A0A5K4EIQ0_SCHMA Loading...

Putative leukocyte receptor cluster (Lrc) member

AlphaFold DB , UniProt , Accession A0A5K4EIQ0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 597 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	33.9	Very low	34.4	Very low	249 Å²	249	151.2 Å²	151.2	100%	1.227	79%	0.786	S	S	*	*				0	125.9	0	-60.8	158.4	171.9	0	0	107.4
2	A	35	Very low	34	Very low	88 Å²	88	154.2 Å²	154.2	73%	0.727	79%	0.793	S	S	*	*			cis	-158.8	122.3	-22.4	0	0	0	0	0	104.9
3	Q	33.6	Very low	34	Very low	155 Å²	155	148.5 Å²	148.5	72%	0.724	80%	0.796	S	S	*	*				59.1	121.6	109.5	-105.6	179.9	4.6	0	0	113.8
4	W	35	Very low	34.1	Very low	229 Å²	229	144.4 Å²	144.4	87%	0.867	79%	0.793	S	S	*	*			cis	-143.3	174.9	15.8	-65.3	75.3	0	0	0	109.1
5	G	36.5	Very low	34.1	Very low	67 Å²	67	149.7 Å²	149.7	69%	0.691	80%	0.798	S	S	*	*			cis	163.3	145.8	-5.7	0	0	0	0	0	111.5
6	S	35.9	Very low	34.4	Very low	97 Å²	97	147.8 Å²	147.8	68%	0.678	80%	0.797	S	S	*	*			trans	-10.5	144.6	167.4	-80.3	0	0	0	0	119.8
7	Y	33.6	Very low	34.7	Very low	229 Å²	229	143.5 Å²	143.5	90%	0.898	80%	0.796	S	S	*	*			cis	-139.8	177.5	26.5	-82.9	-65.7	0	0	0	111.7
8	G	35.3	Very low	34.7	Very low	60 Å²	60	147.9 Å²	147.9	62%	0.619	80%	0.8	S	S	*	*			cis	-177.6	-144.6	7.2	0	0	0	0	0	114.2
9	S	34	Very low	34.8	Very low	105 Å²	105	152.5 Å²	152.5	73%	0.734	81%	0.807	S	S	*	*			trans	-159.9	172.4	-177.2	-60	0	0	0	0	108
10	Y	32.3	Very low	34.6	Very low	179 Å²	179	151.7 Å²	151.7	70%	0.702	80%	0.802	S	S	*	*			cis	-178.8	164.2	49.7	-124	-53.4	0	0	0	113.7
11	W	33.2	Very low	34.7	Very low	205 Å²	205	155 Å²	155	78%	0.777	81%	0.805	S	S	*	*			trans	82.5	138.3	148.2	-69.4	128	0	0	0	122.9
12	Q	30.1	Very low	34.9	Very low	187 Å²	187	147 Å²	147	87%	0.874	78%	0.78	S	S	*	*			trans	-103.2	153.1	166.9	-64.2	159.5	-39.7	0	0	108.6
13	G	33.5	Very low	35	Very low	81 Å²	81	151.3 Å²	151.3	84%	0.835	79%	0.785	S	S	*	*			trans	-150.9	157.8	173	0	0	0	0	0	109.8
14	A	34.8	Very low	35.2	Very low	90 Å²	90	149.1 Å²	149.1	74%	0.744	78%	0.784	S	S	*	*			trans	-139	149.7	-157.7	0	0	0	0	0	116.7
15	Y	34.4	Very low	35.2	Very low	224 Å²	224	143 Å²	143	88%	0.878	78%	0.782	S	S	*	*			trans	71.3	160.1	154.3	-82.9	-52.5	0	0	0	118.4
16	P	39.9	Very low	35.2	Very low	120 Å²	120	147.1 Å²	147.1	78%	0.779	78%	0.783	S	S	*	*				-126.1	176.8	-122.7	43.6	-30.2	0	0	0	115.3
17	G	39.3	Very low	35.3	Very low	75 Å²	75	149 Å²	149	77%	0.773	79%	0.79	S	S	*	*			trans	-133	144.6	167.7	0	0	0	0	0	112.1
18	Y	33.8	Very low	35.4	Very low	222 Å²	222	146.6 Å²	146.6	87%	0.871	78%	0.781	S	S	*	*			trans	-67.7	139.3	170.7	-109.5	-111.7	0	0	0	110.9
19	Y	36.5	Very low	35.9	Very low	236 Å²	236	149.7 Å²	149.7	93%	0.925	78%	0.783	S	S	*	*			trans	-151.3	135.4	140.2	-93.5	-68.1	0	0	0	110
20	D	31.7	Very low	36.3	Very low	135 Å²	135	153 Å²	153	72%	0.722	78%	0.781	S	S	*	*			trans	-94.8	135.8	172.8	172	28.7	0	0	0	109.3
21	Y	36.9	Very low	37.5	Very low	221 Å²	221	150.3 Å²	150.3	87%	0.867	78%	0.779	S	S	*	*			trans	-162	124.3	160.2	-106.3	-67.5	0	0	0	111.2
22	A	37.7	Very low	37.9	Very low	83 Å²	83	148 Å²	148	69%	0.686	78%	0.776	S	S	*	*			trans	-77.2	134.2	175.7	0	0	0	0	0	112.7
23	Q	37.9	Very low	38.6	Very low	178 Å²	178	147.1 Å²	147.1	83%	0.832	77%	0.772	S	S	*	*			trans	-137.5	138.9	161	-81	-62.7	-67.6	0	0	109.4
24	P	36.2	Very low	38.8	Very low	109 Å²	109	149.8 Å²	149.8	71%	0.708	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-75	152.1	-176.3	31.2	-35.2	0	0	0	112.4	Q26	P24-Q26 PolarHBondContact O-N 3.25Å
25	A	36.6	Very low	39.1	Very low	100 Å²	100	152.5 Å²	152.5	83%	0.826	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-66.9	121.6	179.2	0	0	0	0	0	111.8
26	Q	36.2	Very low	39.5	Very low	153 Å²	153	147 Å²	147	72%	0.715	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-80.2	117	171.1	-67.4	-175	-3.5	0	0	110.4	P24	P24-Q26 PolarHBondContact O-N 3.25Å
27	T	36.6	Very low	39.4	Very low	136 Å²	136	148.2 Å²	148.2	83%	0.834	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-92.8	117.8	168.4	51.7	0	0	0	0	109.5
28	Y	36.6	Very low	39.6	Very low	180 Å²	180	150 Å²	150	71%	0.706	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-78.8	134.3	178.6	-61.5	-77.5	0	0	0	111.8
29	D	46.7	Very low	39.7	Very low	124 Å²	124	144.6 Å²	144.6	66%	0.663	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-87.8	157.8	168.6	-176.3	36.8	0	0	0	111.5	N31 H32	D29-N31 PolarHBondContact O-N 3.2Å; D29-H32 PolarHBondContact O-N 2.98Å
30	Y	42.2	Very low	39.8	Very low	175 Å²	175	139.1 Å²	139.1	69%	0.686	76%	0.756	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.4	-8.2	-163.8	-141.1	-98.5	0	0	0	115.5
31	N	56.8	Low	40.2	Very low	122 Å²	122	140.5 Å²	140.5	65%	0.652	76%	0.758	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.9	2.2	-174.8	-68.8	-54.1	0	0	0	115.1	D29 Q33	D29-N31 PolarHBondContact O-N 3.2Å; N31-Q33 PolarHBondContact O-N 3.02Å
32	H	41.2	Very low	40.3	Very low	157 Å²	157	135.9 Å²	135.9	73%	0.727	75%	0.748	S	S	*	*			trans	54.9	14.9	171.3	-82.4	-77.5	0	0	0	118.2	D29	D29-H32 PolarHBondContact O-N 2.98Å
33	Q	44.5	Very low	40.4	Very low	169 Å²	169	140.4 Å²	140.4	79%	0.79	75%	0.753	S	S	*	*			trans	-78	125.9	177.2	-68	-168.9	1.3	0	0	111.8	N31 I35	N31-Q33 PolarHBondContact O-N 3.02Å; Q33-I35 PolarHBondContact O-N 3.09Å
34	T	38.1	Very low	40.4	Very low	137 Å²	137	137.2 Å²	137.2	84%	0.84	75%	0.747	S	S	*	*			trans	-83.6	108.8	178.7	50.4	0	0	0	0	111.2
35	I	41.5	Very low	40.4	Very low	146 Å²	146	137.2 Å²	137.2	75%	0.749	75%	0.75	S	S	*	*			trans	-99.6	117.6	169.5	-56.2	178.3	0	0	0	108.8	Q33	Q33-I35 PolarHBondContact O-N 3.09Å
36	P	41.7	Very low	40.8	Very low	109 Å²	109	138.6 Å²	138.6	71%	0.708	75%	0.748	S	S	*	*			trans	-75.3	129.7	175.5	30.1	-32.8	0	0	0	110.8	S38	P36-S38 PolarHBondContact O-N 3.49Å
37	V	38.9	Very low	41.5	Very low	146 Å²	146	136.8 Å²	136.8	89%	0.885	75%	0.75	S	S	*	*			trans	-82.6	109.1	175.5	179	0	0	0	0	109.7
38	S	42.6	Very low	42	Very low	113 Å²	113	136 Å²	136	79%	0.79	75%	0.747	S	S	*	*			trans	-109.2	120.4	167.1	-70	0	0	0	0	109.9	P36	P36-S38 PolarHBondContact O-N 3.49Å
39	S	36.3	Very low	43	Very low	108 Å²	108	133.1 Å²	133.1	76%	0.755	75%	0.75	S	S	*	*			trans	-76.9	146	173	55.6	0	0	0	0	112.1
40	V	40	Very low	42.9	Very low	121 Å²	121	133.7 Å²	133.7	73%	0.733	76%	0.76	S	S	*	*			trans	-166.7	125.3	139.1	131.9	0	0	0	0	112.4
41	Q	38.3	Very low	42.9	Very low	164 Å²	164	128.8 Å²	128.8	77%	0.766	76%	0.764	S	S	*	*			trans	43.7	108.3	148.7	-58.6	171.5	-95.4	0	0	123
42	D	39.4	Very low	42.2	Very low	124 Å²	124	129.4 Å²	129.4	66%	0.663	77%	0.771	S	S	*	*				52.2	124.8	112.9	-91.1	-64.6	0	0	0	124
43	K	39.8	Very low	42.1	Very low	178 Å²	178	130.3 Å²	130.3	77%	0.774	78%	0.776	S	S	*	*			trans	85.4	154	132.8	-83.3	177.9	-175.7	95.5	0	120.5
44	P	37.9	Very low	42	Very low	110 Å²	110	126.8 Å²	126.8	71%	0.714	77%	0.77	S	S	*	*				-142	-167.9	-119.3	45.2	-26.1	0	0	0	117.1
45	S	36.7	Very low	42.3	Very low	109 Å²	109	127 Å²	127	76%	0.762	77%	0.771	S	S	*	*			trans	85.4	128.1	155.6	76.6	0	0	0	0	119.9
46	T	43.9	Very low	42.2	Very low	130 Å²	130	126.5 Å²	126.5	80%	0.798	78%	0.775	S	S	*	*			trans	177.2	136.8	131.6	-71.1	0	0	0	0	109.4
47	P	51.5	Low	42.3	Very low	115 Å²	115	127 Å²	127	75%	0.747	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-89.7	173.5	-177	35.9	-36.7	0	0	0	115.2
48	P	46.5	Very low	42.2	Very low	119 Å²	119	127.7 Å²	127.7	77%	0.773	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-101.4	167.2	-164.2	39.4	-36.9	0	0	0	116.7
49	P	58.7	Low	42.4	Very low	120 Å²	120	129.4 Å²	129.4	78%	0.779	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-92.3	168.9	172.6	37.2	-34.6	0	0	0	114.6
50	P	45	Very low	42.6	Very low	135 Å²	135	130.3 Å²	130.3	88%	0.877	77%	0.771	S	S	*	*			trans	-103.2	-178.6	-163.8	41	-36.2	0	0	0	115.6
51	G	40.8	Very low	42.6	Very low	73 Å²	73	128.3 Å²	128.3	75%	0.753	78%	0.775	S	S	*	*			trans	-119	-160	-170.5	0	0	0	0	0	117.5
52	V	43.8	Very low	42.6	Very low	135 Å²	135	128.3 Å²	128.3	82%	0.818	78%	0.78	S	S	*	*			trans	-149.8	119.7	-176.3	-168.6	0	0	0	0	104.9
53	E	39.3	Very low	42.4	Very low	175 Å²	175	127.7 Å²	127.7	82%	0.818	78%	0.78	S	S	*	*				69.3	132.1	65.1	-170.6	166.6	-132.6	0	0	112.8
54	S	40.8	Very low	42.2	Very low	96 Å²	96	126.1 Å²	126.1	67%	0.671	79%	0.786	S	S	*	*			cis	-157.4	160.4	-8	-129.5	0	0	0	0	110.5
55	T	44	Very low	42.1	Very low	140 Å²	140	126.3 Å²	126.3	86%	0.859	79%	0.785	S	S	*	*			trans	174.6	131	133.3	23.4	0	0	0	0	113.6
56	V	39.7	Very low	42	Very low	136 Å²	136	127.6 Å²	127.6	82%	0.824	79%	0.788	S	S	*	*			trans	-152.4	136	169.8	-177	0	0	0	0	109.3
57	P	44.8	Very low	41.7	Very low	119 Å²	119	126.1 Å²	126.1	77%	0.773	78%	0.783	S	S	*	*				-136.7	143.8	126.3	34.6	-22.2	0	0	0	111.4
58	K	37.4	Very low	40.8	Very low	162 Å²	162	126.2 Å²	126.2	70%	0.704	79%	0.787	S	S	*	*			cis	88.2	98.2	33.1	-165.4	-173.8	-177.7	-172.1	0	114	D60	K58-D60 WeakPolarHBondContact CE-OD2 3.22Å; K58-D60 WeakPolarHBondContact CG-OD2 3.49Å
59	V	45.6	Very low	40.5	Very low	149 Å²	149	128.1 Å²	128.1	90%	0.903	79%	0.789	S	S	*	*			trans	-138.9	155.1	157.3	-178.3	0	0	0	0	107.9
60	D	40.4	Very low	39.2	Very low	127 Å²	127	128.2 Å²	128.2	68%	0.679	79%	0.789	S	S	*	*			trans	-132.6	162.3	-152.3	-70.1	-95.2	0	0	0	115.3	K58	K58-D60 WeakPolarHBondContact CE-OD2 3.22Å; K58-D60 WeakPolarHBondContact CG-OD2 3.49Å
61	G	40.4	Very low	38.8	Very low	79 Å²	79	126.6 Å²	126.6	81%	0.814	79%	0.787	S	S	*	*			trans	117.5	148.7	171.7	0	0	0	0	0	115
62	N	38.4	Very low	38.4	Very low	164 Å²	164	129.7 Å²	129.7	88%	0.877	79%	0.792	S	S	*	*			cis	-149.5	168.7	-2	-164.7	9.5	0	0	0	111.3
63	V	35	Very low	37.9	Very low	111 Å²	111	134 Å²	134	67%	0.673	80%	0.795	S	S	*	*			trans	-101.6	147.3	-165.1	175.4	0	0	0	0	113.6	V65	V63-V65 HydrophobicContact CG1-CG2 4.47Å
64	T	36.2	Very low	37.4	Very low	144 Å²	144	132 Å²	132	88%	0.883	79%	0.79	S	S	*	*			trans	-150.7	131.1	143.7	-70.7	0	0	0	0	112.3
65	V	34.7	Very low	37.3	Very low	114 Å²	114	131.4 Å²	131.4	69%	0.691	78%	0.784	S	S	*	*			trans	-70.9	143.5	-172.4	170.6	0	0	0	0	115.3	V63	V63-V65 HydrophobicContact CG1-CG2 4.47Å
66	T	35.4	Very low	36.6	Very low	137 Å²	137	129.1 Å²	129.1	84%	0.84	77%	0.773	S	S	*	*			trans	-153.3	116.2	132.9	-0	0	0	0	0	114.9
67	S	36.9	Very low	36.3	Very low	98 Å²	98	134.8 Å²	134.8	69%	0.685	78%	0.78	S	S	*	*			trans	26.8	112.3	150.1	58.5	0	0	0	0	121
68	S	33.5	Very low	35.6	Very low	118 Å²	118	134.5 Å²	134.5	83%	0.825	78%	0.78	S	S	*	*			trans	-96.9	147.9	151.1	52.8	0	0	0	0	111
69	I	38.8	Very low	35.2	Very low	159 Å²	159	133.1 Å²	133.1	82%	0.815	79%	0.785	S	S	*	*			trans	-136.6	117	168.1	-59.1	179.1	0	0	0	108.1
70	P	32.5	Very low	34.6	Very low	121 Å²	121	131.9 Å²	131.9	79%	0.786	78%	0.783	S	S	*	*			trans	-88.9	144.4	171	34.5	-31.5	0	0	0	111.2
71	A	37.1	Very low	34.5	Very low	101 Å²	101	132 Å²	132	84%	0.835	79%	0.788	S	S	*	*			trans	-139	110.4	170.8	0	0	0	0	0	110.1
72	T	32.2	Very low	34.4	Very low	139 Å²	139	134 Å²	134	85%	0.853	79%	0.787	S	S	*	*			trans	-88.2	124.8	177.5	-55.8	0	0	0	0	110
73	Y	33.1	Very low	34.3	Very low	225 Å²	225	136 Å²	136	88%	0.882	79%	0.788	S	S	*	*			trans	-151.6	128.1	159.8	-146.6	-104.7	0	0	0	112.3
74	D	29.1	Very low	34.3	Very low	132 Å²	132	139 Å²	139	71%	0.706	80%	0.795	S	S	*	*			trans	-104	178.5	171.8	-148.2	23.4	0	0	0	106.8
75	P	38.1	Very low	34.2	Very low	85 Å²	85	137.7 Å²	137.7	55%	0.552	79%	0.791	S	S	*	*			cis	-135.9	179.5	-4.1	40.2	-21.1	0	0	0	115.5
76	S	29.1	Very low	34.3	Very low	91 Å²	91	137.3 Å²	137.3	64%	0.636	79%	0.791	S	S	*	*			trans	36.9	109.6	143.4	67.5	0	0	0	0	120.7
77	W	33.4	Very low	34.3	Very low	256 Å²	256	137.7 Å²	137.7	97%	0.97	79%	0.788	S	S	*	*			trans	-133.9	82	144.7	-84.2	86.7	0	0	0	110.3
78	C	30.9	Very low	34.3	Very low	113 Å²	113	143.5 Å²	143.5	76%	0.764	80%	0.801	S	S	*	*			trans	-98.9	139.5	167.3	-68.9	0	0	0	0	110.3
79	T	29	Very low	34.2	Very low	132 Å²	132	142.1 Å²	142.1	81%	0.81	80%	0.797	S	S	*	*			trans	44	110.7	149.8	-45.4	0	0	0	0	118.6
80	S	32.7	Very low	33.9	Very low	123 Å²	123	141 Å²	141	86%	0.86	80%	0.801	S	S	*	*			trans	-148.2	118.8	151.3	-77.9	0	0	0	0	111.7
81	T	38.8	Very low	33.9	Very low	129 Å²	129	139.2 Å²	139.2	79%	0.791	80%	0.797	S	S	*	*			trans	-74.6	155.2	160.1	40.6	0	0	0	0	109.8
82	P	37.7	Very low	33.8	Very low	122 Å²	122	145.8 Å²	145.8	79%	0.792	80%	0.802	S	S	*	*			trans	-80.7	134	-171.1	31.1	-34.9	0	0	0	113.1
83	F	35.8	Very low	33.9	Very low	206 Å²	206	144.8 Å²	144.8	90%	0.904	80%	0.796	S	S	*	*			trans	-142.9	159.1	160	-121	-89.6	0	0	0	111.4
84	H	35.6	Very low	34.1	Very low	175 Å²	175	145.4 Å²	145.4	81%	0.81	80%	0.798	S	S	*	*			trans	-71	138.9	-167	-66.7	3.7	0	0	0	115.1
85	S	32.8	Very low	34.3	Very low	115 Å²	115	144 Å²	144	80%	0.804	80%	0.799	S	S	*	*				-175.6	158.5	109	-79.3	0	0	0	0	112.5
86	P	38.4	Very low	34.5	Very low	106 Å²	106	145.6 Å²	145.6	69%	0.688	81%	0.809	S	S	*	*			trans	-105.2	174.6	-167.3	40.8	-36.3	0	0	0	115.4
87	N	34.9	Very low	35.1	Very low	146 Å²	146	147.9 Å²	147.9	78%	0.781	82%	0.82	S	S	*	*			trans	66.3	103.4	160.3	-60.7	-17.7	0	0	0	118.7
88	F	36.1	Very low	35.5	Very low	220 Å²	220	141.9 Å²	141.9	97%	0.965	81%	0.811	S	S	*	*				-150.1	147.8	119	-115	-78.4	0	0	0	109.7
89	A	31.6	Very low	36.6	Very low	88 Å²	88	142 Å²	142	73%	0.727	81%	0.81	S	S	*	*			trans	-116.9	137.7	-174.9	0	0	0	0	0	111.7
