBondContact O-N 2.74Å; E455-R459 PolarHBondContact O-N 3.02Å
456	L	97.6	Very high	97	Very high	38 Å²	38	60.7 Å²	60.7	20%	0.199	32%	0.317	C	S	.	.	H	α-helix	trans	-56.9	-46.2	173.4	-179.9	58.3	0	0	0	112.1	L357 I452 R459 L460	L357-L456 HydrophobicContact CD1-CD2 4.5Å; L357-L456 HydrophobicContact CD1-CG 4.28Å; L357-L456 HydrophobicContact CD2-CD2 4.2Å; L357-L456 HydrophobicContact CG-CD2 4.41Å; I452-L456 WeakPolarHBondContact O-CB 3.18Å; I452-L456 PolarHBondContact O-N 2.87Å; L456-R459 PolarHBondContact O-N 2.74Å; L456-L460 HydrophobicContact CD1-CD1 3.84Å; L456-L460 HydrophobicContact CD1-CG 4Å; L456-L460 HydrophobicContact CG-CD1 3.78Å; L456-L460 HydrophobicContact CG-CG 4.37Å; L456-L460 WeakPolarHBondContact O-CB 3.32Å; L456-L460 VanDerWaalsContact O-CG 3.27Å; L456-L460 WeakPolarHBondContact O-CG 3.24Å; L456-L460 PolarHBondContact O-N 3.23Å
457	L	98.1	Very high	97.3	Very high	5 Å²	5	61.8 Å²	61.8	3%	0.026	32%	0.321	C	S	.	.	H	α-helix	trans	-59.6	-49.6	177.6	177.6	61.4	0	0	0	112	M354 L357 V445 L449 K453 R454 E455 R459 L460 Q461 L507	M354-L457 HydrophobicContact CE-CD1 4.15Å; M354-L457 HydrophobicContact SD-CD1 4.49Å; L357-L457 HydrophobicContact CD1-CB 3.94Å; L357-L457 HydrophobicContact CD1-CD1 4.04Å; V445-L457 HydrophobicContact CG1-CD2 3.65Å; L449-L457 HydrophobicContact CD1-CB 4.08Å; L449-L457 HydrophobicContact CD1-CD2 3.73Å; K453-L457 WeakPolarHBondContact O-CB 3.47Å; K453-L457 PolarHBondContact O-N 2.7Å; R454-L457 PolarHBondContact O-N 3.23Å; E455-L457 PolarHBondContact O-N 3.19Å; L457-R459 VanDerWaalsContact C-N 3.27Å; L457-R459 PolarHBondContact O-N 3.09Å; L457-L460 PolarHBondContact O-N 3.43Å; L457-Q461 HydrophobicContact CD1-CG 3.94Å; L457-Q461 HydrophobicContact CG-CG 4.25Å; L457-Q461 WeakPolarHBondContact O-CB 3.47Å; L457-Q461 VanDerWaalsContact O-CG 3.31Å; L457-Q461 WeakPolarHBondContact O-CG 3.43Å; L457-Q461 PolarHBondContact O-N 2.95Å; L457-L507 HydrophobicContact CD1-CB 4.22Å; L457-L507 HydrophobicContact CD1-CD2 3.86Å; L457-L507 HydrophobicContact CD2-CD2 3.7Å; L457-L507 HydrophobicContact CG-CD2 4.38Å
458	L	97.9	Very high	97.4	Very high	100 Å²	100	60.2 Å²	60.2	52%	0.524	30%	0.304	S	S	.	.	H	α-helix	trans	-61.2	-38.3	-179.4	-70.1	169	0	0	0	111.6	R454 E455 S462	R454-L458 HydrophobicContact CG-CD1 4.42Å; R454-L458 WeakPolarHBondContact O-CG 3.43Å; R454-L458 PolarHBondContact O-N 2.95Å; R454-L458 VanDerWaalsContact O-N 3.12Å; E455-L458 PolarHBondContact O-N 2.74Å; L458-S462 WeakPolarHBondContact O-CB 3.43Å; L458-S462 PolarHBondContact O-N 3.02Å
459	R	98.2	Very high	97.6	Very high	96 Å²	96	62.8 Å²	62.8	36%	0.362	32%	0.318	S	S	.	.	H	α-helix	trans	-65.1	-48.7	173.5	-174.2	-178.1	66.5	79.1	4.2	111.7	E455 L456 L457 S462 E463	E455-R459 PolarHBondContact O-N 3.02Å; L456-R459 PolarHBondContact O-N 2.74Å; L457-R459 VanDerWaalsContact C-N 3.27Å; L457-R459 PolarHBondContact O-N 3.09Å; R459-S462 PolarHBondContact O-N 2.83Å; R459-E463 VanDerWaalsContact CD-OE1 3.27Å; R459-E463 WeakPolarHBondContact CD-OE1 3.32Å; R459-E463 HydrophobicContact CG-CG 4.38Å; R459-E463 WeakPolarHBondContact CG-OE1 3.25Å; R459-E463 IonicContact CZ-OE1 2.7Å; R459-E463 IonicContact CZ-OE2 3.71Å; R459-E463 IonicContact NE-OE1 2.87Å; R459-E463 IonicContact NH1-OE1 2.63Å; R459-E463 PolarHBondContact NH1-OE1 2.94Å; R459-E463 IonicContact NH1-OE2 2.76Å; R459-E463 PolarHBondContact NH1-OE2 3.49Å; R459-E463 WeakPolarHBondContact O-CB 3.28Å; R459-E463 WeakPolarHBondContact O-CG 3.43Å; R459-E463 PolarHBondContact O-N 2.86Å
460	L	98.3	Very high	97.6	Very high	0 Å²	0	64.6 Å²	64.6	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-64.5	-41.4	-179.6	-71.2	168.9	0	0	0	112.6	L350 Q353 M354 L357 L456 L457 S462 E463 I464	L350-L460 HydrophobicContact CD2-CD2 3.84Å; Q353-L460 HydrophobicContact CB-CD1 3.78Å; Q353-L460 HydrophobicContact CB-CD2 3.61Å; Q353-L460 HydrophobicContact CB-CG 4.34Å; Q353-L460 HydrophobicContact CG-CD2 4.39Å; M354-L460 HydrophobicContact CE-CB 4.15Å; L357-L460 HydrophobicContact CD1-CD1 3.71Å; L357-L460 HydrophobicContact CG-CD1 4.41Å; L456-L460 HydrophobicContact CD1-CD1 3.84Å; L456-L460 HydrophobicContact CD1-CG 4Å; L456-L460 HydrophobicContact CG-CD1 3.78Å; L456-L460 HydrophobicContact CG-CG 4.37Å; L456-L460 WeakPolarHBondContact O-CB 3.32Å; L456-L460 VanDerWaalsContact O-CG 3.27Å; L456-L460 WeakPolarHBondContact O-CG 3.24Å; L456-L460 PolarHBondContact O-N 3.23Å; L457-L460 PolarHBondContact O-N 3.43Å; L460-S462 VanDerWaalsContact C-N 3.33Å; L460-S462 PolarHBondContact O-N 2.51Å; L460-E463 PolarHBondContact O-N 3.16Å; L460-I464 VanDerWaalsContact O-CB 3.23Å; L460-I464 WeakPolarHBondContact O-CB 3.16Å; L460-I464 WeakPolarHBondContact O-CG1 3.47Å; L460-I464 PolarHBondContact O-N 2.87Å
461	Q	98.3	Very high	97.8	Very high	59 Å²	59	61.4 Å²	61.4	28%	0.276	32%	0.315	S	S	.	.	H	α-helix	trans	-56.2	-48.8	173	-75.2	172.7	-24.8	0	0	110.8	L457 E465 L507	L457-Q461 HydrophobicContact CD1-CG 3.94Å; L457-Q461 HydrophobicContact CG-CG 4.25Å; L457-Q461 WeakPolarHBondContact O-CB 3.47Å; L457-Q461 VanDerWaalsContact O-CG 3.31Å; L457-Q461 WeakPolarHBondContact O-CG 3.43Å; L457-Q461 PolarHBondContact O-N 2.95Å; Q461-E465 VanDerWaalsContact O-CB 3.24Å; Q461-E465 WeakPolarHBondContact O-CB 3.44Å; Q461-E465 PolarHBondContact O-N 2.84Å; Q461-L507 PolarHBondContact NE2-O 3.13Å
462	S	98.4	Very high	97.9	Very high	64 Å²	64	57.5 Å²	57.5	45%	0.448	29%	0.288	S	S	.	.	H	α-helix	trans	-64.2	-46.9	178	-175.1	0	0	0	0	112.4	L458 R459 L460 E465 N466	L458-S462 WeakPolarHBondContact O-CB 3.43Å; L458-S462 PolarHBondContact O-N 3.02Å; R459-S462 PolarHBondContact O-N 2.83Å; L460-S462 VanDerWaalsContact C-N 3.33Å; L460-S462 PolarHBondContact O-N 2.51Å; S462-E465 PolarHBondContact O-N 2.79Å; S462-N466 WeakPolarHBondContact O-CB 3.44Å; S462-N466 VanDerWaalsContact O-CG 3.31Å; S462-N466 PolarHBondContact O-N 2.63Å; S462-N466 PolarHBondContact O-ND2 2.89Å; S462-N466 PolarHBondContact OG-ND2 3.04Å
463	E	98.6	Very high	98	Very high	68 Å²	68	54.2 Å²	54.2	32%	0.318	27%	0.274	S	S	.	.	H	α-helix	trans	-65.3	-43.6	180	-73.8	174.7	-158.3	0	0	111.9	L350 R459 L460 N466 V467	L350-E463 HydrophobicContact CD1-CB 4.3Å; L350-E463 HydrophobicContact CD2-CB 3.63Å; L350-E463 VanDerWaalsContact CD2-OE2 3.3Å; L350-E463 WeakPolarHBondContact CD2-OE2 3.33Å; R459-E463 VanDerWaalsContact CD-OE1 3.27Å; R459-E463 WeakPolarHBondContact CD-OE1 3.32Å; R459-E463 HydrophobicContact CG-CG 4.38Å; R459-E463 WeakPolarHBondContact CG-OE1 3.25Å; R459-E463 IonicContact CZ-OE1 2.7Å; R459-E463 IonicContact CZ-OE2 3.71Å; R459-E463 IonicContact NE-OE1 2.87Å; R459-E463 IonicContact NH1-OE1 2.63Å; R459-E463 PolarHBondContact NH1-OE1 2.94Å; R459-E463 IonicContact NH1-OE2 2.76Å; R459-E463 PolarHBondContact NH1-OE2 3.49Å; R459-E463 WeakPolarHBondContact O-CB 3.28Å; R459-E463 WeakPolarHBondContact O-CG 3.43Å; R459-E463 PolarHBondContact O-N 2.86Å; L460-E463 PolarHBondContact O-N 3.16Å; E463-N466 PolarHBondContact O-N 3.05Å; E463-V467 WeakPolarHBondContact O-CG2 3.21Å; E463-V467 PolarHBondContact O-N 3.22Å
464	I	98.6	Very high	98.1	Very high	6 Å²	6	53.8 Å²	53.8	3%	0.031	27%	0.274	C	S	.	.	H	α-helix	trans	-61.6	-46.7	175.2	-70.2	168.3	0	0	0	110.7	L331 L350 M354 L460 N466 V467 T468	L331-I464 HydrophobicContact CD1-CD1 4.31Å; L331-I464 HydrophobicContact CD1-CG1 4.34Å; L350-I464 HydrophobicContact CB-CG1 4.02Å; L350-I464 HydrophobicContact CD1-CG1 4.37Å; L350-I464 HydrophobicContact CD2-CG1 4.43Å; M354-I464 HydrophobicContact CB-CD1 4.07Å; M354-I464 HydrophobicContact CE-CD1 3.71Å; M354-I464 HydrophobicContact CG-CD1 4.33Å; L460-I464 VanDerWaalsContact O-CB 3.23Å; L460-I464 WeakPolarHBondContact O-CB 3.16Å; L460-I464 WeakPolarHBondContact O-CG1 3.47Å; L460-I464 PolarHBondContact O-N 2.87Å; I464-N466 VanDerWaalsContact C-N 3.31Å; I464-N466 PolarHBondContact O-N 3.11Å; I464-V467 WeakPolarHBondContact O-CG2 3.31Å; I464-V467 PolarHBondContact O-N 2.88Å; I464-T468 HydrophobicContact CG2-CG2 4.2Å; I464-T468 WeakPolarHBondContact O-CB 3.33Å; I464-T468 VanDerWaalsContact O-CG2 3.27Å; I464-T468 WeakPolarHBondContact O-CG2 3.34Å; I464-T468 PolarHBondContact O-N 3.45Å; I464-T468 PolarHBondContact O-OG1 2.91Å
465	E	98.3	Very high	98.2	Very high	29 Å²	29	48 Å²	48	14%	0.136	25%	0.252	C	S	.	.	H	α-helix	trans	-65.5	-34.8	-178.7	-171.9	70	160.3	0	0	112.4	Q461 S462 D469 S470 L472 T473	Q461-E465 VanDerWaalsContact O-CB 3.24Å; Q461-E465 WeakPolarHBondContact O-CB 3.44Å; Q461-E465 PolarHBondContact O-N 2.84Å; S462-E465 PolarHBondContact O-N 2.79Å; E465-D469 PolarHBondContact O-N 2.96Å; E465-S470 VanDerWaalsContact CD-CA 3.47Å; E465-S470 PolarHBondContact O-N 3.2Å; E465-S470 WeakPolarHBondContact OE1-CA 3.42Å; E465-L472 VanDerWaalsContact OE2-CB 3.28Å; E465-L472 WeakPolarHBondContact OE2-CB 3.48Å; E465-L472 PolarHBondContact OE2-N 2.92Å; E465-L472 VanDerWaalsContact OE2-N 3.14Å; E465-T473 WeakPolarHBondContact OE1-CA 3.47Å; E465-T473 WeakPolarHBondContact OE1-CB 3.4Å; E465-T473 PolarHBondContact OE1-N 2.91Å; E465-T473 PolarHBondContact OE1-OG1 3.08Å
466	N	98.3	Very high	98.2	Very high	112 Å²	112	42.9 Å²	42.9	60%	0.599	23%	0.229	S	C	*	.	H	α-helix	trans	-67.7	-47.1	173.5	-76.4	-54.5	0	0	0	112.4	S462 E463 I464 T468 D469	S462-N466 WeakPolarHBondContact O-CB 3.44Å; S462-N466 VanDerWaalsContact O-CG 3.31Å; S462-N466 PolarHBondContact O-N 2.63Å; S462-N466 PolarHBondContact O-ND2 2.89Å; S462-N466 PolarHBondContact OG-ND2 3.04Å; E463-N466 PolarHBondContact O-N 3.05Å; I464-N466 VanDerWaalsContact C-N 3.31Å; I464-N466 PolarHBondContact O-N 3.11Å; N466-T468 VanDerWaalsContact C-N 3.3Å; N466-T468 PolarHBondContact O-N 2.8Å; N466-D469 PolarHBondContact O-N 3.17Å
467	V	97.9	Very high	98.3	Very high	34 Å²	34	46.1 Å²	46.1	21%	0.206	24%	0.242	C	C	.	.	H	α-helix	trans	-73.9	-21.9	-179.1	-60.1	0	0	0	0	113.4	K342 T346 M347 L350 E463 I464	K342-V467 WeakPolarHBondContact CD-O 3.41Å; K342-V467 WeakPolarHBondContact CE-O 3.38Å; K342-V467 PolarHBondContact NZ-O 3.41Å; T346-V467 HydrophobicContact CG2-CG1 4.42Å; M347-V467 HydrophobicContact CE-CB 4.23Å; M347-V467 HydrophobicContact CE-CG2 3.78Å; M347-V467 HydrophobicContact SD-CB 3.6Å; M347-V467 VanDerWaalsContact SD-CB 3.6Å; M347-V467 HydrophobicContact SD-CG1 4.35Å; M347-V467 HydrophobicContact SD-CG2 3.3Å; M347-V467 WeakPolarHBondContact SD-CG2 3.39Å; L350-V467 HydrophobicContact CD1-CG1 4.12Å; L350-V467 HydrophobicContact CD1-CG2 3.69Å; E463-V467 WeakPolarHBondContact O-CG2 3.21Å; E463-V467 PolarHBondContact O-N 3.22Å; I464-V467 WeakPolarHBondContact O-CG2 3.31Å; I464-V467 PolarHBondContact O-N 2.88Å
468	T	98.3	Very high	98.3	Very high	3 Å²	3	45.9 Å²	45.9	2%	0.018	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.5	10.5	176.4	61.8	0	0	0	0	114.2	I327 L331 Y336 M347 I464 N466 S470 W471 H570	I327-T468 HydrophobicContact CB-CG2 3.77Å; I327-T468 HydrophobicContact CG1-CG2 3.93Å; I327-T468 HydrophobicContact CG2-CG2 3.75Å; L331-T468 HydrophobicContact CD2-CG2 4.48Å; Y336-T468 HydrophobicContact CE1-CG2 4.4Å; Y336-T468 HydrophobicContact CE2-CG2 4.44Å; Y336-T468 WeakPolarHBondContact OH-CA 3.41Å; Y336-T468 PolarHBondContact OH-O 2.97Å; Y336-T468 VanDerWaalsContact OH-O 3.08Å; M347-T468 HydrophobicContact CE-CG2 4.22Å; I464-T468 HydrophobicContact CG2-CG2 4.2Å; I464-T468 WeakPolarHBondContact O-CB 3.33Å; I464-T468 VanDerWaalsContact O-CG2 3.27Å; I464-T468 WeakPolarHBondContact O-CG2 3.34Å; I464-T468 PolarHBondContact O-N 3.45Å; I464-T468 PolarHBondContact O-OG1 2.91Å; N466-T468 VanDerWaalsContact C-N 3.3Å; N466-T468 PolarHBondContact O-N 2.8Å; T468-S470 VanDerWaalsContact C-N 3.33Å; T468-S470 PolarHBondContact O-N 3.04Å; T468-W471 PolarHBondContact O-N 3.49Å; T468-H570 PolarHBondContact O-NE2 3.27Å
469	D	97.3	Very high	98.3	Very high	77 Å²	77	41.1 Å²	41.1	41%	0.412	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.2	42.9	175.7	-44.2	-72.9	0	0	0	113.3	K342 E465 N466	K342-D469 WeakPolarHBondContact CE-OD2 3.44Å; K342-D469 IonicContact NZ-OD1 2.76Å; K342-D469 PolarHBondContact NZ-OD1 3.44Å; K342-D469 IonicContact NZ-OD2 3.95Å; K342-D469 PolarHBondContact NZ-OD2 3.48Å; E465-D469 PolarHBondContact O-N 2.96Å; N466-D469 PolarHBondContact O-N 3.17Å
470	S	97.8	Very high	98.3	Very high	56 Å²	56	41 Å²	41	39%	0.392	22%	0.222	S	C	.	.	S	Bend	trans	62.2	38.2	-179.4	-53.3	0	0	0	0	115.3	E465 T468 T474	E465-S470 VanDerWaalsContact CD-CA 3.47Å; E465-S470 PolarHBondContact O-N 3.2Å; E465-S470 WeakPolarHBondContact OE1-CA 3.42Å; T468-S470 VanDerWaalsContact C-N 3.33Å; T468-S470 PolarHBondContact O-N 3.04Å; S470-T474 WeakPolarHBondContact O-CB 3.3Å; S470-T474 PolarHBondContact O-N 3.4Å; S470-T474 PolarHBondContact O-OG1 3.29Å
