A0A087Y9P0_POEFO Loading...

PEX5-related protein

Accessory subunit of hyperpolarization-activated cyclic nucleotide-gated (HCN) channels, regulating their cell-surface expression and cyclic nucleotide dependence.

AlphaFold DB , UniProt , Accession A0A087Y9P0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 620 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	31.7	Very low	33	Very low	229 Å²	229	157.2 Å²	157.2	100%	1.128	84%	0.836	S	S	*	*				0	135	0	-81.2	-178.5	170.1	0	0	107.8
2	Y	31.9	Very low	32.9	Very low	198 Å²	198	163.9 Å²	163.9	78%	0.776	84%	0.841	S	S	*	*			trans	55.5	115.7	173.6	-69.6	-92.6	0	0	0	116.5
3	Q	37	Very low	32.6	Very low	178 Å²	178	158.7 Å²	158.7	83%	0.832	84%	0.837	S	S	*	*				65.6	136	76.5	-70.9	-173.3	-15.6	0	0	113.7
4	G	31.5	Very low	32.4	Very low	77 Å²	77	154.3 Å²	154.3	79%	0.794	84%	0.835	S	S	*	*			cis	-177.3	170.1	-2.1	0	0	0	0	0	113.2
5	H	38.5	Very low	32.1	Very low	188 Å²	188	153.9 Å²	153.9	87%	0.87	83%	0.832	S	S	*	*			trans	-81.9	152.5	175	-76.8	-57.7	0	0	0	112.5
6	L	35.8	Very low	32	Very low	173 Å²	173	157.2 Å²	157.2	91%	0.906	84%	0.836	S	S	*	*				174.6	139.2	107.2	-94	165.5	0	0	0	112.7
7	Q	30.1	Very low	31.6	Very low	200 Å²	200	155.7 Å²	155.7	94%	0.935	84%	0.835	S	S	*	*			trans	-157.5	136.4	162.9	-162.1	173	18.9	0	0	109.3
8	G	30.1	Very low	31.2	Very low	77 Å²	77	155 Å²	155	79%	0.794	84%	0.836	S	S	*	*			trans	147.7	97.1	177.5	0	0	0	0	0	114.3
9	K	32.8	Very low	30.9	Very low	189 Å²	189	151.4 Å²	151.4	82%	0.822	83%	0.83	S	S	*	*			trans	-108.4	-174.5	160.7	-52.3	-176.8	175.1	-178.5	0	108
10	D	30.2	Very low	30.6	Very low	122 Å²	122	152.3 Å²	152.3	65%	0.652	83%	0.83	S	S	*	*			cis	-165.9	140	19.5	-130.5	-37.3	0	0	0	112.2
11	S	32.9	Very low	30.3	Very low	98 Å²	98	150.7 Å²	150.7	69%	0.685	83%	0.825	S	S	*	*			trans	67.3	161.8	143.3	89	0	0	0	0	120
12	R	32.2	Very low	30.1	Very low	238 Å²	238	147.7 Å²	147.7	90%	0.898	81%	0.812	S	S	*	*			cis	-166.1	175.4	-3.6	-136	171	-179.3	167.7	-0.9	112.9
13	A	29.5	Very low	29.9	Very low	96 Å²	96	148.2 Å²	148.2	79%	0.793	82%	0.819	S	S	*	*			trans	81	141.2	156.5	0	0	0	0	0	118.2
14	A	30	Very low	29.3	Very low	97 Å²	97	147.7 Å²	147.7	80%	0.802	82%	0.816	S	S	*	*			cis	-152.7	162.8	-6.8	0	0	0	0	0	112.9
15	D	28	Very low	29.3	Very low	148 Å²	148	150.8 Å²	150.8	79%	0.791	81%	0.813	S	S	*	*			trans	-78.2	164	-173.4	-50.9	-91.5	0	0	0	116.5
16	K	29.3	Very low	29.1	Very low	207 Å²	207	148 Å²	148	90%	0.9	81%	0.812	S	S	*	*				-160.3	109.5	128.6	-110.6	164.4	-172	175.6	0	112.9
17	T	25.5	Very low	28.9	Very low	132 Å²	132	144.9 Å²	144.9	81%	0.81	81%	0.805	S	S	*	*			trans	-124.6	150.1	166.4	47.2	0	0	0	0	109.7
18	V	25.3	Very low	28.9	Very low	143 Å²	143	145.7 Å²	145.7	87%	0.867	81%	0.805	S	S	*	*			trans	-135.1	137	174.7	-176.9	0	0	0	0	108.6
19	A	25.3	Very low	28.9	Very low	86 Å²	86	146.9 Å²	146.9	71%	0.711	81%	0.808	S	S	*	*			trans	-77.8	-171.6	176.7	0	0	0	0	0	110.6
20	M	24.4	Very low	28.7	Very low	169 Å²	169	143.5 Å²	143.5	83%	0.833	81%	0.808	S	S	*	*			cis	-165.9	165	24	-146	158.8	67.8	0	0	105.4
21	V	25.1	Very low	28.7	Very low	119 Å²	119	142.3 Å²	142.3	72%	0.721	81%	0.809	S	S	*	*				-168.2	142.4	59.3	169	0	0	0	0	109
22	L	27.3	Very low	28.5	Very low	166 Å²	166	146.7 Å²	146.7	87%	0.869	82%	0.819	S	S	*	*			trans	-94.6	152.9	163.5	-85.5	164.6	0	0	0	111
23	K	26.1	Very low	28.4	Very low	210 Å²	210	138.7 Å²	138.7	91%	0.913	81%	0.81	S	S	*	*			trans	-140	141.2	162.3	-157.5	175.1	-176.3	-178.3	0	110.6
24	E	25.3	Very low	28.6	Very low	167 Å²	167	143.5 Å²	143.5	78%	0.78	81%	0.813	S	S	*	*			trans	-110.8	145.5	-159.8	-101.5	-175.6	158.7	0	0	114.2
25	I	32.3	Very low	28.7	Very low	141 Å²	141	145 Å²	145	72%	0.723	82%	0.815	S	S	*	*			trans	22.3	148.7	152.3	7.5	179	0	0	0	121.3
26	P	34.2	Very low	28.7	Very low	130 Å²	130	145.6 Å²	145.6	84%	0.844	82%	0.817	S	S	*	*				-139.7	174.4	80.5	37	-20.2	0	0	0	115.5
27	S	31.3	Very low	28.7	Very low	108 Å²	108	143.9 Å²	143.9	76%	0.755	82%	0.817	S	S	*	*			trans	-98.1	161.1	-171.4	55.7	0	0	0	0	114.6
28	K	29.8	Very low	28.7	Very low	216 Å²	216	143.6 Å²	143.6	94%	0.939	82%	0.815	S	S	*	*			trans	-162.8	158.9	147	-113	168.8	-174.1	179.3	0	110.9
29	A	29.1	Very low	28.7	Very low	103 Å²	103	142.6 Å²	142.6	85%	0.851	81%	0.809	S	S	*	*			trans	-116.3	149.5	-177.4	0	0	0	0	0	111.8
30	S	28.6	Very low	28.8	Very low	118 Å²	118	144.6 Å²	144.6	83%	0.825	81%	0.813	S	S	*	*			trans	-157.1	153.4	150.2	-167.4	0	0	0	0	109.5
31	S	30.8	Very low	29.1	Very low	96 Å²	96	142.9 Å²	142.9	67%	0.671	81%	0.812	S	S	*	*			trans	-78.1	147.6	171.7	49.4	0	0	0	0	111.9
32	E	29.9	Very low	29.2	Very low	191 Å²	191	146.3 Å²	146.3	89%	0.893	82%	0.817	S	S	*	*				-170.4	164.1	103.9	-99.9	174.9	-173.4	0	0	111.3
33	G	29.4	Very low	29.3	Very low	70 Å²	70	146.9 Å²	146.9	72%	0.722	82%	0.82	S	S	*	*			trans	-104.3	138.6	-160.5	0	0	0	0	0	116
34	K	32.8	Very low	29.4	Very low	197 Å²	197	143.2 Å²	143.2	86%	0.857	82%	0.815	S	S	*	*			trans	-170	125.6	143.3	-100.5	149.4	-173.2	177.1	0	109.1	L36	K34-L36 PolarHBondContact O-N 2.71Å
35	P	33.5	Very low	29.3	Very low	128 Å²	128	139.8 Å²	139.8	83%	0.831	81%	0.809	S	S	*	*			trans	-78.9	107.6	178.4	30.6	-32.1	0	0	0	110.7
36	L	27.1	Very low	29.2	Very low	161 Å²	161	142.4 Å²	142.4	84%	0.843	82%	0.818	S	S	*	*			trans	-79	129.8	153.3	-71.5	169.7	0	0	0	107.5	K34 T38	K34-L36 PolarHBondContact O-N 2.71Å; L36-T38 PolarHBondContact O-N 2.75Å
37	L	29.5	Very low	28.9	Very low	171 Å²	171	143.7 Å²	143.7	90%	0.895	81%	0.813	S	S	*	*			trans	-77.1	90.8	178.4	-88.8	163.4	0	0	0	110.2	V39	L37-V39 PolarHBondContact O-N 3.3Å
38	T	25.1	Very low	28.8	Very low	125 Å²	125	148 Å²	148	77%	0.767	82%	0.822	S	S	*	*			trans	-64.8	122	171.9	-48.2	0	0	0	0	110.1	L36 T40	L36-T38 PolarHBondContact O-N 2.75Å; T38-T40 PolarHBondContact O-N 2.59Å
39	V	26.4	Very low	28.6	Very low	123 Å²	123	145.9 Å²	145.9	75%	0.745	82%	0.815	S	S	*	*			trans	-58.5	122.3	176.9	177.5	0	0	0	0	110.5	L37 T41	L37-V39 PolarHBondContact O-N 3.3Å; V39-T41 HydrophobicContact CG1-CG2 4.41Å
40	T	27.8	Very low	28.6	Very low	128 Å²	128	146.6 Å²	146.6	79%	0.785	81%	0.814	S	S	*	*			trans	-96.8	95.7	171.9	46.6	0	0	0	0	110.2	T38 K42	T38-T40 PolarHBondContact O-N 2.59Å; T40-K42 PolarHBondContact O-N 2.64Å; T40-K42 VanDerWaalsContact O-N 3.16Å
41	T	30.6	Very low	28.8	Very low	133 Å²	133	151.1 Å²	151.1	82%	0.816	81%	0.812	S	S	*	*			trans	-64.3	114.1	171.8	42.2	0	0	0	0	110.5	V39	V39-T41 HydrophobicContact CG1-CG2 4.41Å
42	K	25.9	Very low	28.7	Very low	191 Å²	191	151.5 Å²	151.5	83%	0.83	81%	0.813	S	S	*	*			trans	-114.1	126.7	161.3	-85.2	-172.8	173.2	-179.4	0	108.6	T40 V44	T40-K42 PolarHBondContact O-N 2.64Å; T40-K42 VanDerWaalsContact O-N 3.16Å; K42-V44 PolarHBondContact O-N 2.75Å
43	L	30.8	Very low	28.6	Very low	178 Å²	178	149.5 Å²	149.5	93%	0.932	81%	0.808	S	S	*	*			trans	-61.8	129.6	173.1	-64.4	103.4	0	0	0	109.7
44	V	26.3	Very low	28.8	Very low	132 Å²	132	153.6 Å²	153.6	80%	0.8	81%	0.812	S	S	*	*			trans	-119.3	148.7	159.5	177.8	0	0	0	0	106.3	K42	K42-V44 PolarHBondContact O-N 2.75Å
45	S	25.1	Very low	28.6	Very low	96 Å²	96	149.4 Å²	149.4	67%	0.671	81%	0.807	S	S	*	*			trans	-53.6	140.1	-170.4	46.7	0	0	0	0	114.3	Q47	S45-Q47 PolarHBondContact O-N 2.59Å; S45-Q47 VanDerWaalsContact O-N 3.16Å
46	E	29.8	Very low	28.5	Very low	195 Å²	195	148.2 Å²	148.2	91%	0.911	80%	0.8	S	S	*	*			trans	-56	114.7	164.1	-62.9	163.2	125.7	0	0	110
47	Q	26.5	Very low	28.6	Very low	158 Å²	158	143.5 Å²	143.5	74%	0.738	78%	0.78	S	S	*	*			trans	-108.7	123.9	152.7	-69.8	-166.4	-57.2	0	0	106.9	S45 E49	S45-Q47 PolarHBondContact O-N 2.59Å; S45-Q47 VanDerWaalsContact O-N 3.16Å; Q47-E49 VanDerWaalsContact C-N 3.28Å; Q47-E49 PolarHBondContact O-N 3.36Å
48	Q	29.9	Very low	29	Very low	199 Å²	199	142.5 Å²	142.5	93%	0.93	77%	0.774	S	S	*	*			trans	-79.3	83.4	175.2	-69.3	177.7	-73.7	0	0	108.5
49	E	26.8	Very low	29.6	Very low	171 Å²	171	142.3 Å²	142.3	80%	0.799	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-66.4	139.2	174.1	-65	-174	150.9	0	0	110.2	Q47 R51	Q47-E49 VanDerWaalsContact C-N 3.28Å; Q47-E49 PolarHBondContact O-N 3.36Å; E49-R51 PolarHBondContact O-N 2.98Å
50	S	28.3	Very low	30.3	Very low	118 Å²	118	141.9 Å²	141.9	83%	0.825	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-77.6	124.8	-164.8	52.3	0	0	0	0	112.4
51	R	32.2	Very low	30.5	Very low	212 Å²	212	144.4 Å²	144.4	80%	0.8	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-54	143.6	170.5	-63	179.1	177.5	-176.1	-4.2	111.5	E49 L53	E49-R51 PolarHBondContact O-N 2.98Å; R51-L53 PolarHBondContact O-N 2.9Å
52	P	28.8	Very low	30.8	Very low	104 Å²	104	145 Å²	145	68%	0.675	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-65.8	119.7	154.8	29.7	-30.7	0	0	0	108	L54	P52-L54 PolarHBondContact O-N 3.39Å
53	L	29.2	Very low	31.2	Very low	150 Å²	150	141.4 Å²	141.4	79%	0.785	76%	0.757	S	S	*	*			trans	-88.2	105.7	176.6	-71.9	173.4	0	0	0	109.6	R51	R51-L53 PolarHBondContact O-N 2.9Å
54	L	31.6	Very low	31.3	Very low	156 Å²	156	142 Å²	142	82%	0.817	76%	0.755	S	S	*	*			trans	-119.5	133.9	158.8	-70.8	171.6	0	0	0	107.2	P52	P52-L54 PolarHBondContact O-N 3.39Å
55	S	29.6	Very low	31.8	Very low	108 Å²	108	141 Å²	141	76%	0.755	75%	0.75	S	S	*	*	S	Bend	trans	67.3	148.4	-166.4	78.9	0	0	0	0	116.7
56	P	31.6	Very low	31.9	Very low	103 Å²	103	146 Å²	146	67%	0.669	76%	0.76	S	S	*	*			trans	-86.1	153.9	178.4	-5.2	25	0	0	0	113.2
57	S	29.3	Very low	31.9	Very low	63 Å²	63	142.9 Å²	142.9	44%	0.441	76%	0.757	S	S	.	*			trans	-74.7	145.6	167.3	-168.5	0	0	0	0	111	D59 D60	S57-D59 PolarHBondContact O-N 3.13Å; S57-D59 VanDerWaalsContact O-N 3.16Å; S57-D59 PolarHBondContact OG-OD2 3.02Å; S57-D60 PolarHBondContact O-N 3.03Å
58	I	38.3	Very low	31.9	Very low	150 Å²	150	143.9 Å²	143.9	77%	0.769	77%	0.768	S	S	*	*	G	3₁₀ helix	trans	-60.9	-21.7	174.7	-82.2	173.1	0	0	0	112.7	D60 F61	I58-D60 VanDerWaalsContact C-N 3.28Å; I58-D60 PolarHBondContact O-N 3.16Å; I58-F61 PolarHBondContact O-N 2.95Å
59	D	37.9	Very low	31.9	Very low	121 Å²	121	137.6 Å²	137.6	65%	0.647	76%	0.756	S	S	*	*	G	3₁₀ helix	trans	-60.8	-31.7	178.2	-62.7	-65.8	0	0	0	113.9	S57 F61 L62	S57-D59 PolarHBondContact O-N 3.13Å; S57-D59 VanDerWaalsContact O-N 3.16Å; S57-D59 PolarHBondContact OG-OD2 3.02Å; D59-F61 VanDerWaalsContact C-N 3.25Å; D59-F61 PolarHBondContact O-N 2.99Å; D59-L62 PolarHBondContact O-N 3.06Å
60	D	39.6	Very low	31.9	Very low	114 Å²	114	138 Å²	138	61%	0.61	76%	0.762	S	S	*	*	G	3₁₀ helix	trans	-67.5	-25.8	-177	-74.3	-40.5	0	0	0	112.4	S57 I58 L62	S57-D60 PolarHBondContact O-N 3.03Å; I58-D60 VanDerWaalsContact C-N 3.28Å; I58-D60 PolarHBondContact O-N 3.16Å; D60-L62 PolarHBondContact O-N 3.42Å
61	F	33	Very low	31.8	Very low	181 Å²	181	137.4 Å²	137.4	79%	0.794	76%	0.758	S	S	*	*	G	3₁₀ helix	trans	-73.6	-5.4	-176.9	-96.6	-82.1	0	0	0	115.3	I58 D59	I58-F61 PolarHBondContact O-N 2.95Å; D59-F61 VanDerWaalsContact C-N 3.25Å; D59-F61 PolarHBondContact O-N 2.99Å
62	L	36.1	Very low	31.5	Very low	146 Å²	146	138.8 Å²	138.8	76%	0.764	76%	0.763	S	S	*	*	G	3₁₀ helix	trans	-102.9	-0.9	-179.7	-66.3	179.7	0	0	0	114.7	D59 D60	D59-L62 PolarHBondContact O-N 3.06Å; D60-L62 PolarHBondContact O-N 3.42Å
63	C	35.8	Very low	31.6	Very low	114 Å²	114	139.6 Å²	139.6	77%	0.77	77%	0.768	S	S	*	*	S	Bend	trans	-103.8	-0.7	-171.9	-81.5	0	0	0	0	116.8
64	E	31.9	Very low	31.4	Very low	191 Å²	191	139.1 Å²	139.1	89%	0.893	77%	0.772	S	S	*	*	S	Bend	trans	-101.5	24.3	178.3	-66.7	-145.2	133.6	0	0	115.7
65	T	36.4	Very low	31.2	Very low	112 Å²	112	137.3 Å²	137.3	69%	0.687	77%	0.767	S	S	*	*			trans	-135.4	62.5	173.9	53.8	0	0	0	0	116.2
66	K	28.3	Very low	31.1	Very low	201 Å²	201	137.2 Å²	137.2	87%	0.874	77%	0.767	S	S	*	*			trans	-153.8	131.8	146.7	-92.1	112.3	-156.2	162.5	0	111.8
67	C	28.1	Very low	30.8	Very low	128 Å²	128	139.7 Å²	139.7	87%	0.865	77%	0.774	S	S	*	*			trans	-78.3	156.5	167	-63.1	0	0	0	0	111.1	G69	C67-G69 PolarHBondContact O-N 2.97Å
68	D	27.8	Very low	30.6	Very low	180 Å²	180	143.3 Å²	143.3	96%	0.963	79%	0.794	S	S	*	*			trans	-56.6	126.2	173.3	-81	-60.6	0	0	0	112.7
69	G	28.5	Very low	30.1	Very low	66 Å²	66	140.5 Å²	140.5	68%	0.68	79%	0.793	S	S	*	*			trans	-149.3	104.3	-179.8	0	0	0	0	0	111.1	C67 S71	C67-G69 PolarHBondContact O-N 2.97Å; G69-S71 PolarHBondContact O-N 2.82Å
70	I	28.2	Very low	29.5	Very low	180 Å²	180	140.7 Å²	140.7	92%	0.923	80%	0.798	S	S	*	*			trans	-47.3	118.5	-172.9	-61.4	167.1	0	0	0	112.1
71	S	26.2	Very low	28.8	Very low	106 Å²	106	142.4 Å²	142.4	74%	0.741	81%	0.807	S	S	*	*			trans	-91.8	127.9	-179.6	58.3	0	0	0	0	112.8	G69	G69-S71 PolarHBondContact O-N 2.82Å
72	R	26.6	Very low	28.4	Very low	241 Å²	241	139.3 Å²	139.3	91%	0.909	81%	0.807	S	S	*	*			trans	-143.5	147.6	146.9	-76.1	-155	171.2	-178.9	-1.8	110.4
73	P	30.8	Very low	27.9	Very low	120 Å²	120	136.7 Å²	136.7	78%	0.779	80%	0.801	S	S	*	*			trans	-98.9	167.7	-165.5	39.1	-37.1	0	0	0	113.5
74	V	24.6	Very low	27.4	Very low	141 Å²	141	136.7 Å²	136.7	86%	0.855	80%	0.798	S	S	*	*				-167.2	164.4	127.1	136.5	0	0	0	0	110.1
75	T	26	Very low	27.3	Very low	118 Å²	118	134.7 Å²	134.7	72%	0.724	79%	0.792	S	S	*	*			trans	-92.7	-178.8	-168.8	58.9	0	0	0	0	114.5
76	S	27.5	Very low	26.9	Very low	106 Å²	106	135.1 Å²	135.1	74%	0.741	79%	0.79	S	S	*	*			trans	99.6	120.2	147.2	-53.3	0	0	0	0	118.3
77	N	25.3	Very low	26.8	Very low	154 Å²	154	131.8 Å²	131.8	82%	0.824	78%	0.781	S	S	*	*			trans	-66.4	146.2	164	-47.1	-56.2	0	0	0	111
78	T	26.2	Very low	27	Very low	140 Å²	140	132.9 Å²	132.9	86%	0.859	78%	0.778	S	S	*	*				178.1	155.3	124.7	22.9	0	0	0	0	112.9
79	A	27.3	Very low	27	Very low	90 Å²	90	130.4 Å²	130.4	74%	0.744	77%	0.765	S	S	*	*			trans	58.1	127.4	168.6	0	0	0	0	0	117.8
80	V	25.1	Very low	27	Very low	125 Å²	125	134.1 Å²	134.1	76%	0.758	77%	0.768	S	S	*	*			cis	85.3	97.4	30.3	-173.6	0	0	0	0	114.4
81	L	25.3	Very low	27.1	Very low	151 Å²	151	131.2 Å²	131.2	79%	0.791	76%	0.764	S	S	*	*			trans	66.1	105.9	147.9	-63.3	171.9	0	0	0	121.8
82	S	25.3	Very low	27.5	Very low	115 Å²	115	134.9 Å²	134.9	80%	0.804	77%	0.769	S	S	*	*			trans	76.1	162.9	130.6	90.7	0	0	0	0	117.4
83	S	25.4	Very low	28.3	Very low	91 Å²	91	129.8 Å²	129.8	64%	0.636	77%	0.767	S	S	*	*			cis	-155.9	165.3	3.6	53	0	0	0	0	112.1
84	T	25.1	Very low	28.1	Very low	114 Å²	114	126.9 Å²	126.9	70%	0.699	76%	0.76	S	S	*	*			trans	57	129.4	148.6	50.6	0	0	0	0	123
85	L	28.6	Very low	28.3	Very low	149 Å²	149	128 Å²	128	78%	0.78	76%	0.755	S	S	*	*			trans	68.9	151.4	138.7	-90.4	70.3	0	0	0	118.9
86	D	28.2	Very low	28.4	Very low	121 Å²	121	132.3 Å²	132.3	65%	0.647	76%	0.758	S	S	*	*			cis	-157.1	172.2	-12.8	-142.4	-16.7	0	0	0	111.6
87	L	27.9	Very low	28.4	Very low	131 Å²	131	138 Å²	138	69%	0.686	76%	0.764	S	S	*	*			trans	50.4	125.9	153.1	-67.6	163.3	0	0	0	122.6
88	L	30.4	Very low	28.7	Very low	151 Å²	151	138.3 Å²	138.3	79%	0.791	77%	0.765	S	S	*	*				23.1	143.7	128.4	-53.5	174.3	0	0	0	119.5
89	D	29	Very low	28.7	Very low	129 Å²	129	137.5 Å²	137.5	69%	0.69	77%	0.765	S	S	*	*				-168.9	168.5	51.4	-159.4	23	0	0	0	116.2
90	L	28.6	Very low	28.9	Very low	143 Å²	143	142.5 Å²	142.5	75%	0.749	77%	0.77	S	S	*	*			trans	19.2	129.9	161.7	-74.8	171.1	0	0	0	123.7
91	S	28.9	Very low	29.1	Very low	119 Å²	119	142.5 Å²	142.5	83%	0.832	77%	0.766	S	S	*	*				179.3	142.3	106.2	36.9	0	0	0	0	115
92	E	36.2	Very low	29.4	Very low	184 Å²	184	143.1 Å²	143.1	86%	0.86	76%	0.762	S	S	*	*			trans	-99.5	162.2	165.7	-53.8	-168	151.8	0	0	111
93	P	42.6	Very low	29.6	Very low	133 Å²	133	146.9 Å²	146.9	86%	0.864	76%	0.764	S	S	*	*				-137.6	-174.5	77.1	20.7	3.6	0	0	0	112.8
94	G	27.4	Very low	29.7	Very low	60 Å²	60	148 Å²	148	62%	0.619	77%	0.772	S	S	*	*			cis	146.3	148.4	-4.3	0	0	0	0	0	112.9
95	E	28.1	Very low	29.7	Very low	163 Å²	163	147.5 Å²	147.5	76%	0.762	78%	0.779	S	S	*	*			trans	70.2	138.8	176.9	-56.7	-112.2	95.1	0	0	116
96	R	28.1	Very low	29.8	Very low	210 Å²	210	148.1 Å²	148.1	79%	0.792	78%	0.783	S	S	*	*			cis	77	144.9	45.8	-65	176.4	170.6	175.2	0.1	112.7
97	R	28.1	Very low	29.8	Very low	225 Å²	225	148.6 Å²	148.6	85%	0.849	79%	0.789	S	S	*	*			cis	-162	172.3	20.7	-145.2	173.3	-173.4	169.7	0.2	113.1
98	N	31.6	Very low	29.8	Very low	161 Å²	161	146.6 Å²	146.6	86%	0.861	79%	0.787	S	S	*	*			trans	-67.4	161.8	170.7	-67.2	-28.8	0	0	0	114.8
99	S	26	Very low	29.8	Very low	122 Å²	122	150.3 Å²	150.3	85%	0.853	79%	0.79	S	S	*	*			trans	-145	160.8	151.2	71	0	0	0	0	113.5
100	K	31	Very low	29.7	Very low	195 Å²	195	147.1 Å²	147.1	85%	0.848	79%	0.787	S	S	*	*			trans	-144.1	145.7	172.5	-83.5	-176	174.7	179.8	0	107.4
101	D	29	Very low	29.6	Very low	125 Å²	125	147.7 Å²	147.7	67%	0.668	79%	0.791	S	S	*	*			trans	162.3	162.2	146.8	-94.5	10.9	0	0	0	111.8
102	K	32.8	Very low	29.5	Very low	164 Å²	164	146.1 Å²	146.1	71%	0.713	79%	0.793	S	S	*	*			cis	-170.1	176.8	-33.2	-122	-166.9	-149.3	83.8	0	109.1
103	K	28	Very low	29.2	Very low	195 Å²	195	145.1 Å²	145.1	85%	0.848	79%	0.789	S	S	*	*			trans	84.4	132	172	-56.5	178.9	178.2	177.1	0	115.6
104	S	28.1	Very low	28.5	Very low	114 Å²	114	146.8 Å²	146.8	80%	0.797	78%	0.783	S	S	*	*			cis	109.4	116.5	2.2	81.2	0	0	0	0	117.1
105	A	25.8	Very low	28.4	Very low	104 Å²	104	150.8 Å²	150.8	86%	0.86	79%	0.79	S	S	*	*			trans	-154.1	119	151.7	0	0	0	0	0	109
106	L	29.7	Very low	28.3	Very low	162 Å²	162	147.7 Å²	147.7	85%	0.848	79%	0.786	S	S	*	*			trans	-165.2	110.9	-177.4	-160.3	174.6	0	0	0	112.2
107	V	27.9	Very low	28.4	Very low	130 Å²	130	143 Å²	143	79%	0.788	79%	0.786	S	S	*	*			trans	-160.3	115.2	165.2	160.2	0	0	0	0	103.9
108	S	29.1	Very low	28.5	Very low	90 Å²	90	139.5 Å²	139.5	63%	0.629	78%	0.779	S	S	*	*				66.9	144.6	58.9	94.4	0	0	0	0	112.9
109	R	30.6	Very low	28.4	Very low	229 Å²	229	140 Å²	140	86%	0.864	77%	0.773	S	S	*	*			cis	-169.5	171.6	19.9	-161	169.3	158.5	-176.7	-5.9	110.6
110	G	25.5	Very low	28.7	Very low	61 Å²	61	143.5 Å²	143.5	63%	0.629	77%	0.773	S	S	*	*			trans	118.5	109.4	168.7	0	0	0	0	0	112.4
111	D	27.4	Very low	28.5	Very low	156 Å²	156	142 Å²	142	83%	0.834	77%	0.766	S	S	*	*				80.5	120.9	56.3	-67.1	-53.2	0	0	0	113.4
112	G	25.7	Very low	28.6	Very low	85 Å²	85	141.4 Å²	141.4	88%	0.876	77%	0.768	S	S	*	*			trans	163.6	97.5	176.2	0	0	0	0	0	117.1
113	Q	30.4	Very low	28.3	Very low	164 Å²	164	138.7 Å²	138.7	77%	0.766	76%	0.761	S	S	*	*			trans	-66	155.3	-175.5	-69	178.6	-14.5	0	0	118.7
114	K	29	Very low	28.3	Very low	168 Å²	168	137.8 Å²	137.8	73%	0.73	76%	0.76	S	S	*	*			trans	52.3	125	136.1	-66.1	171.5	179.4	178.4	0	122.1
115	N	25.1	Very low	28.3	Very low	144 Å²	144	137.4 Å²	137.4	77%	0.77	75%	0.752	S	S	*	*				169.8	136.8	115.3	-80.9	-18.9	0	0	0	108
116	S	25.8	Very low	28.5	Very low	98 Å²	98	140.3 Å²	140.3	69%	0.685	75%	0.748	S	S	*	*			cis	91.6	83.9	24.3	82.7	0	0	0	0	116.6
117	S	30.3	Very low	28.5	Very low	112 Å²	112	140.2 Å²	140.2	78%	0.783	75%	0.748	S	S	*	*			trans	176.3	151.4	157.3	42.9	0	0	0	0	111.1
118	H	30.5	Very low	28.4	Very low	151 Å²	151	141.6 Å²	141.6	70%	0.699	75%	0.749	S	S	*	*			cis	-171.2	137.1	-29.5	-123.6	-5.3	0	0	0	111.7
119	K	29.5	Very low	28.3	Very low	172 Å²	172	145 Å²	145	75%	0.748	76%	0.755	S	S	*	*			trans	65.7	158.8	152.2	-59.9	164.8	-178	169.4	0	116.4
120	K	31.1	Very low	28	Very low	194 Å²	194	140.2 Å²	140.2	84%	0.843	75%	0.751	S	S	*	*			cis	-119.1	171.5	3	-52.5	172.2	177.2	176.8	0	109.4
121	K	28.2	Very low	28	Very low	164 Å²	164	145.4 Å²	145.4	71%	0.713	76%	0.759	S	S	*	*			cis	63.5	147	33.8	-95.8	-165.7	162.8	-73.2	0	113.1	D123	K121-D123 IonicContact NZ-OD2 3.2Å; K121-D123 PolarHBondContact NZ-OD2 3.34Å
122	T	29.8	Very low	28	Very low	113 Å²	113	143.9 Å²	143.9	69%	0.693	76%	0.755	S	S	*	*			cis	-143.7	165.2	-1.5	49.3	0	0	0	0	108.8
123	D	27.7	Very low	28.1	Very low	106 Å²	106	147.5 Å²	147.5	57%	0.567	75%	0.749	S	S	*	*			cis	-167.3	-156.6	-32.4	-79.1	-31.1	0	0	0	105	K121	K121-D123 IonicContact NZ-OD2 3.2Å; K121-D123 PolarHBondContact NZ-OD2 3.34Å
124	E	27.9	Very low	28	Very low	177 Å²	177	147.1 Å²	147.1	83%	0.827	75%	0.747	S	S	*	*			trans	-14.1	167.9	159.6	-67.1	159.7	178.5	0	0	122.5
125	T	28.4	Very low	27.8	Very low	105 Å²	105	145.4 Å²	145.4	64%	0.644	75%	0.751	S	S	*	*			cis	-167.5	-179.9	-8.9	29.7	0	0	0	0	111
126	E	29.3	Very low	27.7	Very low	166 Å²	166	141.9 Å²	141.9	78%	0.776	75%	0.748	S	S	*	*			trans	68.9	158.7	160.3	-74.3	150.9	-114.8	0	0	118.2
127	L	29.4	Very low	28.6	Very low	160 Å²	160	143.4 Å²	143.4	84%	0.838	76%	0.756	S	S	*	*			cis	135.9	158.7	-11.6	-94.2	173.9	0	0	0	111.2
128	I	26.8	Very low	28.3	Very low	158 Å²	158	143.2 Å²	143.2	81%	0.81	76%	0.755	S	S	*	*			trans	90.2	153.5	171.3	-54.5	-175.5	0	0	0	117.1
129	Q	24.9	Very low	28.1	Very low	162 Å²	162	143 Å²	143	76%	0.757	76%	0.756	S	S	*	*			trans	-102.2	178.7	-159.8	-53.5	147.8	-92.3	0	0	114.1
130	V	25.3	Very low	28	Very low	128 Å²	128	144.9 Å²	144.9	78%	0.776	76%	0.758	S	S	*	*			trans	154.2	121.8	131.2	157.5	0	0	0	0	107.1
131	E	26.1	Very low	27.7	Very low	170 Å²	170	143.4 Å²	143.4	79%	0.794	76%	0.759	S	S	*	*			cis	123.4	179.7	24	-176.6	167.8	-108.2	0	0	108.3
132	V	27.2	Very low	28.1	Very low	125 Å²	125	141.4 Å²	141.4	76%	0.758	76%	0.763	S	S	*	*			trans	90.8	98.5	-173.1	-175.3	0	0	0	0	113.2
133	E	28.3	Very low	27.9	Very low	160 Å²	160	143 Å²	143	75%	0.748	76%	0.763	S	S	*	*				74.8	139.9	77.5	-96.9	-164.8	-159.9	0	0	114
134	Q	27.7	Very low	27.9	Very low	157 Å²	157	148.1 Å²	148.1	73%	0.734	77%	0.774	S	S	*	*			cis	-137.4	175.3	2.8	-52.6	-179.4	-13.5	0	0	107.9
135	T	25.3	Very low	27.7	Very low	132 Å²	132	144.4 Å²	144.4	81%	0.81	77%	0.774	S	S	*	*			cis	-159.6	164.7	30	48.8	0	0	0	0	111.8
136	G	23.4	Very low	27.4	Very low	69 Å²	69	144 Å²	144	71%	0.711	78%	0.776	S	S	*	*			trans	-143	-153	159.5	0	0	0	0	0	110.1
137	P	43.7	Very low	27.3	Very low	131 Å²	131	143.1 Å²	143.1	85%	0.851	78%	0.775	S	S	*	*			cis	-139	-141.2	-10.3	43	-22.8	0	0	0	111.9
138	S	24.5	Very low	27	Very low	107 Å²	107	143.2 Å²	143.2	75%	0.748	77%	0.771	S	S	*	*			trans	86.8	140.3	159	-134.4	0	0	0	0	117.4
139	M	26.7	Very low	26.9	Very low	147 Å²	147	140 Å²	140	72%	0.724	76%	0.763	S	S	*	*			cis	-160.2	177.3	-10	-119.6	-69.8	148.5	0	0	112.6
140	R	26.1	Very low	26.9	Very low	212 Å²	212	138.9 Å²	138.9	80%	0.8	77%	0.767	S	S	*	*			trans	-31.8	155.2	176.1	-70.3	155.6	179.7	169.4	-1.5	119.5
141	N	25.9	Very low	26.8	Very low	162 Å²	162	138.6 Å²	138.6	87%	0.866	77%	0.765	S	S	*	*			trans	-116.8	143.5	145.9	-103.2	-13.6	0	0	0	111
142	P	35.4	Very low	26.8	Very low	123 Å²	123	138.3 Å²	138.3	80%	0.799	77%	0.768	S	S	*	*			trans	-105.9	-170.4	-179.7	41.2	-35.5	0	0	0	114.5
143	E	26.1	Very low	26.8	Very low	145 Å²	145	135.7 Å²	135.7	68%	0.678	77%	0.766	S	S	*	*			trans	-90.8	163.6	-172.5	-51.2	-175.7	153	0	0	116.8
144	R	26.9	Very low	26.6	Very low	214 Å²	214	133.2 Å²	133.2	81%	0.808	77%	0.767	S	S	*	*			trans	78.8	151	134.1	-95.1	179.4	171.6	123.7	-7.1	122.7
145	A	24.4	Very low	26.5	Very low	99 Å²	99	132.2 Å²	132.2	82%	0.818	77%	0.765	S	S	*	*			trans	74.7	147.5	153.7	0	0	0	0	0	119.3
146	S	22.9	Very low	26.6	Very low	98 Å²	98	132.1 Å²	132.1	69%	0.685	76%	0.76	S	S	*	*			cis	-173.2	150.9	-27.4	-157.4	0	0	0	0	110.6
147	L	25.7	Very low	26.8	Very low	147 Å²	147	135 Å²	135	77%	0.77	75%	0.753	S	S	*	*			trans	61.4	165.6	160.4	-69.4	161.6	0	0	0	116.7
148	E	23.4	Very low	26	Very low	161 Å²	161	140.5 Å²	140.5	75%	0.752	76%	0.757	S	S	*	*			cis	-137.1	134.6	1.9	-111.7	142.9	-139.5	0	0	106.2
149	S	24.2	Very low	26	Very low	91 Å²	91	141.5 Å²	141.5	64%	0.636	75%	0.75	S	S	*	*				80	111.7	66.9	92.2	0	0	0	0	117.4
150	V	25	Very low	25.9	Very low	138 Å²	138	143.1 Å²	143.1	84%	0.836	76%	0.756	S	S	*	*			trans	-157.5	91	151.4	172.5	0	0	0	0	106
151	T	23.1	Very low	25.7	Very low	122 Å²	122	141.6 Å²	141.6	75%	0.748	76%	0.762	S	S	*	*				38.3	121.7	90	13.7	0	0	0	0	114.4
152	I	27.7	Very low	25.6	Very low	165 Å²	165	140.9 Å²	140.9	85%	0.846	76%	0.758	S	S	*	*				-152.7	135.7	59.3	-72.9	161	0	0	0	106.6
153	G	25.8	Very low	25.9	Very low	70 Å²	70	139.1 Å²	139.1	72%	0.722	75%	0.747	S	S	*	*				99.1	146.2	71.5	0	0	0	0	0	109.6
154	S	25.4	Very low	25.8	Very low	108 Å²	108	139.3 Å²	139.3	76%	0.755	75%	0.753	S	S	*	*			cis	-153.7	143.1	13.3	-118.3	0	0	0	0	108.7
155	L	25.8	Very low	25.7	Very low	135 Å²	135	133.1 Å²	133.1	71%	0.707	75%	0.747	S	S	*	*				78.4	138.3	86.6	-162.8	79.7	0	0	0	113.1
156	D	27.5	Very low	25.7	Very low	130 Å²	130	137.4 Å²	137.4	70%	0.695	75%	0.75	S	S	*	*			cis	-120.6	164.3	3.7	-83.8	-64.8	0	0	0	111
157	K	26.6	Very low	25.8	Very low	131 Å²	131	141.4 Å²	141.4	57%	0.57	76%	0.755	S	S	*	*			cis	103.7	112.2	8.1	-161.3	-148.9	-170.4	-156.2	0	117.2	E159	K157-E159 VanDerWaalsContact CE-OE1 3.29Å; K157-E159 WeakPolarHBondContact CE-OE1 3.29Å; K157-E159 IonicContact NZ-OE1 3.88Å; K157-E159 PolarHBondContact NZ-OE1 2.87Å
158	W	27.2	Very low	25.7	Very low	246 Å²	246	142.2 Å²	142.2	93%	0.932	76%	0.761	S	S	*	*			trans	-157.5	97.6	152.1	-78.7	90.8	0	0	0	106.1
159	E	24.7	Very low	25.7	Very low	127 Å²	127	138.4 Å²	138.4	59%	0.593	76%	0.764	S	S	*	*				51.8	96.9	92.9	-66.2	-174.2	-171.5	0	0	112.9	K157	K157-E159 VanDerWaalsContact CE-OE1 3.29Å; K157-E159 WeakPolarHBondContact CE-OE1 3.29Å; K157-E159 IonicContact NZ-OE1 3.88Å; K157-E159 PolarHBondContact NZ-OE1 2.87Å
160	E	23.1	Very low	25.8	Very low	182 Å²	182	141.8 Å²	141.8	85%	0.85	78%	0.775	S	S	*	*				63.5	113.5	63	-73.9	-152	137.4	0	0	116.8
161	L	22.1	Very low	25.8	Very low	179 Å²	179	145.2 Å²	145.2	94%	0.937	77%	0.773	S	S	*	*			trans	-144.1	140.9	142.9	-84.5	-175.9	0	0	0	110.5
162	N	24.6	Very low	25.9	Very low	147 Å²	147	149 Å²	149	79%	0.786	78%	0.779	S	S	*	*			trans	-165.8	179	-174.2	-133.6	-14.4	0	0	0	106.5
163	P	42.1	Very low	25.7	Very low	86 Å²	86	152 Å²	152	56%	0.558	78%	0.78	S	S	*	*			cis	-136.7	-158.3	-10.7	36.6	-14.2	0	0	0	113.5
164	N	24.4	Very low	25.5	Very low	149 Å²	149	158.1 Å²	158.1	80%	0.797	79%	0.787	S	S	*	*			trans	98.9	144.1	158.7	-57.5	-39.2	0	0	0	118.1
165	A	24	Very low	25.5	Very low	84 Å²	84	160.5 Å²	160.5	69%	0.694	79%	0.79	S	S	*	*			cis	-170.1	176.9	-19.9	0	0	0	0	0	111
166	E	23.5	Very low	25.2	Very low	189 Å²	189	162.7 Å²	162.7	88%	0.883	80%	0.797	S	S	*	*			trans	104.2	168.8	159.8	-58.5	-107.9	105.6	0	0	118.4
167	K	26.6	Very low	25	Very low	182 Å²	182	167.7 Å²	167.7	79%	0.791	81%	0.806	S	S	*	*			trans	-133.6	172.7	-144.6	-66.2	175.5	178.2	169.9	0	115.1
168	N	24	Very low	24.7	Very low	165 Å²	165	173.7 Å²	173.7	88%	0.882	83%	0.825	S	S	*	*			trans	81.2	130.4	158.8	-61.9	-26.2	0	0	0	118
169	G	23.4	Very low	24.4	Very low	80 Å²	80	173.6 Å²	173.6	83%	0.825	82%	0.824	S	S	*	*			trans	-176.1	29.3	178.2	0	0	0	0	0	116.3	R171	G169-R171 PolarHBondContact O-N 3.48Å
170	N	24.3	Very low	24.2	Very low	162 Å²	162	172.8 Å²	172.8	87%	0.866	83%	0.833	S	S	*	*			trans	-71.3	119.5	-172.8	-155.4	-2.2	0	0	0	112.2
171	R	25.3	Very low	24.3	Very low	211 Å²	211	168.5 Å²	168.5	80%	0.796	82%	0.823	S	S	*	*			trans	-158.7	117.9	168.1	-109	157.2	-150.7	-148.1	2.9	113.8	G169	G169-R171 PolarHBondContact O-N 3.48Å
172	K	25	Very low	24.4	Very low	202 Å²	202	168.6 Å²	168.6	88%	0.878	82%	0.816	S	S	*	*			trans	-71.7	150.4	162.1	-68.5	176.9	176	176.7	0	109.9
173	W	23.8	Very low	24.4	Very low	226 Å²	226	169.1 Å²	169.1	86%	0.856	82%	0.819	S	S	*	*			trans	-120.7	128.8	164.6	-72.6	101.9	0	0	0	111.5
174	K	23	Very low	23.5	Very low	200 Å²	200	170.4 Å²	170.4	87%	0.87	83%	0.83	S	S	*	*			trans	-142	114	168.2	-105.1	-163	175.2	-168.1	0	107.1
175	L	23.8	Very low	23.7	Very low	157 Å²	157	167.8 Å²	167.8	82%	0.822	82%	0.823	S	S	*	*			trans	-176	115.4	155.8	-124	56.7	0	0	0	104.3
176	E	21.3	Very low	23.8	Very low	182 Å²	182	171.3 Å²	171.3	85%	0.85	83%	0.83	S	S	*	*				79.4	134	56.4	-166.7	165.5	-141.8	0	0	113.1
177	R	22.1	Very low	24	Very low	235 Å²	235	169.6 Å²	169.6	89%	0.887	82%	0.822	S	S	*	*			trans	-84.3	134.5	-161.2	-76.6	171.7	-92.5	178.1	-9.6	113.2
178	R	20.7	Very low	23.9	Very low	256 Å²	256	170.3 Å²	170.3	97%	0.966	83%	0.826	S	S	*	*				-162	172.9	125.7	-108.9	164	-170	-129.8	-0.1	113.5
179	R	21.1	Very low	24	Very low	244 Å²	244	169.2 Å²	169.2	92%	0.921	82%	0.819	S	S	*	*			trans	-95.7	171.9	-156.9	-68.3	176.7	167.3	174.2	-6	114.5
180	S	20.8	Very low	24	Very low	110 Å²	110	177 Å²	177	77%	0.769	82%	0.824	S	S	*	*			trans	87.5	137.3	159.9	157	0	0	0	0	117.6
181	S	23.8	Very low	24	Very low	93 Å²	93	174.3 Å²	174.3	65%	0.65	82%	0.818	S	S	*	*			cis	-168.3	165.1	-16.8	51.7	0	0	0	0	112.2
182	K	25.3	Very low	23.9	Very low	181 Å²	181	171.5 Å²	171.5	79%	0.787	82%	0.817	S	S	*	*			trans	76.9	111.8	163.3	-63.2	-175.5	178.5	-177.9	0	119.9
183	N	25	Very low	23.8	Very low	157 Å²	157	167.5 Å²	167.5	84%	0.84	81%	0.805	S	S	*	*			trans	71.8	149.4	141	-58.7	28	0	0	0	118.3
184	S	23.3	Very low	23.8	Very low	114 Å²	114	162.2 Å²	162.2	80%	0.797	80%	0.801	S	S	*	*			cis	-124	134.8	1.7	53.1	0	0	0	0	112.3
185	S	27.3	Very low	23.8	Very low	94 Å²	94	160.1 Å²	160.1	66%	0.657	79%	0.792	S	S	*	*			trans	-84.5	162.3	172.6	44.1	0	0	0	0	112.3
186	N	26.5	Very low	23.8	Very low	158 Å²	158	160.6 Å²	160.6	85%	0.845	79%	0.794	S	S	*	*			trans	-143.3	73.2	161.5	-134.9	20.9	0	0	0	107.7
187	E	27.5	Very low	23.9	Very low	152 Å²	152	161.1 Å²	161.1	71%	0.71	80%	0.796	S	S	*	*			trans	-107.6	128.6	178.4	-67.3	171.4	155.8	0	0	108.6
188	F	25.5	Very low	24.1	Very low	198 Å²	198	154.9 Å²	154.9	87%	0.868	79%	0.789	S	S	*	*			trans	-100	90.5	170.8	-86.8	-79.9	0	0	0	109.9
189	L	25.3	Very low	24.2	Very low	141 Å²	141	150.9 Å²	150.9	74%	0.738	79%	0.787	S	S	*	*			trans	-74.9	132.1	170.5	-71	165.6	0	0	0	110.4
190	W	22.6	Very low	24.3	Very low	243 Å²	243	144.6 Å²	144.6	92%	0.92	78%	0.78	S	S	*	*			trans	-89.7	121.3	154	-83.2	76.4	0	0	0	108.6
191	S	24.6	Very low	24.6	Very low	107 Å²	107	147.2 Å²	147.2	75%	0.748	79%	0.786	S	S	*	*			trans	-157.1	124.6	170.6	-75.3	0	0	0	0	109.2
192	I	23.9	Very low	24.9	Very low	151 Å²	151	152.6 Å²	152.6	77%	0.774	80%	0.797	S	S	*	*			trans	-89.9	117.3	-177.2	-63.2	169.8	0	0	0	108.6
193	D	23.3	Very low	25	Very low	119 Å²	119	151.1 Å²	151.1	64%	0.636	80%	0.798	S	S	*	*			trans	-107.6	84.7	179.6	-169	14.2	0	0	0	111.3	K195	D193-K195 PolarHBondContact O-N 3.15Å; D193-K195 IonicContact OD1-NZ 2.73Å; D193-K195 PolarHBondContact OD1-NZ 3.3Å; D193-K195 IonicContact OD2-NZ 2.78Å; D193-K195 PolarHBondContact OD2-NZ 3.43Å
194	C	22.9	Very low	25	Very low	114 Å²	114	150.7 Å²	150.7	77%	0.77	80%	0.795	S	S	*	*			trans	-72.1	95.2	177.7	-81	0	0	0	0	111.8
195	K	23.8	Very low	25.2	Very low	156 Å²	156	151.9 Å²	151.9	68%	0.678	79%	0.791	S	S	*	*			trans	-106.1	102.9	170.8	-76.9	-175.1	175.2	66.4	0	113	D193	D193-K195 PolarHBondContact O-N 3.15Å; D193-K195 IonicContact OD1-NZ 2.73Å; D193-K195 PolarHBondContact OD1-NZ 3.3Å; D193-K195 IonicContact OD2-NZ 2.78Å; D193-K195 PolarHBondContact OD2-NZ 3.43Å
196	I	23.8	Very low	25.2	Very low	168 Å²	168	156 Å²	156	86%	0.862	80%	0.8	S	S	*	*			trans	-65.8	133.8	160.4	-61.1	166.5	0	0	0	108.4
197	Q	23.7	Very low	25.1	Very low	192 Å²	192	152 Å²	152	90%	0.897	79%	0.789	S	S	*	*			trans	-130.2	148.1	160.5	-95.5	-170.1	-7.5	0	0	111.6
198	S	24.6	Very low	25.1	Very low	104 Å²	104	151.9 Å²	151.9	73%	0.727	79%	0.794	S	S	*	*			trans	-102.6	129.4	-170.1	54.1	0	0	0	0	111.8
199	D	23.6	Very low	25.2	Very low	173 Å²	173	149 Å²	149	93%	0.925	79%	0.792	S	S	*	*			trans	-66.1	148.2	167.8	-84.8	-42.1	0	0	0	112.1
200	S	24.3	Very low	25.4	Very low	112 Å²	112	151.7 Å²	151.7	78%	0.783	80%	0.798	S	S	*	*			trans	-148.4	110.1	172.4	-79.4	0	0	0	0	110.8
201	N	26.9	Very low	25.6	Very low	165 Å²	165	144.5 Å²	144.5	88%	0.882	79%	0.79	S	S	*	*			trans	-66.1	139.5	-178.9	-81.3	-51	0	0	0	113
202	K	29.3	Very low	25.7	Very low	205 Å²	205	147.9 Å²	147.9	89%	0.891	80%	0.795	S	S	*	*			trans	-156.8	148.8	148.8	-109	157.3	-170.9	174.2	0	111
203	N	26.6	Very low	26.6	Very low	151 Å²	151	145.1 Å²	145.1	81%	0.807	79%	0.786	S	S	*	*			trans	-84.9	163.9	-176.5	-48.5	-54	0	0	0	111.2
204	L	25.1	Very low	26.8	Very low	148 Å²	148	148.2 Å²	148.2	78%	0.775	80%	0.797	S	S	*	*				163.1	125.9	91.7	-161.9	71.6	0	0	0	114.5
205	L	27.7	Very low	26.9	Very low	138 Å²	138	147.9 Å²	147.9	72%	0.723	80%	0.796	S	S	*	*			trans	56.9	157.2	149.4	-76.3	170.9	0	0	0	125.1
206	E	27	Very low	27	Very low	180 Å²	180	144.4 Å²	144.4	84%	0.841	80%	0.796	S	S	*	*			trans	67	147.3	159.4	-72	171.8	-148.4	0	0	120.1
207	A	26.2	Very low	27.2	Very low	75 Å²	75	145 Å²	145	62%	0.62	80%	0.8	S	S	*	*			cis	-165	151.8	-26	0	0	0	0	0	112.4
208	N	26.5	Very low	27.2	Very low	149 Å²	149	139.5 Å²	139.5	80%	0.797	79%	0.788	S	S	*	*			trans	45.3	114.9	151.8	-66.7	-33	0	0	0	121.7
209	T	28.4	Very low	27.4	Very low	137 Å²	137	140 Å²	140	84%	0.84	79%	0.791	S	S	*	*				163.7	152.3	113.9	34.8	0	0	0	0	109.2
210	K	28.5	Very low	27.7	Very low	198 Å²	198	141.4 Å²	141.4	86%	0.861	79%	0.792	S	S	*	*			cis	174.6	156.8	-26.1	-125.3	-170.7	178.2	-173.9	0	104.5
211	A	26.5	Very low	27.9	Very low	92 Å²	92	143.1 Å²	143.1	76%	0.76	79%	0.792	S	S	*	*			trans	74.1	117.5	174.7	0	0	0	0	0	115.5
212	E	26.6	Very low	28	Very low	179 Å²	179	140.6 Å²	140.6	84%	0.836	78%	0.778	S	S	*	*				96.4	148.5	54	-77.3	-69.7	103.2	0	0	111.8
213	P	43.4	Very low	28	Very low	92 Å²	92	139.7 Å²	139.7	60%	0.597	77%	0.769	S	S	*	*				-136	-152.6	-121.4	41.2	-21.7	0	0	0	114.8
214	E	28.7	Very low	28	Very low	184 Å²	184	141.7 Å²	141.7	86%	0.86	77%	0.774	S	S	*	*			trans	73.9	159.4	165.2	-79.2	-178.7	-156.8	0	0	117.2
215	S	24.2	Very low	28.1	Very low	107 Å²	107	144.1 Å²	144.1	75%	0.748	77%	0.774	S	S	*	*			cis	-144.3	174.6	3.9	131.8	0	0	0	0	112.9
216	A	25.5	Very low	28.1	Very low	83 Å²	83	145.1 Å²	145.1	69%	0.686	78%	0.779	S	S	*	*			trans	-55.8	157.6	-170.9	0	0	0	0	0	118.4
217	L	27.7	Very low	28.2	Very low	180 Å²	180	141.7 Å²	141.7	94%	0.942	78%	0.775	S	S	*	*				-137.7	139	128.5	-114.5	172.2	0	0	0	109.3
218	A	25.1	Very low	28.1	Very low	77 Å²	77	141.5 Å²	141.5	64%	0.636	78%	0.779	S	S	*	*			trans	-146	165.1	-168.8	0	0	0	0	0	112.7
219	S	27.3	Very low	28.2	Very low	114 Å²	114	146.5 Å²	146.5	80%	0.797	79%	0.787	S	S	*	*			trans	86.8	101	165.9	-44.4	0	0	0	0	117.7
220	Q	30.2	Very low	28.3	Very low	203 Å²	203	149.4 Å²	149.4	95%	0.949	79%	0.791	S	S	*	*				-136.2	132.2	128.2	-139.9	167.6	9.6	0	0	110.3
221	L	29.5	Very low	28.4	Very low	149 Å²	149	144.2 Å²	144.2	78%	0.78	79%	0.785	S	S	*	*			trans	-89.5	172.8	179.8	-64.3	156.8	0	0	0	108.6
222	N	28.8	Very low	29.1	Very low	112 Å²	112	151.6 Å²	151.6	60%	0.599	79%	0.793	S	S	*	*			cis	-167.9	169.2	9.9	-127.3	-24.2	0	0	0	106.2
223	R	29.4	Very low	29.5	Very low	185 Å²	185	149.4 Å²	149.4	70%	0.698	79%	0.786	S	S	*	*			cis	-168.1	132.9	-4.7	-170.1	-157.3	-53.4	-102.6	3.8	108.8
224	Q	26.9	Very low	29.2	Very low	194 Å²	194	149.3 Å²	149.3	91%	0.907	78%	0.784	S	S	*	*			trans	-160.7	147.6	143.8	-118.5	171.2	7.5	0	0	113.7
225	Y	26	Very low	29.7	Very low	199 Å²	199	149.5 Å²	149.5	78%	0.78	78%	0.782	S	S	*	*			trans	-92.9	168.4	177.7	-86.9	-122.8	0	0	0	108.9
226	I	28.7	Very low	30.3	Very low	159 Å²	159	150.9 Å²	150.9	82%	0.815	78%	0.777	S	S	*	*			cis	-148.6	159.6	46.5	-70.7	170	0	0	0	111.6
227	S	27.4	Very low	31	Very low	108 Å²	108	153.1 Å²	153.1	76%	0.755	77%	0.773	S	S	*	*			trans	-45.1	155.4	171.8	-44	0	0	0	0	115.7
228	G	25.6	Very low	31.6	Very low	70 Å²	70	154.9 Å²	154.9	72%	0.722	77%	0.767	S	S	*	*			cis	122.6	131.6	-0.6	0	0	0	0	0	114
229	R	27.3	Very low	32.1	Very low	254 Å²	254	160.2 Å²	160.2	96%	0.958	77%	0.771	S	S	*	*			trans	-162.8	152.1	162.8	-110.7	177.9	-171.5	-152.9	0.7	110.9
230	H	30.9	Very low	32.6	Very low	198 Å²	198	156.6 Å²	156.6	92%	0.917	75%	0.752	S	S	*	*			trans	-78.6	139	178.6	-67.5	-81.6	0	0	0	112.8
231	A	31.1	Very low	33.3	Very low	90 Å²	90	150.5 Å²	150.5	74%	0.744	73%	0.732	S	S	*	*			trans	-143.2	129.7	149.6	0	0	0	0	0	108.7	L233	A231-L233 PolarHBondContact O-N 2.92Å
232	R	40.7	Very low	34.1	Very low	246 Å²	246	146.4 Å²	146.4	93%	0.928	72%	0.719	S	S	*	*			trans	-78.1	115.8	166.8	-74.8	177.6	172.7	174.9	-3.5	107.4
233	L	35.8	Very low	34.7	Very low	133 Å²	133	145.8 Å²	145.8	70%	0.696	72%	0.716	S	S	*	*			trans	-87.7	128.9	164.9	-69.3	176.2	0	0	0	109.2	A231	A231-L233 PolarHBondContact O-N 2.92Å
234	T	36.1	Very low	35.6	Very low	90 Å²	90	143 Å²	143	55%	0.552	71%	0.714	S	S	*	*			trans	-79.6	169.5	-176.9	54.6	0	0	0	0	111.7	E236	T234-E236 WeakPolarHBondContact CB-OE2 3.35Å; T234-E236 PolarHBondContact O-N 3.15Å; T234-E236 PolarHBondContact OG1-OE2 2.86Å
235	K	38.6	Very low	36.6	Very low	188 Å²	188	137 Å²	137	82%	0.817	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.6	-10	-172.7	-159.5	175	178.9	-175.6	0	113.8
236	E	38.5	Very low	37.6	Very low	137 Å²	137	136.2 Å²	136.2	64%	0.64	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.4	-32.9	-170.8	-65.9	129.5	148	0	0	114.3	T234 R238 W239	T234-E236 WeakPolarHBondContact CB-OE2 3.35Å; T234-E236 PolarHBondContact O-N 3.15Å; T234-E236 PolarHBondContact OG1-OE2 2.86Å; E236-R238 PolarHBondContact O-N 2.92Å; E236-R238 VanDerWaalsContact O-N 3.11Å; E236-W239 PolarHBondContact O-N 3.04Å; E236-W239 VanDerWaalsContact O-N 3.08Å