90	C	33.5	Very low	37.1	Very low	135 Å²	135	140.8 Å²	140.8	91%	0.912	81%	0.805	S	S	*	*			trans	-130.7	132.2	159.6	-80.5	0	0	0	0	108.1
91	A	32.1	Very low	37.5	Very low	84 Å²	84	145.5 Å²	145.5	69%	0.694	80%	0.804	S	S	*	*			trans	-106.5	147	-177.2	0	0	0	0	0	111.2
92	Y	34.9	Very low	37.5	Very low	240 Å²	240	147.7 Å²	147.7	94%	0.941	81%	0.805	S	S	*	*			trans	-126.1	119.8	154.3	-85.4	-76.9	0	0	0	109
93	T	33.7	Very low	37.6	Very low	117 Å²	117	147.4 Å²	147.4	72%	0.718	80%	0.803	S	S	*	*			trans	-97.1	135.4	-174.8	48.2	0	0	0	0	111.5
94	Y	37.2	Very low	37.9	Very low	238 Å²	238	144 Å²	144	93%	0.933	80%	0.799	S	S	*	*			trans	-142.1	125.6	146.9	-114.2	-84.7	0	0	0	109.1
95	S	33.8	Very low	37.9	Very low	104 Å²	104	143.8 Å²	143.8	73%	0.727	80%	0.8	S	S	*	*			trans	-95.9	149.2	-173	-63.5	0	0	0	0	112.5
96	P	41.6	Very low	38.1	Very low	117 Å²	117	148.2 Å²	148.2	76%	0.76	81%	0.805	S	S	*	*			trans	-84.7	167.8	176.8	35.9	-36.2	0	0	0	112.4
97	T	42.7	Very low	38.2	Very low	140 Å²	140	150.2 Å²	150.2	86%	0.859	81%	0.81	S	S	*	*			trans	-135.8	125.5	169.3	-57.6	0	0	0	0	110.2
98	V	41.5	Very low	38.9	Very low	130 Å²	130	148.1 Å²	148.1	79%	0.788	81%	0.805	S	S	*	*			trans	-143.7	127.5	175.5	177.1	0	0	0	0	109.3
99	P	53.9	Low	39.1	Very low	114 Å²	114	143 Å²	143	74%	0.74	80%	0.796	S	S	*	*			trans	-100.3	151.1	162.3	34.9	-28.5	0	0	0	112.1
100	P	40.4	Very low	39.9	Very low	108 Å²	108	144.6 Å²	144.6	70%	0.701	80%	0.799	S	S	*	*			trans	-119.9	-175.4	-166.8	42.3	-31.3	0	0	0	115.7
101	R	40.2	Very low	40.2	Very low	222 Å²	222	146.8 Å²	146.8	84%	0.838	80%	0.796	S	S	*	*			trans	84.2	156.5	173.2	-57.7	167.3	175	-100.4	2	115.8
102	Q	38.8	Very low	40.5	Very low	174 Å²	174	152.2 Å²	152.2	81%	0.813	80%	0.798	S	S	*	*			cis	-171.9	162.7	-45.1	-115.6	179.9	-20.7	0	0	107.2
103	P	39.9	Very low	40.7	Very low	117 Å²	117	147.1 Å²	147.1	76%	0.76	78%	0.783	S	S	*	*			trans	-112	165.9	-156.8	41.2	-36.5	0	0	0	117.6
104	V	41.9	Very low	41	Very low	135 Å²	135	148.4 Å²	148.4	82%	0.818	78%	0.782	S	S	*	*			trans	-152.6	118.4	158	-95	0	0	0	0	107.9
105	M	35.9	Very low	41.2	Very low	170 Å²	170	144.9 Å²	144.9	84%	0.837	78%	0.777	S	S	*	*				63.6	103.7	91.1	-82.9	-166.9	156.5	0	0	116.6
106	F	37.6	Very low	41.7	Very low	208 Å²	208	144.9 Å²	144.9	91%	0.912	77%	0.774	S	S	*	*				-168.6	167.8	102.7	-120	-92.8	0	0	0	112.5
107	D	39.6	Very low	41.3	Very low	148 Å²	148	146 Å²	146	79%	0.791	77%	0.773	S	S	*	*			trans	-112.4	-173.1	-168.6	-135.4	7.6	0	0	0	112
108	P	49.9	Very low	41.2	Very low	102 Å²	102	146.2 Å²	146.2	66%	0.662	77%	0.774	S	S	*	*			trans	-126.3	-167.6	-139.3	38.3	-15.5	0	0	0	114.1
109	S	40.1	Very low	41	Very low	112 Å²	112	143.4 Å²	143.4	78%	0.783	76%	0.761	S	S	*	*			trans	154.7	161	136.7	-73.2	0	0	0	0	114
110	P	48.6	Very low	40.3	Very low	122 Å²	122	148.5 Å²	148.5	79%	0.792	77%	0.767	S	S	*	*			trans	-128.3	167.7	-157	42.7	-28.8	0	0	0	117.3
111	Q	39.1	Very low	40.2	Very low	180 Å²	180	149.4 Å²	149.4	84%	0.841	77%	0.773	S	S	*	*			trans	-162.4	154.8	158.6	-96.5	165.9	32.8	0	0	107.5
112	R	39.7	Very low	39.9	Very low	199 Å²	199	144 Å²	144	75%	0.751	77%	0.769	S	S	*	*			cis	-179.6	170.2	-23.6	-112.2	-164.5	-172.7	-175.8	0.8	107.4
113	H	39.2	Very low	40.2	Very low	133 Å²	133	147 Å²	147	62%	0.616	77%	0.774	S	S	*	*			trans	90.6	104.8	151.9	-66.6	-60.2	0	0	0	123.9
114	M	40.1	Very low	40.1	Very low	143 Å²	143	144.7 Å²	144.7	70%	0.704	77%	0.771	S	S	*	*				85.5	99.3	123.5	-57.2	-56.7	159.6	0	0	125.5
115	M	40.6	Very low	39.8	Very low	165 Å²	165	144.1 Å²	144.1	81%	0.813	77%	0.773	S	S	*	*				62.2	170	123.8	-58.9	-163.4	89.9	0	0	121.7
116	P	43.7	Very low	40	Very low	103 Å²	103	142.2 Å²	142.2	67%	0.669	77%	0.774	S	S	*	*				-137.5	159.6	-55.1	40.1	-24.8	0	0	0	116.9
117	N	33.6	Very low	39.9	Very low	140 Å²	140	140.9 Å²	140.9	75%	0.749	77%	0.77	S	S	*	*			trans	39.3	114.4	143.4	-169.1	35.4	0	0	0	123
118	V	41.6	Very low	39.7	Very low	145 Å²	145	142.1 Å²	142.1	88%	0.879	78%	0.776	S	S	*	*			trans	-145.5	151	152.6	-175.4	0	0	0	0	109.6
119	S	35.7	Very low	38.9	Very low	72 Å²	72	142.3 Å²	142.3	50%	0.503	78%	0.777	S	S	.	*			trans	-128.4	172.4	-170.4	-61.3	0	0	0	0	115.1
120	Y	39.6	Very low	38.7	Very low	221 Å²	221	144.7 Å²	144.7	87%	0.867	78%	0.781	S	S	*	*			trans	81.4	161.1	164.1	-52.2	-70.4	0	0	0	118.5
121	P	39.8	Very low	38	Very low	127 Å²	127	146 Å²	146	83%	0.825	78%	0.776	S	S	*	*			cis	-126.2	-172.5	-14.1	22.6	1.7	0	0	0	114.5
122	S	33.5	Very low	37.8	Very low	108 Å²	108	145.4 Å²	145.4	76%	0.755	78%	0.775	S	S	*	*			trans	-97.4	158.7	-176.5	-179.3	0	0	0	0	114.8
123	Y	44.6	Very low	37.3	Very low	237 Å²	237	142.7 Å²	142.7	93%	0.929	77%	0.771	S	S	*	*			trans	-138	153.8	157.4	-88.7	-87.6	0	0	0	108.9
124	G	37.7	Very low	36.9	Very low	68 Å²	68	142.2 Å²	142.2	70%	0.701	78%	0.782	S	S	*	*			trans	-175	-160.9	-179.3	0	0	0	0	0	115.4
125	S	35.8	Very low	36.3	Very low	123 Å²	123	142.7 Å²	142.7	86%	0.86	78%	0.783	S	S	*	*			trans	72.7	158.6	-178.4	-71.4	0	0	0	0	115.6
126	P	41.1	Very low	35.8	Very low	130 Å²	130	142.6 Å²	142.6	84%	0.844	79%	0.785	S	S	*	*			cis	-123.4	-178.7	15.9	41.7	-27	0	0	0	117.3
127	Q	33.9	Very low	35	Very low	180 Å²	180	141.8 Å²	141.8	84%	0.841	80%	0.795	S	S	*	*			trans	-93.6	164.3	-176	-51.4	167.7	-53.1	0	0	113.5
128	L	35.7	Very low	34.7	Very low	175 Å²	175	139.5 Å²	139.5	92%	0.916	79%	0.789	S	S	*	*				-147.2	158.5	127.5	-83.6	-169.3	0	0	0	110.7
129	P	33.8	Very low	34.1	Very low	105 Å²	105	138.8 Å²	138.8	68%	0.682	78%	0.781	S	S	*	*			trans	-120.1	166.5	-164.8	41.2	-30.2	0	0	0	115.9
130	L	35.3	Very low	33.8	Very low	163 Å²	163	145.6 Å²	145.6	85%	0.853	80%	0.795	S	S	*	*				176.2	128.7	121.1	-95.4	167.2	0	0	0	115.4
131	H	34.2	Very low	33.3	Very low	149 Å²	149	142.5 Å²	142.5	69%	0.69	79%	0.794	S	S	*	*			trans	48.1	102.2	134.3	-168.8	79.9	0	0	0	122.2
132	M	35.1	Very low	32.8	Very low	167 Å²	167	140.9 Å²	140.9	82%	0.823	79%	0.791	S	S	*	*				-160	148.6	113.2	-120.1	-62.9	170.5	0	0	110.8
133	Q	27.8	Very low	32.6	Very low	143 Å²	143	139.6 Å²	139.6	67%	0.668	79%	0.787	S	S	*	*			trans	-128.2	119.8	-166.8	178.1	172.3	-26	0	0	112.5	Q135	Q133-Q135 HydrophobicContact CG-CG 4.29Å
134	S	31.5	Very low	31.9	Very low	122 Å²	122	139.3 Å²	139.3	85%	0.853	78%	0.784	S	S	*	*			trans	-126.3	101.1	169.9	-176	0	0	0	0	109.6
135	Q	28.2	Very low	31.6	Very low	153 Å²	153	141 Å²	141	72%	0.715	78%	0.783	S	S	*	*			trans	-100.4	106.5	174	-72.5	-169.7	9.3	0	0	110.4	Q133	Q133-Q135 HydrophobicContact CG-CG 4.29Å
136	L	30.7	Very low	31.3	Very low	163 Å²	163	141.1 Å²	141.1	85%	0.853	78%	0.779	S	S	*	*			trans	-146.6	74.5	156.5	-79.7	-173.1	0	0	0	110.4	C138	L136-C138 PolarHBondContact O-N 3.06Å
137	G	25.3	Very low	30.8	Very low	87 Å²	87	144.1 Å²	144.1	90%	0.897	78%	0.775	S	S	*	*			trans	-74.7	101	167.5	0	0	0	0	0	110.7
138	C	29.1	Very low	30.6	Very low	92 Å²	92	138.5 Å²	138.5	62%	0.622	77%	0.765	S	S	*	*			trans	-97.5	97.3	178	54.3	0	0	0	0	112.1	L136 W140	L136-C138 PolarHBondContact O-N 3.06Å; C138-W140 VanDerWaalsContact O-CD1 3.28Å; C138-W140 PolarHBondContact O-N 2.77Å
139	N	28.1	Very low	30.6	Very low	130 Å²	130	139.8 Å²	139.8	70%	0.695	76%	0.759	S	S	*	*			trans	-70.6	110.2	173.2	175.9	6.7	0	0	0	111	N141	N139-N141 VanDerWaalsContact C-N 3.35Å; N139-N141 PolarHBondContact O-N 2.73Å; N139-N141 PolarHBondContact OD1-N 3.43Å; N139-N141 VanDerWaalsContact OD1-N 3.1Å
140	W	28.3	Very low	30.7	Very low	214 Å²	214	140.2 Å²	140.2	81%	0.811	76%	0.762	S	S	*	*			trans	-91	26.3	-178.6	-80.8	96.8	0	0	0	115.1	C138	C138-W140 VanDerWaalsContact O-CD1 3.28Å; C138-W140 PolarHBondContact O-N 2.77Å
141	N	31	Very low	30.4	Very low	156 Å²	156	139.7 Å²	139.7	83%	0.834	77%	0.765	S	S	*	*			trans	-105.3	45.3	173.5	-84.4	-30.8	0	0	0	113.8	N139	N139-N141 VanDerWaalsContact C-N 3.35Å; N139-N141 PolarHBondContact O-N 2.73Å; N139-N141 PolarHBondContact OD1-N 3.43Å; N139-N141 VanDerWaalsContact OD1-N 3.1Å
142	A	29	Very low	30.5	Very low	93 Å²	93	139.9 Å²	139.9	77%	0.769	77%	0.771	S	S	*	*	S	Bend	trans	-147.5	32	-177.4	0	0	0	0	0	116.1
143	A	29.3	Very low	30.2	Very low	82 Å²	82	135.9 Å²	135.9	68%	0.678	77%	0.773	S	S	*	*			trans	-152.7	59.6	180	0	0	0	0	0	115.7	P145	A143-P145 WeakPolarHBondContact O-CD 3.31Å
144	R	28.7	Very low	30.3	Very low	230 Å²	230	132.7 Å²	132.7	87%	0.868	78%	0.778	S	S	*	*			trans	-102.4	105.6	160.9	-93.1	-174.7	173.5	-106.6	4.8	110	T146	R144-T146 PolarHBondContact O-N 3.4Å
145	P	32.2	Very low	30.1	Very low	104 Å²	104	131.7 Å²	131.7	68%	0.675	78%	0.777	S	S	*	*			trans	-73.6	91.1	168.6	30	-32.6	0	0	0	109.3	A143 Y147	A143-P145 WeakPolarHBondContact O-CD 3.31Å; P145-Y147 VanDerWaalsContact C-N 3.3Å; P145-Y147 HydrophobicContact CB-CD2 4.2Å; P145-Y147 HydrophobicContact CB-CE2 4.23Å; P145-Y147 PolarHBondContact O-N 2.93Å
146	T	28.7	Very low	30.2	Very low	125 Å²	125	130.2 Å²	130.2	77%	0.767	78%	0.778	S	S	*	*			trans	-72.8	83.2	177.1	-57	0	0	0	0	110.2	R144 G148	R144-T146 PolarHBondContact O-N 3.4Å; T146-G148 PolarHBondContact O-N 3.05Å
147	Y	31.7	Very low	30.2	Very low	194 Å²	194	129.7 Å²	129.7	76%	0.761	77%	0.771	S	S	*	*			trans	-71.8	74.9	170.5	-88.2	-83.4	0	0	0	111.2	P145 Y149	P145-Y147 VanDerWaalsContact C-N 3.3Å; P145-Y147 HydrophobicContact CB-CD2 4.2Å; P145-Y147 HydrophobicContact CB-CE2 4.23Å; P145-Y147 PolarHBondContact O-N 2.93Å; Y147-Y149 PolarHBondContact O-N 3.18Å
148	G	29.9	Very low	30.3	Very low	61 Å²	61	131.4 Å²	131.4	63%	0.629	77%	0.77	S	S	*	*			trans	-75	110.3	162.6	0	0	0	0	0	109.5	T146 P150	T146-G148 PolarHBondContact O-N 3.05Å; G148-P150 WeakPolarHBondContact O-CD 3.17Å
149	Y	34.9	Very low	30.3	Very low	203 Å²	203	136.2 Å²	136.2	80%	0.796	78%	0.78	S	S	*	*			trans	-72.1	119.6	173.2	-78.5	-89.9	0	0	0	110.2	Y147 V151	Y147-Y149 PolarHBondContact O-N 3.18Å; Y149-V151 PolarHBondContact O-N 3.38Å
150	P	35.7	Very low	30.4	Very low	114 Å²	114	133.3 Å²	133.3	74%	0.74	78%	0.782	S	S	*	*			trans	-71.8	114.9	169.7	29.5	-31.9	0	0	0	109	G148 N152	G148-P150 WeakPolarHBondContact O-CD 3.17Å; P150-N152 PolarHBondContact O-N 2.99Å
151	V	30	Very low	30.7	Very low	151 Å²	151	130 Å²	130	92%	0.915	78%	0.777	S	S	*	*			trans	-72.9	99.1	168	177.6	0	0	0	0	107.6	Y149	Y149-V151 PolarHBondContact O-N 3.38Å
152	N	35.3	Very low	30.8	Very low	153 Å²	153	132.5 Å²	132.5	82%	0.818	78%	0.775	S	S	*	*			trans	-137.3	132.1	171.5	-137.1	-17.2	0	0	0	110.1	P150	P150-N152 PolarHBondContact O-N 2.99Å
153	G	28.2	Very low	31.1	Very low	84 Å²	84	133 Å²	133	87%	0.866	77%	0.77	S	S	*	*			trans	-81	120.9	-171.3	0	0	0	0	0	112.3
154	G	29.7	Very low	31.4	Very low	75 Å²	75	136.2 Å²	136.2	77%	0.773	78%	0.776	S	S	*	*			trans	-160.8	133.3	172.7	0	0	0	0	0	110.1
155	A	28.5	Very low	31.7	Very low	101 Å²	101	128.7 Å²	128.7	84%	0.835	77%	0.769	S	S	*	*			trans	-83.4	150.2	179.4	0	0	0	0	0	111.3
156	V	30.5	Very low	31.7	Very low	122 Å²	122	135 Å²	135	74%	0.739	78%	0.78	S	S	*	*			trans	-163.3	121.3	137.8	133.4	0	0	0	0	111.3
157	Q	31	Very low	32	Very low	152 Å²	152	134.2 Å²	134.2	71%	0.71	78%	0.78	S	S	*	*			trans	48.5	105.5	148	-55	173.4	23.2	0	0	120.2
158	S	26.8	Very low	32.1	Very low	123 Å²	123	129.8 Å²	129.8	86%	0.86	78%	0.777	S	S	*	*			trans	-79	142.4	148	-179.1	0	0	0	0	109.6
159	F	29.4	Very low	32.3	Very low	193 Å²	193	133 Å²	133	85%	0.846	78%	0.784	S	S	*	*			trans	-104.8	121.2	174.1	-113.5	-93.5	0	0	0	110.8
160	G	29.6	Very low	32.4	Very low	70 Å²	70	132 Å²	132	72%	0.722	79%	0.787	S	S	*	*			trans	-178.4	120	175.4	0	0	0	0	0	112.4
161	M	33.7	Very low	32.8	Very low	145 Å²	145	131.7 Å²	131.7	71%	0.714	78%	0.784	S	S	*	*			trans	-152.5	152.3	172.7	-49.9	-168.3	82.8	0	0	106.2
162	W	33.5	Very low	33.2	Very low	208 Å²	208	132.6 Å²	132.6	79%	0.788	78%	0.784	S	S	*	*			cis	-136	-176.9	16.6	-82	98.3	0	0	0	107.9
163	P	36.3	Very low	33.3	Very low	102 Å²	102	128.3 Å²	128.3	66%	0.662	78%	0.776	S	S	*	*			cis	-143.5	173.4	22.8	44	-23.8	0	0	0	119.5
164	D	34.9	Very low	33.7	Very low	151 Å²	151	132.6 Å²	132.6	81%	0.807	78%	0.778	S	S	*	*			trans	49.1	145.4	149.8	-58.8	-22.2	0	0	0	122.9
165	G	34.3	Very low	34	Very low	71 Å²	71	133 Å²	133	73%	0.732	77%	0.774	S	S	*	*			trans	146.1	35	152.4	0	0	0	0	0	122.5
166	R	33.4	Very low	34.5	Very low	237 Å²	237	134.1 Å²	134.1	89%	0.894	77%	0.77	S	S	*	*			trans	49.8	120.5	158.4	-67.5	178.5	173.8	-110.1	0.5	120.6
167	S	34.3	Very low	35	Very low	109 Å²	109	134.9 Å²	134.9	76%	0.762	78%	0.775	S	S	*	*			trans	67.2	151.3	130.5	-61.4	0	0	0	0	121.4
168	S	33.7	Very low	35.2	Very low	101 Å²	101	131 Å²	131	71%	0.706	78%	0.777	S	S	*	*			cis	-169.6	172.1	-18.2	-88.4	0	0	0	0	109.4
169	V	35.4	Very low	35.9	Very low	129 Å²	129	131 Å²	131	78%	0.782	77%	0.774	S	S	*	*			trans	83.2	84.1	159	-160.4	0	0	0	0	120.1
170	H	35.5	Very low	36.1	Very low	182 Å²	182	131.5 Å²	131.5	84%	0.843	77%	0.77	S	S	*	*				61.7	151.4	127.2	-80.6	-96.6	0	0	0	125.4
171	P	45.2	Very low	36.3	Very low	106 Å²	106	136.2 Å²	136.2	69%	0.688	77%	0.771	S	S	*	*			trans	-120.5	-174.5	-174.9	45.3	-32.8	0	0	0	114.9
172	N	38.6	Very low	36.8	Very low	170 Å²	170	135 Å²	135	91%	0.909	77%	0.774	S	S	*	*			trans	-167.1	155.9	154.8	-111	-28.2	0	0	0	115.5
173	G	36.6	Very low	36.8	Very low	64 Å²	64	133.9 Å²	133.9	66%	0.66	78%	0.775	S	S	*	*			trans	92.8	116.8	168.2	0	0	0	0	0	115.9
174	L	36.2	Very low	37	Very low	173 Å²	173	137.8 Å²	137.8	91%	0.906	78%	0.784	S	S	*	*			cis	81.2	135.5	41.1	-61.1	173.5	0	0	0	114
175	A	36.2	Very low	36.9	Very low	83 Å²	83	135.1 Å²	135.1	69%	0.686	78%	0.777	S	S	*	*			cis	-165.2	-154.7	-6.4	0	0	0	0	0	111.4