471	W	98.7	Very high	98.3	Very high	4 Å²	4	42.9 Å²	42.9	2%	0.015	23%	0.232	C	C	.	.	H	α-helix	trans	-58.9	-49	178	-174.4	-75.1	0	0	0	111.9	E323 T324 I327 Y336 F340 T468 T474 A475 I567 H570 L573	E323-W471 WeakPolarHBondContact O-CZ2 3.49Å; T324-W471 PolarHBondContact O-NE1 3.02Å; I327-W471 HydrophobicContact CD1-CD2 3.56Å; I327-W471 HydrophobicContact CD1-CE3 4.01Å; I327-W471 HydrophobicContact CD1-CG 3.87Å; I327-W471 HydrophobicContact CD1-CH2 4.39Å; I327-W471 HydrophobicContact CD1-CZ2 3.96Å; I327-W471 HydrophobicContact CD1-CZ3 4.41Å; I327-W471 HydrophobicContact CG1-CB 4.02Å; I327-W471 HydrophobicContact CG1-CD2 3.88Å; I327-W471 HydrophobicContact CG1-CE3 4.44Å; I327-W471 HydrophobicContact CG1-CG 3.66Å; Y336-W471 HydrophobicContact CE2-CE3 4.45Å; F340-W471 HydrophobicContact CZ-CZ3 4.28Å; T468-W471 PolarHBondContact O-N 3.49Å; W471-T474 PolarHBondContact O-N 2.92Å; W471-T474 VanDerWaalsContact O-N 3.15Å; W471-A475 PolarHBondContact O-N 3.41Å; W471-I567 HydrophobicContact CH2-CG2 3.81Å; W471-I567 HydrophobicContact CZ2-CG2 3.51Å; W471-H570 AromaticContact CE3-CD2 3.79Å; W471-H570 AromaticContact CE3-CE1 3.66Å; W471-H570 AromaticContact CE3-CG 3.91Å; W471-H570 AromaticContact CE3-ND1 3.85Å; W471-H570 AromaticContact CE3-NE2 3.61Å; W471-H570 AromaticContact CZ3-ND1 3.88Å; W471-L573 HydrophobicContact CD2-CD1 3.78Å; W471-L573 VanDerWaalsContact CE2-CD1 3.48Å; W471-L573 HydrophobicContact CE3-CD1 4.38Å; W471-L573 HydrophobicContact CG-CD1 4.11Å; W471-L573 HydrophobicContact CH2-CD1 4.45Å; W471-L573 HydrophobicContact CZ2-CD1 3.86Å
472	L	98.6	Very high	98.3	Very high	29 Å²	29	40.1 Å²	40.1	15%	0.152	22%	0.219	C	C	.	.	H	α-helix	trans	-65.7	-45.2	-175.9	-179.2	64.8	0	0	0	111.2	I325 I326 E465 T474 A475 L476 Y508 L510	I325-L472 HydrophobicContact CG2-CD1 4.16Å; I326-L472 HydrophobicContact CG2-CD1 4.12Å; E465-L472 VanDerWaalsContact OE2-CB 3.28Å; E465-L472 WeakPolarHBondContact OE2-CB 3.48Å; E465-L472 PolarHBondContact OE2-N 2.92Å; E465-L472 VanDerWaalsContact OE2-N 3.14Å; L472-T474 PolarHBondContact O-N 3.44Å; L472-A475 PolarHBondContact O-N 2.88Å; L472-L476 HydrophobicContact CD1-CD1 4.48Å; L472-L476 HydrophobicContact CD1-CG 4.45Å; L472-L476 HydrophobicContact CG-CD1 3.98Å; L472-L476 HydrophobicContact CG-CG 4.39Å; L472-L476 VanDerWaalsContact O-CB 3.3Å; L472-L476 WeakPolarHBondContact O-CB 3.38Å; L472-L476 WeakPolarHBondContact O-CG 3.12Å; L472-L476 PolarHBondContact O-N 3.14Å; L472-Y508 HydrophobicContact CD1-CD1 4.43Å; L472-Y508 HydrophobicContact CD2-CD1 4.07Å; L472-L510 HydrophobicContact CD1-CD2 4.09Å
473	T	98.4	Very high	98.1	Very high	63 Å²	63	41.2 Å²	41.2	39%	0.387	22%	0.217	S	C	.	.	H	α-helix	trans	-59	-36.3	174.5	-65.5	0	0	0	0	111.4	E465 K477	E465-T473 WeakPolarHBondContact OE1-CA 3.47Å; E465-T473 WeakPolarHBondContact OE1-CB 3.4Å; E465-T473 PolarHBondContact OE1-N 2.91Å; E465-T473 PolarHBondContact OE1-OG1 3.08Å; T473-K477 WeakPolarHBondContact O-CG 3.48Å; T473-K477 PolarHBondContact O-N 2.7Å
474	T	98.3	Very high	98	Very high	19 Å²	19	42.2 Å²	42.2	12%	0.117	23%	0.231	C	C	.	.	H	α-helix	trans	-70.7	-41.8	178.1	-54.6	0	0	0	0	111.6	S470 W471 L472 L573 V574	S470-T474 WeakPolarHBondContact O-CB 3.3Å; S470-T474 PolarHBondContact O-N 3.4Å; S470-T474 PolarHBondContact O-OG1 3.29Å; W471-T474 PolarHBondContact O-N 2.92Å; W471-T474 VanDerWaalsContact O-N 3.15Å; L472-T474 PolarHBondContact O-N 3.44Å; T474-L573 HydrophobicContact CG2-CB 3.81Å; T474-V574 HydrophobicContact CG2-CG2 3.9Å
475	A	98.7	Very high	97.7	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-65.4	-41.3	172.6	0	0	0	0	0	112.4	I325 W471 L472 K477 S478 L479 L573	I325-A475 HydrophobicContact CG2-CB 4.16Å; W471-A475 PolarHBondContact O-N 3.41Å; L472-A475 PolarHBondContact O-N 2.88Å; A475-K477 VanDerWaalsContact C-N 3.31Å; A475-K477 PolarHBondContact O-N 2.87Å; A475-S478 PolarHBondContact O-N 3.45Å; A475-L479 WeakPolarHBondContact O-CG 3.41Å; A475-L479 PolarHBondContact O-N 3.22Å; A475-L573 HydrophobicContact CB-CD1 4.3Å; A475-L573 HydrophobicContact CB-CD2 4.14Å
476	L	98.4	Very high	97.1	Very high	39 Å²	39	46.8 Å²	46.8	20%	0.204	27%	0.273	C	S	.	.	H	α-helix	trans	-58.4	-36.9	178	-84.4	171.3	0	0	0	113.1	L472 S478 L479 L480 L510 V513	L472-L476 HydrophobicContact CD1-CD1 4.48Å; L472-L476 HydrophobicContact CD1-CG 4.45Å; L472-L476 HydrophobicContact CG-CD1 3.98Å; L472-L476 HydrophobicContact CG-CG 4.39Å; L472-L476 VanDerWaalsContact O-CB 3.3Å; L472-L476 WeakPolarHBondContact O-CB 3.38Å; L472-L476 WeakPolarHBondContact O-CG 3.12Å; L472-L476 PolarHBondContact O-N 3.14Å; L476-S478 PolarHBondContact O-N 3.28Å; L476-L479 HydrophobicContact CD2-CD1 4.42Å; L476-L479 PolarHBondContact O-N 2.71Å; L476-L480 WeakPolarHBondContact O-CB 3.34Å; L476-L480 VanDerWaalsContact O-CG 3.25Å; L476-L480 WeakPolarHBondContact O-CG 3.34Å; L476-L480 PolarHBondContact O-N 2.72Å; L476-L510 HydrophobicContact CD2-CD2 3.81Å; L476-L510 HydrophobicContact CG-CD2 4.41Å; L476-V513 HydrophobicContact CD2-CG2 4.21Å
477	K	98.2	Very high	96.9	Very high	105 Å²	105	46 Å²	46	46%	0.457	26%	0.264	S	S	.	.	H	α-helix	trans	-57.4	-48.1	175	-74.5	170.7	-176.7	176.3	0	112.2	T473 A475 L481	T473-K477 WeakPolarHBondContact O-CG 3.48Å; T473-K477 PolarHBondContact O-N 2.7Å; A475-K477 VanDerWaalsContact C-N 3.31Å; A475-K477 PolarHBondContact O-N 2.87Å; K477-L481 VanDerWaalsContact O-CB 3.26Å; K477-L481 WeakPolarHBondContact O-CB 3.17Å; K477-L481 PolarHBondContact O-N 3.46Å
478	S	98.6	Very high	96.8	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-64.9	-44.4	176.4	-65.6	0	0	0	0	112	A475 L476 L481 I482 H577	A475-S478 PolarHBondContact O-N 3.45Å; L476-S478 PolarHBondContact O-N 3.28Å; S478-L481 PolarHBondContact O-N 3.41Å; S478-I482 WeakPolarHBondContact O-CD1 3.42Å; S478-I482 VanDerWaalsContact O-CG1 3.29Å; S478-I482 WeakPolarHBondContact O-CG1 3.24Å; S478-I482 PolarHBondContact O-N 3.41Å; S478-H577 WeakPolarHBondContact OG-CA 3.42Å; S478-H577 WeakPolarHBondContact OG-CB 3.3Å; S478-H577 PolarHBondContact OG-N 3.1Å
479	L	98.6	Very high	96.7	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-60	-46.8	178.2	-75.3	168.2	0	0	0	112.9	W319 I325 A475 L476 I482 Q483 N490 L510 V513 F514	W319-L479 HydrophobicContact CD2-CD2 3.87Å; W319-L479 HydrophobicContact CE3-CD2 4.49Å; W319-L479 HydrophobicContact CG-CD2 4.26Å; W319-L479 HydrophobicContact CH2-CD2 4.19Å; W319-L479 HydrophobicContact CH2-CG 4.15Å; W319-L479 HydrophobicContact CZ2-CD2 3.53Å; W319-L479 HydrophobicContact CZ2-CG 3.87Å; I325-L479 HydrophobicContact CD1-CD1 4.1Å; I325-L479 HydrophobicContact CD1-CD2 4.27Å; I325-L479 HydrophobicContact CG1-CD1 4.3Å; I325-L479 HydrophobicContact CG2-CD1 3.86Å; A475-L479 WeakPolarHBondContact O-CG 3.41Å; A475-L479 PolarHBondContact O-N 3.22Å; L476-L479 HydrophobicContact CD2-CD1 4.42Å; L476-L479 PolarHBondContact O-N 2.71Å; L479-I482 PolarHBondContact O-N 3.35Å; L479-Q483 WeakPolarHBondContact O-CB 3.39Å; L479-Q483 PolarHBondContact O-N 3.34Å; L479-N490 HydrophobicContact CD2-CB 4.44Å; L479-N490 PolarHBondContact O-ND2 3.38Å; L479-L510 HydrophobicContact CD1-CD2 4.07Å; L479-V513 HydrophobicContact CB-CG1 3.76Å; L479-V513 HydrophobicContact CB-CG2 4.46Å; L479-V513 HydrophobicContact CD1-CG1 4.31Å; L479-V513 HydrophobicContact CD2-CG1 3.9Å; L479-V513 HydrophobicContact CG-CG1 4.21Å; L479-F514 HydrophobicContact CD1-CE2 4.25Å; L479-F514 HydrophobicContact CD2-CE2 3.93Å; L479-F514 HydrophobicContact CD2-CZ 3.6Å
480	L	98	Very high	96.8	Very high	93 Å²	93	43.5 Å²	43.5	49%	0.487	25%	0.25	S	C	.	.	H	α-helix	trans	-69.6	-36.7	178.8	-69.9	168.1	0	0	0	112	L476 Q483 S484 V513	L476-L480 WeakPolarHBondContact O-CB 3.34Å; L476-L480 VanDerWaalsContact O-CG 3.25Å; L476-L480 WeakPolarHBondContact O-CG 3.34Å; L476-L480 PolarHBondContact O-N 2.72Å; L480-Q483 PolarHBondContact O-N 2.99Å; L480-S484 PolarHBondContact O-N 3.49Å; L480-V513 HydrophobicContact CD2-CG2 4.02Å; L480-V513 HydrophobicContact CG-CG2 4.49Å
481	L	98	Very high	96.8	Very high	41 Å²	41	40.9 Å²	40.9	22%	0.215	23%	0.231	C	C	.	.	H	α-helix	trans	-64	-40.3	173.1	179	56.9	0	0	0	111.7	K477 S478 S484 R485 L580 E581	K477-L481 VanDerWaalsContact O-CB 3.26Å; K477-L481 WeakPolarHBondContact O-CB 3.17Å; K477-L481 PolarHBondContact O-N 3.46Å; S478-L481 PolarHBondContact O-N 3.41Å; L481-S484 PolarHBondContact O-OG 3.23Å; L481-R485 WeakPolarHBondContact O-CD 3.23Å; L481-R485 WeakPolarHBondContact O-CG 3.32Å; L481-L580 HydrophobicContact CD2-CB 3.66Å; L481-L580 HydrophobicContact CG-CB 4.38Å; L481-E581 HydrophobicContact CD2-CB 4.49Å; L481-E581 HydrophobicContact CD2-CG 3.73Å
482	I	97.8	Very high	96.9	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-63.7	-41.8	171.7	-69.6	160.9	0	0	0	111	F317 W319 S478 L479 S484 R485 C488 N490 L580	F317-I482 HydrophobicContact CB-CD1 4.19Å; F317-I482 HydrophobicContact CD1-CD1 3.78Å; F317-I482 HydrophobicContact CD1-CG1 4.48Å; F317-I482 HydrophobicContact CD2-CB 4.32Å; F317-I482 HydrophobicContact CD2-CD1 3.85Å; F317-I482 HydrophobicContact CD2-CG1 3.94Å; F317-I482 HydrophobicContact CD2-CG2 3.4Å; F317-I482 HydrophobicContact CE1-CD1 4Å; F317-I482 HydrophobicContact CE1-CG1 4.32Å; F317-I482 HydrophobicContact CE2-CB 4.35Å; F317-I482 HydrophobicContact CE2-CD1 4.07Å; F317-I482 HydrophobicContact CE2-CG1 3.76Å; F317-I482 HydrophobicContact CE2-CG2 3.68Å; F317-I482 HydrophobicContact CG-CD1 3.67Å; F317-I482 HydrophobicContact CG-CG1 4.27Å; F317-I482 HydrophobicContact CG-CG2 4.2Å; F317-I482 HydrophobicContact CZ-CD1 4.11Å; F317-I482 HydrophobicContact CZ-CG1 3.93Å; W319-I482 HydrophobicContact CZ2-CD1 3.8Å; S478-I482 WeakPolarHBondContact O-CD1 3.42Å; S478-I482 VanDerWaalsContact O-CG1 3.29Å; S478-I482 WeakPolarHBondContact O-CG1 3.24Å; S478-I482 PolarHBondContact O-N 3.41Å; L479-I482 PolarHBondContact O-N 3.35Å; I482-S484 PolarHBondContact O-N 2.92Å; I482-R485 WeakPolarHBondContact O-CB 3.44Å; I482-R485 PolarHBondContact O-N 3.37Å; I482-C488 HydrophobicContact CG2-CB 4.01Å; I482-N490 WeakPolarHBondContact CG2-OD1 3.48Å; I482-L580 HydrophobicContact CD1-CD1 3.89Å; I482-L580 HydrophobicContact CD1-CD2 4.17Å; I482-L580 HydrophobicContact CG1-CD1 4Å; I482-L580 HydrophobicContact CG1-CD2 3.79Å
483	Q	95.4	Very high	96.9	Very high	88 Å²	88	39.4 Å²	39.4	41%	0.411	22%	0.224	S	C	.	.	H	α-helix	trans	-68.3	-31.4	-179	-172.2	174.6	16.8	0	0	113.4	L479 L480 R485 D512	L479-Q483 WeakPolarHBondContact O-CB 3.39Å; L479-Q483 PolarHBondContact O-N 3.34Å; L480-Q483 PolarHBondContact O-N 2.99Å; Q483-R485 VanDerWaalsContact C-N 3.29Å; Q483-R485 PolarHBondContact O-N 3.32Å; Q483-D512 PolarHBondContact NE2-O 3.43Å
484	S	95.7	Very high	96.9	Very high	89 Å²	89	36.4 Å²	36.4	62%	0.622	21%	0.206	S	C	*	.	H	α-helix	trans	-72.8	-22	176.9	73	0	0	0	0	113.2	L480 L481 I482 G486	L480-S484 PolarHBondContact O-N 3.49Å; L481-S484 PolarHBondContact O-OG 3.23Å; I482-S484 PolarHBondContact O-N 2.92Å; S484-G486 PolarHBondContact O-N 3.38Å
485	R	93.2	Very high	96.9	Very high	49 Å²	49	39.1 Å²	39.1	19%	0.185	22%	0.222	C	C	.	.	S	Bend	trans	-79.3	97.2	175	-68	160.5	163.4	-132.9	-25.7	109.6	L481 I482 Q483 K487 C488 L580 D583 L585	L481-R485 WeakPolarHBondContact O-CD 3.23Å; L481-R485 WeakPolarHBondContact O-CG 3.32Å; I482-R485 WeakPolarHBondContact O-CB 3.44Å; I482-R485 PolarHBondContact O-N 3.37Å; Q483-R485 VanDerWaalsContact C-N 3.29Å; Q483-R485 PolarHBondContact O-N 3.32Å; R485-K487 PolarHBondContact O-N 2.97Å; R485-C488 HydrophobicContact CB-CB 3.84Å; R485-C488 WeakPolarHBondContact O-CB 3.38Å; R485-C488 PolarHBondContact O-N 2.92Å; R485-L580 PolarHBondContact NH2-O 3.29Å; R485-D583 IonicContact CZ-OD1 2.72Å; R485-D583 IonicContact NH1-OD1 2.68Å; R485-D583 PolarHBondContact NH1-OD1 2.76Å; R485-D583 IonicContact NH2-OD1 2.73Å; R485-D583 PolarHBondContact NH2-OD1 2.76Å; R485-L585 PolarHBondContact NH1-O 3.37Å
486	G	84.8	Confident	96.9	Very high	82 Å²	82	40.2 Å²	40.2	85%	0.845	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-0.2	-173.5	0	0	0	0	0	118.4	S484	S484-G486 PolarHBondContact O-N 3.38Å
487	K	93.3	Very high	96.9	Very high	95 Å²	95	40.6 Å²	40.6	41%	0.413	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-113	1.5	170.9	-61.3	-175	-177.2	173.1	0	113.9	D312 L313 E314 R315 R485	D312-K487 WeakPolarHBondContact O-CG 3.18Å; L313-K487 WeakPolarHBondContact CA-O 3.34Å; E314-K487 HydrophobicContact CB-CB 4.32Å; E314-K487 HydrophobicContact CG-CD 3.94Å; E314-K487 PolarHBondContact N-O 2.96Å; E314-K487 IonicContact OE1-NZ 2.63Å; E314-K487 PolarHBondContact OE1-NZ 3.34Å; E314-K487 WeakPolarHBondContact OE2-CD 3.45Å; E314-K487 IonicContact OE2-NZ 3.04Å; E314-K487 PolarHBondContact OE2-NZ 3.4Å; R315-K487 PolarHBondContact N-O 2.96Å; R485-K487 PolarHBondContact O-N 2.97Å