237	Q	39.7	Very low	38.6	Very low	129 Å²	129	134.7 Å²	134.7	60%	0.603	68%	0.678	S	S	*	*	H	α-helix	trans	-64.4	-20.8	-175.7	-85	-168.6	-25.5	0	0	114.6	W239	Q237-W239 VanDerWaalsContact C-N 3.29Å; Q237-W239 PolarHBondContact O-N 3.33Å
238	R	40.1	Very low	39.6	Very low	217 Å²	217	135.1 Å²	135.1	82%	0.819	67%	0.668	S	S	*	*	H	α-helix	trans	-67.7	-26.4	174.7	-82.8	-171.3	172.7	-172.8	-2.5	113.6	E236 A242	E236-R238 PolarHBondContact O-N 2.92Å; E236-R238 VanDerWaalsContact O-N 3.11Å; R238-A242 PolarHBondContact O-N 3.35Å
239	W	35.5	Very low	41.3	Very low	189 Å²	189	134.4 Å²	134.4	72%	0.716	65%	0.653	S	S	*	*	H	α-helix	trans	-80	-38.3	-173.9	-71	58.6	0	0	0	111.6	E236 Q237 A242 L243	E236-W239 PolarHBondContact O-N 3.04Å; E236-W239 VanDerWaalsContact O-N 3.08Å; Q237-W239 VanDerWaalsContact C-N 3.29Å; Q237-W239 PolarHBondContact O-N 3.33Å; W239-A242 PolarHBondContact O-N 2.92Å; W239-L243 WeakPolarHBondContact O-CG 3.41Å; W239-L243 PolarHBondContact O-N 3.04Å
240	G	38.7	Very low	42.6	Very low	38 Å²	38	127.3 Å²	127.3	39%	0.392	63%	0.633	S	S	.	*	H	α-helix	trans	-60.9	-46	174.2	0	0	0	0	0	112.9	A242 L243 L244	G240-A242 PolarHBondContact O-N 3.5Å; G240-L243 PolarHBondContact O-N 3.19Å; G240-L244 WeakPolarHBondContact O-CB 3.4Å; G240-L244 WeakPolarHBondContact O-CG 3.41Å; G240-L244 PolarHBondContact O-N 2.85Å
241	S	44.3	Very low	44.4	Very low	76 Å²	76	123.3 Å²	123.3	53%	0.531	62%	0.615	S	S	.	*	H	α-helix	trans	-65.2	-38.3	178.9	-165.8	0	0	0	0	112.7	S245	S241-S245 PolarHBondContact O-N 3.23Å; S241-S245 PolarHBondContact O-OG 2.88Å
242	A	45.4	Very low	46.2	Very low	62 Å²	62	123.7 Å²	123.7	51%	0.512	60%	0.601	S	S	.	*	H	α-helix	trans	-69	-37.6	178.1	0	0	0	0	0	112.4	R238 W239 G240 R246	R238-A242 PolarHBondContact O-N 3.35Å; W239-A242 PolarHBondContact O-N 2.92Å; G240-A242 PolarHBondContact O-N 3.5Å; A242-R246 VanDerWaalsContact O-CB 3.28Å; A242-R246 WeakPolarHBondContact O-CB 3.4Å; A242-R246 PolarHBondContact O-N 3.09Å
243	L	42.6	Very low	47.1	Very low	100 Å²	100	116.8 Å²	116.8	52%	0.524	58%	0.579	S	S	.	*	H	α-helix	trans	-70.2	-40.1	175	-71.8	170	0	0	0	112.1	W239 G240 R246 H247	W239-L243 WeakPolarHBondContact O-CG 3.41Å; W239-L243 PolarHBondContact O-N 3.04Å; G240-L243 PolarHBondContact O-N 3.19Å; L243-R246 PolarHBondContact O-N 3.11Å; L243-H247 PolarHBondContact O-CD2 3.31Å; L243-H247 PolarHBondContact O-N 3.11Å
244	L	46.8	Very low	48.5	Very low	125 Å²	125	116.3 Å²	116.3	65%	0.654	57%	0.572	S	S	*	*	H	α-helix	trans	-63.5	-48.6	175.2	-75.6	166.8	0	0	0	111.8	G240 R246 H247 Q248	G240-L244 WeakPolarHBondContact O-CB 3.4Å; G240-L244 WeakPolarHBondContact O-CG 3.41Å; G240-L244 PolarHBondContact O-N 2.85Å; L244-R246 VanDerWaalsContact C-N 3.27Å; L244-R246 PolarHBondContact O-N 3.37Å; L244-H247 PolarHBondContact O-N 3.07Å; L244-Q248 WeakPolarHBondContact O-CB 3.36Å; L244-Q248 PolarHBondContact O-N 3.3Å
245	S	49	Very low	49.9	Very low	70 Å²	70	116.1 Å²	116.1	49%	0.49	57%	0.565	S	S	.	*	H	α-helix	trans	-63	-32.1	174.9	-64	0	0	0	0	112.8	S241 S249	S241-S245 PolarHBondContact O-N 3.23Å; S241-S245 PolarHBondContact O-OG 2.88Å; S245-S249 VanDerWaalsContact O-CB 3.29Å; S245-S249 WeakPolarHBondContact O-CB 3.41Å; S245-S249 PolarHBondContact O-N 3.34Å
246	R	46.8	Very low	51.2	Low	181 Å²	181	114.1 Å²	114.1	68%	0.683	55%	0.552	S	S	*	*	H	α-helix	trans	-71.9	-39.7	175.5	-171.4	177.2	-177.9	-163.5	-0.7	112.6	A242 L243 L244 L250	A242-R246 VanDerWaalsContact O-CB 3.28Å; A242-R246 WeakPolarHBondContact O-CB 3.4Å; A242-R246 PolarHBondContact O-N 3.09Å; L243-R246 PolarHBondContact O-N 3.11Å; L244-R246 VanDerWaalsContact C-N 3.27Å; L244-R246 PolarHBondContact O-N 3.37Å; R246-L250 PolarHBondContact O-N 2.75Å; R246-L250 VanDerWaalsContact O-N 3.07Å
247	H	48.7	Very low	51.9	Low	127 Å²	127	110.3 Å²	110.3	59%	0.588	54%	0.544	S	S	*	.	H	α-helix	trans	-65	-44.6	172.2	-91.8	-80.4	0	0	0	111.3	L243 L244 S249 L250 E251	L243-H247 PolarHBondContact O-CD2 3.31Å; L243-H247 PolarHBondContact O-N 3.11Å; L244-H247 PolarHBondContact O-N 3.07Å; H247-S249 VanDerWaalsContact C-N 3.34Å; H247-S249 PolarHBondContact O-N 3.11Å; H247-L250 PolarHBondContact O-N 2.87Å; H247-L250 VanDerWaalsContact O-N 3.1Å; H247-E251 WeakPolarHBondContact O-CB 3.45Å; H247-E251 PolarHBondContact O-N 2.96Å
248	Q	49.5	Very low	52.7	Low	117 Å²	117	107.4 Å²	107.4	55%	0.547	53%	0.529	S	S	.	.	H	α-helix	trans	-61.9	-40.7	177	-172.9	173	-7	0	0	112.1	L244 L250 E251 E252	L244-Q248 WeakPolarHBondContact O-CB 3.36Å; L244-Q248 PolarHBondContact O-N 3.3Å; Q248-L250 VanDerWaalsContact C-N 3.32Å; Q248-L250 PolarHBondContact O-N 2.9Å; Q248-E251 PolarHBondContact O-N 3.42Å; Q248-E252 WeakPolarHBondContact CG-OE1 3.35Å; Q248-E252 PolarHBondContact NE2-OE1 2.88Å; Q248-E252 WeakPolarHBondContact O-CB 3.44Å; Q248-E252 WeakPolarHBondContact O-CG 3.47Å; Q248-E252 PolarHBondContact O-N 3.29Å
249	S	61.8	Low	53.7	Low	56 Å²	56	99.4 Å²	99.4	39%	0.392	51%	0.51	S	S	.	.	H	α-helix	trans	-61	-38.6	172.1	-171.4	0	0	0	0	112.7	S245 H247 E253	S245-S249 VanDerWaalsContact O-CB 3.29Å; S245-S249 WeakPolarHBondContact O-CB 3.41Å; S245-S249 PolarHBondContact O-N 3.34Å; H247-S249 VanDerWaalsContact C-N 3.34Å; H247-S249 PolarHBondContact O-N 3.11Å; S249-E253 WeakPolarHBondContact O-CB 3.25Å; S249-E253 WeakPolarHBondContact O-CG 3.48Å; S249-E253 PolarHBondContact O-N 3.46Å
250	L	54.5	Low	54.4	Low	104 Å²	104	92.7 Å²	92.7	55%	0.545	50%	0.495	S	S	.	.	H	α-helix	trans	-73.8	-35.5	179.1	-140.9	80.5	0	0	0	111.9	R246 H247 Q248 E253 F254	R246-L250 PolarHBondContact O-N 2.75Å; R246-L250 VanDerWaalsContact O-N 3.07Å; H247-L250 PolarHBondContact O-N 2.87Å; H247-L250 VanDerWaalsContact O-N 3.1Å; Q248-L250 VanDerWaalsContact C-N 3.32Å; Q248-L250 PolarHBondContact O-N 2.9Å; L250-E253 PolarHBondContact O-N 3.29Å; L250-F254 VanDerWaalsContact O-CB 3.3Å; L250-F254 WeakPolarHBondContact O-CB 3.44Å; L250-F254 PolarHBondContact O-N 3.04Å
251	E	69.1	Low	54.8	Low	115 Å²	115	95.2 Å²	95.2	54%	0.537	50%	0.502	S	S	.	.	H	α-helix	trans	-66.9	-42.2	173.7	-154.1	76.7	-158.2	0	0	110.6	H247 Q248 E253 F254 E255	H247-E251 WeakPolarHBondContact O-CB 3.45Å; H247-E251 PolarHBondContact O-N 2.96Å; Q248-E251 PolarHBondContact O-N 3.42Å; E251-E253 VanDerWaalsContact C-N 3.32Å; E251-E253 PolarHBondContact O-N 2.82Å; E251-F254 PolarHBondContact O-N 3.32Å; E251-E255 WeakPolarHBondContact O-CB 3.13Å; E251-E255 PolarHBondContact O-N 3.41Å
252	E	67.7	Low	55	Low	97 Å²	97	95.5 Å²	95.5	45%	0.453	50%	0.495	S	S	.	.	H	α-helix	trans	-68.9	-27.5	174.4	-73.9	175.4	-154.1	0	0	112.8	Q248 R256	Q248-E252 WeakPolarHBondContact CG-OE1 3.35Å; Q248-E252 PolarHBondContact NE2-OE1 2.88Å; Q248-E252 WeakPolarHBondContact O-CB 3.44Å; Q248-E252 WeakPolarHBondContact O-CG 3.47Å; Q248-E252 PolarHBondContact O-N 3.29Å; E252-R256 WeakPolarHBondContact O-CB 3.17Å; E252-R256 PolarHBondContact O-N 3.17Å; E252-R256 PolarHBondContact O-NH1 3.3Å; E252-R256 VanDerWaalsContact O-NH1 3.12Å; E252-R256 PolarHBondContact O-NH2 3.14Å
253	E	59.2	Low	55.3	Low	102 Å²	102	95.8 Å²	95.8	48%	0.477	49%	0.493	S	S	.	.	H	α-helix	trans	-75.3	-40.7	169.1	-78.3	171.9	174.2	0	0	112	S249 L250 E251 R256 A257	S249-E253 WeakPolarHBondContact O-CB 3.25Å; S249-E253 WeakPolarHBondContact O-CG 3.48Å; S249-E253 PolarHBondContact O-N 3.46Å; L250-E253 PolarHBondContact O-N 3.29Å; E251-E253 VanDerWaalsContact C-N 3.32Å; E251-E253 PolarHBondContact O-N 2.82Å; E253-R256 PolarHBondContact O-N 3.44Å; E253-A257 WeakPolarHBondContact O-CB 3.4Å; E253-A257 PolarHBondContact O-N 2.99Å
254	F	66.2	Low	55.4	Low	123 Å²	123	95.3 Å²	95.3	54%	0.539	49%	0.491	S	S	.	.	H	α-helix	trans	-65.3	-50.7	176.6	177.4	-102	0	0	0	111.8	L250 E251 R256 A257 K258	L250-F254 VanDerWaalsContact O-CB 3.3Å; L250-F254 WeakPolarHBondContact O-CB 3.44Å; L250-F254 PolarHBondContact O-N 3.04Å; E251-F254 PolarHBondContact O-N 3.32Å; F254-R256 VanDerWaalsContact C-N 3.25Å; F254-R256 PolarHBondContact O-N 2.85Å; F254-A257 PolarHBondContact O-N 3.07Å; F254-K258 HydrophobicContact CE1-CD 4.08Å; F254-K258 HydrophobicContact CZ-CD 4.45Å; F254-K258 WeakPolarHBondContact O-CB 3.39Å; F254-K258 PolarHBondContact O-N 3.01Å
255	E	64.4	Low	55.8	Low	86 Å²	86	92.8 Å²	92.8	40%	0.402	48%	0.481	S	S	.	.	H	α-helix	trans	-66.4	-26.2	176.4	-77.9	-64.5	150	0	0	112.3	E251 K258 A259	E251-E255 WeakPolarHBondContact O-CB 3.13Å; E251-E255 PolarHBondContact O-N 3.41Å; E255-K258 IonicContact OE1-NZ 3.57Å; E255-K258 IonicContact OE2-NZ 2.78Å; E255-K258 PolarHBondContact OE2-NZ 2.8Å; E255-A259 WeakPolarHBondContact O-CB 3.2Å; E255-A259 PolarHBondContact O-N 2.84Å
256	R	65.8	Low	56.2	Low	145 Å²	145	96.2 Å²	96.2	55%	0.547	49%	0.489	S	S	.	.	H	α-helix	trans	-74.5	-38.9	171.7	-172.3	-177.6	-54.2	101.6	10.4	112.6	E252 E253 F254 A260	E252-R256 WeakPolarHBondContact O-CB 3.17Å; E252-R256 PolarHBondContact O-N 3.17Å; E252-R256 PolarHBondContact O-NH1 3.3Å; E252-R256 VanDerWaalsContact O-NH1 3.12Å; E252-R256 PolarHBondContact O-NH2 3.14Å; E253-R256 PolarHBondContact O-N 3.44Å; F254-R256 VanDerWaalsContact C-N 3.25Å; F254-R256 PolarHBondContact O-N 2.85Å; R256-A260 WeakPolarHBondContact O-CB 3.4Å; R256-A260 PolarHBondContact O-N 3.41Å
257	A	53.9	Low	56.3	Low	57 Å²	57	91.2 Å²	91.2	47%	0.471	47%	0.473	S	S	.	.	H	α-helix	trans	-69.3	-40.5	173.9	0	0	0	0	0	111.4	E253 F254 A260 V261	E253-A257 WeakPolarHBondContact O-CB 3.4Å; E253-A257 PolarHBondContact O-N 2.99Å; F254-A257 PolarHBondContact O-N 3.07Å; A257-A260 WeakPolarHBondContact O-CB 3.43Å; A257-A260 PolarHBondContact O-N 3.06Å; A257-V261 WeakPolarHBondContact O-CG2 3.4Å; A257-V261 PolarHBondContact O-N 2.98Å
258	K	56.5	Low	56.5	Low	69 Å²	69	91.7 Å²	91.7	30%	0.3	47%	0.469	S	S	.	.	H	α-helix	trans	-63.7	-47.2	173.3	176.9	179.2	149	-63.2	0	111.1	F254 E255 A260 V261 E262	F254-K258 HydrophobicContact CE1-CD 4.08Å; F254-K258 HydrophobicContact CZ-CD 4.45Å; F254-K258 WeakPolarHBondContact O-CB 3.39Å; F254-K258 PolarHBondContact O-N 3.01Å; E255-K258 IonicContact OE1-NZ 3.57Å; E255-K258 IonicContact OE2-NZ 2.78Å; E255-K258 PolarHBondContact OE2-NZ 2.8Å; K258-A260 VanDerWaalsContact C-N 3.28Å; K258-A260 PolarHBondContact O-N 3.42Å; K258-V261 CarbonylContact O-C 3.6Å; K258-V261 PolarHBondContact O-N 3.44Å; K258-E262 WeakPolarHBondContact CE-OE1 3.3Å; K258-E262 HydrophobicContact CG-CG 4.28Å; K258-E262 IonicContact NZ-OE1 3.05Å; K258-E262 PolarHBondContact NZ-OE1 2.81Å; K258-E262 IonicContact NZ-OE2 2.93Å; K258-E262 PolarHBondContact NZ-OE2 3.02Å; K258-E262 VanDerWaalsContact O-CB 3.3Å; K258-E262 WeakPolarHBondContact O-CB 3.24Å; K258-E262 VanDerWaalsContact O-CG 3.27Å; K258-E262 WeakPolarHBondContact O-CG 3.18Å; K258-E262 PolarHBondContact O-N 3.43Å
259	A	60.4	Low	56.9	Low	49 Å²	49	91.6 Å²	91.6	41%	0.405	47%	0.473	S	S	.	.	H	α-helix	trans	-64.9	-28.9	174.6	0	0	0	0	0	113.1	E255 S263	E255-A259 WeakPolarHBondContact O-CB 3.2Å; E255-A259 PolarHBondContact O-N 2.84Å; A259-S263 WeakPolarHBondContact O-CB 3.47Å; A259-S263 PolarHBondContact O-N 3.26Å
260	A	51.2	Low	56.8	Low	48 Å²	48	94.7 Å²	94.7	40%	0.397	48%	0.479	S	S	.	.	H	α-helix	trans	-69.1	-46.8	170.9	0	0	0	0	0	111.3	R256 A257 K258 S263 D264	R256-A260 WeakPolarHBondContact O-CB 3.4Å; R256-A260 PolarHBondContact O-N 3.41Å; A257-A260 WeakPolarHBondContact O-CB 3.43Å; A257-A260 PolarHBondContact O-N 3.06Å; K258-A260 VanDerWaalsContact C-N 3.28Å; K258-A260 PolarHBondContact O-N 3.42Å; A260-S263 PolarHBondContact O-N 3.49Å; A260-D264 WeakPolarHBondContact O-CB 3.44Å; A260-D264 VanDerWaalsContact O-CG 3.3Å; A260-D264 PolarHBondContact O-N 2.96Å
261	V	46.1	Very low	56.6	Low	91 Å²	91	91 Å²	91	55%	0.552	46%	0.459	S	S	*	.	H	α-helix	trans	-64.7	-41	175.1	172.3	0	0	0	0	111.8	A257 K258 D264 T265	A257-V261 WeakPolarHBondContact O-CG2 3.4Å; A257-V261 PolarHBondContact O-N 2.98Å; K258-V261 CarbonylContact O-C 3.6Å; K258-V261 PolarHBondContact O-N 3.44Å; V261-D264 PolarHBondContact O-N 3.34Å; V261-T265 WeakPolarHBondContact O-CG2 3.48Å; V261-T265 PolarHBondContact O-N 2.91Å; V261-T265 PolarHBondContact O-OG1 2.96Å
262	E	48.7	Very low	55.9	Low	82 Å²	82	89.5 Å²	89.5	38%	0.383	45%	0.452	S	S	.	.	H	α-helix	trans	-62.4	-45.8	174.5	-73.7	169.6	160.4	0	0	109.9	K258 D264 T265 E266	K258-E262 WeakPolarHBondContact CE-OE1 3.3Å; K258-E262 HydrophobicContact CG-CG 4.28Å; K258-E262 IonicContact NZ-OE1 3.05Å; K258-E262 PolarHBondContact NZ-OE1 2.81Å; K258-E262 IonicContact NZ-OE2 2.93Å; K258-E262 PolarHBondContact NZ-OE2 3.02Å; K258-E262 VanDerWaalsContact O-CB 3.3Å; K258-E262 WeakPolarHBondContact O-CB 3.24Å; K258-E262 VanDerWaalsContact O-CG 3.27Å; K258-E262 WeakPolarHBondContact O-CG 3.18Å; K258-E262 PolarHBondContact O-N 3.43Å; E262-D264 PolarHBondContact O-N 2.88Å; E262-T265 WeakPolarHBondContact CA-OG1 3.47Å; E262-T265 PolarHBondContact O-N 3.12Å; E262-T265 PolarHBondContact O-OG1 3.3Å; E262-E266 WeakPolarHBondContact O-CB 3.23Å; E262-E266 WeakPolarHBondContact O-CG 3.45Å; E262-E266 PolarHBondContact O-N 3.47Å
263	S	53.1	Low	55.6	Low	68 Å²	68	87.4 Å²	87.4	48%	0.476	45%	0.451	S	S	.	.	H	α-helix	trans	-63.2	-37.4	173.8	-177.1	0	0	0	0	113.2	A259 A260 F267	A259-S263 WeakPolarHBondContact O-CB 3.47Å; A259-S263 PolarHBondContact O-N 3.26Å; A260-S263 PolarHBondContact O-N 3.49Å; S263-F267 WeakPolarHBondContact O-CB 3.5Å; S263-F267 PolarHBondContact O-N 2.85Å
264	D	44.7	Very low	55.3	Low	89 Å²	89	87.2 Å²	87.2	48%	0.476	45%	0.451	S	S	.	.	H	α-helix	trans	-67.9	-42.9	174.9	-74.9	-17.6	0	0	0	109.8	A260 V261 E262 F267 W268	A260-D264 WeakPolarHBondContact O-CB 3.44Å; A260-D264 VanDerWaalsContact O-CG 3.3Å; A260-D264 PolarHBondContact O-N 2.96Å; V261-D264 PolarHBondContact O-N 3.34Å; E262-D264 PolarHBondContact O-N 2.88Å; D264-F267 CarbonylContact O-C 3.37Å; D264-F267 PolarHBondContact O-N 3.39Å; D264-W268 WeakPolarHBondContact O-CB 3.33Å; D264-W268 PolarHBondContact O-N 3.48Å
265	T	54.8	Low	54.6	Low	72 Å²	72	87.4 Å²	87.4	44%	0.442	45%	0.448	S	S	.	.	H	α-helix	trans	-66.4	-40.1	174.6	54.7	0	0	0	0	112.8	V261 E262 F267 W268 D269	V261-T265 WeakPolarHBondContact O-CG2 3.48Å; V261-T265 PolarHBondContact O-N 2.91Å; V261-T265 PolarHBondContact O-OG1 2.96Å; E262-T265 WeakPolarHBondContact CA-OG1 3.47Å; E262-T265 PolarHBondContact O-N 3.12Å; E262-T265 PolarHBondContact O-OG1 3.3Å; T265-F267 VanDerWaalsContact C-N 3.29Å; T265-F267 PolarHBondContact O-N 3.38Å; T265-W268 PolarHBondContact O-N 3.07Å; T265-D269 VanDerWaalsContact O-CB 3.3Å; T265-D269 WeakPolarHBondContact O-CB 3.34Å; T265-D269 PolarHBondContact O-N 3.03Å
266	E	56.6	Low	54.2	Low	143 Å²	143	88.9 Å²	88.9	67%	0.668	46%	0.455	S	S	*	.	H	α-helix	trans	-65	-34.8	173.4	-75.3	-174.4	179.4	0	0	111.3	E262 K270	E262-E266 WeakPolarHBondContact O-CB 3.23Å; E262-E266 WeakPolarHBondContact O-CG 3.45Å; E262-E266 PolarHBondContact O-N 3.47Å; E266-K270 WeakPolarHBondContact O-CB 3.45Å; E266-K270 PolarHBondContact O-N 3.03Å
267	F	50.1	Low	53.8	Low	75 Å²	75	84.3 Å²	84.3	33%	0.329	44%	0.439	S	S	.	.	H	α-helix	trans	-68.7	-43.6	172.9	172.1	-96.4	0	0	0	111.9	S263 D264 T265 K270 M271 M594	S263-F267 WeakPolarHBondContact O-CB 3.5Å; S263-F267 PolarHBondContact O-N 2.85Å; D264-F267 CarbonylContact O-C 3.37Å; D264-F267 PolarHBondContact O-N 3.39Å; T265-F267 VanDerWaalsContact C-N 3.29Å; T265-F267 PolarHBondContact O-N 3.38Å; F267-K270 PolarHBondContact O-N 2.9Å; F267-M271 HydrophobicContact CD1-CG 4.3Å; F267-M271 HydrophobicContact CD2-CG 4.3Å; F267-M271 HydrophobicContact CE1-CG 3.9Å; F267-M271 HydrophobicContact CE2-CG 3.9Å; F267-M271 HydrophobicContact CE2-SD 4.37Å; F267-M271 HydrophobicContact CG-CG 4.49Å; F267-M271 HydrophobicContact CZ-CG 3.68Å; F267-M271 HydrophobicContact CZ-SD 4.27Å; F267-M271 VanDerWaalsContact O-CB 3.25Å; F267-M271 WeakPolarHBondContact O-CB 3.35Å; F267-M271 VanDerWaalsContact O-CG 3.26Å; F267-M271 WeakPolarHBondContact O-CG 3.12Å; F267-M271 PolarHBondContact O-N 3.5Å; F267-M594 HydrophobicContact CE1-CE 3.83Å; F267-M594 HydrophobicContact CE1-SD 3.58Å; F267-M594 VanDerWaalsContact CE1-SD 3.58Å; F267-M594 HydrophobicContact CZ-CE 4.16Å; F267-M594 HydrophobicContact CZ-SD 3.77Å
268	W	51.7	Low	53.5	Low	138 Å²	138	84.6 Å²	84.6	52%	0.523	43%	0.433	S	S	.	.	H	α-helix	trans	-68.5	-41.4	176.3	-76.9	113.1	0	0	0	112.3	D264 T265 M271 Q272 M594	D264-W268 WeakPolarHBondContact O-CB 3.33Å; D264-W268 PolarHBondContact O-N 3.48Å; T265-W268 PolarHBondContact O-N 3.07Å; W268-M271 PolarHBondContact O-N 2.8Å; W268-Q272 WeakPolarHBondContact O-CB 3.33Å; W268-Q272 PolarHBondContact O-N 3.3Å; W268-M594 HydrophobicContact CE3-CE 4.18Å; W268-M594 HydrophobicContact CH2-CE 3.33Å; W268-M594 HydrophobicContact CH2-SD 4.17Å; W268-M594 HydrophobicContact CZ2-CE 4.04Å; W268-M594 HydrophobicContact CZ2-SD 4.42Å; W268-M594 HydrophobicContact CZ3-CE 3.41Å; W268-M594 VanDerWaalsContact CZ3-CE 3.41Å
269	D	58.1	Low	53.1	Low	115 Å²	115	83.6 Å²	83.6	62%	0.615	44%	0.438	S	S	*	.	H	α-helix	trans	-63.8	-40.4	172.8	-81.6	-16.4	0	0	0	111.2	T265 Q272 A273	T265-D269 VanDerWaalsContact O-CB 3.3Å; T265-D269 WeakPolarHBondContact O-CB 3.34Å; T265-D269 PolarHBondContact O-N 3.03Å; D269-Q272 PolarHBondContact O-N 2.89Å; D269-A273 VanDerWaalsContact O-CB 3.28Å; D269-A273 WeakPolarHBondContact O-CB 3.22Å; D269-A273 PolarHBondContact O-N 3.15Å
270	K	60.7	Low	52.4	Low	121 Å²	121	87.3 Å²	87.3	53%	0.526	44%	0.441	S	S	.	.	H	α-helix	trans	-67.9	-41.8	174.3	-178	176.9	176	-82.9	0	111.8	E266 F267 A273 E274	E266-K270 WeakPolarHBondContact O-CB 3.45Å; E266-K270 PolarHBondContact O-N 3.03Å; F267-K270 PolarHBondContact O-N 2.9Å; K270-A273 PolarHBondContact O-N 3.02Å; K270-E274 VanDerWaalsContact CE-OE1 3.29Å; K270-E274 WeakPolarHBondContact CE-OE1 3.45Å; K270-E274 IonicContact NZ-OE1 3.15Å; K270-E274 PolarHBondContact NZ-OE1 2.96Å; K270-E274 WeakPolarHBondContact O-CB 3.41Å; K270-E274 WeakPolarHBondContact O-CG 3.39Å; K270-E274 PolarHBondContact O-N 2.9Å
271	M	49.8	Very low	52.1	Low	25 Å²	25	91.6 Å²	91.6	12%	0.123	45%	0.447	C	S	.	.	H	α-helix	trans	-64.5	-41.9	175	-80.6	-64.3	-64.1	0	0	110.6	F267 W268 E274 W275 M594	F267-M271 HydrophobicContact CD1-CG 4.3Å; F267-M271 HydrophobicContact CD2-CG 4.3Å; F267-M271 HydrophobicContact CE1-CG 3.9Å; F267-M271 HydrophobicContact CE2-CG 3.9Å; F267-M271 HydrophobicContact CE2-SD 4.37Å; F267-M271 HydrophobicContact CG-CG 4.49Å; F267-M271 HydrophobicContact CZ-CG 3.68Å; F267-M271 HydrophobicContact CZ-SD 4.27Å; F267-M271 VanDerWaalsContact O-CB 3.25Å; F267-M271 WeakPolarHBondContact O-CB 3.35Å; F267-M271 VanDerWaalsContact O-CG 3.26Å; F267-M271 WeakPolarHBondContact O-CG 3.12Å; F267-M271 PolarHBondContact O-N 3.5Å; W268-M271 PolarHBondContact O-N 2.8Å; M271-E274 CarbonylContact O-C 3.56Å; M271-E274 PolarHBondContact O-N 3.37Å; M271-W275 VanDerWaalsContact O-CB 3.27Å; M271-W275 WeakPolarHBondContact O-CB 3.33Å; M271-W275 PolarHBondContact O-N 3.39Å; M271-M594 HydrophobicContact CE-CE 4.23Å
272	Q	53.6	Low	51.9	Low	84 Å²	84	90.9 Å²	90.9	39%	0.393	44%	0.44	S	S	.	.	H	α-helix	trans	-62	-43.7	173.2	177.3	64.1	18.3	0	0	111.2	W268 D269 W275 E276	W268-Q272 WeakPolarHBondContact O-CB 3.33Å; W268-Q272 PolarHBondContact O-N 3.3Å; D269-Q272 PolarHBondContact O-N 2.89Å; Q272-W275 CarbonylContact O-C 3.55Å; Q272-W275 WeakPolarHBondContact O-CB 3.13Å; Q272-W275 PolarHBondContact O-N 3.1Å; Q272-W275 VanDerWaalsContact O-N 3.15Å; Q272-E276 PolarHBondContact NE2-OE1 3.16Å; Q272-E276 WeakPolarHBondContact O-CB 3.25Å; Q272-E276 WeakPolarHBondContact O-CG 3.4Å; Q272-E276 PolarHBondContact O-N 3.33Å
273	A	61.7	Low	51.3	Low	53 Å²	53	95.2 Å²	95.2	44%	0.438	45%	0.453	S	S	.	.	H	α-helix	trans	-66.9	-37.2	175.6	0	0	0	0	0	112.5	D269 K270 W275 E277	D269-A273 VanDerWaalsContact O-CB 3.28Å; D269-A273 WeakPolarHBondContact O-CB 3.22Å; D269-A273 PolarHBondContact O-N 3.15Å; K270-A273 PolarHBondContact O-N 3.02Å; A273-W275 VanDerWaalsContact C-N 3.33Å; A273-E277 WeakPolarHBondContact O-CB 3.48Å; A273-E277 PolarHBondContact O-N 3.43Å
274	E	53.5	Low	50.3	Low	98 Å²	98	95.1 Å²	95.1	46%	0.458	45%	0.447	S	S	.	.	H	α-helix	trans	-69.4	-29.7	170.5	-74.9	-170.6	-148.9	0	0	111.8	K270 M271 L278	K270-E274 VanDerWaalsContact CE-OE1 3.29Å; K270-E274 WeakPolarHBondContact CE-OE1 3.45Å; K270-E274 IonicContact NZ-OE1 3.15Å; K270-E274 PolarHBondContact NZ-OE1 2.96Å; K270-E274 WeakPolarHBondContact O-CB 3.41Å; K270-E274 WeakPolarHBondContact O-CG 3.39Å; K270-E274 PolarHBondContact O-N 2.9Å; M271-E274 CarbonylContact O-C 3.56Å; M271-E274 PolarHBondContact O-N 3.37Å; E274-L278 WeakPolarHBondContact O-CB 3.23Å; E274-L278 PolarHBondContact O-N 2.97Å
275	W	50.9	Low	50	Low	128 Å²	128	93.9 Å²	93.9	49%	0.485	44%	0.442	S	S	.	.	H	α-helix	trans	-73.7	-43.3	175	-147.7	77.1	0	0	0	111.8	M271 Q272 A273 L278 A279	M271-W275 VanDerWaalsContact O-CB 3.27Å; M271-W275 WeakPolarHBondContact O-CB 3.33Å; M271-W275 PolarHBondContact O-N 3.39Å; Q272-W275 CarbonylContact O-C 3.55Å; Q272-W275 WeakPolarHBondContact O-CB 3.13Å; Q272-W275 PolarHBondContact O-N 3.1Å; Q272-W275 VanDerWaalsContact O-N 3.15Å; A273-W275 VanDerWaalsContact C-N 3.33Å; W275-L278 PolarHBondContact O-N 3.15Å; W275-A279 VanDerWaalsContact O-CB 3.22Å; W275-A279 WeakPolarHBondContact O-CB 3.4Å; W275-A279 PolarHBondContact O-N 3.03Å
276	E	57.1	Low	49.1	Very low	116 Å²	116	96.8 Å²	96.8	54%	0.542	45%	0.451	S	S	.	.	H	α-helix	trans	-65.2	-42.3	173.1	-74.9	179.3	-166.9	0	0	111.1	Q272 A279 R280	Q272-E276 PolarHBondContact NE2-OE1 3.16Å; Q272-E276 WeakPolarHBondContact O-CB 3.25Å; Q272-E276 WeakPolarHBondContact O-CG 3.4Å; Q272-E276 PolarHBondContact O-N 3.33Å; E276-A279 PolarHBondContact O-N 2.71Å; E276-R280 WeakPolarHBondContact O-CB 3.32Å; E276-R280 PolarHBondContact O-N 3.39Å
277	E	56.3	Low	48.2	Very low	49 Å²	49	94.9 Å²	94.9	23%	0.229	45%	0.445	C	S	.	.	H	α-helix	trans	-71	-32.5	174.8	174.9	61.9	-173.1	0	0	112.2	A273 R280 R281	A273-E277 WeakPolarHBondContact O-CB 3.48Å; A273-E277 PolarHBondContact O-N 3.43Å; E277-R280 IonicContact OE1-CZ 2.67Å; E277-R280 IonicContact OE1-NH2 2.65Å; E277-R280 PolarHBondContact OE1-NH2 3.13Å; E277-R280 IonicContact OE2-CZ 3.97Å; E277-R280 IonicContact OE2-NE 2.88Å; E277-R280 PolarHBondContact OE2-NE 3.42Å; E277-R280 IonicContact OE2-NH2 2.92Å; E277-R280 PolarHBondContact OE2-NH2 3.39Å; E277-R281 VanDerWaalsContact O-CB 3.29Å; E277-R281 WeakPolarHBondContact O-CB 3.32Å; E277-R281 WeakPolarHBondContact O-CD 3.46Å; E277-R281 WeakPolarHBondContact O-CG 3.48Å; E277-R281 PolarHBondContact O-N 3.25Å; E277-R281 IonicContact OE1-CZ 3.61Å; E277-R281 IonicContact OE1-NE 3.96Å; E277-R281 PolarHBondContact OE1-NE 3.43Å; E277-R281 IonicContact OE1-NH2 3.17Å; E277-R281 PolarHBondContact OE1-NH2 3.3Å
278	L	48.1	Very low	47.5	Very low	64 Å²	64	97.6 Å²	97.6	34%	0.335	46%	0.459	S	S	.	.	H	α-helix	trans	-71.3	-39.9	172.1	-177.4	63.4	0	0	0	111.4	E274 W275 R281 N282	E274-L278 WeakPolarHBondContact O-CB 3.23Å; E274-L278 PolarHBondContact O-N 2.97Å; W275-L278 PolarHBondContact O-N 3.15Å; L278-R281 PolarHBondContact O-N 2.85Å; L278-N282 WeakPolarHBondContact O-CB 3.4Å; L278-N282 PolarHBondContact O-N 3.08Å; L278-N282 PolarHBondContact O-OD1 3.09Å
279	A	47.3	Very low	46.7	Very low	48 Å²	48	96.7 Å²	96.7	40%	0.397	46%	0.461	S	S	.	.	H	α-helix	trans	-64.6	-42	172.5	0	0	0	0	0	110.9	W275 E276 R281 N282 W283	W275-A279 VanDerWaalsContact O-CB 3.22Å; W275-A279 WeakPolarHBondContact O-CB 3.4Å; W275-A279 PolarHBondContact O-N 3.03Å; E276-A279 PolarHBondContact O-N 2.71Å; A279-R281 VanDerWaalsContact C-N 3.34Å; A279-R281 PolarHBondContact O-N 3.3Å; A279-N282 PolarHBondContact O-N 3.04Å; A279-W283 VanDerWaalsContact O-CB 3.26Å; A279-W283 WeakPolarHBondContact O-CB 3.49Å; A279-W283 PolarHBondContact O-N 3.03Å
280	R	45.8	Very low	45.6	Very low	127 Å²	127	94.3 Å²	94.3	48%	0.479	46%	0.457	S	S	.	.	H	α-helix	trans	-66.5	-33.9	174.6	-164.1	-171.1	71.1	74.9	8.2	112.3	E276 E277 L284	E276-R280 WeakPolarHBondContact O-CB 3.32Å; E276-R280 PolarHBondContact O-N 3.39Å; E277-R280 IonicContact OE1-CZ 2.67Å; E277-R280 IonicContact OE1-NH2 2.65Å; E277-R280 PolarHBondContact OE1-NH2 3.13Å; E277-R280 IonicContact OE2-CZ 3.97Å; E277-R280 IonicContact OE2-NE 2.88Å; E277-R280 PolarHBondContact OE2-NE 3.42Å; E277-R280 IonicContact OE2-NH2 2.92Å; E277-R280 PolarHBondContact OE2-NH2 3.39Å; R280-L284 WeakPolarHBondContact O-CB 3.39Å; R280-L284 PolarHBondContact O-N 3.13Å
281	R	46	Very low	44.3	Very low	137 Å²	137	96.4 Å²	96.4	52%	0.517	47%	0.469	S	S	.	.	H	α-helix	trans	-69.8	-46.4	170.9	-77.5	167.7	-168.2	167	8.3	111.5	E277 L278 A279 W283 L284 T285	E277-R281 VanDerWaalsContact O-CB 3.29Å; E277-R281 WeakPolarHBondContact O-CB 3.32Å; E277-R281 WeakPolarHBondContact O-CD 3.46Å; E277-R281 WeakPolarHBondContact O-CG 3.48Å; E277-R281 PolarHBondContact O-N 3.25Å; E277-R281 IonicContact OE1-CZ 3.61Å; E277-R281 IonicContact OE1-NE 3.96Å; E277-R281 PolarHBondContact OE1-NE 3.43Å; E277-R281 IonicContact OE1-NH2 3.17Å; E277-R281 PolarHBondContact OE1-NH2 3.3Å; L278-R281 PolarHBondContact O-N 2.85Å; A279-R281 VanDerWaalsContact C-N 3.34Å; A279-R281 PolarHBondContact O-N 3.3Å; R281-W283 VanDerWaalsContact C-N 3.32Å; R281-W283 PolarHBondContact O-N 2.95Å; R281-L284 CarbonylContact O-C 3.57Å; R281-L284 PolarHBondContact O-N 3.47Å; R281-L284 VanDerWaalsContact O-N 3.14Å; R281-T285 WeakPolarHBondContact O-CG2 3.33Å; R281-T285 PolarHBondContact O-N 3.04Å; R281-T285 PolarHBondContact O-OG1 3.12Å; R281-T285 VanDerWaalsContact O-OG1 3.1Å
282	N	40.2	Very low	43.6	Very low	77 Å²	77	101.6 Å²	101.6	41%	0.412	50%	0.496	S	S	.	.	H	α-helix	trans	-57.4	-46.7	175	-71.3	-7.8	0	0	0	110.3	L278 A279 L284 T285 E286	L278-N282 WeakPolarHBondContact O-CB 3.4Å; L278-N282 PolarHBondContact O-N 3.08Å; L278-N282 PolarHBondContact O-OD1 3.09Å; A279-N282 PolarHBondContact O-N 3.04Å; N282-L284 PolarHBondContact O-N 2.88Å; N282-T285 WeakPolarHBondContact CA-OG1 3.49Å; N282-T285 CarbonylContact O-C 3.56Å; N282-T285 PolarHBondContact O-N 3.28Å; N282-T285 VanDerWaalsContact O-N 3.14Å; N282-T285 PolarHBondContact O-OG1 3.16Å; N282-E286 WeakPolarHBondContact O-CB 3.49Å; N282-E286 WeakPolarHBondContact O-CG 3.26Å; N282-E286 PolarHBondContact O-N 2.99Å
283	W	36.2	Very low	42.6	Very low	173 Å²	173	101.9 Å²	101.9	66%	0.655	51%	0.505	S	S	*	.	H	α-helix	trans	-60.6	-40.5	174.3	-179.1	-88.7	0	0	0	113.3	A279 R281 E286 N287	A279-W283 VanDerWaalsContact O-CB 3.26Å; A279-W283 WeakPolarHBondContact O-CB 3.49Å; A279-W283 PolarHBondContact O-N 3.03Å; R281-W283 VanDerWaalsContact C-N 3.32Å; R281-W283 PolarHBondContact O-N 2.95Å; W283-E286 PolarHBondContact O-N 3.36Å; W283-N287 PolarHBondContact O-N 3.31Å; W283-N287 VanDerWaalsContact O-N 3.15Å; W283-N287 PolarHBondContact O-ND2 2.7Å
284	L	33.4	Very low	41.2	Very low	66 Å²	66	105.5 Å²	105.5	35%	0.346	53%	0.527	S	S	.	.	H	α-helix	trans	-65.6	-41.5	172.5	-93	159.4	0	0	0	111.6	R280 R281 N282 N287 E288	R280-L284 WeakPolarHBondContact O-CB 3.39Å; R280-L284 PolarHBondContact O-N 3.13Å; R281-L284 CarbonylContact O-C 3.57Å; R281-L284 PolarHBondContact O-N 3.47Å; R281-L284 VanDerWaalsContact O-N 3.14Å; N282-L284 PolarHBondContact O-N 2.88Å; L284-N287 CarbonylContact O-C 3.54Å; L284-N287 PolarHBondContact O-N 2.91Å; L284-E288 WeakPolarHBondContact O-CB 3.34Å; L284-E288 WeakPolarHBondContact O-CG 3.4Å; L284-E288 PolarHBondContact O-N 3.35Å
285	T	38.7	Very low	40.2	Very low	62 Å²	62	104.4 Å²	104.4	38%	0.38	53%	0.53	S	S	.	.	H	α-helix	trans	-73.7	-24.3	175.5	56	0	0	0	0	113.2	R281 N282 N287 Q289	R281-T285 WeakPolarHBondContact O-CG2 3.33Å; R281-T285 PolarHBondContact O-N 3.04Å; R281-T285 PolarHBondContact O-OG1 3.12Å; R281-T285 VanDerWaalsContact O-OG1 3.1Å; N282-T285 WeakPolarHBondContact CA-OG1 3.49Å; N282-T285 CarbonylContact O-C 3.56Å; N282-T285 PolarHBondContact O-N 3.28Å; N282-T285 VanDerWaalsContact O-N 3.14Å; N282-T285 PolarHBondContact O-OG1 3.16Å; T285-N287 VanDerWaalsContact C-N 3.28Å; T285-Q289 VanDerWaalsContact CA-OE1 3.23Å; T285-Q289 VanDerWaalsContact CG2-OE1 3.27Å; T285-Q289 CarbonylContact O-C 3.55Å; T285-Q289 WeakPolarHBondContact O-CA 3.45Å; T285-Q289 WeakPolarHBondContact O-CB 3.21Å; T285-Q289 PolarHBondContact O-N 3.36Å; T285-Q289 PolarHBondContact O-OE1 3.3Å
286	E	35.3	Very low	39.6	Very low	133 Å²	133	101.1 Å²	101.1	62%	0.621	52%	0.524	S	S	*	.	H	α-helix	trans	-71	-28.7	169.6	-77	175.7	153.2	0	0	111.1	N282 W283 A290	N282-E286 WeakPolarHBondContact O-CB 3.49Å; N282-E286 WeakPolarHBondContact O-CG 3.26Å; N282-E286 PolarHBondContact O-N 2.99Å; W283-E286 PolarHBondContact O-N 3.36Å; E286-A290 PolarHBondContact O-N 2.68Å
287	N	38.6	Very low	38.7	Very low	103 Å²	103	99.3 Å²	99.3	55%	0.551	52%	0.524	S	S	*	.	H	α-helix	trans	-86.5	-28.7	173.9	-76.4	-84.8	0	0	0	113.7	W283 L284 T285	W283-N287 PolarHBondContact O-N 3.31Å; W283-N287 VanDerWaalsContact O-N 3.15Å; W283-N287 PolarHBondContact O-ND2 2.7Å; L284-N287 CarbonylContact O-C 3.54Å; L284-N287 PolarHBondContact O-N 2.91Å; T285-N287 VanDerWaalsContact C-N 3.28Å
288	E	34.4	Very low	38.2	Very low	132 Å²	132	101.4 Å²	101.4	62%	0.617	54%	0.542	S	S	*	.	H	α-helix	trans	-100.4	-36.8	-178.7	-66.6	-170.4	156.4	0	0	113.5	L284 A290	L284-E288 WeakPolarHBondContact O-CB 3.34Å; L284-E288 WeakPolarHBondContact O-CG 3.4Å; L284-E288 PolarHBondContact O-N 3.35Å; E288-A290 PolarHBondContact O-N 2.64Å
289	Q	34.1	Very low	38.2	Very low	119 Å²	119	106.6 Å²	106.6	56%	0.556	56%	0.564	S	S	*	*			trans	-89.3	26.8	162	-71.2	74.4	19.9	0	0	112.6	T285 Q291	T285-Q289 VanDerWaalsContact CA-OE1 3.23Å; T285-Q289 VanDerWaalsContact CG2-OE1 3.27Å; T285-Q289 CarbonylContact O-C 3.55Å; T285-Q289 WeakPolarHBondContact O-CA 3.45Å; T285-Q289 WeakPolarHBondContact O-CB 3.21Å; T285-Q289 PolarHBondContact O-N 3.36Å; T285-Q289 PolarHBondContact O-OE1 3.3Å; Q289-Q291 CarbonylContact O-C 3.59Å; Q289-Q291 PolarHBondContact O-N 2.85Å
290	A	34.7	Very low	38.2	Very low	65 Å²	65	107.2 Å²	107.2	54%	0.537	56%	0.559	S	S	.	*			trans	-57.2	-0.5	143.3	0	0	0	0	0	112.8	E286 E288 I292	E286-A290 PolarHBondContact O-N 2.68Å; E288-A290 PolarHBondContact O-N 2.64Å; A290-I292 PolarHBondContact O-N 2.89Å
291	Q	35.1	Very low	38.7	Very low	166 Å²	166	107.6 Å²	107.6	78%	0.776	56%	0.564	S	S	*	*	S	Bend	trans	-62.6	81.2	153	-64.8	-154	12.2	0	0	111.9	Q289	Q289-Q291 CarbonylContact O-C 3.59Å; Q289-Q291 PolarHBondContact O-N 2.85Å
292	I	35.3	Very low	39.9	Very low	134 Å²	134	103.1 Å²	103.1	69%	0.687	56%	0.56	S	S	*	*			trans	-20.1	117.6	157.7	-60.4	155.6	0	0	0	112.1	A290 S294	A290-I292 PolarHBondContact O-N 2.89Å; I292-S294 PolarHBondContact O-N 2.74Å; I292-S294 VanDerWaalsContact O-N 3.16Å
293	P	30.8	Very low	41.9	Very low	89 Å²	89	100 Å²	100	58%	0.578	54%	0.543	S	S	*	.			trans	-55.6	120.3	161.2	-22.6	33.7	0	0	0	108.7	S295 V296	P293-S295 PolarHBondContact O-N 3.26Å; P293-V296 PolarHBondContact O-N 3.27Å
294	S	32.5	Very low	44.2	Very low	130 Å²	130	100.1 Å²	100.1	91%	0.909	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	18.4	-169.8	51.3	0	0	0	0	115.1	I292	I292-S294 PolarHBondContact O-N 2.74Å; I292-S294 VanDerWaalsContact O-N 3.16Å
295	S	33.1	Very low	46.7	Very low	75 Å²	75	98.3 Å²	98.3	52%	0.524	53%	0.534	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.9	16.2	-176.6	61	0	0	0	0	113.2	P293 T307	P293-S295 PolarHBondContact O-N 3.26Å; S295-T307 WeakPolarHBondContact O-CB 3.49Å; S295-T307 WeakPolarHBondContact O-CG2 3.4Å; S295-T307 PolarHBondContact O-OG1 2.92Å
296	V	38.7	Very low	48.9	Very low	59 Å²	59	97.8 Å²	97.8	36%	0.358	53%	0.527	S	S	.	.			trans	-116.9	122	179.8	-175.8	0	0	0	0	110.5	P293 P298 Y304	P293-V296 PolarHBondContact O-N 3.27Å; V296-P298 WeakPolarHBondContact O-CD 3.48Å; V296-Y304 HydrophobicContact CG1-CD1 4.19Å
297	S	37.1	Very low	50.9	Low	77 Å²	77	94.1 Å²	94.1	54%	0.538	51%	0.514	S	S	.	.			trans	-82.4	120.2	171.7	54.9	0	0	0	0	110.7
298	P	46.9	Very low	52.9	Low	94 Å²	94	94.7 Å²	94.7	61%	0.61	52%	0.517	S	S	*	.			trans	-72.1	163.7	174.5	30.5	-34.8	0	0	0	112.1	V296	V296-P298 WeakPolarHBondContact O-CD 3.48Å
299	H	48.4	Very low	55.4	Low	172 Å²	172	89 Å²	89	80%	0.796	49%	0.491	S	S	*	.			trans	87.8	75.3	169.5	-44.6	-64.5	0	0	0	118.6
300	E	46.7	Very low	57.9	Low	61 Å²	61	87.9 Å²	87.9	29%	0.285	49%	0.494	S	S	.	.	S	Bend		-134.6	123	100.7	-85.2	-139.3	158.8	0	0	110.7	G302 Y303 F305 R373	E300-G302 PolarHBondContact O-N 3.23Å; E300-Y303 PolarHBondContact O-N 3.17Å; E300-F305 HydrophobicContact CB-CE2 4.36Å; E300-R373 IonicContact OE1-NH2 3.7Å; E300-R373 PolarHBondContact OE1-NH2 2.78Å; E300-R373 IonicContact OE2-CZ 2.89Å; E300-R373 IonicContact OE2-NE 2.8Å; E300-R373 PolarHBondContact OE2-NE 3.33Å; E300-R373 VanDerWaalsContact OE2-NE 3.16Å; E300-R373 IonicContact OE2-NH2 2.75Å; E300-R373 PolarHBondContact OE2-NH2 3.19Å
301	K	55.3	Low	60.5	Low	135 Å²	135	88 Å²	88	59%	0.587	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	39.5	27.4	163.5	-66.1	-167.9	173.1	-172.2	0	119.5	E376	K301-E376 WeakPolarHBondContact CD-OE2 3.42Å; K301-E376 IonicContact NZ-OE1 2.85Å; K301-E376 PolarHBondContact NZ-OE1 3Å; K301-E376 IonicContact NZ-OE2 3.35Å; K301-E376 PolarHBondContact NZ-OE2 3.09Å
302	G	71.5	Confident	63	Low	43 Å²	43	85.3 Å²	85.3	44%	0.443	47%	0.467	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.6	9.7	178.6	0	0	0	0	0	115.1	E300	E300-G302 PolarHBondContact O-N 3.23Å
303	Y	83.4	Confident	65.4	Low	12 Å²	12	85.9 Å²	85.9	5%	0.047	47%	0.471	C	S	.	.			trans	-80.7	141.3	161.9	-166.3	-92.1	0	0	0	109.7	E300 F305 E338 W351 L354 Q358 A366 V369 S370	E300-Y303 PolarHBondContact O-N 3.17Å; Y303-F305 AromaticContact CD1-CD1 3.67Å; Y303-F305 HydrophobicContact CD1-CD1 3.67Å; Y303-F305 HydrophobicContact CD1-CD2 4.04Å; Y303-F305 AromaticContact CD1-CE1 3.61Å; Y303-F305 HydrophobicContact CD1-CE1 3.61Å; Y303-F305 HydrophobicContact CD1-CE2 4Å; Y303-F305 AromaticContact CD1-CG 3.89Å; Y303-F305 HydrophobicContact CD1-CG 3.89Å; Y303-F305 AromaticContact CD1-CZ 3.8Å; Y303-F305 HydrophobicContact CD1-CZ 3.8Å; Y303-F305 AromaticContact CE1-CD1 3.68Å; Y303-F305 HydrophobicContact CE1-CD1 3.68Å; Y303-F305 AromaticContact CE1-CE1 3.83Å; Y303-F305 HydrophobicContact CE1-CE1 3.83Å; Y303-F305 HydrophobicContact CE1-CG 4.19Å; Y303-F305 HydrophobicContact CE1-CZ 4.47Å; Y303-E338 HydrophobicContact CE1-CG 3.99Å; Y303-E338 PolarHBondContact OH-OE1 2.98Å; Y303-E338 VanDerWaalsContact OH-OE1 3.11Å; Y303-W351 HydrophobicContact CD2-CZ3 4.09Å; Y303-W351 HydrophobicContact CG-CH2 4.26Å; Y303-W351 HydrophobicContact CG-CZ3 4.06Å; Y303-L354 HydrophobicContact CE1-CD2 4.36Å; Y303-L354 HydrophobicContact CE2-CD2 4.25Å; Y303-Q358 PolarHBondContact OH-NE2 3.05Å; Y303-A366 HydrophobicContact CE2-CB 3.91Å; Y303-V369 HydrophobicContact CD2-CB 4.44Å; Y303-V369 HydrophobicContact CD2-CG1 4.18Å; Y303-S370 WeakPolarHBondContact CD2-OG 3.42Å; Y303-S370 WeakPolarHBondContact CE2-OG 3.37Å
304	Y	84.3	Confident	68.3	Low	175 Å²	175	84.8 Å²	84.8	69%	0.686	46%	0.46	S	S	*	.			trans	-110.1	101.1	178.9	-63.1	-73.1	0	0	0	109.5	V296	V296-Y304 HydrophobicContact CG1-CD1 4.19Å
305	F	85.9	Confident	71	Confident	28 Å²	28	83.2 Å²	83.2	12%	0.123	45%	0.447	C	S	.	.			trans	-75.6	148.8	177	-66.9	-74.5	0	0	0	112.2	E300 Y303 T307 E338 V341 L342 W351	E300-F305 HydrophobicContact CB-CE2 4.36Å; Y303-F305 AromaticContact CD1-CD1 3.67Å; Y303-F305 HydrophobicContact CD1-CD1 3.67Å; Y303-F305 HydrophobicContact CD1-CD2 4.04Å; Y303-F305 AromaticContact CD1-CE1 3.61Å; Y303-F305 HydrophobicContact CD1-CE1 3.61Å; Y303-F305 HydrophobicContact CD1-CE2 4Å; Y303-F305 AromaticContact CD1-CG 3.89Å; Y303-F305 HydrophobicContact CD1-CG 3.89Å; Y303-F305 AromaticContact CD1-CZ 3.8Å; Y303-F305 HydrophobicContact CD1-CZ 3.8Å; Y303-F305 AromaticContact CE1-CD1 3.68Å; Y303-F305 HydrophobicContact CE1-CD1 3.68Å; Y303-F305 AromaticContact CE1-CE1 3.83Å; Y303-F305 HydrophobicContact CE1-CE1 3.83Å; Y303-F305 HydrophobicContact CE1-CG 4.19Å; Y303-F305 HydrophobicContact CE1-CZ 4.47Å; F305-T307 PolarHBondContact O-N 3.34Å; F305-E338 HydrophobicContact CD1-CB 4.13Å; F305-E338 HydrophobicContact CD1-CG 3.94Å; F305-E338 HydrophobicContact CE1-CG 4.33Å; F305-V341 HydrophobicContact CE1-CG2 3.61Å; F305-V341 HydrophobicContact CZ-CG2 4.07Å; F305-L342 HydrophobicContact CD1-CD1 4.15Å; F305-L342 HydrophobicContact CD1-CD2 4.23Å; F305-L342 HydrophobicContact CD1-CG 4.13Å; F305-L342 HydrophobicContact CD2-CD2 4.25Å; F305-L342 HydrophobicContact CE1-CD2 4.1Å; F305-L342 HydrophobicContact CE1-CG 4.03Å; F305-L342 HydrophobicContact CE2-CD2 4.1Å; F305-L342 HydrophobicContact CG-CD1 4.49Å; F305-L342 HydrophobicContact CG-CD2 4.3Å; F305-L342 HydrophobicContact CZ-CD2 4.02Å; F305-L342 HydrophobicContact CZ-CG 4.41Å; F305-W351 HydrophobicContact CE1-CH2 4.35Å; F305-W351 AromaticContact CZ-CH2 3.74Å; F305-W351 HydrophobicContact CZ-CH2 3.74Å; F305-W351 HydrophobicContact CZ-CZ2 4.25Å