176	V	40.2	Very low	36.9	Very low	125 Å²	125	137.6 Å²	137.6	76%	0.758	78%	0.778	S	S	*	*			trans	82.3	92.2	169.3	-171.5	0	0	0	0	115
177	T	40.1	Very low	37	Very low	138 Å²	138	133.6 Å²	133.6	85%	0.847	77%	0.774	S	S	*	*				61.9	135.7	74	68.3	0	0	0	0	115
178	G	36.4	Very low	37.1	Very low	72 Å²	72	135.3 Å²	135.3	74%	0.742	78%	0.775	S	S	*	*			cis	163.3	-164.8	5.6	0	0	0	0	0	107.7
179	P	39.9	Very low	37.1	Very low	123 Å²	123	135.4 Å²	135.4	80%	0.799	78%	0.775	S	S	*	*			cis	-108.8	177.2	-25.9	39.3	-23	0	0	0	111.3
180	R	33.9	Very low	37.8	Very low	203 Å²	203	134 Å²	134	77%	0.766	77%	0.769	S	S	*	*			cis	70.1	137.3	35.7	-57.1	-177	73	-151.1	1.7	114.1
181	F	34.8	Very low	37.7	Very low	168 Å²	168	132.2 Å²	132.2	74%	0.737	77%	0.765	S	S	*	*			cis	-163.9	-168.2	-9.8	-115	-22	0	0	0	108.3
182	P	43.4	Very low	37.3	Very low	119 Å²	119	132.6 Å²	132.6	77%	0.773	77%	0.766	S	S	*	*			cis	-136.8	-119.5	13.4	42.7	-19.6	0	0	0	115.5
183	F	34.1	Very low	37.4	Very low	185 Å²	185	131.1 Å²	131.1	81%	0.811	76%	0.763	S	S	*	*			trans	-162	162.6	-174.4	-152.5	-96.8	0	0	0	106.5
184	Q	39.7	Very low	37.4	Very low	185 Å²	185	131.8 Å²	131.8	86%	0.864	76%	0.762	S	S	*	*			trans	-156.9	154.3	161.3	-161.7	160.9	-5.4	0	0	113.3
185	S	32.8	Very low	37.5	Very low	94 Å²	94	128.6 Å²	128.6	66%	0.657	75%	0.754	S	S	*	*			trans	-161.5	130.3	-171.9	55.2	0	0	0	0	114.6
186	T	35.4	Very low	37.3	Very low	123 Å²	123	131.7 Å²	131.7	76%	0.755	75%	0.754	S	S	*	*			trans	-158.1	138.6	170.5	41.5	0	0	0	0	107.9
187	L	33.8	Very low	37.1	Very low	154 Å²	154	131.9 Å²	131.9	81%	0.806	75%	0.752	S	S	*	*				72	103.5	52.7	-80.4	165.8	0	0	0	115.3
188	D	37.2	Very low	37	Very low	145 Å²	145	131.9 Å²	131.9	78%	0.775	75%	0.751	S	S	*	*				171.6	123.7	116	-91.2	-25.6	0	0	0	116.2
189	S	34.7	Very low	36.8	Very low	103 Å²	103	132 Å²	132	72%	0.72	75%	0.746	S	S	*	*				21.9	166.6	120.2	-59.3	0	0	0	0	123.6
190	P	48.6	Very low	36.6	Very low	99 Å²	99	133.1 Å²	133.1	64%	0.643	75%	0.745	S	S	*	*			cis	-147	-171.5	-35.3	41.7	-23.2	0	0	0	116.1
191	N	33.9	Very low	36.7	Very low	144 Å²	144	129.6 Å²	129.6	77%	0.77	75%	0.746	S	S	*	*			trans	75.4	158	156	-63.3	-19	0	0	0	118.8
192	T	37.9	Very low	36.5	Very low	114 Å²	114	127.2 Å²	127.2	70%	0.699	75%	0.748	S	S	*	*			cis	-157.4	148.4	26.8	-32.8	0	0	0	0	114
193	V	40.7	Very low	36	Very low	139 Å²	139	129.7 Å²	129.7	84%	0.842	75%	0.752	S	S	*	*			trans	50.4	153.1	160.1	-72.2	0	0	0	0	121.8
194	A	34.9	Very low	36.1	Very low	79 Å²	79	126.2 Å²	126.2	65%	0.653	75%	0.751	S	S	*	*			cis	-173.9	163.3	-28	0	0	0	0	0	111.1
195	S	38.1	Very low	35.8	Very low	105 Å²	105	127 Å²	127	73%	0.734	75%	0.752	S	S	*	*			trans	65.9	149.8	153.3	-66	0	0	0	0	120.2
196	E	33.9	Very low	35.8	Very low	148 Å²	148	131.7 Å²	131.7	69%	0.692	76%	0.763	S	S	*	*			cis	-168.9	147.7	-30	-135.6	176.4	-105.6	0	0	110.8
197	N	35.1	Very low	35.7	Very low	130 Å²	130	131.2 Å²	131.2	70%	0.695	76%	0.76	S	S	*	*			trans	62.4	158	163.7	-47.2	-45.3	0	0	0	116.9
198	T	38	Very low	35.6	Very low	137 Å²	137	131.5 Å²	131.5	84%	0.84	76%	0.761	S	S	*	*			cis	-141.7	160.9	3.6	-33.3	0	0	0	0	110.4
199	A	32.2	Very low	35.3	Very low	76 Å²	76	134.4 Å²	134.4	63%	0.628	77%	0.77	S	S	*	*			trans	-69.7	144	-174.3	0	0	0	0	0	115.9
200	N	35.4	Very low	35.2	Very low	146 Å²	146	137.2 Å²	137.2	78%	0.781	77%	0.772	S	S	*	*				177.9	121.3	104.5	-88	-40.8	0	0	0	114.1
201	T	35.6	Very low	34.5	Very low	129 Å²	129	138 Å²	138	79%	0.791	78%	0.777	S	S	*	*			trans	37.8	99.4	151.1	-41.7	0	0	0	0	120.9
202	P	31.2	Very low	34.7	Very low	118 Å²	118	136.6 Å²	136.6	77%	0.766	78%	0.776	S	S	*	*			trans	-119.6	149.3	140.4	36	-28.3	0	0	0	112.3
203	I	33.6	Very low	34.5	Very low	170 Å²	170	136.8 Å²	136.8	87%	0.872	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-79.7	127.4	178	-65.7	172.4	0	0	0	110.2
204	S	34.8	Very low	34.1	Very low	112 Å²	112	134 Å²	134	78%	0.783	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-72.8	146.9	-175.8	-57.4	0	0	0	0	114.1
205	K	34.2	Very low	34.3	Very low	203 Å²	203	139.3 Å²	139.3	88%	0.883	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-87.3	124.5	157.5	-53.6	167.6	-176.6	172.4	0	108
206	E	33.5	Very low	33.9	Very low	191 Å²	191	143.4 Å²	143.4	89%	0.893	79%	0.792	S	S	*	*			trans	-175.8	-174.8	142.8	-116.9	-170	123.5	0	0	112.7
207	V	32.4	Very low	34	Very low	114 Å²	114	144.1 Å²	144.1	69%	0.691	80%	0.8	S	S	*	*			trans	80.8	102.1	171.4	-170.7	0	0	0	0	115.7
208	L	31.6	Very low	33.8	Very low	159 Å²	159	146.6 Å²	146.6	83%	0.832	81%	0.805	S	S	*	*			trans	-45.1	147.6	159.3	-92.4	57.6	0	0	0	111.8	Q210	L208-Q210 PolarHBondContact O-N 3.12Å
209	Q	31.3	Very low	33.5	Very low	207 Å²	207	142.6 Å²	142.6	97%	0.967	79%	0.791	S	S	*	*			trans	-61.9	92.1	-179.9	-71	167.3	-26.5	0	0	112.6
210	Q	33.3	Very low	33.9	Very low	161 Å²	161	145.3 Å²	145.3	75%	0.752	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-73.5	148.2	163.9	-67.8	-177.2	-10.1	0	0	109.9	L208	L208-Q210 PolarHBondContact O-N 3.12Å
211	P	33.4	Very low	34.2	Very low	116 Å²	116	147.6 Å²	147.6	75%	0.753	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-63.8	150.5	173	28.5	-34.8	0	0	0	111	A213	P211-A213 PolarHBondContact O-N 3.28Å
212	P	37.9	Very low	34.8	Very low	115 Å²	115	149.1 Å²	149.1	75%	0.747	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-64.8	128.5	-170	25.2	-34.7	0	0	0	112.6	S214	P212-S214 VanDerWaalsContact C-N 3.29Å; P212-S214 PolarHBondContact O-N 2.95Å
213	A	33.9	Very low	35.8	Very low	118 Å²	118	150 Å²	150	98%	0.975	80%	0.795	S	S	*	*			trans	-69.5	80.8	177.6	0	0	0	0	0	112	P211	P211-A213 PolarHBondContact O-N 3.28Å
214	S	32.3	Very low	36.7	Very low	80 Å²	80	148.7 Å²	148.7	56%	0.559	78%	0.779	S	S	*	*			trans	-134.7	152.1	165.8	57.7	0	0	0	0	107.9	P212	P212-S214 VanDerWaalsContact C-N 3.29Å; P212-S214 PolarHBondContact O-N 2.95Å
215	F	38.1	Very low	38.4	Very low	190 Å²	190	145.7 Å²	145.7	83%	0.833	76%	0.758	S	S	*	*			trans	70.1	48.3	-164.8	-52.9	-79.7	0	0	0	115.5
216	Q	31.2	Very low	40	Very low	192 Å²	192	141.5 Å²	141.5	90%	0.897	75%	0.745	S	S	*	*	S	Bend	trans	-102.4	147	136.2	-66	-176.7	-0.6	0	0	107.5
217	D	34.6	Very low	41.7	Very low	162 Å²	162	135.7 Å²	135.7	87%	0.866	72%	0.718	S	S	*	*	S	Bend	trans	49.6	78.1	-171.2	-81.7	-19.4	0	0	0	117.5
218	K	32	Very low	43.6	Very low	182 Å²	182	130.5 Å²	130.5	79%	0.791	69%	0.686	S	S	*	*	S	Bend	trans	-157	152.7	137.1	-101.4	135.6	-167.8	173.9	0	110.8
219	G	31.5	Very low	45.6	Very low	53 Å²	53	126.9 Å²	126.9	55%	0.546	66%	0.664	S	S	.	*			trans	-71.2	141.7	-159.7	0	0	0	0	0	115.3	K221	G219-K221 PolarHBondContact O-N 3.47Å
220	V	40.4	Very low	47.7	Very low	133 Å²	133	121.1 Å²	121.1	81%	0.806	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.7	42.7	179.4	-164.1	0	0	0	0	112.6
221	K	42.6	Very low	49.8	Very low	195 Å²	195	113.5 Å²	113.5	85%	0.848	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126	-12.9	-178.3	-68.7	-173.4	177	-179.1	0	114.1	G219	G219-K221 PolarHBondContact O-N 3.47Å
222	E	47.6	Very low	51.8	Low	160 Å²	160	109.2 Å²	109.2	75%	0.748	57%	0.573	S	S	*	*	S	Bend	trans	-87.4	-10.6	-174.9	-63.2	-177.4	138.3	0	0	114.4	W224	E222-W224 VanDerWaalsContact C-N 3.33Å; E222-W224 PolarHBondContact O-N 2.78Å
223	Q	52.3	Low	53.5	Low	138 Å²	138	109.8 Å²	109.8	65%	0.645	57%	0.566	S	S	*	*	S	Bend	trans	-79.3	-6.1	-169.2	-70.8	175.7	-14.4	0	0	115.8
224	W	52.9	Low	55.5	Low	142 Å²	142	107.6 Å²	107.6	54%	0.538	53%	0.532	S	S	.	.	S	Bend	trans	-131	92.7	173.2	-65.5	78.6	0	0	0	108.9	E222 L228 K229	E222-W224 VanDerWaalsContact C-N 3.33Å; E222-W224 PolarHBondContact O-N 2.78Å; W224-L228 HydrophobicContact CE3-CD2 4.05Å; W224-K229 WeakPolarHBondContact O-CE 3.07Å; W224-K229 PolarHBondContact O-NZ 3.02Å
225	S	70.5	Confident	57.4	Low	49 Å²	49	103.8 Å²	103.8	34%	0.343	51%	0.505	S	S	.	.			trans	-61.6	150.3	170.9	61.4	0	0	0	0	110.4	E227 L228 K229	S225-E227 PolarHBondContact O-N 3.45Å; S225-L228 WeakPolarHBondContact O-CB 3.28Å; S225-L228 PolarHBondContact O-N 3.32Å; S225-L228 VanDerWaalsContact O-N 3.08Å; S225-L228 WeakPolarHBondContact OG-CB 3.48Å; S225-L228 PolarHBondContact OG-N 2.9Å; S225-K229 PolarHBondContact O-N 3.5Å
226	D	66.2	Low	59	Low	115 Å²	115	97.7 Å²	97.7	62%	0.615	48%	0.479	S	S	*	.	H	α-helix	trans	-66.4	-27.9	179.8	-62.7	-53.7	0	0	0	112	L228 K229 E230	D226-L228 VanDerWaalsContact C-N 3.29Å; D226-L228 PolarHBondContact O-N 2.84Å; D226-K229 PolarHBondContact O-N 3.45Å; D226-K229 WeakPolarHBondContact OD1-CD 3.46Å; D226-K229 IonicContact OD1-NZ 2.79Å; D226-K229 PolarHBondContact OD1-NZ 3.46Å; D226-E230 VanDerWaalsContact O-CB 3.32Å; D226-E230 WeakPolarHBondContact O-CB 3.4Å; D226-E230 PolarHBondContact O-N 3Å
227	E	70.9	Confident	60.7	Low	69 Å²	69	93.8 Å²	93.8	32%	0.322	47%	0.471	S	S	.	.	H	α-helix	trans	-61.2	-36.1	171.3	-46.4	-174.5	152.8	0	0	112.5	S225 Y231 W268 K269	S225-E227 PolarHBondContact O-N 3.45Å; E227-Y231 WeakPolarHBondContact O-CB 3.36Å; E227-Y231 PolarHBondContact O-N 3.02Å; E227-W268 HydrophobicContact CB-CB 4.11Å; E227-K269 HydrophobicContact CB-CG 4.49Å; E227-K269 HydrophobicContact CG-CD 4.4Å; E227-K269 HydrophobicContact CG-CG 4.42Å; E227-K269 WeakPolarHBondContact OE1-CD 3.23Å; E227-K269 WeakPolarHBondContact OE1-CE 3.48Å; E227-K269 IonicContact OE1-NZ 3.35Å; E227-K269 PolarHBondContact OE1-NZ 2.99Å
228	L	71.9	Confident	62.2	Low	4 Å²	4	89 Å²	89	2%	0.021	45%	0.451	C	S	.	.	H	α-helix	trans	-70.8	-41.6	175.7	-170.3	62	0	0	0	111.2	W224 S225 D226 E230 Y231 V232 L256 F260 W268	W224-L228 HydrophobicContact CE3-CD2 4.05Å; S225-L228 WeakPolarHBondContact O-CB 3.28Å; S225-L228 PolarHBondContact O-N 3.32Å; S225-L228 VanDerWaalsContact O-N 3.08Å; S225-L228 WeakPolarHBondContact OG-CB 3.48Å; S225-L228 PolarHBondContact OG-N 2.9Å; D226-L228 VanDerWaalsContact C-N 3.29Å; D226-L228 PolarHBondContact O-N 2.84Å; L228-E230 VanDerWaalsContact C-N 3.34Å; L228-Y231 PolarHBondContact O-N 3.2Å; L228-V232 WeakPolarHBondContact O-CB 3.45Å; L228-V232 WeakPolarHBondContact O-CG2 3.41Å; L228-V232 PolarHBondContact O-N 3.45Å; L228-L256 HydrophobicContact CD1-CD2 3.53Å; L228-L256 HydrophobicContact CD2-CD2 4.13Å; L228-L256 HydrophobicContact CG-CD2 4.17Å; L228-F260 HydrophobicContact CD2-CE2 4.44Å; L228-F260 HydrophobicContact CD2-CZ 4.08Å; L228-W268 HydrophobicContact CD1-CD2 3.55Å; L228-W268 VanDerWaalsContact CD1-CE2 3.46Å; L228-W268 HydrophobicContact CD1-CE3 3.77Å; L228-W268 HydrophobicContact CD1-CG 4.15Å; L228-W268 HydrophobicContact CD1-CH2 3.79Å; L228-W268 HydrophobicContact CD1-CZ2 3.58Å; L228-W268 HydrophobicContact CD1-CZ3 3.89Å
229	K	73.8	Confident	63.8	Low	83 Å²	83	81.5 Å²	81.5	36%	0.361	42%	0.419	S	S	.	.	H	α-helix	trans	-63.4	-42.9	174.9	-60.8	168.4	-156.9	151.1	0	110.4	W224 S225 D226 V232 Q233	W224-K229 WeakPolarHBondContact O-CE 3.07Å; W224-K229 PolarHBondContact O-NZ 3.02Å; S225-K229 PolarHBondContact O-N 3.5Å; D226-K229 PolarHBondContact O-N 3.45Å; D226-K229 WeakPolarHBondContact OD1-CD 3.46Å; D226-K229 IonicContact OD1-NZ 2.79Å; D226-K229 PolarHBondContact OD1-NZ 3.46Å; K229-V232 PolarHBondContact O-N 3.29Å; K229-Q233 VanDerWaalsContact O-CB 3.31Å; K229-Q233 WeakPolarHBondContact O-CB 3.46Å; K229-Q233 VanDerWaalsContact O-CG 3.25Å; K229-Q233 WeakPolarHBondContact O-CG 3.14Å; K229-Q233 PolarHBondContact O-N 2.7Å
230	E	75.1	Confident	65.4	Low	86 Å²	86	86.9 Å²	86.9	40%	0.402	44%	0.435	S	S	.	.	H	α-helix	trans	-64.9	-40.7	176.4	-171.8	-170.9	179.8	0	0	111.9	D226 L228 Q233 R234	D226-E230 VanDerWaalsContact O-CB 3.32Å; D226-E230 WeakPolarHBondContact O-CB 3.4Å; D226-E230 PolarHBondContact O-N 3Å; L228-E230 VanDerWaalsContact C-N 3.34Å; E230-Q233 PolarHBondContact O-N 3.07Å; E230-R234 VanDerWaalsContact O-CB 3.3Å; E230-R234 WeakPolarHBondContact O-CB 3.29Å; E230-R234 VanDerWaalsContact O-CG 3.27Å; E230-R234 WeakPolarHBondContact O-CG 3.38Å; E230-R234 PolarHBondContact O-N 3.35Å; E230-R234 PolarHBondContact O-NE 3.42Å
231	Y	76.3	Confident	66.9	Low	1 Å²	1	83.3 Å²	83.3	0%	0.004	41%	0.414	C	S	.	.	H	α-helix	trans	-62.9	-46.3	172.9	174.2	-90.1	0	0	0	111.8	E227 L228 R234 A235 L252 K255 W268 E271 P274	E227-Y231 WeakPolarHBondContact O-CB 3.36Å; E227-Y231 PolarHBondContact O-N 3.02Å; L228-Y231 PolarHBondContact O-N 3.2Å; Y231-R234 PolarHBondContact O-N 3.42Å; Y231-A235 WeakPolarHBondContact O-CB 3.5Å; Y231-A235 PolarHBondContact O-N 2.85Å; Y231-L252 HydrophobicContact CD1-CD2 4.36Å; Y231-L252 HydrophobicContact CE1-CD2 3.62Å; Y231-K255 PolarHBondContact OH-NZ 3.03Å; Y231-W268 HydrophobicContact CD1-CE3 4.03Å; Y231-W268 HydrophobicContact CD1-CZ3 4.28Å; Y231-W268 HydrophobicContact CD2-CE3 4.42Å; Y231-W268 HydrophobicContact CE1-CE3 4.36Å; Y231-W268 HydrophobicContact CE1-CZ3 4.27Å; Y231-W268 HydrophobicContact CG-CE3 4.08Å; Y231-E271 HydrophobicContact CD2-CB 4.48Å; Y231-E271 HydrophobicContact CE2-CB 4.18Å; Y231-P274 WeakPolarHBondContact OH-CD 3.22Å
232	V	76.7	Confident	68.3	Low	27 Å²	27	78.3 Å²	78.3	16%	0.164	40%	0.403	C	S	.	.	H	α-helix	trans	-63.9	-40.4	176.2	168.6	0	0	0	0	111.7	L228 K229 A235 F236 L252	L228-V232 WeakPolarHBondContact O-CB 3.45Å; L228-V232 WeakPolarHBondContact O-CG2 3.41Å; L228-V232 PolarHBondContact O-N 3.45Å; K229-V232 PolarHBondContact O-N 3.29Å; V232-A235 PolarHBondContact O-N 3.49Å; V232-F236 HydrophobicContact CG1-CD2 3.78Å; V232-F236 HydrophobicContact CG1-CE2 3.75Å; V232-F236 VanDerWaalsContact O-CD2 3.3Å; V232-F236 WeakPolarHBondContact O-CD2 3.19Å; V232-F236 PolarHBondContact O-N 3.3Å; V232-L252 HydrophobicContact CG1-CD1 4.31Å