488	C	96.4	Very high	96.9	Very high	22 Å²	22	35.6 Å²	35.6	15%	0.149	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	158.4	178.1	-63.5	0	0	0	0	110.2	R315 F317 I482 R485	R315-C488 VanDerWaalsContact O-CA 3.28Å; R315-C488 WeakPolarHBondContact O-CA 3.45Å; F317-C488 HydrophobicContact CE2-CB 4.02Å; I482-C488 HydrophobicContact CG2-CB 4.01Å; R485-C488 HydrophobicContact CB-CB 3.84Å; R485-C488 WeakPolarHBondContact O-CB 3.38Å; R485-C488 PolarHBondContact O-N 2.92Å
489	M	97.1	Very high	96.9	Very high	34 Å²	34	35.6 Å²	35.6	17%	0.167	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	134.1	179.7	175.9	159.6	46.8	0	0	112.4	L313 R315 V316 F317 V491 N518 F538	L313-M489 HydrophobicContact CD1-CE 3.41Å; L313-M489 VanDerWaalsContact CD1-CE 3.41Å; L313-M489 HydrophobicContact CD2-CB 4.36Å; L313-M489 HydrophobicContact CD2-CE 3.93Å; L313-M489 HydrophobicContact CG-CE 4.34Å; R315-M489 PolarHBondContact O-N 3.04Å; V316-M489 WeakPolarHBondContact CA-O 3.16Å; V316-M489 HydrophobicContact CG2-CB 4.27Å; V316-M489 HydrophobicContact CG2-CE 4.05Å; F317-M489 PolarHBondContact N-O 3.09Å; M489-V491 HydrophobicContact CG-CG2 4.37Å; M489-N518 VanDerWaalsContact CG-ND2 3.28Å; M489-N518 WeakPolarHBondContact CG-ND2 3.26Å; M489-N518 PolarHBondContact SD-ND2 3.23Å; M489-F538 HydrophobicContact CE-CD1 3.57Å; M489-F538 HydrophobicContact CE-CE1 3.2Å; M489-F538 HydrophobicContact CE-CE2 4.25Å; M489-F538 HydrophobicContact CE-CG 4.23Å; M489-F538 HydrophobicContact CE-CZ 3.57Å; M489-F538 HydrophobicContact SD-CE1 4.1Å; M489-F538 HydrophobicContact SD-CZ 4.13Å
490	N	98.6	Very high	96.9	Very high	6 Å²	6	36 Å²	36	3%	0.032	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	137	170.2	-65.3	-52	0	0	0	110.7	W319 L479 I482 V513 F514 N518	W319-N490 PolarHBondContact NE1-OD1 2.92Å; L479-N490 HydrophobicContact CD2-CB 4.44Å; L479-N490 PolarHBondContact O-ND2 3.38Å; I482-N490 WeakPolarHBondContact CG2-OD1 3.48Å; N490-V513 HydrophobicContact CB-CG1 4.44Å; N490-F514 HydrophobicContact CB-CD1 4.08Å; N490-F514 HydrophobicContact CB-CE1 3.66Å; N490-F514 HydrophobicContact CB-CZ 4.22Å; N490-N518 PolarHBondContact O-ND2 2.66Å
491	V	98.9	Very high	96.9	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	132.6	173	177.2	0	0	0	0	108.3	V316 F317 L318 W319 M489 V493 N518 Y520 I534 F538	V316-V491 HydrophobicContact CG1-CB 4.39Å; V316-V491 HydrophobicContact CG1-CG2 3.79Å; F317-V491 PolarHBondContact O-N 2.83Å; F317-V491 VanDerWaalsContact O-O 3.12Å; L318-V491 HydrophobicContact CD2-CB 3.86Å; L318-V491 HydrophobicContact CD2-CG1 4.08Å; L318-V491 HydrophobicContact CD2-CG2 4.45Å; W319-V491 PolarHBondContact N-O 3.3Å; M489-V491 HydrophobicContact CG-CG2 4.37Å; V491-V493 HydrophobicContact CG1-CG2 4.3Å; V491-N518 CarbonylContact C-O 3.56Å; V491-N518 WeakPolarHBondContact CA-O 3.16Å; V491-N518 WeakPolarHBondContact CG1-O 3.28Å; V491-N518 HydrophobicContact CG2-CB 4.28Å; V491-Y520 HydrophobicContact CG1-CD2 3.76Å; V491-Y520 HydrophobicContact CG1-CE2 3.64Å; V491-I534 HydrophobicContact CG1-CD1 3.82Å; V491-I534 HydrophobicContact CG1-CG1 4.29Å; V491-F538 HydrophobicContact CG2-CE2 3.89Å; V491-F538 HydrophobicContact CG2-CZ 4.34Å
492	L	98.9	Very high	97	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	133	-178.6	-166.6	67.7	0	0	0	110.4	W319 L321 I325 V505 F514 N518 I519 Y520	W319-L492 HydrophobicContact CB-CD1 4.15Å; L321-L492 HydrophobicContact CB-CD1 3.98Å; L321-L492 HydrophobicContact CB-CD2 4.38Å; L321-L492 HydrophobicContact CB-CG 4.43Å; L321-L492 HydrophobicContact CD1-CD1 4.38Å; L321-L492 HydrophobicContact CD1-CD2 4.21Å; L321-L492 HydrophobicContact CD2-CD2 4.42Å; I325-L492 HydrophobicContact CD1-CD1 3.83Å; L492-V505 HydrophobicContact CD2-CG2 3.47Å; L492-V505 VanDerWaalsContact CD2-CG2 3.47Å; L492-F514 HydrophobicContact CB-CD1 3.75Å; L492-F514 HydrophobicContact CB-CE1 3.69Å; L492-F514 HydrophobicContact CB-CG 4.38Å; L492-F514 HydrophobicContact CB-CZ 4.29Å; L492-F514 HydrophobicContact CD1-CE1 4.21Å; L492-F514 HydrophobicContact CD1-CE2 4.45Å; L492-F514 HydrophobicContact CD1-CZ 3.98Å; L492-N518 PolarHBondContact N-O 2.93Å; L492-I519 HydrophobicContact CB-CG1 4.18Å; L492-I519 HydrophobicContact CD2-CG1 4.35Å; L492-I519 HydrophobicContact CD2-CG2 4.31Å; L492-Y520 PolarHBondContact O-N 3.25Å
493	V	98.9	Very high	97	Very high	2 Å²	2	29.6 Å²	29.6	1%	0.012	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	91.9	178.4	-167.2	0	0	0	0	109.6	W319 V491 Y520 A522 K527 C530 F531 I534	W319-V493 PolarHBondContact O-N 3.4Å; V491-V493 HydrophobicContact CG1-CG2 4.3Å; V493-Y520 WeakPolarHBondContact CA-O 3.43Å; V493-A522 HydrophobicContact CG1-CB 4.34Å; V493-K527 HydrophobicContact CB-CD 4.47Å; V493-K527 HydrophobicContact CG1-CD 3.83Å; V493-K527 WeakPolarHBondContact O-CE 3.31Å; V493-K527 PolarHBondContact O-NZ 3.43Å; V493-C530 HydrophobicContact CG1-CB 3.52Å; V493-F531 HydrophobicContact CB-CE1 4.09Å; V493-F531 HydrophobicContact CG1-CD1 4.43Å; V493-F531 HydrophobicContact CG1-CE1 4.09Å; V493-F531 HydrophobicContact CG2-CD1 4.32Å; V493-F531 HydrophobicContact CG2-CE1 3.99Å; V493-I534 HydrophobicContact CG2-CD1 3.48Å; V493-I534 VanDerWaalsContact CG2-CD1 3.48Å
494	T	98.8	Very high	97.2	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	154.9	-176.6	175.2	0	0	0	0	112	L321 D322 T496 A501 Y520 A522	L321-T494 HydrophobicContact CD2-CG2 4.36Å; D322-T494 PolarHBondContact OD2-OG1 2.95Å; T494-T496 VanDerWaalsContact C-N 3.26Å; T494-T496 WeakPolarHBondContact OG1-CB 3.1Å; T494-T496 PolarHBondContact OG1-N 3.47Å; T494-T496 VanDerWaalsContact OG1-N 3.09Å; T494-T496 PolarHBondContact OG1-OG1 3.21Å; T494-A501 HydrophobicContact CG2-CB 3.67Å; T494-Y520 PolarHBondContact N-O 2.69Å; T494-A522 WeakPolarHBondContact O-CB 3.31Å; T494-A522 PolarHBondContact O-N 3.14Å
495	T	98.1	Very high	97.4	Very high	76 Å²	76	21.9 Å²	21.9	47%	0.466	13%	0.131	S	C	.	.	S	Bend	trans	-78.3	-5.7	169.3	52.5	0	0	0	0	113.8	T523	T495-T523 PolarHBondContact O-OG1 3.06Å
496	T	98.3	Very high	97.6	Very high	24 Å²	24	19.6 Å²	19.6	15%	0.147	12%	0.123	C	C	.	.	S	Bend	trans	-71	144	172.5	-55.2	0	0	0	0	111.1	D322 T494 P500 A501 K504 S521 T523	D322-T496 PolarHBondContact OD2-OG1 2.86Å; T494-T496 VanDerWaalsContact C-N 3.26Å; T494-T496 WeakPolarHBondContact OG1-CB 3.1Å; T494-T496 PolarHBondContact OG1-N 3.47Å; T494-T496 VanDerWaalsContact OG1-N 3.09Å; T494-T496 PolarHBondContact OG1-OG1 3.21Å; T496-P500 HydrophobicContact CG2-CB 3.92Å; T496-A501 HydrophobicContact CG2-CB 4.11Å; T496-K504 HydrophobicContact CG2-CD 4.4Å; T496-K504 PolarHBondContact OG1-NZ 2.73Å; T496-S521 WeakPolarHBondContact O-CB 3.39Å; T496-S521 PolarHBondContact O-OG 3.13Å; T496-T523 PolarHBondContact O-OG1 2.86Å
497	Q	98.6	Very high	98.3	Very high	46 Å²	46	15.7 Å²	15.7	22%	0.215	8%	0.082	C	C	.	.			trans	-54.1	149.7	170.9	-75.5	-169.8	45.6	0	0	110.9	D375 V499 P500 A501 T523	D375-Q497 WeakPolarHBondContact OD2-CA 3.39Å; D375-Q497 WeakPolarHBondContact OD2-CB 3.36Å; Q497-V499 PolarHBondContact O-N 3.05Å; Q497-P500 HydrophobicContact CB-CG 4.29Å; Q497-P500 WeakPolarHBondContact O-CD 3.45Å; Q497-A501 WeakPolarHBondContact O-CB 3.3Å; Q497-A501 PolarHBondContact O-N 2.98Å; Q497-T523 HydrophobicContact CG-CG2 4.14Å; Q497-T523 PolarHBondContact N-OG1 3.14Å; Q497-T523 VanDerWaalsContact N-OG1 3.14Å
498	L	98.8	Very high	98.5	Very high	0 Å²	0	11.7 Å²	11.7	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-62.6	-40	-169	-178.8	58.7	0	0	0	112.7	D375 Q376 Y431 A501 L502 I519	D375-L498 WeakPolarHBondContact OD1-CB 3.28Å; D375-L498 PolarHBondContact OD1-N 2.7Å; D375-L498 PolarHBondContact OD2-N 2.77Å; Q376-L498 VanDerWaalsContact O-CB 3.24Å; Q376-L498 WeakPolarHBondContact O-CB 3.11Å; Q376-L498 WeakPolarHBondContact O-CD2 3.21Å; Y431-L498 HydrophobicContact CE1-CD2 4.04Å; L498-A501 PolarHBondContact O-N 3.32Å; L498-L502 HydrophobicContact CD1-CD1 4.16Å; L498-L502 HydrophobicContact CD1-CG 4.19Å; L498-L502 HydrophobicContact CG-CD1 4.1Å; L498-L502 VanDerWaalsContact O-CG 3.24Å; L498-L502 WeakPolarHBondContact O-CG 3.45Å; L498-L502 PolarHBondContact O-N 2.57Å; L498-I519 HydrophobicContact CD1-CG2 3.88Å
499	V	98.8	Very high	98.6	Very high	1 Å²	1	12.8 Å²	12.8	1%	0.006	8%	0.079	C	C	.	.	H	α-helix	trans	-67.4	-51.6	-178.5	177.3	0	0	0	0	112.7	A362 L366 F368 L371 L434 Q497 A501 L502 A503	A362-V499 HydrophobicContact CB-CG1 4.27Å; L366-V499 HydrophobicContact CB-CG1 3.67Å; L366-V499 WeakPolarHBondContact O-CG1 3.37Å; F368-V499 HydrophobicContact CB-CG1 3.78Å; F368-V499 HydrophobicContact CD2-CB 3.99Å; F368-V499 HydrophobicContact CD2-CG1 4.01Å; F368-V499 HydrophobicContact CG-CG1 4.28Å; L371-V499 HydrophobicContact CB-CG2 4.07Å; L371-V499 HydrophobicContact CD1-CG2 3.73Å; L434-V499 HydrophobicContact CD2-CG2 3.92Å; Q497-V499 PolarHBondContact O-N 3.05Å; V499-A501 VanDerWaalsContact C-N 3.31Å; V499-A501 PolarHBondContact O-N 3.14Å; V499-L502 PolarHBondContact O-N 3.15Å; V499-A503 PolarHBondContact O-N 2.89Å; V499-A503 VanDerWaalsContact O-N 3.09Å
500	P	98.8	Very high	98.7	Very high	7 Å²	7	11.1 Å²	11.1	5%	0.045	7%	0.071	C	C	.	.	H	α-helix	trans	-63.9	-29.4	171.5	-23.8	34.8	0	0	0	114.2	I358 F368 T496 Q497 A503 K504	I358-P500 HydrophobicContact CG2-CB 4.46Å; F368-P500 HydrophobicContact CD2-CG 3.93Å; F368-P500 HydrophobicContact CE1-CG 4.38Å; F368-P500 HydrophobicContact CE2-CG 3.58Å; F368-P500 HydrophobicContact CG-CG 4.48Å; F368-P500 HydrophobicContact CZ-CG 3.84Å; T496-P500 HydrophobicContact CG2-CB 3.92Å; Q497-P500 HydrophobicContact CB-CG 4.29Å; Q497-P500 WeakPolarHBondContact O-CD 3.45Å; P500-A503 WeakPolarHBondContact O-CB 3.46Å; P500-A503 PolarHBondContact O-N 2.93Å; P500-K504 WeakPolarHBondContact O-CG 3.34Å; P500-K504 PolarHBondContact O-N 3.45Å
501	A	98.9	Very high	98.6	Very high	0 Å²	0	10.9 Å²	10.9	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-63.2	-41.2	173.1	0	0	0	0	0	111.7	T494 T496 Q497 L498 V499 K504 V505	T494-A501 HydrophobicContact CG2-CB 3.67Å; T496-A501 HydrophobicContact CG2-CB 4.11Å; Q497-A501 WeakPolarHBondContact O-CB 3.3Å; Q497-A501 PolarHBondContact O-N 2.98Å; L498-A501 PolarHBondContact O-N 3.32Å; V499-A501 VanDerWaalsContact C-N 3.31Å; V499-A501 PolarHBondContact O-N 3.14Å; A501-K504 PolarHBondContact O-N 3.35Å; A501-V505 VanDerWaalsContact O-CG2 3.31Å; A501-V505 WeakPolarHBondContact O-CG2 3.47Å; A501-V505 PolarHBondContact O-N 3.34Å
502	L	98.9	Very high	98.5	Very high	1 Å²	1	14.6 Å²	14.6	1%	0.005	9%	0.09	C	C	.	.	H	α-helix	trans	-67.1	-37.2	174.3	-66.3	167	0	0	0	111.8	L366 L434 Y438 L498 V499 V505 L506 I516 I519	L366-L502 HydrophobicContact CD1-CB 4.49Å; L434-L502 HydrophobicContact CD1-CD1 4.11Å; L434-L502 HydrophobicContact CD2-CD1 3.81Å; L434-L502 HydrophobicContact CG-CD1 3.97Å; Y438-L502 HydrophobicContact CD2-CB 4.36Å; Y438-L502 HydrophobicContact CD2-CD2 3.75Å; Y438-L502 HydrophobicContact CE2-CD2 3.69Å; L498-L502 HydrophobicContact CD1-CD1 4.16Å; L498-L502 HydrophobicContact CD1-CG 4.19Å; L498-L502 HydrophobicContact CG-CD1 4.1Å; L498-L502 VanDerWaalsContact O-CG 3.24Å; L498-L502 WeakPolarHBondContact O-CG 3.45Å; L498-L502 PolarHBondContact O-N 2.57Å; V499-L502 PolarHBondContact O-N 3.15Å; L502-V505 PolarHBondContact O-N 2.7Å; L502-L506 WeakPolarHBondContact O-CB 3.45Å; L502-L506 VanDerWaalsContact O-CG 3.28Å; L502-L506 WeakPolarHBondContact O-CG 3.47Å; L502-L506 PolarHBondContact O-N 3.47Å; L502-I516 HydrophobicContact CD1-CD1 3.71Å; L502-I516 HydrophobicContact CD1-CG1 4.34Å; L502-I516 HydrophobicContact CD2-CD1 3.77Å; L502-I516 HydrophobicContact CD2-CG1 3.7Å; L502-I516 HydrophobicContact CG-CD1 4.41Å; L502-I519 HydrophobicContact CD2-CB 4.44Å; L502-I519 HydrophobicContact CD2-CD1 3.58Å; L502-I519 HydrophobicContact CD2-CG2 4.27Å
503	A	98.8	Very high	98.4	Very high	0 Å²	0	15 Å²	15	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-60.1	-48.5	171.7	0	0	0	0	0	111.8	I358 L361 A362 L366 V499 P500 V505 L506 L507	I358-A503 HydrophobicContact CG2-CB 4.14Å; I358-A503 WeakPolarHBondContact O-CB 3.4Å; L361-A503 HydrophobicContact CB-CB 4.42Å; L361-A503 HydrophobicContact CD2-CB 4.05Å; L361-A503 HydrophobicContact CG-CB 4.31Å; A362-A503 HydrophobicContact CB-CB 4.22Å; L366-A503 HydrophobicContact CD1-CB 3.92Å; V499-A503 PolarHBondContact O-N 2.89Å; V499-A503 VanDerWaalsContact O-N 3.09Å; P500-A503 WeakPolarHBondContact O-CB 3.46Å; P500-A503 PolarHBondContact O-N 2.93Å; A503-V505 PolarHBondContact O-N 2.68Å; A503-L506 PolarHBondContact O-N 3.4Å; A503-L507 WeakPolarHBondContact O-CB 3.45Å; A503-L507 VanDerWaalsContact O-CG 3.27Å; A503-L507 WeakPolarHBondContact O-CG 3.28Å; A503-L507 PolarHBondContact O-N 3.36Å