306	H	84.4	Confident	73.8	Confident	51 Å²	51	84.5 Å²	84.5	24%	0.236	45%	0.448	C	S	.	.			trans	-70.9	118	168	-60.9	83.5	0	0	0	109.3	N309 L335 E338 Q578	H306-N309 HydrophobicContact CB-CB 4.44Å; H306-N309 WeakPolarHBondContact O-CB 3.31Å; H306-L335 HydrophobicContact CB-CD2 3.71Å; H306-E338 IonicContact CE1-OE1 3.75Å; H306-E338 PolarHBondContact CE1-OE1 3.22Å; H306-E338 IonicContact CE1-OE2 3.11Å; H306-E338 IonicContact CG-OE2 2.73Å; H306-E338 PolarHBondContact N-OE2 2.89Å; H306-E338 IonicContact ND1-OE1 3.95Å; H306-E338 PolarHBondContact ND1-OE1 3.45Å; H306-E338 IonicContact ND1-OE2 3.11Å; H306-E338 PolarHBondContact ND1-OE2 3.36Å; H306-Q578 PolarHBondContact CD2-NE2 3.49Å; H306-Q578 VanDerWaalsContact CD2-NE2 3.31Å; H306-Q578 PolarHBondContact CE1-NE2 2.77Å; H306-Q578 PolarHBondContact NE2-NE2 2.77Å
307	T	78.3	Confident	76.4	Confident	57 Å²	57	81.8 Å²	81.8	35%	0.35	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72	-40.1	-173.7	35.2	0	0	0	0	112.6	S295 F305 N309	S295-T307 WeakPolarHBondContact O-CB 3.49Å; S295-T307 WeakPolarHBondContact O-CG2 3.4Å; S295-T307 PolarHBondContact O-OG1 2.92Å; F305-T307 PolarHBondContact O-N 3.34Å; T307-N309 VanDerWaalsContact C-N 3.33Å; T307-N309 PolarHBondContact O-N 3.45Å
308	D	80.6	Confident	79.2	Confident	115 Å²	115	80.1 Å²	80.1	62%	0.615	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.5	53	173.5	-58.5	-49.5	0	0	0	111.4	P310	D308-P310 WeakPolarHBondContact O-CD 3.35Å
309	N	86.5	Confident	81.6	Confident	13 Å²	13	81.5 Å²	81.5	7%	0.07	41%	0.413	C	S	.	.			trans	-77.8	114.9	178.4	-178	-20.2	0	0	0	111.2	H306 T307 Y311 K312 L335	H306-N309 HydrophobicContact CB-CB 4.44Å; H306-N309 WeakPolarHBondContact O-CB 3.31Å; T307-N309 VanDerWaalsContact C-N 3.33Å; T307-N309 PolarHBondContact O-N 3.45Å; N309-Y311 PolarHBondContact O-N 2.68Å; N309-Y311 PolarHBondContact OD1-N 3.42Å; N309-K312 WeakPolarHBondContact O-CB 3.38Å; N309-K312 PolarHBondContact O-N 2.96Å; N309-L335 PolarHBondContact ND2-O 3.19Å; N309-L335 PolarHBondContact OD1-O 3.47Å
310	P	86.5	Confident	83.8	Confident	95 Å²	95	76.9 Å²	76.9	62%	0.617	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-13.8	-174.9	31.1	-36.8	0	0	0	114.1	D308	D308-P310 WeakPolarHBondContact O-CD 3.35Å
311	Y	88.6	Confident	86	Confident	67 Å²	67	74 Å²	74	26%	0.263	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.5	2.1	-178.1	-53.1	-62.9	0	0	0	113.7	N309 D313 L314 N332 L335 L336 A339	N309-Y311 PolarHBondContact O-N 2.68Å; N309-Y311 PolarHBondContact OD1-N 3.42Å; Y311-D313 VanDerWaalsContact C-N 3.28Å; Y311-D313 PolarHBondContact O-N 3.14Å; Y311-D313 VanDerWaalsContact O-N 3.15Å; Y311-L314 HydrophobicContact CD1-CD2 4.25Å; Y311-L314 WeakPolarHBondContact O-CB 3.4Å; Y311-L314 PolarHBondContact O-N 3.01Å; Y311-N332 HydrophobicContact CE2-CB 4.42Å; Y311-N332 PolarHBondContact OH-OD1 3.2Å; Y311-L335 HydrophobicContact CD2-CB 3.66Å; Y311-L335 HydrophobicContact CE2-CB 3.97Å; Y311-L335 HydrophobicContact CE2-CD1 4.38Å; Y311-L336 HydrophobicContact CD1-CD2 3.9Å; Y311-L336 HydrophobicContact CD1-CG 4.39Å; Y311-L336 HydrophobicContact CD2-CD2 4.04Å; Y311-L336 HydrophobicContact CD2-CG 3.74Å; Y311-L336 HydrophobicContact CE2-CG 4.13Å; Y311-L336 HydrophobicContact CG-CD2 3.62Å; Y311-L336 HydrophobicContact CG-CG 3.88Å; Y311-A339 VanDerWaalsContact O-CB 3.26Å; Y311-A339 WeakPolarHBondContact O-CB 3.36Å
312	K	87.1	Confident	88	Confident	109 Å²	109	69 Å²	69	47%	0.474	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49	-44.8	-174	-175.9	177.9	-179.7	176.1	0	114.2	N309 Q343	N309-K312 WeakPolarHBondContact O-CB 3.38Å; N309-K312 PolarHBondContact O-N 2.96Å; K312-Q343 PolarHBondContact O-NE2 3.04Å
313	D	87.6	Confident	89.1	Confident	147 Å²	147	71.3 Å²	71.3	79%	0.786	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.9	10	-177.8	-54.9	-43.8	0	0	0	113.1	Y311	Y311-D313 VanDerWaalsContact C-N 3.28Å; Y311-D313 PolarHBondContact O-N 3.14Å; Y311-D313 VanDerWaalsContact O-N 3.15Å
314	L	90.7	Very high	89.6	Confident	66 Å²	66	73.1 Å²	73.1	35%	0.346	36%	0.364	S	S	.	.			trans	-76.6	123.7	-179.6	-171.1	77.4	0	0	0	110.6	Y311 L336 Q343	Y311-L314 HydrophobicContact CD1-CD2 4.25Å; Y311-L314 WeakPolarHBondContact O-CB 3.4Å; Y311-L314 PolarHBondContact O-N 3.01Å; L314-L336 HydrophobicContact CD2-CD2 3.48Å; L314-L336 VanDerWaalsContact CD2-CD2 3.48Å; L314-Q343 PolarHBondContact O-NE2 2.7Å
315	P	89.4	Confident	90	Very high	97 Å²	97	65.4 Å²	65.4	63%	0.63	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	148.8	172.4	29.3	-34.8	0	0	0	111.1	A317	P315-A317 PolarHBondContact O-N 3.36Å
316	N	91.6	Very high	90.3	Very high	102 Å²	102	73 Å²	73	55%	0.545	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.7	29.8	-178.6	-61.6	29.7	0	0	0	114.2	F318 E319 E320	N316-F318 PolarHBondContact O-N 3.35Å; N316-E319 HydrophobicContact CB-CG 4.49Å; N316-E319 PolarHBondContact ND2-OE2 3.26Å; N316-E319 PolarHBondContact O-N 3.47Å; N316-E320 PolarHBondContact O-N 2.94Å
317	A	94.3	Very high	90.7	Very high	1 Å²	1	75.6 Å²	75.6	1%	0.008	38%	0.375	C	S	.	.	H	α-helix	trans	-53.1	-31.9	-178.5	0	0	0	0	0	113.9	P315 G321 L336 A339 A340	P315-A317 PolarHBondContact O-N 3.36Å; A317-G321 PolarHBondContact O-N 3.24Å; A317-L336 HydrophobicContact CB-CD2 4.38Å; A317-L336 WeakPolarHBondContact CB-O 3.45Å; A317-A339 HydrophobicContact CB-CB 3.94Å; A317-A340 HydrophobicContact CB-CB 4.44Å
318	F	95.8	Very high	91.1	Very high	43 Å²	43	73.5 Å²	73.5	19%	0.189	37%	0.365	C	S	.	.	H	α-helix	trans	-63.1	-42.8	174.9	-177.9	-118.8	0	0	0	113.5	N316 G321 L322 L337 A340 E349 A350 V353	N316-F318 PolarHBondContact O-N 3.35Å; F318-G321 PolarHBondContact O-N 2.98Å; F318-L322 HydrophobicContact CD1-CD1 4.05Å; F318-L322 HydrophobicContact CE1-CD1 3.51Å; F318-L322 HydrophobicContact CE1-CG 4.44Å; F318-L322 HydrophobicContact CE2-CD1 4.06Å; F318-L322 HydrophobicContact CE2-CG 4.13Å; F318-L322 HydrophobicContact CZ-CD1 3.52Å; F318-L322 HydrophobicContact CZ-CG 4.07Å; F318-L322 WeakPolarHBondContact O-CB 3.43Å; F318-L322 PolarHBondContact O-N 3.32Å; F318-L337 HydrophobicContact CD2-CD2 3.77Å; F318-L337 HydrophobicContact CE2-CD2 4.08Å; F318-A340 HydrophobicContact CB-CB 3.81Å; F318-A340 HydrophobicContact CD2-CB 4.5Å; F318-E349 HydrophobicContact CZ-CB 4.2Å; F318-E349 HydrophobicContact CZ-CG 3.9Å; F318-A350 HydrophobicContact CD2-CB 3.9Å; F318-A350 HydrophobicContact CE2-CB 4.11Å; F318-V353 HydrophobicContact CE2-CB 4.22Å; F318-V353 HydrophobicContact CE2-CG2 4.11Å; F318-V353 HydrophobicContact CZ-CG2 4.35Å
319	E	95.7	Very high	91.7	Very high	122 Å²	122	69.8 Å²	69.8	57%	0.57	35%	0.345	S	S	*	.	H	α-helix	trans	-69.7	-43	-177.6	-61.8	-173.2	133.7	0	0	111.2	N316 K323	N316-E319 HydrophobicContact CB-CG 4.49Å; N316-E319 PolarHBondContact ND2-OE2 3.26Å; N316-E319 PolarHBondContact O-N 3.47Å; E319-K323 WeakPolarHBondContact O-CB 3.39Å; E319-K323 PolarHBondContact O-N 3.04Å
320	E	94.7	Very high	92	Very high	75 Å²	75	69.1 Å²	69.1	35%	0.35	34%	0.342	S	S	.	.	H	α-helix	trans	-69.4	-34.6	174	-77.4	-66.6	151.8	0	0	111.8	N316 K323 K324 L336	N316-E320 PolarHBondContact O-N 2.94Å; E320-K323 PolarHBondContact O-N 3.14Å; E320-K323 IonicContact OE1-NZ 2.59Å; E320-K323 PolarHBondContact OE1-NZ 2.75Å; E320-K323 IonicContact OE2-NZ 2.71Å; E320-K323 PolarHBondContact OE2-NZ 2.7Å; E320-K324 WeakPolarHBondContact O-CB 3.44Å; E320-K324 WeakPolarHBondContact O-CG 3.31Å; E320-K324 PolarHBondContact O-N 3.31Å; E320-L336 HydrophobicContact CB-CD1 4.3Å; E320-L336 HydrophobicContact CB-CD2 4.22Å
321	G	94.8	Very high	92.2	Very high	0 Å²	0	64.9 Å²	64.9	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-63.1	-45.9	172.6	0	0	0	0	0	112.9	A317 F318 K323 K324 S325	A317-G321 PolarHBondContact O-N 3.24Å; F318-G321 PolarHBondContact O-N 2.98Å; G321-K323 VanDerWaalsContact C-N 3.32Å; G321-K323 PolarHBondContact O-N 3.23Å; G321-K324 PolarHBondContact O-N 3.06Å; G321-S325 WeakPolarHBondContact O-CB 3.29Å; G321-S325 PolarHBondContact O-N 3Å
322	L	95.5	Very high	92.4	Very high	32 Å²	32	62.5 Å²	62.5	17%	0.168	31%	0.306	C	S	.	.	H	α-helix	trans	-59.4	-41	172.2	-86.9	171.7	0	0	0	112.5	F318 R326 V353	F318-L322 HydrophobicContact CD1-CD1 4.05Å; F318-L322 HydrophobicContact CE1-CD1 3.51Å; F318-L322 HydrophobicContact CE1-CG 4.44Å; F318-L322 HydrophobicContact CE2-CD1 4.06Å; F318-L322 HydrophobicContact CE2-CG 4.13Å; F318-L322 HydrophobicContact CZ-CD1 3.52Å; F318-L322 HydrophobicContact CZ-CG 4.07Å; F318-L322 WeakPolarHBondContact O-CB 3.43Å; F318-L322 PolarHBondContact O-N 3.32Å; L322-R326 VanDerWaalsContact O-CG 3.3Å; L322-R326 WeakPolarHBondContact O-CG 3.3Å; L322-R326 PolarHBondContact O-N 3.24Å; L322-R326 VanDerWaalsContact O-N 3.14Å; L322-V353 HydrophobicContact CD2-CG1 3.76Å; L322-V353 HydrophobicContact CD2-CG2 4.09Å; L322-V353 HydrophobicContact CG-CG1 4.41Å
323	K	95.6	Very high	92.7	Very high	90 Å²	90	57.3 Å²	57.3	39%	0.391	28%	0.283	S	S	.	.	H	α-helix	trans	-65.5	-45	175.9	170.6	175.4	155.4	-129.8	0	111.2	E319 E320 G321 R326 E327	E319-K323 WeakPolarHBondContact O-CB 3.39Å; E319-K323 PolarHBondContact O-N 3.04Å; E320-K323 PolarHBondContact O-N 3.14Å; E320-K323 IonicContact OE1-NZ 2.59Å; E320-K323 PolarHBondContact OE1-NZ 2.75Å; E320-K323 IonicContact OE2-NZ 2.71Å; E320-K323 PolarHBondContact OE2-NZ 2.7Å; G321-K323 VanDerWaalsContact C-N 3.32Å; G321-K323 PolarHBondContact O-N 3.23Å; K323-R326 PolarHBondContact O-N 3.36Å; K323-E327 WeakPolarHBondContact CE-OE1 3.32Å; K323-E327 WeakPolarHBondContact CG-OE1 3.34Å; K323-E327 WeakPolarHBondContact O-CG 3.47Å; K323-E327 PolarHBondContact O-N 2.76Å
324	K	93.6	Very high	93	Very high	50 Å²	50	50.3 Å²	50.3	22%	0.217	25%	0.246	C	C	.	.	H	α-helix	trans	-64.3	-39.1	177.2	-78.8	-78.1	163.2	-159.9	0	113.4	E320 G321 E327 G328 D329 N332 A333 L336	E320-K324 WeakPolarHBondContact O-CB 3.44Å; E320-K324 WeakPolarHBondContact O-CG 3.31Å; E320-K324 PolarHBondContact O-N 3.31Å; G321-K324 PolarHBondContact O-N 3.06Å; K324-E327 VanDerWaalsContact CE-OE2 3.23Å; K324-E327 WeakPolarHBondContact CE-OE2 3.29Å; K324-E327 IonicContact NZ-OE2 3.24Å; K324-E327 PolarHBondContact NZ-OE2 3Å; K324-E327 PolarHBondContact O-N 2.98Å; K324-G328 PolarHBondContact O-N 3.43Å; K324-G328 VanDerWaalsContact O-N 3.14Å; K324-D329 HydrophobicContact CB-CB 4.4Å; K324-D329 HydrophobicContact CD-CB 3.6Å; K324-D329 WeakPolarHBondContact CD-OD2 3.39Å; K324-D329 WeakPolarHBondContact CE-OD2 3.25Å; K324-D329 IonicContact NZ-OD2 3.24Å; K324-D329 PolarHBondContact NZ-OD2 2.89Å; K324-D329 PolarHBondContact O-N 3.35Å; K324-N332 HydrophobicContact CD-CB 4.44Å; K324-A333 HydrophobicContact CB-CB 3.81Å; K324-L336 HydrophobicContact CB-CD1 4.15Å; K324-L336 HydrophobicContact CG-CD1 3.7Å
325	S	93.1	Very high	93.1	Very high	13 Å²	13	47.6 Å²	47.6	9%	0.091	23%	0.231	C	C	.	.	H	α-helix	trans	-57	-49	169.9	162.7	0	0	0	0	110.8	G321 E327 G328 H533	G321-S325 WeakPolarHBondContact O-CB 3.29Å; G321-S325 PolarHBondContact O-N 3Å; S325-E327 PolarHBondContact O-N 3.47Å; S325-G328 PolarHBondContact O-N 2.78Å; S325-H533 PolarHBondContact O-CE1 3.37Å; S325-H533 VanDerWaalsContact O-CE1 3.24Å
326	R	92.1	Very high	93.4	Very high	187 Å²	187	43.2 Å²	43.2	71%	0.706	20%	0.203	S	C	*	.	H	α-helix	trans	-65.4	-33.1	177.5	-67.3	167.8	-170.2	169.5	6.4	113.8	L322 K323 G328	L322-R326 VanDerWaalsContact O-CG 3.3Å; L322-R326 WeakPolarHBondContact O-CG 3.3Å; L322-R326 PolarHBondContact O-N 3.24Å; L322-R326 VanDerWaalsContact O-N 3.14Å; K323-R326 PolarHBondContact O-N 3.36Å; R326-G328 PolarHBondContact O-N 3.42Å
327	E	91.6	Very high	93.6	Very high	107 Å²	107	38.3 Å²	38.3	50%	0.5	18%	0.177	S	C	.	.	H	α-helix	trans	-69.5	-16.1	172.8	-73.2	172.8	-167	0	0	113	K323 K324 S325	K323-E327 WeakPolarHBondContact CE-OE1 3.32Å; K323-E327 WeakPolarHBondContact CG-OE1 3.34Å; K323-E327 WeakPolarHBondContact O-CG 3.47Å; K323-E327 PolarHBondContact O-N 2.76Å; K324-E327 VanDerWaalsContact CE-OE2 3.23Å; K324-E327 WeakPolarHBondContact CE-OE2 3.29Å; K324-E327 IonicContact NZ-OE2 3.24Å; K324-E327 PolarHBondContact NZ-OE2 3Å; K324-E327 PolarHBondContact O-N 2.98Å; S325-E327 PolarHBondContact O-N 3.47Å
328	G	88.8	Confident	93.5	Very high	12 Å²	12	38.3 Å²	38.3	12%	0.124	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	84.9	13	-175.5	0	0	0	0	0	114.7	K324 S325 R326 L330 H533 G535	K324-G328 PolarHBondContact O-N 3.43Å; K324-G328 VanDerWaalsContact O-N 3.14Å; S325-G328 PolarHBondContact O-N 2.78Å; R326-G328 PolarHBondContact O-N 3.42Å; G328-L330 PolarHBondContact O-N 2.9Å; G328-L330 VanDerWaalsContact O-N 3.13Å; G328-H533 WeakPolarHBondContact CA-CE1 3.36Å; G328-H533 WeakPolarHBondContact CA-NE2 3.22Å; G328-G535 WeakPolarHBondContact O-CA 3.48Å
329	D	92.2	Very high	93.4	Very high	37 Å²	37	36.2 Å²	36.2	20%	0.198	17%	0.167	C	C	.	.			trans	-89	58.3	176.6	-165.2	-7.1	0	0	0	109.6	K324 P331 N332 A333	K324-D329 HydrophobicContact CB-CB 4.4Å; K324-D329 HydrophobicContact CD-CB 3.6Å; K324-D329 WeakPolarHBondContact CD-OD2 3.39Å; K324-D329 WeakPolarHBondContact CE-OD2 3.25Å; K324-D329 IonicContact NZ-OD2 3.24Å; K324-D329 PolarHBondContact NZ-OD2 2.89Å; K324-D329 PolarHBondContact O-N 3.35Å; D329-P331 VanDerWaalsContact C-CD 3.47Å; D329-N332 PolarHBondContact O-N 3.48Å; D329-N332 WeakPolarHBondContact OD1-CB 3.46Å; D329-N332 PolarHBondContact OD1-ND2 2.95Å; D329-N332 PolarHBondContact OD2-ND2 3.27Å; D329-A333 WeakPolarHBondContact O-CB 3.4Å; D329-A333 PolarHBondContact O-N 2.88Å
330	L	92.8	Very high	93.4	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-54.9	-40.2	-170.6	-55.8	-179	0	0	0	113.9	G328 A333 V334 T357 E360 N361 G535 I537	G328-L330 PolarHBondContact O-N 2.9Å; G328-L330 VanDerWaalsContact O-N 3.13Å; L330-A333 WeakPolarHBondContact O-CB 3.4Å; L330-A333 PolarHBondContact O-N 3.46Å; L330-V334 WeakPolarHBondContact O-CG2 3.36Å; L330-V334 PolarHBondContact O-N 2.89Å; L330-T357 HydrophobicContact CB-CG2 4.35Å; L330-T357 HydrophobicContact CD2-CG2 4.11Å; L330-E360 HydrophobicContact CD1-CB 3.91Å; L330-N361 HydrophobicContact CB-CB 4.5Å; L330-G535 WeakPolarHBondContact CD1-O 3.26Å; L330-I537 HydrophobicContact CB-CD1 4.36Å; L330-I537 HydrophobicContact CD1-CD1 4.37Å
331	P	91.6	Very high	93.4	Very high	6 Å²	6	27.3 Å²	27.3	4%	0.039	13%	0.127	C	C	.	.	H	α-helix	trans	-67.7	-41	179.9	-22.6	36.2	0	0	0	113.2	D329 V334 L335 I537	D329-P331 VanDerWaalsContact C-CD 3.47Å; P331-V334 PolarHBondContact O-N 2.66Å; P331-L335 WeakPolarHBondContact O-CG 3.41Å; P331-L335 PolarHBondContact O-N 3.47Å; P331-I537 HydrophobicContact CG-CD1 4.22Å
332	N	91.7	Very high	93.2	Very high	16 Å²	16	30.9 Å²	30.9	9%	0.086	15%	0.146	C	C	.	.	H	α-helix	trans	-71.5	-34	174.5	-69.4	-49.4	0	0	0	111.3	Y311 K324 D329 L335 L336 S570	Y311-N332 HydrophobicContact CE2-CB 4.42Å; Y311-N332 PolarHBondContact OH-OD1 3.2Å; K324-N332 HydrophobicContact CD-CB 4.44Å; D329-N332 PolarHBondContact O-N 3.48Å; D329-N332 WeakPolarHBondContact OD1-CB 3.46Å; D329-N332 PolarHBondContact OD1-ND2 2.95Å; D329-N332 PolarHBondContact OD2-ND2 3.27Å; N332-L335 PolarHBondContact O-N 2.69Å; N332-L336 WeakPolarHBondContact O-CB 3.49Å; N332-L336 WeakPolarHBondContact O-CD1 3.46Å; N332-L336 WeakPolarHBondContact O-CG 3.41Å; N332-L336 PolarHBondContact O-N 2.83Å; N332-S570 WeakPolarHBondContact OD1-CA 3.4Å; N332-S570 WeakPolarHBondContact OD1-CB 3.45Å
333	A	94.6	Very high	93	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-59.2	-45.3	171.1	0	0	0	0	0	111.7	K324 D329 L330 L335 L336 L337 T357	K324-A333 HydrophobicContact CB-CB 3.81Å; D329-A333 WeakPolarHBondContact O-CB 3.4Å; D329-A333 PolarHBondContact O-N 2.88Å; L330-A333 WeakPolarHBondContact O-CB 3.4Å; L330-A333 PolarHBondContact O-N 3.46Å; A333-L335 PolarHBondContact O-N 3.32Å; A333-L336 PolarHBondContact O-N 3.45Å; A333-L337 WeakPolarHBondContact O-CB 3.45Å; A333-L337 WeakPolarHBondContact O-CD1 3.44Å; A333-L337 WeakPolarHBondContact O-CG 3.32Å; A333-L337 PolarHBondContact O-N 2.97Å; A333-T357 HydrophobicContact CB-CG2 4.01Å
334	V	93.9	Very high	92.8	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-56.8	-48.6	174.2	163.9	0	0	0	0	111.4	L330 P331 L336 L337 E338 L354 T357 Q358	L330-V334 WeakPolarHBondContact O-CG2 3.36Å; L330-V334 PolarHBondContact O-N 2.89Å; P331-V334 PolarHBondContact O-N 2.66Å; V334-L336 VanDerWaalsContact C-N 3.35Å; V334-L336 PolarHBondContact O-N 3.12Å; V334-L337 PolarHBondContact O-N 2.87Å; V334-E338 WeakPolarHBondContact CG1-OE1 3.38Å; V334-E338 WeakPolarHBondContact O-CB 3.45Å; V334-E338 WeakPolarHBondContact O-CG 3.28Å; V334-E338 PolarHBondContact O-N 3.27Å; V334-L354 HydrophobicContact CG1-CD1 4.28Å; V334-T357 HydrophobicContact CG2-CG2 3.78Å; V334-Q358 VanDerWaalsContact CG1-NE2 3.29Å; V334-Q358 HydrophobicContact CG2-CG 4.1Å
335	L	92.7	Very high	92.7	Very high	9 Å²	9	33.1 Å²	33.1	5%	0.047	16%	0.164	C	C	.	.	H	α-helix	trans	-63.5	-38.8	179.6	-65.2	170.8	0	0	0	112.3	H306 N309 Y311 P331 N332 A333 A339	H306-L335 HydrophobicContact CB-CD2 3.71Å; N309-L335 PolarHBondContact ND2-O 3.19Å; N309-L335 PolarHBondContact OD1-O 3.47Å; Y311-L335 HydrophobicContact CD2-CB 3.66Å; Y311-L335 HydrophobicContact CE2-CB 3.97Å; Y311-L335 HydrophobicContact CE2-CD1 4.38Å; P331-L335 WeakPolarHBondContact O-CG 3.41Å; P331-L335 PolarHBondContact O-N 3.47Å; N332-L335 PolarHBondContact O-N 2.69Å; A333-L335 PolarHBondContact O-N 3.32Å; L335-A339 PolarHBondContact O-N 3.41Å
336	L	94.5	Very high	92.7	Very high	5 Å²	5	39.2 Å²	39.2	3%	0.026	19%	0.191	C	C	.	.	H	α-helix	trans	-66.9	-39.8	174.5	-77.1	159.7	0	0	0	112.7	Y311 L314 A317 E320 K324 N332 A333 V334 A339 A340	Y311-L336 HydrophobicContact CD1-CD2 3.9Å; Y311-L336 HydrophobicContact CD1-CG 4.39Å; Y311-L336 HydrophobicContact CD2-CD2 4.04Å; Y311-L336 HydrophobicContact CD2-CG 3.74Å; Y311-L336 HydrophobicContact CE2-CG 4.13Å; Y311-L336 HydrophobicContact CG-CD2 3.62Å; Y311-L336 HydrophobicContact CG-CG 3.88Å; L314-L336 HydrophobicContact CD2-CD2 3.48Å; L314-L336 VanDerWaalsContact CD2-CD2 3.48Å; A317-L336 HydrophobicContact CB-CD2 4.38Å; A317-L336 WeakPolarHBondContact CB-O 3.45Å; E320-L336 HydrophobicContact CB-CD1 4.3Å; E320-L336 HydrophobicContact CB-CD2 4.22Å; K324-L336 HydrophobicContact CB-CD1 4.15Å; K324-L336 HydrophobicContact CG-CD1 3.7Å; N332-L336 WeakPolarHBondContact O-CB 3.49Å; N332-L336 WeakPolarHBondContact O-CD1 3.46Å; N332-L336 WeakPolarHBondContact O-CG 3.41Å; N332-L336 PolarHBondContact O-N 2.83Å; A333-L336 PolarHBondContact O-N 3.45Å; V334-L336 VanDerWaalsContact C-N 3.35Å; V334-L336 PolarHBondContact O-N 3.12Å; L336-A339 WeakPolarHBondContact O-CB 3.48Å; L336-A339 PolarHBondContact O-N 3.17Å; L336-A340 PolarHBondContact O-N 2.93Å
337	L	95.5	Very high	92.8	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-72.6	-33.5	177.9	-68.4	163.3	0	0	0	111.9	F318 A333 V334 A340 V341 V353 L354 T357	F318-L337 HydrophobicContact CD2-CD2 3.77Å; F318-L337 HydrophobicContact CE2-CD2 4.08Å; A333-L337 WeakPolarHBondContact O-CB 3.45Å; A333-L337 WeakPolarHBondContact O-CD1 3.44Å; A333-L337 WeakPolarHBondContact O-CG 3.32Å; A333-L337 PolarHBondContact O-N 2.97Å; V334-L337 PolarHBondContact O-N 2.87Å; L337-A340 WeakPolarHBondContact O-CB 3.42Å; L337-A340 PolarHBondContact O-N 3.43Å; L337-V341 PolarHBondContact O-N 3.17Å; L337-V353 HydrophobicContact CD1-CG1 3.78Å; L337-V353 HydrophobicContact CD2-CB 4.12Å; L337-V353 HydrophobicContact CD2-CG1 3.71Å; L337-V353 HydrophobicContact CG-CG1 4.42Å; L337-L354 HydrophobicContact CB-CB 4.11Å; L337-L354 HydrophobicContact CB-CD1 3.88Å; L337-T357 HydrophobicContact CD1-CG2 4.32Å; L337-T357 WeakPolarHBondContact CD1-OG1 3.46Å
338	E	93.8	Very high	93	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-63.9	-42.3	168.4	-79.9	-178.3	-148	0	0	111.8	Y303 F305 H306 V334 A340 V341 L342 L354	Y303-E338 HydrophobicContact CE1-CG 3.99Å; Y303-E338 PolarHBondContact OH-OE1 2.98Å; Y303-E338 VanDerWaalsContact OH-OE1 3.11Å; F305-E338 HydrophobicContact CD1-CB 4.13Å; F305-E338 HydrophobicContact CD1-CG 3.94Å; F305-E338 HydrophobicContact CE1-CG 4.33Å; H306-E338 IonicContact CE1-OE1 3.75Å; H306-E338 PolarHBondContact CE1-OE1 3.22Å; H306-E338 IonicContact CE1-OE2 3.11Å; H306-E338 IonicContact CG-OE2 2.73Å; H306-E338 PolarHBondContact N-OE2 2.89Å; H306-E338 IonicContact ND1-OE1 3.95Å; H306-E338 PolarHBondContact ND1-OE1 3.45Å; H306-E338 IonicContact ND1-OE2 3.11Å; H306-E338 PolarHBondContact ND1-OE2 3.36Å; V334-E338 WeakPolarHBondContact CG1-OE1 3.38Å; V334-E338 WeakPolarHBondContact O-CB 3.45Å; V334-E338 WeakPolarHBondContact O-CG 3.28Å; V334-E338 PolarHBondContact O-N 3.27Å; E338-A340 VanDerWaalsContact C-N 3.29Å; E338-A340 PolarHBondContact O-N 3.33Å; E338-V341 WeakPolarHBondContact O-CG2 3.35Å; E338-V341 PolarHBondContact O-N 2.78Å; E338-L342 WeakPolarHBondContact O-CB 3.19Å; E338-L342 WeakPolarHBondContact O-CG 3.19Å; E338-L342 PolarHBondContact O-N 3.06Å; E338-L354 HydrophobicContact CG-CD1 3.96Å; E338-L354 HydrophobicContact CG-CD2 4.12Å
339	A	93.6	Very high	93.3	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-61.2	-39.2	172.7	0	0	0	0	0	111.6	Y311 A317 L335 L336 L342 Q343	Y311-A339 VanDerWaalsContact O-CB 3.26Å; Y311-A339 WeakPolarHBondContact O-CB 3.36Å; A317-A339 HydrophobicContact CB-CB 3.94Å; L335-A339 PolarHBondContact O-N 3.41Å; L336-A339 WeakPolarHBondContact O-CB 3.48Å; L336-A339 PolarHBondContact O-N 3.17Å; A339-L342 PolarHBondContact O-N 3.38Å; A339-Q343 VanDerWaalsContact O-CG 3.25Å; A339-Q343 WeakPolarHBondContact O-CG 3.34Å; A339-Q343 PolarHBondContact O-N 3.14Å
340	A	95.1	Very high	93.5	Very high	9 Å²	9	31 Å²	31	7%	0.074	16%	0.16	C	C	.	.	H	α-helix	trans	-62.1	-50.4	176.1	0	0	0	0	0	113.2	A317 F318 L336 L337 E338 L342 Q343 D344 A350	A317-A340 HydrophobicContact CB-CB 4.44Å; F318-A340 HydrophobicContact CB-CB 3.81Å; F318-A340 HydrophobicContact CD2-CB 4.5Å; L336-A340 PolarHBondContact O-N 2.93Å; L337-A340 WeakPolarHBondContact O-CB 3.42Å; L337-A340 PolarHBondContact O-N 3.43Å; E338-A340 VanDerWaalsContact C-N 3.29Å; E338-A340 PolarHBondContact O-N 3.33Å; A340-L342 PolarHBondContact O-N 2.88Å; A340-Q343 WeakPolarHBondContact O-CB 3.47Å; A340-Q343 PolarHBondContact O-N 2.87Å; A340-D344 PolarHBondContact O-N 3.11Å; A340-A350 HydrophobicContact CB-CB 4.26Å
341	V	94	Very high	93.7	Very high	1 Å²	1	31.1 Å²	31.1	1%	0.006	16%	0.161	C	C	.	.	H	α-helix	trans	-70.9	-18.3	178	-59.4	0	0	0	0	113.3	F305 L337 E338 D344 P345 A350 W351 L354	F305-V341 HydrophobicContact CE1-CG2 3.61Å; F305-V341 HydrophobicContact CZ-CG2 4.07Å; L337-V341 PolarHBondContact O-N 3.17Å; E338-V341 WeakPolarHBondContact O-CG2 3.35Å; E338-V341 PolarHBondContact O-N 2.78Å; V341-D344 CarbonylContact O-C 3.57Å; V341-P345 WeakPolarHBondContact O-CA 3.42Å; V341-P345 WeakPolarHBondContact O-CG 3.39Å; V341-P345 VanDerWaalsContact O-N 3.12Å; V341-A350 HydrophobicContact CG1-CB 3.52Å; V341-W351 HydrophobicContact CB-CD2 4.25Å; V341-W351 HydrophobicContact CB-CZ2 4.01Å; V341-W351 HydrophobicContact CG1-CD2 3.81Å; V341-W351 HydrophobicContact CG1-CE3 4.33Å; V341-W351 HydrophobicContact CG1-CG 3.91Å; V341-W351 HydrophobicContact CG1-CZ2 4.48Å; V341-W351 HydrophobicContact CG2-CH2 4.15Å; V341-W351 HydrophobicContact CG2-CZ2 4.06Å; V341-W351 HydrophobicContact CG2-CZ3 4.46Å; V341-L354 HydrophobicContact CG1-CD2 4.45Å; V341-L354 HydrophobicContact CG2-CD2 3.99Å
342	L	91.9	Very high	94	Very high	74 Å²	74	32.4 Å²	32.4	39%	0.387	17%	0.166	S	C	.	.	H	α-helix	trans	-78.4	-23	169	-71.6	171	0	0	0	112.5	F305 E338 A339 A340	F305-L342 HydrophobicContact CD1-CD1 4.15Å; F305-L342 HydrophobicContact CD1-CD2 4.23Å; F305-L342 HydrophobicContact CD1-CG 4.13Å; F305-L342 HydrophobicContact CD2-CD2 4.25Å; F305-L342 HydrophobicContact CE1-CD2 4.1Å; F305-L342 HydrophobicContact CE1-CG 4.03Å; F305-L342 HydrophobicContact CE2-CD2 4.1Å; F305-L342 HydrophobicContact CG-CD1 4.49Å; F305-L342 HydrophobicContact CG-CD2 4.3Å; F305-L342 HydrophobicContact CZ-CD2 4.02Å; F305-L342 HydrophobicContact CZ-CG 4.41Å; E338-L342 WeakPolarHBondContact O-CB 3.19Å; E338-L342 WeakPolarHBondContact O-CG 3.19Å; E338-L342 PolarHBondContact O-N 3.06Å; A339-L342 PolarHBondContact O-N 3.38Å; A340-L342 PolarHBondContact O-N 2.88Å
343	Q	90.4	Very high	94.3	Very high	96 Å²	96	32.1 Å²	32.1	45%	0.449	17%	0.165	S	C	.	.	H	α-helix	trans	-84.2	-39.8	173.9	-70.7	169.4	18.8	0	0	111.9	K312 L314 A339 A340	K312-Q343 PolarHBondContact O-NE2 3.04Å; L314-Q343 PolarHBondContact O-NE2 2.7Å; A339-Q343 VanDerWaalsContact O-CG 3.25Å; A339-Q343 WeakPolarHBondContact O-CG 3.34Å; A339-Q343 PolarHBondContact O-N 3.14Å; A340-Q343 WeakPolarHBondContact O-CB 3.47Å; A340-Q343 PolarHBondContact O-N 2.87Å
344	D	91.4	Very high	94.4	Very high	82 Å²	82	32.1 Å²	32.1	44%	0.439	17%	0.165	S	C	.	.			trans	-133.6	94.6	167.4	-169.6	-10.5	0	0	0	112.1	A340 V341 H346 D347	A340-D344 PolarHBondContact O-N 3.11Å; V341-D344 CarbonylContact O-C 3.57Å; D344-H346 PolarHBondContact O-N 2.9Å; D344-H346 VanDerWaalsContact O-N 3.09Å; D344-H346 WeakPolarHBondContact OD1-CA 3.16Å; D344-H346 WeakPolarHBondContact OD1-CB 3.41Å; D344-H346 PolarHBondContact OD1-N 3.26Å; D344-D347 HydrophobicContact CB-CB 4.34Å; D344-D347 PolarHBondContact O-N 3.19Å; D344-D347 PolarHBondContact OD1-N 3.08Å
345	P	92	Very high	94.5	Very high	42 Å²	42	32.1 Å²	32.1	27%	0.273	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-10	176.1	-23.7	34.2	0	0	0	115.1	V341 W351	V341-P345 WeakPolarHBondContact O-CA 3.42Å; V341-P345 WeakPolarHBondContact O-CG 3.39Å; V341-P345 VanDerWaalsContact O-N 3.12Å; P345-W351 PolarHBondContact O-NE1 3.45Å; P345-W351 VanDerWaalsContact O-NE1 3.11Å
346	H	92.4	Very high	94.8	Very high	141 Å²	141	33.3 Å²	33.3	65%	0.653	17%	0.173	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.2	-4.9	178.1	-68.9	-57	0	0	0	113.9	D344 S348	D344-H346 PolarHBondContact O-N 2.9Å; D344-H346 VanDerWaalsContact O-N 3.09Å; D344-H346 WeakPolarHBondContact OD1-CA 3.16Å; D344-H346 WeakPolarHBondContact OD1-CB 3.41Å; D344-H346 PolarHBondContact OD1-N 3.26Å; H346-S348 PolarHBondContact O-N 3.4Å; H346-S348 VanDerWaalsContact O-N 3.11Å
347	D	94.4	Very high	94.9	Very high	45 Å²	45	33.1 Å²	33.1	24%	0.241	17%	0.171	C	C	.	.			trans	-72.8	104.5	174.8	-178.8	19.2	0	0	0	112.1	D344 E349 A350 W351	D344-D347 HydrophobicContact CB-CB 4.34Å; D344-D347 PolarHBondContact O-N 3.19Å; D344-D347 PolarHBondContact OD1-N 3.08Å; D347-E349 PolarHBondContact O-N 2.85Å; D347-E349 WeakPolarHBondContact OD1-CB 3.42Å; D347-E349 PolarHBondContact OD1-N 3.2Å; D347-A350 HydrophobicContact CB-CB 4.11Å; D347-A350 WeakPolarHBondContact OD2-CB 3.1Å; D347-A350 PolarHBondContact OD2-N 2.89Å; D347-W351 PolarHBondContact O-N 2.9Å
348	S	95	Very high	94.9	Very high	25 Å²	25	33.2 Å²	33.2	18%	0.175	17%	0.172	C	C	.	.	H	α-helix	trans	-65.9	-22.3	175.2	71.4	0	0	0	0	113.9	H346 Q352 C374	H346-S348 PolarHBondContact O-N 3.4Å; H346-S348 VanDerWaalsContact O-N 3.11Å; S348-Q352 WeakPolarHBondContact O-CB 3.38Å; S348-Q352 PolarHBondContact O-N 3.26Å; S348-C374 PolarHBondContact O-SG 2.73Å
349	E	96.3	Very high	95	Very high	101 Å²	101	34 Å²	34	47%	0.472	18%	0.179	S	C	.	.	H	α-helix	trans	-78.6	-45.8	179	-157.6	177.9	152.5	0	0	111	F318 D347 W351 Q352 V353	F318-E349 HydrophobicContact CZ-CB 4.2Å; F318-E349 HydrophobicContact CZ-CG 3.9Å; D347-E349 PolarHBondContact O-N 2.85Å; D347-E349 WeakPolarHBondContact OD1-CB 3.42Å; D347-E349 PolarHBondContact OD1-N 3.2Å; E349-W351 VanDerWaalsContact C-N 3.32Å; E349-W351 PolarHBondContact O-N 2.8Å; E349-Q352 WeakPolarHBondContact O-CB 3.4Å; E349-Q352 PolarHBondContact O-N 2.86Å; E349-Q352 VanDerWaalsContact O-N 3.12Å; E349-V353 HydrophobicContact CG-CG2 4.48Å; E349-V353 WeakPolarHBondContact O-CG2 3.49Å; E349-V353 PolarHBondContact O-N 3.33Å
350	A	96.2	Very high	95.1	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-54.9	-44.7	169.2	0	0	0	0	0	112.4	F318 A340 V341 D347 Q352 V353 L354	F318-A350 HydrophobicContact CD2-CB 3.9Å; F318-A350 HydrophobicContact CE2-CB 4.11Å; A340-A350 HydrophobicContact CB-CB 4.26Å; V341-A350 HydrophobicContact CG1-CB 3.52Å; D347-A350 HydrophobicContact CB-CB 4.11Å; D347-A350 WeakPolarHBondContact OD2-CB 3.1Å; D347-A350 PolarHBondContact OD2-N 2.89Å; A350-Q352 PolarHBondContact O-N 2.89Å; A350-V353 PolarHBondContact O-N 3.11Å; A350-L354 VanDerWaalsContact O-CB 3.23Å; A350-L354 WeakPolarHBondContact O-CB 3.5Å; A350-L354 PolarHBondContact O-N 3.32Å
351	W	97.1	Very high	95.1	Very high	2 Å²	2	34.8 Å²	34.8	1%	0.008	18%	0.181	C	C	.	.	H	α-helix	trans	-63.7	-37.4	174.4	-80	113.3	0	0	0	113.8	Y303 F305 V341 P345 D347 E349 L354 G355 R373 C374 L377	Y303-W351 HydrophobicContact CD2-CZ3 4.09Å; Y303-W351 HydrophobicContact CG-CH2 4.26Å; Y303-W351 HydrophobicContact CG-CZ3 4.06Å; F305-W351 HydrophobicContact CE1-CH2 4.35Å; F305-W351 AromaticContact CZ-CH2 3.74Å; F305-W351 HydrophobicContact CZ-CH2 3.74Å; F305-W351 HydrophobicContact CZ-CZ2 4.25Å; V341-W351 HydrophobicContact CB-CD2 4.25Å; V341-W351 HydrophobicContact CB-CZ2 4.01Å; V341-W351 HydrophobicContact CG1-CD2 3.81Å; V341-W351 HydrophobicContact CG1-CE3 4.33Å; V341-W351 HydrophobicContact CG1-CG 3.91Å; V341-W351 HydrophobicContact CG1-CZ2 4.48Å; V341-W351 HydrophobicContact CG2-CH2 4.15Å; V341-W351 HydrophobicContact CG2-CZ2 4.06Å; V341-W351 HydrophobicContact CG2-CZ3 4.46Å; P345-W351 PolarHBondContact O-NE1 3.45Å; P345-W351 VanDerWaalsContact O-NE1 3.11Å; D347-W351 PolarHBondContact O-N 2.9Å; E349-W351 VanDerWaalsContact C-N 3.32Å; E349-W351 PolarHBondContact O-N 2.8Å; W351-L354 HydrophobicContact CE3-CD2 4.12Å; W351-L354 HydrophobicContact CZ3-CD2 4.02Å; W351-G355 PolarHBondContact O-N 3.07Å; W351-G355 VanDerWaalsContact O-N 3.12Å; W351-R373 HydrophobicContact CD2-CB 3.96Å; W351-R373 HydrophobicContact CD2-CG 3.5Å; W351-R373 VanDerWaalsContact CD2-CG 3.5Å; W351-R373 VanDerWaalsContact CE2-CG 3.43Å; W351-R373 HydrophobicContact CE3-CB 3.95Å; W351-R373 HydrophobicContact CE3-CG 3.88Å; W351-R373 HydrophobicContact CG-CB 4.35Å; W351-R373 HydrophobicContact CG-CG 3.95Å; W351-R373 HydrophobicContact CH2-CG 4.11Å; W351-R373 HydrophobicContact CZ2-CG 3.75Å; W351-R373 HydrophobicContact CZ3-CB 4.35Å; W351-R373 HydrophobicContact CZ3-CG 4.17Å; W351-C374 HydrophobicContact CB-CB 3.9Å; W351-L377 HydrophobicContact CG-CD1 4.42Å
352	Q	97.8	Very high	95.1	Very high	33 Å²	33	34.8 Å²	34.8	15%	0.154	18%	0.181	C	C	.	.	H	α-helix	trans	-62.2	-51.7	173.9	179.2	-157.2	-80.7	0	0	111	S348 E349 A350 G355 T356 C374 N381 P383 A384	S348-Q352 WeakPolarHBondContact O-CB 3.38Å; S348-Q352 PolarHBondContact O-N 3.26Å; E349-Q352 WeakPolarHBondContact O-CB 3.4Å; E349-Q352 PolarHBondContact O-N 2.86Å; E349-Q352 VanDerWaalsContact O-N 3.12Å; A350-Q352 PolarHBondContact O-N 2.89Å; Q352-G355 PolarHBondContact O-N 3.15Å; Q352-G355 VanDerWaalsContact O-N 3.17Å; Q352-T356 PolarHBondContact O-N 3.4Å; Q352-C374 HydrophobicContact CB-CB 4.47Å; Q352-N381 PolarHBondContact OE1-ND2 3.36Å; Q352-N381 PolarHBondContact OE1-OD1 3.4Å; Q352-N381 VanDerWaalsContact OE1-OD1 3.07Å; Q352-P383 HydrophobicContact CG-CB 4.45Å; Q352-A384 HydrophobicContact CG-CB 4.24Å
353	V	97.7	Very high	95.1	Very high	10 Å²	10	34 Å²	34	6%	0.061	18%	0.177	C	C	.	.	H	α-helix	trans	-70.9	-37	-173.5	179	0	0	0	0	111	F318 L322 L337 E349 A350 G355 T356 T357	F318-V353 HydrophobicContact CE2-CB 4.22Å; F318-V353 HydrophobicContact CE2-CG2 4.11Å; F318-V353 HydrophobicContact CZ-CG2 4.35Å; L322-V353 HydrophobicContact CD2-CG1 3.76Å; L322-V353 HydrophobicContact CD2-CG2 4.09Å; L322-V353 HydrophobicContact CG-CG1 4.41Å; L337-V353 HydrophobicContact CD1-CG1 3.78Å; L337-V353 HydrophobicContact CD2-CB 4.12Å; L337-V353 HydrophobicContact CD2-CG1 3.71Å; L337-V353 HydrophobicContact CG-CG1 4.42Å; E349-V353 HydrophobicContact CG-CG2 4.48Å; E349-V353 WeakPolarHBondContact O-CG2 3.49Å; E349-V353 PolarHBondContact O-N 3.33Å; A350-V353 PolarHBondContact O-N 3.11Å; V353-G355 VanDerWaalsContact C-N 3.29Å; V353-G355 PolarHBondContact O-N 3.49Å; V353-T356 PolarHBondContact O-OG1 3.04Å; V353-T357 VanDerWaalsContact O-CB 3.28Å; V353-T357 WeakPolarHBondContact O-CB 3.43Å; V353-T357 PolarHBondContact O-N 2.87Å; V353-T357 PolarHBondContact O-OG1 2.76Å
354	L	97	Very high	95	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-58	-44.2	169.1	-179.1	57.4	0	0	0	110.9	Y303 V334 L337 E338 V341 A350 W351 T357 Q358	Y303-L354 HydrophobicContact CE1-CD2 4.36Å; Y303-L354 HydrophobicContact CE2-CD2 4.25Å; V334-L354 HydrophobicContact CG1-CD1 4.28Å; L337-L354 HydrophobicContact CB-CB 4.11Å; L337-L354 HydrophobicContact CB-CD1 3.88Å; E338-L354 HydrophobicContact CG-CD1 3.96Å; E338-L354 HydrophobicContact CG-CD2 4.12Å; V341-L354 HydrophobicContact CG1-CD2 4.45Å; V341-L354 HydrophobicContact CG2-CD2 3.99Å; A350-L354 VanDerWaalsContact O-CB 3.23Å; A350-L354 WeakPolarHBondContact O-CB 3.5Å; A350-L354 PolarHBondContact O-N 3.32Å; W351-L354 HydrophobicContact CE3-CD2 4.12Å; W351-L354 HydrophobicContact CZ3-CD2 4.02Å; L354-T357 PolarHBondContact O-N 3.02Å; L354-Q358 HydrophobicContact CD1-CG 4.21Å; L354-Q358 WeakPolarHBondContact O-CB 3.47Å; L354-Q358 WeakPolarHBondContact O-CG 3.24Å; L354-Q358 PolarHBondContact O-N 3.42Å
355	G	96.8	Very high	94.9	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-63.3	-46.5	178.6	0	0	0	0	0	114.4	W351 Q352 V353 A359 A367 S370	W351-G355 PolarHBondContact O-N 3.07Å; W351-G355 VanDerWaalsContact O-N 3.12Å; Q352-G355 PolarHBondContact O-N 3.15Å; Q352-G355 VanDerWaalsContact O-N 3.17Å; V353-G355 VanDerWaalsContact C-N 3.29Å; V353-G355 PolarHBondContact O-N 3.49Å; G355-A359 PolarHBondContact O-N 3.4Å; G355-A359 VanDerWaalsContact O-N 3.16Å; G355-A367 VanDerWaalsContact O-CB 3.25Å; G355-A367 WeakPolarHBondContact O-CB 3.3Å; G355-S370 VanDerWaalsContact CA-CB 3.45Å
356	T	97.6	Very high	94.9	Very high	34 Å²	34	30.8 Å²	30.8	21%	0.209	16%	0.158	C	C	.	.	H	α-helix	trans	-66.6	-43.5	175.8	57.4	0	0	0	0	111.4	Q352 V353 Q358 A359 E360 L371 A387	Q352-T356 PolarHBondContact O-N 3.4Å; V353-T356 PolarHBondContact O-OG1 3.04Å; T356-Q358 VanDerWaalsContact C-N 3.33Å; T356-Q358 PolarHBondContact O-N 3.37Å; T356-A359 WeakPolarHBondContact O-CB 3.27Å; T356-A359 PolarHBondContact O-N 3.05Å; T356-E360 WeakPolarHBondContact O-CG 3.39Å; T356-E360 PolarHBondContact O-N 2.85Å; T356-L371 HydrophobicContact CG2-CD2 4.43Å; T356-A387 HydrophobicContact CG2-CB 3.91Å
357	T	97.2	Very high	95	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-61.7	-39.9	179.3	-50.3	0	0	0	0	111.5	L330 A333 V334 L337 V353 L354 E360 N361	L330-T357 HydrophobicContact CB-CG2 4.35Å; L330-T357 HydrophobicContact CD2-CG2 4.11Å; A333-T357 HydrophobicContact CB-CG2 4.01Å; V334-T357 HydrophobicContact CG2-CG2 3.78Å; L337-T357 HydrophobicContact CD1-CG2 4.32Å; L337-T357 WeakPolarHBondContact CD1-OG1 3.46Å; V353-T357 VanDerWaalsContact O-CB 3.28Å; V353-T357 WeakPolarHBondContact O-CB 3.43Å; V353-T357 PolarHBondContact O-N 2.87Å; V353-T357 PolarHBondContact O-OG1 2.76Å; L354-T357 PolarHBondContact O-N 3.02Å; T357-E360 PolarHBondContact O-N 3.44Å; T357-N361 WeakPolarHBondContact O-CB 3.43Å; T357-N361 PolarHBondContact O-N 2.95Å
358	Q	95.4	Very high	95	Very high	3 Å²	3	22.3 Å²	22.3	1%	0.014	12%	0.118	C	C	.	.	H	α-helix	trans	-65.8	-36.4	173.8	-73.1	-74.8	26.4	0	0	112.7	Y303 V334 L354 T356 E360 N361 E362 N363 A366 A367	Y303-Q358 PolarHBondContact OH-NE2 3.05Å; V334-Q358 VanDerWaalsContact CG1-NE2 3.29Å; V334-Q358 HydrophobicContact CG2-CG 4.1Å; L354-Q358 HydrophobicContact CD1-CG 4.21Å; L354-Q358 WeakPolarHBondContact O-CB 3.47Å; L354-Q358 WeakPolarHBondContact O-CG 3.24Å; L354-Q358 PolarHBondContact O-N 3.42Å; T356-Q358 VanDerWaalsContact C-N 3.33Å; T356-Q358 PolarHBondContact O-N 3.37Å; Q358-E360 VanDerWaalsContact C-N 3.32Å; Q358-E360 PolarHBondContact O-N 3.36Å; Q358-N361 PolarHBondContact O-N 2.69Å; Q358-N361 PolarHBondContact OE1-ND2 2.89Å; Q358-E362 PolarHBondContact O-N 3.22Å; Q358-N363 HydrophobicContact CB-CB 4.48Å; Q358-N363 CarbonylContact O-C 3.51Å; Q358-N363 PolarHBondContact O-N 3.3Å; Q358-N363 PolarHBondContact OE1-ND2 3.11Å; Q358-A366 HydrophobicContact CB-CB 4.13Å; Q358-A366 HydrophobicContact CG-CB 3.89Å; Q358-A367 HydrophobicContact CB-CB 4.11Å
359	A	95.9	Very high	94.9	Very high	17 Å²	17	22 Å²	22	14%	0.14	12%	0.115	C	C	.	.	H	α-helix	trans	-65.3	-37.2	175	0	0	0	0	0	111.8	G355 T356 A367 R538	G355-A359 PolarHBondContact O-N 3.4Å; G355-A359 VanDerWaalsContact O-N 3.16Å; T356-A359 WeakPolarHBondContact O-CB 3.27Å; T356-A359 PolarHBondContact O-N 3.05Å; A359-A367 HydrophobicContact CB-CB 3.75Å; A359-R538 PolarHBondContact O-NE 2.75Å; A359-R538 PolarHBondContact O-NH2 3.2Å