233	Q	73.6	Confident	69.2	Low	127 Å²	127	75.7 Å²	75.7	59%	0.593	39%	0.391	S	S	*	.	H	α-helix	trans	-65	-49.1	174.9	-78	174.2	-10.9	0	0	111.5	K229 E230 A235 F236 C237	K229-Q233 VanDerWaalsContact O-CB 3.31Å; K229-Q233 WeakPolarHBondContact O-CB 3.46Å; K229-Q233 VanDerWaalsContact O-CG 3.25Å; K229-Q233 WeakPolarHBondContact O-CG 3.14Å; K229-Q233 PolarHBondContact O-N 2.7Å; E230-Q233 PolarHBondContact O-N 3.07Å; Q233-A235 PolarHBondContact O-N 3.34Å; Q233-F236 PolarHBondContact O-N 3.13Å; Q233-F236 VanDerWaalsContact O-N 3.14Å; Q233-C237 WeakPolarHBondContact O-CB 3.24Å; Q233-C237 PolarHBondContact O-N 3.45Å; Q233-C237 PolarHBondContact O-SG 3.02Å
234	R	75.9	Confident	70	Confident	72 Å²	72	70.4 Å²	70.4	27%	0.272	37%	0.366	S	S	.	.	H	α-helix	trans	-54.5	-41	174.6	-78.5	179.6	-70	156.6	-1.7	111.9	E230 Y231 C237 S238 W268 K269 I273	E230-R234 VanDerWaalsContact O-CB 3.3Å; E230-R234 WeakPolarHBondContact O-CB 3.29Å; E230-R234 VanDerWaalsContact O-CG 3.27Å; E230-R234 WeakPolarHBondContact O-CG 3.38Å; E230-R234 PolarHBondContact O-N 3.35Å; E230-R234 PolarHBondContact O-NE 3.42Å; Y231-R234 PolarHBondContact O-N 3.42Å; R234-C237 PolarHBondContact O-N 2.83Å; R234-S238 PolarHBondContact O-N 3.33Å; R234-W268 PolarHBondContact NH2-O 3.13Å; R234-K269 PolarHBondContact NH1-O 3.46Å; R234-K269 VanDerWaalsContact NH1-O 3.1Å; R234-I273 HydrophobicContact CB-CD1 3.89Å; R234-I273 HydrophobicContact CB-CG1 4.41Å
235	A	71.9	Confident	70.9	Confident	0 Å²	0	68.7 Å²	68.7	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-70.1	-34.1	178	0	0	0	0	0	114.3	Y231 V232 Q233 S238 M248 L252 I273	Y231-A235 WeakPolarHBondContact O-CB 3.5Å; Y231-A235 PolarHBondContact O-N 2.85Å; V232-A235 PolarHBondContact O-N 3.49Å; Q233-A235 PolarHBondContact O-N 3.34Å; A235-S238 PolarHBondContact O-OG 2.82Å; A235-M248 HydrophobicContact CB-CE 4.05Å; A235-M248 HydrophobicContact CB-CG 4.35Å; A235-M248 HydrophobicContact CB-SD 3.88Å; A235-L252 HydrophobicContact CB-CD1 4.05Å; A235-L252 HydrophobicContact CB-CD2 4.09Å; A235-I273 HydrophobicContact CB-CG2 4.03Å
236	F	70.7	Confident	71.1	Confident	62 Å²	62	71 Å²	71	27%	0.272	37%	0.371	S	S	.	.	H	α-helix	trans	-79.4	-29.6	172	-78.5	-60.4	0	0	0	113.1	V232 Q233 S238 K245 M248 E249 L252	V232-F236 HydrophobicContact CG1-CD2 3.78Å; V232-F236 HydrophobicContact CG1-CE2 3.75Å; V232-F236 VanDerWaalsContact O-CD2 3.3Å; V232-F236 WeakPolarHBondContact O-CD2 3.19Å; V232-F236 PolarHBondContact O-N 3.3Å; Q233-F236 PolarHBondContact O-N 3.13Å; Q233-F236 VanDerWaalsContact O-N 3.14Å; F236-S238 VanDerWaalsContact C-N 3.26Å; F236-S238 PolarHBondContact O-N 3.15Å; F236-K245 HydrophobicContact CD1-CG 4.02Å; F236-K245 HydrophobicContact CE1-CG 3.84Å; F236-M248 HydrophobicContact CD1-CG 4.31Å; F236-M248 HydrophobicContact CE1-CB 4.4Å; F236-M248 HydrophobicContact CE1-CG 4.26Å; F236-E249 HydrophobicContact CE1-CB 4.22Å; F236-E249 HydrophobicContact CZ-CB 4.01Å; F236-E249 HydrophobicContact CZ-CG 4.25Å; F236-L252 HydrophobicContact CD2-CD1 4.22Å; F236-L252 HydrophobicContact CE2-CD1 3.78Å; F236-L252 HydrophobicContact CZ-CD1 3.99Å
237	C	67	Low	71.1	Confident	109 Å²	109	67.7 Å²	67.7	74%	0.736	35%	0.352	S	S	*	.	H	α-helix	trans	-73.6	-12.3	175.2	-70.3	0	0	0	0	113.7	Q233 R234 I239	Q233-C237 WeakPolarHBondContact O-CB 3.24Å; Q233-C237 PolarHBondContact O-N 3.45Å; Q233-C237 PolarHBondContact O-SG 3.02Å; R234-C237 PolarHBondContact O-N 2.83Å; C237-I239 VanDerWaalsContact C-N 3.29Å; C237-I239 PolarHBondContact O-N 3.06Å
238	S	66.8	Low	71.3	Confident	63 Å²	63	64.4 Å²	64.4	44%	0.441	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	12.4	174.7	61.9	0	0	0	0	114.2	R234 A235 F236	R234-S238 PolarHBondContact O-N 3.33Å; A235-S238 PolarHBondContact O-OG 2.82Å; F236-S238 VanDerWaalsContact C-N 3.26Å; F236-S238 PolarHBondContact O-N 3.15Å
239	I	65.6	Low	71.5	Confident	23 Å²	23	67.9 Å²	67.9	12%	0.118	35%	0.353	C	S	.	.			trans	-141	125.7	-169.8	-65.8	171.9	0	0	0	112.1	C237 T241 E244 M248 I276	C237-I239 VanDerWaalsContact C-N 3.29Å; C237-I239 PolarHBondContact O-N 3.06Å; I239-T241 WeakPolarHBondContact CG2-O 3.45Å; I239-E244 HydrophobicContact CD1-CB 4.48Å; I239-E244 HydrophobicContact CG2-CB 3.45Å; I239-E244 VanDerWaalsContact CG2-CB 3.45Å; I239-M248 HydrophobicContact CD1-CB 3.38Å; I239-M248 HydrophobicContact CD1-CE 3.72Å; I239-M248 HydrophobicContact CD1-CG 3.76Å; I239-I276 HydrophobicContact CD1-CD1 3.86Å
240	D	64.2	Low	71.6	Confident	166 Å²	166	70.5 Å²	70.5	89%	0.888	36%	0.36	S	S	*	.			trans	-97.3	-17.2	179.2	-60.9	-49.4	0	0	0	114.5
241	T	72.6	Confident	71.8	Confident	59 Å²	59	68.5 Å²	68.5	36%	0.362	35%	0.352	S	S	.	.			trans	-111.3	146.7	-170.6	91.5	0	0	0	0	114	I239 E243 E244 K245	I239-T241 WeakPolarHBondContact CG2-O 3.45Å; T241-E243 PolarHBondContact O-N 3.31Å; T241-E244 WeakPolarHBondContact CG2-OE1 3.44Å; T241-E244 PolarHBondContact O-N 3.47Å; T241-E244 WeakPolarHBondContact OG1-CB 3.21Å; T241-E244 WeakPolarHBondContact OG1-CG 3.03Å; T241-E244 PolarHBondContact OG1-N 3.46Å; T241-E244 PolarHBondContact OG1-OE1 2.89Å; T241-K245 PolarHBondContact O-N 3.11Å
242	S	72	Confident	71.9	Confident	89 Å²	89	68.7 Å²	68.7	62%	0.622	35%	0.353	S	S	*	.	H	α-helix	trans	-65.7	-35.6	-179	-161.8	0	0	0	0	113.1	E244 K245 D246	S242-E244 VanDerWaalsContact C-N 3.32Å; S242-E244 PolarHBondContact O-N 2.75Å; S242-K245 PolarHBondContact O-N 3.15Å; S242-D246 PolarHBondContact O-N 2.95Å; S242-D246 VanDerWaalsContact O-N 3.08Å
243	E	66.7	Low	71.9	Confident	105 Å²	105	72.9 Å²	72.9	49%	0.491	37%	0.369	S	S	.	.	H	α-helix	trans	-68.8	-32.1	178.9	-70.1	-168.1	-129.3	0	0	112.5	T241 Q247 R285	T241-E243 PolarHBondContact O-N 3.31Å; E243-Q247 WeakPolarHBondContact O-CG 3.08Å; E243-Q247 PolarHBondContact O-N 3.19Å; E243-Q247 PolarHBondContact O-NE2 2.99Å; E243-R285 IonicContact OE1-NH1 3.23Å; E243-R285 IonicContact OE2-CZ 3.78Å; E243-R285 IonicContact OE2-NH1 3.27Å; E243-R285 PolarHBondContact OE2-NH1 2.76Å; E243-R285 IonicContact OE2-NH2 3.88Å; E243-R285 PolarHBondContact OE2-NH2 3.5Å
244	E	69.5	Low	71.9	Confident	27 Å²	27	70.3 Å²	70.3	13%	0.126	36%	0.357	C	S	.	.	H	α-helix	trans	-78.9	-33.3	175.6	-70.9	152.2	-130.8	0	0	111	I239 T241 S242 Q247 M248 I276 S278	I239-E244 HydrophobicContact CD1-CB 4.48Å; I239-E244 HydrophobicContact CG2-CB 3.45Å; I239-E244 VanDerWaalsContact CG2-CB 3.45Å; T241-E244 WeakPolarHBondContact CG2-OE1 3.44Å; T241-E244 PolarHBondContact O-N 3.47Å; T241-E244 WeakPolarHBondContact OG1-CB 3.21Å; T241-E244 WeakPolarHBondContact OG1-CG 3.03Å; T241-E244 PolarHBondContact OG1-N 3.46Å; T241-E244 PolarHBondContact OG1-OE1 2.89Å; S242-E244 VanDerWaalsContact C-N 3.32Å; S242-E244 PolarHBondContact O-N 2.75Å; E244-Q247 WeakPolarHBondContact O-CB 3.18Å; E244-Q247 PolarHBondContact O-N 3.02Å; E244-Q247 VanDerWaalsContact O-N 3.15Å; E244-M248 PolarHBondContact O-N 2.87Å; E244-I276 HydrophobicContact CB-CG2 4.44Å; E244-I276 HydrophobicContact CG-CG2 4.04Å; E244-S278 WeakPolarHBondContact OE1-CB 3.15Å; E244-S278 WeakPolarHBondContact OE2-CB 3.47Å; E244-S278 PolarHBondContact OE2-OG 2.9Å
245	K	70.9	Confident	71.8	Confident	107 Å²	107	69.2 Å²	69.2	47%	0.465	35%	0.354	S	S	.	.	H	α-helix	trans	-59.8	-44.9	171.5	-172.8	-177.7	177.2	-178.4	0	111.8	F236 T241 S242 Q247 M248 E249	F236-K245 HydrophobicContact CD1-CG 4.02Å; F236-K245 HydrophobicContact CE1-CG 3.84Å; T241-K245 PolarHBondContact O-N 3.11Å; S242-K245 PolarHBondContact O-N 3.15Å; K245-Q247 PolarHBondContact O-N 2.77Å; K245-M248 PolarHBondContact O-N 2.92Å; K245-E249 WeakPolarHBondContact O-CB 3.43Å; K245-E249 PolarHBondContact O-N 3.42Å
246	D	74.2	Confident	72	Confident	96 Å²	96	70.2 Å²	70.2	51%	0.513	36%	0.36	S	S	.	.	H	α-helix	trans	-67.4	-20.4	176.7	-66.5	-7.3	0	0	0	113.1	S242 R250	S242-D246 PolarHBondContact O-N 2.95Å; S242-D246 VanDerWaalsContact O-N 3.08Å; D246-R250 PolarHBondContact O-NH2 2.7Å
247	Q	68	Low	72.3	Confident	46 Å²	46	72.2 Å²	72.2	22%	0.215	37%	0.37	C	S	.	.	H	α-helix	trans	-83	-44.8	171.1	-72.4	168	62.1	0	0	111	E243 E244 K245 R250 I251 I276	E243-Q247 WeakPolarHBondContact O-CG 3.08Å; E243-Q247 PolarHBondContact O-N 3.19Å; E243-Q247 PolarHBondContact O-NE2 2.99Å; E244-Q247 WeakPolarHBondContact O-CB 3.18Å; E244-Q247 PolarHBondContact O-N 3.02Å; E244-Q247 VanDerWaalsContact O-N 3.15Å; K245-Q247 PolarHBondContact O-N 2.77Å; Q247-R250 WeakPolarHBondContact O-CB 3.19Å; Q247-R250 PolarHBondContact O-N 2.78Å; Q247-I251 VanDerWaalsContact O-CG1 3.29Å; Q247-I251 WeakPolarHBondContact O-CG1 3.49Å; Q247-I251 PolarHBondContact O-N 2.89Å; Q247-I276 HydrophobicContact CB-CD1 3.89Å
248	M	74.6	Confident	72.6	Confident	0 Å²	0	73.7 Å²	73.7	0%	0	36%	0.361	C	S	.	.	H	α-helix	trans	-64.2	-43.1	177.9	-177	58	83.5	0	0	112.1	A235 F236 I239 E244 K245 R250 I251 L252 I273 P274 I276	A235-M248 HydrophobicContact CB-CE 4.05Å; A235-M248 HydrophobicContact CB-CG 4.35Å; A235-M248 HydrophobicContact CB-SD 3.88Å; F236-M248 HydrophobicContact CD1-CG 4.31Å; F236-M248 HydrophobicContact CE1-CB 4.4Å; F236-M248 HydrophobicContact CE1-CG 4.26Å; I239-M248 HydrophobicContact CD1-CB 3.38Å; I239-M248 HydrophobicContact CD1-CE 3.72Å; I239-M248 HydrophobicContact CD1-CG 3.76Å; E244-M248 PolarHBondContact O-N 2.87Å; K245-M248 PolarHBondContact O-N 2.92Å; M248-R250 PolarHBondContact O-N 2.9Å; M248-I251 PolarHBondContact O-N 3.15Å; M248-L252 HydrophobicContact CG-CD1 3.73Å; M248-L252 HydrophobicContact CG-CG 4.08Å; M248-L252 WeakPolarHBondContact O-CB 3.29Å; M248-L252 VanDerWaalsContact O-CG 3.26Å; M248-L252 WeakPolarHBondContact O-CG 3.41Å; M248-L252 PolarHBondContact O-N 3.37Å; M248-L252 HydrophobicContact SD-CD1 3.98Å; M248-L252 HydrophobicContact SD-CD2 4.2Å; M248-L252 HydrophobicContact SD-CG 3.76Å; M248-I273 HydrophobicContact CE-CG2 4.27Å; M248-P274 HydrophobicContact CE-CB 4.23Å; M248-P274 HydrophobicContact CE-CG 4.42Å; M248-P274 WeakPolarHBondContact CE-O 3.28Å; M248-P274 HydrophobicContact SD-CB 4.41Å; M248-P274 HydrophobicContact SD-CG 4.21Å; M248-I276 HydrophobicContact CB-CD1 3.81Å; M248-I276 HydrophobicContact CE-CD1 4.18Å; M248-I276 HydrophobicContact CE-CG1 4.26Å
249	E	76.6	Confident	73.1	Confident	78 Å²	78	71.3 Å²	71.3	36%	0.364	34%	0.343	S	S	.	.	H	α-helix	trans	-58.5	-38.5	177	-169.3	-175.7	123.7	0	0	111.7	F236 K245 K253	F236-E249 HydrophobicContact CE1-CB 4.22Å; F236-E249 HydrophobicContact CZ-CB 4.01Å; F236-E249 HydrophobicContact CZ-CG 4.25Å; K245-E249 WeakPolarHBondContact O-CB 3.43Å; K245-E249 PolarHBondContact O-N 3.42Å; E249-K253 HydrophobicContact CG-CD 4.21Å; E249-K253 WeakPolarHBondContact O-CB 3.39Å; E249-K253 VanDerWaalsContact O-CG 3.24Å; E249-K253 WeakPolarHBondContact O-CG 3.24Å; E249-K253 PolarHBondContact O-N 3.05Å; E249-K253 WeakPolarHBondContact OE1-CE 3.47Å; E249-K253 IonicContact OE1-NZ 3.36Å; E249-K253 PolarHBondContact OE1-NZ 3.26Å
250	R	75.9	Confident	73.5	Confident	138 Å²	138	76 Å²	76	52%	0.521	36%	0.363	S	S	.	.	H	α-helix	trans	-67.3	-50.6	176.2	-166.5	-167.4	-39.9	155.6	14.6	111.8	D246 Q247 M248 L252 K253 E254	D246-R250 PolarHBondContact O-NH2 2.7Å; Q247-R250 WeakPolarHBondContact O-CB 3.19Å; Q247-R250 PolarHBondContact O-N 2.78Å; M248-R250 PolarHBondContact O-N 2.9Å; R250-L252 VanDerWaalsContact C-N 3.31Å; R250-L252 PolarHBondContact O-N 3.46Å; R250-K253 PolarHBondContact O-N 3.36Å; R250-E254 WeakPolarHBondContact O-CG 3.35Å; R250-E254 PolarHBondContact O-N 2.67Å
251	I	77.2	Confident	74	Confident	43 Å²	43	76.7 Å²	76.7	22%	0.221	35%	0.353	C	S	.	.	H	α-helix	trans	-59.9	-42.3	178.5	-68.1	163.9	0	0	0	110.7	Q247 M248 K255 P274 I276 I536	Q247-I251 VanDerWaalsContact O-CG1 3.29Å; Q247-I251 WeakPolarHBondContact O-CG1 3.49Å; Q247-I251 PolarHBondContact O-N 2.89Å; M248-I251 PolarHBondContact O-N 3.15Å; I251-K255 WeakPolarHBondContact O-CB 3.25Å; I251-K255 PolarHBondContact O-N 2.88Å; I251-P274 HydrophobicContact CG2-CB 3.91Å; I251-P274 HydrophobicContact CG2-CG 3.95Å; I251-I276 HydrophobicContact CD1-CD1 4.2Å; I251-I276 HydrophobicContact CD1-CG1 4.37Å; I251-I536 HydrophobicContact CG2-CD1 4.4Å
252	L	78.7	Confident	73.8	Confident	6 Å²	6	77.9 Å²	77.9	3%	0.031	36%	0.358	C	S	.	.	H	α-helix	trans	-65.7	-47.2	176	-70.4	174.1	0	0	0	111.5	Y231 V232 A235 F236 M248 R250 E254 K255 L256	Y231-L252 HydrophobicContact CD1-CD2 4.36Å; Y231-L252 HydrophobicContact CE1-CD2 3.62Å; V232-L252 HydrophobicContact CG1-CD1 4.31Å; A235-L252 HydrophobicContact CB-CD1 4.05Å; A235-L252 HydrophobicContact CB-CD2 4.09Å; F236-L252 HydrophobicContact CD2-CD1 4.22Å; F236-L252 HydrophobicContact CE2-CD1 3.78Å; F236-L252 HydrophobicContact CZ-CD1 3.99Å; M248-L252 HydrophobicContact CG-CD1 3.73Å; M248-L252 HydrophobicContact CG-CG 4.08Å; M248-L252 WeakPolarHBondContact O-CB 3.29Å; M248-L252 VanDerWaalsContact O-CG 3.26Å; M248-L252 WeakPolarHBondContact O-CG 3.41Å; M248-L252 PolarHBondContact O-N 3.37Å; M248-L252 HydrophobicContact SD-CD1 3.98Å; M248-L252 HydrophobicContact SD-CD2 4.2Å; M248-L252 HydrophobicContact SD-CG 3.76Å; R250-L252 VanDerWaalsContact C-N 3.31Å; R250-L252 PolarHBondContact O-N 3.46Å; L252-E254 PolarHBondContact O-N 3.42Å; L252-K255 PolarHBondContact O-N 3.45Å; L252-L256 WeakPolarHBondContact O-CB 3.24Å; L252-L256 WeakPolarHBondContact O-CG 3.32Å; L252-L256 PolarHBondContact O-N 2.64Å