504	K	98.8	Very high	98.4	Very high	15 Å²	15	14.9 Å²	14.9	7%	0.065	9%	0.092	C	C	.	.	H	α-helix	trans	-54.8	-51.2	173.1	-74	176	177.4	-177.1	0	111.8	L321 D322 I326 I358 T496 P500 A501 L506 L507 Y508	L321-K504 HydrophobicContact CD2-CB 3.98Å; L321-K504 HydrophobicContact CD2-CD 3.7Å; D322-K504 IonicContact OD1-NZ 2.6Å; D322-K504 PolarHBondContact OD1-NZ 3.08Å; D322-K504 IonicContact OD2-NZ 3.63Å; D322-K504 PolarHBondContact OD2-NZ 2.83Å; I326-K504 HydrophobicContact CD1-CB 4.41Å; I326-K504 HydrophobicContact CD1-CD 4.14Å; I326-K504 HydrophobicContact CD1-CG 4.45Å; I358-K504 HydrophobicContact CD1-CG 3.77Å; I358-K504 HydrophobicContact CG1-CG 4.14Å; I358-K504 HydrophobicContact CG2-CG 4.24Å; T496-K504 HydrophobicContact CG2-CD 4.4Å; T496-K504 PolarHBondContact OG1-NZ 2.73Å; P500-K504 WeakPolarHBondContact O-CG 3.34Å; P500-K504 PolarHBondContact O-N 3.45Å; A501-K504 PolarHBondContact O-N 3.35Å; K504-L506 VanDerWaalsContact C-N 3.31Å; K504-L506 PolarHBondContact O-N 3.47Å; K504-L507 PolarHBondContact O-N 3.09Å; K504-Y508 WeakPolarHBondContact O-CB 3.39Å; K504-Y508 WeakPolarHBondContact O-CD2 3.48Å; K504-Y508 PolarHBondContact O-N 3.34Å
505	V	98.9	Very high	98.3	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-61.5	-37.4	-177.8	167.4	0	0	0	0	112.3	L321 Y438 L492 A501 L502 A503 G509 L510 G511 I519	L321-V505 HydrophobicContact CD1-CG2 4.39Å; Y438-V505 HydrophobicContact CE2-CG1 3.92Å; Y438-V505 WeakPolarHBondContact OH-CG1 3.42Å; L492-V505 HydrophobicContact CD2-CG2 3.47Å; L492-V505 VanDerWaalsContact CD2-CG2 3.47Å; A501-V505 VanDerWaalsContact O-CG2 3.31Å; A501-V505 WeakPolarHBondContact O-CG2 3.47Å; A501-V505 PolarHBondContact O-N 3.34Å; L502-V505 PolarHBondContact O-N 2.7Å; A503-V505 PolarHBondContact O-N 2.68Å; V505-G509 PolarHBondContact O-N 3.41Å; V505-L510 HydrophobicContact CB-CB 4.47Å; V505-L510 HydrophobicContact CG1-CB 3.89Å; V505-L510 PolarHBondContact O-N 2.99Å; V505-G511 PolarHBondContact O-N 2.89Å; V505-I519 HydrophobicContact CB-CD1 4.46Å; V505-I519 HydrophobicContact CG1-CD1 4Å; V505-I519 HydrophobicContact CG2-CD1 4.27Å
506	L	98.8	Very high	98.4	Very high	1 Å²	1	14.1 Å²	14.1	1%	0.005	9%	0.087	C	C	.	.	H	α-helix	trans	-69	-47	173.2	-69.3	173.4	0	0	0	112.2	L361 Y438 K442 V445 L502 A503 K504 G509	L361-L506 HydrophobicContact CD2-CB 4.22Å; L361-L506 HydrophobicContact CD2-CD1 4.37Å; Y438-L506 HydrophobicContact CD2-CD1 4.09Å; Y438-L506 HydrophobicContact CD2-CD2 3.73Å; Y438-L506 HydrophobicContact CD2-CG 3.83Å; Y438-L506 HydrophobicContact CE2-CD2 3.88Å; Y438-L506 HydrophobicContact CE2-CG 4.01Å; Y438-L506 HydrophobicContact CG-CD2 4.35Å; K442-L506 HydrophobicContact CB-CD2 4.29Å; V445-L506 HydrophobicContact CB-CB 4.25Å; V445-L506 WeakPolarHBondContact CG1-O 3.43Å; V445-L506 HydrophobicContact CG2-CB 3.84Å; L502-L506 WeakPolarHBondContact O-CB 3.45Å; L502-L506 VanDerWaalsContact O-CG 3.28Å; L502-L506 WeakPolarHBondContact O-CG 3.47Å; L502-L506 PolarHBondContact O-N 3.47Å; A503-L506 PolarHBondContact O-N 3.4Å; K504-L506 VanDerWaalsContact C-N 3.31Å; K504-L506 PolarHBondContact O-N 3.47Å; L506-G509 PolarHBondContact O-N 3.14Å
507	L	98.7	Very high	98.4	Very high	0 Å²	0	15.6 Å²	15.6	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-72.8	-26.3	-175.8	-67.1	168.5	0	0	0	113.7	M354 L357 I358 L361 V445 L449 L457 Q461 A503 K504 G509	M354-L507 HydrophobicContact SD-CB 4.38Å; L357-L507 HydrophobicContact CB-CD1 4.2Å; I358-L507 HydrophobicContact CB-CD1 4.25Å; I358-L507 HydrophobicContact CG1-CD1 3.68Å; L361-L507 HydrophobicContact CB-CD1 4.3Å; L361-L507 HydrophobicContact CD2-CD1 3.86Å; L361-L507 HydrophobicContact CD2-CD2 3.87Å; L361-L507 HydrophobicContact CD2-CG 3.6Å; V445-L507 HydrophobicContact CG2-CD2 3.96Å; L449-L507 HydrophobicContact CD1-CD2 4.18Å; L457-L507 HydrophobicContact CD1-CB 4.22Å; L457-L507 HydrophobicContact CD1-CD2 3.86Å; L457-L507 HydrophobicContact CD2-CD2 3.7Å; L457-L507 HydrophobicContact CG-CD2 4.38Å; Q461-L507 PolarHBondContact NE2-O 3.13Å; A503-L507 WeakPolarHBondContact O-CB 3.45Å; A503-L507 VanDerWaalsContact O-CG 3.27Å; A503-L507 WeakPolarHBondContact O-CG 3.28Å; A503-L507 PolarHBondContact O-N 3.36Å; K504-L507 PolarHBondContact O-N 3.09Å; L507-G509 VanDerWaalsContact C-N 3.34Å
508	Y	98.6	Very high	98.4	Very high	11 Å²	11	13.7 Å²	13.7	4%	0.043	8%	0.084	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.1	9.9	172.1	-77.9	-103.8	0	0	0	113.1	I326 I327 M354 L472 K504 L510	I326-Y508 HydrophobicContact CB-CD1 3.66Å; I326-Y508 HydrophobicContact CB-CE1 3.64Å; I326-Y508 HydrophobicContact CB-CG 4.21Å; I326-Y508 HydrophobicContact CD1-CD2 4.11Å; I326-Y508 HydrophobicContact CD1-CE1 4.35Å; I326-Y508 HydrophobicContact CD1-CE2 3.92Å; I326-Y508 HydrophobicContact CD1-CG 4.4Å; I326-Y508 HydrophobicContact CG1-CE1 4.49Å; I326-Y508 HydrophobicContact CG2-CD1 3.41Å; I326-Y508 VanDerWaalsContact CG2-CD1 3.41Å; I326-Y508 HydrophobicContact CG2-CD2 4.37Å; I326-Y508 HydrophobicContact CG2-CE1 3.96Å; I326-Y508 HydrophobicContact CG2-CG 3.63Å; I327-Y508 PolarHBondContact O-OH 3.43Å; M354-Y508 HydrophobicContact CE-CE2 4.22Å; M354-Y508 HydrophobicContact CG-CE2 3.85Å; M354-Y508 HydrophobicContact SD-CE2 3.92Å; L472-Y508 HydrophobicContact CD1-CD1 4.43Å; L472-Y508 HydrophobicContact CD2-CD1 4.07Å; K504-Y508 WeakPolarHBondContact O-CB 3.39Å; K504-Y508 WeakPolarHBondContact O-CD2 3.48Å; K504-Y508 PolarHBondContact O-N 3.34Å; Y508-L510 PolarHBondContact O-N 3.28Å
509	G	97.8	Very high	98.4	Very high	44 Å²	44	13.7 Å²	13.7	45%	0.454	8%	0.084	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.7	14.1	174.5	0	0	0	0	0	115.2	V505 L506 L507 G511	V505-G509 PolarHBondContact O-N 3.41Å; L506-G509 PolarHBondContact O-N 3.14Å; L507-G509 VanDerWaalsContact C-N 3.34Å; G509-G511 VanDerWaalsContact C-N 3.26Å; G509-G511 PolarHBondContact O-N 3.42Å
510	L	98.6	Very high	98.4	Very high	0 Å²	0	14 Å²	14	0%	0	9%	0.085	C	C	.	.	G	3₁₀ helix	trans	-80.7	-5.1	-177.1	-62.7	175.2	0	0	0	113.1	L321 I325 I326 L472 L476 L479 V505 Y508 D512 V513 F514	L321-L510 HydrophobicContact CD1-CD1 3.8Å; I325-L510 HydrophobicContact CG2-CD1 3.69Å; I325-L510 HydrophobicContact CG2-CD2 3.72Å; I325-L510 HydrophobicContact CG2-CG 4.37Å; I326-L510 HydrophobicContact CG2-CD1 3.81Å; L472-L510 HydrophobicContact CD1-CD2 4.09Å; L476-L510 HydrophobicContact CD2-CD2 3.81Å; L476-L510 HydrophobicContact CG-CD2 4.41Å; L479-L510 HydrophobicContact CD1-CD2 4.07Å; V505-L510 HydrophobicContact CB-CB 4.47Å; V505-L510 HydrophobicContact CG1-CB 3.89Å; V505-L510 PolarHBondContact O-N 2.99Å; Y508-L510 PolarHBondContact O-N 3.28Å; L510-D512 VanDerWaalsContact C-N 3.33Å; L510-D512 PolarHBondContact O-N 3.15Å; L510-V513 WeakPolarHBondContact O-CB 3.22Å; L510-V513 PolarHBondContact O-N 3.11Å; L510-V513 VanDerWaalsContact O-N 3.07Å; L510-F514 HydrophobicContact CB-CD2 4.17Å; L510-F514 PolarHBondContact O-N 3.02Å; L510-F514 VanDerWaalsContact O-N 3.11Å
511	G	97.7	Very high	98.4	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	8%	0.083	C	C	.	.	G	3₁₀ helix	trans	-63.8	-28.3	-171.4	0	0	0	0	0	115.7	Y438 V505 G509	Y438-G511 WeakPolarHBondContact OH-CA 3.43Å; V505-G511 PolarHBondContact O-N 2.89Å; G509-G511 VanDerWaalsContact C-N 3.26Å; G509-G511 PolarHBondContact O-N 3.42Å
512	D	96	Very high	98.4	Very high	79 Å²	79	13.9 Å²	13.9	42%	0.422	9%	0.085	S	C	.	.	G	3₁₀ helix	trans	-79.7	-21.4	174.9	-79.7	-47.1	0	0	0	113.5	K442 G443 Q483 L510	K442-D512 IonicContact NZ-OD1 2.72Å; K442-D512 PolarHBondContact NZ-OD1 2.81Å; G443-D512 WeakPolarHBondContact CA-OD2 3.05Å; Q483-D512 PolarHBondContact NE2-O 3.43Å; L510-D512 VanDerWaalsContact C-N 3.33Å; L510-D512 PolarHBondContact O-N 3.15Å
513	V	97.6	Very high	98.3	Very high	8 Å²	8	17 Å²	17	5%	0.048	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-40.9	177	172.1	0	0	0	0	111.7	L476 L479 L480 N490 L510 P515	L476-V513 HydrophobicContact CD2-CG2 4.21Å; L479-V513 HydrophobicContact CB-CG1 3.76Å; L479-V513 HydrophobicContact CB-CG2 4.46Å; L479-V513 HydrophobicContact CD1-CG1 4.31Å; L479-V513 HydrophobicContact CD2-CG1 3.9Å; L479-V513 HydrophobicContact CG-CG1 4.21Å; L480-V513 HydrophobicContact CD2-CG2 4.02Å; L480-V513 HydrophobicContact CG-CG2 4.49Å; N490-V513 HydrophobicContact CB-CG1 4.44Å; L510-V513 WeakPolarHBondContact O-CB 3.22Å; L510-V513 PolarHBondContact O-N 3.11Å; L510-V513 VanDerWaalsContact O-N 3.07Å; V513-P515 WeakPolarHBondContact O-CD 3.27Å
514	F	98.4	Very high	98.2	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	13%	0.126	C	C	.	.	S	Bend	trans	-108	108	-178.2	-66.2	-82.6	0	0	0	111.1	W319 I325 Y438 L479 N490 L492 L510 I519	W319-F514 HydrophobicContact CB-CZ 4.43Å; W319-F514 HydrophobicContact CG-CZ 4.38Å; I325-F514 HydrophobicContact CD1-CE2 3.91Å; I325-F514 HydrophobicContact CD1-CZ 3.7Å; Y438-F514 PolarHBondContact OH-O 3.15Å; L479-F514 HydrophobicContact CD1-CE2 4.25Å; L479-F514 HydrophobicContact CD2-CE2 3.93Å; L479-F514 HydrophobicContact CD2-CZ 3.6Å; N490-F514 HydrophobicContact CB-CD1 4.08Å; N490-F514 HydrophobicContact CB-CE1 3.66Å; N490-F514 HydrophobicContact CB-CZ 4.22Å; L492-F514 HydrophobicContact CB-CD1 3.75Å; L492-F514 HydrophobicContact CB-CE1 3.69Å; L492-F514 HydrophobicContact CB-CG 4.38Å; L492-F514 HydrophobicContact CB-CZ 4.29Å; L492-F514 HydrophobicContact CD1-CE1 4.21Å; L492-F514 HydrophobicContact CD1-CE2 4.45Å; L492-F514 HydrophobicContact CD1-CZ 3.98Å; L510-F514 HydrophobicContact CB-CD2 4.17Å; L510-F514 PolarHBondContact O-N 3.02Å; L510-F514 VanDerWaalsContact O-N 3.11Å; F514-I519 HydrophobicContact CB-CD1 4.08Å; F514-I519 HydrophobicContact CB-CG1 4.1Å
515	P	97.6	Very high	98.2	Very high	57 Å²	57	24.3 Å²	24.3	37%	0.37	14%	0.138	S	C	.	.			trans	-53	143	159.1	-22.6	33.3	0	0	0	109.9	V513 E517 N518	V513-P515 WeakPolarHBondContact O-CD 3.27Å; P515-E517 PolarHBondContact O-N 2.98Å; P515-N518 HydrophobicContact CB-CB 4.42Å; P515-N518 WeakPolarHBondContact O-CA 3.33Å; P515-N518 WeakPolarHBondContact O-CB 3.34Å; P515-N518 PolarHBondContact O-N 3.37Å
516	I	98.5	Very high	98.1	Very high	2 Å²	2	25.9 Å²	25.9	1%	0.01	15%	0.154	C	C	.	.	G	3₁₀ helix	trans	-63.3	-30.6	-179.2	-174.6	166.4	0	0	0	112.1	I379 K435 Y438 L502 N518 I519	I379-I516 HydrophobicContact CB-CD1 4.29Å; I379-I516 HydrophobicContact CB-CG1 4Å; I379-I516 HydrophobicContact CD1-CD1 3.67Å; I379-I516 HydrophobicContact CD1-CG1 4.33Å; I379-I516 HydrophobicContact CG1-CD1 3.68Å; I379-I516 HydrophobicContact CG1-CG1 3.86Å; I379-I516 HydrophobicContact CG2-CG1 4.15Å; K435-I516 HydrophobicContact CD-CG2 4.43Å; K435-I516 HydrophobicContact CG-CG2 3.98Å; Y438-I516 HydrophobicContact CD1-CB 3.62Å; Y438-I516 HydrophobicContact CD1-CD1 4.35Å; Y438-I516 HydrophobicContact CD1-CG1 4.43Å; Y438-I516 HydrophobicContact CD1-CG2 4.17Å; Y438-I516 HydrophobicContact CD2-CD1 4.37Å; Y438-I516 HydrophobicContact CE1-CB 3.8Å; Y438-I516 HydrophobicContact CG-CB 4.09Å; Y438-I516 HydrophobicContact CG-CD1 3.95Å; Y438-I516 HydrophobicContact CG-CG1 4.42Å; L502-I516 HydrophobicContact CD1-CD1 3.71Å; L502-I516 HydrophobicContact CD1-CG1 4.34Å; L502-I516 HydrophobicContact CD2-CD1 3.77Å; L502-I516 HydrophobicContact CD2-CG1 3.7Å; L502-I516 HydrophobicContact CG-CD1 4.41Å; I516-N518 PolarHBondContact O-N 3.49Å; I516-N518 VanDerWaalsContact O-N 3.13Å; I516-I519 PolarHBondContact O-N 3.05Å; I516-I519 VanDerWaalsContact O-N 3.15Å
517	E	98.3	Very high	98.1	Very high	56 Å²	56	26.2 Å²	26.2	26%	0.262	16%	0.156	S	C	.	.	G	3₁₀ helix	trans	-61.5	-17.5	171	-59.5	86.2	168.3	0	0	112.6	H378 K435 P515 R537	H378-E517 WeakPolarHBondContact NE2-CA 3.26Å; H378-E517 CovalentContact NE2-O 1.76Å; H378-E517 PolarHBondContact NE2-O 2.89Å; K435-E517 WeakPolarHBondContact CE-OE1 3.27Å; K435-E517 IonicContact NZ-OE1 3.9Å; K435-E517 PolarHBondContact NZ-OE1 3.46Å; P515-E517 PolarHBondContact O-N 2.98Å; E517-R537 PolarHBondContact O-NH1 2.84Å
518	N	98.7	Very high	98.1	Very high	6 Å²	6	29.6 Å²	29.6	3%	0.032	17%	0.172	C	C	.	.	G	3₁₀ helix	trans	-102	15.7	179.5	-72.1	9	0	0	0	112.9	M489 N490 V491 L492 P515 I516 R537	M489-N518 VanDerWaalsContact CG-ND2 3.28Å; M489-N518 WeakPolarHBondContact CG-ND2 3.26Å; M489-N518 PolarHBondContact SD-ND2 3.23Å; N490-N518 PolarHBondContact O-ND2 2.66Å; V491-N518 CarbonylContact C-O 3.56Å; V491-N518 WeakPolarHBondContact CA-O 3.16Å; V491-N518 WeakPolarHBondContact CG1-O 3.28Å; V491-N518 HydrophobicContact CG2-CB 4.28Å; L492-N518 PolarHBondContact N-O 2.93Å; P515-N518 HydrophobicContact CB-CB 4.42Å; P515-N518 WeakPolarHBondContact O-CA 3.33Å; P515-N518 WeakPolarHBondContact O-CB 3.34Å; P515-N518 PolarHBondContact O-N 3.37Å; I516-N518 PolarHBondContact O-N 3.49Å; I516-N518 VanDerWaalsContact O-N 3.13Å; N518-R537 PolarHBondContact OD1-NH2 3.49Å