360	E	96.1	Very high	94.9	Very high	12 Å²	12	17.2 Å²	17.2	6%	0.056	9%	0.093	C	C	.	.	H	α-helix	trans	-74.3	-26.6	176.3	-65.1	167.5	-133.7	0	0	112.9	L330 T356 T357 Q358 E362 Y503 L504 F536 I537 R538	L330-E360 HydrophobicContact CD1-CB 3.91Å; T356-E360 WeakPolarHBondContact O-CG 3.39Å; T356-E360 PolarHBondContact O-N 2.85Å; T357-E360 PolarHBondContact O-N 3.44Å; Q358-E360 VanDerWaalsContact C-N 3.32Å; Q358-E360 PolarHBondContact O-N 3.36Å; E360-E362 VanDerWaalsContact C-N 3.28Å; E360-E362 PolarHBondContact O-N 2.86Å; E360-Y503 PolarHBondContact OE2-OH 3.43Å; E360-L504 HydrophobicContact CG-CD2 3.87Å; E360-F536 HydrophobicContact CB-CD2 4.09Å; E360-F536 HydrophobicContact CB-CE2 3.9Å; E360-F536 HydrophobicContact CG-CD2 4.39Å; E360-F536 HydrophobicContact CG-CE2 3.81Å; E360-I537 PolarHBondContact O-N 3Å; E360-R538 WeakPolarHBondContact O-CB 3.39Å; E360-R538 PolarHBondContact O-N 3.5Å
361	N	94.6	Very high	95	Very high	12 Å²	12	17.2 Å²	17.2	6%	0.064	9%	0.093	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.4	7.7	175.4	-170.8	38.4	0	0	0	113.9	L330 T357 Q358 I537 Q567	L330-N361 HydrophobicContact CB-CB 4.5Å; T357-N361 WeakPolarHBondContact O-CB 3.43Å; T357-N361 PolarHBondContact O-N 2.95Å; Q358-N361 PolarHBondContact O-N 2.69Å; Q358-N361 PolarHBondContact OE1-ND2 2.89Å; N361-I537 VanDerWaalsContact OD1-CD1 3.28Å; N361-I537 WeakPolarHBondContact OD1-CD1 2.96Å; N361-Q567 PolarHBondContact O-NE2 3.43Å
362	E	94.1	Very high	94.9	Very high	1 Å²	1	21.7 Å²	21.7	1%	0.005	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.9	42.4	-175.6	-171.4	49.6	-117.5	0	0	113	Q358 E360 I537 R538 Y541 S581 N583 I584	Q358-E362 PolarHBondContact O-N 3.22Å; E360-E362 VanDerWaalsContact C-N 3.28Å; E360-E362 PolarHBondContact O-N 2.86Å; E362-I537 HydrophobicContact CB-CG2 3.89Å; E362-R538 IonicContact OE1-CZ 2.64Å; E362-R538 IonicContact OE1-NH1 2.75Å; E362-R538 PolarHBondContact OE1-NH1 3.5Å; E362-R538 VanDerWaalsContact OE1-NH1 3.11Å; E362-R538 WeakPolarHBondContact OE2-CD 3.45Å; E362-R538 IonicContact OE2-CZ 2.68Å; E362-R538 IonicContact OE2-NE 3.47Å; E362-R538 PolarHBondContact OE2-NE 3.05Å; E362-R538 VanDerWaalsContact OE2-NE 3.11Å; E362-R538 IonicContact OE2-NH1 3.61Å; E362-R538 PolarHBondContact OE2-NH1 3.11Å; E362-Y541 HydrophobicContact CG-CD1 4.28Å; E362-Y541 HydrophobicContact CG-CG 4.12Å; E362-Y541 WeakPolarHBondContact OE2-CD1 3.27Å; E362-S581 VanDerWaalsContact O-CB 3.31Å; E362-S581 WeakPolarHBondContact O-CB 3.36Å; E362-S581 PolarHBondContact O-OG 3.44Å; E362-N583 HydrophobicContact CG-CB 4.48Å; E362-N583 PolarHBondContact OE1-ND2 2.96Å; E362-I584 HydrophobicContact CB-CD1 4.07Å; E362-I584 HydrophobicContact CB-CG1 4.44Å; E362-I584 HydrophobicContact CG-CD1 3.9Å; E362-I584 HydrophobicContact CG-CG1 3.72Å
363	N	90.8	Very high	94.7	Very high	57 Å²	57	21.3 Å²	21.3	31%	0.305	11%	0.11	S	C	.	.			trans	-130.2	74.2	174.4	-173.5	-3.6	0	0	0	111.1	Q358 Q365 A366 A367	Q358-N363 HydrophobicContact CB-CB 4.48Å; Q358-N363 CarbonylContact O-C 3.51Å; Q358-N363 PolarHBondContact O-N 3.3Å; Q358-N363 PolarHBondContact OE1-ND2 3.11Å; N363-Q365 VanDerWaalsContact C-N 3.31Å; N363-Q365 PolarHBondContact O-N 2.76Å; N363-A366 HydrophobicContact CB-CB 4.49Å; N363-A366 VanDerWaalsContact CG-CB 3.48Å; N363-A366 VanDerWaalsContact ND2-CB 3.32Å; N363-A366 WeakPolarHBondContact ND2-CB 3.41Å; N363-A366 PolarHBondContact O-N 2.77Å; N363-A366 WeakPolarHBondContact OD1-CB 3.47Å; N363-A366 PolarHBondContact OD1-N 2.89Å; N363-A367 PolarHBondContact O-N 2.98Å; N363-A367 VanDerWaalsContact O-N 3.1Å
364	E	88.6	Confident	94.7	Very high	16 Å²	16	20.8 Å²	20.8	8%	0.075	11%	0.108	C	C	.	.	H	α-helix	trans	-62.6	-34.1	-174	-154.7	72.1	-92.7	0	0	113.5	A367 I368 S391 N394 T395 R538	E364-A367 WeakPolarHBondContact O-CB 3.37Å; E364-A367 PolarHBondContact O-N 3.26Å; E364-I368 HydrophobicContact CG-CD1 4.16Å; E364-I368 VanDerWaalsContact O-CG1 3.32Å; E364-I368 WeakPolarHBondContact O-CG1 3.44Å; E364-I368 PolarHBondContact O-N 3.41Å; E364-S391 WeakPolarHBondContact OE1-CA 3.16Å; E364-S391 WeakPolarHBondContact OE1-CB 3.32Å; E364-S391 PolarHBondContact OE1-OG 2.96Å; E364-N394 HydrophobicContact CG-CB 4.45Å; E364-N394 VanDerWaalsContact OE2-CB 3.28Å; E364-N394 WeakPolarHBondContact OE2-CB 3.43Å; E364-N394 PolarHBondContact OE2-ND2 3.05Å; E364-T395 HydrophobicContact CB-CG2 4.41Å; E364-T395 HydrophobicContact CG-CG2 3.73Å; E364-R538 IonicContact OE1-NH2 3.92Å; E364-R538 IonicContact OE2-CZ 2.85Å; E364-R538 IonicContact OE2-NH1 2.74Å; E364-R538 PolarHBondContact OE2-NH1 3.33Å; E364-R538 IonicContact OE2-NH2 2.89Å; E364-R538 PolarHBondContact OE2-NH2 3.33Å
365	Q	89.6	Confident	94.6	Very high	123 Å²	123	21.9 Å²	21.9	58%	0.575	11%	0.113	S	C	*	.	H	α-helix	trans	-68.4	-45	-178.9	-175.4	59.1	29.3	0	0	111.6	N363 A367 I368 V369	N363-Q365 VanDerWaalsContact C-N 3.31Å; N363-Q365 PolarHBondContact O-N 2.76Å; Q365-A367 VanDerWaalsContact C-N 3.29Å; Q365-A367 PolarHBondContact O-N 3.02Å; Q365-I368 PolarHBondContact O-N 3.12Å; Q365-V369 WeakPolarHBondContact O-CG2 3.47Å; Q365-V369 PolarHBondContact O-N 3.12Å
366	A	91.3	Very high	94.5	Very high	14 Å²	14	26.7 Å²	26.7	12%	0.116	14%	0.136	C	C	.	.	H	α-helix	trans	-66.4	-33.9	174.7	0	0	0	0	0	111.8	Y303 Q358 N363 S370	Y303-A366 HydrophobicContact CE2-CB 3.91Å; Q358-A366 HydrophobicContact CB-CB 4.13Å; Q358-A366 HydrophobicContact CG-CB 3.89Å; N363-A366 HydrophobicContact CB-CB 4.49Å; N363-A366 VanDerWaalsContact CG-CB 3.48Å; N363-A366 VanDerWaalsContact ND2-CB 3.32Å; N363-A366 WeakPolarHBondContact ND2-CB 3.41Å; N363-A366 PolarHBondContact O-N 2.77Å; N363-A366 WeakPolarHBondContact OD1-CB 3.47Å; N363-A366 PolarHBondContact OD1-N 2.89Å; A366-S370 WeakPolarHBondContact O-CB 3.3Å; A366-S370 PolarHBondContact O-N 3.21Å; A366-S370 VanDerWaalsContact O-N 3.08Å; A366-S370 PolarHBondContact O-OG 2.92Å
367	A	95	Very high	94.3	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-61.2	-54.7	173.7	0	0	0	0	0	111.9	G355 Q358 A359 N363 E364 Q365 V369 S370 L371	G355-A367 VanDerWaalsContact O-CB 3.25Å; G355-A367 WeakPolarHBondContact O-CB 3.3Å; Q358-A367 HydrophobicContact CB-CB 4.11Å; A359-A367 HydrophobicContact CB-CB 3.75Å; N363-A367 PolarHBondContact O-N 2.98Å; N363-A367 VanDerWaalsContact O-N 3.1Å; E364-A367 WeakPolarHBondContact O-CB 3.37Å; E364-A367 PolarHBondContact O-N 3.26Å; Q365-A367 VanDerWaalsContact C-N 3.29Å; Q365-A367 PolarHBondContact O-N 3.02Å; A367-V369 VanDerWaalsContact C-N 3.33Å; A367-V369 PolarHBondContact O-N 2.88Å; A367-S370 PolarHBondContact O-N 3.49Å; A367-L371 WeakPolarHBondContact O-CB 3.35Å; A367-L371 WeakPolarHBondContact O-CG 3.1Å; A367-L371 PolarHBondContact O-N 2.89Å
368	I	94.8	Very high	94.2	Very high	8 Å²	8	31.1 Å²	31.1	4%	0.041	16%	0.155	C	C	.	.	H	α-helix	trans	-55.5	-47.6	-179.3	-71.9	168.4	0	0	0	111	E364 Q365 L371 Q372 L388 L392 T395	E364-I368 HydrophobicContact CG-CD1 4.16Å; E364-I368 VanDerWaalsContact O-CG1 3.32Å; E364-I368 WeakPolarHBondContact O-CG1 3.44Å; E364-I368 PolarHBondContact O-N 3.41Å; Q365-I368 PolarHBondContact O-N 3.12Å; I368-L371 PolarHBondContact O-N 3.13Å; I368-Q372 HydrophobicContact CG2-CG 4.44Å; I368-Q372 WeakPolarHBondContact O-CB 3.46Å; I368-Q372 VanDerWaalsContact O-CG 3.23Å; I368-Q372 WeakPolarHBondContact O-CG 3.29Å; I368-Q372 PolarHBondContact O-N 3.06Å; I368-L388 HydrophobicContact CB-CD1 4.39Å; I368-L388 HydrophobicContact CG1-CD1 4.3Å; I368-L388 HydrophobicContact CG2-CD1 4.07Å; I368-L392 HydrophobicContact CD1-CD2 4.14Å; I368-L392 HydrophobicContact CG2-CD2 4.41Å; I368-T395 HydrophobicContact CD1-CG2 3.65Å
369	V	94.1	Very high	94.2	Very high	20 Å²	20	34.3 Å²	34.3	12%	0.121	18%	0.176	C	C	.	.	H	α-helix	trans	-63.5	-44.5	179.5	175.7	0	0	0	0	111.7	Y303 Q365 A367 Q372 R373	Y303-V369 HydrophobicContact CD2-CB 4.44Å; Y303-V369 HydrophobicContact CD2-CG1 4.18Å; Q365-V369 WeakPolarHBondContact O-CG2 3.47Å; Q365-V369 PolarHBondContact O-N 3.12Å; A367-V369 VanDerWaalsContact C-N 3.33Å; A367-V369 PolarHBondContact O-N 2.88Å; V369-Q372 PolarHBondContact O-N 3.02Å; V369-R373 WeakPolarHBondContact O-CB 3.28Å; V369-R373 PolarHBondContact O-N 3.24Å
370	S	94.9	Very high	94.1	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-64.3	-42.3	179.2	-54.8	0	0	0	0	112.3	Y303 G355 A366 A367 R373 C374	Y303-S370 WeakPolarHBondContact CD2-OG 3.42Å; Y303-S370 WeakPolarHBondContact CE2-OG 3.37Å; G355-S370 VanDerWaalsContact CA-CB 3.45Å; A366-S370 WeakPolarHBondContact O-CB 3.3Å; A366-S370 PolarHBondContact O-N 3.21Å; A366-S370 VanDerWaalsContact O-N 3.08Å; A366-S370 PolarHBondContact O-OG 2.92Å; A367-S370 PolarHBondContact O-N 3.49Å; S370-R373 WeakPolarHBondContact O-CB 3.47Å; S370-R373 PolarHBondContact O-N 3.23Å; S370-C374 PolarHBondContact O-N 2.94Å
371	L	97.6	Very high	94.1	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-69.2	-37.7	178.8	-65.1	168	0	0	0	111.4	T356 A367 I368 C374 L375 A384 A387 L388	T356-L371 HydrophobicContact CG2-CD2 4.43Å; A367-L371 WeakPolarHBondContact O-CB 3.35Å; A367-L371 WeakPolarHBondContact O-CG 3.1Å; A367-L371 PolarHBondContact O-N 2.89Å; I368-L371 PolarHBondContact O-N 3.13Å; L371-C374 WeakPolarHBondContact O-CB 3.32Å; L371-L375 WeakPolarHBondContact O-CD1 3.33Å; L371-L375 VanDerWaalsContact O-CG 3.24Å; L371-L375 WeakPolarHBondContact O-CG 3.35Å; L371-L375 PolarHBondContact O-N 2.89Å; L371-L375 VanDerWaalsContact O-N 3.09Å; L371-A384 HydrophobicContact CD2-CB 4.21Å; L371-A387 HydrophobicContact CD1-CB 3.74Å; L371-A387 HydrophobicContact CD2-CB 3.91Å; L371-A387 HydrophobicContact CG-CB 4.5Å; L371-L388 HydrophobicContact CB-CB 4.13Å; L371-L388 HydrophobicContact CB-CD1 4.3Å; L371-L388 HydrophobicContact CD1-CB 4.34Å
372	Q	95.4	Very high	94.3	Very high	95 Å²	95	38.3 Å²	38.3	44%	0.444	20%	0.196	S	C	.	.	H	α-helix	trans	-62.2	-43.9	169.7	-74.2	174.8	4.1	0	0	111.4	I368 V369 L375 E376 L388	I368-Q372 HydrophobicContact CG2-CG 4.44Å; I368-Q372 WeakPolarHBondContact O-CB 3.46Å; I368-Q372 VanDerWaalsContact O-CG 3.23Å; I368-Q372 WeakPolarHBondContact O-CG 3.29Å; I368-Q372 PolarHBondContact O-N 3.06Å; V369-Q372 PolarHBondContact O-N 3.02Å; Q372-L375 CarbonylContact O-C 3.48Å; Q372-L375 WeakPolarHBondContact O-CA 3.28Å; Q372-L375 PolarHBondContact O-N 3.05Å; Q372-E376 PolarHBondContact O-N 2.84Å; Q372-L388 HydrophobicContact CG-CD1 4.2Å; Q372-L388 HydrophobicContact CG-CD2 4.11Å
373	R	94.7	Very high	94.4	Very high	25 Å²	25	41.8 Å²	41.8	9%	0.094	22%	0.218	C	C	.	.	H	α-helix	trans	-62.5	-42.6	177.4	-170.6	62	170.5	124.6	9.1	112.3	E300 W351 V369 S370 L375 E376 L377	E300-R373 IonicContact OE1-NH2 3.7Å; E300-R373 PolarHBondContact OE1-NH2 2.78Å; E300-R373 IonicContact OE2-CZ 2.89Å; E300-R373 IonicContact OE2-NE 2.8Å; E300-R373 PolarHBondContact OE2-NE 3.33Å; E300-R373 VanDerWaalsContact OE2-NE 3.16Å; E300-R373 IonicContact OE2-NH2 2.75Å; E300-R373 PolarHBondContact OE2-NH2 3.19Å; W351-R373 HydrophobicContact CD2-CB 3.96Å; W351-R373 HydrophobicContact CD2-CG 3.5Å; W351-R373 VanDerWaalsContact CD2-CG 3.5Å; W351-R373 VanDerWaalsContact CE2-CG 3.43Å; W351-R373 HydrophobicContact CE3-CB 3.95Å; W351-R373 HydrophobicContact CE3-CG 3.88Å; W351-R373 HydrophobicContact CG-CB 4.35Å; W351-R373 HydrophobicContact CG-CG 3.95Å; W351-R373 HydrophobicContact CH2-CG 4.11Å; W351-R373 HydrophobicContact CZ2-CG 3.75Å; W351-R373 HydrophobicContact CZ3-CB 4.35Å; W351-R373 HydrophobicContact CZ3-CG 4.17Å; V369-R373 WeakPolarHBondContact O-CB 3.28Å; V369-R373 PolarHBondContact O-N 3.24Å; S370-R373 WeakPolarHBondContact O-CB 3.47Å; S370-R373 PolarHBondContact O-N 3.23Å; R373-L375 VanDerWaalsContact C-N 3.26Å; R373-L375 PolarHBondContact O-N 3.14Å; R373-E376 WeakPolarHBondContact CD-OE2 3.41Å; R373-E376 IonicContact CZ-OE2 3.86Å; R373-E376 IonicContact NE-OE2 2.87Å; R373-E376 IonicContact NH1-OE2 2.71Å; R373-E376 PolarHBondContact NH1-OE2 2.92Å; R373-E376 PolarHBondContact O-N 3.5Å; R373-L377 WeakPolarHBondContact O-CG 3.39Å; R373-L377 PolarHBondContact O-N 3.48Å
374	C	96.9	Very high	94.8	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-54.4	-42.4	168.7	169.9	0	0	0	0	111.9	S348 W351 Q352 S370 L371 L377 H378 N381 A384	S348-C374 PolarHBondContact O-SG 2.73Å; W351-C374 HydrophobicContact CB-CB 3.9Å; Q352-C374 HydrophobicContact CB-CB 4.47Å; S370-C374 PolarHBondContact O-N 2.94Å; L371-C374 WeakPolarHBondContact O-CB 3.32Å; C374-L377 PolarHBondContact O-N 3.17Å; C374-H378 PolarHBondContact O-N 3.09Å; C374-N381 PolarHBondContact SG-ND2 3.14Å; C374-A384 HydrophobicContact CB-CB 4.36Å; C374-A384 VanDerWaalsContact SG-CB 3.59Å
375	L	95.3	Very high	95.2	Very high	23 Å²	23	38.5 Å²	38.5	12%	0.12	20%	0.201	C	C	.	.	H	α-helix	trans	-81.1	-18	-176.3	-68.1	168.6	0	0	0	114	L371 Q372 R373 L377 P379 N381 A384 L385 L388	L371-L375 WeakPolarHBondContact O-CD1 3.33Å; L371-L375 VanDerWaalsContact O-CG 3.24Å; L371-L375 WeakPolarHBondContact O-CG 3.35Å; L371-L375 PolarHBondContact O-N 2.89Å; L371-L375 VanDerWaalsContact O-N 3.09Å; Q372-L375 CarbonylContact O-C 3.48Å; Q372-L375 WeakPolarHBondContact O-CA 3.28Å; Q372-L375 PolarHBondContact O-N 3.05Å; R373-L375 VanDerWaalsContact C-N 3.26Å; R373-L375 PolarHBondContact O-N 3.14Å; L375-L377 VanDerWaalsContact C-N 3.35Å; L375-P379 VanDerWaalsContact O-CA 3.31Å; L375-P379 WeakPolarHBondContact O-CA 3.43Å; L375-P379 WeakPolarHBondContact O-CG 3.18Å; L375-N381 HydrophobicContact CD2-CB 4.03Å; L375-A384 HydrophobicContact CD1-CB 4.39Å; L375-A384 HydrophobicContact CD2-CB 3.99Å; L375-A384 HydrophobicContact CG-CB 4.04Å; L375-L385 HydrophobicContact CD1-CD2 3.72Å; L375-L385 HydrophobicContact CD1-CG 4.12Å; L375-L385 HydrophobicContact CD2-CD1 4.44Å; L375-L385 HydrophobicContact CD2-CD2 3.98Å; L375-L385 HydrophobicContact CD2-CG 3.7Å; L375-L388 HydrophobicContact CD1-CD2 3.66Å
376	E	94.3	Very high	95.6	Very high	100 Å²	100	33.3 Å²	33.3	47%	0.467	18%	0.177	S	C	.	.	H	α-helix	trans	-64.9	-41.2	162.9	-63.9	-168.2	136.3	0	0	111.6	K301 Q372 R373	K301-E376 WeakPolarHBondContact CD-OE2 3.42Å; K301-E376 IonicContact NZ-OE1 2.85Å; K301-E376 PolarHBondContact NZ-OE1 3Å; K301-E376 IonicContact NZ-OE2 3.35Å; K301-E376 PolarHBondContact NZ-OE2 3.09Å; Q372-E376 PolarHBondContact O-N 2.84Å; R373-E376 WeakPolarHBondContact CD-OE2 3.41Å; R373-E376 IonicContact CZ-OE2 3.86Å; R373-E376 IonicContact NE-OE2 2.87Å; R373-E376 IonicContact NH1-OE2 2.71Å; R373-E376 PolarHBondContact NH1-OE2 2.92Å; R373-E376 PolarHBondContact O-N 3.5Å
377	L	94	Very high	96	Very high	54 Å²	54	33.3 Å²	33.3	28%	0.283	18%	0.177	S	C	.	.	H	α-helix	trans	-78.3	-42.3	-177.1	-63.5	166.7	0	0	0	111.4	W351 R373 C374 L375	W351-L377 HydrophobicContact CG-CD1 4.42Å; R373-L377 WeakPolarHBondContact O-CG 3.39Å; R373-L377 PolarHBondContact O-N 3.48Å; C374-L377 PolarHBondContact O-N 3.17Å; L375-L377 VanDerWaalsContact C-N 3.35Å
378	H	95.3	Very high	96.1	Very high	73 Å²	73	33.9 Å²	33.9	34%	0.338	18%	0.18	S	C	.	.			trans	-139.3	80	-175.1	-170.4	-157.1	0	0	0	111.4	C374 N380 N381	C374-H378 PolarHBondContact O-N 3.09Å; H378-N380 PolarHBondContact CD2-ND2 3.32Å; H378-N380 PolarHBondContact CD2-OD1 3.29Å; H378-N380 VanDerWaalsContact CD2-OD1 3.31Å; H378-N380 PolarHBondContact NE2-ND2 2.98Å; H378-N380 PolarHBondContact O-N 2.91Å; H378-N381 VanDerWaalsContact O-CB 3.32Å; H378-N381 WeakPolarHBondContact O-CB 3.36Å; H378-N381 PolarHBondContact O-N 3.47Å
379	P	94.7	Very high	96.3	Very high	70 Å²	70	33.5 Å²	33.5	46%	0.455	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-18.2	-171.1	-25.2	32.8	0	0	0	116.1	L375	L375-P379 VanDerWaalsContact O-CA 3.31Å; L375-P379 WeakPolarHBondContact O-CA 3.43Å; L375-P379 WeakPolarHBondContact O-CG 3.18Å
380	N	94.2	Very high	96.4	Very high	77 Å²	77	33.6 Å²	33.6	41%	0.412	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.4	16.4	178.9	61.6	-92.5	0	0	0	113.6	H378 L382 H411	H378-N380 PolarHBondContact CD2-ND2 3.32Å; H378-N380 PolarHBondContact CD2-OD1 3.29Å; H378-N380 VanDerWaalsContact CD2-OD1 3.31Å; H378-N380 PolarHBondContact NE2-ND2 2.98Å; H378-N380 PolarHBondContact O-N 2.91Å; N380-L382 PolarHBondContact O-N 3.43Å; N380-L382 VanDerWaalsContact O-N 3.15Å; N380-H411 HydrophobicContact CB-CB 4Å; N380-H411 WeakPolarHBondContact CB-ND1 3.32Å
381	N	97	Very high	96.5	Very high	10 Å²	10	33.7 Å²	33.7	5%	0.053	18%	0.18	C	C	.	.			trans	-69.3	103.9	173.4	-173.9	-37.6	0	0	0	110.4	Q352 C374 L375 H378 P383 A384 L385	Q352-N381 PolarHBondContact OE1-ND2 3.36Å; Q352-N381 PolarHBondContact OE1-OD1 3.4Å; Q352-N381 VanDerWaalsContact OE1-OD1 3.07Å; C374-N381 PolarHBondContact SG-ND2 3.14Å; L375-N381 HydrophobicContact CD2-CB 4.03Å; H378-N381 VanDerWaalsContact O-CB 3.32Å; H378-N381 WeakPolarHBondContact O-CB 3.36Å; H378-N381 PolarHBondContact O-N 3.47Å; N381-P383 WeakPolarHBondContact OD1-CD 3.08Å; N381-A384 HydrophobicContact CB-CB 3.94Å; N381-A384 PolarHBondContact O-N 3.43Å; N381-A384 WeakPolarHBondContact OD1-CB 3.21Å; N381-A384 PolarHBondContact OD1-N 3.33Å; N381-L385 WeakPolarHBondContact O-CG 3.25Å; N381-L385 PolarHBondContact O-N 3.06Å
382	L	97.1	Very high	96.3	Very high	39 Å²	39	34 Å²	34	20%	0.204	18%	0.181	C	C	.	.	H	α-helix	trans	-69.6	-43.3	-176.3	-58.7	177.9	0	0	0	113.6	N380 A384 L385 M386 W408 H411 N412	N380-L382 PolarHBondContact O-N 3.43Å; N380-L382 VanDerWaalsContact O-N 3.15Å; L382-A384 PolarHBondContact O-N 2.95Å; L382-L385 HydrophobicContact CD2-CD1 4.47Å; L382-L385 PolarHBondContact O-N 3.44Å; L382-M386 PolarHBondContact O-N 3.01Å; L382-W408 HydrophobicContact CD2-CG 4.31Å; L382-W408 PolarHBondContact O-NE1 3.4Å; L382-H411 HydrophobicContact CD2-CB 3.95Å; L382-N412 HydrophobicContact CD1-CB 4.01Å; L382-N412 HydrophobicContact CD2-CB 4.1Å
383	P	97.6	Very high	96.3	Very high	74 Å²	74	30.8 Å²	30.8	48%	0.481	17%	0.168	S	C	.	.	H	α-helix	trans	-53.6	-48.7	169.2	-28.5	34.5	0	0	0	113.2	Q352 N381 L385 M386 A387	Q352-P383 HydrophobicContact CG-CB 4.45Å; N381-P383 WeakPolarHBondContact OD1-CD 3.08Å; P383-L385 PolarHBondContact O-N 2.94Å; P383-M386 PolarHBondContact O-N 3.47Å; P383-A387 WeakPolarHBondContact O-CB 3.41Å; P383-A387 PolarHBondContact O-N 3.44Å
384	A	97.9	Very high	96	Very high	0 Å²	0	34 Å²	34	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-64.4	-40.2	-179.2	0	0	0	0	0	112.6	Q352 L371 C374 L375 N381 L382 L388	Q352-A384 HydrophobicContact CG-CB 4.24Å; L371-A384 HydrophobicContact CD2-CB 4.21Å; C374-A384 HydrophobicContact CB-CB 4.36Å; C374-A384 VanDerWaalsContact SG-CB 3.59Å; L375-A384 HydrophobicContact CD1-CB 4.39Å; L375-A384 HydrophobicContact CD2-CB 3.99Å; L375-A384 HydrophobicContact CG-CB 4.04Å; N381-A384 HydrophobicContact CB-CB 3.94Å; N381-A384 PolarHBondContact O-N 3.43Å; N381-A384 WeakPolarHBondContact OD1-CB 3.21Å; N381-A384 PolarHBondContact OD1-N 3.33Å; L382-A384 PolarHBondContact O-N 2.95Å; A384-L388 WeakPolarHBondContact O-CB 3.33Å; A384-L388 PolarHBondContact O-N 3.03Å
385	L	98.3	Very high	95.7	Very high	3 Å²	3	36.9 Å²	36.9	2%	0.016	21%	0.205	C	C	.	.	H	α-helix	trans	-63.2	-39.9	175.1	-76.3	166.5	0	0	0	112.7	L375 N381 L382 P383 A389 R407 W408	L375-L385 HydrophobicContact CD1-CD2 3.72Å; L375-L385 HydrophobicContact CD1-CG 4.12Å; L375-L385 HydrophobicContact CD2-CD1 4.44Å; L375-L385 HydrophobicContact CD2-CD2 3.98Å; L375-L385 HydrophobicContact CD2-CG 3.7Å; N381-L385 WeakPolarHBondContact O-CG 3.25Å; N381-L385 PolarHBondContact O-N 3.06Å; L382-L385 HydrophobicContact CD2-CD1 4.47Å; L382-L385 PolarHBondContact O-N 3.44Å; P383-L385 PolarHBondContact O-N 2.94Å; L385-A389 WeakPolarHBondContact O-CB 3.32Å; L385-A389 PolarHBondContact O-N 2.93Å; L385-R407 HydrophobicContact CD1-CB 4.19Å; L385-R407 HydrophobicContact CD2-CB 3.72Å; L385-W408 HydrophobicContact CB-CB 4.07Å; L385-W408 HydrophobicContact CB-CG 4.49Å; L385-W408 HydrophobicContact CD1-CB 4.48Å
386	M	98.4	Very high	95.4	Very high	14 Å²	14	38.1 Å²	38.1	7%	0.069	22%	0.223	C	C	.	.	H	α-helix	trans	-72.2	-42.3	178	-173.9	60.5	65.2	0	0	111.7	L382 P383 A389 V390 L405 W408 D470 T473	L382-M386 PolarHBondContact O-N 3.01Å; P383-M386 PolarHBondContact O-N 3.47Å; M386-A389 PolarHBondContact O-N 3.31Å; M386-V390 WeakPolarHBondContact O-CG2 3.4Å; M386-V390 PolarHBondContact O-N 2.71Å; M386-V390 VanDerWaalsContact O-N 3.14Å; M386-L405 HydrophobicContact CE-CD2 3.93Å; M386-L405 HydrophobicContact SD-CD2 3.83Å; M386-W408 HydrophobicContact CE-CD2 3.92Å; M386-W408 HydrophobicContact CE-CG 4.12Å; M386-W408 HydrophobicContact CE-CZ2 4.16Å; M386-D470 VanDerWaalsContact CE-O 3.25Å; M386-D470 WeakPolarHBondContact CE-O 3.35Å; M386-T473 HydrophobicContact CG-CG2 4.11Å; M386-T473 HydrophobicContact SD-CG2 3.8Å
387	A	98.3	Very high	95.1	Very high	15 Å²	15	37.3 Å²	37.3	12%	0.124	22%	0.22	C	C	.	.	H	α-helix	trans	-61.1	-45.6	174.4	0	0	0	0	0	111.3	T356 L371 P383 A389 V390 S391	T356-A387 HydrophobicContact CG2-CB 3.91Å; L371-A387 HydrophobicContact CD1-CB 3.74Å; L371-A387 HydrophobicContact CD2-CB 3.91Å; L371-A387 HydrophobicContact CG-CB 4.5Å; P383-A387 WeakPolarHBondContact O-CB 3.41Å; P383-A387 PolarHBondContact O-N 3.44Å; A387-A389 PolarHBondContact O-N 3.05Å; A387-V390 PolarHBondContact O-N 3.31Å; A387-S391 PolarHBondContact O-N 3.09Å; A387-S391 PolarHBondContact O-OG 2.67Å
388	L	97.9	Very high	94.9	Very high	12 Å²	12	42.5 Å²	42.5	6%	0.063	24%	0.236	C	C	.	.	H	α-helix	trans	-63.4	-40.1	178.7	-179.4	60.9	0	0	0	111.7	I368 L371 Q372 L375 A384 V390 S391 L392	I368-L388 HydrophobicContact CB-CD1 4.39Å; I368-L388 HydrophobicContact CG1-CD1 4.3Å; I368-L388 HydrophobicContact CG2-CD1 4.07Å; L371-L388 HydrophobicContact CB-CB 4.13Å; L371-L388 HydrophobicContact CB-CD1 4.3Å; L371-L388 HydrophobicContact CD1-CB 4.34Å; Q372-L388 HydrophobicContact CG-CD1 4.2Å; Q372-L388 HydrophobicContact CG-CD2 4.11Å; L375-L388 HydrophobicContact CD1-CD2 3.66Å; A384-L388 WeakPolarHBondContact O-CB 3.33Å; A384-L388 PolarHBondContact O-N 3.03Å; L388-V390 VanDerWaalsContact C-N 3.33Å; L388-V390 PolarHBondContact O-N 3.28Å; L388-S391 PolarHBondContact O-N 2.94Å; L388-L392 HydrophobicContact CD1-CD1 3.83Å; L388-L392 HydrophobicContact CD1-CD2 4.49Å; L388-L392 HydrophobicContact CD1-CG 3.9Å; L388-L392 HydrophobicContact CD2-CD1 4.38Å; L388-L392 HydrophobicContact CG-CD1 3.7Å; L388-L392 HydrophobicContact CG-CG 4.23Å; L388-L392 WeakPolarHBondContact O-CB 3.45Å; L388-L392 WeakPolarHBondContact O-CG 3.33Å; L388-L392 PolarHBondContact O-N 3.42Å
389	A	97.8	Very high	94.6	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-61.6	-39.1	175.1	0	0	0	0	0	113.2	L385 M386 A387 T393 A404 L405	L385-A389 WeakPolarHBondContact O-CB 3.32Å; L385-A389 PolarHBondContact O-N 2.93Å; M386-A389 PolarHBondContact O-N 3.31Å; A387-A389 PolarHBondContact O-N 3.05Å; A389-T393 WeakPolarHBondContact O-CB 3.43Å; A389-T393 PolarHBondContact O-N 3.35Å; A389-T393 VanDerWaalsContact O-N 3.09Å; A389-T393 PolarHBondContact O-OG1 2.87Å; A389-A404 HydrophobicContact CB-CB 4Å; A389-L405 HydrophobicContact CB-CD1 4.35Å; A389-L405 HydrophobicContact CB-CD2 3.53Å; A389-L405 HydrophobicContact CB-CG 3.58Å
390	V	97.8	Very high	94.4	Very high	22 Å²	22	43.1 Å²	43.1	13%	0.133	24%	0.235	C	C	.	.	H	α-helix	trans	-65.9	-50.5	173.9	172.9	0	0	0	0	110.3	M386 A387 L388 L392 T393 N394 V477	M386-V390 WeakPolarHBondContact O-CG2 3.4Å; M386-V390 PolarHBondContact O-N 2.71Å; M386-V390 VanDerWaalsContact O-N 3.14Å; A387-V390 PolarHBondContact O-N 3.31Å; L388-V390 VanDerWaalsContact C-N 3.33Å; L388-V390 PolarHBondContact O-N 3.28Å; V390-L392 VanDerWaalsContact C-N 3.35Å; V390-L392 PolarHBondContact O-N 3.28Å; V390-T393 WeakPolarHBondContact O-CA 3.45Å; V390-T393 WeakPolarHBondContact O-CB 3.3Å; V390-T393 PolarHBondContact O-N 2.92Å; V390-N394 PolarHBondContact O-N 3.38Å; V390-N394 PolarHBondContact O-OD1 3.4Å; V390-V477 HydrophobicContact CG2-CG2 3.75Å
391	S	96.1	Very high	94.4	Very high	2 Å²	2	39.4 Å²	39.4	1%	0.014	22%	0.215	C	C	.	.	H	α-helix	trans	-58	-43.7	178.7	-66.1	0	0	0	0	113	E364 A387 L388 T393 N394 T395	E364-S391 WeakPolarHBondContact OE1-CA 3.16Å; E364-S391 WeakPolarHBondContact OE1-CB 3.32Å; E364-S391 PolarHBondContact OE1-OG 2.96Å; A387-S391 PolarHBondContact O-N 3.09Å; A387-S391 PolarHBondContact O-OG 2.67Å; L388-S391 PolarHBondContact O-N 2.94Å; S391-T393 VanDerWaalsContact C-N 3.27Å; S391-T393 PolarHBondContact O-N 3.43Å; S391-N394 WeakPolarHBondContact O-CB 3.4Å; S391-N394 PolarHBondContact O-N 3.4Å; S391-T395 PolarHBondContact O-N 3.23Å; S391-T395 VanDerWaalsContact O-N 3.09Å; S391-T395 PolarHBondContact O-OG1 3.16Å
392	L	94.1	Very high	94.3	Very high	5 Å²	5	39 Å²	39	3%	0.026	21%	0.214	C	C	.	.	H	α-helix	trans	-69.2	-23.3	176.1	-68.9	169.9	0	0	0	113.1	I368 L388 V390 T395 G396 M397 D400 A401	I368-L392 HydrophobicContact CD1-CD2 4.14Å; I368-L392 HydrophobicContact CG2-CD2 4.41Å; L388-L392 HydrophobicContact CD1-CD1 3.83Å; L388-L392 HydrophobicContact CD1-CD2 4.49Å; L388-L392 HydrophobicContact CD1-CG 3.9Å; L388-L392 HydrophobicContact CD2-CD1 4.38Å; L388-L392 HydrophobicContact CG-CD1 3.7Å; L388-L392 HydrophobicContact CG-CG 4.23Å; L388-L392 WeakPolarHBondContact O-CB 3.45Å; L388-L392 WeakPolarHBondContact O-CG 3.33Å; L388-L392 PolarHBondContact O-N 3.42Å; V390-L392 VanDerWaalsContact C-N 3.35Å; V390-L392 PolarHBondContact O-N 3.28Å; L392-T395 PolarHBondContact O-OG1 3.45Å; L392-G396 PolarHBondContact O-N 3.19Å; L392-M397 HydrophobicContact CB-CB 4.21Å; L392-M397 HydrophobicContact CD2-CB 3.92Å; L392-M397 HydrophobicContact CD2-CE 4.03Å; L392-M397 HydrophobicContact CD2-CG 4.35Å; L392-M397 HydrophobicContact CD2-SD 3.59Å; L392-M397 VanDerWaalsContact CD2-SD 3.59Å; L392-M397 CarbonylContact O-C 3.52Å; L392-M397 WeakPolarHBondContact O-CA 3.23Å; L392-M397 WeakPolarHBondContact O-CB 3.36Å; L392-M397 PolarHBondContact O-N 2.88Å; L392-D400 HydrophobicContact CD1-CB 3.85Å; L392-D400 HydrophobicContact CD2-CB 4.48Å; L392-A401 HydrophobicContact CB-CB 3.84Å
393	T	93.9	Very high	94	Very high	29 Å²	29	39.2 Å²	39.2	18%	0.178	21%	0.213	C	C	.	.	H	α-helix	trans	-74.3	-41.3	171.8	-63.2	0	0	0	0	110.5	A389 V390 S391 T395 G396 V477 L481	A389-T393 WeakPolarHBondContact O-CB 3.43Å; A389-T393 PolarHBondContact O-N 3.35Å; A389-T393 VanDerWaalsContact O-N 3.09Å; A389-T393 PolarHBondContact O-OG1 2.87Å; V390-T393 WeakPolarHBondContact O-CA 3.45Å; V390-T393 WeakPolarHBondContact O-CB 3.3Å; V390-T393 PolarHBondContact O-N 2.92Å; S391-T393 VanDerWaalsContact C-N 3.27Å; S391-T393 PolarHBondContact O-N 3.43Å; T393-T395 VanDerWaalsContact C-N 3.35Å; T393-T395 PolarHBondContact O-N 3.39Å; T393-G396 PolarHBondContact O-N 3.34Å; T393-G396 VanDerWaalsContact O-N 3.08Å; T393-V477 HydrophobicContact CG2-CG1 4.38Å; T393-V477 VanDerWaalsContact OG1-CG1 3.24Å; T393-V477 WeakPolarHBondContact OG1-CG1 3.44Å; T393-L481 HydrophobicContact CG2-CD2 3.77Å; T393-L481 HydrophobicContact CG2-CG 3.95Å
394	N	90.1	Very high	93.9	Very high	91 Å²	91	35.8 Å²	35.8	49%	0.487	19%	0.191	S	C	.	.	H	α-helix	trans	-63.5	-37	176.7	-61.4	-11.9	0	0	0	112.4	E364 V390 S391 G396	E364-N394 HydrophobicContact CG-CB 4.45Å; E364-N394 VanDerWaalsContact OE2-CB 3.28Å; E364-N394 WeakPolarHBondContact OE2-CB 3.43Å; E364-N394 PolarHBondContact OE2-ND2 3.05Å; V390-N394 PolarHBondContact O-N 3.38Å; V390-N394 PolarHBondContact O-OD1 3.4Å; S391-N394 WeakPolarHBondContact O-CB 3.4Å; S391-N394 PolarHBondContact O-N 3.4Å; N394-G396 VanDerWaalsContact C-N 3.25Å; N394-G396 PolarHBondContact O-N 3.47Å
395	T	89.9	Confident	93.8	Very high	62 Å²	62	35.8 Å²	35.8	38%	0.38	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.8	3.1	174	60.9	0	0	0	0	114.3	E364 I368 S391 L392 T393 M397	E364-T395 HydrophobicContact CB-CG2 4.41Å; E364-T395 HydrophobicContact CG-CG2 3.73Å; I368-T395 HydrophobicContact CD1-CG2 3.65Å; S391-T395 PolarHBondContact O-N 3.23Å; S391-T395 VanDerWaalsContact O-N 3.09Å; S391-T395 PolarHBondContact O-OG1 3.16Å; L392-T395 PolarHBondContact O-OG1 3.45Å; T393-T395 VanDerWaalsContact C-N 3.35Å; T393-T395 PolarHBondContact O-N 3.39Å; T395-M397 PolarHBondContact O-N 3.07Å; T395-M397 WeakPolarHBondContact OG1-CG 3.1Å
396	G	88.8	Confident	93.6	Very high	49 Å²	49	36.2 Å²	36.2	51%	0.505	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.2	7.5	-178.7	0	0	0	0	0	115.3	L392 T393 N394 R398	L392-G396 PolarHBondContact O-N 3.19Å; T393-G396 PolarHBondContact O-N 3.34Å; T393-G396 VanDerWaalsContact O-N 3.08Å; N394-G396 VanDerWaalsContact C-N 3.25Å; N394-G396 PolarHBondContact O-N 3.47Å; G396-R398 WeakPolarHBondContact O-CG 3.5Å; G396-R398 PolarHBondContact O-N 3.22Å
397	M	88.6	Confident	93.4	Very high	82 Å²	82	41.1 Å²	41.1	40%	0.404	21%	0.211	S	C	.	.			trans	-75.7	60.4	178.8	-64.5	-178.5	71.5	0	0	112.2	L392 T395 H399 D400 A401	L392-M397 HydrophobicContact CB-CB 4.21Å; L392-M397 HydrophobicContact CD2-CB 3.92Å; L392-M397 HydrophobicContact CD2-CE 4.03Å; L392-M397 HydrophobicContact CD2-CG 4.35Å; L392-M397 HydrophobicContact CD2-SD 3.59Å; L392-M397 VanDerWaalsContact CD2-SD 3.59Å; L392-M397 CarbonylContact O-C 3.52Å; L392-M397 WeakPolarHBondContact O-CA 3.23Å; L392-M397 WeakPolarHBondContact O-CB 3.36Å; L392-M397 PolarHBondContact O-N 2.88Å; T395-M397 PolarHBondContact O-N 3.07Å; T395-M397 WeakPolarHBondContact OG1-CG 3.1Å; M397-H399 VanDerWaalsContact C-N 3.3Å; M397-H399 PolarHBondContact O-N 3.29Å; M397-H399 VanDerWaalsContact O-N 3.15Å; M397-D400 WeakPolarHBondContact CE-OD2 3.19Å; M397-D400 PolarHBondContact O-N 3.34Å; M397-D400 VanDerWaalsContact O-N 3.16Å; M397-A401 PolarHBondContact O-N 2.86Å; M397-A401 VanDerWaalsContact O-N 3.07Å
398	R	89.6	Confident	93.3	Very high	163 Å²	163	40.7 Å²	40.7	62%	0.615	21%	0.206	S	C	*	.	H	α-helix	trans	-53.2	-39.8	-169.3	-58.7	-171	177.7	165.5	-2.5	114.3	G396 C402 L481	G396-R398 WeakPolarHBondContact O-CG 3.5Å; G396-R398 PolarHBondContact O-N 3.22Å; R398-C402 PolarHBondContact O-N 2.74Å; R398-C402 PolarHBondContact O-SG 2.94Å; R398-L481 HydrophobicContact CB-CD2 3.99Å; R398-L481 HydrophobicContact CG-CD2 3.78Å
399	H	89.1	Confident	93.1	Very high	86 Å²	86	40.1 Å²	40.1	40%	0.398	20%	0.203	S	C	.	.	H	α-helix	trans	-63.4	-51.2	-179.9	175.3	-89.6	0	0	0	111.6	M397 A401 C402 E403	M397-H399 VanDerWaalsContact C-N 3.3Å; M397-H399 PolarHBondContact O-N 3.29Å; M397-H399 VanDerWaalsContact O-N 3.15Å; H399-A401 PolarHBondContact O-N 3.41Å; H399-C402 WeakPolarHBondContact O-CB 3.36Å; H399-C402 PolarHBondContact O-N 3.33Å; H399-C402 VanDerWaalsContact O-N 3.12Å; H399-E403 PolarHBondContact O-N 3.45Å
400	D	90.4	Very high	92.8	Very high	70 Å²	70	43.2 Å²	43.2	37%	0.374	22%	0.217	S	C	.	.	H	α-helix	trans	-74.7	-29.8	-173.9	-62.9	-17.8	0	0	0	111.6	L392 M397 C402 E403 A404	L392-D400 HydrophobicContact CD1-CB 3.85Å; L392-D400 HydrophobicContact CD2-CB 4.48Å; M397-D400 WeakPolarHBondContact CE-OD2 3.19Å; M397-D400 PolarHBondContact O-N 3.34Å; M397-D400 VanDerWaalsContact O-N 3.16Å; D400-C402 VanDerWaalsContact C-N 3.34Å; D400-E403 PolarHBondContact O-N 3.49Å; D400-A404 VanDerWaalsContact O-CB 3.32Å; D400-A404 WeakPolarHBondContact O-CB 3.46Å; D400-A404 PolarHBondContact O-N 2.92Å
401	A	93.6	Very high	92.5	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-59.4	-43.3	166.8	0	0	0	0	0	111.9	L392 M397 H399 A404 L405 L481	L392-A401 HydrophobicContact CB-CB 3.84Å; M397-A401 PolarHBondContact O-N 2.86Å; M397-A401 VanDerWaalsContact O-N 3.07Å; H399-A401 PolarHBondContact O-N 3.41Å; A401-A404 PolarHBondContact O-N 3.03Å; A401-L405 WeakPolarHBondContact O-CG 3.3Å; A401-L405 PolarHBondContact O-N 2.86Å; A401-L481 HydrophobicContact CB-CD1 3.96Å; A401-L481 HydrophobicContact CB-CD2 4.44Å
402	C	94.2	Very high	92.4	Very high	2 Å²	2	45.7 Å²	45.7	1%	0.014	23%	0.227	C	C	.	.	H	α-helix	trans	-66.3	-41.5	176.8	-67.1	0	0	0	0	112.4	R398 H399 D400 L405 L406 L448 V452	R398-C402 PolarHBondContact O-N 2.74Å; R398-C402 PolarHBondContact O-SG 2.94Å; H399-C402 WeakPolarHBondContact O-CB 3.36Å; H399-C402 PolarHBondContact O-N 3.33Å; H399-C402 VanDerWaalsContact O-N 3.12Å; D400-C402 VanDerWaalsContact C-N 3.34Å; C402-L405 PolarHBondContact O-N 3.29Å; C402-L406 WeakPolarHBondContact O-CB 3.49Å; C402-L406 PolarHBondContact O-N 3.45Å; C402-L448 HydrophobicContact CB-CD2 3.77Å; C402-L448 HydrophobicContact CB-CG 3.9Å; C402-V452 HydrophobicContact CB-CG2 4.35Å
403	E	91.6	Very high	92.2	Very high	42 Å²	42	50.1 Å²	50.1	20%	0.196	26%	0.256	C	S	.	.	H	α-helix	trans	-70.2	-32	176	169	60.1	-179.8	0	0	112.2	H399 D400 L406 R407 K410 L448	H399-E403 PolarHBondContact O-N 3.45Å; D400-E403 PolarHBondContact O-N 3.49Å; E403-L406 PolarHBondContact O-N 3.44Å; E403-R407 VanDerWaalsContact CG-NH2 3.31Å; E403-R407 WeakPolarHBondContact O-CB 3.28Å; E403-R407 VanDerWaalsContact O-CG 3.27Å; E403-R407 WeakPolarHBondContact O-CG 3.45Å; E403-R407 PolarHBondContact O-N 2.79Å; E403-R407 IonicContact OE1-CZ 3.36Å; E403-R407 VanDerWaalsContact OE1-CZ 3.24Å; E403-R407 IonicContact OE1-NE 3.16Å; E403-R407 PolarHBondContact OE1-NE 2.91Å; E403-R407 IonicContact OE1-NH2 3.74Å; E403-R407 PolarHBondContact OE1-NH2 3.28Å; E403-K410 IonicContact OE1-NZ 2.7Å; E403-K410 IonicContact OE2-NZ 3.34Å; E403-K410 PolarHBondContact OE2-NZ 2.92Å; E403-L448 HydrophobicContact CB-CD2 4.33Å
404	A	94.9	Very high	92	Very high	3 Å²	3	54.7 Å²	54.7	3%	0.025	27%	0.274	C	S	.	.	H	α-helix	trans	-63.1	-43.9	170.9	0	0	0	0	0	112	A389 D400 A401 R407 W408	A389-A404 HydrophobicContact CB-CB 4Å; D400-A404 VanDerWaalsContact O-CB 3.32Å; D400-A404 WeakPolarHBondContact O-CB 3.46Å; D400-A404 PolarHBondContact O-N 2.92Å; A401-A404 PolarHBondContact O-N 3.03Å; A404-R407 WeakPolarHBondContact O-CB 3.35Å; A404-R407 PolarHBondContact O-N 3.26Å; A404-W408 PolarHBondContact O-N 3.02Å
405	L	96.4	Very high	91.9	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-67.9	-36.8	173.9	-68.5	177.1	0	0	0	112.6	M386 A389 A401 C402 R407 W408 L409 V452 F456 V477 L478	M386-L405 HydrophobicContact CE-CD2 3.93Å; M386-L405 HydrophobicContact SD-CD2 3.83Å; A389-L405 HydrophobicContact CB-CD1 4.35Å; A389-L405 HydrophobicContact CB-CD2 3.53Å; A389-L405 HydrophobicContact CB-CG 3.58Å; A401-L405 WeakPolarHBondContact O-CG 3.3Å; A401-L405 PolarHBondContact O-N 2.86Å; C402-L405 PolarHBondContact O-N 3.29Å; L405-R407 VanDerWaalsContact C-N 3.34Å; L405-W408 WeakPolarHBondContact O-CB 3.47Å; L405-W408 PolarHBondContact O-N 3.18Å; L405-L409 PolarHBondContact O-N 3.43Å; L405-V452 HydrophobicContact CB-CG1 4.19Å; L405-F456 HydrophobicContact CB-CE2 3.98Å; L405-F456 HydrophobicContact CB-CZ 3.92Å; L405-F456 HydrophobicContact CD2-CZ 4.28Å; L405-F456 WeakPolarHBondContact O-CE2 3.5Å; L405-V477 HydrophobicContact CD1-CB 4.18Å; L405-V477 HydrophobicContact CD1-CG1 3.91Å; L405-L478 HydrophobicContact CD1-CD1 4.07Å; L405-L478 HydrophobicContact CD1-CD2 3.88Å; L405-L478 HydrophobicContact CD1-CG 3.6Å
406	L	93.9	Very high	91.5	Very high	12 Å²	12	52.2 Å²	52.2	6%	0.063	25%	0.253	C	S	.	.	H	α-helix	trans	-65.2	-38.9	174.4	-175.5	57.1	0	0	0	111.3	C402 E403 L409 K410 L448 V452 L455	C402-L406 WeakPolarHBondContact O-CB 3.49Å; C402-L406 PolarHBondContact O-N 3.45Å; E403-L406 PolarHBondContact O-N 3.44Å; L406-L409 PolarHBondContact O-N 2.94Å; L406-K410 HydrophobicContact CG-CD 4.19Å; L406-K410 WeakPolarHBondContact O-CB 3.44Å; L406-K410 WeakPolarHBondContact O-CD 3.47Å; L406-K410 WeakPolarHBondContact O-CG 3.47Å; L406-K410 PolarHBondContact O-N 3.43Å; L406-L448 HydrophobicContact CD2-CD1 4.26Å; L406-V452 HydrophobicContact CB-CG1 4.38Å; L406-V452 HydrophobicContact CB-CG2 3.92Å; L406-V452 HydrophobicContact CD1-CG2 4.36Å; L406-V452 HydrophobicContact CD2-CG2 4.23Å; L406-V452 HydrophobicContact CG-CG2 4.36Å; L406-L455 HydrophobicContact CD1-CD1 3.76Å
407	R	94.3	Very high	91.1	Very high	116 Å²	116	54.7 Å²	54.7	44%	0.438	26%	0.255	S	S	.	.	H	α-helix	trans	-61.9	-45.2	169.1	-74.3	171.5	-166.4	171.7	11.9	111.6	L385 E403 A404 L405 L409 K410 H411	L385-R407 HydrophobicContact CD1-CB 4.19Å; L385-R407 HydrophobicContact CD2-CB 3.72Å; E403-R407 VanDerWaalsContact CG-NH2 3.31Å; E403-R407 WeakPolarHBondContact O-CB 3.28Å; E403-R407 VanDerWaalsContact O-CG 3.27Å; E403-R407 WeakPolarHBondContact O-CG 3.45Å; E403-R407 PolarHBondContact O-N 2.79Å; E403-R407 IonicContact OE1-CZ 3.36Å; E403-R407 VanDerWaalsContact OE1-CZ 3.24Å; E403-R407 IonicContact OE1-NE 3.16Å; E403-R407 PolarHBondContact OE1-NE 2.91Å; E403-R407 IonicContact OE1-NH2 3.74Å; E403-R407 PolarHBondContact OE1-NH2 3.28Å; A404-R407 WeakPolarHBondContact O-CB 3.35Å; A404-R407 PolarHBondContact O-N 3.26Å; L405-R407 VanDerWaalsContact C-N 3.34Å; R407-L409 VanDerWaalsContact C-N 3.29Å; R407-L409 PolarHBondContact O-N 3.17Å; R407-K410 PolarHBondContact O-N 3.13Å; R407-K410 VanDerWaalsContact O-N 3.15Å; R407-H411 WeakPolarHBondContact O-CB 3.12Å; R407-H411 PolarHBondContact O-CD2 3.46Å; R407-H411 PolarHBondContact O-N 2.94Å