253	K	77.7	Confident	73.4	Confident	114 Å²	114	80.6 Å²	80.6	50%	0.496	37%	0.365	S	S	.	.	H	α-helix	trans	-56.8	-49.7	176.9	-80.8	170.6	172	173.5	0	112.1	E249 R250 K255 L256 E257	E249-K253 HydrophobicContact CG-CD 4.21Å; E249-K253 WeakPolarHBondContact O-CB 3.39Å; E249-K253 VanDerWaalsContact O-CG 3.24Å; E249-K253 WeakPolarHBondContact O-CG 3.24Å; E249-K253 PolarHBondContact O-N 3.05Å; E249-K253 WeakPolarHBondContact OE1-CE 3.47Å; E249-K253 IonicContact OE1-NZ 3.36Å; E249-K253 PolarHBondContact OE1-NZ 3.26Å; R250-K253 PolarHBondContact O-N 3.36Å; K253-K255 PolarHBondContact O-N 3.04Å; K253-L256 PolarHBondContact O-N 3.38Å; K253-E257 WeakPolarHBondContact O-CB 3.38Å; K253-E257 PolarHBondContact O-N 3.25Å
254	E	73.5	Confident	73.6	Confident	74 Å²	74	78.9 Å²	78.9	35%	0.346	36%	0.359	S	S	.	.	H	α-helix	trans	-63.1	-41.2	178.5	-70.8	172.7	-167.6	0	0	112.2	R250 L252 Y258	R250-E254 WeakPolarHBondContact O-CG 3.35Å; R250-E254 PolarHBondContact O-N 2.67Å; L252-E254 PolarHBondContact O-N 3.42Å; E254-Y258 WeakPolarHBondContact O-CB 3.37Å; E254-Y258 PolarHBondContact O-N 3.45Å
255	K	73	Confident	73.5	Confident	48 Å²	48	87.1 Å²	87.1	21%	0.209	39%	0.394	C	S	.	.	H	α-helix	trans	-66.1	-43.9	177.4	-170.1	179	-168.5	-176.7	0	112.2	Y231 I251 L252 K253 Y258 V259 E271	Y231-K255 PolarHBondContact OH-NZ 3.03Å; I251-K255 WeakPolarHBondContact O-CB 3.25Å; I251-K255 PolarHBondContact O-N 2.88Å; L252-K255 PolarHBondContact O-N 3.45Å; K253-K255 PolarHBondContact O-N 3.04Å; K255-Y258 PolarHBondContact O-N 2.84Å; K255-V259 WeakPolarHBondContact O-CG2 3.23Å; K255-V259 PolarHBondContact O-N 2.84Å; K255-E271 WeakPolarHBondContact CE-OE1 3.24Å; K255-E271 VanDerWaalsContact CE-OE2 3.3Å; K255-E271 WeakPolarHBondContact CE-OE2 3.43Å; K255-E271 IonicContact NZ-OE1 2.69Å; K255-E271 PolarHBondContact NZ-OE1 3.34Å; K255-E271 IonicContact NZ-OE2 3.46Å; K255-E271 PolarHBondContact NZ-OE2 3.23Å
256	L	76.3	Confident	73.2	Confident	22 Å²	22	83.4 Å²	83.4	12%	0.115	38%	0.38	C	S	.	.	H	α-helix	trans	-63.2	-48.6	176.5	-69.3	171.6	0	0	0	110.6	L228 L252 K253 Y258 V259 F260 W268	L228-L256 HydrophobicContact CD1-CD2 3.53Å; L228-L256 HydrophobicContact CD2-CD2 4.13Å; L228-L256 HydrophobicContact CG-CD2 4.17Å; L252-L256 WeakPolarHBondContact O-CB 3.24Å; L252-L256 WeakPolarHBondContact O-CG 3.32Å; L252-L256 PolarHBondContact O-N 2.64Å; K253-L256 PolarHBondContact O-N 3.38Å; L256-Y258 VanDerWaalsContact C-N 3.29Å; L256-Y258 PolarHBondContact O-N 3.47Å; L256-V259 PolarHBondContact O-N 3.06Å; L256-F260 HydrophobicContact CB-CD2 4.37Å; L256-F260 HydrophobicContact CB-CE2 4.42Å; L256-F260 HydrophobicContact CD2-CE2 4.42Å; L256-F260 WeakPolarHBondContact O-CB 3.25Å; L256-F260 WeakPolarHBondContact O-CD2 3.33Å; L256-F260 PolarHBondContact O-N 3.43Å; L256-W268 HydrophobicContact CD2-CH2 4.1Å
257	E	76.8	Confident	72.9	Confident	104 Å²	104	84.6 Å²	84.6	49%	0.486	39%	0.387	S	S	.	.	H	α-helix	trans	-55.9	-43	173.9	-84.7	-166	-141.9	0	0	112.2	K253 R261	K253-E257 WeakPolarHBondContact O-CB 3.38Å; K253-E257 PolarHBondContact O-N 3.25Å; E257-R261 WeakPolarHBondContact O-CB 3.21Å; E257-R261 PolarHBondContact O-N 2.92Å; E257-R261 IonicContact OE2-CZ 2.65Å; E257-R261 IonicContact OE2-NH1 3.43Å; E257-R261 PolarHBondContact OE2-NH1 3.11Å; E257-R261 IonicContact OE2-NH2 2.66Å; E257-R261 PolarHBondContact OE2-NH2 3.4Å
258	Y	73.6	Confident	72.9	Confident	139 Å²	139	83.5 Å²	83.5	55%	0.545	38%	0.381	S	S	.	.	H	α-helix	trans	-64.1	-43.3	178.4	-179.1	-93	0	0	0	112.4	E254 K255 L256 N262 I264	E254-Y258 WeakPolarHBondContact O-CB 3.37Å; E254-Y258 PolarHBondContact O-N 3.45Å; K255-Y258 PolarHBondContact O-N 2.84Å; L256-Y258 VanDerWaalsContact C-N 3.29Å; L256-Y258 PolarHBondContact O-N 3.47Å; Y258-N262 VanDerWaalsContact CD2-ND2 3.3Å; Y258-N262 WeakPolarHBondContact CD2-ND2 3.32Å; Y258-N262 WeakPolarHBondContact CE2-ND2 3.32Å; Y258-N262 WeakPolarHBondContact O-CB 3.37Å; Y258-N262 PolarHBondContact O-N 3.23Å; Y258-N262 PolarHBondContact O-ND2 2.91Å; Y258-I264 HydrophobicContact CD1-CD1 4Å; Y258-I264 HydrophobicContact CE1-CD1 3.44Å; Y258-I264 VanDerWaalsContact CE1-CD1 3.44Å
259	V	76.8	Confident	72.2	Confident	13 Å²	13	89.4 Å²	89.4	8%	0.079	41%	0.406	C	S	.	.	H	α-helix	trans	-69.7	-45.6	179.9	172.2	0	0	0	0	111.4	K255 L256 N263 I264 V266 W268	K255-V259 WeakPolarHBondContact O-CG2 3.23Å; K255-V259 PolarHBondContact O-N 2.84Å; L256-V259 PolarHBondContact O-N 3.06Å; V259-N263 PolarHBondContact O-N 3.02Å; V259-I264 HydrophobicContact CG1-CB 4.31Å; V259-I264 WeakPolarHBondContact CG1-O 3.21Å; V259-I264 PolarHBondContact O-N 3.16Å; V259-I264 VanDerWaalsContact O-N 3.14Å; V259-V266 HydrophobicContact CG1-CG2 3.87Å; V259-V266 HydrophobicContact CG2-CG2 3.87Å; V259-W268 HydrophobicContact CB-CH2 4.1Å; V259-W268 HydrophobicContact CB-CZ2 4.3Å; V259-W268 HydrophobicContact CG1-CH2 3.97Å; V259-W268 HydrophobicContact CG1-CZ2 3.68Å; V259-W268 HydrophobicContact CG2-CH2 3.96Å; V259-W268 HydrophobicContact CG2-CZ2 4.5Å
260	F	75.6	Confident	71.3	Confident	121 Å²	121	91 Å²	91	53%	0.531	42%	0.422	S	S	.	.	H	α-helix	trans	-64.9	-43.7	176.8	-76.6	-62.3	0	0	0	112.6	L228 L256 N262 N263	L228-F260 HydrophobicContact CD2-CE2 4.44Å; L228-F260 HydrophobicContact CD2-CZ 4.08Å; L256-F260 HydrophobicContact CB-CD2 4.37Å; L256-F260 HydrophobicContact CB-CE2 4.42Å; L256-F260 HydrophobicContact CD2-CE2 4.42Å; L256-F260 WeakPolarHBondContact O-CB 3.25Å; L256-F260 WeakPolarHBondContact O-CD2 3.33Å; L256-F260 PolarHBondContact O-N 3.43Å; F260-N262 VanDerWaalsContact C-N 3.31Å; F260-N262 PolarHBondContact O-N 2.95Å; F260-N263 PolarHBondContact O-N 3.2Å
261	R	74.3	Confident	70.7	Confident	181 Å²	181	87.2 Å²	87.2	68%	0.683	41%	0.41	S	S	*	.	H	α-helix	trans	-68.2	-28.3	-177.8	-172.7	174.7	-66.1	136.9	8.5	113.3	E257	E257-R261 WeakPolarHBondContact O-CB 3.21Å; E257-R261 PolarHBondContact O-N 2.92Å; E257-R261 IonicContact OE2-CZ 2.65Å; E257-R261 IonicContact OE2-NH1 3.43Å; E257-R261 PolarHBondContact OE2-NH1 3.11Å; E257-R261 IonicContact OE2-NH2 2.66Å; E257-R261 PolarHBondContact OE2-NH2 3.4Å
262	N	67.6	Low	69.9	Low	85 Å²	85	90.9 Å²	90.9	46%	0.455	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.1	3.1	179	-61.4	-54.4	0	0	0	113.4	Y258 F260 I264	Y258-N262 VanDerWaalsContact CD2-ND2 3.3Å; Y258-N262 WeakPolarHBondContact CD2-ND2 3.32Å; Y258-N262 WeakPolarHBondContact CE2-ND2 3.32Å; Y258-N262 WeakPolarHBondContact O-CB 3.37Å; Y258-N262 PolarHBondContact O-N 3.23Å; Y258-N262 PolarHBondContact O-ND2 2.91Å; F260-N262 VanDerWaalsContact C-N 3.31Å; F260-N262 PolarHBondContact O-N 2.95Å; N262-I264 HydrophobicContact CB-CD1 3.76Å; N262-I264 HydrophobicContact CB-CG1 3.71Å; N262-I264 PolarHBondContact O-N 3.2Å
263	N	64.5	Low	69.2	Low	146 Å²	146	93 Å²	93	78%	0.781	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	50	40.2	-177.7	-163.1	25.2	0	0	0	113.9	V259 F260	V259-N263 PolarHBondContact O-N 3.02Å; F260-N263 PolarHBondContact O-N 3.2Å
264	I	70.1	Confident	68.4	Low	69 Å²	69	88.3 Å²	88.3	35%	0.354	42%	0.422	S	S	.	.			trans	-78.9	126.5	-175.8	-58.2	168.7	0	0	0	108.9	Y258 V259 N262 V266	Y258-I264 HydrophobicContact CD1-CD1 4Å; Y258-I264 HydrophobicContact CE1-CD1 3.44Å; Y258-I264 VanDerWaalsContact CE1-CD1 3.44Å; V259-I264 HydrophobicContact CG1-CB 4.31Å; V259-I264 WeakPolarHBondContact CG1-O 3.21Å; V259-I264 PolarHBondContact O-N 3.16Å; V259-I264 VanDerWaalsContact O-N 3.14Å; N262-I264 HydrophobicContact CB-CD1 3.76Å; N262-I264 HydrophobicContact CB-CG1 3.71Å; N262-I264 PolarHBondContact O-N 3.2Å; I264-V266 HydrophobicContact CB-CG2 4.28Å; I264-V266 HydrophobicContact CG2-CG2 3.7Å; I264-V266 PolarHBondContact O-N 2.88Å
265	K	66.9	Low	67.6	Low	200 Å²	200	90.1 Å²	90.1	87%	0.87	44%	0.438	S	S	*	.			trans	-74.7	112.3	168.2	-64.8	-175.1	179.4	-176.8	0	108.6
266	V	64.3	Low	67	Low	28 Å²	28	89 Å²	89	17%	0.17	43%	0.434	C	S	.	.			trans	-119.1	126.8	179	179.6	0	0	0	0	108.8	V259 I264 W268 E271	V259-V266 HydrophobicContact CG1-CG2 3.87Å; V259-V266 HydrophobicContact CG2-CG2 3.87Å; I264-V266 HydrophobicContact CB-CG2 4.28Å; I264-V266 HydrophobicContact CG2-CG2 3.7Å; I264-V266 PolarHBondContact O-N 2.88Å; V266-W268 HydrophobicContact CB-CD2 4.28Å; V266-W268 HydrophobicContact CB-CH2 4.42Å; V266-W268 HydrophobicContact CB-CZ2 4.12Å; V266-W268 HydrophobicContact CG1-CD2 4.06Å; V266-W268 HydrophobicContact CG1-CE3 3.97Å; V266-W268 HydrophobicContact CG1-CH2 4.44Å; V266-W268 HydrophobicContact CG1-CZ2 4.5Å; V266-W268 HydrophobicContact CG1-CZ3 4.16Å; V266-W268 PolarHBondContact O-N 2.9Å; V266-W268 PolarHBondContact O-NE1 3.22Å; V266-E271 HydrophobicContact CG1-CB 4.34Å; V266-E271 HydrophobicContact CG1-CG 4.11Å
267	D	68.5	Low	66.1	Low	121 Å²	121	90 Å²	90	65%	0.647	44%	0.441	S	S	*	.			trans	-80.8	82.6	176.8	-62.1	-31.8	0	0	0	109.9	K269 T270 E271	D267-K269 PolarHBondContact O-N 3.37Å; D267-T270 PolarHBondContact O-N 2.93Å; D267-E271 PolarHBondContact O-N 3.01Å; D267-E271 VanDerWaalsContact O-N 3.16Å
268	W	67.6	Low	65	Low	24 Å²	24	86.9 Å²	86.9	9%	0.091	43%	0.432	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-22.3	-172.2	-57.8	105.4	0	0	0	115.1	E227 L228 Y231 R234 L256 V259 V266	E227-W268 HydrophobicContact CB-CB 4.11Å; L228-W268 HydrophobicContact CD1-CD2 3.55Å; L228-W268 VanDerWaalsContact CD1-CE2 3.46Å; L228-W268 HydrophobicContact CD1-CE3 3.77Å; L228-W268 HydrophobicContact CD1-CG 4.15Å; L228-W268 HydrophobicContact CD1-CH2 3.79Å; L228-W268 HydrophobicContact CD1-CZ2 3.58Å; L228-W268 HydrophobicContact CD1-CZ3 3.89Å; Y231-W268 HydrophobicContact CD1-CE3 4.03Å; Y231-W268 HydrophobicContact CD1-CZ3 4.28Å; Y231-W268 HydrophobicContact CD2-CE3 4.42Å; Y231-W268 HydrophobicContact CE1-CE3 4.36Å; Y231-W268 HydrophobicContact CE1-CZ3 4.27Å; Y231-W268 HydrophobicContact CG-CE3 4.08Å; R234-W268 PolarHBondContact NH2-O 3.13Å; L256-W268 HydrophobicContact CD2-CH2 4.1Å; V259-W268 HydrophobicContact CB-CH2 4.1Å; V259-W268 HydrophobicContact CB-CZ2 4.3Å; V259-W268 HydrophobicContact CG1-CH2 3.97Å; V259-W268 HydrophobicContact CG1-CZ2 3.68Å; V259-W268 HydrophobicContact CG2-CH2 3.96Å; V259-W268 HydrophobicContact CG2-CZ2 4.5Å; V266-W268 HydrophobicContact CB-CD2 4.28Å; V266-W268 HydrophobicContact CB-CH2 4.42Å; V266-W268 HydrophobicContact CB-CZ2 4.12Å; V266-W268 HydrophobicContact CG1-CD2 4.06Å; V266-W268 HydrophobicContact CG1-CE3 3.97Å; V266-W268 HydrophobicContact CG1-CH2 4.44Å; V266-W268 HydrophobicContact CG1-CZ2 4.5Å; V266-W268 HydrophobicContact CG1-CZ3 4.16Å; V266-W268 PolarHBondContact O-N 2.9Å; V266-W268 PolarHBondContact O-NE1 3.22Å
269	K	60.1	Low	63.9	Low	124 Å²	124	90.9 Å²	90.9	54%	0.539	45%	0.446	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-47.3	171.7	-79.1	168.5	168.6	155.4	0	111.8	E227 R234 D267	E227-K269 HydrophobicContact CB-CG 4.49Å; E227-K269 HydrophobicContact CG-CD 4.4Å; E227-K269 HydrophobicContact CG-CG 4.42Å; E227-K269 WeakPolarHBondContact OE1-CD 3.23Å; E227-K269 WeakPolarHBondContact OE1-CE 3.48Å; E227-K269 IonicContact OE1-NZ 3.35Å; E227-K269 PolarHBondContact OE1-NZ 2.99Å; R234-K269 PolarHBondContact NH1-O 3.46Å; R234-K269 VanDerWaalsContact NH1-O 3.1Å; D267-K269 PolarHBondContact O-N 3.37Å
270	T	58.1	Low	62.5	Low	112 Å²	112	91.9 Å²	91.9	69%	0.687	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	-14	-173.5	-23.1	0	0	0	0	113.3	D267	D267-T270 PolarHBondContact O-N 2.93Å
271	E	63.2	Low	61.3	Low	57 Å²	57	88.3 Å²	88.3	27%	0.266	44%	0.441	S	S	.	.	S	Bend	trans	-77.1	133.1	-172.5	-146.2	-163.3	-177.3	0	0	113.4	Y231 K255 V266 D267	Y231-E271 HydrophobicContact CD2-CB 4.48Å; Y231-E271 HydrophobicContact CE2-CB 4.18Å; K255-E271 WeakPolarHBondContact CE-OE1 3.24Å; K255-E271 VanDerWaalsContact CE-OE2 3.3Å; K255-E271 WeakPolarHBondContact CE-OE2 3.43Å; K255-E271 IonicContact NZ-OE1 2.69Å; K255-E271 PolarHBondContact NZ-OE1 3.34Å; K255-E271 IonicContact NZ-OE2 3.46Å; K255-E271 PolarHBondContact NZ-OE2 3.23Å; V266-E271 HydrophobicContact CG1-CB 4.34Å; V266-E271 HydrophobicContact CG1-CG 4.11Å; D267-E271 PolarHBondContact O-N 3.01Å; D267-E271 VanDerWaalsContact O-N 3.16Å
272	N	61.9	Low	60	Low	120 Å²	120	82.1 Å²	82.1	64%	0.642	43%	0.429	S	S	*	.	P	Polyproline II helix	trans	-67.6	133.9	-178.6	-72.8	-64.3	0	0	0	112.6
273	I	63	Low	59	Low	52 Å²	52	81.6 Å²	81.6	27%	0.267	43%	0.432	S	S	.	.	P	Polyproline II helix	trans	-62.2	138.9	173.7	-58	168.4	0	0	0	109.5	R234 A235 M248 T275	R234-I273 HydrophobicContact CB-CD1 3.89Å; R234-I273 HydrophobicContact CB-CG1 4.41Å; A235-I273 HydrophobicContact CB-CG2 4.03Å; M248-I273 HydrophobicContact CE-CG2 4.27Å; I273-T275 PolarHBondContact O-N 3.07Å
274	P	61	Low	58.1	Low	15 Å²	15	77.3 Å²	77.3	10%	0.097	41%	0.406	C	S	.	.			trans	-67.7	100.5	175.3	-15.9	30.8	0	0	0	110.4	Y231 M248 I251 I276	Y231-P274 WeakPolarHBondContact OH-CD 3.22Å; M248-P274 HydrophobicContact CE-CB 4.23Å; M248-P274 HydrophobicContact CE-CG 4.42Å; M248-P274 WeakPolarHBondContact CE-O 3.28Å; M248-P274 HydrophobicContact SD-CB 4.41Å; M248-P274 HydrophobicContact SD-CG 4.21Å; I251-P274 HydrophobicContact CG2-CB 3.91Å; I251-P274 HydrophobicContact CG2-CG 3.95Å; P274-I276 PolarHBondContact O-N 3.26Å; P274-I276 VanDerWaalsContact O-N 3.11Å