519	I	98.9	Very high	98.1	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	129	177	-60.1	173.1	0	0	0	109.1	H378 Y438 L492 L498 L502 V505 F514 I516	H378-I519 PolarHBondContact CD2-O 3.07Å; Y438-I519 HydrophobicContact CE2-CD1 4.22Å; Y438-I519 WeakPolarHBondContact OH-CD1 3.46Å; L492-I519 HydrophobicContact CB-CG1 4.18Å; L492-I519 HydrophobicContact CD2-CG1 4.35Å; L492-I519 HydrophobicContact CD2-CG2 4.31Å; L498-I519 HydrophobicContact CD1-CG2 3.88Å; L502-I519 HydrophobicContact CD2-CB 4.44Å; L502-I519 HydrophobicContact CD2-CD1 3.58Å; L502-I519 HydrophobicContact CD2-CG2 4.27Å; V505-I519 HydrophobicContact CB-CD1 4.46Å; V505-I519 HydrophobicContact CG1-CD1 4Å; V505-I519 HydrophobicContact CG2-CD1 4.27Å; F514-I519 HydrophobicContact CB-CD1 4.08Å; F514-I519 HydrophobicContact CB-CG1 4.1Å; I516-I519 PolarHBondContact O-N 3.05Å; I516-I519 VanDerWaalsContact O-N 3.15Å
520	Y	98.9	Very high	98.1	Very high	7 Å²	7	29.3 Å²	29.3	3%	0.027	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	130.6	179.9	-63.2	-101	0	0	0	110.4	V377 H378 V491 L492 V493 T494 I534 R537	V377-Y520 HydrophobicContact CG1-CD1 4.48Å; V377-Y520 CarbonylContact O-C 3.24Å; V377-Y520 WeakPolarHBondContact O-CA 3.29Å; H378-Y520 HydrophobicContact CB-CD1 4.23Å; H378-Y520 HydrophobicContact CB-CE1 4.36Å; H378-Y520 AromaticContact CD2-CD1 3.68Å; H378-Y520 AromaticContact CD2-CE1 3.43Å; H378-Y520 VanDerWaalsContact CD2-CE1 3.43Å; H378-Y520 WeakPolarHBondContact CD2-CE1 3.39Å; H378-Y520 AromaticContact CD2-CZ 3.72Å; H378-Y520 AromaticContact NE2-CZ 3.89Å; V491-Y520 HydrophobicContact CG1-CD2 3.76Å; V491-Y520 HydrophobicContact CG1-CE2 3.64Å; L492-Y520 PolarHBondContact O-N 3.25Å; V493-Y520 WeakPolarHBondContact CA-O 3.43Å; T494-Y520 PolarHBondContact N-O 2.69Å; Y520-I534 HydrophobicContact CD1-CG1 4.34Å; Y520-I534 HydrophobicContact CD2-CD1 3.78Å; Y520-I534 HydrophobicContact CD2-CG1 3.98Å; Y520-I534 HydrophobicContact CE1-CG1 3.93Å; Y520-I534 HydrophobicContact CE2-CD1 3.86Å; Y520-I534 HydrophobicContact CE2-CG1 3.55Å; Y520-I534 HydrophobicContact CG-CD1 4.12Å; Y520-I534 HydrophobicContact CG-CG1 4.35Å; Y520-R537 PolarHBondContact OH-NH1 3.25Å
521	S	98.8	Very high	98.2	Very high	1 Å²	1	29.4 Å²	29.4	1%	0.007	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	120.9	168	178.1	0	0	0	0	110.5	V377 T496 T523	V377-S521 WeakPolarHBondContact CG1-O 3.25Å; V377-S521 PolarHBondContact O-N 3.05Å; T496-S521 WeakPolarHBondContact O-CB 3.39Å; T496-S521 PolarHBondContact O-OG 3.13Å; S521-T523 VanDerWaalsContact C-N 3.33Å; S521-T523 PolarHBondContact OG-N 3.08Å; S521-T523 PolarHBondContact OG-OG1 3.07Å
522	A	98.6	Very high	98.2	Very high	4 Å²	4	34.3 Å²	34.3	3%	0.033	19%	0.188	C	C	.	.			trans	-84.1	-2.7	173.3	0	0	0	0	0	113.2	V493 T494 K524 I525 G526 K527	V493-A522 HydrophobicContact CG1-CB 4.34Å; T494-A522 WeakPolarHBondContact O-CB 3.31Å; T494-A522 PolarHBondContact O-N 3.14Å; A522-K524 VanDerWaalsContact C-N 3.26Å; A522-K524 PolarHBondContact O-N 3.3Å; A522-K524 VanDerWaalsContact O-N 3.14Å; A522-I525 PolarHBondContact O-N 3.25Å; A522-G526 WeakPolarHBondContact O-CA 3.31Å; A522-G526 PolarHBondContact O-N 3.45Å; A522-K527 HydrophobicContact CB-CD 3.96Å; A522-K527 HydrophobicContact CB-CG 4.46Å
523	T	97.9	Very high	98.3	Very high	67 Å²	67	35.3 Å²	35.3	41%	0.411	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-37.4	-171	-48.3	0	0	0	0	113.5	T495 T496 Q497 S521	T495-T523 PolarHBondContact O-OG1 3.06Å; T496-T523 PolarHBondContact O-OG1 2.86Å; Q497-T523 HydrophobicContact CG-CG2 4.14Å; Q497-T523 PolarHBondContact N-OG1 3.14Å; Q497-T523 VanDerWaalsContact N-OG1 3.14Å; S521-T523 VanDerWaalsContact C-N 3.33Å; S521-T523 PolarHBondContact OG-N 3.08Å; S521-T523 PolarHBondContact OG-OG1 3.07Å
524	K	96.8	Very high	98.4	Very high	107 Å²	107	35 Å²	35	47%	0.465	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.5	-18.9	-176.1	-64.6	-174	-179.5	-178.6	0	114.8	E373 D375 A522	E373-K524 PolarHBondContact O-NZ 2.92Å; D375-K524 WeakPolarHBondContact O-CD 3.32Å; D375-K524 WeakPolarHBondContact O-CE 3.49Å; D375-K524 PolarHBondContact O-NZ 3.13Å; A522-K524 VanDerWaalsContact C-N 3.26Å; A522-K524 PolarHBondContact O-N 3.3Å; A522-K524 VanDerWaalsContact O-N 3.14Å
525	I	97.6	Very high	98.3	Very high	60 Å²	60	36 Å²	36	31%	0.308	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-130.8	-6.8	-173.9	70.6	168.8	0	0	0	115.7	V377 A522 S529	V377-I525 HydrophobicContact CB-CD1 4.38Å; V377-I525 HydrophobicContact CG1-CD1 3.68Å; V377-I525 HydrophobicContact CG1-CG1 4.23Å; V377-I525 HydrophobicContact CG2-CB 4.45Å; V377-I525 HydrophobicContact CG2-CD1 3.87Å; V377-I525 HydrophobicContact CG2-CG1 3.81Å; V377-I525 HydrophobicContact CG2-CG2 3.9Å; A522-I525 PolarHBondContact O-N 3.25Å; I525-S529 WeakPolarHBondContact O-CB 3.33Å; I525-S529 PolarHBondContact O-OG 3.34Å
526	G	98.3	Very high	98.3	Very high	33 Å²	33	38 Å²	38	34%	0.34	20%	0.204	S	C	.	.	H	α-helix	trans	78.6	160.8	-177.5	0	0	0	0	0	114.8	A522 E528 S529 C530	A522-G526 WeakPolarHBondContact O-CA 3.31Å; A522-G526 PolarHBondContact O-N 3.45Å; G526-E528 VanDerWaalsContact C-N 3.3Å; G526-E528 PolarHBondContact O-N 3.2Å; G526-S529 PolarHBondContact O-N 2.79Å; G526-C530 PolarHBondContact O-N 3.08Å
527	K	98.3	Very high	98.3	Very high	9 Å²	9	42.1 Å²	42.1	4%	0.039	22%	0.219	C	C	.	.	H	α-helix	trans	-57.8	-41.2	-178	-65.7	-66.4	-176.4	82.5	0	112.2	D320 V493 A522 C530 F531 D552 E553 A556	D320-K527 VanDerWaalsContact OD1-CE 3.29Å; D320-K527 WeakPolarHBondContact OD1-CE 3.34Å; D320-K527 IonicContact OD1-NZ 2.79Å; D320-K527 PolarHBondContact OD1-NZ 3.42Å; V493-K527 HydrophobicContact CB-CD 4.47Å; V493-K527 HydrophobicContact CG1-CD 3.83Å; V493-K527 WeakPolarHBondContact O-CE 3.31Å; V493-K527 PolarHBondContact O-NZ 3.43Å; A522-K527 HydrophobicContact CB-CD 3.96Å; A522-K527 HydrophobicContact CB-CG 4.46Å; K527-C530 WeakPolarHBondContact O-CB 3.47Å; K527-C530 PolarHBondContact O-N 3.44Å; K527-F531 VanDerWaalsContact O-CD1 3.25Å; K527-F531 WeakPolarHBondContact O-CD1 3.32Å; K527-F531 WeakPolarHBondContact O-CG 3.33Å; K527-F531 PolarHBondContact O-N 2.76Å; K527-D552 HydrophobicContact CG-CB 4.01Å; K527-E553 HydrophobicContact CD-CB 4.42Å; K527-E553 HydrophobicContact CG-CB 4.27Å; K527-E553 IonicContact NZ-OE1 3.9Å; K527-E553 IonicContact NZ-OE2 3.22Å; K527-E553 PolarHBondContact NZ-OE2 3.16Å; K527-A556 HydrophobicContact CB-CB 4Å
528	E	98.1	Very high	98.2	Very high	71 Å²	71	40.7 Å²	40.7	33%	0.332	21%	0.212	S	C	.	.	H	α-helix	trans	-59.9	-49.5	-177.8	-170.8	174.4	-177.2	0	0	112.8	G526 C530 F531 E532 A556 Q559 H560	G526-E528 VanDerWaalsContact C-N 3.3Å; G526-E528 PolarHBondContact O-N 3.2Å; E528-C530 VanDerWaalsContact C-N 3.34Å; E528-C530 PolarHBondContact O-N 3.2Å; E528-F531 WeakPolarHBondContact O-CB 3.27Å; E528-F531 PolarHBondContact O-N 3.1Å; E528-F531 VanDerWaalsContact O-N 3.15Å; E528-E532 PolarHBondContact O-N 3.39Å; E528-A556 HydrophobicContact CB-CB 3.94Å; E528-Q559 WeakPolarHBondContact OE1-CG 3.5Å; E528-H560 WeakPolarHBondContact CA-NE2 3.12Å; E528-H560 WeakPolarHBondContact CG-NE2 3.38Å; E528-H560 PolarHBondContact O-NE2 3Å
529	S	98.6	Very high	98.1	Very high	48 Å²	48	41.7 Å²	41.7	34%	0.336	22%	0.224	S	C	.	.	H	α-helix	trans	-70.3	-29	178.3	-54.7	0	0	0	0	113	I525 G526 R533	I525-S529 WeakPolarHBondContact O-CB 3.33Å; I525-S529 PolarHBondContact O-OG 3.34Å; G526-S529 PolarHBondContact O-N 2.79Å; S529-R533 PolarHBondContact O-N 3.12Å; S529-R533 VanDerWaalsContact O-N 3.16Å
530	C	98.8	Very high	97.9	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-64.4	-44.5	167.3	-73.7	0	0	0	0	111.3	V493 G526 K527 E528 E532 R533 I534	V493-C530 HydrophobicContact CG1-CB 3.52Å; G526-C530 PolarHBondContact O-N 3.08Å; K527-C530 WeakPolarHBondContact O-CB 3.47Å; K527-C530 PolarHBondContact O-N 3.44Å; E528-C530 VanDerWaalsContact C-N 3.34Å; E528-C530 PolarHBondContact O-N 3.2Å; C530-E532 VanDerWaalsContact C-N 3.34Å; C530-E532 PolarHBondContact O-N 3.03Å; C530-R533 WeakPolarHBondContact O-CB 3.48Å; C530-R533 PolarHBondContact O-N 3.04Å; C530-I534 VanDerWaalsContact O-CD1 3.31Å; C530-I534 WeakPolarHBondContact O-CD1 3.39Å; C530-I534 WeakPolarHBondContact O-CG1 3.41Å; C530-I534 PolarHBondContact O-N 2.89Å
531	F	98.7	Very high	97.7	Very high	2 Å²	2	60.6 Å²	60.6	1%	0.009	31%	0.306	C	S	.	.	H	α-helix	trans	-62.5	-40.6	177.2	-66.5	1.5	0	0	0	111.1	L318 V493 K527 E528 R533 I534 I535 V546 E553 A556 M562	L318-F531 HydrophobicContact CB-CE1 4.18Å; L318-F531 HydrophobicContact CB-CZ 4.42Å; L318-F531 HydrophobicContact CD1-CD1 3.72Å; L318-F531 HydrophobicContact CD1-CD2 4.29Å; L318-F531 HydrophobicContact CD1-CE1 3.94Å; L318-F531 HydrophobicContact CD1-CE2 4.49Å; L318-F531 HydrophobicContact CD1-CG 3.92Å; L318-F531 HydrophobicContact CD1-CZ 4.33Å; V493-F531 HydrophobicContact CB-CE1 4.09Å; V493-F531 HydrophobicContact CG1-CD1 4.43Å; V493-F531 HydrophobicContact CG1-CE1 4.09Å; V493-F531 HydrophobicContact CG2-CD1 4.32Å; V493-F531 HydrophobicContact CG2-CE1 3.99Å; K527-F531 VanDerWaalsContact O-CD1 3.25Å; K527-F531 WeakPolarHBondContact O-CD1 3.32Å; K527-F531 WeakPolarHBondContact O-CG 3.33Å; K527-F531 PolarHBondContact O-N 2.76Å; E528-F531 WeakPolarHBondContact O-CB 3.27Å; E528-F531 PolarHBondContact O-N 3.1Å; E528-F531 VanDerWaalsContact O-N 3.15Å; F531-R533 PolarHBondContact O-N 2.93Å; F531-I534 HydrophobicContact CD1-CD1 4.47Å; F531-I534 PolarHBondContact O-N 3.21Å; F531-I535 WeakPolarHBondContact O-CD1 3.46Å; F531-I535 WeakPolarHBondContact O-CG1 3.46Å; F531-I535 PolarHBondContact O-N 3.01Å; F531-V546 HydrophobicContact CD2-CG2 4.42Å; F531-V546 HydrophobicContact CE2-CB 4.48Å; F531-V546 HydrophobicContact CE2-CG1 3.83Å; F531-V546 HydrophobicContact CE2-CG2 3.76Å; F531-V546 HydrophobicContact CZ-CG1 3.63Å; F531-V546 HydrophobicContact CZ-CG2 4.12Å; F531-E553 HydrophobicContact CZ-CB 4.01Å; F531-A556 HydrophobicContact CD2-CB 3.56Å; F531-A556 HydrophobicContact CE2-CB 3.55Å; F531-A556 HydrophobicContact CG-CB 4.45Å; F531-A556 HydrophobicContact CZ-CB 4.44Å; F531-M562 HydrophobicContact CD2-SD 4.3Å
532	E	98.4	Very high	97.5	Very high	104 Å²	104	61.3 Å²	61.3	49%	0.486	31%	0.31	S	S	.	.	H	α-helix	trans	-58.6	-43.7	173.2	-70.7	-158.6	133.6	0	0	113.5	E528 C530 I534 S536 H560	E528-E532 PolarHBondContact O-N 3.39Å; C530-E532 VanDerWaalsContact C-N 3.34Å; C530-E532 PolarHBondContact O-N 3.03Å; E532-I534 VanDerWaalsContact C-N 3.34Å; E532-I534 PolarHBondContact O-N 3.2Å; E532-S536 WeakPolarHBondContact O-CB 3.29Å; E532-S536 PolarHBondContact O-N 3.41Å; E532-S536 PolarHBondContact O-OG 2.96Å; E532-H560 WeakPolarHBondContact CG-CE1 3.39Å; E532-H560 WeakPolarHBondContact CG-NE2 3.28Å; E532-H560 IonicContact OE1-CE1 3.75Å; E532-H560 PolarHBondContact OE1-CE1 2.85Å
533	R	98.4	Very high	97.5	Very high	100 Å²	100	64.3 Å²	64.3	38%	0.377	33%	0.329	S	S	.	.	H	α-helix	trans	-60.3	-43.5	174	-78.3	175.6	153.7	-137.9	-11	111.5	V377 D381 S529 C530 F531 S536 R537	V377-R533 VanDerWaalsContact CG1-NH1 3.35Å; D381-R533 VanDerWaalsContact CG-NH1 3.28Å; D381-R533 IonicContact OD1-CZ 3.33Å; D381-R533 IonicContact OD1-NH1 3.5Å; D381-R533 PolarHBondContact OD1-NH1 2.76Å; D381-R533 IonicContact OD1-NH2 3.36Å; D381-R533 PolarHBondContact OD1-NH2 3.01Å; D381-R533 IonicContact OD2-CZ 2.68Å; D381-R533 IonicContact OD2-NH1 3.21Å; D381-R533 PolarHBondContact OD2-NH1 2.69Å; D381-R533 IonicContact OD2-NH2 2.73Å; S529-R533 PolarHBondContact O-N 3.12Å; S529-R533 VanDerWaalsContact O-N 3.16Å; C530-R533 WeakPolarHBondContact O-CB 3.48Å; C530-R533 PolarHBondContact O-N 3.04Å; F531-R533 PolarHBondContact O-N 2.93Å; R533-S536 WeakPolarHBondContact O-CB 3.27Å; R533-S536 PolarHBondContact O-N 3.38Å; R533-R537 PolarHBondContact O-N 3.43Å