408	W	96.6	Very high	90.6	Very high	6 Å²	6	52.3 Å²	52.3	2%	0.023	24%	0.244	C	C	.	.	H	α-helix	trans	-53.3	-48.3	175.8	-173.8	97.1	0	0	0	111.1	L382 L385 M386 A404 L405 H411 N412 Y415 F456 D470 L471	L382-W408 HydrophobicContact CD2-CG 4.31Å; L382-W408 PolarHBondContact O-NE1 3.4Å; L385-W408 HydrophobicContact CB-CB 4.07Å; L385-W408 HydrophobicContact CB-CG 4.49Å; L385-W408 HydrophobicContact CD1-CB 4.48Å; M386-W408 HydrophobicContact CE-CD2 3.92Å; M386-W408 HydrophobicContact CE-CG 4.12Å; M386-W408 HydrophobicContact CE-CZ2 4.16Å; A404-W408 PolarHBondContact O-N 3.02Å; L405-W408 WeakPolarHBondContact O-CB 3.47Å; L405-W408 PolarHBondContact O-N 3.18Å; W408-H411 PolarHBondContact O-N 2.91Å; W408-N412 HydrophobicContact CE3-CB 4.5Å; W408-N412 WeakPolarHBondContact CH2-ND2 3.4Å; W408-N412 VanDerWaalsContact CZ2-ND2 3.35Å; W408-N412 WeakPolarHBondContact CZ2-ND2 3.45Å; W408-N412 HydrophobicContact CZ3-CB 4.49Å; W408-N412 VanDerWaalsContact O-CB 3.25Å; W408-N412 WeakPolarHBondContact O-CB 3.41Å; W408-N412 PolarHBondContact O-N 2.92Å; W408-Y415 HydrophobicContact CH2-CD2 4.28Å; W408-Y415 AromaticContact CH2-CE2 3.9Å; W408-Y415 HydrophobicContact CH2-CE2 3.9Å; W408-Y415 AromaticContact CZ3-CD2 3.9Å; W408-Y415 HydrophobicContact CZ3-CD2 3.9Å; W408-Y415 AromaticContact CZ3-CE2 3.91Å; W408-Y415 HydrophobicContact CZ3-CE2 3.91Å; W408-F456 AromaticContact CE3-CE1 3.97Å; W408-F456 HydrophobicContact CE3-CE1 3.97Å; W408-F456 AromaticContact CE3-CZ 3.76Å; W408-F456 HydrophobicContact CE3-CZ 3.76Å; W408-F456 HydrophobicContact CZ3-CE1 4.01Å; W408-F456 HydrophobicContact CZ3-CZ 4.25Å; W408-D470 HydrophobicContact CH2-CB 4.19Å; W408-D470 HydrophobicContact CZ2-CB 3.61Å; W408-L471 HydrophobicContact CH2-CB 4.24Å; W408-L471 HydrophobicContact CH2-CD1 4.42Å; W408-L471 HydrophobicContact CZ3-CD1 3.88Å
409	L	93.8	Very high	89.7	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-68	-38.3	178.7	-158.4	74.3	0	0	0	112.9	L405 L406 R407 Y415 L419 L455 F456 A459 L471	L405-L409 PolarHBondContact O-N 3.43Å; L406-L409 PolarHBondContact O-N 2.94Å; R407-L409 VanDerWaalsContact C-N 3.29Å; R407-L409 PolarHBondContact O-N 3.17Å; L409-Y415 HydrophobicContact CD1-CD2 3.76Å; L409-Y415 HydrophobicContact CD1-CG 3.69Å; L409-L419 HydrophobicContact CB-CD1 4.41Å; L409-L419 HydrophobicContact CD2-CD1 4.38Å; L409-L419 HydrophobicContact CD2-CD2 4.44Å; L409-L419 HydrophobicContact CG-CD1 4.18Å; L409-L419 WeakPolarHBondContact O-CD1 3.39Å; L409-L455 HydrophobicContact CD2-CB 3.71Å; L409-F456 HydrophobicContact CB-CE2 3.92Å; L409-F456 HydrophobicContact CB-CZ 4.3Å; L409-F456 HydrophobicContact CD1-CD2 4.35Å; L409-F456 HydrophobicContact CD1-CE2 4.19Å; L409-F456 HydrophobicContact CD1-CZ 4.31Å; L409-F456 HydrophobicContact CD2-CD2 4.07Å; L409-F456 HydrophobicContact CD2-CE2 4.18Å; L409-F456 HydrophobicContact CG-CE2 4.33Å; L409-A459 HydrophobicContact CD1-CB 4.05Å; L409-L471 HydrophobicContact CD1-CD1 3.99Å
410	K	91.4	Very high	88.7	Confident	66 Å²	66	47 Å²	47	29%	0.287	23%	0.225	S	C	.	.	H	α-helix	trans	-62.3	-38	174.3	-73.8	159.8	177.9	160.4	0	112.4	E403 L406 R407 L419	E403-K410 IonicContact OE1-NZ 2.7Å; E403-K410 IonicContact OE2-NZ 3.34Å; E403-K410 PolarHBondContact OE2-NZ 2.92Å; L406-K410 HydrophobicContact CG-CD 4.19Å; L406-K410 WeakPolarHBondContact O-CB 3.44Å; L406-K410 WeakPolarHBondContact O-CD 3.47Å; L406-K410 WeakPolarHBondContact O-CG 3.47Å; L406-K410 PolarHBondContact O-N 3.43Å; R407-K410 PolarHBondContact O-N 3.13Å; R407-K410 VanDerWaalsContact O-N 3.15Å; K410-L419 HydrophobicContact CB-CD1 4.34Å; K410-L419 HydrophobicContact CG-CD1 4.05Å
411	H	92	Very high	87.3	Confident	66 Å²	66	45.8 Å²	45.8	31%	0.306	23%	0.225	S	C	.	.	H	α-helix	trans	-88.6	-29.1	-176.8	-73.6	-71.7	0	0	0	113.6	N380 L382 R407 W408 P413	N380-H411 HydrophobicContact CB-CB 4Å; N380-H411 WeakPolarHBondContact CB-ND1 3.32Å; L382-H411 HydrophobicContact CD2-CB 3.95Å; R407-H411 WeakPolarHBondContact O-CB 3.12Å; R407-H411 PolarHBondContact O-CD2 3.46Å; R407-H411 PolarHBondContact O-N 2.94Å; W408-H411 PolarHBondContact O-N 2.91Å; H411-P413 WeakPolarHBondContact O-CD 3.38Å
412	N	93.3	Very high	85.8	Confident	9 Å²	9	48.4 Å²	48.4	5%	0.048	24%	0.236	C	C	.	.			trans	-63.3	118.6	-178.4	-173	-31.6	0	0	0	111.9	L382 W408 K414 Y415 K416	L382-N412 HydrophobicContact CD1-CB 4.01Å; L382-N412 HydrophobicContact CD2-CB 4.1Å; W408-N412 HydrophobicContact CE3-CB 4.5Å; W408-N412 WeakPolarHBondContact CH2-ND2 3.4Å; W408-N412 VanDerWaalsContact CZ2-ND2 3.35Å; W408-N412 WeakPolarHBondContact CZ2-ND2 3.45Å; W408-N412 HydrophobicContact CZ3-CB 4.49Å; W408-N412 VanDerWaalsContact O-CB 3.25Å; W408-N412 WeakPolarHBondContact O-CB 3.41Å; W408-N412 PolarHBondContact O-N 2.92Å; N412-K414 PolarHBondContact O-N 3.5Å; N412-K414 VanDerWaalsContact O-N 3.13Å; N412-K414 WeakPolarHBondContact OD1-CB 3.2Å; N412-K414 PolarHBondContact OD1-N 2.9Å; N412-Y415 HydrophobicContact CB-CD2 4.01Å; N412-Y415 WeakPolarHBondContact ND2-CE2 3.4Å; N412-Y415 PolarHBondContact O-N 3.43Å; N412-Y415 VanDerWaalsContact O-N 3.16Å; N412-K416 WeakPolarHBondContact O-CB 3.43Å; N412-K416 PolarHBondContact O-N 3.34Å
413	P	90.8	Very high	84	Confident	99 Å²	99	52.6 Å²	52.6	64%	0.643	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-29.7	-177.2	-27.3	35.9	0	0	0	115	H411	H411-P413 WeakPolarHBondContact O-CD 3.38Å
414	K	88.8	Confident	82	Confident	125 Å²	125	57.8 Å²	57.8	54%	0.543	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-48.4	177.9	-63.5	172.2	175.1	170.4	0	111.2	N412 D468	N412-K414 PolarHBondContact O-N 3.5Å; N412-K414 VanDerWaalsContact O-N 3.13Å; N412-K414 WeakPolarHBondContact OD1-CB 3.2Å; N412-K414 PolarHBondContact OD1-N 2.9Å; K414-D468 WeakPolarHBondContact CD-OD2 3.38Å; K414-D468 IonicContact NZ-OD2 2.64Å; K414-D468 PolarHBondContact NZ-OD2 3.26Å
415	Y	89	Confident	79.7	Confident	4 Å²	4	65 Å²	65	2%	0.016	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.9	-15.1	-168.8	-53.1	-60.3	0	0	0	114.1	W408 L409 N412 N417 L418 L419 A459 N463 D468 L471	W408-Y415 HydrophobicContact CH2-CD2 4.28Å; W408-Y415 AromaticContact CH2-CE2 3.9Å; W408-Y415 HydrophobicContact CH2-CE2 3.9Å; W408-Y415 AromaticContact CZ3-CD2 3.9Å; W408-Y415 HydrophobicContact CZ3-CD2 3.9Å; W408-Y415 AromaticContact CZ3-CE2 3.91Å; W408-Y415 HydrophobicContact CZ3-CE2 3.91Å; L409-Y415 HydrophobicContact CD1-CD2 3.76Å; L409-Y415 HydrophobicContact CD1-CG 3.69Å; N412-Y415 HydrophobicContact CB-CD2 4.01Å; N412-Y415 WeakPolarHBondContact ND2-CE2 3.4Å; N412-Y415 PolarHBondContact O-N 3.43Å; N412-Y415 VanDerWaalsContact O-N 3.16Å; Y415-N417 PolarHBondContact O-N 3.02Å; Y415-L418 WeakPolarHBondContact O-CB 3.21Å; Y415-L418 PolarHBondContact O-N 3.13Å; Y415-L419 PolarHBondContact O-N 2.96Å; Y415-A459 HydrophobicContact CD1-CB 3.56Å; Y415-A459 HydrophobicContact CE1-CB 3.85Å; Y415-A459 HydrophobicContact CG-CB 4.12Å; Y415-N463 WeakPolarHBondContact CE1-ND2 3.49Å; Y415-N463 PolarHBondContact OH-ND2 3.5Å; Y415-D468 VanDerWaalsContact OH-CB 3.24Å; Y415-D468 WeakPolarHBondContact OH-CB 3.44Å; Y415-D468 PolarHBondContact OH-OD2 3.21Å; Y415-L471 HydrophobicContact CD2-CD1 4.32Å; Y415-L471 HydrophobicContact CE1-CD1 4.46Å; Y415-L471 HydrophobicContact CE1-CD2 4.13Å; Y415-L471 HydrophobicContact CE2-CB 4.28Å; Y415-L471 HydrophobicContact CE2-CD1 3.92Å; Y415-L471 HydrophobicContact CE2-CG 4.48Å
416	K	81.1	Confident	77	Confident	97 Å²	97	69.5 Å²	69.5	42%	0.422	35%	0.345	S	S	.	.	H	α-helix	trans	-52.6	-25.5	177.3	-169.8	166.9	-170.8	167.3	0	114.6	N412 K420	N412-K416 WeakPolarHBondContact O-CB 3.43Å; N412-K416 PolarHBondContact O-N 3.34Å; K416-K420 WeakPolarHBondContact O-CG 3.48Å; K416-K420 PolarHBondContact O-N 3.44Å
417	N	79.6	Confident	74.2	Confident	100 Å²	100	71 Å²	71	54%	0.535	36%	0.363	S	S	.	.	H	α-helix	trans	-82.5	-29.9	177.8	-68.1	-26.9	0	0	0	113.6	Y415 K420 A421	Y415-N417 PolarHBondContact O-N 3.02Å; N417-K420 PolarHBondContact O-N 3.45Å; N417-K420 PolarHBondContact OD1-NZ 3.29Å; N417-A421 PolarHBondContact O-N 2.84Å
418	L	77.4	Confident	71.8	Confident	33 Å²	33	68.5 Å²	68.5	17%	0.173	36%	0.364	C	S	.	.	H	α-helix	trans	-63.1	-48	173	173.1	62.6	0	0	0	110.6	Y415 K420 A421 K422 E458 A459	Y415-L418 WeakPolarHBondContact O-CB 3.21Å; Y415-L418 PolarHBondContact O-N 3.13Å; L418-K420 VanDerWaalsContact C-N 3.34Å; L418-K420 PolarHBondContact O-N 3.09Å; L418-A421 WeakPolarHBondContact O-CB 3.12Å; L418-A421 PolarHBondContact O-N 3.49Å; L418-A421 VanDerWaalsContact O-N 3.08Å; L418-K422 PolarHBondContact O-N 3.45Å; L418-E458 HydrophobicContact CD1-CB 4.45Å; L418-E458 HydrophobicContact CD2-CB 3.78Å; L418-A459 HydrophobicContact CD2-CB 4.01Å
419	L	72.1	Confident	69.2	Low	34 Å²	34	72.7 Å²	72.7	18%	0.178	39%	0.392	C	S	.	.	H	α-helix	trans	-58.9	-43	176.5	-70.6	165.6	0	0	0	112	L409 K410 Y415 K422 T423 L455	L409-L419 HydrophobicContact CB-CD1 4.41Å; L409-L419 HydrophobicContact CD2-CD1 4.38Å; L409-L419 HydrophobicContact CD2-CD2 4.44Å; L409-L419 HydrophobicContact CG-CD1 4.18Å; L409-L419 WeakPolarHBondContact O-CD1 3.39Å; K410-L419 HydrophobicContact CB-CD1 4.34Å; K410-L419 HydrophobicContact CG-CD1 4.05Å; Y415-L419 PolarHBondContact O-N 2.96Å; L419-K422 PolarHBondContact O-N 3.15Å; L419-T423 WeakPolarHBondContact O-CG2 3.49Å; L419-T423 PolarHBondContact O-N 3.47Å; L419-T423 VanDerWaalsContact O-N 3.1Å; L419-L455 HydrophobicContact CD2-CD1 4.15Å; L419-L455 HydrophobicContact CD2-CD2 3.94Å
420	K	67.9	Low	66.9	Low	103 Å²	103	78.4 Å²	78.4	45%	0.448	42%	0.422	S	S	.	.	H	α-helix	trans	-60	-46.6	172.2	-72.1	171.7	-173	168.7	0	111.8	K416 N417 L418 K422 T423 H424	K416-K420 WeakPolarHBondContact O-CG 3.48Å; K416-K420 PolarHBondContact O-N 3.44Å; N417-K420 PolarHBondContact O-N 3.45Å; N417-K420 PolarHBondContact OD1-NZ 3.29Å; L418-K420 VanDerWaalsContact C-N 3.34Å; L418-K420 PolarHBondContact O-N 3.09Å; K420-K422 VanDerWaalsContact C-N 3.32Å; K420-K422 PolarHBondContact O-N 3.33Å; K420-T423 WeakPolarHBondContact CA-OG1 3.29Å; K420-T423 PolarHBondContact O-N 2.95Å; K420-T423 VanDerWaalsContact O-N 3.13Å; K420-T423 PolarHBondContact O-OG1 3.32Å; K420-H424 PolarHBondContact O-CD2 2.73Å; K420-H424 VanDerWaalsContact O-CD2 3.3Å; K420-H424 PolarHBondContact O-N 3.27Å
421	A	60.8	Low	64.6	Low	44 Å²	44	76.9 Å²	76.9	36%	0.364	42%	0.42	S	S	.	.	H	α-helix	trans	-57.6	-44.7	179.1	0	0	0	0	0	111.4	N417 L418 T423 H424 L425	N417-A421 PolarHBondContact O-N 2.84Å; L418-A421 WeakPolarHBondContact O-CB 3.12Å; L418-A421 PolarHBondContact O-N 3.49Å; L418-A421 VanDerWaalsContact O-N 3.08Å; A421-T423 PolarHBondContact O-N 2.87Å; A421-H424 PolarHBondContact O-N 3.09Å; A421-H424 VanDerWaalsContact O-N 3.15Å; A421-L425 WeakPolarHBondContact O-CB 3.24Å; A421-L425 WeakPolarHBondContact O-CG 3.35Å; A421-L425 PolarHBondContact O-N 3.22Å
422	K	61.9	Low	62	Low	55 Å²	55	78.4 Å²	78.4	24%	0.239	43%	0.427	C	S	.	.	H	α-helix	trans	-60.2	-42.1	175.5	-154.3	159.9	179.3	168	0	111.5	L418 L419 K420 H424 M426 E454 L455 E458	L418-K422 PolarHBondContact O-N 3.45Å; L419-K422 PolarHBondContact O-N 3.15Å; K420-K422 VanDerWaalsContact C-N 3.32Å; K420-K422 PolarHBondContact O-N 3.33Å; K422-H424 VanDerWaalsContact C-N 3.34Å; K422-H424 PolarHBondContact O-N 3.38Å; K422-M426 WeakPolarHBondContact O-CG 3.33Å; K422-M426 PolarHBondContact O-N 2.91Å; K422-M426 VanDerWaalsContact O-N 3.14Å; K422-E454 IonicContact NZ-OE2 3.94Å; K422-E454 PolarHBondContact NZ-OE2 2.76Å; K422-L455 HydrophobicContact CD-CD2 3.77Å; K422-E458 IonicContact NZ-OE1 2.71Å; K422-E458 PolarHBondContact NZ-OE1 2.93Å; K422-E458 IonicContact NZ-OE2 3.43Å; K422-E458 PolarHBondContact NZ-OE2 3.13Å
423	T	56.7	Low	59.7	Low	90 Å²	90	85.2 Å²	85.2	55%	0.552	45%	0.453	S	S	*	.	H	α-helix	trans	-65.7	-28.4	174.9	62.2	0	0	0	0	115	L419 K420 A421	L419-T423 WeakPolarHBondContact O-CG2 3.49Å; L419-T423 PolarHBondContact O-N 3.47Å; L419-T423 VanDerWaalsContact O-N 3.1Å; K420-T423 WeakPolarHBondContact CA-OG1 3.29Å; K420-T423 PolarHBondContact O-N 2.95Å; K420-T423 VanDerWaalsContact O-N 3.13Å; K420-T423 PolarHBondContact O-OG1 3.32Å; A421-T423 PolarHBondContact O-N 2.87Å
424	H	48.9	Very low	57.3	Low	151 Å²	151	89.9 Å²	89.9	70%	0.699	46%	0.457	S	S	*	.	H	α-helix	trans	-85.4	-38.7	176.5	-78.9	-73.6	0	0	0	112.9	K420 A421 K422 M426 G427	K420-H424 PolarHBondContact O-CD2 2.73Å; K420-H424 VanDerWaalsContact O-CD2 3.3Å; K420-H424 PolarHBondContact O-N 3.27Å; A421-H424 PolarHBondContact O-N 3.09Å; A421-H424 VanDerWaalsContact O-N 3.15Å; K422-H424 VanDerWaalsContact C-N 3.34Å; K422-H424 PolarHBondContact O-N 3.38Å; H424-M426 VanDerWaalsContact C-N 3.29Å; H424-M426 PolarHBondContact O-N 2.72Å; H424-G427 PolarHBondContact O-N 3.4Å; H424-G427 VanDerWaalsContact O-N 3.12Å
425	L	46.6	Very low	55	Low	154 Å²	154	87.2 Å²	87.2	81%	0.806	45%	0.448	S	S	*	.	H	α-helix	trans	-65.6	-31.9	177.2	-73.2	166.5	0	0	0	112.1	A421 G427	A421-L425 WeakPolarHBondContact O-CB 3.24Å; A421-L425 WeakPolarHBondContact O-CG 3.35Å; A421-L425 PolarHBondContact O-N 3.22Å; L425-G427 PolarHBondContact O-N 3.01Å; L425-G427 VanDerWaalsContact O-N 3.13Å
426	M	39.4	Very low	52.6	Low	95 Å²	95	89.9 Å²	89.9	47%	0.468	47%	0.467	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80	25.2	171.6	-60.4	-157.7	89.5	0	0	114	K422 H424 S428 S431	K422-M426 WeakPolarHBondContact O-CG 3.33Å; K422-M426 PolarHBondContact O-N 2.91Å; K422-M426 VanDerWaalsContact O-N 3.14Å; H424-M426 VanDerWaalsContact C-N 3.29Å; H424-M426 PolarHBondContact O-N 2.72Å; M426-S428 PolarHBondContact O-N 3.37Å; M426-S431 WeakPolarHBondContact O-CB 3.31Å
427	G	36.6	Very low	50.6	Low	43 Å²	43	91.8 Å²	91.8	44%	0.443	47%	0.472	S	S	.	.			trans	-65.1	24.6	-176.5	0	0	0	0	0	117.6	H424 L425	H424-G427 PolarHBondContact O-N 3.4Å; H424-G427 VanDerWaalsContact O-N 3.12Å; L425-G427 PolarHBondContact O-N 3.01Å; L425-G427 VanDerWaalsContact O-N 3.13Å
428	S	42.5	Very low	48.8	Very low	65 Å²	65	89.5 Å²	89.5	46%	0.455	47%	0.467	S	S	.	.	S	Bend	trans	-84	132	164.9	-179	0	0	0	0	109.7	M426 N430 S431 Q432	M426-S428 PolarHBondContact O-N 3.37Å; S428-N430 PolarHBondContact O-N 2.9Å; S428-S431 PolarHBondContact O-N 3.1Å; S428-Q432 PolarHBondContact O-N 3.21Å
429	P	43.8	Very low	47.3	Very low	94 Å²	94	93 Å²	93	61%	0.61	49%	0.486	S	S	*	.	H	α-helix	trans	-55.8	-27.8	-174.1	-29.5	35.9	0	0	0	115.4	R433	P429-R433 PolarHBondContact O-N 2.93Å
430	N	44.3	Very low	45.8	Very low	119 Å²	119	98.3 Å²	98.3	64%	0.636	51%	0.514	S	S	*	.	H	α-helix	trans	-78.2	-27.6	176	-76.8	-11.8	0	0	0	113.4	S428 R434	S428-N430 PolarHBondContact O-N 2.9Å; N430-R434 PolarHBondContact O-N 3.27Å
431	S	43.1	Very low	44.3	Very low	34 Å²	34	96 Å²	96	24%	0.238	52%	0.515	C	S	.	.	H	α-helix	trans	-81.5	-37.7	176.4	-62.6	0	0	0	0	111.7	M426 S428 R433 R434 M435	M426-S431 WeakPolarHBondContact O-CB 3.31Å; S428-S431 PolarHBondContact O-N 3.1Å; S431-R433 VanDerWaalsContact C-N 3.29Å; S431-R433 PolarHBondContact O-N 3.43Å; S431-R434 WeakPolarHBondContact O-CB 3.28Å; S431-R434 PolarHBondContact O-N 2.89Å; S431-M435 PolarHBondContact O-N 3.1Å; S431-M435 VanDerWaalsContact O-N 3.07Å
432	Q	38.7	Very low	43.7	Very low	98 Å²	98	98 Å²	98	46%	0.458	54%	0.54	S	S	.	.	H	α-helix	trans	-58.3	-42.5	171.6	-71.2	-179.7	-34.3	0	0	111.4	S428 R434 M435 S436	S428-Q432 PolarHBondContact O-N 3.21Å; Q432-R434 PolarHBondContact O-N 2.99Å; Q432-M435 PolarHBondContact O-N 2.81Å; Q432-S436 WeakPolarHBondContact O-CB 3.38Å; Q432-S436 PolarHBondContact O-N 3.43Å; Q432-S436 PolarHBondContact O-OG 3.17Å
433	R	42.9	Very low	42.8	Very low	153 Å²	153	105.6 Å²	105.6	58%	0.577	57%	0.566	S	S	*	*	H	α-helix	trans	-59.6	-42.2	170.6	-79.7	-176.1	170.8	-175.6	-1.3	112.9	P429 S431 M435 S436 Y437	P429-R433 PolarHBondContact O-N 2.93Å; S431-R433 VanDerWaalsContact C-N 3.29Å; S431-R433 PolarHBondContact O-N 3.43Å; R433-M435 VanDerWaalsContact C-N 3.34Å; R433-M435 PolarHBondContact O-N 3.47Å; R433-S436 PolarHBondContact O-OG 2.71Å; R433-Y437 HydrophobicContact CB-CD2 4.05Å; R433-Y437 HydrophobicContact CB-CE2 3.78Å; R433-Y437 HydrophobicContact CG-CE2 3.77Å; R433-Y437 WeakPolarHBondContact O-CB 3.49Å; R433-Y437 WeakPolarHBondContact O-CD2 3.34Å; R433-Y437 VanDerWaalsContact O-CG 3.32Å; R433-Y437 PolarHBondContact O-N 3.11Å; R433-Y437 VanDerWaalsContact O-N 3.11Å
434	R	41.5	Very low	42.2	Very low	196 Å²	196	108.3 Å²	108.3	74%	0.74	57%	0.573	S	S	*	*	H	α-helix	trans	-58.1	-44.9	176.7	-75.9	-177.4	-178	-171.3	1.1	111.6	N430 S431 Q432 A438	N430-R434 PolarHBondContact O-N 3.27Å; S431-R434 WeakPolarHBondContact O-CB 3.28Å; S431-R434 PolarHBondContact O-N 2.89Å; Q432-R434 PolarHBondContact O-N 2.99Å; R434-A438 WeakPolarHBondContact O-CB 3.48Å; R434-A438 PolarHBondContact O-N 3.11Å
435	M	40.6	Very low	42.1	Very low	70 Å²	70	108.3 Å²	108.3	35%	0.345	57%	0.573	S	S	.	*	H	α-helix	trans	-78.9	-39.5	-179.4	-81.6	-69.3	117.4	0	0	114.3	S431 Q432 R433 Y437 A438 L439	S431-M435 PolarHBondContact O-N 3.1Å; S431-M435 VanDerWaalsContact O-N 3.07Å; Q432-M435 PolarHBondContact O-N 2.81Å; R433-M435 VanDerWaalsContact C-N 3.34Å; R433-M435 PolarHBondContact O-N 3.47Å; M435-Y437 PolarHBondContact O-N 2.94Å; M435-A438 HydrophobicContact CE-CB 3.92Å; M435-A438 PolarHBondContact O-N 2.86Å; M435-L439 PolarHBondContact O-N 2.69Å; M435-L439 VanDerWaalsContact O-N 3.11Å
436	S	39.1	Very low	42.5	Very low	59 Å²	59	106.5 Å²	106.5	41%	0.413	57%	0.573	S	S	.	*	H	α-helix	trans	-64.7	-26.4	177.3	68.7	0	0	0	0	113	Q432 R433 N440	Q432-S436 WeakPolarHBondContact O-CB 3.38Å; Q432-S436 PolarHBondContact O-N 3.43Å; Q432-S436 PolarHBondContact O-OG 3.17Å; R433-S436 PolarHBondContact O-OG 2.71Å; S436-N440 PolarHBondContact O-ND2 3.3Å
437	Y	39.3	Very low	44.1	Very low	137 Å²	137	105.5 Å²	105.5	54%	0.537	58%	0.575	S	S	.	*	H	α-helix	trans	-93.9	-31.9	173.4	-56.3	-43.5	0	0	0	113	R433 M435 L439 N440 A441	R433-Y437 HydrophobicContact CB-CD2 4.05Å; R433-Y437 HydrophobicContact CB-CE2 3.78Å; R433-Y437 HydrophobicContact CG-CE2 3.77Å; R433-Y437 WeakPolarHBondContact O-CB 3.49Å; R433-Y437 WeakPolarHBondContact O-CD2 3.34Å; R433-Y437 VanDerWaalsContact O-CG 3.32Å; R433-Y437 PolarHBondContact O-N 3.11Å; R433-Y437 VanDerWaalsContact O-N 3.11Å; M435-Y437 PolarHBondContact O-N 2.94Å; Y437-L439 VanDerWaalsContact C-N 3.35Å; Y437-L439 PolarHBondContact O-N 3.35Å; Y437-N440 CarbonylContact O-C 3.55Å; Y437-N440 PolarHBondContact O-N 3.35Å; Y437-A441 WeakPolarHBondContact O-CA 3.41Å; Y437-A441 WeakPolarHBondContact O-CB 3.37Å; Y437-A441 PolarHBondContact O-N 3.24Å
438	A	40.1	Very low	46.5	Very low	52 Å²	52	104.9 Å²	104.9	43%	0.43	56%	0.562	S	S	.	*	H	α-helix	trans	-63.5	-38.3	175.1	0	0	0	0	0	112.7	R434 M435 N440	R434-A438 WeakPolarHBondContact O-CB 3.48Å; R434-A438 PolarHBondContact O-N 3.11Å; M435-A438 HydrophobicContact CE-CB 3.92Å; M435-A438 PolarHBondContact O-N 2.86Å; A438-N440 PolarHBondContact O-N 2.77Å
439	L	46.3	Very low	48.8	Very low	108 Å²	108	103.1 Å²	103.1	57%	0.565	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.7	-5.5	176.2	-73.1	166.4	0	0	0	114.4	M435 Y437	M435-L439 PolarHBondContact O-N 2.69Å; M435-L439 VanDerWaalsContact O-N 3.11Å; Y437-L439 VanDerWaalsContact C-N 3.35Å; Y437-L439 PolarHBondContact O-N 3.35Å
440	N	41.4	Very low	51	Low	144 Å²	144	102.2 Å²	102.2	77%	0.77	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-138.8	-1.8	-173.5	-75.4	-58.4	0	0	0	115.2	S436 Y437 A438	S436-N440 PolarHBondContact O-ND2 3.3Å; Y437-N440 CarbonylContact O-C 3.55Å; Y437-N440 PolarHBondContact O-N 3.35Å; A438-N440 PolarHBondContact O-N 2.77Å
441	A	35.8	Very low	53.2	Low	56 Å²	56	100.2 Å²	100.2	46%	0.463	53%	0.528	S	S	.	.	S	Bend	trans	-145.1	115.1	-179.5	0	0	0	0	0	109.9	Y437 R443	Y437-A441 WeakPolarHBondContact O-CA 3.41Å; Y437-A441 WeakPolarHBondContact O-CB 3.37Å; Y437-A441 PolarHBondContact O-N 3.24Å; A441-R443 PolarHBondContact O-N 2.94Å
442	G	47.6	Very low	55.6	Low	86 Å²	86	98.6 Å²	98.6	89%	0.887	52%	0.517	S	S	*	.			trans	-55.5	130.9	-169	0	0	0	0	0	114.4
443	R	44.8	Very low	58.3	Low	213 Å²	213	95.4 Å²	95.4	80%	0.804	50%	0.501	S	S	*	.			trans	-144.5	111.5	169.4	-81.9	-172.4	163.7	-110.8	-7.3	110	A441	A441-R443 PolarHBondContact O-N 2.94Å
444	H	42.6	Very low	60.6	Low	148 Å²	148	93.1 Å²	93.1	69%	0.685	50%	0.497	S	S	*	.			trans	47.2	97.3	168	-60.3	-74.4	0	0	0	116	S446 S447	H444-S446 PolarHBondContact O-N 3.1Å; H444-S447 PolarHBondContact O-N 3.43Å
445	E	47.9	Very low	63.1	Low	151 Å²	151	84 Å²	84	71%	0.706	46%	0.463	S	S	*	.	G	3₁₀ helix	trans	-52	-29.5	175	-60.5	104.1	146.5	0	0	113	S447	E445-S447 PolarHBondContact O-N 3.14Å; E445-S447 VanDerWaalsContact O-N 3.1Å
446	S	55.3	Low	65.7	Low	115 Å²	115	80.7 Å²	80.7	80%	0.804	45%	0.447	S	S	*	.	G	3₁₀ helix	trans	-57	-19.3	177.3	-179.2	0	0	0	0	115.5	H444	H444-S446 PolarHBondContact O-N 3.1Å
447	S	72.4	Confident	68.3	Low	74 Å²	74	80.6 Å²	80.6	52%	0.517	44%	0.442	S	S	.	.	G	3₁₀ helix	trans	-99.6	-7.8	-173	-165.7	0	0	0	0	115.7	H444 E445	H444-S447 PolarHBondContact O-N 3.43Å; E445-S447 PolarHBondContact O-N 3.14Å; E445-S447 VanDerWaalsContact O-N 3.1Å
448	L	86.8	Confident	70.8	Confident	31 Å²	31	76.2 Å²	76.2	16%	0.162	43%	0.426	C	S	.	.	H	α-helix	trans	-73.3	-44.3	-171.2	-177.3	61.7	0	0	0	113	C402 E403 L406 E451 V452	C402-L448 HydrophobicContact CB-CD2 3.77Å; C402-L448 HydrophobicContact CB-CG 3.9Å; E403-L448 HydrophobicContact CB-CD2 4.33Å; L406-L448 HydrophobicContact CD2-CD1 4.26Å; L448-E451 PolarHBondContact O-N 3.34Å; L448-V452 HydrophobicContact CD1-CG2 3.89Å; L448-V452 HydrophobicContact CG-CG2 4.12Å; L448-V452 WeakPolarHBondContact O-CG2 3.45Å; L448-V452 PolarHBondContact O-N 3.24Å
449	L	89.9	Confident	73.2	Confident	28 Å²	28	73.8 Å²	73.8	15%	0.147	41%	0.406	C	S	.	.	H	α-helix	trans	-58.5	-47.9	-174.9	-174.4	167.2	0	0	0	113	E451 V452 K453 L481	L449-E451 VanDerWaalsContact C-N 3.32Å; L449-E451 PolarHBondContact O-N 2.77Å; L449-V452 PolarHBondContact O-N 3Å; L449-K453 WeakPolarHBondContact O-CB 3.41Å; L449-K453 PolarHBondContact O-N 3.02Å; L449-L481 HydrophobicContact CD1-CB 3.59Å; L449-L481 WeakPolarHBondContact CD1-O 3.35Å
450	P	91.4	Very high	75.4	Confident	74 Å²	74	69.9 Å²	69.9	48%	0.481	39%	0.389	S	S	.	.	H	α-helix	trans	-59	-38.7	177	-25.5	35.8	0	0	0	113.8	K453 E454	P450-K453 PolarHBondContact O-N 3.09Å; P450-E454 PolarHBondContact O-N 3.09Å
451	E	89.8	Confident	77.6	Confident	77 Å²	77	69.9 Å²	69.9	36%	0.36	38%	0.384	S	S	.	.	H	α-helix	trans	-67.7	-46.2	179	-176.2	175.4	172.4	0	0	111.4	L448 L449 K453 E454 L455	L448-E451 PolarHBondContact O-N 3.34Å; L449-E451 VanDerWaalsContact C-N 3.32Å; L449-E451 PolarHBondContact O-N 2.77Å; E451-K453 VanDerWaalsContact C-N 3.31Å; E451-K453 PolarHBondContact O-N 3.37Å; E451-E454 PolarHBondContact O-N 3.46Å; E451-L455 HydrophobicContact CG-CD1 4.3Å; E451-L455 VanDerWaalsContact O-CG 3.3Å; E451-L455 WeakPolarHBondContact O-CG 3.32Å; E451-L455 PolarHBondContact O-N 2.82Å
452	V	93.7	Very high	80	Confident	0 Å²	0	72.5 Å²	72.5	0%	0	39%	0.391	C	S	.	.	H	α-helix	trans	-64.2	-38.4	176.9	-176.8	0	0	0	0	110.9	C402 L405 L406 L448 L449 L455 F456 L478	C402-V452 HydrophobicContact CB-CG2 4.35Å; L405-V452 HydrophobicContact CB-CG1 4.19Å; L406-V452 HydrophobicContact CB-CG1 4.38Å; L406-V452 HydrophobicContact CB-CG2 3.92Å; L406-V452 HydrophobicContact CD1-CG2 4.36Å; L406-V452 HydrophobicContact CD2-CG2 4.23Å; L406-V452 HydrophobicContact CG-CG2 4.36Å; L448-V452 HydrophobicContact CD1-CG2 3.89Å; L448-V452 HydrophobicContact CG-CG2 4.12Å; L448-V452 WeakPolarHBondContact O-CG2 3.45Å; L448-V452 PolarHBondContact O-N 3.24Å; L449-V452 PolarHBondContact O-N 3Å; V452-L455 PolarHBondContact O-N 3.4Å; V452-F456 HydrophobicContact CG1-CD2 3.94Å; V452-F456 HydrophobicContact CG1-CE2 3.92Å; V452-F456 WeakPolarHBondContact O-CD2 3.38Å; V452-F456 PolarHBondContact O-N 3.46Å; V452-L478 HydrophobicContact CB-CD2 4.15Å; V452-L478 HydrophobicContact CG1-CD1 4.04Å; V452-L478 HydrophobicContact CG1-CD2 3.86Å
453	K	94.5	Very high	81.7	Confident	32 Å²	32	70.5 Å²	70.5	14%	0.139	36%	0.359	C	S	.	.	H	α-helix	trans	-65.2	-41.4	175.3	-172.1	166.9	59.8	-172.9	0	112.9	L449 P450 E451 F456 L457 Y479 S482 E484	L449-K453 WeakPolarHBondContact O-CB 3.41Å; L449-K453 PolarHBondContact O-N 3.02Å; P450-K453 PolarHBondContact O-N 3.09Å; E451-K453 VanDerWaalsContact C-N 3.31Å; E451-K453 PolarHBondContact O-N 3.37Å; K453-F456 PolarHBondContact O-N 3.36Å; K453-L457 HydrophobicContact CG-CD1 4.25Å; K453-L457 WeakPolarHBondContact O-CG 3.27Å; K453-L457 PolarHBondContact O-N 3.19Å; K453-Y479 HydrophobicContact CD-CD1 3.94Å; K453-Y479 HydrophobicContact CD-CE1 3.81Å; K453-S482 PolarHBondContact NZ-OG 2.92Å; K453-E484 IonicContact NZ-OE1 3.24Å; K453-E484 PolarHBondContact NZ-OE1 3.22Å
454	E	92.4	Very high	83.2	Confident	104 Å²	104	65.4 Å²	65.4	49%	0.486	36%	0.357	S	S	.	.	H	α-helix	trans	-59	-47.2	172.2	-174.7	-174.1	-108.3	0	0	111	K422 P450 E451 F456 L457 E458	K422-E454 IonicContact NZ-OE2 3.94Å; K422-E454 PolarHBondContact NZ-OE2 2.76Å; P450-E454 PolarHBondContact O-N 3.09Å; E451-E454 PolarHBondContact O-N 3.46Å; E454-F456 PolarHBondContact O-N 3.14Å; E454-L457 PolarHBondContact O-N 3.37Å; E454-L457 VanDerWaalsContact O-N 3.14Å; E454-E458 WeakPolarHBondContact O-CG 3Å; E454-E458 PolarHBondContact O-N 3.22Å
455	L	92.8	Very high	85	Confident	6 Å²	6	66.5 Å²	66.5	3%	0.031	37%	0.368	C	S	.	.	H	α-helix	trans	-62.6	-37.5	-179.7	-69.7	169	0	0	0	113.4	L406 L409 L419 K422 E451 V452 A459	L406-L455 HydrophobicContact CD1-CD1 3.76Å; L409-L455 HydrophobicContact CD2-CB 3.71Å; L419-L455 HydrophobicContact CD2-CD1 4.15Å; L419-L455 HydrophobicContact CD2-CD2 3.94Å; K422-L455 HydrophobicContact CD-CD2 3.77Å; E451-L455 HydrophobicContact CG-CD1 4.3Å; E451-L455 VanDerWaalsContact O-CG 3.3Å; E451-L455 WeakPolarHBondContact O-CG 3.32Å; E451-L455 PolarHBondContact O-N 2.82Å; V452-L455 PolarHBondContact O-N 3.4Å; L455-A459 VanDerWaalsContact O-CB 3.29Å; L455-A459 WeakPolarHBondContact O-CB 3.32Å; L455-A459 PolarHBondContact O-N 3.07Å
456	F	95.4	Very high	86.9	Confident	0 Å²	0	63 Å²	63	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-71.1	-33.2	174.1	-89.7	-109.4	0	0	0	112.4	L405 W408 L409 V452 K453 E454 A459 A460 L471 L475 L478	L405-F456 HydrophobicContact CB-CE2 3.98Å; L405-F456 HydrophobicContact CB-CZ 3.92Å; L405-F456 HydrophobicContact CD2-CZ 4.28Å; L405-F456 WeakPolarHBondContact O-CE2 3.5Å; W408-F456 AromaticContact CE3-CE1 3.97Å; W408-F456 HydrophobicContact CE3-CE1 3.97Å; W408-F456 AromaticContact CE3-CZ 3.76Å; W408-F456 HydrophobicContact CE3-CZ 3.76Å; W408-F456 HydrophobicContact CZ3-CE1 4.01Å; W408-F456 HydrophobicContact CZ3-CZ 4.25Å; L409-F456 HydrophobicContact CB-CE2 3.92Å; L409-F456 HydrophobicContact CB-CZ 4.3Å; L409-F456 HydrophobicContact CD1-CD2 4.35Å; L409-F456 HydrophobicContact CD1-CE2 4.19Å; L409-F456 HydrophobicContact CD1-CZ 4.31Å; L409-F456 HydrophobicContact CD2-CD2 4.07Å; L409-F456 HydrophobicContact CD2-CE2 4.18Å; L409-F456 HydrophobicContact CG-CE2 4.33Å; V452-F456 HydrophobicContact CG1-CD2 3.94Å; V452-F456 HydrophobicContact CG1-CE2 3.92Å; V452-F456 WeakPolarHBondContact O-CD2 3.38Å; V452-F456 PolarHBondContact O-N 3.46Å; K453-F456 PolarHBondContact O-N 3.36Å; E454-F456 PolarHBondContact O-N 3.14Å; F456-A459 PolarHBondContact O-N 3.12Å; F456-A460 PolarHBondContact O-N 3.16Å; F456-L471 HydrophobicContact CD1-CD1 3.45Å; F456-L471 VanDerWaalsContact CD1-CD1 3.45Å; F456-L471 HydrophobicContact CD1-CG 4.2Å; F456-L471 HydrophobicContact CE1-CD1 3.8Å; F456-L471 HydrophobicContact CG-CD1 4.16Å; F456-L475 HydrophobicContact CB-CD2 3.64Å; F456-L475 HydrophobicContact CB-CG 4.01Å; F456-L475 HydrophobicContact CD1-CG 4.39Å; F456-L478 HydrophobicContact CB-CD1 3.94Å; F456-L478 HydrophobicContact CD1-CD1 4.14Å; F456-L478 HydrophobicContact CD2-CD1 3.72Å; F456-L478 HydrophobicContact CE2-CD1 4.23Å; F456-L478 HydrophobicContact CG-CD1 3.66Å
457	L	94.1	Very high	88.6	Confident	57 Å²	57	60.7 Å²	60.7	30%	0.298	34%	0.34	S	S	.	.	H	α-helix	trans	-71.8	-41.1	174.5	-71.8	170.3	0	0	0	112.3	K453 E454 A459 A460 Q461 L475	K453-L457 HydrophobicContact CG-CD1 4.25Å; K453-L457 WeakPolarHBondContact O-CG 3.27Å; K453-L457 PolarHBondContact O-N 3.19Å; E454-L457 PolarHBondContact O-N 3.37Å; E454-L457 VanDerWaalsContact O-N 3.14Å; L457-A459 VanDerWaalsContact C-N 3.31Å; L457-A459 PolarHBondContact O-N 3.5Å; L457-A460 PolarHBondContact O-N 3.15Å; L457-Q461 VanDerWaalsContact O-CG 3.32Å; L457-Q461 WeakPolarHBondContact O-CG 3.28Å; L457-Q461 PolarHBondContact O-N 2.69Å; L457-L475 HydrophobicContact CD2-CD1 4.46Å; L457-L475 HydrophobicContact CD2-CD2 3.77Å; L457-L475 HydrophobicContact CG-CD2 3.91Å
458	E	91.4	Very high	89.7	Confident	45 Å²	45	57.6 Å²	57.6	21%	0.21	32%	0.318	C	S	.	.	H	α-helix	trans	-57	-45.9	168.6	-73.4	178	-172.8	0	0	110.6	L418 K422 E454 A460 Q461 N462	L418-E458 HydrophobicContact CD1-CB 4.45Å; L418-E458 HydrophobicContact CD2-CB 3.78Å; K422-E458 IonicContact NZ-OE1 2.71Å; K422-E458 PolarHBondContact NZ-OE1 2.93Å; K422-E458 IonicContact NZ-OE2 3.43Å; K422-E458 PolarHBondContact NZ-OE2 3.13Å; E454-E458 WeakPolarHBondContact O-CG 3Å; E454-E458 PolarHBondContact O-N 3.22Å; E458-A460 VanDerWaalsContact C-N 3.29Å; E458-A460 PolarHBondContact O-N 2.8Å; E458-Q461 PolarHBondContact O-N 3.21Å; E458-N462 PolarHBondContact O-N 3.19Å; E458-N462 PolarHBondContact O-ND2 3.42Å
459	A	92.1	Very high	90.2	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-61.4	-34.7	178	0	0	0	0	0	113.1	L409 Y415 L418 L455 F456 L457 N463 L471	L409-A459 HydrophobicContact CD1-CB 4.05Å; Y415-A459 HydrophobicContact CD1-CB 3.56Å; Y415-A459 HydrophobicContact CE1-CB 3.85Å; Y415-A459 HydrophobicContact CG-CB 4.12Å; L418-A459 HydrophobicContact CD2-CB 4.01Å; L455-A459 VanDerWaalsContact O-CB 3.29Å; L455-A459 WeakPolarHBondContact O-CB 3.32Å; L455-A459 PolarHBondContact O-N 3.07Å; F456-A459 PolarHBondContact O-N 3.12Å; L457-A459 VanDerWaalsContact C-N 3.31Å; L457-A459 PolarHBondContact O-N 3.5Å; A459-N463 PolarHBondContact O-N 3.32Å; A459-L471 HydrophobicContact CB-CD1 3.79Å; A459-L471 HydrophobicContact CB-CD2 3.98Å
460	A	91.4	Very high	90.6	Very high	26 Å²	26	58 Å²	58	22%	0.215	32%	0.321	C	S	.	.	H	α-helix	trans	-72.7	-44	176.2	0	0	0	0	0	111.7	F456 L457 E458 N462 N463 L471 L475	F456-A460 PolarHBondContact O-N 3.16Å; L457-A460 PolarHBondContact O-N 3.15Å; E458-A460 VanDerWaalsContact C-N 3.29Å; E458-A460 PolarHBondContact O-N 2.8Å; A460-N462 PolarHBondContact O-N 3.16Å; A460-N463 CarbonylContact O-C 3.4Å; A460-N463 PolarHBondContact O-N 3.2Å; A460-N463 VanDerWaalsContact O-N 3.11Å; A460-L471 HydrophobicContact CB-CD2 3.82Å; A460-L475 HydrophobicContact CB-CD1 4.13Å
461	Q	88.4	Confident	90.8	Very high	144 Å²	144	54.6 Å²	54.6	67%	0.673	30%	0.299	S	S	*	.	H	α-helix	trans	-63.4	-39.2	178.4	-70.5	171.7	16.4	0	0	112.6	L457 E458 N463 S464	L457-Q461 VanDerWaalsContact O-CG 3.32Å; L457-Q461 WeakPolarHBondContact O-CG 3.28Å; L457-Q461 PolarHBondContact O-N 2.69Å; E458-Q461 PolarHBondContact O-N 3.21Å; Q461-N463 PolarHBondContact O-N 3.2Å; Q461-S464 PolarHBondContact O-N 3.1Å
462	N	85.7	Confident	91.2	Very high	112 Å²	112	52.4 Å²	52.4	60%	0.599	29%	0.289	S	S	*	.	H	α-helix	trans	-69	-18.8	175.9	-76.3	-80	0	0	0	113.2	E458 A460	E458-N462 PolarHBondContact O-N 3.19Å; E458-N462 PolarHBondContact O-ND2 3.42Å; A460-N462 PolarHBondContact O-N 3.16Å
463	N	82.6	Confident	91.4	Very high	43 Å²	43	52.6 Å²	52.6	23%	0.23	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.2	32.7	176.5	-83.2	30	0	0	0	112.8	Y415 A459 A460 Q461 D465 S466	Y415-N463 WeakPolarHBondContact CE1-ND2 3.49Å; Y415-N463 PolarHBondContact OH-ND2 3.5Å; A459-N463 PolarHBondContact O-N 3.32Å; A460-N463 CarbonylContact O-C 3.4Å; A460-N463 PolarHBondContact O-N 3.2Å; A460-N463 VanDerWaalsContact O-N 3.11Å; Q461-N463 PolarHBondContact O-N 3.2Å; N463-D465 PolarHBondContact O-N 3.38Å; N463-S466 PolarHBondContact O-N 3.44Å; N463-S466 VanDerWaalsContact O-N 3.07Å; N463-S466 VanDerWaalsContact O-O 3.1Å
464	S	76.3	Confident	91.6	Very high	107 Å²	107	51 Å²	51	75%	0.748	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-18.8	-174.1	-169	0	0	0	0	115.6	Q461	Q461-S464 PolarHBondContact O-N 3.1Å
465	D	80.1	Confident	91.8	Very high	171 Å²	171	46.3 Å²	46.3	91%	0.914	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-19.1	179.7	-62.7	-36	0	0	0	113.8	N463	N463-D465 PolarHBondContact O-N 3.38Å
466	S	87.6	Confident	92.1	Very high	77 Å²	77	46 Å²	46	54%	0.538	26%	0.26	S	S	.	.	S	Bend	trans	-156	124.2	-175.8	66	0	0	0	0	113	N463 D468	N463-S466 PolarHBondContact O-N 3.44Å; N463-S466 VanDerWaalsContact O-N 3.07Å; N463-S466 VanDerWaalsContact O-O 3.1Å; S466-D468 PolarHBondContact O-N 2.73Å
467	V	92.9	Very high	92.2	Very high	66 Å²	66	46.3 Å²	46.3	40%	0.4	26%	0.262	S	S	.	.			trans	-62.9	123	172.4	175.3	0	0	0	0	110.4	P469 Q472 T494 V498	V467-P469 WeakPolarHBondContact O-CD 3.33Å; V467-Q472 HydrophobicContact CG1-CG 4.07Å; V467-T494 HydrophobicContact CG1-CG2 3.68Å; V467-T494 HydrophobicContact CG2-CG2 4.08Å; V467-V498 HydrophobicContact CB-CG2 3.77Å; V467-V498 HydrophobicContact CG1-CG2 3.61Å
468	D	95.4	Very high	92.4	Very high	9 Å²	9	43.6 Å²	43.6	5%	0.048	25%	0.247	C	C	.	.			trans	-96.5	108.9	169.7	-170.5	-59	0	0	0	109.5	K414 Y415 S466 D470 L471 Q472	K414-D468 WeakPolarHBondContact CD-OD2 3.38Å; K414-D468 IonicContact NZ-OD2 2.64Å; K414-D468 PolarHBondContact NZ-OD2 3.26Å; Y415-D468 VanDerWaalsContact OH-CB 3.24Å; Y415-D468 WeakPolarHBondContact OH-CB 3.44Å; Y415-D468 PolarHBondContact OH-OD2 3.21Å; S466-D468 PolarHBondContact O-N 2.73Å; D468-D470 VanDerWaalsContact C-N 3.28Å; D468-D470 PolarHBondContact O-N 2.94Å; D468-D470 PolarHBondContact OD1-N 3.4Å; D468-L471 HydrophobicContact CB-CB 3.91Å; D468-L471 PolarHBondContact O-N 2.89Å; D468-L471 PolarHBondContact OD1-N 3.39Å; D468-Q472 WeakPolarHBondContact O-CG 3.46Å; D468-Q472 PolarHBondContact O-N 3.03Å
469	P	96.9	Very high	92.7	Very high	13 Å²	13	42.9 Å²	42.9	8%	0.084	24%	0.243	C	C	.	.	H	α-helix	trans	-68	-24.3	-175	26.2	-34.7	0	0	0	113.5	V467 T473 A495 V498 R499	V467-P469 WeakPolarHBondContact O-CD 3.33Å; P469-T473 WeakPolarHBondContact O-CB 3.22Å; P469-T473 PolarHBondContact O-N 2.91Å; P469-T473 PolarHBondContact O-OG1 3.11Å; P469-A495 HydrophobicContact CB-CB 3.96Å; P469-V498 HydrophobicContact CB-CB 4.32Å; P469-V498 HydrophobicContact CG-CB 4.27Å; P469-V498 HydrophobicContact CG-CG1 4.04Å; P469-R499 HydrophobicContact CB-CG 4.33Å; P469-R499 HydrophobicContact CG-CG 4.21Å
470	D	96.8	Very high	92.9	Very high	54 Å²	54	44.1 Å²	44.1	29%	0.289	25%	0.25	S	C	.	.	H	α-helix	trans	-79.3	-36.6	177.8	-57.6	-50.5	0	0	0	110.8	M386 W408 D468 Q472 T473 G474 R499	M386-D470 VanDerWaalsContact CE-O 3.25Å; M386-D470 WeakPolarHBondContact CE-O 3.35Å; W408-D470 HydrophobicContact CH2-CB 4.19Å; W408-D470 HydrophobicContact CZ2-CB 3.61Å; D468-D470 VanDerWaalsContact C-N 3.28Å; D468-D470 PolarHBondContact O-N 2.94Å; D468-D470 PolarHBondContact OD1-N 3.4Å; D470-Q472 VanDerWaalsContact C-N 3.35Å; D470-T473 WeakPolarHBondContact O-CB 3.44Å; D470-T473 PolarHBondContact O-N 3.45Å; D470-G474 PolarHBondContact O-N 2.9Å; D470-R499 IonicContact OD1-CZ 2.75Å; D470-R499 VanDerWaalsContact OD1-CZ 3.24Å; D470-R499 IonicContact OD1-NH1 3.89Å; D470-R499 PolarHBondContact OD1-NH1 3.47Å; D470-R499 IonicContact OD1-NH2 2.75Å; D470-R499 PolarHBondContact OD1-NH2 2.97Å; D470-R499 IonicContact OD2-CZ 2.59Å; D470-R499 IonicContact OD2-NH2 3.88Å; D470-R499 PolarHBondContact OD2-NH2 2.93Å
471	L	96.8	Very high	93	Very high	3 Å²	3	43.4 Å²	43.4	2%	0.016	24%	0.242	C	C	.	.	H	α-helix	trans	-61.8	-44	168.8	-173.9	76.4	0	0	0	111.3	W408 L409 Y415 F456 A459 A460 D468 T473 G474 L475	W408-L471 HydrophobicContact CH2-CB 4.24Å; W408-L471 HydrophobicContact CH2-CD1 4.42Å; W408-L471 HydrophobicContact CZ3-CD1 3.88Å; L409-L471 HydrophobicContact CD1-CD1 3.99Å; Y415-L471 HydrophobicContact CD2-CD1 4.32Å; Y415-L471 HydrophobicContact CE1-CD1 4.46Å; Y415-L471 HydrophobicContact CE1-CD2 4.13Å; Y415-L471 HydrophobicContact CE2-CB 4.28Å; Y415-L471 HydrophobicContact CE2-CD1 3.92Å; Y415-L471 HydrophobicContact CE2-CG 4.48Å; F456-L471 HydrophobicContact CD1-CD1 3.45Å; F456-L471 VanDerWaalsContact CD1-CD1 3.45Å; F456-L471 HydrophobicContact CD1-CG 4.2Å; F456-L471 HydrophobicContact CE1-CD1 3.8Å; F456-L471 HydrophobicContact CG-CD1 4.16Å; A459-L471 HydrophobicContact CB-CD1 3.79Å; A459-L471 HydrophobicContact CB-CD2 3.98Å; A460-L471 HydrophobicContact CB-CD2 3.82Å; D468-L471 HydrophobicContact CB-CB 3.91Å; D468-L471 PolarHBondContact O-N 2.89Å; D468-L471 PolarHBondContact OD1-N 3.39Å; L471-T473 VanDerWaalsContact C-N 3.31Å; L471-T473 PolarHBondContact O-N 2.88Å; L471-G474 PolarHBondContact O-N 3.32Å; L471-G474 VanDerWaalsContact O-N 3.17Å; L471-L475 PolarHBondContact O-N 3.11Å