275	T	57.4	Low	57.1	Low	111 Å²	111	80.6 Å²	80.6	68%	0.681	41%	0.414	S	S	*	.			trans	-66.5	112.2	177.3	37.1	0	0	0	0	110.4	I273 P277	I273-T275 PolarHBondContact O-N 3.07Å; T275-P277 VanDerWaalsContact O-CD 3.3Å; T275-P277 WeakPolarHBondContact O-CD 3.35Å
276	I	59	Low	56.3	Low	25 Å²	25	78.7 Å²	78.7	13%	0.128	41%	0.406	C	S	.	.			trans	-88.3	116.3	170.2	-58.8	-174.5	0	0	0	107.5	I239 E244 Q247 M248 I251 P274 S278	I239-I276 HydrophobicContact CD1-CD1 3.86Å; E244-I276 HydrophobicContact CB-CG2 4.44Å; E244-I276 HydrophobicContact CG-CG2 4.04Å; Q247-I276 HydrophobicContact CB-CD1 3.89Å; M248-I276 HydrophobicContact CB-CD1 3.81Å; M248-I276 HydrophobicContact CE-CD1 4.18Å; M248-I276 HydrophobicContact CE-CG1 4.26Å; I251-I276 HydrophobicContact CD1-CD1 4.2Å; I251-I276 HydrophobicContact CD1-CG1 4.37Å; P274-I276 PolarHBondContact O-N 3.26Å; P274-I276 VanDerWaalsContact O-N 3.11Å; I276-S278 VanDerWaalsContact C-N 3.25Å; I276-S278 PolarHBondContact O-N 2.83Å; I276-S278 PolarHBondContact O-OG 3.37Å
277	P	57.3	Low	55.4	Low	42 Å²	42	80.5 Å²	80.5	27%	0.273	42%	0.42	S	S	.	.			trans	-79.1	69.9	-177.3	-22.8	40.2	0	0	0	113.1	T275 R279 A280 I281 L534	T275-P277 VanDerWaalsContact O-CD 3.3Å; T275-P277 WeakPolarHBondContact O-CD 3.35Å; P277-R279 PolarHBondContact O-N 3.24Å; P277-R279 VanDerWaalsContact O-N 3.13Å; P277-A280 HydrophobicContact CB-CB 3.9Å; P277-A280 WeakPolarHBondContact O-CB 3.43Å; P277-A280 PolarHBondContact O-N 2.7Å; P277-I281 PolarHBondContact O-N 3.44Å; P277-I281 VanDerWaalsContact O-N 3.13Å; P277-L534 HydrophobicContact CB-CD1 4.04Å; P277-L534 HydrophobicContact CG-CD1 3.58Å; P277-L534 HydrophobicContact CG-CD2 3.7Å; P277-L534 HydrophobicContact CG-CG 4.18Å
278	S	55.2	Low	54.3	Low	40 Å²	40	80.1 Å²	80.1	28%	0.28	41%	0.413	S	S	.	.	H	α-helix	trans	-42.1	-49	177.7	-36.8	0	0	0	0	112.3	E244 I276 A280 A282	E244-S278 WeakPolarHBondContact OE1-CB 3.15Å; E244-S278 WeakPolarHBondContact OE2-CB 3.47Å; E244-S278 PolarHBondContact OE2-OG 2.9Å; I276-S278 VanDerWaalsContact C-N 3.25Å; I276-S278 PolarHBondContact O-N 2.83Å; I276-S278 PolarHBondContact O-OG 3.37Å; S278-A280 PolarHBondContact O-N 3Å; S278-A282 WeakPolarHBondContact O-CB 2.91Å; S278-A282 PolarHBondContact O-N 3.45Å
279	R	49.6	Very low	53.1	Low	223 Å²	223	85.2 Å²	85.2	84%	0.842	44%	0.442	S	S	*	.	H	α-helix	trans	-67	-34.7	-179.6	-69.6	-172.5	179.3	-172.8	1.1	113.7	P277 S283	P277-R279 PolarHBondContact O-N 3.24Å; P277-R279 VanDerWaalsContact O-N 3.13Å; R279-S283 WeakPolarHBondContact O-CB 3.47Å; R279-S283 PolarHBondContact O-N 3.37Å; R279-S283 VanDerWaalsContact O-N 3.11Å; R279-S283 PolarHBondContact O-OG 3.18Å
280	A	48.2	Very low	52.3	Low	34 Å²	34	86 Å²	86	28%	0.281	45%	0.45	S	S	.	.	H	α-helix	trans	-68.9	-53	176.8	0	0	0	0	0	110.7	P277 S278 A282 S283 F284	P277-A280 HydrophobicContact CB-CB 3.9Å; P277-A280 WeakPolarHBondContact O-CB 3.43Å; P277-A280 PolarHBondContact O-N 2.7Å; S278-A280 PolarHBondContact O-N 3Å; A280-A282 PolarHBondContact O-N 2.97Å; A280-S283 PolarHBondContact O-N 3.16Å; A280-S283 VanDerWaalsContact O-N 3.16Å; A280-F284 VanDerWaalsContact O-CD2 3.3Å; A280-F284 WeakPolarHBondContact O-CD2 3.48Å; A280-F284 PolarHBondContact O-N 3.46Å
281	I	49.8	Very low	51.5	Low	46 Å²	46	90.2 Å²	90.2	24%	0.236	45%	0.454	C	S	.	.	H	α-helix	trans	-63.5	-42.2	-176.4	-58.5	171.6	0	0	0	110.7	P277 R285	P277-I281 PolarHBondContact O-N 3.44Å; P277-I281 VanDerWaalsContact O-N 3.13Å; I281-R285 WeakPolarHBondContact O-CB 3.37Å; I281-R285 WeakPolarHBondContact O-CG 3.13Å; I281-R285 PolarHBondContact O-N 3.09Å
282	A	47.6	Very low	50.2	Low	51 Å²	51	90.4 Å²	90.4	42%	0.421	47%	0.471	S	S	.	.	H	α-helix	trans	-66.9	-34.4	176	0	0	0	0	0	113.2	S278 A280 K286	S278-A282 WeakPolarHBondContact O-CB 2.91Å; S278-A282 PolarHBondContact O-N 3.45Å; A280-A282 PolarHBondContact O-N 2.97Å; A282-K286 WeakPolarHBondContact O-CB 3.36Å; A282-K286 WeakPolarHBondContact O-CG 3.44Å; A282-K286 PolarHBondContact O-N 2.88Å; A282-K286 VanDerWaalsContact O-N 3.09Å
283	S	45.9	Very low	48.8	Very low	74 Å²	74	92 Å²	92	52%	0.517	48%	0.479	S	S	.	.	H	α-helix	trans	-72.7	-43.2	177.2	-59.1	0	0	0	0	111.5	R279 A280 K286 S287	R279-S283 WeakPolarHBondContact O-CB 3.47Å; R279-S283 PolarHBondContact O-N 3.37Å; R279-S283 VanDerWaalsContact O-N 3.11Å; R279-S283 PolarHBondContact O-OG 3.18Å; A280-S283 PolarHBondContact O-N 3.16Å; A280-S283 VanDerWaalsContact O-N 3.16Å; S283-K286 PolarHBondContact O-N 3.04Å; S283-K286 VanDerWaalsContact O-N 3.15Å; S283-S287 PolarHBondContact O-N 2.99Å; S283-S287 PolarHBondContact O-OG 3.43Å
284	F	45.8	Very low	47.3	Very low	55 Å²	55	94.7 Å²	94.7	24%	0.241	50%	0.503	C	S	.	.	H	α-helix	trans	-60	-45.6	173.3	-85.7	-66.3	0	0	0	112.1	A280 K286 S287 F288 F532 F587	A280-F284 VanDerWaalsContact O-CD2 3.3Å; A280-F284 WeakPolarHBondContact O-CD2 3.48Å; A280-F284 PolarHBondContact O-N 3.46Å; F284-K286 VanDerWaalsContact C-N 3.27Å; F284-K286 PolarHBondContact O-N 2.7Å; F284-S287 PolarHBondContact O-N 3Å; F284-S287 PolarHBondContact O-OG 3.44Å; F284-F288 HydrophobicContact CD1-CD2 4.22Å; F284-F288 AromaticContact CD1-CE2 3.8Å; F284-F288 HydrophobicContact CD1-CE2 3.8Å; F284-F288 HydrophobicContact CE1-CE2 4.31Å; F284-F288 WeakPolarHBondContact O-CB 3.33Å; F284-F288 VanDerWaalsContact O-CD2 3.29Å; F284-F288 WeakPolarHBondContact O-CD2 3.42Å; F284-F288 PolarHBondContact O-N 2.93Å; F284-F532 HydrophobicContact CD1-CZ 4.2Å; F284-F532 HydrophobicContact CD2-CZ 4.33Å; F284-F532 HydrophobicContact CE1-CE2 4.18Å; F284-F532 AromaticContact CE1-CZ 3.6Å; F284-F532 HydrophobicContact CE1-CZ 3.6Å; F284-F532 AromaticContact CE2-CE2 3.9Å; F284-F532 HydrophobicContact CE2-CE2 3.9Å; F284-F532 AromaticContact CE2-CZ 3.73Å; F284-F532 HydrophobicContact CE2-CZ 3.73Å; F284-F532 AromaticContact CZ-CE2 3.51Å; F284-F532 HydrophobicContact CZ-CE2 3.51Å; F284-F532 AromaticContact CZ-CZ 3.34Å; F284-F532 HydrophobicContact CZ-CZ 3.34Å; F284-F587 AromaticContact CE2-CE1 3.79Å; F284-F587 HydrophobicContact CE2-CE1 3.79Å; F284-F587 HydrophobicContact CE2-CZ 4.11Å; F284-F587 AromaticContact CZ-CE1 3.72Å; F284-F587 HydrophobicContact CZ-CE1 3.72Å; F284-F587 HydrophobicContact CZ-CZ 4.27Å
285	R	48.1	Very low	46.3	Very low	138 Å²	138	100 Å²	100	52%	0.521	54%	0.535	S	S	.	.	H	α-helix	trans	-61.3	-34.4	174.4	-74.3	179.6	177	-178.7	2.8	112.8	E243 I281 N289	E243-R285 IonicContact OE1-NH1 3.23Å; E243-R285 IonicContact OE2-CZ 3.78Å; E243-R285 IonicContact OE2-NH1 3.27Å; E243-R285 PolarHBondContact OE2-NH1 2.76Å; E243-R285 IonicContact OE2-NH2 3.88Å; E243-R285 PolarHBondContact OE2-NH2 3.5Å; I281-R285 WeakPolarHBondContact O-CB 3.37Å; I281-R285 WeakPolarHBondContact O-CG 3.13Å; I281-R285 PolarHBondContact O-N 3.09Å; R285-N289 WeakPolarHBondContact O-CB 3.36Å; R285-N289 PolarHBondContact O-N 3.48Å
286	K	50.7	Low	45.3	Very low	161 Å²	161	102.1 Å²	102.1	70%	0.7	54%	0.542	S	S	*	.	H	α-helix	trans	-73.6	-41.9	176.5	-82.4	-176.7	174.8	-179.5	0	113.4	A282 S283 F284 I290	A282-K286 WeakPolarHBondContact O-CB 3.36Å; A282-K286 WeakPolarHBondContact O-CG 3.44Å; A282-K286 PolarHBondContact O-N 2.88Å; A282-K286 VanDerWaalsContact O-N 3.09Å; S283-K286 PolarHBondContact O-N 3.04Å; S283-K286 VanDerWaalsContact O-N 3.15Å; F284-K286 VanDerWaalsContact C-N 3.27Å; F284-K286 PolarHBondContact O-N 2.7Å; K286-I290 WeakPolarHBondContact O-CD1 3.28Å; K286-I290 WeakPolarHBondContact O-CG1 3.48Å
287	S	45.3	Very low	44.2	Very low	65 Å²	65	106.9 Å²	106.9	46%	0.455	57%	0.572	S	S	.	*	H	α-helix	trans	-70.4	-37.4	179.6	54.3	0	0	0	0	112.6	S283 F284	S283-S287 PolarHBondContact O-N 2.99Å; S283-S287 PolarHBondContact O-OG 3.43Å; F284-S287 PolarHBondContact O-N 3Å; F284-S287 PolarHBondContact O-OG 3.44Å
288	F	46.2	Very low	43.2	Very low	114 Å²	114	109.9 Å²	109.9	50%	0.5	59%	0.592	S	S	.	*	H	α-helix	trans	-74.4	-38.5	179.9	-81.3	-111.7	0	0	0	112.8	F284 I290 R291 F496	F284-F288 HydrophobicContact CD1-CD2 4.22Å; F284-F288 AromaticContact CD1-CE2 3.8Å; F284-F288 HydrophobicContact CD1-CE2 3.8Å; F284-F288 HydrophobicContact CE1-CE2 4.31Å; F284-F288 WeakPolarHBondContact O-CB 3.33Å; F284-F288 VanDerWaalsContact O-CD2 3.29Å; F284-F288 WeakPolarHBondContact O-CD2 3.42Å; F284-F288 PolarHBondContact O-N 2.93Å; F288-I290 PolarHBondContact O-N 3.47Å; F288-R291 PolarHBondContact O-N 2.96Å; F288-F496 HydrophobicContact CE1-CD2 4.2Å; F288-F496 AromaticContact CZ-CD2 3.8Å; F288-F496 HydrophobicContact CZ-CD2 3.8Å; F288-F496 HydrophobicContact CZ-CE2 4.11Å
289	N	41.7	Very low	42.3	Very low	131 Å²	131	116.8 Å²	116.8	70%	0.701	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76	-2.3	-175.4	-156.9	18.6	0	0	0	114.5	R285	R285-N289 WeakPolarHBondContact O-CB 3.36Å; R285-N289 PolarHBondContact O-N 3.48Å
290	I	44.1	Very low	41.6	Very low	141 Å²	141	113.2 Å²	113.2	72%	0.723	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85	-26.2	176.7	-72.3	169.9	0	0	0	112.4	K286 F288	K286-I290 WeakPolarHBondContact O-CD1 3.28Å; K286-I290 WeakPolarHBondContact O-CG1 3.48Å; F288-I290 PolarHBondContact O-N 3.47Å
291	R	39.5	Very low	41	Very low	200 Å²	200	116.3 Å²	116.3	76%	0.755	64%	0.642	S	S	*	*	S	Bend	trans	-95.8	-1.7	-177.8	-61.9	-170.5	-177.9	-156.5	-0.6	114.3	F288 S597	F288-R291 PolarHBondContact O-N 2.96Å; R291-S597 PolarHBondContact NH2-OG 3.37Å
292	G	36.3	Very low	40.7	Very low	61 Å²	61	120.2 Å²	120.2	63%	0.629	67%	0.668	S	S	*	*	S	Bend	trans	-94.9	-17.2	-167.1	0	0	0	0	0	118.6
293	N	33.7	Very low	40.1	Very low	152 Å²	152	129.8 Å²	129.8	81%	0.813	69%	0.694	S	S	*	*	S	Bend	trans	-149.6	51.5	-165.6	-159.1	91	0	0	0	115.2
294	S	31.6	Very low	39.8	Very low	110 Å²	110	129.9 Å²	129.9	77%	0.769	71%	0.706	S	S	*	*			trans	-155.7	69.5	170.2	-172.8	0	0	0	0	114.5
295	V	38.3	Very low	39.7	Very low	127 Å²	127	134.6 Å²	134.6	77%	0.77	73%	0.734	S	S	*	*			trans	-129.7	87.2	159.1	-174.9	0	0	0	0	109	T297	V295-T297 PolarHBondContact O-N 3.29Å
296	N	36.3	Very low	39.3	Very low	154 Å²	154	132.6 Å²	132.6	82%	0.824	74%	0.741	S	S	*	*			trans	-67.2	125.5	153.8	-73.2	-54.3	0	0	0	106.8	P298	N296-P298 WeakPolarHBondContact O-CD 3.44Å
297	T	37.8	Very low	39	Very low	126 Å²	126	134.4 Å²	134.4	77%	0.773	75%	0.749	S	S	*	*			trans	-62.4	114.9	-177.1	37.6	0	0	0	0	111.4	V295 Q299	V295-T297 PolarHBondContact O-N 3.29Å; T297-Q299 PolarHBondContact O-N 2.95Å; T297-Q299 VanDerWaalsContact O-N 3.09Å
298	P	35.3	Very low	38.7	Very low	105 Å²	105	135.1 Å²	135.1	68%	0.682	77%	0.767	S	S	*	*			trans	-78.5	96.7	173.1	31.6	-30	0	0	0	108.1	N296 L300	N296-P298 WeakPolarHBondContact O-CD 3.44Å; P298-L300 WeakPolarHBondContact O-CD1 3.48Å; P298-L300 PolarHBondContact O-N 2.96Å
299	Q	35.8	Very low	38.5	Very low	185 Å²	185	139.9 Å²	139.9	86%	0.864	78%	0.781	S	S	*	*			trans	-70.3	105.1	-179.5	-154.9	-176.4	21	0	0	110.2	T297 A301	T297-Q299 PolarHBondContact O-N 2.95Å; T297-Q299 VanDerWaalsContact O-N 3.09Å; Q299-A301 PolarHBondContact O-N 3.17Å
300	L	34.9	Very low	38.6	Very low	148 Å²	148	142.8 Å²	142.8	78%	0.775	78%	0.782	S	S	*	*			trans	-66.8	97.6	171.6	-91.7	71.6	0	0	0	109.7	P298 T302	P298-L300 WeakPolarHBondContact O-CD1 3.48Å; P298-L300 PolarHBondContact O-N 2.96Å; L300-T302 PolarHBondContact O-N 3.44Å
301	A	36.9	Very low	38.5	Very low	99 Å²	99	145.7 Å²	145.7	82%	0.818	78%	0.784	S	S	*	*			trans	-80.4	89.1	167.3	0	0	0	0	0	109.7	Q299	Q299-A301 PolarHBondContact O-N 3.17Å
302	T	42.3	Very low	38.8	Very low	128 Å²	128	146.6 Å²	146.6	79%	0.785	79%	0.788	S	S	*	*			trans	-63	146	-177.7	-43.4	0	0	0	0	112.2	L300 G304	L300-T302 PolarHBondContact O-N 3.44Å; T302-G304 PolarHBondContact O-N 2.88Å
303	R	36.4	Very low	39.1	Very low	252 Å²	252	155 Å²	155	95%	0.951	80%	0.8	S	S	*	*			trans	-59.8	117.9	-176.9	-65.9	155.7	70.5	177	3	111.5
304	G	39.7	Very low	39.3	Very low	76 Å²	76	151.2 Å²	151.2	78%	0.784	80%	0.797	S	S	*	*			trans	-147.3	108.3	176.6	0	0	0	0	0	112.7	T302	T302-G304 PolarHBondContact O-N 2.88Å
305	N	42	Very low	39.8	Very low	153 Å²	153	150.1 Å²	150.1	82%	0.818	80%	0.803	S	S	*	*			trans	-101.4	117.4	-176	170.8	30.6	0	0	0	111.8
306	S	41.4	Very low	39.9	Very low	97 Å²	97	149 Å²	149	68%	0.678	81%	0.808	S	S	*	*			trans	-179.6	123.5	138.2	-88.6	0	0	0	0	116.6
307	K	43.9	Very low	40.1	Very low	198 Å²	198	146.5 Å²	146.5	86%	0.861	80%	0.802	S	S	*	*			trans	42.9	102.9	132	-62.3	174	178.6	171.3	0	120.7
308	G	39	Very low	40.4	Very low	80 Å²	80	148.1 Å²	148.1	83%	0.825	81%	0.806	S	S	*	*			trans	106.8	166.4	133.4	0	0	0	0	0	117.8
309	R	42.1	Very low	40.9	Very low	214 Å²	214	147.7 Å²	147.7	81%	0.808	81%	0.811	S	S	*	*			cis	-162.8	111.2	-2.9	178.8	-170.4	-175.1	-149.6	9.2	111.8
310	R	43.3	Very low	41.2	Very low	192 Å²	192	146.6 Å²	146.6	73%	0.725	81%	0.811	S	S	*	*			trans	66.9	157	167.8	-66.3	173.3	171	178.5	-4.8	114.1
311	R	42.2	Very low	41.6	Very low	202 Å²	202	144.1 Å²	144.1	76%	0.762	81%	0.806	S	S	*	*			cis	-151.4	145.2	15.4	-126.3	143.3	-176.8	171	-4.8	110
312	R	45.6	Very low	42.1	Very low	220 Å²	220	144.2 Å²	144.2	83%	0.83	80%	0.801	S	S	*	*			trans	23.5	143.6	140.5	-60.5	179.1	175.2	-176.9	-4.7	118.8
313	R	42.6	Very low	42.4	Very low	236 Å²	236	143.5 Å²	143.5	89%	0.891	80%	0.797	S	S	*	*			cis	-166.5	157.4	19.1	-132.3	175.1	178.8	178.2	-3.7	106
314	G	39.1	Very low	42.7	Very low	73 Å²	73	138.7 Å²	138.7	75%	0.753	79%	0.79	S	S	*	*			cis	171.6	139.5	-5.1	0	0	0	0	0	108