534	I	98.6	Very high	97.5	Very high	0 Å²	0	61.9 Å²	61.9	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-67.9	-43.6	-179.1	-67.9	160.1	0	0	0	111.6	L318 V491 V493 Y520 C530 F531 E532 S536 R537 F538 Y544	L318-I534 HydrophobicContact CD2-CD1 4.33Å; L318-I534 HydrophobicContact CD2-CG2 3.73Å; V491-I534 HydrophobicContact CG1-CD1 3.82Å; V491-I534 HydrophobicContact CG1-CG1 4.29Å; V493-I534 HydrophobicContact CG2-CD1 3.48Å; V493-I534 VanDerWaalsContact CG2-CD1 3.48Å; Y520-I534 HydrophobicContact CD1-CG1 4.34Å; Y520-I534 HydrophobicContact CD2-CD1 3.78Å; Y520-I534 HydrophobicContact CD2-CG1 3.98Å; Y520-I534 HydrophobicContact CE1-CG1 3.93Å; Y520-I534 HydrophobicContact CE2-CD1 3.86Å; Y520-I534 HydrophobicContact CE2-CG1 3.55Å; Y520-I534 HydrophobicContact CG-CD1 4.12Å; Y520-I534 HydrophobicContact CG-CG1 4.35Å; C530-I534 VanDerWaalsContact O-CD1 3.31Å; C530-I534 WeakPolarHBondContact O-CD1 3.39Å; C530-I534 WeakPolarHBondContact O-CG1 3.41Å; C530-I534 PolarHBondContact O-N 2.89Å; F531-I534 HydrophobicContact CD1-CD1 4.47Å; F531-I534 PolarHBondContact O-N 3.21Å; E532-I534 VanDerWaalsContact C-N 3.34Å; E532-I534 PolarHBondContact O-N 3.2Å; I534-S536 VanDerWaalsContact C-N 3.27Å; I534-S536 PolarHBondContact O-N 3.26Å; I534-R537 PolarHBondContact O-N 3.32Å; I534-F538 HydrophobicContact CG2-CD2 3.76Å; I534-F538 HydrophobicContact CG2-CE2 3.95Å; I534-F538 WeakPolarHBondContact O-CD2 3.47Å; I534-F538 PolarHBondContact O-N 3.26Å; I534-Y544 HydrophobicContact CG2-CE1 4.11Å
535	I	98.1	Very high	97.6	Very high	22 Å²	22	57 Å²	57	11%	0.113	29%	0.291	C	S	.	.	H	α-helix	trans	-60.1	-39.3	172.5	-63.5	159.3	0	0	0	110.7	F531 R537 G539 K540 Y544 H560 M562	F531-I535 WeakPolarHBondContact O-CD1 3.46Å; F531-I535 WeakPolarHBondContact O-CG1 3.46Å; F531-I535 PolarHBondContact O-N 3.01Å; I535-R537 VanDerWaalsContact C-N 3.33Å; I535-G539 WeakPolarHBondContact O-CA 3.23Å; I535-G539 PolarHBondContact O-N 2.96Å; I535-K540 HydrophobicContact CG2-CG 3.72Å; I535-Y544 HydrophobicContact CG1-CE2 4.32Å; I535-H560 HydrophobicContact CD1-CB 4.21Å; I535-M562 HydrophobicContact CD1-CE 3.44Å; I535-M562 VanDerWaalsContact CD1-CE 3.44Å; I535-M562 HydrophobicContact CG1-CE 3.52Å
536	S	97.6	Very high	97.6	Very high	99 Å²	99	54.1 Å²	54.1	69%	0.692	28%	0.276	S	S	*	.	H	α-helix	trans	-68.9	-30.7	179.2	-59.9	0	0	0	0	112.6	E532 R533 I534	E532-S536 WeakPolarHBondContact O-CB 3.29Å; E532-S536 PolarHBondContact O-N 3.41Å; E532-S536 PolarHBondContact O-OG 2.96Å; R533-S536 WeakPolarHBondContact O-CB 3.27Å; R533-S536 PolarHBondContact O-N 3.38Å; I534-S536 VanDerWaalsContact C-N 3.27Å; I534-S536 PolarHBondContact O-N 3.26Å
537	R	97.1	Very high	97.7	Very high	89 Å²	89	52.6 Å²	52.6	34%	0.336	26%	0.26	S	S	.	.	H	α-helix	trans	-80.1	-47.5	178.2	176	173.1	161.1	-152.8	-9.8	113.7	H378 E517 N518 Y520 R533 I534 I535	H378-R537 PolarHBondContact NE2-NH1 3.35Å; E517-R537 PolarHBondContact O-NH1 2.84Å; N518-R537 PolarHBondContact OD1-NH2 3.49Å; Y520-R537 PolarHBondContact OH-NH1 3.25Å; R533-R537 PolarHBondContact O-N 3.43Å; I534-R537 PolarHBondContact O-N 3.32Å; I535-R537 VanDerWaalsContact C-N 3.33Å
538	F	96.5	Very high	97.7	Very high	25 Å²	25	52.1 Å²	52.1	11%	0.11	26%	0.258	C	S	.	.	H	α-helix	trans	-94.9	-16.3	-175.7	-56.5	-62.3	0	0	0	113.5	L313 V316 M489 V491 I534 V542	L313-F538 HydrophobicContact CD1-CD1 4.11Å; V316-F538 HydrophobicContact CG2-CD2 4.28Å; V316-F538 HydrophobicContact CG2-CG 4.39Å; M489-F538 HydrophobicContact CE-CD1 3.57Å; M489-F538 HydrophobicContact CE-CE1 3.2Å; M489-F538 HydrophobicContact CE-CE2 4.25Å; M489-F538 HydrophobicContact CE-CG 4.23Å; M489-F538 HydrophobicContact CE-CZ 3.57Å; M489-F538 HydrophobicContact SD-CE1 4.1Å; M489-F538 HydrophobicContact SD-CZ 4.13Å; V491-F538 HydrophobicContact CG2-CE2 3.89Å; V491-F538 HydrophobicContact CG2-CZ 4.34Å; I534-F538 HydrophobicContact CG2-CD2 3.76Å; I534-F538 HydrophobicContact CG2-CE2 3.95Å; I534-F538 WeakPolarHBondContact O-CD2 3.47Å; I534-F538 PolarHBondContact O-N 3.26Å; F538-V542 HydrophobicContact CB-CG2 4.38Å; F538-V542 WeakPolarHBondContact O-CG2 3.41Å
539	G	96.2	Very high	97.7	Very high	27 Å²	27	51.6 Å²	51.6	28%	0.278	26%	0.258	S	S	.	.			trans	93.2	149	169.4	0	0	0	0	0	114.6	I535 K541 V542 Y544	I535-G539 WeakPolarHBondContact O-CA 3.23Å; I535-G539 PolarHBondContact O-N 2.96Å; G539-K541 PolarHBondContact O-N 2.96Å; G539-V542 PolarHBondContact O-N 3.32Å; G539-Y544 PolarHBondContact N-OH 2.93Å; G539-Y544 PolarHBondContact O-OH 3.44Å
540	K	94.8	Very high	97.6	Very high	193 Å²	193	50.1 Å²	50.1	84%	0.839	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.2	11.5	-173.8	-57.5	-172.1	178	-167.9	0	115.7	I535	I535-K540 HydrophobicContact CG2-CG 3.72Å
541	K	94.3	Very high	97.5	Very high	212 Å²	212	59.5 Å²	59.5	92%	0.922	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.6	-19.4	174.1	-70	-173.2	177.4	-176.9	0	113	G539	G539-K541 PolarHBondContact O-N 2.96Å
542	V	96.4	Very high	97.5	Very high	15 Å²	15	64.1 Å²	64.1	9%	0.091	31%	0.31	C	S	.	.	S	Bend	trans	-73.9	142.4	178.1	-179.2	0	0	0	0	109.3	L313 V316 F538 G539 Y544	L313-V542 HydrophobicContact CB-CG2 4.2Å; V316-V542 HydrophobicContact CB-CG1 3.96Å; V316-V542 HydrophobicContact CG2-CG1 3.71Å; F538-V542 HydrophobicContact CB-CG2 4.38Å; F538-V542 WeakPolarHBondContact O-CG2 3.41Å; G539-V542 PolarHBondContact O-N 3.32Å; V542-Y544 HydrophobicContact CB-CE2 3.92Å; V542-Y544 HydrophobicContact CG1-CE1 4.46Å; V542-Y544 HydrophobicContact CG1-CE2 4.41Å; V542-Y544 WeakPolarHBondContact O-CD2 3.45Å; V542-Y544 WeakPolarHBondContact O-CE2 3.46Å
543	T	96.8	Very high	97.4	Very high	68 Å²	68	59.6 Å²	59.6	42%	0.417	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	125.1	169.5	-56.9	0	0	0	0	109.2	E314 R315 V316	E314-T543 WeakPolarHBondContact O-CB 3.46Å; E314-T543 PolarHBondContact O-N 3.02Å; E314-T543 PolarHBondContact O-OG1 2.95Å; R315-T543 CarbonylContact C-O 3.57Å; R315-T543 VanDerWaalsContact CA-O 3.23Å; R315-T543 WeakPolarHBondContact CA-O 3.22Å; R315-T543 HydrophobicContact CG-CG2 4.36Å; R315-T543 WeakPolarHBondContact CG-O 3.4Å; V316-T543 PolarHBondContact N-O 3.41Å
544	Y	98.6	Very high	97.4	Very high	15 Å²	15	56.7 Å²	56.7	6%	0.059	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	128	176.9	-61.2	-92.1	0	0	0	109.8	V316 L318 I534 I535 G539 V542 M562 P563	V316-Y544 HydrophobicContact CB-CD1 3.89Å; V316-Y544 HydrophobicContact CB-CE1 4.01Å; V316-Y544 HydrophobicContact CG1-CD1 3.9Å; V316-Y544 HydrophobicContact CG1-CE1 4.06Å; V316-Y544 WeakPolarHBondContact O-CA 3.27Å; L318-Y544 HydrophobicContact CD1-CD1 4.28Å; L318-Y544 HydrophobicContact CD2-CD1 4.42Å; L318-Y544 HydrophobicContact CG-CD1 4.48Å; I534-Y544 HydrophobicContact CG2-CE1 4.11Å; I535-Y544 HydrophobicContact CG1-CE2 4.32Å; G539-Y544 PolarHBondContact N-OH 2.93Å; G539-Y544 PolarHBondContact O-OH 3.44Å; V542-Y544 HydrophobicContact CB-CE2 3.92Å; V542-Y544 HydrophobicContact CG1-CE1 4.46Å; V542-Y544 HydrophobicContact CG1-CE2 4.41Å; V542-Y544 WeakPolarHBondContact O-CD2 3.45Å; V542-Y544 WeakPolarHBondContact O-CE2 3.46Å; Y544-M562 VanDerWaalsContact CB-SD 3.57Å; Y544-M562 HydrophobicContact CD1-CE 4.21Å; Y544-M562 HydrophobicContact CD2-CE 3.94Å; Y544-M562 HydrophobicContact CG-CE 3.63Å; Y544-M562 HydrophobicContact CG-SD 4.31Å; Y544-P563 VanDerWaalsContact O-CD 3.28Å; Y544-P563 WeakPolarHBondContact O-CD 3.24Å; Y544-P563 WeakPolarHBondContact O-CG 3.23Å
545	V	98.6	Very high	97.4	Very high	5 Å²	5	61.9 Å²	61.9	3%	0.03	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	124.1	174	-177.1	0	0	0	0	107.8	R315 V316 F317 L318 I547 P563 L585	R315-V545 HydrophobicContact CG-CG2 4.14Å; V316-V545 PolarHBondContact O-N 3.41Å; F317-V545 CarbonylContact C-O 3.56Å; F317-V545 WeakPolarHBondContact CA-O 3.44Å; F317-V545 HydrophobicContact CD1-CB 3.84Å; F317-V545 HydrophobicContact CD1-CG1 4.2Å; F317-V545 HydrophobicContact CD1-CG2 4.42Å; F317-V545 HydrophobicContact CE1-CB 4.1Å; F317-V545 HydrophobicContact CE1-CG1 4.37Å; F317-V545 HydrophobicContact CE1-CG2 4.23Å; L318-V545 PolarHBondContact N-O 3.32Å; V545-I547 HydrophobicContact CG1-CG1 4.41Å; V545-P563 HydrophobicContact CG2-CG 4.16Å; V545-L585 HydrophobicContact CG1-CD2 4.47Å
546	V	98.9	Very high	97.4	Very high	0 Å²	0	60.9 Å²	60.9	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	132.3	-179.2	-175.1	0	0	0	0	109.3	L318 F531 E553 A557 M562 P563 F564 W565	L318-V546 HydrophobicContact CB-CG2 4.2Å; L318-V546 HydrophobicContact CD1-CG2 4.16Å; L318-V546 HydrophobicContact CG-CG2 4.48Å; L318-V546 CarbonylContact O-C 3.57Å; L318-V546 WeakPolarHBondContact O-CA 3.36Å; F531-V546 HydrophobicContact CD2-CG2 4.42Å; F531-V546 HydrophobicContact CE2-CB 4.48Å; F531-V546 HydrophobicContact CE2-CG1 3.83Å; F531-V546 HydrophobicContact CE2-CG2 3.76Å; F531-V546 HydrophobicContact CZ-CG1 3.63Å; F531-V546 HydrophobicContact CZ-CG2 4.12Å; V546-E553 HydrophobicContact CG1-CB 3.99Å; V546-A557 HydrophobicContact CB-CB 3.92Å; V546-A557 HydrophobicContact CG1-CB 4.24Å; V546-A557 HydrophobicContact CG2-CB 3.75Å; V546-M562 HydrophobicContact CG2-CB 3.92Å; V546-M562 HydrophobicContact CG2-CG 4.46Å; V546-M562 HydrophobicContact CG2-SD 3.67Å; V546-P563 PolarHBondContact N-O 2.84Å; V546-F564 HydrophobicContact CB-CD2 3.91Å; V546-F564 HydrophobicContact CG1-CD2 3.71Å; V546-F564 HydrophobicContact CG1-CE2 4.02Å; V546-F564 CarbonylContact O-C 3.53Å; V546-F564 WeakPolarHBondContact O-CA 3.45Å; V546-W565 PolarHBondContact O-N 3.15Å
547	I	98.9	Very high	97.5	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	122.8	-177.5	-56.9	162.1	0	0	0	108.3	F317 L318 W319 D320 T324 V545 W565 I567 L576	F317-I547 HydrophobicContact CB-CD1 4.4Å; F317-I547 HydrophobicContact CD1-CD1 3.9Å; L318-I547 PolarHBondContact O-N 2.98Å; W319-I547 CarbonylContact C-O 3.51Å; W319-I547 WeakPolarHBondContact CA-O 2.88Å; W319-I547 HydrophobicContact CD2-CB 4.17Å; W319-I547 HydrophobicContact CD2-CD1 3.85Å; W319-I547 HydrophobicContact CD2-CG2 4.32Å; W319-I547 HydrophobicContact CE3-CB 3.98Å; W319-I547 HydrophobicContact CE3-CD1 4.16Å; W319-I547 HydrophobicContact CE3-CG2 3.65Å; W319-I547 HydrophobicContact CH2-CD1 4.01Å; W319-I547 HydrophobicContact CH2-CG2 4.42Å; W319-I547 HydrophobicContact CZ2-CD1 3.65Å; W319-I547 HydrophobicContact CZ3-CB 4.43Å; W319-I547 HydrophobicContact CZ3-CD1 4.24Å; W319-I547 HydrophobicContact CZ3-CG2 3.71Å; D320-I547 PolarHBondContact N-O 3.22Å; T324-I547 HydrophobicContact CG2-CG2 4.19Å; V545-I547 HydrophobicContact CG1-CG1 4.41Å; I547-W565 WeakPolarHBondContact CA-O 3.37Å; I547-W565 HydrophobicContact CG1-CB 4.24Å; I547-I567 HydrophobicContact CG2-CD1 4.23Å; I547-I567 HydrophobicContact CG2-CG1 3.74Å; I547-L576 HydrophobicContact CD1-CD1 4.19Å; I547-L576 HydrophobicContact CD1-CD2 4Å; I547-L576 HydrophobicContact CG2-CD2 3.98Å
548	G	98.8	Very high	97.5	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-173.9	165.6	-179.4	0	0	0	0	0	113.1	T324 F564 W565 R566 I567	T324-G548 WeakPolarHBondContact OG1-CA 3.36Å; G548-F564 VanDerWaalsContact O-CZ 3.26Å; G548-F564 WeakPolarHBondContact O-CZ 3.31Å; G548-W565 PolarHBondContact N-O 3.32Å; G548-R566 CarbonylContact O-C 3.52Å; G548-R566 VanDerWaalsContact O-CA 3.3Å; G548-R566 WeakPolarHBondContact O-CA 3.37Å; G548-I567 PolarHBondContact O-N 3.47Å
549	D	98.4	Very high	97.6	Very high	59 Å²	59	61.1 Å²	61.1	32%	0.316	29%	0.29	S	S	.	.	S	Bend	trans	-90.7	-33.4	169.1	81.7	-59.8	0	0	0	111.9	T324 R566 I567	T324-D549 PolarHBondContact OG1-N 2.97Å; T324-D549 PolarHBondContact OG1-OD1 3.26Å; D549-R566 VanDerWaalsContact O-CZ 3.28Å; D549-R566 PolarHBondContact O-NE 2.94Å; D549-R566 PolarHBondContact O-NH2 3.3Å; D549-I567 WeakPolarHBondContact CA-O 3.3Å; D549-I567 WeakPolarHBondContact CB-O 3.42Å
550	G	96.3	Very high	97.6	Very high	17 Å²	17	62.2 Å²	62.2	18%	0.175	29%	0.287	C	S	.	.	S	Bend	trans	-68.1	166.6	-168.5	0	0	0	0	0	115.2	E553 R566	G550-E553 VanDerWaalsContact CA-OE1 3.25Å; G550-E553 WeakPolarHBondContact CA-OE1 3.11Å; G550-E553 PolarHBondContact N-OE1 3.29Å; G550-R566 PolarHBondContact O-NH2 3.11Å
551	R	97.2	Very high	97.7	Very high	198 Å²	198	60.1 Å²	60.1	75%	0.747	29%	0.286	S	S	*	.	H	α-helix	trans	-86.1	-22.3	178.7	-66.9	-178.1	-62.4	163.8	3.8	113	F555	R551-F555 VanDerWaalsContact O-CB 3.27Å; R551-F555 WeakPolarHBondContact O-CB 3.3Å; R551-F555 PolarHBondContact O-N 3.24Å
552	D	97.6	Very high	97.9	Very high	99 Å²	99	51 Å²	51	53%	0.529	25%	0.247	S	C	.	.	H	α-helix	trans	-79.3	-41.8	-169.4	-63.3	2.3	0	0	0	110.6	K527 F555 A556	K527-D552 HydrophobicContact CG-CB 4.01Å; D552-F555 PolarHBondContact O-N 3.41Å; D552-A556 VanDerWaalsContact O-CB 3.3Å; D552-A556 WeakPolarHBondContact O-CB 3.28Å; D552-A556 PolarHBondContact O-N 3.24Å