472	Q	97.9	Very high	93.3	Very high	32 Å²	32	38.8 Å²	38.8	15%	0.15	23%	0.226	C	C	.	.	H	α-helix	trans	-65.2	-34	176.3	-69.7	-67.4	-5.3	0	0	112.3	V467 D468 D470 L475 G476 T494 A495	V467-Q472 HydrophobicContact CG1-CG 4.07Å; D468-Q472 WeakPolarHBondContact O-CG 3.46Å; D468-Q472 PolarHBondContact O-N 3.03Å; D470-Q472 VanDerWaalsContact C-N 3.35Å; Q472-L475 PolarHBondContact O-N 2.86Å; Q472-G476 PolarHBondContact O-N 3.1Å; Q472-T494 HydrophobicContact CG-CG2 3.98Å; Q472-A495 HydrophobicContact CB-CB 3.96Å
473	T	98.3	Very high	93.7	Very high	3 Å²	3	35.3 Å²	35.3	2%	0.018	22%	0.217	C	C	.	.	H	α-helix	trans	-59.3	-46.8	170.1	-57.3	0	0	0	0	110.7	M386 P469 D470 L471 L475 G476 V477 F492 L505	M386-T473 HydrophobicContact CG-CG2 4.11Å; M386-T473 HydrophobicContact SD-CG2 3.8Å; P469-T473 WeakPolarHBondContact O-CB 3.22Å; P469-T473 PolarHBondContact O-N 2.91Å; P469-T473 PolarHBondContact O-OG1 3.11Å; D470-T473 WeakPolarHBondContact O-CB 3.44Å; D470-T473 PolarHBondContact O-N 3.45Å; L471-T473 VanDerWaalsContact C-N 3.31Å; L471-T473 PolarHBondContact O-N 2.88Å; T473-L475 PolarHBondContact O-N 3.39Å; T473-G476 PolarHBondContact O-N 3.24Å; T473-V477 WeakPolarHBondContact O-CG2 3.39Å; T473-V477 PolarHBondContact O-N 3.19Å; T473-F492 HydrophobicContact CG2-CE1 4.17Å; T473-L505 HydrophobicContact CG2-CD2 4.49Å; T473-L505 WeakPolarHBondContact OG1-CD2 3.38Å
474	G	97.8	Very high	94.4	Very high	0 Å²	0	36 Å²	36	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-63.2	-39	176.2	0	0	0	0	0	113.7	D470 L471 V477 L478	D470-G474 PolarHBondContact O-N 2.9Å; L471-G474 PolarHBondContact O-N 3.32Å; L471-G474 VanDerWaalsContact O-N 3.17Å; G474-V477 PolarHBondContact O-N 3.46Å; G474-L478 WeakPolarHBondContact O-CD1 3.42Å; G474-L478 WeakPolarHBondContact O-CG 3.41Å; G474-L478 PolarHBondContact O-N 2.88Å
475	L	97.9	Very high	95.4	Very high	4 Å²	4	33.6 Å²	33.6	2%	0.021	20%	0.195	C	C	.	.	H	α-helix	trans	-61.9	-44.3	171.6	-80.2	168.3	0	0	0	112	F456 L457 A460 L471 Q472 T473 V477 L478 Y479 A491	F456-L475 HydrophobicContact CB-CD2 3.64Å; F456-L475 HydrophobicContact CB-CG 4.01Å; F456-L475 HydrophobicContact CD1-CG 4.39Å; L457-L475 HydrophobicContact CD2-CD1 4.46Å; L457-L475 HydrophobicContact CD2-CD2 3.77Å; L457-L475 HydrophobicContact CG-CD2 3.91Å; A460-L475 HydrophobicContact CB-CD1 4.13Å; L471-L475 PolarHBondContact O-N 3.11Å; Q472-L475 PolarHBondContact O-N 2.86Å; T473-L475 PolarHBondContact O-N 3.39Å; L475-V477 VanDerWaalsContact C-N 3.31Å; L475-V477 PolarHBondContact O-N 3.42Å; L475-L478 PolarHBondContact O-N 3.46Å; L475-Y479 HydrophobicContact CB-CE2 4.47Å; L475-Y479 HydrophobicContact CD2-CE2 4.39Å; L475-Y479 WeakPolarHBondContact O-CB 3.08Å; L475-Y479 WeakPolarHBondContact O-CD2 3.36Å; L475-Y479 PolarHBondContact O-N 3.16Å; L475-A491 HydrophobicContact CB-CB 4.16Å
476	G	98.2	Very high	96.2	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-61.2	-36.8	176.4	0	0	0	0	0	113.3	Q472 T473 N480 A488 F492	Q472-G476 PolarHBondContact O-N 3.1Å; T473-G476 PolarHBondContact O-N 3.24Å; G476-N480 PolarHBondContact O-N 2.97Å; G476-N480 VanDerWaalsContact O-N 3.1Å; G476-N480 PolarHBondContact O-ND2 3.47Å; G476-A488 WeakPolarHBondContact O-CB 3.36Å; G476-F492 VanDerWaalsContact C-CZ 3.47Å
477	V	98.1	Very high	96.7	Very high	7 Å²	7	30.8 Å²	30.8	4%	0.042	17%	0.169	C	C	.	.	H	α-helix	trans	-67.7	-46.5	172.2	175.4	0	0	0	0	111.2	V390 T393 L405 T473 G474 L475 Y479 N480 L481 F492	V390-V477 HydrophobicContact CG2-CG2 3.75Å; T393-V477 HydrophobicContact CG2-CG1 4.38Å; T393-V477 VanDerWaalsContact OG1-CG1 3.24Å; T393-V477 WeakPolarHBondContact OG1-CG1 3.44Å; L405-V477 HydrophobicContact CD1-CB 4.18Å; L405-V477 HydrophobicContact CD1-CG1 3.91Å; T473-V477 WeakPolarHBondContact O-CG2 3.39Å; T473-V477 PolarHBondContact O-N 3.19Å; G474-V477 PolarHBondContact O-N 3.46Å; L475-V477 VanDerWaalsContact C-N 3.31Å; L475-V477 PolarHBondContact O-N 3.42Å; V477-Y479 VanDerWaalsContact C-N 3.3Å; V477-Y479 PolarHBondContact O-N 3.35Å; V477-N480 PolarHBondContact O-N 3.49Å; V477-L481 HydrophobicContact CG1-CD1 3.99Å; V477-L481 HydrophobicContact CG1-CG 4.46Å; V477-L481 WeakPolarHBondContact O-CG 3.43Å; V477-L481 PolarHBondContact O-N 2.9Å; V477-F492 HydrophobicContact CG2-CZ 4.43Å
478	L	97.7	Very high	97	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-62.6	-34.6	178.7	-72.9	159.1	0	0	0	113	L405 V452 F456 G474 L475 S482	L405-L478 HydrophobicContact CD1-CD1 4.07Å; L405-L478 HydrophobicContact CD1-CD2 3.88Å; L405-L478 HydrophobicContact CD1-CG 3.6Å; V452-L478 HydrophobicContact CB-CD2 4.15Å; V452-L478 HydrophobicContact CG1-CD1 4.04Å; V452-L478 HydrophobicContact CG1-CD2 3.86Å; F456-L478 HydrophobicContact CB-CD1 3.94Å; F456-L478 HydrophobicContact CD1-CD1 4.14Å; F456-L478 HydrophobicContact CD2-CD1 3.72Å; F456-L478 HydrophobicContact CE2-CD1 4.23Å; F456-L478 HydrophobicContact CG-CD1 3.66Å; G474-L478 WeakPolarHBondContact O-CD1 3.42Å; G474-L478 WeakPolarHBondContact O-CG 3.41Å; G474-L478 PolarHBondContact O-N 2.88Å; L475-L478 PolarHBondContact O-N 3.46Å; L478-S482 PolarHBondContact O-N 2.9Å; L478-S482 PolarHBondContact O-OG 2.97Å
479	Y	98	Very high	97.1	Very high	30 Å²	30	27.8 Å²	27.8	12%	0.118	15%	0.152	C	C	.	.	H	α-helix	trans	-74.5	-35.9	175	-76.3	-50.5	0	0	0	112.9	K453 L475 V477 S482 G483 E484 K487	K453-Y479 HydrophobicContact CD-CD1 3.94Å; K453-Y479 HydrophobicContact CD-CE1 3.81Å; L475-Y479 HydrophobicContact CB-CE2 4.47Å; L475-Y479 HydrophobicContact CD2-CE2 4.39Å; L475-Y479 WeakPolarHBondContact O-CB 3.08Å; L475-Y479 WeakPolarHBondContact O-CD2 3.36Å; L475-Y479 PolarHBondContact O-N 3.16Å; V477-Y479 VanDerWaalsContact C-N 3.3Å; V477-Y479 PolarHBondContact O-N 3.35Å; Y479-S482 CarbonylContact O-C 3.17Å; Y479-S482 PolarHBondContact O-N 3.45Å; Y479-G483 PolarHBondContact O-N 3.22Å; Y479-G483 VanDerWaalsContact O-N 3.1Å; Y479-E484 HydrophobicContact CD1-CB 3.75Å; Y479-E484 HydrophobicContact CD1-CG 4.4Å; Y479-E484 HydrophobicContact CG-CB 4.35Å; Y479-E484 PolarHBondContact O-N 2.86Å; Y479-K487 HydrophobicContact CD1-CB 3.85Å; Y479-K487 HydrophobicContact CD1-CD 4.1Å; Y479-K487 HydrophobicContact CD2-CB 3.68Å; Y479-K487 HydrophobicContact CE1-CB 3.88Å; Y479-K487 HydrophobicContact CE1-CD 3.56Å; Y479-K487 HydrophobicContact CE1-CG 4.38Å; Y479-K487 HydrophobicContact CE2-CB 3.72Å; Y479-K487 HydrophobicContact CG-CB 3.74Å
480	N	95.9	Very high	97.2	Very high	26 Å²	26	33.2 Å²	33.2	14%	0.139	18%	0.176	C	C	.	.	H	α-helix	trans	-61	-45.2	168.7	-89.1	-84.6	0	0	0	111.2	G476 V477 S482 G483 A488 T512	G476-N480 PolarHBondContact O-N 2.97Å; G476-N480 VanDerWaalsContact O-N 3.1Å; G476-N480 PolarHBondContact O-ND2 3.47Å; V477-N480 PolarHBondContact O-N 3.49Å; N480-S482 PolarHBondContact O-N 2.95Å; N480-S482 VanDerWaalsContact O-N 3.14Å; N480-G483 PolarHBondContact O-N 3.02Å; N480-A488 WeakPolarHBondContact ND2-CB 3.38Å; N480-T512 PolarHBondContact ND2-OG1 3.39Å
481	L	94.2	Very high	97.3	Very high	10 Å²	10	30.8 Å²	30.8	5%	0.052	16%	0.163	C	C	.	.	H	α-helix	trans	-60.8	-22.3	178.5	-73.4	168.6	0	0	0	113.7	T393 R398 A401 L449 V477	T393-L481 HydrophobicContact CG2-CD2 3.77Å; T393-L481 HydrophobicContact CG2-CG 3.95Å; R398-L481 HydrophobicContact CB-CD2 3.99Å; R398-L481 HydrophobicContact CG-CD2 3.78Å; A401-L481 HydrophobicContact CB-CD1 3.96Å; A401-L481 HydrophobicContact CB-CD2 4.44Å; L449-L481 HydrophobicContact CD1-CB 3.59Å; L449-L481 WeakPolarHBondContact CD1-O 3.35Å; V477-L481 HydrophobicContact CG1-CD1 3.99Å; V477-L481 HydrophobicContact CG1-CG 4.46Å; V477-L481 WeakPolarHBondContact O-CG 3.43Å; V477-L481 PolarHBondContact O-N 2.9Å
482	S	93.9	Very high	97.4	Very high	47 Å²	47	30.8 Å²	30.8	33%	0.329	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.7	10.5	172.3	57.6	0	0	0	0	115.5	K453 L478 Y479 N480 E484	K453-S482 PolarHBondContact NZ-OG 2.92Å; L478-S482 PolarHBondContact O-N 2.9Å; L478-S482 PolarHBondContact O-OG 2.97Å; Y479-S482 CarbonylContact O-C 3.17Å; Y479-S482 PolarHBondContact O-N 3.45Å; N480-S482 PolarHBondContact O-N 2.95Å; N480-S482 VanDerWaalsContact O-N 3.14Å; S482-E484 PolarHBondContact O-N 3.28Å; S482-E484 PolarHBondContact OG-OE1 3.1Å
483	G	93.6	Very high	97.4	Very high	40 Å²	40	32.7 Å²	32.7	41%	0.412	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	68.3	13.7	179.3	0	0	0	0	0	115.1	Y479 N480 F485	Y479-G483 PolarHBondContact O-N 3.22Å; Y479-G483 VanDerWaalsContact O-N 3.1Å; N480-G483 PolarHBondContact O-N 3.02Å; G483-F485 WeakPolarHBondContact O-CD2 3.36Å; G483-F485 PolarHBondContact O-N 2.67Å
484	E	97.1	Very high	97.4	Very high	56 Å²	56	34.7 Å²	34.7	26%	0.262	19%	0.187	S	C	.	.			trans	-85.4	52.3	179.7	-71.7	176.4	-88.4	0	0	110.9	K453 Y479 S482 N486 K487 A488	K453-E484 IonicContact NZ-OE1 3.24Å; K453-E484 PolarHBondContact NZ-OE1 3.22Å; Y479-E484 HydrophobicContact CD1-CB 3.75Å; Y479-E484 HydrophobicContact CD1-CG 4.4Å; Y479-E484 HydrophobicContact CG-CB 4.35Å; Y479-E484 PolarHBondContact O-N 2.86Å; S482-E484 PolarHBondContact O-N 3.28Å; S482-E484 PolarHBondContact OG-OE1 3.1Å; E484-N486 VanDerWaalsContact C-N 3.29Å; E484-N486 PolarHBondContact O-N 2.83Å; E484-N486 VanDerWaalsContact O-N 3.11Å; E484-K487 HydrophobicContact CB-CB 4.44Å; E484-K487 HydrophobicContact CB-CD 4.33Å; E484-K487 PolarHBondContact O-N 2.62Å; E484-K487 WeakPolarHBondContact OE2-CD 3.48Å; E484-K487 WeakPolarHBondContact OE2-CE 3.44Å; E484-K487 IonicContact OE2-NZ 2.81Å; E484-K487 PolarHBondContact OE2-NZ 3.31Å; E484-A488 PolarHBondContact O-N 2.72Å; E484-A488 VanDerWaalsContact O-N 3.15Å
485	F	97.5	Very high	97.4	Very high	58 Å²	58	34.7 Å²	34.7	25%	0.254	19%	0.187	S	C	.	.	H	α-helix	trans	-53.1	-39.6	-166.3	-58.2	-63.2	0	0	0	114	G483 K487 A488 V489 T512 N515	G483-F485 WeakPolarHBondContact O-CD2 3.36Å; G483-F485 PolarHBondContact O-N 2.67Å; F485-K487 VanDerWaalsContact C-N 3.3Å; F485-K487 PolarHBondContact O-N 2.86Å; F485-A488 WeakPolarHBondContact O-CB 3.45Å; F485-A488 PolarHBondContact O-N 2.81Å; F485-A488 VanDerWaalsContact O-N 3.13Å; F485-V489 WeakPolarHBondContact O-CG2 3.16Å; F485-V489 PolarHBondContact O-N 3Å; F485-T512 HydrophobicContact CB-CG2 4.31Å; F485-T512 HydrophobicContact CD1-CG2 4.42Å; F485-T512 WeakPolarHBondContact O-CG2 3.37Å; F485-N515 HydrophobicContact CD1-CB 4Å; F485-N515 HydrophobicContact CE1-CB 3.56Å; F485-N515 VanDerWaalsContact CE2-O 3.23Å; F485-N515 WeakPolarHBondContact CE2-O 3.39Å; F485-N515 HydrophobicContact CZ-CB 3.97Å; F485-N515 WeakPolarHBondContact CZ-O 3.29Å
486	N	98	Very high	97.4	Very high	101 Å²	101	35 Å²	35	54%	0.54	19%	0.188	S	C	.	.	H	α-helix	trans	-61.1	-35.6	176.7	-71.1	-37.8	0	0	0	113.2	E484 V489 E490 R518	E484-N486 VanDerWaalsContact C-N 3.29Å; E484-N486 PolarHBondContact O-N 2.83Å; E484-N486 VanDerWaalsContact O-N 3.11Å; N486-V489 PolarHBondContact O-N 3.14Å; N486-E490 WeakPolarHBondContact O-CG 3.3Å; N486-E490 PolarHBondContact O-N 3Å; N486-R518 PolarHBondContact OD1-NH1 3.27Å
487	K	98.3	Very high	97.4	Very high	88 Å²	88	39.3 Å²	39.3	38%	0.383	22%	0.218	S	C	.	.	H	α-helix	trans	-76.9	-30.5	175.4	-59.5	-179.2	-170.6	167.8	0	112.2	Y479 E484 F485 E490 A491	Y479-K487 HydrophobicContact CD1-CB 3.85Å; Y479-K487 HydrophobicContact CD1-CD 4.1Å; Y479-K487 HydrophobicContact CD2-CB 3.68Å; Y479-K487 HydrophobicContact CE1-CB 3.88Å; Y479-K487 HydrophobicContact CE1-CD 3.56Å; Y479-K487 HydrophobicContact CE1-CG 4.38Å; Y479-K487 HydrophobicContact CE2-CB 3.72Å; Y479-K487 HydrophobicContact CG-CB 3.74Å; E484-K487 HydrophobicContact CB-CB 4.44Å; E484-K487 HydrophobicContact CB-CD 4.33Å; E484-K487 PolarHBondContact O-N 2.62Å; E484-K487 WeakPolarHBondContact OE2-CD 3.48Å; E484-K487 WeakPolarHBondContact OE2-CE 3.44Å; E484-K487 IonicContact OE2-NZ 2.81Å; E484-K487 PolarHBondContact OE2-NZ 3.31Å; F485-K487 VanDerWaalsContact C-N 3.3Å; F485-K487 PolarHBondContact O-N 2.86Å; K487-E490 PolarHBondContact O-N 3.16Å; K487-A491 WeakPolarHBondContact O-CB 3.17Å; K487-A491 PolarHBondContact O-N 3.21Å
488	A	98.5	Very high	97.4	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-65.4	-40.9	169.6	0	0	0	0	0	111.5	G476 N480 E484 F485 A491 F492 T512	G476-A488 WeakPolarHBondContact O-CB 3.36Å; N480-A488 WeakPolarHBondContact ND2-CB 3.38Å; E484-A488 PolarHBondContact O-N 2.72Å; E484-A488 VanDerWaalsContact O-N 3.15Å; F485-A488 WeakPolarHBondContact O-CB 3.45Å; F485-A488 PolarHBondContact O-N 2.81Å; F485-A488 VanDerWaalsContact O-N 3.13Å; A488-A491 PolarHBondContact O-N 2.88Å; A488-F492 HydrophobicContact CB-CE2 4.37Å; A488-F492 WeakPolarHBondContact O-CD2 3.48Å; A488-F492 PolarHBondContact O-N 3.24Å; A488-T512 HydrophobicContact CB-CG2 3.35Å
489	V	98.7	Very high	97.4	Very high	12 Å²	12	46.2 Å²	46.2	7%	0.073	25%	0.251	C	S	.	.	H	α-helix	trans	-60.5	-44.3	172.1	167.3	0	0	0	0	111.4	F485 N486 N493 L509 T512 L513	F485-V489 WeakPolarHBondContact O-CG2 3.16Å; F485-V489 PolarHBondContact O-N 3Å; N486-V489 PolarHBondContact O-N 3.14Å; V489-N493 VanDerWaalsContact CG1-ND2 3.35Å; V489-N493 WeakPolarHBondContact CG1-ND2 3.43Å; V489-N493 VanDerWaalsContact O-CB 3.3Å; V489-N493 WeakPolarHBondContact O-CB 3.45Å; V489-N493 PolarHBondContact O-N 3.41Å; V489-N493 PolarHBondContact O-ND2 3.08Å; V489-L509 HydrophobicContact CB-CD1 4.26Å; V489-L509 HydrophobicContact CG1-CD1 3.92Å; V489-L509 HydrophobicContact CG2-CD1 4.12Å; V489-T512 HydrophobicContact CG2-CG2 3.61Å; V489-L513 HydrophobicContact CG1-CD2 4.41Å; V489-L513 HydrophobicContact CG2-CD2 3.77Å; V489-L513 HydrophobicContact CG2-CG 4Å
490	E	98.3	Very high	97.4	Very high	126 Å²	126	48.2 Å²	48.2	59%	0.589	27%	0.268	S	S	*	.	H	α-helix	trans	-59.4	-44.9	173.1	-74.1	171.5	-175.1	0	0	112.1	N486 K487 T494	N486-E490 WeakPolarHBondContact O-CG 3.3Å; N486-E490 PolarHBondContact O-N 3Å; K487-E490 PolarHBondContact O-N 3.16Å; E490-T494 VanDerWaalsContact O-CB 3.29Å; E490-T494 WeakPolarHBondContact O-CB 3.47Å; E490-T494 PolarHBondContact O-N 3.47Å; E490-T494 PolarHBondContact O-OG1 2.99Å
491	A	98.3	Very high	97.5	Very high	3 Å²	3	52.5 Å²	52.5	3%	0.025	29%	0.287	C	S	.	.	H	α-helix	trans	-64.9	-46	179.2	0	0	0	0	0	112.5	L475 K487 A488 T494 A495	L475-A491 HydrophobicContact CB-CB 4.16Å; K487-A491 WeakPolarHBondContact O-CB 3.17Å; K487-A491 PolarHBondContact O-N 3.21Å; A488-A491 PolarHBondContact O-N 2.88Å; A491-T494 WeakPolarHBondContact O-CB 3.43Å; A491-T494 PolarHBondContact O-N 3.31Å; A491-A495 PolarHBondContact O-N 3.1Å
492	F	98.7	Very high	97.7	Very high	3 Å²	3	53.5 Å²	53.5	1%	0.013	29%	0.292	C	S	.	.	H	α-helix	trans	-68.4	-38.6	177.7	-68.9	-54.8	0	0	0	112.7	T473 G476 V477 A488 T494 A495 L496 L505 R508 L509 T512	T473-F492 HydrophobicContact CG2-CE1 4.17Å; G476-F492 VanDerWaalsContact C-CZ 3.47Å; V477-F492 HydrophobicContact CG2-CZ 4.43Å; A488-F492 HydrophobicContact CB-CE2 4.37Å; A488-F492 WeakPolarHBondContact O-CD2 3.48Å; A488-F492 PolarHBondContact O-N 3.24Å; F492-T494 VanDerWaalsContact C-N 3.29Å; F492-T494 PolarHBondContact O-N 2.82Å; F492-A495 PolarHBondContact O-N 3.06Å; F492-L496 WeakPolarHBondContact O-CB 3.46Å; F492-L496 WeakPolarHBondContact O-CG 3.36Å; F492-L496 PolarHBondContact O-N 2.89Å; F492-L505 HydrophobicContact CD1-CD2 4.01Å; F492-R508 HydrophobicContact CD1-CB 4.01Å; F492-R508 HydrophobicContact CD2-CB 4.39Å; F492-R508 HydrophobicContact CE1-CB 3.75Å; F492-R508 HydrophobicContact CE1-CG 4.3Å; F492-R508 HydrophobicContact CE2-CB 4.15Å; F492-R508 HydrophobicContact CG-CB 4.34Å; F492-R508 HydrophobicContact CZ-CB 3.82Å; F492-R508 HydrophobicContact CZ-CG 4.4Å; F492-L509 HydrophobicContact CB-CB 4.22Å; F492-L509 HydrophobicContact CB-CD1 4.47Å; F492-T512 WeakPolarHBondContact CD2-OG1 3.47Å; F492-T512 WeakPolarHBondContact CE2-OG1 3.5Å
493	N	98.6	Very high	97.9	Very high	73 Å²	73	53.6 Å²	53.6	39%	0.39	29%	0.286	S	S	.	.	H	α-helix	trans	-62.5	-37.3	170.7	-80	-52	0	0	0	112	V489 L496 S497	V489-N493 VanDerWaalsContact CG1-ND2 3.35Å; V489-N493 WeakPolarHBondContact CG1-ND2 3.43Å; V489-N493 VanDerWaalsContact O-CB 3.3Å; V489-N493 WeakPolarHBondContact O-CB 3.45Å; V489-N493 PolarHBondContact O-N 3.41Å; V489-N493 PolarHBondContact O-ND2 3.08Å; N493-L496 PolarHBondContact O-N 3.3Å; N493-S497 PolarHBondContact O-N 3.29Å
494	T	98	Very high	98.1	Very high	45 Å²	45	53.8 Å²	53.8	28%	0.276	28%	0.277	S	S	.	.	H	α-helix	trans	-65.2	-39.4	175.1	-58.9	0	0	0	0	111.2	V467 Q472 E490 A491 F492 S497	V467-T494 HydrophobicContact CG1-CG2 3.68Å; V467-T494 HydrophobicContact CG2-CG2 4.08Å; Q472-T494 HydrophobicContact CG-CG2 3.98Å; E490-T494 VanDerWaalsContact O-CB 3.29Å; E490-T494 WeakPolarHBondContact O-CB 3.47Å; E490-T494 PolarHBondContact O-N 3.47Å; E490-T494 PolarHBondContact O-OG1 2.99Å; A491-T494 WeakPolarHBondContact O-CB 3.43Å; A491-T494 PolarHBondContact O-N 3.31Å; F492-T494 VanDerWaalsContact C-N 3.29Å; F492-T494 PolarHBondContact O-N 2.82Å; T494-S497 PolarHBondContact O-N 2.71Å; T494-S497 PolarHBondContact O-OG 3.04Å
495	A	98.3	Very high	98.2	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-65.9	-44.2	172.4	0	0	0	0	0	112.6	P469 Q472 A491 F492 S497 V498 R499 L505	P469-A495 HydrophobicContact CB-CB 3.96Å; Q472-A495 HydrophobicContact CB-CB 3.96Å; A491-A495 PolarHBondContact O-N 3.1Å; F492-A495 PolarHBondContact O-N 3.06Å; A495-S497 VanDerWaalsContact C-N 3.26Å; A495-S497 PolarHBondContact O-N 3.2Å; A495-V498 PolarHBondContact O-N 3.49Å; A495-R499 PolarHBondContact O-N 3.2Å; A495-L505 HydrophobicContact CB-CD1 3.65Å; A495-L505 HydrophobicContact CB-CD2 3.85Å; A495-L505 HydrophobicContact CB-CG 4.44Å
496	L	98.5	Very high	98.3	Very high	9 Å²	9	51 Å²	51	5%	0.047	26%	0.263	C	S	.	.	H	α-helix	trans	-62.3	-30.1	176.2	-75.7	169.2	0	0	0	112.7	F492 N493 V498 R499 P500 L505 W506 L509	F492-L496 WeakPolarHBondContact O-CB 3.46Å; F492-L496 WeakPolarHBondContact O-CG 3.36Å; F492-L496 PolarHBondContact O-N 2.89Å; N493-L496 PolarHBondContact O-N 3.3Å; L496-V498 PolarHBondContact O-N 2.9Å; L496-V498 VanDerWaalsContact O-N 3.17Å; L496-R499 CarbonylContact O-C 3.58Å; L496-R499 PolarHBondContact O-N 3.24Å; L496-P500 VanDerWaalsContact O-CA 3.29Å; L496-P500 WeakPolarHBondContact O-CA 3.44Å; L496-P500 WeakPolarHBondContact O-CD 3.37Å; L496-L505 HydrophobicContact CD2-CB 3.47Å; L496-L505 VanDerWaalsContact CD2-CB 3.47Å; L496-L505 HydrophobicContact CD2-CD1 4.2Å; L496-L505 HydrophobicContact CD2-CG 4.5Å; L496-L505 HydrophobicContact CG-CB 3.87Å; L496-L505 HydrophobicContact CG-CD1 4.39Å; L496-W506 HydrophobicContact CD1-CD2 3.93Å; L496-W506 HydrophobicContact CD1-CE3 4Å; L496-W506 HydrophobicContact CD1-CG 4.48Å; L496-W506 HydrophobicContact CD1-CH2 4.26Å; L496-W506 HydrophobicContact CD1-CZ2 4.2Å; L496-W506 HydrophobicContact CD1-CZ3 4.17Å; L496-W506 HydrophobicContact CD2-CD2 4.05Å; L496-W506 HydrophobicContact CD2-CG 4.01Å; L496-W506 HydrophobicContact CD2-CZ2 4.34Å; L496-L509 HydrophobicContact CD1-CB 4.37Å; L496-L509 HydrophobicContact CD1-CD2 3.69Å
497	S	97.9	Very high	98.3	Very high	91 Å²	91	47 Å²	47	64%	0.636	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-22.6	173.6	81.2	0	0	0	0	113.5	N493 T494 A495	N493-S497 PolarHBondContact O-N 3.29Å; T494-S497 PolarHBondContact O-N 2.71Å; T494-S497 PolarHBondContact O-OG 3.04Å; A495-S497 VanDerWaalsContact C-N 3.26Å; A495-S497 PolarHBondContact O-N 3.2Å
498	V	97.8	Very high	98.3	Very high	72 Å²	72	44.8 Å²	44.8	44%	0.436	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.7	-33	173.8	-174.9	0	0	0	0	111.7	V467 P469 A495 L496	V467-V498 HydrophobicContact CB-CG2 3.77Å; V467-V498 HydrophobicContact CG1-CG2 3.61Å; P469-V498 HydrophobicContact CB-CB 4.32Å; P469-V498 HydrophobicContact CG-CB 4.27Å; P469-V498 HydrophobicContact CG-CG1 4.04Å; A495-V498 PolarHBondContact O-N 3.49Å; L496-V498 PolarHBondContact O-N 2.9Å; L496-V498 VanDerWaalsContact O-N 3.17Å
499	R	98.1	Very high	98.3	Very high	81 Å²	81	45.2 Å²	45.2	31%	0.306	23%	0.233	S	C	.	.			trans	-127.4	74.1	-179.7	-59.7	-174.9	-176.8	149.1	4.5	112.2	P469 D470 A495 L496 E501 D502 L505	P469-R499 HydrophobicContact CB-CG 4.33Å; P469-R499 HydrophobicContact CG-CG 4.21Å; D470-R499 IonicContact OD1-CZ 2.75Å; D470-R499 VanDerWaalsContact OD1-CZ 3.24Å; D470-R499 IonicContact OD1-NH1 3.89Å; D470-R499 PolarHBondContact OD1-NH1 3.47Å; D470-R499 IonicContact OD1-NH2 2.75Å; D470-R499 PolarHBondContact OD1-NH2 2.97Å; D470-R499 IonicContact OD2-CZ 2.59Å; D470-R499 IonicContact OD2-NH2 3.88Å; D470-R499 PolarHBondContact OD2-NH2 2.93Å; A495-R499 PolarHBondContact O-N 3.2Å; L496-R499 CarbonylContact O-C 3.58Å; L496-R499 PolarHBondContact O-N 3.24Å; R499-E501 VanDerWaalsContact C-N 3.25Å; R499-E501 PolarHBondContact O-N 3.48Å; R499-D502 HydrophobicContact CB-CB 3.74Å; R499-D502 VanDerWaalsContact CD-OD2 3.3Å; R499-D502 WeakPolarHBondContact CD-OD2 3.3Å; R499-D502 IonicContact NH1-OD2 3.51Å; R499-D502 WeakPolarHBondContact O-CB 3.46Å; R499-D502 PolarHBondContact O-N 3.41Å; R499-L505 HydrophobicContact CB-CD1 4.12Å
500	P	98	Very high	98.3	Very high	72 Å²	72	44.6 Å²	44.6	47%	0.468	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-19.9	-173.8	25.7	-34.9	0	0	0	114.4	L496 W506	L496-P500 VanDerWaalsContact O-CA 3.29Å; L496-P500 WeakPolarHBondContact O-CA 3.44Å; L496-P500 WeakPolarHBondContact O-CD 3.37Å; P500-W506 PolarHBondContact O-NE1 3.32Å
501	E	97.9	Very high	98.2	Very high	116 Å²	116	39.7 Å²	39.7	54%	0.542	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.2	14.4	179.7	-51.3	-59.1	92	0	0	112.9	R499 Y503 R528 L532	R499-E501 VanDerWaalsContact C-N 3.25Å; R499-E501 PolarHBondContact O-N 3.48Å; E501-Y503 PolarHBondContact O-N 2.85Å; E501-R528 IonicContact OE1-CZ 3.78Å; E501-R528 IonicContact OE1-NH2 2.69Å; E501-R528 PolarHBondContact OE1-NH2 3Å; E501-R528 IonicContact OE2-NH2 3.08Å; E501-R528 PolarHBondContact OE2-NH2 3.04Å; E501-L532 HydrophobicContact CB-CD2 3.92Å; E501-L532 HydrophobicContact CG-CD2 4.41Å; E501-L532 WeakPolarHBondContact OE2-CD2 3.4Å
502	D	98.1	Very high	98.2	Very high	30 Å²	30	39.7 Å²	39.7	16%	0.16	21%	0.21	C	C	.	.			trans	-83.3	96.2	176.9	-176	-30.9	0	0	0	110.1	R499 L504 L505 W506	R499-D502 HydrophobicContact CB-CB 3.74Å; R499-D502 VanDerWaalsContact CD-OD2 3.3Å; R499-D502 WeakPolarHBondContact CD-OD2 3.3Å; R499-D502 IonicContact NH1-OD2 3.51Å; R499-D502 WeakPolarHBondContact O-CB 3.46Å; R499-D502 PolarHBondContact O-N 3.41Å; D502-L504 PolarHBondContact O-N 3.25Å; D502-L504 WeakPolarHBondContact OD1-CB 3.44Å; D502-L504 PolarHBondContact OD1-N 3.27Å; D502-L504 VanDerWaalsContact OD1-N 3.14Å; D502-L505 HydrophobicContact CB-CB 4.13Å; D502-L505 HydrophobicContact CB-CD1 3.92Å; D502-L505 HydrophobicContact CB-CG 4.1Å; D502-L505 WeakPolarHBondContact O-CB 3.26Å; D502-L505 PolarHBondContact O-N 3.36Å; D502-L505 VanDerWaalsContact O-N 3.12Å; D502-L505 PolarHBondContact OD1-N 3.33Å; D502-W506 VanDerWaalsContact O-CD1 3.29Å; D502-W506 PolarHBondContact O-N 2.91Å; D502-W506 VanDerWaalsContact O-N 3.12Å
503	Y	98.4	Very high	98.2	Very high	50 Å²	50	39.9 Å²	39.9	20%	0.196	21%	0.211	C	C	.	.	H	α-helix	trans	-61.4	-27.4	-178.5	65	-87.8	0	0	0	113.2	E360 E501 W506 N507 H533 F536	E360-Y503 PolarHBondContact OE2-OH 3.43Å; E501-Y503 PolarHBondContact O-N 2.85Å; Y503-W506 PolarHBondContact O-N 3.06Å; Y503-N507 PolarHBondContact O-N 2.88Å; Y503-H533 HydrophobicContact CD1-CB 3.98Å; Y503-H533 HydrophobicContact CD2-CB 3.7Å; Y503-H533 HydrophobicContact CE1-CB 4.38Å; Y503-H533 HydrophobicContact CE2-CB 4.11Å; Y503-H533 AromaticContact CE2-CD2 3.88Å; Y503-H533 AromaticContact CE2-CG 3.99Å; Y503-H533 HydrophobicContact CG-CB 3.64Å; Y503-F536 AromaticContact CD2-CD1 3.63Å; Y503-F536 HydrophobicContact CD2-CD1 3.63Å; Y503-F536 AromaticContact CD2-CE1 3.61Å; Y503-F536 HydrophobicContact CD2-CE1 3.61Å; Y503-F536 HydrophobicContact CD2-CG 4.23Å; Y503-F536 HydrophobicContact CD2-CZ 4.19Å; Y503-F536 HydrophobicContact CE2-CD1 4.34Å; Y503-F536 HydrophobicContact CE2-CE1 4.29Å; Y503-F536 HydrophobicContact CE2-CZ 4.46Å
504	L	98.2	Very high	97.9	Very high	43 Å²	43	36.9 Å²	36.9	23%	0.225	20%	0.196	C	C	.	.	H	α-helix	trans	-70.7	-37.5	176	-57.7	176	0	0	0	110.9	E360 D502 R508 F536	E360-L504 HydrophobicContact CG-CD2 3.87Å; D502-L504 PolarHBondContact O-N 3.25Å; D502-L504 WeakPolarHBondContact OD1-CB 3.44Å; D502-L504 PolarHBondContact OD1-N 3.27Å; D502-L504 VanDerWaalsContact OD1-N 3.14Å; L504-R508 VanDerWaalsContact O-CG 3.28Å; L504-R508 WeakPolarHBondContact O-CG 3.23Å; L504-R508 PolarHBondContact O-N 3.04Å; L504-F536 HydrophobicContact CD2-CE1 4.28Å; L504-F536 HydrophobicContact CD2-CE2 4.14Å; L504-F536 HydrophobicContact CD2-CZ 3.65Å
505	L	98.6	Very high	97.7	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-66	-41.5	171	-74.3	178.7	0	0	0	112.2	T473 F492 A495 L496 R499 D502 N507 R508 L509	T473-L505 HydrophobicContact CG2-CD2 4.49Å; T473-L505 WeakPolarHBondContact OG1-CD2 3.38Å; F492-L505 HydrophobicContact CD1-CD2 4.01Å; A495-L505 HydrophobicContact CB-CD1 3.65Å; A495-L505 HydrophobicContact CB-CD2 3.85Å; A495-L505 HydrophobicContact CB-CG 4.44Å; L496-L505 HydrophobicContact CD2-CB 3.47Å; L496-L505 VanDerWaalsContact CD2-CB 3.47Å; L496-L505 HydrophobicContact CD2-CD1 4.2Å; L496-L505 HydrophobicContact CD2-CG 4.5Å; L496-L505 HydrophobicContact CG-CB 3.87Å; L496-L505 HydrophobicContact CG-CD1 4.39Å; R499-L505 HydrophobicContact CB-CD1 4.12Å; D502-L505 HydrophobicContact CB-CB 4.13Å; D502-L505 HydrophobicContact CB-CD1 3.92Å; D502-L505 HydrophobicContact CB-CG 4.1Å; D502-L505 WeakPolarHBondContact O-CB 3.26Å; D502-L505 PolarHBondContact O-N 3.36Å; D502-L505 VanDerWaalsContact O-N 3.12Å; D502-L505 PolarHBondContact OD1-N 3.33Å; L505-N507 PolarHBondContact O-N 3.12Å; L505-R508 PolarHBondContact O-N 3.18Å; L505-L509 PolarHBondContact O-N 2.85Å
506	W	98.8	Very high	97.4	Very high	56 Å²	56	40 Å²	40	21%	0.212	22%	0.215	C	C	.	.	H	α-helix	trans	-60.6	-43.8	175.4	-78.3	108.1	0	0	0	112.7	L496 P500 D502 Y503 R508 L509 G510 A525 R528 A529 L532	L496-W506 HydrophobicContact CD1-CD2 3.93Å; L496-W506 HydrophobicContact CD1-CE3 4Å; L496-W506 HydrophobicContact CD1-CG 4.48Å; L496-W506 HydrophobicContact CD1-CH2 4.26Å; L496-W506 HydrophobicContact CD1-CZ2 4.2Å; L496-W506 HydrophobicContact CD1-CZ3 4.17Å; L496-W506 HydrophobicContact CD2-CD2 4.05Å; L496-W506 HydrophobicContact CD2-CG 4.01Å; L496-W506 HydrophobicContact CD2-CZ2 4.34Å; P500-W506 PolarHBondContact O-NE1 3.32Å; D502-W506 VanDerWaalsContact O-CD1 3.29Å; D502-W506 PolarHBondContact O-N 2.91Å; D502-W506 VanDerWaalsContact O-N 3.12Å; Y503-W506 PolarHBondContact O-N 3.06Å; W506-R508 PolarHBondContact O-N 3Å; W506-L509 HydrophobicContact CE3-CD2 3.98Å; W506-L509 HydrophobicContact CZ3-CD2 3.87Å; W506-L509 PolarHBondContact O-N 3.43Å; W506-G510 PolarHBondContact O-N 3.29Å; W506-A525 HydrophobicContact CE3-CB 4.19Å; W506-R528 HydrophobicContact CD2-CB 3.97Å; W506-R528 HydrophobicContact CD2-CG 3.55Å; W506-R528 VanDerWaalsContact CE2-CG 3.46Å; W506-R528 HydrophobicContact CE3-CB 4.03Å; W506-R528 HydrophobicContact CE3-CG 4.01Å; W506-R528 HydrophobicContact CG-CB 4.32Å; W506-R528 HydrophobicContact CG-CG 3.93Å; W506-R528 HydrophobicContact CH2-CG 4.3Å; W506-R528 HydrophobicContact CZ2-CG 3.87Å; W506-R528 HydrophobicContact CZ3-CB 4.47Å; W506-R528 HydrophobicContact CZ3-CG 4.35Å; W506-A529 HydrophobicContact CB-CB 3.77Å; W506-L532 VanDerWaalsContact CD1-CD1 3.43Å; W506-L532 HydrophobicContact CG-CD1 4.4Å
507	N	98.6	Very high	97.1	Very high	16 Å²	16	46.8 Å²	46.8	9%	0.086	25%	0.251	C	S	.	.	H	α-helix	trans	-66.8	-34.4	174.2	170.7	82.7	0	0	0	113.1	Y503 L505 G510 A511 A529 F536 S539 N542	Y503-N507 PolarHBondContact O-N 2.88Å; L505-N507 PolarHBondContact O-N 3.12Å; N507-G510 PolarHBondContact O-N 3.22Å; N507-A511 WeakPolarHBondContact O-CB 3.04Å; N507-A511 PolarHBondContact O-N 3.46Å; N507-A529 HydrophobicContact CB-CB 4.28Å; N507-F536 HydrophobicContact CB-CD1 4.37Å; N507-F536 HydrophobicContact CB-CE1 3.35Å; N507-F536 HydrophobicContact CB-CZ 3.73Å; N507-S539 WeakPolarHBondContact OD1-CA 3.38Å; N507-N542 PolarHBondContact OD1-ND2 3.5Å
508	R	98.5	Very high	97	Very high	43 Å²	43	46 Å²	46	16%	0.162	23%	0.234	C	C	.	.	H	α-helix	trans	-67.8	-37.7	173.6	-73.4	175.8	-166.5	110.3	1.4	112.3	F492 L504 L505 W506 T512	F492-R508 HydrophobicContact CD1-CB 4.01Å; F492-R508 HydrophobicContact CD2-CB 4.39Å; F492-R508 HydrophobicContact CE1-CB 3.75Å; F492-R508 HydrophobicContact CE1-CG 4.3Å; F492-R508 HydrophobicContact CE2-CB 4.15Å; F492-R508 HydrophobicContact CG-CB 4.34Å; F492-R508 HydrophobicContact CZ-CB 3.82Å; F492-R508 HydrophobicContact CZ-CG 4.4Å; L504-R508 VanDerWaalsContact O-CG 3.28Å; L504-R508 WeakPolarHBondContact O-CG 3.23Å; L504-R508 PolarHBondContact O-N 3.04Å; L505-R508 PolarHBondContact O-N 3.18Å; W506-R508 PolarHBondContact O-N 3Å; R508-T512 WeakPolarHBondContact O-CB 3.37Å; R508-T512 PolarHBondContact O-N 3.49Å; R508-T512 PolarHBondContact O-OG1 3.16Å
509	L	98.8	Very high	96.8	Very high	8 Å²	8	42.9 Å²	42.9	4%	0.042	22%	0.216	C	C	.	.	H	α-helix	trans	-61.9	-49.3	171.5	174.5	61	0	0	0	110.5	V489 F492 L496 L505 W506 A511 T512 L513 A525	V489-L509 HydrophobicContact CB-CD1 4.26Å; V489-L509 HydrophobicContact CG1-CD1 3.92Å; V489-L509 HydrophobicContact CG2-CD1 4.12Å; F492-L509 HydrophobicContact CB-CB 4.22Å; F492-L509 HydrophobicContact CB-CD1 4.47Å; L496-L509 HydrophobicContact CD1-CB 4.37Å; L496-L509 HydrophobicContact CD1-CD2 3.69Å; L505-L509 PolarHBondContact O-N 2.85Å; W506-L509 HydrophobicContact CE3-CD2 3.98Å; W506-L509 HydrophobicContact CZ3-CD2 3.87Å; W506-L509 PolarHBondContact O-N 3.43Å; L509-A511 PolarHBondContact O-N 3.28Å; L509-T512 WeakPolarHBondContact O-CB 3.45Å; L509-T512 PolarHBondContact O-N 3.3Å; L509-L513 HydrophobicContact CD1-CD1 3.88Å; L509-L513 HydrophobicContact CD1-CG 4.16Å; L509-L513 HydrophobicContact CG-CD1 3.83Å; L509-L513 WeakPolarHBondContact O-CG 3.46Å; L509-L513 PolarHBondContact O-N 2.89Å; L509-A525 HydrophobicContact CD2-CB 4.33Å; L509-A525 HydrophobicContact CG-CB 4.19Å
510	G	98.4	Very high	96.7	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-57	-46.8	175.9	0	0	0	0	0	113	W506 N507 T512 L513 A514 A522 Y526	W506-G510 PolarHBondContact O-N 3.29Å; N507-G510 PolarHBondContact O-N 3.22Å; G510-T512 VanDerWaalsContact C-N 3.31Å; G510-T512 PolarHBondContact O-N 3.46Å; G510-L513 PolarHBondContact O-N 3.21Å; G510-A514 WeakPolarHBondContact O-CB 3.41Å; G510-A514 PolarHBondContact O-N 3.44Å; G510-A522 WeakPolarHBondContact O-CB 3.11Å; G510-Y526 PolarHBondContact O-OH 2.85Å
511	A	96.6	Very high	96.7	Very high	23 Å²	23	47 Å²	47	19%	0.19	23%	0.232	C	C	.	.	H	α-helix	trans	-60.9	-40.8	176.8	0	0	0	0	0	112.1	N507 L509 A514 N515 Y526	N507-A511 WeakPolarHBondContact O-CB 3.04Å; N507-A511 PolarHBondContact O-N 3.46Å; L509-A511 PolarHBondContact O-N 3.28Å; A511-A514 PolarHBondContact O-N 3.4Å; A511-N515 VanDerWaalsContact O-CB 3.3Å; A511-N515 WeakPolarHBondContact O-CB 3.23Å; A511-N515 PolarHBondContact O-N 3.33Å; A511-N515 PolarHBondContact O-ND2 2.93Å; A511-N515 PolarHBondContact O-OD1 3.01Å; A511-Y526 WeakPolarHBondContact CA-OH 3.23Å; A511-Y526 PolarHBondContact N-OH 2.91Å; A511-Y526 VanDerWaalsContact N-OH 3.1Å
512	T	97.9	Very high	96.6	Very high	2 Å²	2	41.4 Å²	41.4	1%	0.012	21%	0.207	C	C	.	.	H	α-helix	trans	-66.2	-39.5	176.6	-55.3	0	0	0	0	112.3	N480 F485 A488 V489 F492 R508 L509 G510 G516	N480-T512 PolarHBondContact ND2-OG1 3.39Å; F485-T512 HydrophobicContact CB-CG2 4.31Å; F485-T512 HydrophobicContact CD1-CG2 4.42Å; F485-T512 WeakPolarHBondContact O-CG2 3.37Å; A488-T512 HydrophobicContact CB-CG2 3.35Å; V489-T512 HydrophobicContact CG2-CG2 3.61Å; F492-T512 WeakPolarHBondContact CD2-OG1 3.47Å; F492-T512 WeakPolarHBondContact CE2-OG1 3.5Å; R508-T512 WeakPolarHBondContact O-CB 3.37Å; R508-T512 PolarHBondContact O-N 3.49Å; R508-T512 PolarHBondContact O-OG1 3.16Å; L509-T512 WeakPolarHBondContact O-CB 3.45Å; L509-T512 PolarHBondContact O-N 3.3Å; G510-T512 VanDerWaalsContact C-N 3.31Å; G510-T512 PolarHBondContact O-N 3.46Å; T512-G516 PolarHBondContact O-N 3.26Å; T512-G516 VanDerWaalsContact O-N 3.11Å
513	L	98.1	Very high	96.6	Very high	7 Å²	7	41.9 Å²	41.9	4%	0.037	21%	0.21	C	C	.	.	H	α-helix	trans	-66.9	-46.4	176.7	-73.1	163	0	0	0	110.9	V489 L509 G510 N515 G516 D517 R518 E521 A522 A525	V489-L513 HydrophobicContact CG1-CD2 4.41Å; V489-L513 HydrophobicContact CG2-CD2 3.77Å; V489-L513 HydrophobicContact CG2-CG 4Å; L509-L513 HydrophobicContact CD1-CD1 3.88Å; L509-L513 HydrophobicContact CD1-CG 4.16Å; L509-L513 HydrophobicContact CG-CD1 3.83Å; L509-L513 WeakPolarHBondContact O-CG 3.46Å; L509-L513 PolarHBondContact O-N 2.89Å; G510-L513 PolarHBondContact O-N 3.21Å; L513-N515 PolarHBondContact O-N 3.36Å; L513-G516 CarbonylContact O-C 3.44Å; L513-G516 PolarHBondContact O-N 2.87Å; L513-G516 VanDerWaalsContact O-N 3.16Å; L513-D517 PolarHBondContact O-N 2.89Å; L513-R518 HydrophobicContact CB-CB 4.32Å; L513-R518 HydrophobicContact CD2-CB 4.05Å; L513-R518 VanDerWaalsContact CD2-CZ 3.47Å; L513-R518 CarbonylContact O-C 3.56Å; L513-R518 WeakPolarHBondContact O-CA 3.23Å; L513-R518 WeakPolarHBondContact O-CB 3.36Å; L513-R518 PolarHBondContact O-N 3.49Å; L513-E521 HydrophobicContact CD1-CB 3.92Å; L513-E521 HydrophobicContact CD2-CB 4.04Å; L513-E521 HydrophobicContact CG-CB 4.45Å; L513-A522 HydrophobicContact CB-CB 3.85Å; L513-A525 HydrophobicContact CD1-CB 4.29Å
514	A	93.6	Very high	96.6	Very high	10 Å²	10	46.6 Å²	46.6	8%	0.083	23%	0.234	C	C	.	.	H	α-helix	trans	-61.8	-43.1	177.4	0	0	0	0	0	112.5	G510 A511 G516 D517 A522 S546	G510-A514 WeakPolarHBondContact O-CB 3.41Å; G510-A514 PolarHBondContact O-N 3.44Å; A511-A514 PolarHBondContact O-N 3.4Å; A514-G516 PolarHBondContact O-N 3.46Å; A514-D517 PolarHBondContact O-N 3.46Å; A514-A522 HydrophobicContact CB-CB 3.91Å; A514-S546 WeakPolarHBondContact CB-OG 3.42Å
515	N	92.2	Very high	96.6	Very high	94 Å²	94	44.7 Å²	44.7	50%	0.503	23%	0.225	S	C	.	.	H	α-helix	trans	-68.3	-22.3	176.2	-68.2	-16.3	0	0	0	113.3	F485 A511 L513	F485-N515 HydrophobicContact CD1-CB 4Å; F485-N515 HydrophobicContact CE1-CB 3.56Å; F485-N515 VanDerWaalsContact CE2-O 3.23Å; F485-N515 WeakPolarHBondContact CE2-O 3.39Å; F485-N515 HydrophobicContact CZ-CB 3.97Å; F485-N515 WeakPolarHBondContact CZ-O 3.29Å; A511-N515 VanDerWaalsContact O-CB 3.3Å; A511-N515 WeakPolarHBondContact O-CB 3.23Å; A511-N515 PolarHBondContact O-N 3.33Å; A511-N515 PolarHBondContact O-ND2 2.93Å; A511-N515 PolarHBondContact O-OD1 3.01Å; L513-N515 PolarHBondContact O-N 3.36Å
516	G	92.7	Very high	96.6	Very high	17 Å²	17	45 Å²	45	18%	0.175	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.8	31.6	174.5	0	0	0	0	0	113.3	T512 L513 A514 R518	T512-G516 PolarHBondContact O-N 3.26Å; T512-G516 VanDerWaalsContact O-N 3.11Å; L513-G516 CarbonylContact O-C 3.44Å; L513-G516 PolarHBondContact O-N 2.87Å; L513-G516 VanDerWaalsContact O-N 3.16Å; A514-G516 PolarHBondContact O-N 3.46Å; G516-R518 WeakPolarHBondContact O-CG 3.37Å; G516-R518 PolarHBondContact O-N 3.03Å
517	D	92.3	Very high	96.6	Very high	151 Å²	151	45.3 Å²	45.3	81%	0.807	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.5	6.5	178.3	-57	-50.9	0	0	0	116.5	L513 A514 S519	L513-D517 PolarHBondContact O-N 2.89Å; A514-D517 PolarHBondContact O-N 3.46Å; D517-S519 VanDerWaalsContact C-N 3.31Å; D517-S519 PolarHBondContact O-N 3.05Å
518	R	95.5	Very high	96.6	Very high	74 Å²	74	47.8 Å²	47.8	28%	0.279	24%	0.242	S	C	.	.			trans	-94.1	54.5	-177.7	-67.6	161.7	65.4	-171.2	-4.3	111.2	N486 L513 G516 E520 E521 A522	N486-R518 PolarHBondContact OD1-NH1 3.27Å; L513-R518 HydrophobicContact CB-CB 4.32Å; L513-R518 HydrophobicContact CD2-CB 4.05Å; L513-R518 VanDerWaalsContact CD2-CZ 3.47Å; L513-R518 CarbonylContact O-C 3.56Å; L513-R518 WeakPolarHBondContact O-CA 3.23Å; L513-R518 WeakPolarHBondContact O-CB 3.36Å; L513-R518 PolarHBondContact O-N 3.49Å; G516-R518 WeakPolarHBondContact O-CG 3.37Å; G516-R518 PolarHBondContact O-N 3.03Å; R518-E520 VanDerWaalsContact C-N 3.29Å; R518-E520 PolarHBondContact O-N 2.85Å; R518-E521 IonicContact CZ-OE1 2.77Å; R518-E521 VanDerWaalsContact CZ-OE1 3.24Å; R518-E521 IonicContact CZ-OE2 3.21Å; R518-E521 IonicContact NE-OE1 2.77Å; R518-E521 PolarHBondContact NE-OE1 3.39Å; R518-E521 IonicContact NE-OE2 2.72Å; R518-E521 IonicContact NH2-OE1 2.69Å; R518-E521 PolarHBondContact NH2-OE1 2.96Å; R518-E521 IonicContact NH2-OE2 2.86Å; R518-E521 PolarHBondContact NH2-OE2 3.48Å; R518-E521 PolarHBondContact O-N 2.93Å; R518-A522 PolarHBondContact O-N 3.42Å; R518-A522 VanDerWaalsContact O-N 3.1Å