315	G	40.1	Very low	43	Very low	87 Å²	87	138.9 Å²	138.9	90%	0.897	79%	0.785	S	S	*	*			trans	-93.8	159.6	-176	0	0	0	0	0	114.1
316	A	40.6	Very low	43.1	Very low	105 Å²	105	138.2 Å²	138.2	87%	0.868	78%	0.781	S	S	*	*			trans	-111.1	161.4	159.5	0	0	0	0	0	107.9
317	S	42	Very low	43.2	Very low	100 Å²	100	139.4 Å²	139.4	70%	0.699	78%	0.784	S	S	*	*			cis	-153.2	155.3	12.2	51.3	0	0	0	0	110.7
318	N	42.5	Very low	43.4	Very low	161 Å²	161	134.4 Å²	134.4	86%	0.861	77%	0.774	S	S	*	*			trans	-177.4	156.1	136.8	-94.9	-12.4	0	0	0	111.7
319	A	46.4	Very low	43.7	Very low	95 Å²	95	137.2 Å²	137.2	79%	0.785	77%	0.77	S	S	*	*			trans	65.8	92.3	164.2	0	0	0	0	0	120
320	D	42.6	Very low	43.8	Very low	162 Å²	162	135.4 Å²	135.4	87%	0.866	77%	0.771	S	S	*	*				88.6	157.2	111.7	-148.9	14.3	0	0	0	122.3
321	S	44	Very low	43.6	Very low	96 Å²	96	133.5 Å²	133.5	67%	0.671	78%	0.775	S	S	*	*			trans	73.3	94.5	172.1	62.1	0	0	0	0	120.3
322	S	47.1	Very low	43.9	Very low	102 Å²	102	129.1 Å²	129.1	71%	0.713	77%	0.771	S	S	*	*				68.7	124.4	127.9	62.4	0	0	0	0	123.8
323	T	48	Very low	44	Very low	113 Å²	113	124.2 Å²	124.2	69%	0.693	77%	0.765	S	S	*	*			trans	76.5	120.7	136.9	47.5	0	0	0	0	122.3
324	D	43.7	Very low	44	Very low	150 Å²	150	117.6 Å²	117.6	80%	0.802	76%	0.761	S	S	*	*			trans	72	140.3	137.8	-54.1	-12.3	0	0	0	120.7
325	A	45.9	Very low	44.3	Very low	81 Å²	81	118 Å²	118	67%	0.669	76%	0.758	S	S	*	*			cis	-164.2	170.5	-17.4	0	0	0	0	0	110.5
326	N	42.7	Very low	44.4	Very low	139 Å²	139	126 Å²	126	74%	0.743	76%	0.761	S	S	*	*			trans	65.4	111.2	158.2	-80.9	3.7	0	0	0	119.6
327	T	44.1	Very low	44.2	Very low	122 Å²	122	124.7 Å²	124.7	75%	0.748	76%	0.757	S	S	*	*				92.1	140.4	100.1	55	0	0	0	0	114.3
328	S	47.4	Very low	44	Very low	92 Å²	92	132.4 Å²	132.4	64%	0.643	77%	0.771	S	S	*	*			cis	-167.1	155.6	-4.5	43.9	0	0	0	0	110.2
329	N	45.5	Very low	43.8	Very low	140 Å²	140	128.3 Å²	128.3	75%	0.749	77%	0.766	S	S	*	*			trans	42.9	131.2	149.8	-52.2	7.9	0	0	0	119.3
330	E	45.6	Very low	43.5	Very low	175 Å²	175	136.4 Å²	136.4	82%	0.818	78%	0.776	S	S	*	*				-147.9	169.2	62.9	-84.1	-73.6	105	0	0	112.4
331	D	38.3	Very low	43.3	Very low	152 Å²	152	131.4 Å²	131.4	81%	0.813	76%	0.764	S	S	*	*			trans	-111.5	-149.1	-172.1	-157.6	-32.8	0	0	0	111.6
332	V	48.6	Very low	42.9	Very low	111 Å²	111	134.6 Å²	134.6	67%	0.673	77%	0.773	S	S	*	*			trans	107.2	71.2	165.7	-168.7	0	0	0	0	116.9
333	T	47	Very low	42.6	Very low	116 Å²	116	142.4 Å²	142.4	71%	0.712	79%	0.787	S	S	*	*			trans	73	137.7	131.3	66.5	0	0	0	0	123.4
334	A	42.8	Very low	42	Very low	98 Å²	98	148.5 Å²	148.5	81%	0.81	80%	0.797	S	S	*	*			trans	62.4	133.7	136.5	0	0	0	0	0	120.4
335	A	45.3	Very low	41.8	Very low	82 Å²	82	146.9 Å²	146.9	68%	0.678	80%	0.798	S	S	*	*			cis	-165.1	161	4.3	0	0	0	0	0	112.2
336	R	41.5	Very low	41.7	Very low	255 Å²	255	153 Å²	153	96%	0.962	81%	0.809	S	S	*	*			trans	57.3	129.1	159.7	-63.7	165.1	179	168.1	-0.7	117.4
337	G	38.2	Very low	41.5	Very low	76 Å²	76	158.4 Å²	158.4	78%	0.784	82%	0.819	S	S	*	*			cis	176.1	144.2	-2.1	0	0	0	0	0	109.9
338	R	37.6	Very low	41.2	Very low	263 Å²	263	156 Å²	156	99%	0.992	82%	0.818	S	S	*	*			trans	-75.5	141.9	-175.6	-65.8	179.5	176.7	-178.1	-0.6	111.7
339	G	37.2	Very low	40.8	Very low	74 Å²	74	156.6 Å²	156.6	76%	0.763	82%	0.823	S	S	*	*			trans	-155.1	27.5	-173.4	0	0	0	0	0	117.6	G341	G339-G341 PolarHBondContact O-N 3.43Å
340	R	40.2	Very low	40.7	Very low	265 Å²	265	158.1 Å²	158.1	100%	1	83%	0.829	S	S	*	*			trans	-73.5	93.5	169.1	-79.6	-172	173.6	-171.2	-1.4	109.7
341	G	39.2	Very low	40.5	Very low	58 Å²	58	154 Å²	154	60%	0.598	82%	0.82	S	S	*	*			trans	-116	141.7	-175.4	0	0	0	0	0	114.6	G339 W343	G339-G341 PolarHBondContact O-N 3.43Å; G341-W343 PolarHBondContact O-N 3.46Å
342	N	34.8	Very low	40.7	Very low	162 Å²	162	156.2 Å²	156.2	87%	0.866	82%	0.822	S	S	*	*			trans	-55.4	124.7	-178.7	-73.6	-15.7	0	0	0	113.9	R344	N342-R344 VanDerWaalsContact C-N 3.35Å
343	W	40.3	Very low	40.4	Very low	267 Å²	267	160.1 Å²	160.1	100%	1.011	83%	0.832	S	S	*	*			trans	-95.5	28	168.6	-100.4	58.9	0	0	0	113.6	G341	G341-W343 PolarHBondContact O-N 3.46Å
344	R	36.9	Very low	40.8	Very low	240 Å²	240	160.4 Å²	160.4	91%	0.906	83%	0.834	S	S	*	*			trans	-122.1	39.9	-171.7	-150.8	-177.1	-171.4	-170.7	2.8	115	N342	N342-R344 VanDerWaalsContact C-N 3.35Å
345	S	39.6	Very low	41.4	Very low	116 Å²	116	160.9 Å²	160.9	81%	0.811	83%	0.829	S	S	*	*	S	Bend	trans	-161.6	79.8	160.3	-163.2	0	0	0	0	114.4
346	K	41.9	Very low	42	Very low	210 Å²	210	161.1 Å²	161.1	91%	0.913	82%	0.824	S	S	*	*			trans	-175.9	95.1	150.1	-112.5	175.8	178.5	177.1	0	112.2
347	R	40.1	Very low	43.2	Very low	252 Å²	252	152.3 Å²	152.3	95%	0.951	80%	0.801	S	S	*	*			trans	-146.4	68.2	158.7	-92.3	-159.9	173.6	-159.7	-1	110.2
348	G	37.4	Very low	44.5	Very low	71 Å²	71	156.3 Å²	156.3	73%	0.732	80%	0.799	S	S	*	*			trans	-92	147.3	159	0	0	0	0	0	109.7
349	S	37.7	Very low	46.1	Very low	106 Å²	106	147.8 Å²	147.8	74%	0.741	78%	0.78	S	S	*	*			trans	56.7	107.5	-180	-160	0	0	0	0	116.7	S351	S349-S351 PolarHBondContact OG-OG 3.12Å
350	I	43.5	Very low	47.9	Very low	172 Å²	172	152.6 Å²	152.6	88%	0.882	78%	0.775	S	S	*	*			trans	-113.1	62.4	164.2	-171	61.7	0	0	0	109.5
351	S	42.3	Very low	49.6	Very low	88 Å²	88	144.6 Å²	144.6	62%	0.615	75%	0.752	S	S	*	*			trans	-88.7	122.7	-175.4	61	0	0	0	0	113.2	S349	S349-S351 PolarHBondContact OG-OG 3.12Å
352	K	43.3	Very low	51.4	Low	199 Å²	199	146.1 Å²	146.1	87%	0.865	75%	0.75	S	S	*	*			trans	70	140	160.8	-60.1	-178.7	178.5	-179.5	0	117.4	T354	K352-T354 PolarHBondContact O-N 2.86Å
353	H	42.1	Very low	53.5	Low	192 Å²	192	144.3 Å²	144.3	89%	0.889	74%	0.736	S	S	*	*			trans	-72.9	116.1	-176.3	-156	-106.2	0	0	0	110.2
354	T	55.8	Low	55	Low	122 Å²	122	140.3 Å²	140.3	75%	0.748	72%	0.721	S	S	*	*			trans	-109.4	134.5	170.4	46.8	0	0	0	0	110	K352	K352-T354 PolarHBondContact O-N 2.86Å
355	P	55.4	Low	56.8	Low	108 Å²	108	131.9 Å²	131.9	70%	0.701	70%	0.702	S	S	*	*	P	Polyproline II helix	trans	-64.5	150.7	175.9	27.9	-34	0	0	0	110.4	S357	P355-S357 PolarHBondContact O-N 3.05Å
356	P	56.6	Low	58.4	Low	88 Å²	88	129.3 Å²	129.3	57%	0.571	68%	0.684	S	S	*	*	P	Polyproline II helix	trans	-64.3	120.5	178.7	27.4	-33.7	0	0	0	109.9
357	S	66.2	Low	60	Low	69 Å²	69	128.5 Å²	128.5	48%	0.483	68%	0.676	S	S	.	*	P	Polyproline II helix	trans	-59.2	144.8	177.5	54.2	0	0	0	0	111.7	P355 S359 R360	P355-S357 PolarHBondContact O-N 3.05Å; S357-S359 PolarHBondContact O-N 3.36Å; S357-R360 PolarHBondContact O-N 3.47Å
358	E	66.8	Low	61.2	Low	160 Å²	160	123 Å²	123	75%	0.748	66%	0.659	S	S	*	*	H	α-helix	trans	-48.7	-38.9	-179.7	-74.5	179.5	105.3	0	0	112.7	R360 L361 T362	E358-R360 PolarHBondContact O-N 3.05Å; E358-L361 CarbonylContact O-C 3.55Å; E358-L361 WeakPolarHBondContact O-CA 3.29Å; E358-L361 WeakPolarHBondContact O-CB 3.24Å; E358-L361 PolarHBondContact O-N 3.13Å; E358-T362 PolarHBondContact O-N 3.12Å; E358-T362 PolarHBondContact O-OG1 2.97Å
359	S	71.6	Confident	62.4	Low	84 Å²	84	126.6 Å²	126.6	59%	0.587	66%	0.655	S	S	*	*	H	α-helix	trans	-42.3	-43.1	171.7	174.4	0	0	0	0	113.8	S357 Q363	S357-S359 PolarHBondContact O-N 3.36Å; S359-Q363 VanDerWaalsContact O-CB 3.24Å; S359-Q363 WeakPolarHBondContact O-CB 3.35Å; S359-Q363 PolarHBondContact O-N 3.03Å
360	R	74.9	Confident	63.3	Low	175 Å²	175	128 Å²	128	66%	0.66	65%	0.654	S	S	*	*	H	α-helix	trans	-77.2	-25.5	178.6	-74.9	-177.6	166	176.2	-2.2	114	S357 E358 R364	S357-R360 PolarHBondContact O-N 3.47Å; E358-R360 PolarHBondContact O-N 3.05Å; R360-R364 PolarHBondContact O-N 3.21Å
361	L	75.6	Confident	63.9	Low	97 Å²	97	127.4 Å²	127.4	51%	0.508	65%	0.647	S	S	.	*	H	α-helix	trans	-75	-47.2	172.2	-66	168.6	0	0	0	109.6	E358 Q363 R364 A365	E358-L361 CarbonylContact O-C 3.55Å; E358-L361 WeakPolarHBondContact O-CA 3.29Å; E358-L361 WeakPolarHBondContact O-CB 3.24Å; E358-L361 PolarHBondContact O-N 3.13Å; L361-Q363 PolarHBondContact O-N 3.15Å; L361-R364 WeakPolarHBondContact O-CA 3.38Å; L361-R364 WeakPolarHBondContact O-CB 3.4Å; L361-R364 PolarHBondContact O-N 3.33Å; L361-A365 PolarHBondContact O-N 3.37Å
362	T	76.8	Confident	64.5	Low	91 Å²	91	127.2 Å²	127.2	56%	0.558	64%	0.639	S	S	*	*	H	α-helix	trans	-61.7	-40	175.8	-49.9	0	0	0	0	112.1	E358 R364 A365 S366	E358-T362 PolarHBondContact O-N 3.12Å; E358-T362 PolarHBondContact O-OG1 2.97Å; T362-R364 PolarHBondContact O-N 3.09Å; T362-A365 PolarHBondContact O-N 3.16Å; T362-S366 PolarHBondContact O-N 2.9Å; T362-S366 PolarHBondContact O-OG 3.49Å
363	Q	77.7	Confident	65	Low	123 Å²	123	123.3 Å²	123.3	58%	0.575	63%	0.631	S	S	*	*	H	α-helix	trans	-70.8	-14.8	174.5	-161.8	-174.1	24.5	0	0	113.7	S359 L361 S366	S359-Q363 VanDerWaalsContact O-CB 3.24Å; S359-Q363 WeakPolarHBondContact O-CB 3.35Å; S359-Q363 PolarHBondContact O-N 3.03Å; L361-Q363 PolarHBondContact O-N 3.15Å; Q363-S366 PolarHBondContact O-OG 3.2Å
364	R	72.9	Confident	65.4	Low	183 Å²	183	122.6 Å²	122.6	69%	0.691	63%	0.628	S	S	*	*	H	α-helix	trans	-83.5	-46.1	165.5	-92.5	179.8	166.2	151.5	-5.4	111.1	R360 L361 T362 S366 R367	R360-R364 PolarHBondContact O-N 3.21Å; L361-R364 WeakPolarHBondContact O-CA 3.38Å; L361-R364 WeakPolarHBondContact O-CB 3.4Å; L361-R364 PolarHBondContact O-N 3.33Å; T362-R364 PolarHBondContact O-N 3.09Å; R364-S366 VanDerWaalsContact C-N 3.33Å; R364-S366 PolarHBondContact O-N 2.89Å; R364-R367 WeakPolarHBondContact O-CB 3.46Å; R364-R367 PolarHBondContact O-N 2.94Å
365	A	74	Confident	64.8	Low	63 Å²	63	119.7 Å²	119.7	52%	0.521	61%	0.612	S	S	.	*	H	α-helix	trans	-59.8	-40.2	180	0	0	0	0	0	112.6	L361 T362 R367 F368	L361-A365 PolarHBondContact O-N 3.37Å; T362-A365 PolarHBondContact O-N 3.16Å; A365-R367 PolarHBondContact O-N 3.38Å; A365-F368 PolarHBondContact O-N 3.38Å; A365-F368 VanDerWaalsContact O-N 3.16Å
366	S	74.6	Confident	64.4	Low	62 Å²	62	121.2 Å²	121.2	43%	0.434	62%	0.622	S	S	.	*	H	α-helix	trans	-60	-28.6	179.2	61.9	0	0	0	0	113.9	T362 Q363 R364 F368 K369	T362-S366 PolarHBondContact O-N 2.9Å; T362-S366 PolarHBondContact O-OG 3.49Å; Q363-S366 PolarHBondContact O-OG 3.2Å; R364-S366 VanDerWaalsContact C-N 3.33Å; R364-S366 PolarHBondContact O-N 2.89Å; S366-F368 PolarHBondContact O-N 3.24Å; S366-K369 WeakPolarHBondContact O-CB 3.39Å; S366-K369 PolarHBondContact O-N 3.19Å
367	R	73.8	Confident	64	Low	193 Å²	193	123.6 Å²	123.6	73%	0.728	63%	0.629	S	S	*	*	H	α-helix	trans	-66.8	-23.2	178.9	-62.8	-178.6	177.4	-147.2	-5.4	114.1	R364 A365	R364-R367 WeakPolarHBondContact O-CB 3.46Å; R364-R367 PolarHBondContact O-N 2.94Å; A365-R367 PolarHBondContact O-N 3.38Å
368	F	66.3	Low	62.8	Low	136 Å²	136	123.8 Å²	123.8	60%	0.596	64%	0.641	S	S	*	*	H	α-helix	trans	-93.9	-11.5	177.7	-68	-82.8	0	0	0	112.4	A365 S366 D370 H371 L372	A365-F368 PolarHBondContact O-N 3.38Å; A365-F368 VanDerWaalsContact O-N 3.16Å; S366-F368 PolarHBondContact O-N 3.24Å; F368-D370 PolarHBondContact O-N 3.05Å; F368-H371 PolarHBondContact O-N 2.84Å; F368-L372 WeakPolarHBondContact O-CD1 3.48Å; F368-L372 WeakPolarHBondContact O-CG 3.29Å
369	K	62.2	Low	61.4	Low	148 Å²	148	122.7 Å²	122.7	64%	0.643	65%	0.651	S	S	*	*	H	α-helix	trans	-63	-46.7	-173.5	-165.8	177.3	-178.6	-176.3	0	112	S366 H371 L372	S366-K369 WeakPolarHBondContact O-CB 3.39Å; S366-K369 PolarHBondContact O-N 3.19Å; K369-H371 VanDerWaalsContact C-N 3.26Å; K369-H371 PolarHBondContact O-N 3.43Å; K369-L372 PolarHBondContact O-N 2.74Å
370	D	57.1	Low	59.9	Low	135 Å²	135	122 Å²	122	72%	0.722	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.6	-25.7	-176.4	-57.6	-21.9	0	0	0	112.7	F368 L372	F368-D370 PolarHBondContact O-N 3.05Å; D370-L372 VanDerWaalsContact C-N 3.32Å; D370-L372 PolarHBondContact O-N 2.91Å
371	H	55.6	Low	58.5	Low	160 Å²	160	116.6 Å²	116.6	74%	0.741	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.6	-3.9	-179.6	-147.6	-50.4	0	0	0	113.7	F368 K369	F368-H371 PolarHBondContact O-N 2.84Å; K369-H371 VanDerWaalsContact C-N 3.26Å; K369-H371 PolarHBondContact O-N 3.43Å
372	L	56	Low	57.3	Low	84 Å²	84	118.5 Å²	118.5	44%	0.44	66%	0.656	S	S	.	*	S	Bend	trans	-107.6	-7.4	-178.7	-70.7	167.7	0	0	0	113.7	F368 K369 D370 Q374 S375 I382	F368-L372 WeakPolarHBondContact O-CD1 3.48Å; F368-L372 WeakPolarHBondContact O-CG 3.29Å; K369-L372 PolarHBondContact O-N 2.74Å; D370-L372 VanDerWaalsContact C-N 3.32Å; D370-L372 PolarHBondContact O-N 2.91Å; L372-Q374 PolarHBondContact O-N 2.73Å; L372-S375 PolarHBondContact O-OG 3.11Å; L372-S375 VanDerWaalsContact O-OG 3.08Å; L372-I382 HydrophobicContact CD1-CD1 3.53Å; L372-I382 HydrophobicContact CD1-CG1 4.34Å
373	V	52.2	Low	56	Low	116 Å²	116	118.6 Å²	118.6	70%	0.703	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.7	-12.9	-177.5	178.7	0	0	0	0	112.8
374	Q	51.2	Low	54.5	Low	178 Å²	178	116.9 Å²	116.9	83%	0.832	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.1	-2.2	-176.4	-67.5	178.6	-14.4	0	0	114.5	L372	L372-Q374 PolarHBondContact O-N 2.73Å
375	S	42.9	Very low	53.3	Low	60 Å²	60	112.3 Å²	112.3	42%	0.42	65%	0.647	S	S	.	*	S	Bend	trans	-96.5	128.1	174.8	48.9	0	0	0	0	111.4	L372 I377	L372-S375 PolarHBondContact O-OG 3.11Å; L372-S375 VanDerWaalsContact O-OG 3.08Å; S375-I377 PolarHBondContact O-N 3.07Å
376	P	46.6	Very low	52.3	Low	140 Å²	140	115 Å²	115	91%	0.909	66%	0.657	S	S	*	*	S	Bend	trans	-67.4	13.3	-178.7	-23	34.6	0	0	0	117
377	I	49.4	Very low	51.1	Low	139 Å²	139	116.1 Å²	116.1	71%	0.713	67%	0.665	S	S	*	*	S	Bend	trans	-112	132.4	-170.7	-59.4	178.2	0	0	0	109.3	S375	S375-I377 PolarHBondContact O-N 3.07Å