553	E	98.1	Very high	98	Very high	8 Å²	8	53.8 Å²	53.8	4%	0.037	27%	0.265	C	S	.	.	H	α-helix	trans	-69.7	-34.5	169.5	58.1	-89.3	-148.5	0	0	112.5	K527 F531 V546 G550 F555 A556 A557 F564	K527-E553 HydrophobicContact CD-CB 4.42Å; K527-E553 HydrophobicContact CG-CB 4.27Å; K527-E553 IonicContact NZ-OE1 3.9Å; K527-E553 IonicContact NZ-OE2 3.22Å; K527-E553 PolarHBondContact NZ-OE2 3.16Å; F531-E553 HydrophobicContact CZ-CB 4.01Å; V546-E553 HydrophobicContact CG1-CB 3.99Å; G550-E553 VanDerWaalsContact CA-OE1 3.25Å; G550-E553 WeakPolarHBondContact CA-OE1 3.11Å; G550-E553 PolarHBondContact N-OE1 3.29Å; E553-F555 VanDerWaalsContact C-N 3.35Å; E553-A556 PolarHBondContact O-N 3.21Å; E553-A557 WeakPolarHBondContact O-CB 3.27Å; E553-A557 PolarHBondContact O-N 3.03Å; E553-F564 HydrophobicContact CB-CE2 4.4Å; E553-F564 HydrophobicContact CG-CE2 3.68Å; E553-F564 HydrophobicContact CG-CZ 4.2Å
554	E	98.5	Very high	98.1	Very high	39 Å²	39	52.8 Å²	52.8	18%	0.182	26%	0.255	C	S	.	.	H	α-helix	trans	-64.1	-41.7	172.7	-178.3	-176.8	-175.6	0	0	111.2	K558 F564 R566	E554-K558 VanDerWaalsContact CD-NZ 3.29Å; E554-K558 HydrophobicContact CG-CD 4.34Å; E554-K558 WeakPolarHBondContact O-CD 3.32Å; E554-K558 VanDerWaalsContact O-CG 3.28Å; E554-K558 WeakPolarHBondContact O-CG 3.34Å; E554-K558 PolarHBondContact O-N 2.9Å; E554-K558 VanDerWaalsContact O-N 3.15Å; E554-K558 WeakPolarHBondContact OE1-CE 3.37Å; E554-K558 IonicContact OE1-NZ 2.75Å; E554-K558 PolarHBondContact OE1-NZ 3.22Å; E554-F564 HydrophobicContact CB-CD1 3.92Å; E554-F564 HydrophobicContact CB-CD2 4.3Å; E554-F564 HydrophobicContact CB-CE1 3.63Å; E554-F564 HydrophobicContact CB-CE2 4.07Å; E554-F564 HydrophobicContact CB-CG 4.24Å; E554-F564 HydrophobicContact CB-CZ 3.72Å; E554-F564 HydrophobicContact CG-CD1 3.69Å; E554-F564 HydrophobicContact CG-CE1 3.78Å; E554-F564 HydrophobicContact CG-CG 4.19Å; E554-F564 HydrophobicContact CG-CZ 4.38Å; E554-R566 IonicContact OE1-NH1 2.64Å; E554-R566 IonicContact OE2-CZ 3.46Å; E554-R566 IonicContact OE2-NH1 3.26Å; E554-R566 PolarHBondContact OE2-NH1 3.41Å; E554-R566 IonicContact OE2-NH2 3.5Å; E554-R566 PolarHBondContact OE2-NH2 3.36Å
555	F	98.3	Very high	98.1	Very high	110 Å²	110	55.5 Å²	55.5	48%	0.482	27%	0.265	S	S	.	.	H	α-helix	trans	-65.1	-50	175.3	178.3	-92.6	0	0	0	110.9	R551 D552 E553 A557 K558 Q559	R551-F555 VanDerWaalsContact O-CB 3.27Å; R551-F555 WeakPolarHBondContact O-CB 3.3Å; R551-F555 PolarHBondContact O-N 3.24Å; D552-F555 PolarHBondContact O-N 3.41Å; E553-F555 VanDerWaalsContact C-N 3.35Å; F555-A557 VanDerWaalsContact C-N 3.34Å; F555-A557 PolarHBondContact O-N 3.09Å; F555-K558 WeakPolarHBondContact O-CB 3.41Å; F555-K558 PolarHBondContact O-N 3.14Å; F555-K558 VanDerWaalsContact O-N 3.11Å; F555-Q559 HydrophobicContact CD1-CG 4.21Å; F555-Q559 HydrophobicContact CE1-CG 3.87Å; F555-Q559 VanDerWaalsContact CE2-NE2 3.33Å; F555-Q559 HydrophobicContact CZ-CG 4.21Å; F555-Q559 WeakPolarHBondContact O-CG 3.46Å; F555-Q559 PolarHBondContact O-N 3.44Å
556	A	98.3	Very high	98.1	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-60.2	-40.1	177.6	0	0	0	0	0	112.8	K527 E528 F531 D552 E553 K558 Q559 H560	K527-A556 HydrophobicContact CB-CB 4Å; E528-A556 HydrophobicContact CB-CB 3.94Å; F531-A556 HydrophobicContact CD2-CB 3.56Å; F531-A556 HydrophobicContact CE2-CB 3.55Å; F531-A556 HydrophobicContact CG-CB 4.45Å; F531-A556 HydrophobicContact CZ-CB 4.44Å; D552-A556 VanDerWaalsContact O-CB 3.3Å; D552-A556 WeakPolarHBondContact O-CB 3.28Å; D552-A556 PolarHBondContact O-N 3.24Å; E553-A556 PolarHBondContact O-N 3.21Å; A556-K558 VanDerWaalsContact C-N 3.33Å; A556-K558 PolarHBondContact O-N 3.11Å; A556-Q559 PolarHBondContact O-N 2.94Å; A556-H560 PolarHBondContact O-CD2 3.38Å; A556-H560 VanDerWaalsContact O-CD2 3.23Å; A556-H560 PolarHBondContact O-N 3.18Å
557	A	98.5	Very high	98.1	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-59.1	-44.6	173.8	0	0	0	0	0	111.2	V546 E553 F555 H560 N561 M562 F564	V546-A557 HydrophobicContact CB-CB 3.92Å; V546-A557 HydrophobicContact CG1-CB 4.24Å; V546-A557 HydrophobicContact CG2-CB 3.75Å; E553-A557 WeakPolarHBondContact O-CB 3.27Å; E553-A557 PolarHBondContact O-N 3.03Å; F555-A557 VanDerWaalsContact C-N 3.34Å; F555-A557 PolarHBondContact O-N 3.09Å; A557-H560 CarbonylContact O-C 3.58Å; A557-H560 PolarHBondContact O-N 2.79Å; A557-N561 PolarHBondContact O-N 3.2Å; A557-M562 HydrophobicContact CB-CB 4.21Å; A557-M562 PolarHBondContact O-N 3.12Å; A557-F564 HydrophobicContact CB-CB 4.01Å; A557-F564 HydrophobicContact CB-CD2 4.23Å; A557-F564 HydrophobicContact CB-CG 4.49Å
558	K	98.1	Very high	97.9	Very high	124 Å²	124	61.2 Å²	61.2	54%	0.539	29%	0.293	S	S	.	.	H	α-helix	trans	-65	-40	178.1	-72.2	167.2	-172.3	173.2	0	112.9	E554 F555 A556 H560 N561	E554-K558 VanDerWaalsContact CD-NZ 3.29Å; E554-K558 HydrophobicContact CG-CD 4.34Å; E554-K558 WeakPolarHBondContact O-CD 3.32Å; E554-K558 VanDerWaalsContact O-CG 3.28Å; E554-K558 WeakPolarHBondContact O-CG 3.34Å; E554-K558 PolarHBondContact O-N 2.9Å; E554-K558 VanDerWaalsContact O-N 3.15Å; E554-K558 WeakPolarHBondContact OE1-CE 3.37Å; E554-K558 IonicContact OE1-NZ 2.75Å; E554-K558 PolarHBondContact OE1-NZ 3.22Å; F555-K558 WeakPolarHBondContact O-CB 3.41Å; F555-K558 PolarHBondContact O-N 3.14Å; F555-K558 VanDerWaalsContact O-N 3.11Å; A556-K558 VanDerWaalsContact C-N 3.33Å; A556-K558 PolarHBondContact O-N 3.11Å; K558-H560 VanDerWaalsContact C-N 3.28Å; K558-H560 PolarHBondContact O-N 3.39Å; K558-N561 PolarHBondContact O-N 3.34Å
559	Q	97.7	Very high	97.8	Very high	95 Å²	95	63.9 Å²	63.9	44%	0.444	31%	0.309	S	S	.	.	H	α-helix	trans	-61.3	-38.2	176.2	-61.7	-57.1	-15.1	0	0	112	E528 F555 A556	E528-Q559 WeakPolarHBondContact OE1-CG 3.5Å; F555-Q559 HydrophobicContact CD1-CG 4.21Å; F555-Q559 HydrophobicContact CE1-CG 3.87Å; F555-Q559 VanDerWaalsContact CE2-NE2 3.33Å; F555-Q559 HydrophobicContact CZ-CG 4.21Å; F555-Q559 WeakPolarHBondContact O-CG 3.46Å; F555-Q559 PolarHBondContact O-N 3.44Å; A556-Q559 PolarHBondContact O-N 2.94Å
560	H	96.9	Very high	97.7	Very high	49 Å²	49	62.9 Å²	62.9	23%	0.227	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91	6.6	179.3	-60.6	-51.4	0	0	0	114.4	E528 E532 I535 A556 A557 K558 M562	E528-H560 WeakPolarHBondContact CA-NE2 3.12Å; E528-H560 WeakPolarHBondContact CG-NE2 3.38Å; E528-H560 PolarHBondContact O-NE2 3Å; E532-H560 WeakPolarHBondContact CG-CE1 3.39Å; E532-H560 WeakPolarHBondContact CG-NE2 3.28Å; E532-H560 IonicContact OE1-CE1 3.75Å; E532-H560 PolarHBondContact OE1-CE1 2.85Å; I535-H560 HydrophobicContact CD1-CB 4.21Å; A556-H560 PolarHBondContact O-CD2 3.38Å; A556-H560 VanDerWaalsContact O-CD2 3.23Å; A556-H560 PolarHBondContact O-N 3.18Å; A557-H560 CarbonylContact O-C 3.58Å; A557-H560 PolarHBondContact O-N 2.79Å; K558-H560 VanDerWaalsContact C-N 3.28Å; K558-H560 PolarHBondContact O-N 3.39Å; H560-M562 HydrophobicContact CB-CE 3.87Å; H560-M562 HydrophobicContact CB-CG 3.97Å; H560-M562 HydrophobicContact CB-SD 4.19Å; H560-M562 PolarHBondContact O-N 2.91Å
561	N	97.6	Very high	97.8	Very high	150 Å²	150	63.9 Å²	63.9	80%	0.802	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.1	33.4	-175.1	-58.8	-84.2	0	0	0	114.4	A557 K558	A557-N561 PolarHBondContact O-N 3.2Å; K558-N561 PolarHBondContact O-N 3.34Å
562	M	98.3	Very high	97.9	Very high	21 Å²	21	56.7 Å²	56.7	10%	0.103	29%	0.289	C	S	.	.			trans	-85.1	138.7	176.4	-59.7	178.9	173.7	0	0	110.9	L318 F531 I535 Y544 V546 A557 H560 F564	L318-M562 HydrophobicContact CD1-CE 4.36Å; L318-M562 HydrophobicContact CD1-SD 3.96Å; F531-M562 HydrophobicContact CD2-SD 4.3Å; I535-M562 HydrophobicContact CD1-CE 3.44Å; I535-M562 VanDerWaalsContact CD1-CE 3.44Å; I535-M562 HydrophobicContact CG1-CE 3.52Å; Y544-M562 VanDerWaalsContact CB-SD 3.57Å; Y544-M562 HydrophobicContact CD1-CE 4.21Å; Y544-M562 HydrophobicContact CD2-CE 3.94Å; Y544-M562 HydrophobicContact CG-CE 3.63Å; Y544-M562 HydrophobicContact CG-SD 4.31Å; V546-M562 HydrophobicContact CG2-CB 3.92Å; V546-M562 HydrophobicContact CG2-CG 4.46Å; V546-M562 HydrophobicContact CG2-SD 3.67Å; A557-M562 HydrophobicContact CB-CB 4.21Å; A557-M562 PolarHBondContact O-N 3.12Å; H560-M562 HydrophobicContact CB-CE 3.87Å; H560-M562 HydrophobicContact CB-CG 3.97Å; H560-M562 HydrophobicContact CB-SD 4.19Å; H560-M562 PolarHBondContact O-N 2.91Å; M562-F564 PolarHBondContact O-N 3.36Å
563	P	98.1	Very high	97.9	Very high	72 Å²	72	52 Å²	52	47%	0.468	26%	0.264	S	S	.	.			trans	-57.9	132.5	165.3	24.1	-34.3	0	0	0	110.9	Y544 V545 V546	Y544-P563 VanDerWaalsContact O-CD 3.28Å; Y544-P563 WeakPolarHBondContact O-CD 3.24Å; Y544-P563 WeakPolarHBondContact O-CG 3.23Å; V545-P563 HydrophobicContact CG2-CG 4.16Å; V546-P563 PolarHBondContact N-O 2.84Å
564	F	98.6	Very high	97.9	Very high	48 Å²	48	54.5 Å²	54.5	21%	0.211	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	123.6	177.8	-179.8	-106.3	0	0	0	110.1	V546 G548 E553 E554 A557 M562 R566	V546-F564 HydrophobicContact CB-CD2 3.91Å; V546-F564 HydrophobicContact CG1-CD2 3.71Å; V546-F564 HydrophobicContact CG1-CE2 4.02Å; V546-F564 CarbonylContact O-C 3.53Å; V546-F564 WeakPolarHBondContact O-CA 3.45Å; G548-F564 VanDerWaalsContact O-CZ 3.26Å; G548-F564 WeakPolarHBondContact O-CZ 3.31Å; E553-F564 HydrophobicContact CB-CE2 4.4Å; E553-F564 HydrophobicContact CG-CE2 3.68Å; E553-F564 HydrophobicContact CG-CZ 4.2Å; E554-F564 HydrophobicContact CB-CD1 3.92Å; E554-F564 HydrophobicContact CB-CD2 4.3Å; E554-F564 HydrophobicContact CB-CE1 3.63Å; E554-F564 HydrophobicContact CB-CE2 4.07Å; E554-F564 HydrophobicContact CB-CG 4.24Å; E554-F564 HydrophobicContact CB-CZ 3.72Å; E554-F564 HydrophobicContact CG-CD1 3.69Å; E554-F564 HydrophobicContact CG-CE1 3.78Å; E554-F564 HydrophobicContact CG-CG 4.19Å; E554-F564 HydrophobicContact CG-CZ 4.38Å; A557-F564 HydrophobicContact CB-CB 4.01Å; A557-F564 HydrophobicContact CB-CD2 4.23Å; A557-F564 HydrophobicContact CB-CG 4.49Å; M562-F564 PolarHBondContact O-N 3.36Å; F564-R566 HydrophobicContact CD1-CB 4.4Å; F564-R566 HydrophobicContact CE1-CB 3.76Å
565	W	98.7	Very high	97.9	Very high	72 Å²	72	55.1 Å²	55.1	27%	0.273	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	106.4	172.2	-167.3	-76.6	0	0	0	109.1	V546 I547 G548 I567 D572 L576 A579 L585	V546-W565 PolarHBondContact O-N 3.15Å; I547-W565 WeakPolarHBondContact CA-O 3.37Å; I547-W565 HydrophobicContact CG1-CB 4.24Å; G548-W565 PolarHBondContact N-O 3.32Å; W565-I567 PolarHBondContact O-N 2.84Å; W565-D572 PolarHBondContact NE1-O 3.2Å; W565-D572 VanDerWaalsContact NE1-O 3.13Å; W565-L576 HydrophobicContact CD2-CD1 4.23Å; W565-L576 HydrophobicContact CG-CD1 4.24Å; W565-L576 HydrophobicContact CZ2-CB 4.18Å; W565-A579 HydrophobicContact CH2-CB 3.91Å; W565-A579 HydrophobicContact CZ3-CB 4.21Å; W565-L585 HydrophobicContact CD2-CD1 4.29Å; W565-L585 HydrophobicContact CE3-CD1 3.65Å; W565-L585 HydrophobicContact CH2-CD1 4.4Å; W565-L585 HydrophobicContact CZ3-CD1 3.71Å; W565-L585 HydrophobicContact CZ3-CG 4.45Å
566	R	98.5	Very high	97.9	Very high	82 Å²	82	49.9 Å²	49.9	31%	0.309	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	130.1	175.6	176.1	153.8	-91.8	115.8	3.8	110.1	G548 D549 G550 E554 F564 S568	G548-R566 CarbonylContact O-C 3.52Å; G548-R566 VanDerWaalsContact O-CA 3.3Å; G548-R566 WeakPolarHBondContact O-CA 3.37Å; D549-R566 VanDerWaalsContact O-CZ 3.28Å; D549-R566 PolarHBondContact O-NE 2.94Å; D549-R566 PolarHBondContact O-NH2 3.3Å; G550-R566 PolarHBondContact O-NH2 3.11Å; E554-R566 IonicContact OE1-NH1 2.64Å; E554-R566 IonicContact OE2-CZ 3.46Å; E554-R566 IonicContact OE2-NH1 3.26Å; E554-R566 PolarHBondContact OE2-NH1 3.41Å; E554-R566 IonicContact OE2-NH2 3.5Å; E554-R566 PolarHBondContact OE2-NH2 3.36Å; F564-R566 HydrophobicContact CD1-CB 4.4Å; F564-R566 HydrophobicContact CE1-CB 3.76Å; R566-S568 WeakPolarHBondContact CD-OG 3.27Å; R566-S568 WeakPolarHBondContact CG-OG 3.39Å
567	I	98.6	Very high	97.9	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	27%	0.273	C	S	.	.			trans	-95.3	136.7	159.1	-58.3	-55.4	0	0	0	108.8	T324 W471 I547 G548 D549 W565 D572 L573 L576	T324-I567 HydrophobicContact CG2-CG1 4.23Å; W471-I567 HydrophobicContact CH2-CG2 3.81Å; W471-I567 HydrophobicContact CZ2-CG2 3.51Å; I547-I567 HydrophobicContact CG2-CD1 4.23Å; I547-I567 HydrophobicContact CG2-CG1 3.74Å; G548-I567 PolarHBondContact O-N 3.47Å; D549-I567 WeakPolarHBondContact CA-O 3.3Å; D549-I567 WeakPolarHBondContact CB-O 3.42Å; W565-I567 PolarHBondContact O-N 2.84Å; I567-D572 HydrophobicContact CD1-CB 3.94Å; I567-L573 HydrophobicContact CD1-CD2 3.65Å; I567-L573 HydrophobicContact CD1-CG 4.02Å; I567-L573 HydrophobicContact CG1-CD2 4.02Å; I567-L573 HydrophobicContact CG2-CD2 4.19Å; I567-L573 HydrophobicContact CG2-CG 3.97Å; I567-L576 HydrophobicContact CD1-CD2 4.23Å
568	S	95.8	Very high	97.9	Very high	43 Å²	43	56.4 Å²	56.4	30%	0.301	30%	0.296	S	S	.	.			trans	-151.7	-15.6	174.1	-79.4	0	0	0	0	113.2	K339 R566 D572	K339-S568 VanDerWaalsContact CE-O 3.28Å; K339-S568 WeakPolarHBondContact CE-O 3.47Å; K339-S568 PolarHBondContact NZ-O 3.47Å; R566-S568 WeakPolarHBondContact CD-OG 3.27Å; R566-S568 WeakPolarHBondContact CG-OG 3.39Å; S568-D572 WeakPolarHBondContact CA-OD2 3.43Å; S568-D572 PolarHBondContact N-OD2 3.4Å