519	S	94.1	Very high	96.6	Very high	8 Å²	8	45.7 Å²	45.7	6%	0.056	23%	0.234	C	C	.	.	H	α-helix	trans	-65.8	-25.5	-172.1	-67.9	0	0	0	0	114.2	D517 A522 V523 N549	D517-S519 VanDerWaalsContact C-N 3.31Å; D517-S519 PolarHBondContact O-N 3.05Å; S519-A522 WeakPolarHBondContact O-CB 3.38Å; S519-A522 PolarHBondContact O-N 3.03Å; S519-V523 WeakPolarHBondContact O-CG2 3.29Å; S519-V523 PolarHBondContact O-N 3.44Å; S519-N549 WeakPolarHBondContact OG-CB 3.16Å; S519-N549 PolarHBondContact OG-ND2 3.49Å; S519-N549 VanDerWaalsContact OG-ND2 3.12Å
520	E	95.2	Very high	96.6	Very high	152 Å²	152	46.4 Å²	46.4	71%	0.71	24%	0.238	S	C	*	.	H	α-helix	trans	-64.9	-49.5	173.6	-62.5	-172.8	156.1	0	0	111.8	R518 A522 V523 L550	R518-E520 VanDerWaalsContact C-N 3.29Å; R518-E520 PolarHBondContact O-N 2.85Å; E520-A522 VanDerWaalsContact C-N 3.26Å; E520-A522 PolarHBondContact O-N 2.71Å; E520-V523 WeakPolarHBondContact O-CB 3.47Å; E520-V523 PolarHBondContact O-N 3.38Å; E520-L550 HydrophobicContact CG-CD1 4.41Å; E520-L550 HydrophobicContact CG-CD2 3.64Å
521	E	97.6	Very high	96.5	Very high	86 Å²	86	52.2 Å²	52.2	40%	0.402	27%	0.265	S	S	.	.	H	α-helix	trans	-67.1	-29.5	176.7	-64.1	176.8	-94	0	0	111.8	L513 R518 V523 E524 A525	L513-E521 HydrophobicContact CD1-CB 3.92Å; L513-E521 HydrophobicContact CD2-CB 4.04Å; L513-E521 HydrophobicContact CG-CB 4.45Å; R518-E521 IonicContact CZ-OE1 2.77Å; R518-E521 VanDerWaalsContact CZ-OE1 3.24Å; R518-E521 IonicContact CZ-OE2 3.21Å; R518-E521 IonicContact NE-OE1 2.77Å; R518-E521 PolarHBondContact NE-OE1 3.39Å; R518-E521 IonicContact NE-OE2 2.72Å; R518-E521 IonicContact NH2-OE1 2.69Å; R518-E521 PolarHBondContact NH2-OE1 2.96Å; R518-E521 IonicContact NH2-OE2 2.86Å; R518-E521 PolarHBondContact NH2-OE2 3.48Å; R518-E521 PolarHBondContact O-N 2.93Å; E521-V523 VanDerWaalsContact C-N 3.33Å; E521-V523 PolarHBondContact O-N 2.82Å; E521-E524 PolarHBondContact O-N 3.15Å; E521-A525 PolarHBondContact O-N 2.93Å
522	A	97.7	Very high	96.6	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-62.3	-39.7	173.6	0	0	0	0	0	112	G510 L513 A514 R518 S519 E520 E524 A525 Y526	G510-A522 WeakPolarHBondContact O-CB 3.11Å; L513-A522 HydrophobicContact CB-CB 3.85Å; A514-A522 HydrophobicContact CB-CB 3.91Å; R518-A522 PolarHBondContact O-N 3.42Å; R518-A522 VanDerWaalsContact O-N 3.1Å; S519-A522 WeakPolarHBondContact O-CB 3.38Å; S519-A522 PolarHBondContact O-N 3.03Å; E520-A522 VanDerWaalsContact C-N 3.26Å; E520-A522 PolarHBondContact O-N 2.71Å; A522-E524 VanDerWaalsContact C-N 3.32Å; A522-E524 PolarHBondContact O-N 3.22Å; A522-A525 PolarHBondContact O-N 3.16Å; A522-Y526 HydrophobicContact CB-CD2 4.35Å; A522-Y526 HydrophobicContact CB-CE2 3.84Å; A522-Y526 WeakPolarHBondContact O-CD2 3.46Å; A522-Y526 PolarHBondContact O-N 3.19Å
523	V	98.1	Very high	96.5	Very high	40 Å²	40	53.6 Å²	53.6	24%	0.242	27%	0.268	C	S	.	.	H	α-helix	trans	-58.8	-42	175.6	169.2	0	0	0	0	111.3	S519 E520 E521 T527 L543 L550	S519-V523 WeakPolarHBondContact O-CG2 3.29Å; S519-V523 PolarHBondContact O-N 3.44Å; E520-V523 WeakPolarHBondContact O-CB 3.47Å; E520-V523 PolarHBondContact O-N 3.38Å; E521-V523 VanDerWaalsContact C-N 3.33Å; E521-V523 PolarHBondContact O-N 2.82Å; V523-T527 VanDerWaalsContact O-CB 3.27Å; V523-T527 WeakPolarHBondContact O-CB 3.44Å; V523-T527 PolarHBondContact O-N 2.89Å; V523-T527 PolarHBondContact O-OG1 2.93Å; V523-L543 HydrophobicContact CB-CD1 4.11Å; V523-L543 HydrophobicContact CG1-CD1 3.93Å; V523-L543 HydrophobicContact CG2-CD1 3.83Å; V523-L550 HydrophobicContact CG2-CD1 3.88Å
524	E	98	Very high	96.4	Very high	149 Å²	149	57.1 Å²	57.1	70%	0.696	29%	0.292	S	S	*	.	H	α-helix	trans	-61.9	-46.6	175.4	-61.5	-165.6	163.8	0	0	111.5	E521 A522 T527 R528	E521-E524 PolarHBondContact O-N 3.15Å; A522-E524 VanDerWaalsContact C-N 3.32Å; A522-E524 PolarHBondContact O-N 3.22Å; E524-T527 PolarHBondContact O-N 3.2Å; E524-R528 PolarHBondContact O-N 2.86Å
525	A	98.4	Very high	96.4	Very high	3 Å²	3	56.8 Å²	56.8	3%	0.025	29%	0.29	C	S	.	.	H	α-helix	trans	-65	-41.9	-178.9	0	0	0	0	0	112.9	W506 L509 L513 E521 A522 R528 A529	W506-A525 HydrophobicContact CE3-CB 4.19Å; L509-A525 HydrophobicContact CD2-CB 4.33Å; L509-A525 HydrophobicContact CG-CB 4.19Å; L513-A525 HydrophobicContact CD1-CB 4.29Å; E521-A525 PolarHBondContact O-N 2.93Å; A522-A525 PolarHBondContact O-N 3.16Å; A525-R528 PolarHBondContact O-N 3Å; A525-A529 PolarHBondContact O-N 3.02Å
526	Y	98.6	Very high	96.6	Very high	6 Å²	6	52.5 Å²	52.5	2%	0.024	27%	0.266	C	S	.	.	H	α-helix	trans	-68.8	-37.4	173.4	-60	-52	0	0	0	112.4	G510 A511 A522 R528 A529 L530 N542 L543	G510-Y526 PolarHBondContact O-OH 2.85Å; A511-Y526 WeakPolarHBondContact CA-OH 3.23Å; A511-Y526 PolarHBondContact N-OH 2.91Å; A511-Y526 VanDerWaalsContact N-OH 3.1Å; A522-Y526 HydrophobicContact CB-CD2 4.35Å; A522-Y526 HydrophobicContact CB-CE2 3.84Å; A522-Y526 WeakPolarHBondContact O-CD2 3.46Å; A522-Y526 PolarHBondContact O-N 3.19Å; Y526-R528 VanDerWaalsContact C-N 3.29Å; Y526-R528 PolarHBondContact O-N 3.13Å; Y526-A529 WeakPolarHBondContact O-CB 3.4Å; Y526-A529 PolarHBondContact O-N 3.41Å; Y526-L530 WeakPolarHBondContact O-CB 3.28Å; Y526-L530 VanDerWaalsContact O-CG 3.28Å; Y526-L530 WeakPolarHBondContact O-CG 3.46Å; Y526-L530 PolarHBondContact O-N 3.4Å; Y526-N542 HydrophobicContact CD1-CB 4.08Å; Y526-N542 HydrophobicContact CE1-CB 3.46Å; Y526-N542 VanDerWaalsContact CE1-CB 3.46Å; Y526-N542 HydrophobicContact CE2-CB 4.13Å; Y526-N542 VanDerWaalsContact CZ-CB 3.49Å; Y526-L543 HydrophobicContact CD2-CB 4.07Å; Y526-L543 HydrophobicContact CD2-CD1 4.28Å; Y526-L543 HydrophobicContact CG-CB 4.23Å
527	T	98.1	Very high	96.8	Very high	62 Å²	62	51.7 Å²	51.7	38%	0.38	26%	0.258	S	S	.	.	H	α-helix	trans	-59	-45.3	174.8	-60.2	0	0	0	0	109.7	V523 E524 A529 L530 E531	V523-T527 VanDerWaalsContact O-CB 3.27Å; V523-T527 WeakPolarHBondContact O-CB 3.44Å; V523-T527 PolarHBondContact O-N 2.89Å; V523-T527 PolarHBondContact O-OG1 2.93Å; E524-T527 PolarHBondContact O-N 3.2Å; T527-A529 PolarHBondContact O-N 3.29Å; T527-L530 CarbonylContact O-C 3.44Å; T527-L530 PolarHBondContact O-N 2.97Å; T527-L530 VanDerWaalsContact O-N 3.13Å; T527-E531 WeakPolarHBondContact O-CG 3.47Å; T527-E531 PolarHBondContact O-N 3.17Å
528	R	98.4	Very high	97	Very high	68 Å²	68	45.6 Å²	45.6	26%	0.257	22%	0.224	S	C	.	.	H	α-helix	trans	-63.8	-38.1	175.3	-174.8	55.6	-177.4	158.2	6.9	113.1	E501 W506 E524 A525 Y526 L530 E531 L532	E501-R528 IonicContact OE1-CZ 3.78Å; E501-R528 IonicContact OE1-NH2 2.69Å; E501-R528 PolarHBondContact OE1-NH2 3Å; E501-R528 IonicContact OE2-NH2 3.08Å; E501-R528 PolarHBondContact OE2-NH2 3.04Å; W506-R528 HydrophobicContact CD2-CB 3.97Å; W506-R528 HydrophobicContact CD2-CG 3.55Å; W506-R528 VanDerWaalsContact CE2-CG 3.46Å; W506-R528 HydrophobicContact CE3-CB 4.03Å; W506-R528 HydrophobicContact CE3-CG 4.01Å; W506-R528 HydrophobicContact CG-CB 4.32Å; W506-R528 HydrophobicContact CG-CG 3.93Å; W506-R528 HydrophobicContact CH2-CG 4.3Å; W506-R528 HydrophobicContact CZ2-CG 3.87Å; W506-R528 HydrophobicContact CZ3-CB 4.47Å; W506-R528 HydrophobicContact CZ3-CG 4.35Å; E524-R528 PolarHBondContact O-N 2.86Å; A525-R528 PolarHBondContact O-N 3Å; Y526-R528 VanDerWaalsContact C-N 3.29Å; Y526-R528 PolarHBondContact O-N 3.13Å; R528-L530 VanDerWaalsContact C-N 3.29Å; R528-L530 PolarHBondContact O-N 3.04Å; R528-E531 WeakPolarHBondContact CD-OE2 3.22Å; R528-E531 IonicContact CZ-OE2 2.67Å; R528-E531 IonicContact NE-OE2 2.62Å; R528-E531 IonicContact NH1-OE2 2.94Å; R528-E531 PolarHBondContact NH1-OE2 3.33Å; R528-L532 HydrophobicContact CG-CD1 4.35Å; R528-L532 WeakPolarHBondContact O-CD1 3.4Å; R528-L532 VanDerWaalsContact O-CG 3.3Å; R528-L532 WeakPolarHBondContact O-CG 3.39Å; R528-L532 PolarHBondContact O-N 3.07Å
529	A	98.5	Very high	97.1	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-62.3	-36.5	172.8	0	0	0	0	0	112.5	W506 N507 A525 Y526 T527 H533 F536	W506-A529 HydrophobicContact CB-CB 3.77Å; N507-A529 HydrophobicContact CB-CB 4.28Å; A525-A529 PolarHBondContact O-N 3.02Å; Y526-A529 WeakPolarHBondContact O-CB 3.4Å; Y526-A529 PolarHBondContact O-N 3.41Å; T527-A529 PolarHBondContact O-N 3.29Å; A529-H533 PolarHBondContact O-N 3.28Å; A529-F536 HydrophobicContact CB-CD1 4.2Å; A529-F536 HydrophobicContact CB-CE1 4.36Å
530	L	97.9	Very high	97.3	Very high	22 Å²	22	43.2 Å²	43.2	12%	0.115	21%	0.214	C	C	.	.	H	α-helix	trans	-81.7	-27.1	-179.6	-68.4	168	0	0	0	113.8	Y526 T527 R528 H533 P534 F536 R540 L543	Y526-L530 WeakPolarHBondContact O-CB 3.28Å; Y526-L530 VanDerWaalsContact O-CG 3.28Å; Y526-L530 WeakPolarHBondContact O-CG 3.46Å; Y526-L530 PolarHBondContact O-N 3.4Å; T527-L530 CarbonylContact O-C 3.44Å; T527-L530 PolarHBondContact O-N 2.97Å; T527-L530 VanDerWaalsContact O-N 3.13Å; R528-L530 VanDerWaalsContact C-N 3.29Å; R528-L530 PolarHBondContact O-N 3.04Å; L530-H533 CarbonylContact O-C 3.36Å; L530-P534 WeakPolarHBondContact O-CA 3.42Å; L530-P534 WeakPolarHBondContact O-CD 3.49Å; L530-P534 WeakPolarHBondContact O-CG 3.32Å; L530-F536 HydrophobicContact CD2-CB 4.04Å; L530-F536 WeakPolarHBondContact CD2-O 3.5Å; L530-R540 HydrophobicContact CD1-CG 3.86Å; L530-R540 HydrophobicContact CD2-CG 3.58Å; L530-R540 HydrophobicContact CG-CG 4.41Å; L530-L543 HydrophobicContact CD1-CD2 3.73Å
531	E	97.8	Very high	97.4	Very high	122 Å²	122	38 Å²	38	57%	0.57	19%	0.188	S	C	*	.	H	α-helix	trans	-61.4	-45.3	165.3	-74.5	-178.3	164.6	0	0	111.3	T527 R528	T527-E531 WeakPolarHBondContact O-CG 3.47Å; T527-E531 PolarHBondContact O-N 3.17Å; R528-E531 WeakPolarHBondContact CD-OE2 3.22Å; R528-E531 IonicContact CZ-OE2 2.67Å; R528-E531 IonicContact NE-OE2 2.62Å; R528-E531 IonicContact NH1-OE2 2.94Å; R528-E531 PolarHBondContact NH1-OE2 3.33Å
532	L	97.4	Very high	97.4	Very high	43 Å²	43	35.1 Å²	35.1	23%	0.225	18%	0.175	C	C	.	.	H	α-helix	trans	-72.6	-40.1	-179.1	-71.7	168.6	0	0	0	112.2	E501 W506 R528	E501-L532 HydrophobicContact CB-CD2 3.92Å; E501-L532 HydrophobicContact CG-CD2 4.41Å; E501-L532 WeakPolarHBondContact OE2-CD2 3.4Å; W506-L532 VanDerWaalsContact CD1-CD1 3.43Å; W506-L532 HydrophobicContact CG-CD1 4.4Å; R528-L532 HydrophobicContact CG-CD1 4.35Å; R528-L532 WeakPolarHBondContact O-CD1 3.4Å; R528-L532 VanDerWaalsContact O-CG 3.3Å; R528-L532 WeakPolarHBondContact O-CG 3.39Å; R528-L532 PolarHBondContact O-N 3.07Å
533	H	96.6	Very high	97.4	Very high	11 Å²	11	35.8 Å²	35.8	5%	0.051	18%	0.179	C	C	.	.			trans	-136.1	85.3	-179.7	-161.6	62.6	0	0	0	112.1	S325 G328 Y503 A529 L530 G535 F536	S325-H533 PolarHBondContact O-CE1 3.37Å; S325-H533 VanDerWaalsContact O-CE1 3.24Å; G328-H533 WeakPolarHBondContact CA-CE1 3.36Å; G328-H533 WeakPolarHBondContact CA-NE2 3.22Å; Y503-H533 HydrophobicContact CD1-CB 3.98Å; Y503-H533 HydrophobicContact CD2-CB 3.7Å; Y503-H533 HydrophobicContact CE1-CB 4.38Å; Y503-H533 HydrophobicContact CE2-CB 4.11Å; Y503-H533 AromaticContact CE2-CD2 3.88Å; Y503-H533 AromaticContact CE2-CG 3.99Å; Y503-H533 HydrophobicContact CG-CB 3.64Å; A529-H533 PolarHBondContact O-N 3.28Å; L530-H533 CarbonylContact O-C 3.36Å; H533-G535 PolarHBondContact O-N 3.28Å; H533-F536 HydrophobicContact CB-CB 4.38Å; H533-F536 VanDerWaalsContact O-CB 3.3Å; H533-F536 WeakPolarHBondContact O-CB 3.03Å; H533-F536 PolarHBondContact O-N 2.95Å
534	P	95.1	Very high	97.3	Very high	81 Å²	81	33.9 Å²	33.9	53%	0.526	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-8.1	177.2	-25.5	35	0	0	0	115	L530 R540	L530-P534 WeakPolarHBondContact O-CA 3.42Å; L530-P534 WeakPolarHBondContact O-CD 3.49Å; L530-P534 WeakPolarHBondContact O-CG 3.32Å; P534-R540 PolarHBondContact O-NH1 2.87Å; P534-R540 PolarHBondContact O-NH2 3.43Å
535	G	94.3	Very high	97.2	Very high	4 Å²	4	29.2 Å²	29.2	4%	0.041	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-14.3	170.7	0	0	0	0	0	115.5	G328 L330 H533 I537	G328-G535 WeakPolarHBondContact O-CA 3.48Å; L330-G535 WeakPolarHBondContact CD1-O 3.26Å; H533-G535 PolarHBondContact O-N 3.28Å; G535-I537 PolarHBondContact O-N 3.19Å
536	F	96.7	Very high	97	Very high	3 Å²	3	29 Å²	29	1%	0.013	15%	0.145	C	C	.	.			trans	-71.5	94.1	-162.2	-156.3	-177.4	0	0	0	113.1	E360 Y503 L504 N507 A529 L530 H533 R538 S539 R540	E360-F536 HydrophobicContact CB-CD2 4.09Å; E360-F536 HydrophobicContact CB-CE2 3.9Å; E360-F536 HydrophobicContact CG-CD2 4.39Å; E360-F536 HydrophobicContact CG-CE2 3.81Å; Y503-F536 AromaticContact CD2-CD1 3.63Å; Y503-F536 HydrophobicContact CD2-CD1 3.63Å; Y503-F536 AromaticContact CD2-CE1 3.61Å; Y503-F536 HydrophobicContact CD2-CE1 3.61Å; Y503-F536 HydrophobicContact CD2-CG 4.23Å; Y503-F536 HydrophobicContact CD2-CZ 4.19Å; Y503-F536 HydrophobicContact CE2-CD1 4.34Å; Y503-F536 HydrophobicContact CE2-CE1 4.29Å; Y503-F536 HydrophobicContact CE2-CZ 4.46Å; L504-F536 HydrophobicContact CD2-CE1 4.28Å; L504-F536 HydrophobicContact CD2-CE2 4.14Å; L504-F536 HydrophobicContact CD2-CZ 3.65Å; N507-F536 HydrophobicContact CB-CD1 4.37Å; N507-F536 HydrophobicContact CB-CE1 3.35Å; N507-F536 HydrophobicContact CB-CZ 3.73Å; A529-F536 HydrophobicContact CB-CD1 4.2Å; A529-F536 HydrophobicContact CB-CE1 4.36Å; L530-F536 HydrophobicContact CD2-CB 4.04Å; L530-F536 WeakPolarHBondContact CD2-O 3.5Å; H533-F536 HydrophobicContact CB-CB 4.38Å; H533-F536 VanDerWaalsContact O-CB 3.3Å; H533-F536 WeakPolarHBondContact O-CB 3.03Å; H533-F536 PolarHBondContact O-N 2.95Å; F536-R538 HydrophobicContact CD2-CB 3.9Å; F536-R538 HydrophobicContact CE2-CB 3.61Å; F536-R538 HydrophobicContact CE2-CG 4.12Å; F536-R538 HydrophobicContact CZ-CB 4.42Å; F536-S539 PolarHBondContact O-N 3.23Å; F536-R540 PolarHBondContact O-N 3.07Å
537	I	96.6	Very high	96.8	Very high	1 Å²	1	29.3 Å²	29.3	1%	0.005	15%	0.148	C	C	.	.	H	α-helix	trans	-65.6	-46.5	-177.2	-74.6	156.4	0	0	0	110.8	L330 P331 E360 N361 E362 G535 S539 R540 Y541 A563 L566 Q567 I584	L330-I537 HydrophobicContact CB-CD1 4.36Å; L330-I537 HydrophobicContact CD1-CD1 4.37Å; P331-I537 HydrophobicContact CG-CD1 4.22Å; E360-I537 PolarHBondContact O-N 3Å; N361-I537 VanDerWaalsContact OD1-CD1 3.28Å; N361-I537 WeakPolarHBondContact OD1-CD1 2.96Å; E362-I537 HydrophobicContact CB-CG2 3.89Å; G535-I537 PolarHBondContact O-N 3.19Å; I537-S539 VanDerWaalsContact C-N 3.33Å; I537-S539 PolarHBondContact O-N 3.21Å; I537-R540 PolarHBondContact O-N 2.97Å; I537-R540 VanDerWaalsContact O-N 3.09Å; I537-Y541 PolarHBondContact O-N 3.4Å; I537-A563 HydrophobicContact CG2-CB 4.34Å; I537-L566 HydrophobicContact CD1-CB 4.05Å; I537-L566 HydrophobicContact CG1-CB 3.92Å; I537-L566 HydrophobicContact CG1-CD1 4.3Å; I537-Q567 HydrophobicContact CD1-CG 3.77Å; I537-Q567 HydrophobicContact CG1-CG 4.48Å; I537-Q567 HydrophobicContact CG2-CG 4.18Å; I537-I584 HydrophobicContact CG2-CD1 3.92Å
538	R	96.7	Very high	96.5	Very high	22 Å²	22	27.4 Å²	27.4	8%	0.083	14%	0.135	C	C	.	.	H	α-helix	trans	-50	-47.9	172.3	176.4	68.1	67.4	164.2	17	112.9	A359 E360 E362 E364 F536 R540 Y541 N542	A359-R538 PolarHBondContact O-NE 2.75Å; A359-R538 PolarHBondContact O-NH2 3.2Å; E360-R538 WeakPolarHBondContact O-CB 3.39Å; E360-R538 PolarHBondContact O-N 3.5Å; E362-R538 IonicContact OE1-CZ 2.64Å; E362-R538 IonicContact OE1-NH1 2.75Å; E362-R538 PolarHBondContact OE1-NH1 3.5Å; E362-R538 VanDerWaalsContact OE1-NH1 3.11Å; E362-R538 WeakPolarHBondContact OE2-CD 3.45Å; E362-R538 IonicContact OE2-CZ 2.68Å; E362-R538 IonicContact OE2-NE 3.47Å; E362-R538 PolarHBondContact OE2-NE 3.05Å; E362-R538 VanDerWaalsContact OE2-NE 3.11Å; E362-R538 IonicContact OE2-NH1 3.61Å; E362-R538 PolarHBondContact OE2-NH1 3.11Å; E364-R538 IonicContact OE1-NH2 3.92Å; E364-R538 IonicContact OE2-CZ 2.85Å; E364-R538 IonicContact OE2-NH1 2.74Å; E364-R538 PolarHBondContact OE2-NH1 3.33Å; E364-R538 IonicContact OE2-NH2 2.89Å; E364-R538 PolarHBondContact OE2-NH2 3.33Å; F536-R538 HydrophobicContact CD2-CB 3.9Å; F536-R538 HydrophobicContact CE2-CB 3.61Å; F536-R538 HydrophobicContact CE2-CG 4.12Å; F536-R538 HydrophobicContact CZ-CB 4.42Å; R538-R540 VanDerWaalsContact C-N 3.33Å; R538-R540 PolarHBondContact O-N 3.33Å; R538-Y541 PolarHBondContact O-N 3.36Å; R538-N542 WeakPolarHBondContact O-CB 3.49Å; R538-N542 VanDerWaalsContact O-CG 3.23Å; R538-N542 PolarHBondContact O-N 2.77Å; R538-N542 PolarHBondContact O-ND2 3.31Å
539	S	98	Very high	96.1	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-73.5	-22.4	-178.1	-170.4	0	0	0	0	113.3	N507 F536 I537 L543	N507-S539 WeakPolarHBondContact OD1-CA 3.38Å; F536-S539 PolarHBondContact O-N 3.23Å; I537-S539 VanDerWaalsContact C-N 3.33Å; I537-S539 PolarHBondContact O-N 3.21Å; S539-L543 WeakPolarHBondContact O-CB 3.39Å; S539-L543 PolarHBondContact O-N 3.49Å
540	R	97.8	Very high	95.9	Very high	33 Å²	33	32.2 Å²	32.2	13%	0.125	17%	0.165	C	C	.	.	H	α-helix	trans	-75.4	-41.7	168.7	-73.6	-167.8	178.7	78.7	-9.3	112.5	L530 P534 F536 I537 R538 L543 G544 M562 A563 L566	L530-R540 HydrophobicContact CD1-CG 3.86Å; L530-R540 HydrophobicContact CD2-CG 3.58Å; L530-R540 HydrophobicContact CG-CG 4.41Å; P534-R540 PolarHBondContact O-NH1 2.87Å; P534-R540 PolarHBondContact O-NH2 3.43Å; F536-R540 PolarHBondContact O-N 3.07Å; I537-R540 PolarHBondContact O-N 2.97Å; I537-R540 VanDerWaalsContact O-N 3.09Å; R538-R540 VanDerWaalsContact C-N 3.33Å; R538-R540 PolarHBondContact O-N 3.33Å; R540-L543 PolarHBondContact O-N 3.1Å; R540-G544 PolarHBondContact O-N 3.43Å; R540-M562 VanDerWaalsContact CD-CG 3.45Å; R540-M562 VanDerWaalsContact NE-CG 3.31Å; R540-A563 HydrophobicContact CB-CB 4.05Å; R540-L566 VanDerWaalsContact CZ-CD1 3.47Å
541	Y	97.2	Very high	95.5	Very high	43 Å²	43	33.3 Å²	33.3	17%	0.169	18%	0.182	C	C	.	.	H	α-helix	trans	-57.4	-51.7	172.5	170	-101.4	0	0	0	110.2	E362 I537 R538 L543 G544 I545 F560 N583 I584 A587	E362-Y541 HydrophobicContact CG-CD1 4.28Å; E362-Y541 HydrophobicContact CG-CG 4.12Å; E362-Y541 WeakPolarHBondContact OE2-CD1 3.27Å; I537-Y541 PolarHBondContact O-N 3.4Å; R538-Y541 PolarHBondContact O-N 3.36Å; Y541-L543 PolarHBondContact O-N 2.85Å; Y541-G544 WeakPolarHBondContact O-CA 3.27Å; Y541-G544 PolarHBondContact O-N 2.82Å; Y541-I545 HydrophobicContact CE1-CG1 4.13Å; Y541-I545 HydrophobicContact CE2-CD1 4.2Å; Y541-I545 HydrophobicContact CE2-CG1 4.31Å; Y541-I545 WeakPolarHBondContact O-CG1 3.45Å; Y541-I545 PolarHBondContact O-N 3.33Å; Y541-F560 AromaticContact CD2-CD1 3.91Å; Y541-F560 HydrophobicContact CD2-CD1 3.91Å; Y541-F560 AromaticContact CD2-CE1 3.68Å; Y541-F560 HydrophobicContact CD2-CE1 3.68Å; Y541-F560 HydrophobicContact CE2-CE1 4.09Å; Y541-F560 HydrophobicContact CG-CE1 4.46Å; Y541-F560 WeakPolarHBondContact O-CE1 3.49Å; Y541-N583 HydrophobicContact CE2-CB 4.24Å; Y541-I584 HydrophobicContact CD2-CB 4.34Å; Y541-I584 HydrophobicContact CD2-CG1 3.81Å; Y541-I584 HydrophobicContact CG-CG1 4.36Å; Y541-A587 HydrophobicContact CD2-CB 4.48Å; Y541-A587 HydrophobicContact CE2-CB 3.75Å
542	N	97.1	Very high	95.4	Very high	25 Å²	25	28.9 Å²	28.9	13%	0.134	17%	0.166	C	C	.	.	H	α-helix	trans	-61	-40.4	177.9	-71.3	-14.9	0	0	0	113.3	N507 Y526 R538 G544 I545 S546	N507-N542 PolarHBondContact OD1-ND2 3.5Å; Y526-N542 HydrophobicContact CD1-CB 4.08Å; Y526-N542 HydrophobicContact CE1-CB 3.46Å; Y526-N542 VanDerWaalsContact CE1-CB 3.46Å; Y526-N542 HydrophobicContact CE2-CB 4.13Å; Y526-N542 VanDerWaalsContact CZ-CB 3.49Å; R538-N542 WeakPolarHBondContact O-CB 3.49Å; R538-N542 VanDerWaalsContact O-CG 3.23Å; R538-N542 PolarHBondContact O-N 2.77Å; R538-N542 PolarHBondContact O-ND2 3.31Å; N542-G544 VanDerWaalsContact C-N 3.34Å; N542-I545 PolarHBondContact O-N 3.46Å; N542-S546 PolarHBondContact O-N 3.14Å
543	L	97.9	Very high	95.3	Very high	14 Å²	14	28.8 Å²	28.8	7%	0.073	16%	0.164	C	C	.	.	H	α-helix	trans	-60.8	-42.7	172	176.4	56.6	0	0	0	111.7	V523 Y526 L530 S539 R540 Y541 I545 S546 C547 N559	V523-L543 HydrophobicContact CB-CD1 4.11Å; V523-L543 HydrophobicContact CG1-CD1 3.93Å; V523-L543 HydrophobicContact CG2-CD1 3.83Å; Y526-L543 HydrophobicContact CD2-CB 4.07Å; Y526-L543 HydrophobicContact CD2-CD1 4.28Å; Y526-L543 HydrophobicContact CG-CB 4.23Å; L530-L543 HydrophobicContact CD1-CD2 3.73Å; S539-L543 WeakPolarHBondContact O-CB 3.39Å; S539-L543 PolarHBondContact O-N 3.49Å; R540-L543 PolarHBondContact O-N 3.1Å; Y541-L543 PolarHBondContact O-N 2.85Å; L543-I545 VanDerWaalsContact C-N 3.33Å; L543-I545 PolarHBondContact O-N 2.79Å; L543-S546 PolarHBondContact O-N 3.14Å; L543-C547 PolarHBondContact O-N 2.71Å; L543-C547 PolarHBondContact O-SG 3.16Å; L543-C547 VanDerWaalsContact O-SG 3.36Å; L543-N559 WeakPolarHBondContact CD2-OD1 3.46Å
544	G	96.9	Very high	95.3	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-60.1	-39.4	174.5	0	0	0	0	0	113	R540 Y541 N542 C547 I548 A556	R540-G544 PolarHBondContact O-N 3.43Å; Y541-G544 WeakPolarHBondContact O-CA 3.27Å; Y541-G544 PolarHBondContact O-N 2.82Å; N542-G544 VanDerWaalsContact C-N 3.34Å; G544-C547 WeakPolarHBondContact O-CB 3.39Å; G544-C547 PolarHBondContact O-N 3.33Å; G544-I548 PolarHBondContact O-N 3.26Å; G544-A556 VanDerWaalsContact O-CB 3.23Å; G544-A556 WeakPolarHBondContact O-CB 3.06Å
545	I	94.5	Very high	95.3	Very high	50 Å²	50	34.8 Å²	34.8	26%	0.256	18%	0.18	S	C	.	.	H	α-helix	trans	-63.6	-46.5	173.9	-62.6	-66.7	0	0	0	110.9	Y541 N542 L543 C547 I548 N549 F560 A587	Y541-I545 HydrophobicContact CE1-CG1 4.13Å; Y541-I545 HydrophobicContact CE2-CD1 4.2Å; Y541-I545 HydrophobicContact CE2-CG1 4.31Å; Y541-I545 WeakPolarHBondContact O-CG1 3.45Å; Y541-I545 PolarHBondContact O-N 3.33Å; N542-I545 PolarHBondContact O-N 3.46Å; L543-I545 VanDerWaalsContact C-N 3.33Å; L543-I545 PolarHBondContact O-N 2.79Å; I545-C547 VanDerWaalsContact C-N 3.26Å; I545-C547 PolarHBondContact O-N 3.49Å; I545-I548 WeakPolarHBondContact O-CB 3.39Å; I545-I548 PolarHBondContact O-N 3.32Å; I545-N549 PolarHBondContact O-N 3.18Å; I545-N549 PolarHBondContact O-OD1 3.37Å; I545-F560 HydrophobicContact CD1-CE1 4.28Å; I545-F560 HydrophobicContact CD1-CZ 3.97Å; I545-F560 HydrophobicContact CG1-CE1 4.31Å; I545-F560 HydrophobicContact CG1-CZ 4.28Å; I545-A587 HydrophobicContact CD1-CB 3.93Å
546	S	93.9	Very high	95.4	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-62.6	-31.9	174.2	-73.9	0	0	0	0	113	A514 N542 L543 N549 L550	A514-S546 WeakPolarHBondContact CB-OG 3.42Å; N542-S546 PolarHBondContact O-N 3.14Å; L543-S546 PolarHBondContact O-N 3.14Å; S546-N549 PolarHBondContact O-N 3.13Å; S546-L550 VanDerWaalsContact O-CG 3.29Å; S546-L550 WeakPolarHBondContact O-CG 3.11Å; S546-L550 PolarHBondContact O-N 2.96Å; S546-L550 VanDerWaalsContact O-N 3.17Å
547	C	96.1	Very high	95.4	Very high	11 Å²	11	34.5 Å²	34.5	7%	0.074	18%	0.178	C	C	.	.	H	α-helix	trans	-66	-34.9	170.6	-69.4	0	0	0	0	112.8	L543 G544 I545 L550 G551 A552 E555 A556	L543-C547 PolarHBondContact O-N 2.71Å; L543-C547 PolarHBondContact O-SG 3.16Å; L543-C547 VanDerWaalsContact O-SG 3.36Å; G544-C547 WeakPolarHBondContact O-CB 3.39Å; G544-C547 PolarHBondContact O-N 3.33Å; I545-C547 VanDerWaalsContact C-N 3.26Å; I545-C547 PolarHBondContact O-N 3.49Å; C547-L550 PolarHBondContact O-N 3.01Å; C547-G551 PolarHBondContact O-N 2.8Å; C547-A552 HydrophobicContact CB-CB 4.12Å; C547-A552 CarbonylContact O-C 3.6Å; C547-A552 WeakPolarHBondContact O-CA 3.37Å; C547-A552 WeakPolarHBondContact O-CB 3.27Å; C547-A552 PolarHBondContact O-N 2.9Å; C547-E555 HydrophobicContact CB-CB 4.31Å; C547-A556 HydrophobicContact CB-CB 3.67Å
548	I	91.6	Very high	95.4	Very high	23 Å²	23	36 Å²	36	12%	0.118	19%	0.189	C	C	.	.	H	α-helix	trans	-61.6	-48.5	170.4	-64.1	179.5	0	0	0	110.2	G544 I545 L550 G551 A556 F560 I590 A591	G544-I548 PolarHBondContact O-N 3.26Å; I545-I548 WeakPolarHBondContact O-CB 3.39Å; I545-I548 PolarHBondContact O-N 3.32Å; I548-L550 PolarHBondContact O-N 3.28Å; I548-L550 VanDerWaalsContact O-N 3.13Å; I548-G551 PolarHBondContact O-N 3.43Å; I548-A556 HydrophobicContact CG1-CB 3.67Å; I548-F560 HydrophobicContact CD1-CE2 3.94Å; I548-F560 HydrophobicContact CD1-CZ 4.07Å; I548-F560 HydrophobicContact CG1-CE2 4.37Å; I548-I590 HydrophobicContact CD1-CG2 4.23Å; I548-A591 HydrophobicContact CD1-CB 4.36Å; I548-A591 HydrophobicContact CG1-CB 4.45Å
549	N	90.5	Very high	95.4	Very high	92 Å²	92	36.4 Å²	36.4	49%	0.492	19%	0.193	S	C	.	.	H	α-helix	trans	-59.7	-24.6	-178.9	-64.2	-1.7	0	0	0	113.4	S519 I545 S546	S519-N549 WeakPolarHBondContact OG-CB 3.16Å; S519-N549 PolarHBondContact OG-ND2 3.49Å; S519-N549 VanDerWaalsContact OG-ND2 3.12Å; I545-N549 PolarHBondContact O-N 3.18Å; I545-N549 PolarHBondContact O-OD1 3.37Å; S546-N549 PolarHBondContact O-N 3.13Å
550	L	92.8	Very high	95.4	Very high	76 Å²	76	36.4 Å²	36.4	40%	0.398	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.4	5.2	178.8	-64.3	171.9	0	0	0	113.6	E520 V523 S546 C547 I548 A552	E520-L550 HydrophobicContact CG-CD1 4.41Å; E520-L550 HydrophobicContact CG-CD2 3.64Å; V523-L550 HydrophobicContact CG2-CD1 3.88Å; S546-L550 VanDerWaalsContact O-CG 3.29Å; S546-L550 WeakPolarHBondContact O-CG 3.11Å; S546-L550 PolarHBondContact O-N 2.96Å; S546-L550 VanDerWaalsContact O-N 3.17Å; C547-L550 PolarHBondContact O-N 3.01Å; I548-L550 PolarHBondContact O-N 3.28Å; I548-L550 VanDerWaalsContact O-N 3.13Å; L550-A552 PolarHBondContact O-N 3.34Å
551	G	91.1	Very high	95.3	Very high	46 Å²	46	34.9 Å²	34.9	47%	0.474	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.2	2.7	-174.6	0	0	0	0	0	114.8	C547 I548 H553	C547-G551 PolarHBondContact O-N 2.8Å; I548-G551 PolarHBondContact O-N 3.43Å; G551-H553 PolarHBondContact O-CD2 2.86Å; G551-H553 VanDerWaalsContact O-CD2 3.32Å; G551-H553 PolarHBondContact O-N 3.44Å
552	A	95.1	Very high	95.1	Very high	28 Å²	28	34.5 Å²	34.5	23%	0.231	19%	0.187	C	C	.	.			trans	-81.2	58.1	-179.6	0	0	0	0	0	111	C547 L550 R554 E555 A556	C547-A552 HydrophobicContact CB-CB 4.12Å; C547-A552 CarbonylContact O-C 3.6Å; C547-A552 WeakPolarHBondContact O-CA 3.37Å; C547-A552 WeakPolarHBondContact O-CB 3.27Å; C547-A552 PolarHBondContact O-N 2.9Å; L550-A552 PolarHBondContact O-N 3.34Å; A552-R554 VanDerWaalsContact C-N 3.29Å; A552-R554 PolarHBondContact O-N 3.08Å; A552-E555 VanDerWaalsContact C-OE2 3.31Å; A552-E555 WeakPolarHBondContact CA-OE2 3.44Å; A552-E555 HydrophobicContact CB-CB 4.09Å; A552-E555 HydrophobicContact CB-CG 4.29Å; A552-E555 WeakPolarHBondContact O-CB 3.4Å; A552-E555 PolarHBondContact O-N 3.22Å; A552-A556 PolarHBondContact O-N 3.13Å
553	H	95.1	Very high	95	Very high	41 Å²	41	33.3 Å²	33.3	19%	0.19	18%	0.181	C	C	.	.	H	α-helix	trans	-66.1	-28.5	-168.9	-53.5	-52.3	0	0	0	113.6	G551 A557 M594 M595	G551-H553 PolarHBondContact O-CD2 2.86Å; G551-H553 VanDerWaalsContact O-CD2 3.32Å; G551-H553 PolarHBondContact O-N 3.44Å; H553-A557 WeakPolarHBondContact O-CB 3.42Å; H553-A557 PolarHBondContact O-N 2.94Å; H553-M594 HydrophobicContact CB-CB 4.11Å; H553-M595 HydrophobicContact CB-CG 3.66Å; H553-M595 HydrophobicContact CB-SD 4.49Å
554	R	95.5	Very high	94.7	Very high	124 Å²	124	32.7 Å²	32.7	47%	0.468	18%	0.177	S	C	.	.	H	α-helix	trans	-70	-42	175.2	176.1	170.7	-69.4	-76.9	-0.9	111.3	A552 A556 S558 M595 F616	A552-R554 VanDerWaalsContact C-N 3.29Å; A552-R554 PolarHBondContact O-N 3.08Å; R554-A556 VanDerWaalsContact C-N 3.34Å; R554-S558 WeakPolarHBondContact O-CB 3.17Å; R554-S558 PolarHBondContact O-N 3.46Å; R554-M595 HydrophobicContact CB-CE 3.97Å; R554-M595 HydrophobicContact CB-SD 4.28Å; R554-M595 HydrophobicContact CG-CE 4.28Å; R554-F616 HydrophobicContact CG-CD1 4.44Å; R554-F616 HydrophobicContact CG-CE1 4.04Å
555	E	96.1	Very high	94.5	Very high	95 Å²	95	32.9 Å²	32.9	44%	0.444	18%	0.179	S	C	.	.	H	α-helix	trans	-67.9	-37.8	176.6	-63.8	63.3	-145.9	0	0	110.2	C547 A552 S558 N559	C547-E555 HydrophobicContact CB-CB 4.31Å; A552-E555 VanDerWaalsContact C-OE2 3.31Å; A552-E555 WeakPolarHBondContact CA-OE2 3.44Å; A552-E555 HydrophobicContact CB-CB 4.09Å; A552-E555 HydrophobicContact CB-CG 4.29Å; A552-E555 WeakPolarHBondContact O-CB 3.4Å; A552-E555 PolarHBondContact O-N 3.22Å; E555-S558 PolarHBondContact O-N 3.29Å; E555-N559 PolarHBondContact O-N 2.76Å; E555-N559 PolarHBondContact O-ND2 3.46Å
556	A	96.4	Very high	94.3	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-60.2	-56	171.8	0	0	0	0	0	111.8	G544 C547 I548 A552 R554 S558 N559 F560 A591	G544-A556 VanDerWaalsContact O-CB 3.23Å; G544-A556 WeakPolarHBondContact O-CB 3.06Å; C547-A556 HydrophobicContact CB-CB 3.67Å; I548-A556 HydrophobicContact CG1-CB 3.67Å; A552-A556 PolarHBondContact O-N 3.13Å; R554-A556 VanDerWaalsContact C-N 3.34Å; A556-S558 VanDerWaalsContact C-N 3.29Å; A556-S558 PolarHBondContact O-N 2.76Å; A556-N559 PolarHBondContact O-N 2.78Å; A556-F560 HydrophobicContact CB-CE2 3.95Å; A556-F560 WeakPolarHBondContact O-CD2 3.39Å; A556-F560 WeakPolarHBondContact O-CG 3.29Å; A556-F560 PolarHBondContact O-N 3.38Å; A556-A591 HydrophobicContact CB-CB 4.1Å
557	A	96.6	Very high	94	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-56.9	-42	177.4	0	0	0	0	0	111.8	H553 N559 F560 L561 L588 A591 L592 M595 F616	H553-A557 WeakPolarHBondContact O-CB 3.42Å; H553-A557 PolarHBondContact O-N 2.94Å; A557-N559 VanDerWaalsContact C-N 3.34Å; A557-N559 PolarHBondContact O-N 2.76Å; A557-F560 PolarHBondContact O-N 3Å; A557-L561 WeakPolarHBondContact O-CB 3.21Å; A557-L561 VanDerWaalsContact O-CG 3.23Å; A557-L561 WeakPolarHBondContact O-CG 3.26Å; A557-L561 PolarHBondContact O-N 2.91Å; A557-L588 HydrophobicContact CB-CD1 3.83Å; A557-A591 HydrophobicContact CB-CB 4.06Å; A557-L592 HydrophobicContact CB-CD2 4.22Å; A557-M595 HydrophobicContact CB-SD 4.09Å; A557-F616 HydrophobicContact CB-CE1 3.59Å; A557-F616 HydrophobicContact CB-CE2 4.44Å; A557-F616 HydrophobicContact CB-CZ 3.47Å; A557-F616 VanDerWaalsContact CB-CZ 3.47Å
558	S	96.8	Very high	93.5	Very high	34 Å²	34	35.1 Å²	35.1	24%	0.238	19%	0.185	C	C	.	.	H	α-helix	trans	-59.7	-40.1	174.5	-171.7	0	0	0	0	113	R554 E555 A556 M562	R554-S558 WeakPolarHBondContact O-CB 3.17Å; R554-S558 PolarHBondContact O-N 3.46Å; E555-S558 PolarHBondContact O-N 3.29Å; A556-S558 VanDerWaalsContact C-N 3.29Å; A556-S558 PolarHBondContact O-N 2.76Å; S558-M562 VanDerWaalsContact O-CB 3.28Å; S558-M562 WeakPolarHBondContact O-CB 3.25Å; S558-M562 PolarHBondContact O-N 3.15Å
559	N	97.1	Very high	92.6	Very high	30 Å²	30	38.4 Å²	38.4	16%	0.16	20%	0.198	C	C	.	.	H	α-helix	trans	-69.7	-40	177.6	-86.2	-73.7	0	0	0	112.7	L543 E555 A556 A557 M562 A563	L543-N559 WeakPolarHBondContact CD2-OD1 3.46Å; E555-N559 PolarHBondContact O-N 2.76Å; E555-N559 PolarHBondContact O-ND2 3.46Å; A556-N559 PolarHBondContact O-N 2.78Å; A557-N559 VanDerWaalsContact C-N 3.34Å; A557-N559 PolarHBondContact O-N 2.76Å; N559-M562 WeakPolarHBondContact O-CB 3.2Å; N559-M562 PolarHBondContact O-N 2.77Å; N559-A563 WeakPolarHBondContact O-CB 3.29Å; N559-A563 PolarHBondContact O-N 2.98Å
560	F	96.6	Very high	91.3	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-66.8	-43.1	175	-58	-50.9	0	0	0	111.9	Y541 I545 I548 A556 A557 M562 A563 L564 I584 A587 L588 A591	Y541-F560 AromaticContact CD2-CD1 3.91Å; Y541-F560 HydrophobicContact CD2-CD1 3.91Å; Y541-F560 AromaticContact CD2-CE1 3.68Å; Y541-F560 HydrophobicContact CD2-CE1 3.68Å; Y541-F560 HydrophobicContact CE2-CE1 4.09Å; Y541-F560 HydrophobicContact CG-CE1 4.46Å; Y541-F560 WeakPolarHBondContact O-CE1 3.49Å; I545-F560 HydrophobicContact CD1-CE1 4.28Å; I545-F560 HydrophobicContact CD1-CZ 3.97Å; I545-F560 HydrophobicContact CG1-CE1 4.31Å; I545-F560 HydrophobicContact CG1-CZ 4.28Å; I548-F560 HydrophobicContact CD1-CE2 3.94Å; I548-F560 HydrophobicContact CD1-CZ 4.07Å; I548-F560 HydrophobicContact CG1-CE2 4.37Å; A556-F560 HydrophobicContact CB-CE2 3.95Å; A556-F560 WeakPolarHBondContact O-CD2 3.39Å; A556-F560 WeakPolarHBondContact O-CG 3.29Å; A556-F560 PolarHBondContact O-N 3.38Å; A557-F560 PolarHBondContact O-N 3Å; F560-M562 VanDerWaalsContact C-N 3.35Å; F560-M562 PolarHBondContact O-N 2.84Å; F560-A563 PolarHBondContact O-N 3.16Å; F560-A563 VanDerWaalsContact O-N 3.16Å; F560-L564 WeakPolarHBondContact O-CG 3.15Å; F560-L564 PolarHBondContact O-N 2.8Å; F560-I584 HydrophobicContact CB-CG2 3.79Å; F560-I584 HydrophobicContact CD1-CG2 4.08Å; F560-I584 HydrophobicContact CG-CG2 4.33Å; F560-A587 HydrophobicContact CD1-CB 4.14Å; F560-A587 HydrophobicContact CD2-CB 4.33Å; F560-A587 HydrophobicContact CE1-CB 3.62Å; F560-A587 HydrophobicContact CE2-CB 3.86Å; F560-A587 HydrophobicContact CG-CB 4.47Å; F560-A587 HydrophobicContact CZ-CB 3.48Å; F560-A587 VanDerWaalsContact CZ-CB 3.48Å; F560-L588 HydrophobicContact CB-CB 3.89Å; F560-L588 HydrophobicContact CB-CD1 4.23Å; F560-L588 HydrophobicContact CD2-CB 4.26Å; F560-L588 HydrophobicContact CG-CB 4.35Å; F560-A591 HydrophobicContact CD2-CB 4.32Å; F560-A591 HydrophobicContact CE2-CB 4.13Å
561	L	95.6	Very high	89.6	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-60.5	-43.3	174.5	-72	172.1	0	0	0	111.9	A557 A563 L564 S565 L588 L609 L612 M613 F616 L618	A557-L561 WeakPolarHBondContact O-CB 3.21Å; A557-L561 VanDerWaalsContact O-CG 3.23Å; A557-L561 WeakPolarHBondContact O-CG 3.26Å; A557-L561 PolarHBondContact O-N 2.91Å; L561-A563 PolarHBondContact O-N 3.38Å; L561-L564 PolarHBondContact O-N 2.79Å; L561-S565 WeakPolarHBondContact O-CB 3.47Å; L561-S565 PolarHBondContact O-N 3.27Å; L561-L588 HydrophobicContact CD2-CD1 4.26Å; L561-L588 HydrophobicContact CD2-CD2 3.59Å; L561-L588 HydrophobicContact CG-CD1 3.97Å; L561-L588 HydrophobicContact CG-CD2 4.14Å; L561-L609 HydrophobicContact CD2-CD1 3.57Å; L561-L612 HydrophobicContact CD1-CB 4.31Å; L561-L612 HydrophobicContact CD2-CB 3.53Å; L561-L612 HydrophobicContact CD2-CD1 4.16Å; L561-L612 HydrophobicContact CD2-CG 4.4Å; L561-M613 HydrophobicContact CB-SD 3.83Å; L561-F616 HydrophobicContact CD1-CB 4.12Å; L561-F616 HydrophobicContact CD1-CD1 4.29Å; L561-F616 HydrophobicContact CD1-CD2 3.44Å; L561-F616 VanDerWaalsContact CD1-CD2 3.44Å; L561-F616 HydrophobicContact CD1-CE2 3.85Å; L561-F616 HydrophobicContact CD1-CG 3.69Å; L561-F616 HydrophobicContact CD1-CZ 4.44Å; L561-L618 HydrophobicContact CB-CD1 3.86Å; L561-L618 HydrophobicContact CD1-CD1 4.28Å
562	M	94.3	Very high	87.7	Confident	36 Å²	36	38.2 Å²	38.2	18%	0.177	20%	0.196	C	C	.	.	H	α-helix	trans	-57.6	-46	172.2	-174.8	68.9	60.5	0	0	111.8	R540 S558 N559 F560 S565 L566 L618 F620	R540-M562 VanDerWaalsContact CD-CG 3.45Å; R540-M562 VanDerWaalsContact NE-CG 3.31Å; S558-M562 VanDerWaalsContact O-CB 3.28Å; S558-M562 WeakPolarHBondContact O-CB 3.25Å; S558-M562 PolarHBondContact O-N 3.15Å; N559-M562 WeakPolarHBondContact O-CB 3.2Å; N559-M562 PolarHBondContact O-N 2.77Å; F560-M562 VanDerWaalsContact C-N 3.35Å; F560-M562 PolarHBondContact O-N 2.84Å; M562-S565 PolarHBondContact O-N 2.72Å; M562-S565 PolarHBondContact O-OG 3.38Å; M562-L566 WeakPolarHBondContact O-CG 3.44Å; M562-L566 PolarHBondContact O-N 2.98Å; M562-L566 VanDerWaalsContact O-N 3.09Å; M562-L618 HydrophobicContact CE-CD2 4.36Å; M562-F620 HydrophobicContact CE-CE2 3.61Å; M562-F620 HydrophobicContact CE-CZ 3.87Å; M562-F620 HydrophobicContact SD-CE2 3.47Å; M562-F620 WeakPolarHBondContact SD-CE2 3.09Å; M562-F620 HydrophobicContact SD-CZ 3.6Å
563	A	93.8	Very high	85.3	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-64.4	-43.7	179.1	0	0	0	0	0	112.8	I537 R540 N559 F560 L561 S565 L566 Q567 I584	I537-A563 HydrophobicContact CG2-CB 4.34Å; R540-A563 HydrophobicContact CB-CB 4.05Å; N559-A563 WeakPolarHBondContact O-CB 3.29Å; N559-A563 PolarHBondContact O-N 2.98Å; F560-A563 PolarHBondContact O-N 3.16Å; F560-A563 VanDerWaalsContact O-N 3.16Å; L561-A563 PolarHBondContact O-N 3.38Å; A563-S565 VanDerWaalsContact C-N 3.35Å; A563-L566 PolarHBondContact O-N 3.3Å; A563-Q567 PolarHBondContact O-N 3.2Å; A563-Q567 VanDerWaalsContact O-N 3.1Å; A563-I584 HydrophobicContact CB-CD1 4.06Å; A563-I584 HydrophobicContact CB-CG2 4.26Å
564	L	92.6	Very high	82.6	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-62.2	-40.6	172.6	-67.2	170.3	0	0	0	111.7	F560 L561 L566 Q567 R568 M580 I584 W585 L588 L609	F560-L564 WeakPolarHBondContact O-CG 3.15Å; F560-L564 PolarHBondContact O-N 2.8Å; L561-L564 PolarHBondContact O-N 2.79Å; L564-L566 PolarHBondContact O-N 3.34Å; L564-Q567 PolarHBondContact O-N 3.35Å; L564-R568 WeakPolarHBondContact O-CB 3.28Å; L564-R568 PolarHBondContact O-N 2.78Å; L564-M580 HydrophobicContact CB-SD 4.13Å; L564-M580 HydrophobicContact CD2-CB 3.74Å; L564-M580 HydrophobicContact CD2-CG 4.47Å; L564-M580 HydrophobicContact CD2-SD 4.04Å; L564-I584 HydrophobicContact CD1-CG2 4.25Å; L564-I584 HydrophobicContact CD2-CB 3.92Å; L564-I584 HydrophobicContact CD2-CG2 3.86Å; L564-I584 HydrophobicContact CG-CB 4.31Å; L564-I584 HydrophobicContact CG-CG2 3.67Å; L564-W585 HydrophobicContact CD1-CD2 3.76Å; L564-W585 HydrophobicContact CD1-CE3 3.92Å; L564-W585 HydrophobicContact CD1-CG 4.35Å; L564-W585 HydrophobicContact CD1-CH2 4.02Å; L564-W585 HydrophobicContact CD1-CZ2 3.87Å; L564-W585 HydrophobicContact CD1-CZ3 4.04Å; L564-W585 HydrophobicContact CD2-CD2 4.24Å; L564-W585 HydrophobicContact CD2-CG 4.16Å; L564-L588 HydrophobicContact CD1-CD2 3.68Å; L564-L609 HydrophobicContact CB-CD1 3.9Å; L564-L609 HydrophobicContact CB-CD2 3.94Å; L564-L609 HydrophobicContact CD1-CD1 4.13Å