569	T	96.5	Very high	97.8	Very high	56 Å²	56	51 Å²	51	34%	0.344	27%	0.274	S	S	.	.	S	Bend	trans	-149.3	163.9	-179.8	66.1	0	0	0	0	109.2	G571 D572	T569-G571 PolarHBondContact O-N 3.5Å; T569-G571 PolarHBondContact OG1-N 2.77Å; T569-D572 WeakPolarHBondContact CA-OD2 3.45Å; T569-D572 PolarHBondContact N-OD2 2.88Å; T569-D572 PolarHBondContact O-N 2.96Å; T569-D572 PolarHBondContact OG1-N 3.06Å; T569-D572 PolarHBondContact OG1-OD2 3.15Å
570	H	96.1	Very high	97.8	Very high	38 Å²	38	46.4 Å²	46.4	18%	0.176	25%	0.253	C	S	.	.	H	α-helix	trans	-55.2	-31.4	170	-51.8	70.7	0	0	0	112.5	Y336 F340 T468 W471 D572 L573 V574	Y336-H570 PolarHBondContact OH-CE1 2.85Å; Y336-H570 PolarHBondContact OH-NE2 2.96Å; F340-H570 AromaticContact CE1-CE1 3.87Å; F340-H570 AromaticContact CE1-ND1 3.77Å; T468-H570 PolarHBondContact O-NE2 3.27Å; W471-H570 AromaticContact CE3-CD2 3.79Å; W471-H570 AromaticContact CE3-CE1 3.66Å; W471-H570 AromaticContact CE3-CG 3.91Å; W471-H570 AromaticContact CE3-ND1 3.85Å; W471-H570 AromaticContact CE3-NE2 3.61Å; W471-H570 AromaticContact CZ3-ND1 3.88Å; H570-D572 PolarHBondContact O-N 2.81Å; H570-L573 PolarHBondContact O-N 3.44Å; H570-V574 WeakPolarHBondContact O-CG2 3.21Å; H570-V574 PolarHBondContact O-N 3.32Å
571	G	97.9	Very high	97.8	Very high	38 Å²	38	49.9 Å²	49.9	39%	0.392	27%	0.269	S	S	.	.	H	α-helix	trans	-60.5	-32.7	176.6	0	0	0	0	0	113	T569 S575	T569-G571 PolarHBondContact O-N 3.5Å; T569-G571 PolarHBondContact OG1-N 2.77Å; G571-S575 VanDerWaalsContact O-CB 3.25Å; G571-S575 WeakPolarHBondContact O-CB 3.46Å; G571-S575 PolarHBondContact O-N 3.49Å; G571-S575 PolarHBondContact O-OG 3Å
572	D	98.4	Very high	97.6	Very high	47 Å²	47	48 Å²	48	25%	0.251	26%	0.258	S	S	.	.	H	α-helix	trans	-75.7	-34.2	178.7	-51	-58.2	0	0	0	111.7	W565 I567 S568 T569 H570 L576	W565-D572 PolarHBondContact NE1-O 3.2Å; W565-D572 VanDerWaalsContact NE1-O 3.13Å; I567-D572 HydrophobicContact CD1-CB 3.94Å; S568-D572 WeakPolarHBondContact CA-OD2 3.43Å; S568-D572 PolarHBondContact N-OD2 3.4Å; T569-D572 WeakPolarHBondContact CA-OD2 3.45Å; T569-D572 PolarHBondContact N-OD2 2.88Å; T569-D572 PolarHBondContact O-N 2.96Å; T569-D572 PolarHBondContact OG1-N 3.06Å; T569-D572 PolarHBondContact OG1-OD2 3.15Å; H570-D572 PolarHBondContact O-N 2.81Å; D572-L576 VanDerWaalsContact O-CB 3.28Å; D572-L576 WeakPolarHBondContact O-CB 3.49Å; D572-L576 PolarHBondContact O-N 2.62Å
573	L	98.3	Very high	97.3	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-70.9	-40.2	172.4	-73.9	174	0	0	0	112.1	W471 T474 A475 I567 H570 L576 H577	W471-L573 HydrophobicContact CD2-CD1 3.78Å; W471-L573 VanDerWaalsContact CE2-CD1 3.48Å; W471-L573 HydrophobicContact CE3-CD1 4.38Å; W471-L573 HydrophobicContact CG-CD1 4.11Å; W471-L573 HydrophobicContact CH2-CD1 4.45Å; W471-L573 HydrophobicContact CZ2-CD1 3.86Å; T474-L573 HydrophobicContact CG2-CB 3.81Å; A475-L573 HydrophobicContact CB-CD1 4.3Å; A475-L573 HydrophobicContact CB-CD2 4.14Å; I567-L573 HydrophobicContact CD1-CD2 3.65Å; I567-L573 HydrophobicContact CD1-CG 4.02Å; I567-L573 HydrophobicContact CG1-CD2 4.02Å; I567-L573 HydrophobicContact CG2-CD2 4.19Å; I567-L573 HydrophobicContact CG2-CG 3.97Å; H570-L573 PolarHBondContact O-N 3.44Å; L573-L576 WeakPolarHBondContact O-CB 3.42Å; L573-L576 PolarHBondContact O-N 2.8Å; L573-H577 WeakPolarHBondContact O-CB 3.35Å; L573-H577 PolarHBondContact O-N 2.99Å
574	V	98.2	Very high	96.9	Very high	61 Å²	61	56.1 Å²	56.1	37%	0.37	29%	0.291	S	S	.	.	H	α-helix	trans	-64.8	-42.6	173.8	171.2	0	0	0	0	110.5	T474 H570 H577 Q578	T474-V574 HydrophobicContact CG2-CG2 3.9Å; H570-V574 WeakPolarHBondContact O-CG2 3.21Å; H570-V574 PolarHBondContact O-N 3.32Å; V574-H577 PolarHBondContact O-N 3.19Å; V574-Q578 WeakPolarHBondContact O-CG 3.24Å; V574-Q578 PolarHBondContact O-N 3.44Å
575	S	98.4	Very high	96.3	Very high	52 Å²	52	55 Å²	55	36%	0.364	29%	0.287	S	S	.	.	H	α-helix	trans	-65.9	-38.1	176.6	-58.7	0	0	0	0	112.1	G571 Q578 A579	G571-S575 VanDerWaalsContact O-CB 3.25Å; G571-S575 WeakPolarHBondContact O-CB 3.46Å; G571-S575 PolarHBondContact O-N 3.49Å; G571-S575 PolarHBondContact O-OG 3Å; S575-Q578 PolarHBondContact O-N 3Å; S575-A579 WeakPolarHBondContact O-CB 3.45Å; S575-A579 PolarHBondContact O-N 3.34Å
576	L	98.5	Very high	96.2	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-60.4	-45.9	172	174.5	60.1	0	0	0	111	W319 I547 W565 I567 D572 L573 A579 L580 L585	W319-L576 HydrophobicContact CH2-CD2 3.57Å; W319-L576 HydrophobicContact CZ2-CD2 4.34Å; W319-L576 HydrophobicContact CZ3-CD2 4.02Å; I547-L576 HydrophobicContact CD1-CD1 4.19Å; I547-L576 HydrophobicContact CD1-CD2 4Å; I547-L576 HydrophobicContact CG2-CD2 3.98Å; W565-L576 HydrophobicContact CD2-CD1 4.23Å; W565-L576 HydrophobicContact CG-CD1 4.24Å; W565-L576 HydrophobicContact CZ2-CB 4.18Å; I567-L576 HydrophobicContact CD1-CD2 4.23Å; D572-L576 VanDerWaalsContact O-CB 3.28Å; D572-L576 WeakPolarHBondContact O-CB 3.49Å; D572-L576 PolarHBondContact O-N 2.62Å; L573-L576 WeakPolarHBondContact O-CB 3.42Å; L573-L576 PolarHBondContact O-N 2.8Å; L576-A579 PolarHBondContact O-N 3.4Å; L576-L580 HydrophobicContact CD1-CD1 4.08Å; L576-L580 HydrophobicContact CD1-CG 4.37Å; L576-L580 HydrophobicContact CG-CD1 4.09Å; L576-L580 WeakPolarHBondContact O-CG 3.32Å; L576-L580 PolarHBondContact O-N 2.9Å; L576-L585 HydrophobicContact CD1-CD1 3.55Å
577	H	97.9	Very high	96.1	Very high	33 Å²	33	52.6 Å²	52.6	15%	0.153	29%	0.286	C	S	.	.	H	α-helix	trans	-61.4	-46.9	179	-171.1	39.5	0	0	0	111.5	S478 L573 V574 A579 L580 E581	S478-H577 WeakPolarHBondContact OG-CA 3.42Å; S478-H577 WeakPolarHBondContact OG-CB 3.3Å; S478-H577 PolarHBondContact OG-N 3.1Å; L573-H577 WeakPolarHBondContact O-CB 3.35Å; L573-H577 PolarHBondContact O-N 2.99Å; V574-H577 PolarHBondContact O-N 3.19Å; H577-A579 PolarHBondContact O-N 2.88Å; H577-L580 WeakPolarHBondContact O-CB 3.38Å; H577-L580 PolarHBondContact O-N 3.44Å; H577-E581 IonicContact NE2-OE1 3.18Å; H577-E581 WeakPolarHBondContact O-CG 3.24Å; H577-E581 PolarHBondContact O-N 3.05Å
578	Q	97.9	Very high	95.9	Very high	103 Å²	103	55.6 Å²	55.6	48%	0.481	30%	0.302	S	S	.	.	H	α-helix	trans	-63.1	-40.3	176.9	-70.4	172.8	0.2	0	0	112.6	V574 S575 L580 E581 L582	V574-Q578 WeakPolarHBondContact O-CG 3.24Å; V574-Q578 PolarHBondContact O-N 3.44Å; S575-Q578 PolarHBondContact O-N 3Å; Q578-L580 VanDerWaalsContact C-N 3.3Å; Q578-L580 PolarHBondContact O-N 2.92Å; Q578-E581 PolarHBondContact O-N 3.38Å; Q578-L582 WeakPolarHBondContact O-CB 3.2Å; Q578-L582 WeakPolarHBondContact O-CG 3.27Å; Q578-L582 PolarHBondContact O-N 3.02Å
579	A	97.7	Very high	95.9	Very high	10 Å²	10	56.3 Å²	56.3	8%	0.083	30%	0.302	C	S	.	.	H	α-helix	trans	-65.9	-32.2	176.4	0	0	0	0	0	112.5	W565 S575 L576 H577 D583 F584 L585	W565-A579 HydrophobicContact CH2-CB 3.91Å; W565-A579 HydrophobicContact CZ3-CB 4.21Å; S575-A579 WeakPolarHBondContact O-CB 3.45Å; S575-A579 PolarHBondContact O-N 3.34Å; L576-A579 PolarHBondContact O-N 3.4Å; H577-A579 PolarHBondContact O-N 2.88Å; A579-D583 PolarHBondContact O-N 2.63Å; A579-F584 HydrophobicContact CB-CB 4.48Å; A579-F584 WeakPolarHBondContact O-CB 3.06Å; A579-F584 PolarHBondContact O-N 3.28Å; A579-L585 HydrophobicContact CB-CD1 3.74Å; A579-L585 HydrophobicContact CB-CG 3.99Å; A579-L585 PolarHBondContact O-N 3.17Å
580	L	96.9	Very high	95.9	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-71.8	-44.3	170	-70.3	163	0	0	0	111.9	F317 L481 I482 R485 L576 H577 Q578 L582 D583 L585	F317-L580 HydrophobicContact CE1-CD2 3.79Å; F317-L580 HydrophobicContact CZ-CD2 3.65Å; L481-L580 HydrophobicContact CD2-CB 3.66Å; L481-L580 HydrophobicContact CG-CB 4.38Å; I482-L580 HydrophobicContact CD1-CD1 3.89Å; I482-L580 HydrophobicContact CD1-CD2 4.17Å; I482-L580 HydrophobicContact CG1-CD1 4Å; I482-L580 HydrophobicContact CG1-CD2 3.79Å; R485-L580 PolarHBondContact NH2-O 3.29Å; L576-L580 HydrophobicContact CD1-CD1 4.08Å; L576-L580 HydrophobicContact CD1-CG 4.37Å; L576-L580 HydrophobicContact CG-CD1 4.09Å; L576-L580 WeakPolarHBondContact O-CG 3.32Å; L576-L580 PolarHBondContact O-N 2.9Å; H577-L580 WeakPolarHBondContact O-CB 3.38Å; H577-L580 PolarHBondContact O-N 3.44Å; Q578-L580 VanDerWaalsContact C-N 3.3Å; Q578-L580 PolarHBondContact O-N 2.92Å; L580-L582 VanDerWaalsContact C-N 3.25Å; L580-L582 PolarHBondContact O-N 3.33Å; L580-D583 PolarHBondContact O-N 3Å; L580-D583 VanDerWaalsContact O-N 3.11Å; L580-L585 HydrophobicContact CD2-CB 3.8Å; L580-L585 HydrophobicContact CG-CB 4.21Å
581	E	95.7	Very high	95.9	Very high	122 Å²	122	57.5 Å²	57.5	57%	0.57	31%	0.308	S	S	*	.	H	α-helix	trans	-60	-35.4	178	-74.3	-174.6	122.9	0	0	112.6	L481 H577 Q578 D583	L481-E581 HydrophobicContact CD2-CB 4.49Å; L481-E581 HydrophobicContact CD2-CG 3.73Å; H577-E581 IonicContact NE2-OE1 3.18Å; H577-E581 WeakPolarHBondContact O-CG 3.24Å; H577-E581 PolarHBondContact O-N 3.05Å; Q578-E581 PolarHBondContact O-N 3.38Å; E581-D583 VanDerWaalsContact C-N 3.32Å
582	L	95.2	Very high	95.7	Very high	111 Å²	111	58.9 Å²	58.9	58%	0.581	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	4.5	178.4	-62.6	174.6	0	0	0	114.3	Q578 L580 F584	Q578-L582 WeakPolarHBondContact O-CB 3.2Å; Q578-L582 WeakPolarHBondContact O-CG 3.27Å; Q578-L582 PolarHBondContact O-N 3.02Å; L580-L582 VanDerWaalsContact C-N 3.25Å; L580-L582 PolarHBondContact O-N 3.33Å; L582-F584 HydrophobicContact CB-CD1 4.21Å; L582-F584 HydrophobicContact CB-CD2 3.97Å; L582-F584 HydrophobicContact CB-CE1 4.07Å; L582-F584 HydrophobicContact CB-CE2 3.83Å; L582-F584 HydrophobicContact CB-CG 4.16Å; L582-F584 HydrophobicContact CB-CZ 3.88Å; L582-F584 HydrophobicContact CD1-CD2 4.3Å; L582-F584 HydrophobicContact CD1-CE2 3.63Å; L582-F584 HydrophobicContact CD1-CZ 4.03Å; L582-F584 HydrophobicContact CG-CE2 4.39Å; L582-F584 WeakPolarHBondContact O-CD1 3.07Å; L582-F584 PolarHBondContact O-N 3.35Å
583	D	90.3	Very high	95.5	Very high	107 Å²	107	59.8 Å²	59.8	57%	0.572	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.9	26.9	-177.8	-152.4	38.5	0	0	0	114.9	R485 A579 L580 E581 L585	R485-D583 IonicContact CZ-OD1 2.72Å; R485-D583 IonicContact NH1-OD1 2.68Å; R485-D583 PolarHBondContact NH1-OD1 2.76Å; R485-D583 IonicContact NH2-OD1 2.73Å; R485-D583 PolarHBondContact NH2-OD1 2.76Å; A579-D583 PolarHBondContact O-N 2.63Å; L580-D583 PolarHBondContact O-N 3Å; L580-D583 VanDerWaalsContact O-N 3.11Å; E581-D583 VanDerWaalsContact C-N 3.32Å; D583-L585 VanDerWaalsContact C-N 3.29Å
584	F	90.6	Very high	95.3	Very high	155 Å²	155	64.8 Å²	64.8	68%	0.68	33%	0.332	S	S	*	.			trans	-78	-19	170	-58	-21.7	0	0	0	112.2	A579 L582	A579-F584 HydrophobicContact CB-CB 4.48Å; A579-F584 WeakPolarHBondContact O-CB 3.06Å; A579-F584 PolarHBondContact O-N 3.28Å; L582-F584 HydrophobicContact CB-CD1 4.21Å; L582-F584 HydrophobicContact CB-CD2 3.97Å; L582-F584 HydrophobicContact CB-CE1 4.07Å; L582-F584 HydrophobicContact CB-CE2 3.83Å; L582-F584 HydrophobicContact CB-CG 4.16Å; L582-F584 HydrophobicContact CB-CZ 3.88Å; L582-F584 HydrophobicContact CD1-CD2 4.3Å; L582-F584 HydrophobicContact CD1-CE2 3.63Å; L582-F584 HydrophobicContact CD1-CZ 4.03Å; L582-F584 HydrophobicContact CG-CE2 4.39Å; L582-F584 WeakPolarHBondContact O-CD1 3.07Å; L582-F584 PolarHBondContact O-N 3.35Å
585	L	86	Confident	95	Very high	24 Å²	24	65.2 Å²	65.2	13%	0.126	33%	0.328	C	S	.	.			trans	-128.6	0	176.7	-70.9	-179.5	0	0	0	111.8	R315 F317 R485 V545 W565 L576 A579 L580 D583	R315-L585 WeakPolarHBondContact CD-OXT 3.43Å; R315-L585 PolarHBondContact NE-OXT 2.45Å; R315-L585 PolarHBondContact NH1-O 3.23Å; R315-L585 VanDerWaalsContact NH1-O 3.11Å; R315-L585 PolarHBondContact NH1-OXT 3.31Å; F317-L585 WeakPolarHBondContact CZ-OXT 3.42Å; R485-L585 PolarHBondContact NH1-O 3.37Å; V545-L585 HydrophobicContact CG1-CD2 4.47Å; W565-L585 HydrophobicContact CD2-CD1 4.29Å; W565-L585 HydrophobicContact CE3-CD1 3.65Å; W565-L585 HydrophobicContact CH2-CD1 4.4Å; W565-L585 HydrophobicContact CZ3-CD1 3.71Å; W565-L585 HydrophobicContact CZ3-CG 4.45Å; L576-L585 HydrophobicContact CD1-CD1 3.55Å; A579-L585 HydrophobicContact CB-CD1 3.74Å; A579-L585 HydrophobicContact CB-CG 3.99Å; A579-L585 PolarHBondContact O-N 3.17Å; L580-L585 HydrophobicContact CD2-CB 3.8Å; L580-L585 HydrophobicContact CG-CB 4.21Å; D583-L585 VanDerWaalsContact C-N 3.29Å

Retrieved 585 of 585 residues in 577.4 ms (Link to these results)

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