565	S	91.5	Very high	80.2	Confident	4 Å²	4	49.7 Å²	49.7	3%	0.028	27%	0.267	C	S	.	.	H	α-helix	trans	-63.6	-30.9	177.6	85.5	0	0	0	0	113	L561 M562 A563 K569	L561-S565 WeakPolarHBondContact O-CB 3.47Å; L561-S565 PolarHBondContact O-N 3.27Å; M562-S565 PolarHBondContact O-N 2.72Å; M562-S565 PolarHBondContact O-OG 3.38Å; A563-S565 VanDerWaalsContact C-N 3.35Å; S565-K569 WeakPolarHBondContact O-CG 3.17Å; S565-K569 PolarHBondContact O-N 3.01Å
566	L	90.6	Very high	77.5	Confident	29 Å²	29	47.5 Å²	47.5	15%	0.152	26%	0.262	C	S	.	.	H	α-helix	trans	-73	-48	174.5	-70.3	162.5	0	0	0	110.4	I537 R540 M562 A563 L564 R568 K569	I537-L566 HydrophobicContact CD1-CB 4.05Å; I537-L566 HydrophobicContact CG1-CB 3.92Å; I537-L566 HydrophobicContact CG1-CD1 4.3Å; R540-L566 VanDerWaalsContact CZ-CD1 3.47Å; M562-L566 WeakPolarHBondContact O-CG 3.44Å; M562-L566 PolarHBondContact O-N 2.98Å; M562-L566 VanDerWaalsContact O-N 3.09Å; A563-L566 PolarHBondContact O-N 3.3Å; L564-L566 PolarHBondContact O-N 3.34Å; L566-R568 PolarHBondContact O-N 2.76Å; L566-K569 HydrophobicContact CD2-CD 4.42Å; L566-K569 PolarHBondContact O-N 3.34Å
567	Q	87.9	Confident	75.1	Confident	13 Å²	13	56.6 Å²	56.6	6%	0.061	30%	0.304	C	S	.	.	H	α-helix	trans	-55	-33.1	173.1	-72.9	-175.2	-21.6	0	0	112.7	N361 I537 A563 L564 S570 M580	N361-Q567 PolarHBondContact O-NE2 3.43Å; I537-Q567 HydrophobicContact CD1-CG 3.77Å; I537-Q567 HydrophobicContact CG1-CG 4.48Å; I537-Q567 HydrophobicContact CG2-CG 4.18Å; A563-Q567 PolarHBondContact O-N 3.2Å; A563-Q567 VanDerWaalsContact O-N 3.1Å; L564-Q567 PolarHBondContact O-N 3.35Å; Q567-S570 PolarHBondContact O-OG 2.76Å; Q567-M580 HydrophobicContact CB-CG 4.36Å
568	R	85.5	Confident	72.9	Confident	66 Å²	66	58 Å²	58	25%	0.249	31%	0.311	C	S	.	.	G	3₁₀ helix	trans	-72.4	-21.4	176.2	-172.2	166.2	71.8	162.2	4.4	114.8	L564 L566 S570 Q571 M580 L609 D610	L564-R568 WeakPolarHBondContact O-CB 3.28Å; L564-R568 PolarHBondContact O-N 2.78Å; L566-R568 PolarHBondContact O-N 2.76Å; R568-S570 PolarHBondContact O-N 3.3Å; R568-S570 VanDerWaalsContact O-N 3.09Å; R568-Q571 HydrophobicContact CG-CG 4.49Å; R568-Q571 VanDerWaalsContact O-CB 3.29Å; R568-Q571 WeakPolarHBondContact O-CB 3.16Å; R568-Q571 WeakPolarHBondContact O-CG 3.41Å; R568-Q571 PolarHBondContact O-N 3.16Å; R568-M580 HydrophobicContact CB-CE 4.03Å; R568-M580 HydrophobicContact CG-CE 4.15Å; R568-L609 HydrophobicContact CB-CD2 4.46Å; R568-D610 IonicContact CZ-OD1 2.72Å; R568-D610 IonicContact CZ-OD2 2.71Å; R568-D610 IonicContact NH1-OD1 3.15Å; R568-D610 PolarHBondContact NH1-OD1 3.02Å; R568-D610 IonicContact NH1-OD2 2.77Å; R568-D610 PolarHBondContact NH1-OD2 2.89Å; R568-D610 IonicContact NH2-OD1 2.65Å; R568-D610 PolarHBondContact NH2-OD1 3.35Å
569	K	74.2	Confident	71.1	Confident	92 Å²	92	62.7 Å²	62.7	40%	0.4	34%	0.337	S	S	.	.	G	3₁₀ helix	trans	-69.1	-9.5	-169.6	-82.3	167.8	-171.6	-179.7	0	115.2	S565 L566 Q571	S565-K569 WeakPolarHBondContact O-CG 3.17Å; S565-K569 PolarHBondContact O-N 3.01Å; L566-K569 HydrophobicContact CD2-CD 4.42Å; L566-K569 PolarHBondContact O-N 3.34Å; K569-Q571 VanDerWaalsContact C-N 3.31Å
570	S	61.6	Low	70	Confident	21 Å²	21	62.7 Å²	62.7	15%	0.147	34%	0.337	C	S	.	.	G	3₁₀ helix	trans	-69.5	-23.9	165.2	51.8	0	0	0	0	113.9	N332 Q567 R568 S572 Q578	N332-S570 WeakPolarHBondContact OD1-CA 3.4Å; N332-S570 WeakPolarHBondContact OD1-CB 3.45Å; Q567-S570 PolarHBondContact O-OG 2.76Å; R568-S570 PolarHBondContact O-N 3.3Å; R568-S570 VanDerWaalsContact O-N 3.09Å; S570-S572 PolarHBondContact O-N 3.32Å; S570-S572 VanDerWaalsContact O-N 3.09Å; S570-Q578 PolarHBondContact OG-OE1 2.92Å; S570-Q578 VanDerWaalsContact OG-OE1 3.09Å
571	Q	58.7	Low	69.1	Low	66 Å²	66	63.5 Å²	63.5	31%	0.308	34%	0.343	S	S	.	.			trans	-80.9	13	-165.5	-58.1	179.5	2.1	0	0	115	R568 K569 G573	R568-Q571 HydrophobicContact CG-CG 4.49Å; R568-Q571 VanDerWaalsContact O-CB 3.29Å; R568-Q571 WeakPolarHBondContact O-CB 3.16Å; R568-Q571 WeakPolarHBondContact O-CG 3.41Å; R568-Q571 PolarHBondContact O-N 3.16Å; K569-Q571 VanDerWaalsContact C-N 3.31Å; Q571-G573 PolarHBondContact O-N 2.65Å
572	S	49.7	Very low	68.4	Low	123 Å²	123	65.6 Å²	65.6	86%	0.86	36%	0.364	S	S	*	.	S	Bend	trans	-72.6	5.2	-178.1	-169.3	0	0	0	0	114.5	S570	S570-S572 PolarHBondContact O-N 3.32Å; S570-S572 VanDerWaalsContact O-N 3.09Å
573	G	46	Very low	68.1	Low	62 Å²	62	67.5 Å²	67.5	64%	0.639	38%	0.375	S	S	*	.	S	Bend	trans	-135.3	68.5	-171.5	0	0	0	0	0	113.7	Q571	Q571-G573 PolarHBondContact O-N 2.65Å
574	Q	36.8	Very low	67.9	Low	182 Å²	182	67.5 Å²	67.5	85%	0.85	38%	0.375	S	S	*	.	S	Bend	trans	70.7	171.4	-179.9	-55.2	-162.6	-15	0	0	115.9	S576	Q574-S576 PolarHBondContact O-N 3.33Å
575	Q	45.8	Very low	67.8	Low	191 Å²	191	69 Å²	69	89%	0.893	38%	0.381	S	S	*	.			trans	-85	108.2	-163.4	-66.2	155.2	-48.4	0	0	111.6
576	S	39.4	Very low	67.8	Low	48 Å²	48	70.4 Å²	70.4	34%	0.336	39%	0.393	S	S	.	.			trans	-131.2	139.9	155.5	72.2	0	0	0	0	109.8	Q574 Q578	Q574-S576 PolarHBondContact O-N 3.33Å; S576-Q578 PolarHBondContact O-N 3.35Å
577	H	45.7	Very low	67.8	Low	191 Å²	191	69.2 Å²	69.2	88%	0.884	39%	0.387	S	S	*	.			trans	-81.1	64	-178.7	-73.6	-76.9	0	0	0	110.9	V579	H577-V579 PolarHBondContact O-N 2.81Å; H577-V579 VanDerWaalsContact O-N 3.13Å
578	Q	51.7	Low	68.1	Low	30 Å²	30	68.6 Å²	68.6	14%	0.14	38%	0.384	C	S	.	.			trans	-66.9	111.1	171.2	-170	170	31.7	0	0	109.1	H306 S570 S576 M580	H306-Q578 PolarHBondContact CD2-NE2 3.49Å; H306-Q578 VanDerWaalsContact CD2-NE2 3.31Å; H306-Q578 PolarHBondContact CE1-NE2 2.77Å; H306-Q578 PolarHBondContact NE2-NE2 2.77Å; S570-Q578 PolarHBondContact OG-OE1 2.92Å; S570-Q578 VanDerWaalsContact OG-OE1 3.09Å; S576-Q578 PolarHBondContact O-N 3.35Å; Q578-M580 PolarHBondContact O-N 2.83Å; Q578-M580 VanDerWaalsContact O-N 3.14Å
579	V	58	Low	68.4	Low	132 Å²	132	68.2 Å²	68.2	80%	0.8	38%	0.383	S	S	*	.			trans	-68.8	108.6	-176.6	178.9	0	0	0	0	109.4	H577	H577-V579 PolarHBondContact O-N 2.81Å; H577-V579 VanDerWaalsContact O-N 3.13Å
580	M	74.2	Confident	69.1	Low	31 Å²	31	65.7 Å²	65.7	15%	0.153	37%	0.374	C	S	.	.			trans	-59.8	148.1	167.8	-55.5	174.8	-153.6	0	0	109.5	L564 Q567 R568 Q578 G582 W585 L609	L564-M580 HydrophobicContact CB-SD 4.13Å; L564-M580 HydrophobicContact CD2-CB 3.74Å; L564-M580 HydrophobicContact CD2-CG 4.47Å; L564-M580 HydrophobicContact CD2-SD 4.04Å; Q567-M580 HydrophobicContact CB-CG 4.36Å; R568-M580 HydrophobicContact CB-CE 4.03Å; R568-M580 HydrophobicContact CG-CE 4.15Å; Q578-M580 PolarHBondContact O-N 2.83Å; Q578-M580 VanDerWaalsContact O-N 3.14Å; M580-G582 PolarHBondContact O-N 2.92Å; M580-G582 VanDerWaalsContact O-N 3.16Å; M580-W585 HydrophobicContact SD-CZ2 4.15Å; M580-L609 HydrophobicContact CE-CD2 4.02Å; M580-L609 HydrophobicContact SD-CD2 3.97Å
581	S	77.6	Confident	70.6	Confident	17 Å²	17	64.7 Å²	64.7	12%	0.119	37%	0.367	C	S	.	.			trans	-57.8	121.5	-167.9	-179.1	0	0	0	0	112.5	E362 N583 I584 W585	E362-S581 VanDerWaalsContact O-CB 3.31Å; E362-S581 WeakPolarHBondContact O-CB 3.36Å; E362-S581 PolarHBondContact O-OG 3.44Å; S581-N583 PolarHBondContact O-N 3.34Å; S581-I584 PolarHBondContact O-N 2.65Å; S581-W585 PolarHBondContact O-N 3.04Å
582	G	81.9	Confident	72.2	Confident	44 Å²	44	61.6 Å²	61.6	45%	0.454	35%	0.352	S	S	.	.	H	α-helix	trans	-59.2	-29.3	-179.4	0	0	0	0	0	113	M580 I584 W585 A586	M580-G582 PolarHBondContact O-N 2.92Å; M580-G582 VanDerWaalsContact O-N 3.16Å; G582-I584 PolarHBondContact O-N 2.67Å; G582-W585 PolarHBondContact O-N 2.87Å; G582-A586 WeakPolarHBondContact O-CB 3.43Å; G582-A586 PolarHBondContact O-N 3.27Å
583	N	86.1	Confident	74.2	Confident	76 Å²	76	57.6 Å²	57.6	41%	0.406	32%	0.324	S	S	.	.	H	α-helix	trans	-58.5	-46.4	173.5	-63.9	-5.4	0	0	0	111.1	E362 Y541 S581 A586 A587	E362-N583 HydrophobicContact CG-CB 4.48Å; E362-N583 PolarHBondContact OE1-ND2 2.96Å; Y541-N583 HydrophobicContact CE2-CB 4.24Å; S581-N583 PolarHBondContact O-N 3.34Å; N583-A586 PolarHBondContact O-N 3.27Å; N583-A587 PolarHBondContact O-N 3.28Å
584	I	90.9	Very high	76.1	Confident	0 Å²	0	56 Å²	56	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-69.3	-41.3	-178.5	-50	175.6	0	0	0	110.1	E362 I537 Y541 F560 A563 L564 S581 G582 A586 A587 L588	E362-I584 HydrophobicContact CB-CD1 4.07Å; E362-I584 HydrophobicContact CB-CG1 4.44Å; E362-I584 HydrophobicContact CG-CD1 3.9Å; E362-I584 HydrophobicContact CG-CG1 3.72Å; I537-I584 HydrophobicContact CG2-CD1 3.92Å; Y541-I584 HydrophobicContact CD2-CB 4.34Å; Y541-I584 HydrophobicContact CD2-CG1 3.81Å; Y541-I584 HydrophobicContact CG-CG1 4.36Å; F560-I584 HydrophobicContact CB-CG2 3.79Å; F560-I584 HydrophobicContact CD1-CG2 4.08Å; F560-I584 HydrophobicContact CG-CG2 4.33Å; A563-I584 HydrophobicContact CB-CD1 4.06Å; A563-I584 HydrophobicContact CB-CG2 4.26Å; L564-I584 HydrophobicContact CD1-CG2 4.25Å; L564-I584 HydrophobicContact CD2-CB 3.92Å; L564-I584 HydrophobicContact CD2-CG2 3.86Å; L564-I584 HydrophobicContact CG-CB 4.31Å; L564-I584 HydrophobicContact CG-CG2 3.67Å; S581-I584 PolarHBondContact O-N 2.65Å; G582-I584 PolarHBondContact O-N 2.67Å; I584-A586 VanDerWaalsContact C-N 3.32Å; I584-A586 PolarHBondContact O-N 3.07Å; I584-A587 PolarHBondContact O-N 2.79Å; I584-L588 VanDerWaalsContact O-CB 3.23Å; I584-L588 WeakPolarHBondContact O-CB 3.05Å; I584-L588 PolarHBondContact O-N 3.31Å
585	W	91.1	Very high	78.8	Confident	30 Å²	30	48.8 Å²	48.8	11%	0.114	27%	0.267	C	S	.	.	H	α-helix	trans	-66.1	-29.6	173.3	-81.6	115.5	0	0	0	113.7	L564 M580 S581 G582 L588 R589 A604 L609 L612	L564-W585 HydrophobicContact CD1-CD2 3.76Å; L564-W585 HydrophobicContact CD1-CE3 3.92Å; L564-W585 HydrophobicContact CD1-CG 4.35Å; L564-W585 HydrophobicContact CD1-CH2 4.02Å; L564-W585 HydrophobicContact CD1-CZ2 3.87Å; L564-W585 HydrophobicContact CD1-CZ3 4.04Å; L564-W585 HydrophobicContact CD2-CD2 4.24Å; L564-W585 HydrophobicContact CD2-CG 4.16Å; M580-W585 HydrophobicContact SD-CZ2 4.15Å; S581-W585 PolarHBondContact O-N 3.04Å; G582-W585 PolarHBondContact O-N 2.87Å; W585-L588 HydrophobicContact CE3-CD2 3.88Å; W585-L588 HydrophobicContact CZ3-CD2 3.79Å; W585-R589 WeakPolarHBondContact O-CG 3.47Å; W585-R589 PolarHBondContact O-N 3.48Å; W585-R589 PolarHBondContact O-NE 2.83Å; W585-A604 HydrophobicContact CE3-CB 4.33Å; W585-A604 HydrophobicContact CZ3-CB 4.1Å; W585-L609 HydrophobicContact CH2-CB 4.04Å; W585-L609 HydrophobicContact CH2-CD1 4.27Å; W585-L609 HydrophobicContact CZ2-CB 4.25Å; W585-L612 HydrophobicContact CH2-CD1 4.1Å; W585-L612 HydrophobicContact CZ3-CD1 3.75Å
586	A	89.8	Confident	80.9	Confident	35 Å²	35	45.9 Å²	45.9	29%	0.289	26%	0.258	S	S	.	.	H	α-helix	trans	-71.4	-51	172.7	0	0	0	0	0	111.1	G582 N583 I584 L588 R589 I590	G582-A586 WeakPolarHBondContact O-CB 3.43Å; G582-A586 PolarHBondContact O-N 3.27Å; N583-A586 PolarHBondContact O-N 3.27Å; I584-A586 VanDerWaalsContact C-N 3.32Å; I584-A586 PolarHBondContact O-N 3.07Å; A586-L588 VanDerWaalsContact C-N 3.34Å; A586-L588 PolarHBondContact O-N 2.79Å; A586-R589 PolarHBondContact O-N 3.16Å; A586-R589 VanDerWaalsContact O-N 3.11Å; A586-I590 WeakPolarHBondContact O-CG1 3.44Å; A586-I590 PolarHBondContact O-N 3.31Å
587	A	90.7	Very high	83	Confident	4 Å²	4	47.2 Å²	47.2	3%	0.033	26%	0.259	C	S	.	.	H	α-helix	trans	-63.5	-36.7	179.5	0	0	0	0	0	113	Y541 I545 F560 N583 I584 R589 I590 A591	Y541-A587 HydrophobicContact CD2-CB 4.48Å; Y541-A587 HydrophobicContact CE2-CB 3.75Å; I545-A587 HydrophobicContact CD1-CB 3.93Å; F560-A587 HydrophobicContact CD1-CB 4.14Å; F560-A587 HydrophobicContact CD2-CB 4.33Å; F560-A587 HydrophobicContact CE1-CB 3.62Å; F560-A587 HydrophobicContact CE2-CB 3.86Å; F560-A587 HydrophobicContact CG-CB 4.47Å; F560-A587 HydrophobicContact CZ-CB 3.48Å; F560-A587 VanDerWaalsContact CZ-CB 3.48Å; N583-A587 PolarHBondContact O-N 3.28Å; I584-A587 PolarHBondContact O-N 2.79Å; A587-R589 PolarHBondContact O-N 3.32Å; A587-I590 PolarHBondContact O-N 3.48Å; A587-A591 PolarHBondContact O-N 3.44Å
588	L	94.4	Very high	85	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-60.5	-42.9	171.3	177.1	57.9	0	0	0	112.3	A557 F560 L561 L564 I584 W585 A586 I590 A591 L592 L612	A557-L588 HydrophobicContact CB-CD1 3.83Å; F560-L588 HydrophobicContact CB-CB 3.89Å; F560-L588 HydrophobicContact CB-CD1 4.23Å; F560-L588 HydrophobicContact CD2-CB 4.26Å; F560-L588 HydrophobicContact CG-CB 4.35Å; L561-L588 HydrophobicContact CD2-CD1 4.26Å; L561-L588 HydrophobicContact CD2-CD2 3.59Å; L561-L588 HydrophobicContact CG-CD1 3.97Å; L561-L588 HydrophobicContact CG-CD2 4.14Å; L564-L588 HydrophobicContact CD1-CD2 3.68Å; I584-L588 VanDerWaalsContact O-CB 3.23Å; I584-L588 WeakPolarHBondContact O-CB 3.05Å; I584-L588 PolarHBondContact O-N 3.31Å; W585-L588 HydrophobicContact CE3-CD2 3.88Å; W585-L588 HydrophobicContact CZ3-CD2 3.79Å; A586-L588 VanDerWaalsContact C-N 3.34Å; A586-L588 PolarHBondContact O-N 2.79Å; L588-I590 VanDerWaalsContact C-N 3.34Å; L588-I590 PolarHBondContact O-N 3.22Å; L588-A591 PolarHBondContact O-N 2.9Å; L588-L592 HydrophobicContact CD1-CD1 3.84Å; L588-L592 HydrophobicContact CD1-CG 3.95Å; L588-L592 HydrophobicContact CG-CD1 3.88Å; L588-L592 HydrophobicContact CG-CG 4.39Å; L588-L592 WeakPolarHBondContact O-CB 3.3Å; L588-L592 VanDerWaalsContact O-CG 3.28Å; L588-L592 WeakPolarHBondContact O-CG 3.38Å; L588-L592 PolarHBondContact O-N 2.89Å; L588-L612 HydrophobicContact CD2-CD1 4.29Å
589	R	92.7	Very high	86.8	Confident	58 Å²	58	48.9 Å²	48.9	22%	0.219	27%	0.274	C	S	.	.	H	α-helix	trans	-66.6	-35.4	177.3	-78.6	179.1	-69.4	172.4	0.2	112.5	W585 A586 A587 S593 F601 A604 N605	W585-R589 WeakPolarHBondContact O-CG 3.47Å; W585-R589 PolarHBondContact O-N 3.48Å; W585-R589 PolarHBondContact O-NE 2.83Å; A586-R589 PolarHBondContact O-N 3.16Å; A586-R589 VanDerWaalsContact O-N 3.11Å; A587-R589 PolarHBondContact O-N 3.32Å; R589-S593 WeakPolarHBondContact O-CB 3.5Å; R589-S593 PolarHBondContact O-N 3.31Å; R589-F601 HydrophobicContact CB-CD2 4.16Å; R589-F601 HydrophobicContact CB-CE2 3.88Å; R589-F601 HydrophobicContact CG-CD2 4.36Å; R589-F601 HydrophobicContact CG-CE2 4.31Å; R589-F601 WeakPolarHBondContact O-CD2 3.33Å; R589-A604 HydrophobicContact CG-CB 3.62Å; R589-N605 WeakPolarHBondContact CD-OD1 3.08Å; R589-N605 PolarHBondContact NH1-OD1 3.44Å; R589-N605 VanDerWaalsContact NH1-OD1 3.07Å
590	I	89.4	Confident	88.4	Confident	39 Å²	39	43.6 Å²	43.6	20%	0.2	24%	0.242	C	C	.	.	H	α-helix	trans	-61	-52.7	170.3	-61.2	166.7	0	0	0	109.6	I548 A586 A587 L588 L592 S593 M594	I548-I590 HydrophobicContact CD1-CG2 4.23Å; A586-I590 WeakPolarHBondContact O-CG1 3.44Å; A586-I590 PolarHBondContact O-N 3.31Å; A587-I590 PolarHBondContact O-N 3.48Å; L588-I590 VanDerWaalsContact C-N 3.34Å; L588-I590 PolarHBondContact O-N 3.22Å; I590-L592 VanDerWaalsContact C-N 3.34Å; I590-L592 PolarHBondContact O-N 3.22Å; I590-S593 WeakPolarHBondContact O-CB 3.37Å; I590-S593 PolarHBondContact O-N 2.97Å; I590-S593 VanDerWaalsContact O-N 3.13Å; I590-M594 HydrophobicContact CG2-CE 4.17Å; I590-M594 HydrophobicContact CG2-CG 4.35Å; I590-M594 VanDerWaalsContact O-CG 3.27Å; I590-M594 WeakPolarHBondContact O-CG 3.1Å; I590-M594 PolarHBondContact O-N 3.36Å
591	A	92.7	Very high	89.1	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-58.9	-40.8	-179.9	0	0	0	0	0	113.1	I548 A556 A557 F560 A587 L588 M594 M595	I548-A591 HydrophobicContact CD1-CB 4.36Å; I548-A591 HydrophobicContact CG1-CB 4.45Å; A556-A591 HydrophobicContact CB-CB 4.1Å; A557-A591 HydrophobicContact CB-CB 4.06Å; F560-A591 HydrophobicContact CD2-CB 4.32Å; F560-A591 HydrophobicContact CE2-CB 4.13Å; A587-A591 PolarHBondContact O-N 3.44Å; L588-A591 PolarHBondContact O-N 2.9Å; A591-M594 PolarHBondContact O-N 2.77Å; A591-M595 VanDerWaalsContact O-CG 3.27Å; A591-M595 WeakPolarHBondContact O-CG 3.41Å; A591-M595 PolarHBondContact O-N 2.88Å
592	L	92.3	Very high	89.6	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-70.3	-31	177	-67.1	171.4	0	0	0	113.3	A557 L588 I590 M595 Q597 L600 F601 A604 L612 F616	A557-L592 HydrophobicContact CB-CD2 4.22Å; L588-L592 HydrophobicContact CD1-CD1 3.84Å; L588-L592 HydrophobicContact CD1-CG 3.95Å; L588-L592 HydrophobicContact CG-CD1 3.88Å; L588-L592 HydrophobicContact CG-CG 4.39Å; L588-L592 WeakPolarHBondContact O-CB 3.3Å; L588-L592 VanDerWaalsContact O-CG 3.28Å; L588-L592 WeakPolarHBondContact O-CG 3.38Å; L588-L592 PolarHBondContact O-N 2.89Å; I590-L592 VanDerWaalsContact C-N 3.34Å; I590-L592 PolarHBondContact O-N 3.22Å; L592-M595 HydrophobicContact CD2-SD 4.36Å; L592-M595 PolarHBondContact O-N 2.93Å; L592-Q597 PolarHBondContact O-N 3.2Å; L592-L600 HydrophobicContact CD1-CB 4.27Å; L592-L600 HydrophobicContact CD2-CB 3.93Å; L592-L600 HydrophobicContact CD2-CD1 4.28Å; L592-F601 HydrophobicContact CB-CB 4.46Å; L592-A604 HydrophobicContact CD1-CB 3.74Å; L592-L612 HydrophobicContact CD1-CD2 3.9Å; L592-F616 HydrophobicContact CD2-CE2 3.85Å; L592-F616 HydrophobicContact CD2-CZ 3.79Å
593	S	90.4	Very high	90	Very high	39 Å²	39	48 Å²	48	27%	0.273	25%	0.247	S	C	.	.	H	α-helix	trans	-65.5	-46.7	170.3	-172.4	0	0	0	0	110.9	R589 I590 M595 D596	R589-S593 WeakPolarHBondContact O-CB 3.5Å; R589-S593 PolarHBondContact O-N 3.31Å; I590-S593 WeakPolarHBondContact O-CB 3.37Å; I590-S593 PolarHBondContact O-N 2.97Å; I590-S593 VanDerWaalsContact O-N 3.13Å; S593-M595 PolarHBondContact O-N 2.79Å; S593-M595 VanDerWaalsContact O-N 3.13Å; S593-D596 PolarHBondContact O-N 2.84Å
594	M	87.3	Confident	90.2	Very high	30 Å²	30	44.5 Å²	44.5	15%	0.148	23%	0.23	C	C	.	.	H	α-helix	trans	-63.6	-15.8	176.3	-61.8	-69.8	172	0	0	114	F267 W268 M271 H553 I590 A591	F267-M594 HydrophobicContact CE1-CE 3.83Å; F267-M594 HydrophobicContact CE1-SD 3.58Å; F267-M594 VanDerWaalsContact CE1-SD 3.58Å; F267-M594 HydrophobicContact CZ-CE 4.16Å; F267-M594 HydrophobicContact CZ-SD 3.77Å; W268-M594 HydrophobicContact CE3-CE 4.18Å; W268-M594 HydrophobicContact CH2-CE 3.33Å; W268-M594 HydrophobicContact CH2-SD 4.17Å; W268-M594 HydrophobicContact CZ2-CE 4.04Å; W268-M594 HydrophobicContact CZ2-SD 4.42Å; W268-M594 HydrophobicContact CZ3-CE 3.41Å; W268-M594 VanDerWaalsContact CZ3-CE 3.41Å; M271-M594 HydrophobicContact CE-CE 4.23Å; H553-M594 HydrophobicContact CB-CB 4.11Å; I590-M594 HydrophobicContact CG2-CE 4.17Å; I590-M594 HydrophobicContact CG2-CG 4.35Å; I590-M594 VanDerWaalsContact O-CG 3.27Å; I590-M594 WeakPolarHBondContact O-CG 3.1Å; I590-M594 PolarHBondContact O-N 3.36Å; A591-M594 PolarHBondContact O-N 2.77Å
595	M	91.9	Very high	89.9	Confident	29 Å²	29	47.6 Å²	47.6	14%	0.143	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.7	0	174.2	-67.7	172.6	64.3	0	0	113.8	H553 R554 A557 A591 L592 S593 Q597 F616	H553-M595 HydrophobicContact CB-CG 3.66Å; H553-M595 HydrophobicContact CB-SD 4.49Å; R554-M595 HydrophobicContact CB-CE 3.97Å; R554-M595 HydrophobicContact CB-SD 4.28Å; R554-M595 HydrophobicContact CG-CE 4.28Å; A557-M595 HydrophobicContact CB-SD 4.09Å; A591-M595 VanDerWaalsContact O-CG 3.27Å; A591-M595 WeakPolarHBondContact O-CG 3.41Å; A591-M595 PolarHBondContact O-N 2.88Å; L592-M595 HydrophobicContact CD2-SD 4.36Å; L592-M595 PolarHBondContact O-N 2.93Å; S593-M595 PolarHBondContact O-N 2.79Å; S593-M595 VanDerWaalsContact O-N 3.13Å; M595-Q597 VanDerWaalsContact C-N 3.32Å; M595-Q597 HydrophobicContact CB-CG 3.7Å; M595-Q597 HydrophobicContact CE-CG 4.3Å; M595-Q597 WeakPolarHBondContact O-CG 3.45Å; M595-Q597 PolarHBondContact O-N 2.73Å; M595-Q597 PolarHBondContact O-NE2 3.12Å; M595-F616 HydrophobicContact CE-CE1 4.07Å; M595-F616 HydrophobicContact CE-CZ 3.79Å; M595-F616 HydrophobicContact SD-CE1 4.34Å; M595-F616 HydrophobicContact SD-CZ 3.97Å
596	D	90.4	Very high	89.8	Confident	131 Å²	131	51.7 Å²	51.7	70%	0.701	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.7	50.5	-170	-168.1	25.4	0	0	0	112.6	S593 P598	S593-D596 PolarHBondContact O-N 2.84Å; D596-P598 VanDerWaalsContact C-CD 3.41Å; D596-P598 WeakPolarHBondContact O-CD 3.4Å
597	Q	83.4	Confident	89.6	Confident	76 Å²	76	51.8 Å²	51.8	36%	0.355	27%	0.273	S	S	.	.			trans	-112.8	72.9	179.9	-59.5	-58.6	-74.5	0	0	111.1	L592 M595 E599 L600 F601	L592-Q597 PolarHBondContact O-N 3.2Å; M595-Q597 VanDerWaalsContact C-N 3.32Å; M595-Q597 HydrophobicContact CB-CG 3.7Å; M595-Q597 HydrophobicContact CE-CG 4.3Å; M595-Q597 WeakPolarHBondContact O-CG 3.45Å; M595-Q597 PolarHBondContact O-N 2.73Å; M595-Q597 PolarHBondContact O-NE2 3.12Å; Q597-E599 VanDerWaalsContact C-N 3.28Å; Q597-E599 PolarHBondContact O-N 3.4Å; Q597-L600 HydrophobicContact CB-CB 3.98Å; Q597-L600 HydrophobicContact CB-CD1 3.95Å; Q597-L600 HydrophobicContact CB-CG 4.04Å; Q597-L600 HydrophobicContact CG-CD1 4.16Å; Q597-L600 PolarHBondContact O-N 3.48Å; Q597-L600 VanDerWaalsContact O-N 3.08Å; Q597-F601 PolarHBondContact O-N 3.27Å
598	P	87.4	Confident	89.5	Confident	88 Å²	88	54.1 Å²	54.1	57%	0.571	29%	0.285	S	S	*	.	H	α-helix	trans	-60.9	-32.9	-172.6	23.3	-34.4	0	0	0	113.7	D596 Q602	D596-P598 VanDerWaalsContact C-CD 3.41Å; D596-P598 WeakPolarHBondContact O-CD 3.4Å; P598-Q602 WeakPolarHBondContact O-CB 3.3Å; P598-Q602 PolarHBondContact O-N 3.28Å
599	E	90.6	Very high	89.3	Confident	167 Å²	167	54.3 Å²	54.3	78%	0.78	29%	0.286	S	S	*	.	H	α-helix	trans	-65.6	-41.9	176.1	-61	-177.1	174	0	0	111.9	Q597 Q602 A603	Q597-E599 VanDerWaalsContact C-N 3.28Å; Q597-E599 PolarHBondContact O-N 3.4Å; E599-Q602 PolarHBondContact O-N 2.82Å; E599-A603 PolarHBondContact O-N 2.82Å
600	L	92	Very high	89.2	Confident	22 Å²	22	54.8 Å²	54.8	12%	0.115	29%	0.293	C	S	.	.	H	α-helix	trans	-74.9	-38	178	-55	-175.8	0	0	0	111.1	L592 Q597 Q602 A603 A604 L611 L612 A615 F616	L592-L600 HydrophobicContact CD1-CB 4.27Å; L592-L600 HydrophobicContact CD2-CB 3.93Å; L592-L600 HydrophobicContact CD2-CD1 4.28Å; Q597-L600 HydrophobicContact CB-CB 3.98Å; Q597-L600 HydrophobicContact CB-CD1 3.95Å; Q597-L600 HydrophobicContact CB-CG 4.04Å; Q597-L600 HydrophobicContact CG-CD1 4.16Å; Q597-L600 PolarHBondContact O-N 3.48Å; Q597-L600 VanDerWaalsContact O-N 3.08Å; L600-Q602 VanDerWaalsContact C-N 3.27Å; L600-Q602 PolarHBondContact O-N 3.39Å; L600-A603 WeakPolarHBondContact O-CB 3.44Å; L600-A603 PolarHBondContact O-N 3.34Å; L600-A604 WeakPolarHBondContact O-CB 3.27Å; L600-A604 PolarHBondContact O-N 2.78Å; L600-L611 HydrophobicContact CD2-CD2 3.75Å; L600-L612 HydrophobicContact CB-CD2 3.87Å; L600-L612 HydrophobicContact CD2-CD2 4.32Å; L600-L612 WeakPolarHBondContact O-CD2 3.44Å; L600-A615 HydrophobicContact CD1-CB 4.18Å; L600-A615 HydrophobicContact CD2-CB 3.62Å; L600-F616 HydrophobicContact CD1-CE2 3.99Å
601	F	88.4	Confident	89.3	Confident	70 Å²	70	56 Å²	56	31%	0.307	30%	0.3	S	S	.	.	H	α-helix	trans	-58.1	-41.6	171.1	-179.5	-97.3	0	0	0	111.3	R589 L592 Q597 A604 N605	R589-F601 HydrophobicContact CB-CD2 4.16Å; R589-F601 HydrophobicContact CB-CE2 3.88Å; R589-F601 HydrophobicContact CG-CD2 4.36Å; R589-F601 HydrophobicContact CG-CE2 4.31Å; R589-F601 WeakPolarHBondContact O-CD2 3.33Å; L592-F601 HydrophobicContact CB-CB 4.46Å; Q597-F601 PolarHBondContact O-N 3.27Å; F601-A604 PolarHBondContact O-N 2.93Å; F601-N605 WeakPolarHBondContact CD1-ND2 3.12Å; F601-N605 WeakPolarHBondContact CE1-ND2 3.3Å; F601-N605 PolarHBondContact O-N 2.97Å; F601-N605 PolarHBondContact O-ND2 2.9Å
602	Q	87.9	Confident	89.3	Confident	109 Å²	109	56 Å²	56	51%	0.509	30%	0.3	S	S	.	.	H	α-helix	trans	-67.6	-39.3	174.8	-175	57.1	23.7	0	0	112.5	P598 E599 L600 A604 N605 I606	P598-Q602 WeakPolarHBondContact O-CB 3.3Å; P598-Q602 PolarHBondContact O-N 3.28Å; E599-Q602 PolarHBondContact O-N 2.82Å; L600-Q602 VanDerWaalsContact C-N 3.27Å; L600-Q602 PolarHBondContact O-N 3.39Å; Q602-A604 VanDerWaalsContact C-N 3.29Å; Q602-A604 PolarHBondContact O-N 3.05Å; Q602-N605 PolarHBondContact O-N 3.3Å; Q602-I606 PolarHBondContact O-N 3.1Å
603	A	90.5	Very high	89.3	Confident	4 Å²	4	56.4 Å²	56.4	3%	0.033	30%	0.302	C	S	.	.	H	α-helix	trans	-59.8	-39.1	171.6	0	0	0	0	0	112	E599 L600 I606 G607 D608 L611 L612	E599-A603 PolarHBondContact O-N 2.82Å; L600-A603 WeakPolarHBondContact O-CB 3.44Å; L600-A603 PolarHBondContact O-N 3.34Å; A603-I606 WeakPolarHBondContact O-CG1 3.19Å; A603-I606 PolarHBondContact O-N 3.07Å; A603-G607 PolarHBondContact O-N 3.45Å; A603-D608 HydrophobicContact CB-CB 4.46Å; A603-D608 PolarHBondContact O-N 2.89Å; A603-L611 HydrophobicContact CB-CD1 4.15Å; A603-L611 HydrophobicContact CB-CD2 3.76Å; A603-L611 HydrophobicContact CB-CG 4.4Å; A603-L612 HydrophobicContact CB-CD1 4.47Å; A603-L612 HydrophobicContact CB-CD2 4.07Å; A603-L612 HydrophobicContact CB-CG 4.04Å
604	A	89.1	Confident	89.4	Confident	4 Å²	4	61.9 Å²	61.9	3%	0.033	32%	0.317	C	S	.	.	H	α-helix	trans	-72	-27.3	176.2	0	0	0	0	0	113.6	W585 R589 L592 L600 F601 Q602 G607 L612	W585-A604 HydrophobicContact CE3-CB 4.33Å; W585-A604 HydrophobicContact CZ3-CB 4.1Å; R589-A604 HydrophobicContact CG-CB 3.62Å; L592-A604 HydrophobicContact CD1-CB 3.74Å; L600-A604 WeakPolarHBondContact O-CB 3.27Å; L600-A604 PolarHBondContact O-N 2.78Å; F601-A604 PolarHBondContact O-N 2.93Å; Q602-A604 VanDerWaalsContact C-N 3.29Å; Q602-A604 PolarHBondContact O-N 3.05Å; A604-G607 PolarHBondContact O-N 2.86Å; A604-L612 HydrophobicContact CB-CD1 3.93Å
605	N	85.7	Confident	89.6	Confident	64 Å²	64	62.5 Å²	62.5	34%	0.342	33%	0.326	S	S	.	.	H	α-helix	trans	-71.7	-27	171.6	-77.3	-39.7	0	0	0	113.5	R589 F601 Q602	R589-N605 WeakPolarHBondContact CD-OD1 3.08Å; R589-N605 PolarHBondContact NH1-OD1 3.44Å; R589-N605 VanDerWaalsContact NH1-OD1 3.07Å; F601-N605 WeakPolarHBondContact CD1-ND2 3.12Å; F601-N605 WeakPolarHBondContact CE1-ND2 3.3Å; F601-N605 PolarHBondContact O-N 2.97Å; F601-N605 PolarHBondContact O-ND2 2.9Å; Q602-N605 PolarHBondContact O-N 3.3Å
606	I	87.8	Confident	89.7	Confident	116 Å²	116	62 Å²	62	60%	0.595	32%	0.323	S	S	*	.	H	α-helix	trans	-94.9	-4.1	174.3	66.6	173.8	0	0	0	113.5	Q602 A603 D608	Q602-I606 PolarHBondContact O-N 3.1Å; A603-I606 WeakPolarHBondContact O-CG1 3.19Å; A603-I606 PolarHBondContact O-N 3.07Å; I606-D608 HydrophobicContact CD1-CB 4.11Å; I606-D608 HydrophobicContact CG1-CB 4.05Å
607	G	86.5	Confident	89.7	Confident	37 Å²	37	62.5 Å²	62.5	38%	0.381	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.5	20.4	-179.8	0	0	0	0	0	115.3	A603 A604 L609	A603-G607 PolarHBondContact O-N 3.45Å; A604-G607 PolarHBondContact O-N 2.86Å; G607-L609 VanDerWaalsContact C-N 3.27Å; G607-L609 PolarHBondContact O-N 3.37Å
608	D	89.3	Confident	89.8	Confident	54 Å²	54	60.2 Å²	60.2	29%	0.289	32%	0.316	S	S	.	.			trans	-75.7	79.2	179	-171.3	-12.7	0	0	0	111.1	A603 I606 D610 L611 L612	A603-D608 HydrophobicContact CB-CB 4.46Å; A603-D608 PolarHBondContact O-N 2.89Å; I606-D608 HydrophobicContact CD1-CB 4.11Å; I606-D608 HydrophobicContact CG1-CB 4.05Å; D608-D610 PolarHBondContact O-N 2.81Å; D608-D610 PolarHBondContact OD1-N 3.31Å; D608-L611 HydrophobicContact CB-CB 4.25Å; D608-L611 VanDerWaalsContact CG-CB 3.41Å; D608-L611 WeakPolarHBondContact OD1-CB 3.29Å; D608-L611 PolarHBondContact OD1-N 3.43Å; D608-L611 WeakPolarHBondContact OD2-CB 3.5Å; D608-L612 WeakPolarHBondContact O-CD1 3.38Å; D608-L612 VanDerWaalsContact O-CG 3.29Å; D608-L612 WeakPolarHBondContact O-CG 3.09Å; D608-L612 PolarHBondContact O-N 3.38Å
609	L	90.1	Very high	89	Confident	4 Å²	4	62.4 Å²	62.4	2%	0.021	32%	0.323	C	S	.	.	H	α-helix	trans	-63.2	-28.2	177.9	-174.1	60.1	0	0	0	112.3	L561 L564 R568 M580 W585 G607 L612 M613	L561-L609 HydrophobicContact CD2-CD1 3.57Å; L564-L609 HydrophobicContact CB-CD1 3.9Å; L564-L609 HydrophobicContact CB-CD2 3.94Å; L564-L609 HydrophobicContact CD1-CD1 4.13Å; R568-L609 HydrophobicContact CB-CD2 4.46Å; M580-L609 HydrophobicContact CE-CD2 4.02Å; M580-L609 HydrophobicContact SD-CD2 3.97Å; W585-L609 HydrophobicContact CH2-CB 4.04Å; W585-L609 HydrophobicContact CH2-CD1 4.27Å; W585-L609 HydrophobicContact CZ2-CB 4.25Å; G607-L609 VanDerWaalsContact C-N 3.27Å; G607-L609 PolarHBondContact O-N 3.37Å; L609-L612 PolarHBondContact O-N 2.87Å; L609-M613 HydrophobicContact CD1-CG 3.9Å; L609-M613 HydrophobicContact CD1-SD 4.4Å; L609-M613 HydrophobicContact CG-CG 3.95Å; L609-M613 VanDerWaalsContact O-CB 3.3Å; L609-M613 WeakPolarHBondContact O-CB 3.28Å; L609-M613 WeakPolarHBondContact O-CG 3.34Å; L609-M613 PolarHBondContact O-N 3.28Å
610	D	89.5	Confident	87.3	Confident	68 Å²	68	63.4 Å²	63.4	36%	0.364	33%	0.325	S	S	.	.	H	α-helix	trans	-77.7	-36.3	-177.3	-69.9	-54	0	0	0	112.9	R568 D608 L612 R614	R568-D610 IonicContact CZ-OD1 2.72Å; R568-D610 IonicContact CZ-OD2 2.71Å; R568-D610 IonicContact NH1-OD1 3.15Å; R568-D610 PolarHBondContact NH1-OD1 3.02Å; R568-D610 IonicContact NH1-OD2 2.77Å; R568-D610 PolarHBondContact NH1-OD2 2.89Å; R568-D610 IonicContact NH2-OD1 2.65Å; R568-D610 PolarHBondContact NH2-OD1 3.35Å; D608-D610 PolarHBondContact O-N 2.81Å; D608-D610 PolarHBondContact OD1-N 3.31Å; D610-L612 VanDerWaalsContact C-N 3.33Å; D610-R614 VanDerWaalsContact CB-NH2 3.34Å; D610-R614 WeakPolarHBondContact O-CB 3.44Å; D610-R614 VanDerWaalsContact O-CG 3.26Å; D610-R614 WeakPolarHBondContact O-CG 3.39Å; D610-R614 PolarHBondContact O-N 3.05Å; D610-R614 PolarHBondContact O-NE 2.93Å
611	L	91.1	Very high	87	Confident	63 Å²	63	65.5 Å²	65.5	33%	0.33	34%	0.336	S	S	.	.	H	α-helix	trans	-61	-46.2	168.3	-174.8	164.2	0	0	0	110.2	L600 A603 D608 R614 A615	L600-L611 HydrophobicContact CD2-CD2 3.75Å; A603-L611 HydrophobicContact CB-CD1 4.15Å; A603-L611 HydrophobicContact CB-CD2 3.76Å; A603-L611 HydrophobicContact CB-CG 4.4Å; D608-L611 HydrophobicContact CB-CB 4.25Å; D608-L611 VanDerWaalsContact CG-CB 3.41Å; D608-L611 WeakPolarHBondContact OD1-CB 3.29Å; D608-L611 PolarHBondContact OD1-N 3.43Å; D608-L611 WeakPolarHBondContact OD2-CB 3.5Å; L611-R614 PolarHBondContact O-N 3.42Å; L611-A615 WeakPolarHBondContact O-CB 3.32Å; L611-A615 PolarHBondContact O-N 3.46Å
612	L	92.8	Very high	86.9	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-66.3	-45.6	-178	-68.7	165.5	0	0	0	113.2	L561 W585 L588 L592 L600 A603 A604 D608 L609 D610 R614 A615 F616	L561-L612 HydrophobicContact CD1-CB 4.31Å; L561-L612 HydrophobicContact CD2-CB 3.53Å; L561-L612 HydrophobicContact CD2-CD1 4.16Å; L561-L612 HydrophobicContact CD2-CG 4.4Å; W585-L612 HydrophobicContact CH2-CD1 4.1Å; W585-L612 HydrophobicContact CZ3-CD1 3.75Å; L588-L612 HydrophobicContact CD2-CD1 4.29Å; L592-L612 HydrophobicContact CD1-CD2 3.9Å; L600-L612 HydrophobicContact CB-CD2 3.87Å; L600-L612 HydrophobicContact CD2-CD2 4.32Å; L600-L612 WeakPolarHBondContact O-CD2 3.44Å; A603-L612 HydrophobicContact CB-CD1 4.47Å; A603-L612 HydrophobicContact CB-CD2 4.07Å; A603-L612 HydrophobicContact CB-CG 4.04Å; A604-L612 HydrophobicContact CB-CD1 3.93Å; D608-L612 WeakPolarHBondContact O-CD1 3.38Å; D608-L612 VanDerWaalsContact O-CG 3.29Å; D608-L612 WeakPolarHBondContact O-CG 3.09Å; D608-L612 PolarHBondContact O-N 3.38Å; L609-L612 PolarHBondContact O-N 2.87Å; D610-L612 VanDerWaalsContact C-N 3.33Å; L612-R614 VanDerWaalsContact C-N 3.33Å; L612-R614 PolarHBondContact O-N 3.08Å; L612-A615 PolarHBondContact O-N 2.99Å; L612-A615 VanDerWaalsContact O-N 3.16Å; L612-F616 WeakPolarHBondContact O-CD2 3.36Å; L612-F616 PolarHBondContact O-N 3.05Å
613	M	92.7	Very high	86.9	Confident	9 Å²	9	62.8 Å²	62.8	4%	0.044	33%	0.327	C	S	.	.	H	α-helix	trans	-59.6	-44.6	177.1	-71.9	-74.7	-80.5	0	0	110.9	L561 L609 A615 F616 N617 L618 F620	L561-M613 HydrophobicContact CB-SD 3.83Å; L609-M613 HydrophobicContact CD1-CG 3.9Å; L609-M613 HydrophobicContact CD1-SD 4.4Å; L609-M613 HydrophobicContact CG-CG 3.95Å; L609-M613 VanDerWaalsContact O-CB 3.3Å; L609-M613 WeakPolarHBondContact O-CB 3.28Å; L609-M613 WeakPolarHBondContact O-CG 3.34Å; L609-M613 PolarHBondContact O-N 3.28Å; M613-A615 PolarHBondContact O-N 3.29Å; M613-F616 PolarHBondContact O-N 3.42Å; M613-N617 PolarHBondContact O-N 3.11Å; M613-L618 HydrophobicContact CB-CB 4.47Å; M613-L618 HydrophobicContact CE-CB 3.87Å; M613-L618 VanDerWaalsContact CE-O 3.32Å; M613-L618 WeakPolarHBondContact CE-O 3.43Å; M613-L618 PolarHBondContact O-N 2.59Å; M613-L618 HydrophobicContact SD-CB 3.84Å; M613-L618 HydrophobicContact SD-CD1 4.03Å; M613-F620 HydrophobicContact CE-CD2 4.07Å
614	R	92.4	Very high	86.7	Confident	155 Å²	155	66.3 Å²	66.3	59%	0.585	35%	0.345	S	S	*	.	H	α-helix	trans	-60.8	-42.6	173.2	-71.8	-179.3	-123.6	125.2	-2.9	112.6	D610 L611 L612 F616 N617	D610-R614 VanDerWaalsContact CB-NH2 3.34Å; D610-R614 WeakPolarHBondContact O-CB 3.44Å; D610-R614 VanDerWaalsContact O-CG 3.26Å; D610-R614 WeakPolarHBondContact O-CG 3.39Å; D610-R614 PolarHBondContact O-N 3.05Å; D610-R614 PolarHBondContact O-NE 2.93Å; L611-R614 PolarHBondContact O-N 3.42Å; L612-R614 VanDerWaalsContact C-N 3.33Å; L612-R614 PolarHBondContact O-N 3.08Å; R614-F616 PolarHBondContact O-N 3.35Å; R614-N617 PolarHBondContact O-N 3.24Å
615	A	92.3	Very high	86.5	Confident	42 Å²	42	70.2 Å²	70.2	35%	0.347	36%	0.364	S	S	.	.	H	α-helix	trans	-63.7	-21.2	179.4	0	0	0	0	0	113.9	L600 L611 L612 M613	L600-A615 HydrophobicContact CD1-CB 4.18Å; L600-A615 HydrophobicContact CD2-CB 3.62Å; L611-A615 WeakPolarHBondContact O-CB 3.32Å; L611-A615 PolarHBondContact O-N 3.46Å; L612-A615 PolarHBondContact O-N 2.99Å; L612-A615 VanDerWaalsContact O-N 3.16Å; M613-A615 PolarHBondContact O-N 3.29Å
616	F	93.1	Very high	86.6	Confident	19 Å²	19	70.6 Å²	70.6	8%	0.083	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.3	2.9	174.7	-77.6	-106.2	0	0	0	113.6	R554 A557 L561 L592 M595 L600 L612 M613 R614 L618	R554-F616 HydrophobicContact CG-CD1 4.44Å; R554-F616 HydrophobicContact CG-CE1 4.04Å; A557-F616 HydrophobicContact CB-CE1 3.59Å; A557-F616 HydrophobicContact CB-CE2 4.44Å; A557-F616 HydrophobicContact CB-CZ 3.47Å; A557-F616 VanDerWaalsContact CB-CZ 3.47Å; L561-F616 HydrophobicContact CD1-CB 4.12Å; L561-F616 HydrophobicContact CD1-CD1 4.29Å; L561-F616 HydrophobicContact CD1-CD2 3.44Å; L561-F616 VanDerWaalsContact CD1-CD2 3.44Å; L561-F616 HydrophobicContact CD1-CE2 3.85Å; L561-F616 HydrophobicContact CD1-CG 3.69Å; L561-F616 HydrophobicContact CD1-CZ 4.44Å; L592-F616 HydrophobicContact CD2-CE2 3.85Å; L592-F616 HydrophobicContact CD2-CZ 3.79Å; M595-F616 HydrophobicContact CE-CE1 4.07Å; M595-F616 HydrophobicContact CE-CZ 3.79Å; M595-F616 HydrophobicContact SD-CE1 4.34Å; M595-F616 HydrophobicContact SD-CZ 3.97Å; L600-F616 HydrophobicContact CD1-CE2 3.99Å; L612-F616 WeakPolarHBondContact O-CD2 3.36Å; L612-F616 PolarHBondContact O-N 3.05Å; M613-F616 PolarHBondContact O-N 3.42Å; R614-F616 PolarHBondContact O-N 3.35Å; F616-L618 VanDerWaalsContact C-N 3.28Å; F616-L618 HydrophobicContact CB-CD1 3.86Å; F616-L618 HydrophobicContact CB-CG 3.84Å; F616-L618 PolarHBondContact O-N 3.49Å
617	N	91.4	Very high	86.5	Confident	142 Å²	142	67.4 Å²	67.4	76%	0.759	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.1	37.1	-172.4	-47.8	-81.2	0	0	0	113.3	M613 R614	M613-N617 PolarHBondContact O-N 3.11Å; R614-N617 PolarHBondContact O-N 3.24Å
618	L	86	Confident	86.5	Confident	28 Å²	28	69.7 Å²	69.7	15%	0.147	35%	0.347	C	S	.	.			trans	-98.4	78.7	178	-60.6	176.6	0	0	0	109.8	L561 M562 M613 F616	L561-L618 HydrophobicContact CB-CD1 3.86Å; L561-L618 HydrophobicContact CD1-CD1 4.28Å; M562-L618 HydrophobicContact CE-CD2 4.36Å; M613-L618 HydrophobicContact CB-CB 4.47Å; M613-L618 HydrophobicContact CE-CB 3.87Å; M613-L618 VanDerWaalsContact CE-O 3.32Å; M613-L618 WeakPolarHBondContact CE-O 3.43Å; M613-L618 PolarHBondContact O-N 2.59Å; M613-L618 HydrophobicContact SD-CB 3.84Å; M613-L618 HydrophobicContact SD-CD1 4.03Å; F616-L618 VanDerWaalsContact C-N 3.28Å; F616-L618 HydrophobicContact CB-CD1 3.86Å; F616-L618 HydrophobicContact CB-CG 3.84Å; F616-L618 PolarHBondContact O-N 3.49Å
619	D	68.9	Low	86.3	Confident	133 Å²	133	71 Å²	71	71%	0.711	35%	0.352	S	S	*	.			trans	-89.4	140.9	174.2	-66.7	-39.2	0	0	0	111.4
620	F	54.9	Low	85.9	Confident	189 Å²	189	77.1 Å²	77.1	83%	0.829	38%	0.382	S	S	*	.			trans	-144.6	0	175.4	-85.4	-76.8	0	0	0	111.5	M562 M613	M562-F620 HydrophobicContact CE-CE2 3.61Å; M562-F620 HydrophobicContact CE-CZ 3.87Å; M562-F620 HydrophobicContact SD-CE2 3.47Å; M562-F620 WeakPolarHBondContact SD-CE2 3.09Å; M562-F620 HydrophobicContact SD-CZ 3.6Å; M613-F620 HydrophobicContact CE-CD2 4.07Å

Retrieved 620 of 620 residues in 557.5 ms (Link to these results)

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