378	G	40.1	Very low	50.1	Low	72 Å²	72	111.3 Å²	111.3	74%	0.742	65%	0.651	S	S	*	*			trans	-61.7	144.9	-159.3	0	0	0	0	0	116.9	G380	G378-G380 PolarHBondContact O-N 2.87Å
379	S	38.2	Very low	49.4	Very low	137 Å²	137	108.2 Å²	108.2	96%	0.958	64%	0.641	S	S	*	*	S	Bend	trans	-54.6	128.8	170.5	171.7	0	0	0	0	112.4
380	G	39.8	Very low	49	Very low	70 Å²	70	106.3 Å²	106.3	72%	0.722	64%	0.637	S	S	*	*	S	Bend	trans	162.8	-18.4	162.3	0	0	0	0	0	120.1	G378	G378-G380 PolarHBondContact O-N 2.87Å
381	S	45.6	Very low	48.7	Very low	62 Å²	62	103 Å²	103	43%	0.434	62%	0.624	S	S	.	*			trans	-149.6	94	-168.9	-118.2	0	0	0	0	115	R384	S381-R384 PolarHBondContact OG-NE 3.32Å; S381-R384 PolarHBondContact OG-NH2 3.19Å
382	I	49.4	Very low	48.1	Very low	136 Å²	136	99.9 Å²	99.9	70%	0.697	61%	0.613	S	S	*	*			trans	-105.4	-1.3	178.9	-55.9	165.4	0	0	0	111.6	L372	L372-I382 HydrophobicContact CD1-CD1 3.53Å; L372-I382 HydrophobicContact CD1-CG1 4.34Å
383	A	50	Low	47.7	Very low	94 Å²	94	105.1 Å²	105.1	78%	0.777	63%	0.628	S	S	*	*	S	Bend	trans	-88	-8.4	-177	0	0	0	0	0	114.8
384	R	46.1	Very low	47.3	Very low	86 Å²	86	105.2 Å²	105.2	33%	0.325	63%	0.629	S	S	.	*			trans	-88.4	122.9	-176.7	-76.3	-176.4	-102	166.5	-5.1	110.8	S381 Q388 L389	S381-R384 PolarHBondContact OG-NE 3.32Å; S381-R384 PolarHBondContact OG-NH2 3.19Å; R384-Q388 HydrophobicContact CB-CB 3.76Å; R384-Q388 WeakPolarHBondContact CD-O 3.21Å; R384-Q388 HydrophobicContact CG-CB 3.85Å; R384-L389 HydrophobicContact CB-CD2 4.05Å; R384-L389 HydrophobicContact CB-CG 4.05Å
385	T	48.8	Very low	46.9	Very low	88 Å²	88	103.5 Å²	103.5	54%	0.54	63%	0.626	S	S	.	*			trans	-56.3	160	163.1	13	0	0	0	0	110.2	S387 Q388 L389	T385-S387 PolarHBondContact O-N 3.39Å; T385-Q388 CarbonylContact O-C 3.56Å; T385-Q388 WeakPolarHBondContact O-CA 3.41Å; T385-Q388 WeakPolarHBondContact O-CB 3.24Å; T385-Q388 PolarHBondContact O-N 3.46Å; T385-L389 PolarHBondContact O-N 3.37Å; T385-L389 VanDerWaalsContact O-N 3.1Å
386	T	52.5	Low	46.8	Very low	118 Å²	118	107.7 Å²	107.7	72%	0.724	64%	0.639	S	S	*	*	H	α-helix	trans	-50.6	-44.6	176.2	45.9	0	0	0	0	112.3	Q388 L389 L390	T386-Q388 PolarHBondContact O-N 3.04Å; T386-L389 PolarHBondContact O-N 3.06Å; T386-L389 VanDerWaalsContact O-N 3.09Å; T386-L390 WeakPolarHBondContact O-CD1 3.43Å; T386-L390 PolarHBondContact O-N 3.05Å
387	S	49.3	Very low	46.7	Very low	87 Å²	87	111.7 Å²	111.7	61%	0.608	64%	0.636	S	S	*	*	H	α-helix	trans	-56.5	-28.4	172.4	164.6	0	0	0	0	114.8	T385 S391	T385-S387 PolarHBondContact O-N 3.39Å; S387-S391 PolarHBondContact O-N 3.25Å
388	Q	51.9	Low	46.2	Very low	91 Å²	91	111.5 Å²	111.5	43%	0.425	64%	0.636	S	S	.	*	H	α-helix	trans	-93.9	-9	178.4	-67.9	-178.5	-14.5	0	0	113.8	R384 T385 T386 S391 N392	R384-Q388 HydrophobicContact CB-CB 3.76Å; R384-Q388 WeakPolarHBondContact CD-O 3.21Å; R384-Q388 HydrophobicContact CG-CB 3.85Å; T385-Q388 CarbonylContact O-C 3.56Å; T385-Q388 WeakPolarHBondContact O-CA 3.41Å; T385-Q388 WeakPolarHBondContact O-CB 3.24Å; T385-Q388 PolarHBondContact O-N 3.46Å; T386-Q388 PolarHBondContact O-N 3.04Å; Q388-S391 WeakPolarHBondContact CA-OG 3.3Å; Q388-S391 PolarHBondContact O-OG 2.9Å; Q388-N392 PolarHBondContact O-OD1 3.33Å; Q388-N392 VanDerWaalsContact O-OD1 3.08Å
389	L	51.6	Low	46.5	Very low	72 Å²	72	116.1 Å²	116.1	38%	0.377	64%	0.644	S	S	.	*	H	α-helix	trans	-79.7	-43.4	165.5	-72.2	171.3	0	0	0	109.6	R384 T385 T386 S391 N392	R384-L389 HydrophobicContact CB-CD2 4.05Å; R384-L389 HydrophobicContact CB-CG 4.05Å; T385-L389 PolarHBondContact O-N 3.37Å; T385-L389 VanDerWaalsContact O-N 3.1Å; T386-L389 PolarHBondContact O-N 3.06Å; T386-L389 VanDerWaalsContact O-N 3.09Å; L389-S391 PolarHBondContact O-N 3.4Å; L389-N392 PolarHBondContact O-N 3.15Å
390	L	53.6	Low	47.1	Very low	107 Å²	107	116.9 Å²	116.9	56%	0.56	64%	0.636	S	S	*	*	H	α-helix	trans	-59.9	-41.8	175.9	-89.8	63	0	0	0	112.7	T386 N392 Y393	T386-L390 WeakPolarHBondContact O-CD1 3.43Å; T386-L390 PolarHBondContact O-N 3.05Å; L390-N392 PolarHBondContact O-N 3.09Å; L390-Y393 PolarHBondContact O-N 3.24Å
391	S	51.1	Low	47.4	Very low	65 Å²	65	118.4 Å²	118.4	46%	0.455	64%	0.642	S	S	.	*	T	Hydrogen-bonded Turn	trans	-66.5	-7.3	179.7	62.5	0	0	0	0	115.5	S387 Q388 L389	S387-S391 PolarHBondContact O-N 3.25Å; Q388-S391 WeakPolarHBondContact CA-OG 3.3Å; Q388-S391 PolarHBondContact O-OG 2.9Å; L389-S391 PolarHBondContact O-N 3.4Å
392	N	43.6	Very low	47.5	Very low	96 Å²	96	119.6 Å²	119.6	51%	0.513	65%	0.647	S	S	.	*	T	Hydrogen-bonded Turn	trans	-116.1	9.5	-175	-73.1	59.6	0	0	0	112.4	Q388 L389 L390	Q388-N392 PolarHBondContact O-OD1 3.33Å; Q388-N392 VanDerWaalsContact O-OD1 3.08Å; L389-N392 PolarHBondContact O-N 3.15Å; L390-N392 PolarHBondContact O-N 3.09Å
393	Y	48.3	Very low	47.4	Very low	194 Å²	194	118 Å²	118	76%	0.761	64%	0.639	S	S	*	*	S	Bend	trans	-106.5	-0.3	169	-93.1	-87.5	0	0	0	112.7	L390 D395	L390-Y393 PolarHBondContact O-N 3.24Å; Y393-D395 PolarHBondContact O-N 3.19Å
394	T	43.9	Very low	47.4	Very low	118 Å²	118	120.4 Å²	120.4	72%	0.724	63%	0.633	S	S	*	*			trans	-96.6	61.2	177.2	59.1	0	0	0	0	111
395	D	42.5	Very low	47.7	Very low	141 Å²	141	118.8 Å²	118.8	75%	0.754	64%	0.643	S	S	*	*	S	Bend	trans	-142.2	105	172.9	-162.6	21.1	0	0	0	108.4	Y393	Y393-D395 PolarHBondContact O-N 3.19Å
396	E	41.1	Very low	47.6	Very low	149 Å²	149	119 Å²	119	70%	0.696	65%	0.647	S	S	*	*	S	Bend	trans	51.8	99.7	170.6	-64.6	-71.6	110.7	0	0	119.3
397	R	42.8	Very low	47.7	Very low	224 Å²	224	117.2 Å²	117.2	85%	0.845	64%	0.639	S	S	*	*			trans	99.6	162.1	153.1	-53.1	159.2	-167.3	-152.9	1	119.3
398	D	39	Very low	48.4	Very low	135 Å²	135	118.2 Å²	118.2	72%	0.722	63%	0.634	S	S	*	*			trans	60.2	88.9	172.8	-72.9	19.2	0	0	0	119.8	L400	D398-L400 PolarHBondContact O-N 3.16Å
399	D	46.9	Very low	49.3	Very low	168 Å²	168	117.4 Å²	117.4	90%	0.898	63%	0.632	S	S	*	*				44.4	10.9	120.7	-67.4	0.4	0	0	0	122.3
400	L	51.3	Low	50.6	Low	153 Å²	153	118.3 Å²	118.3	80%	0.801	64%	0.64	S	S	*	*			trans	-115.5	54.9	179.4	-67.7	178.3	0	0	0	113	D398 V402	D398-L400 PolarHBondContact O-N 3.16Å; L400-V402 PolarHBondContact O-N 3.31Å
401	A	45.7	Very low	52	Low	103 Å²	103	113.3 Å²	113.3	85%	0.851	62%	0.615	S	S	*	*			trans	-69.6	76.8	167	0	0	0	0	0	111	D403	A401-D403 PolarHBondContact O-N 3.19Å
402	V	47.4	Very low	53.7	Low	87 Å²	87	114 Å²	114	53%	0.527	62%	0.616	S	S	.	*			trans	-64.7	105.5	172.4	178.3	0	0	0	0	108.7	L400 F404	L400-V402 PolarHBondContact O-N 3.31Å; V402-F404 HydrophobicContact CB-CE2 4.1Å; V402-F404 HydrophobicContact CB-CZ 4.43Å; V402-F404 HydrophobicContact CG1-CD2 4.31Å; V402-F404 HydrophobicContact CG1-CE1 4.34Å; V402-F404 HydrophobicContact CG1-CE2 4.06Å; V402-F404 HydrophobicContact CG1-CZ 4.08Å; V402-F404 WeakPolarHBondContact O-CD2 3.48Å; V402-F404 PolarHBondContact O-N 3.26Å
403	D	47.5	Very low	55.9	Low	101 Å²	101	110.8 Å²	110.8	54%	0.54	60%	0.599	S	S	.	*			trans	-69	94.8	172.6	173.7	28.5	0	0	0	110.1	A401 G405 S406	A401-D403 PolarHBondContact O-N 3.19Å; D403-G405 PolarHBondContact O-N 3.32Å; D403-G405 WeakPolarHBondContact OD1-CA 3.49Å; D403-G405 PolarHBondContact OD1-N 3.35Å; D403-S406 WeakPolarHBondContact O-CB 3.18Å; D403-S406 PolarHBondContact O-N 3.48Å; D403-S406 PolarHBondContact O-OG 3.43Å; D403-S406 PolarHBondContact OD2-N 3.34Å
404	F	51.4	Low	57.9	Low	146 Å²	146	109.4 Å²	109.4	64%	0.64	60%	0.599	S	S	*	*	G	3₁₀ helix	trans	-64.5	-13.6	174.2	-72	-83.5	0	0	0	113.2	V402 S406 C407	V402-F404 HydrophobicContact CB-CE2 4.1Å; V402-F404 HydrophobicContact CB-CZ 4.43Å; V402-F404 HydrophobicContact CG1-CD2 4.31Å; V402-F404 HydrophobicContact CG1-CE1 4.34Å; V402-F404 HydrophobicContact CG1-CE2 4.06Å; V402-F404 HydrophobicContact CG1-CZ 4.08Å; V402-F404 WeakPolarHBondContact O-CD2 3.48Å; V402-F404 PolarHBondContact O-N 3.26Å; F404-S406 VanDerWaalsContact C-N 3.33Å; F404-C407 PolarHBondContact O-N 3.43Å
405	G	52	Low	60.1	Low	52 Å²	52	109.7 Å²	109.7	54%	0.536	59%	0.592	S	S	.	*	G	3₁₀ helix	trans	-65	-36	168.3	0	0	0	0	0	112.4	D403 C407 Q408	D403-G405 PolarHBondContact O-N 3.32Å; D403-G405 WeakPolarHBondContact OD1-CA 3.49Å; D403-G405 PolarHBondContact OD1-N 3.35Å; G405-C407 PolarHBondContact O-N 3.09Å; G405-Q408 PolarHBondContact O-N 3.46Å
406	S	47.1	Very low	62.5	Low	91 Å²	91	106.1 Å²	106.1	64%	0.636	57%	0.573	S	S	*	*	G	3₁₀ helix	trans	-65.9	-15.1	174.5	75.6	0	0	0	0	114.4	D403 F404 Q408	D403-S406 WeakPolarHBondContact O-CB 3.18Å; D403-S406 PolarHBondContact O-N 3.48Å; D403-S406 PolarHBondContact O-OG 3.43Å; D403-S406 PolarHBondContact OD2-N 3.34Å; F404-S406 VanDerWaalsContact C-N 3.33Å; S406-Q408 VanDerWaalsContact C-N 3.28Å; S406-Q408 PolarHBondContact O-N 2.83Å
407	C	53	Low	64.9	Low	82 Å²	82	102.8 Å²	102.8	55%	0.554	56%	0.557	S	S	*	*	G	3₁₀ helix	trans	-88.7	22.1	176.1	-67.2	0	0	0	0	113.7	F404 G405 I409	F404-C407 PolarHBondContact O-N 3.43Å; G405-C407 PolarHBondContact O-N 3.09Å; C407-I409 PolarHBondContact O-N 2.8Å
408	Q	64.1	Low	67.2	Low	108 Å²	108	93 Å²	93	51%	0.505	52%	0.52	S	S	.	.			trans	-62.1	109	177.3	-166.4	174.5	28.9	0	0	111.1	G405 S406 V410 Q472	G405-Q408 PolarHBondContact O-N 3.46Å; S406-Q408 VanDerWaalsContact C-N 3.28Å; S406-Q408 PolarHBondContact O-N 2.83Å; Q408-V410 PolarHBondContact O-N 2.74Å; Q408-V410 VanDerWaalsContact O-N 3.16Å; Q408-Q472 WeakPolarHBondContact CG-O 3.18Å; Q408-Q472 PolarHBondContact NE2-O 3.28Å
409	I	70.4	Confident	69.5	Low	74 Å²	74	93.9 Å²	93.9	38%	0.379	52%	0.52	S	S	.	.			trans	-67.1	114.2	174	-59.2	175	0	0	0	107.6	C407 P429 Q472	C407-I409 PolarHBondContact O-N 2.8Å; I409-P429 HydrophobicContact CG2-CB 4.44Å; I409-P429 HydrophobicContact CG2-CG 4.08Å; I409-Q472 VanDerWaalsContact O-CG 3.3Å; I409-Q472 WeakPolarHBondContact O-CG 3.42Å
410	V	80	Confident	71.5	Confident	90 Å²	90	91.7 Å²	91.7	55%	0.545	50%	0.5	S	S	.	.			trans	-93.6	128.9	171.8	-178.5	0	0	0	0	109	Q408 P434	Q408-V410 PolarHBondContact O-N 2.74Å; Q408-V410 VanDerWaalsContact O-N 3.16Å; V410-P434 HydrophobicContact CG1-CB 4.38Å
411	G	82	Confident	73.1	Confident	3 Å²	3	87.4 Å²	87.4	3%	0.031	48%	0.478	C	S	.	.			trans	-69.4	153.4	179	0	0	0	0	0	113.7	V432 P434	G411-V432 CarbonylContact C-O 3.22Å; G411-V432 VanDerWaalsContact C-O 3.22Å; G411-V432 WeakPolarHBondContact CA-O 3.25Å; G411-P434 VanDerWaalsContact O-CB 3.25Å; G411-P434 WeakPolarHBondContact O-CB 3.18Å; G411-P434 WeakPolarHBondContact O-CD 3.31Å; G411-P434 WeakPolarHBondContact O-CG 3.44Å
412	T	88.5	Confident	75	Confident	78 Å²	78	92.4 Å²	92.4	48%	0.479	48%	0.475	S	S	.	.			trans	-121.5	-0.6	178.7	59.9	0	0	0	0	114.2	Q414 P429 T430 V432	T412-Q414 PolarHBondContact O-N 2.74Å; T412-P429 PolarHBondContact N-O 3.02Å; T412-P429 PolarHBondContact OG1-O 3.01Å; T412-T430 WeakPolarHBondContact OG1-CA 3.31Å; T412-T430 PolarHBondContact OG1-N 3.1Å; T412-V432 PolarHBondContact N-O 3.43Å
413	M	89.1	Confident	76.6	Confident	30 Å²	30	92 Å²	92	15%	0.148	47%	0.469	C	S	.	.			trans	-66.4	124.4	178.5	-166.8	179	-171.2	0	0	111.6	E415 K418 T430 E431 V432 R433 P434	M413-E415 HydrophobicContact CE-CB 4Å; M413-E415 HydrophobicContact CE-CG 4.25Å; M413-E415 WeakPolarHBondContact CE-OE2 3.38Å; M413-E415 HydrophobicContact CG-CB 4.37Å; M413-K418 HydrophobicContact CE-CB 4.24Å; M413-K418 HydrophobicContact CE-CD 4.29Å; M413-K418 HydrophobicContact CE-CG 3.89Å; M413-K418 HydrophobicContact SD-CD 3.78Å; M413-K418 HydrophobicContact SD-CG 4.06Å; M413-T430 WeakPolarHBondContact CB-O 3.46Å; M413-E431 VanDerWaalsContact SD-O 3.42Å; M413-V432 VanDerWaalsContact CB-C 3.47Å; M413-V432 WeakPolarHBondContact CB-O 3.38Å; M413-V432 PolarHBondContact N-O 3.18Å; M413-R433 HydrophobicContact CB-CG 4Å; M413-R433 HydrophobicContact CG-CG 4.14Å; M413-R433 HydrophobicContact SD-CG 4.07Å; M413-P434 WeakPolarHBondContact O-CD 3.29Å
414	Q	90.5	Very high	78.3	Confident	164 Å²	164	92.9 Å²	92.9	77%	0.766	48%	0.478	S	S	*	.			trans	-96.9	-5.2	-177.4	-60.9	-175.3	9.5	0	0	114.1	T412	T412-Q414 PolarHBondContact O-N 2.74Å
415	E	90.5	Very high	79.9	Confident	125 Å²	125	96 Å²	96	58%	0.584	49%	0.486	S	S	*	.			trans	-72.5	140.8	179.4	-56.6	-173.7	153.1	0	0	111.3	M413 R433 I437	M413-E415 HydrophobicContact CE-CB 4Å; M413-E415 HydrophobicContact CE-CG 4.25Å; M413-E415 WeakPolarHBondContact CE-OE2 3.38Å; M413-E415 HydrophobicContact CG-CB 4.37Å; E415-R433 WeakPolarHBondContact O-CD 3.47Å; E415-R433 WeakPolarHBondContact O-CG 3.24Å; E415-I437 VanDerWaalsContact O-CG2 3.29Å; E415-I437 WeakPolarHBondContact O-CG2 3.3Å
416	I	91.4	Very high	81.2	Confident	66 Å²	66	97.3 Å²	97.3	34%	0.338	49%	0.492	S	S	.	.	S	Bend	trans	-85.1	-41.1	-178.3	-59.5	178.5	0	0	0	110.8	R433 S441 H444	I416-R433 PolarHBondContact O-NH1 3.2Å; I416-S441 PolarHBondContact O-OG 3.4Å; I416-S441 VanDerWaalsContact O-OG 3.07Å; I416-H444 HydrophobicContact CG2-CB 3.83Å
417	E	91.8	Very high	82.6	Confident	78 Å²	78	94.4 Å²	94.4	36%	0.364	47%	0.471	S	S	.	.			trans	-93.7	133	175.2	-56.9	-172.5	-179.1	0	0	109.5	H444 K448 W457	E417-H444 IonicContact OE1-CD2 3.77Å; E417-H444 IonicContact OE1-CE1 3.62Å; E417-H444 IonicContact OE1-NE2 2.73Å; E417-H444 PolarHBondContact OE1-NE2 3.2Å; E417-K448 IonicContact OE1-NZ 3.57Å; E417-W457 HydrophobicContact CG-CZ2 3.98Å
418	K	90.8	Very high	84	Confident	19 Å²	19	94.7 Å²	94.7	8%	0.083	47%	0.467	C	S	.	.			trans	-145.7	132.7	-179.4	-179.4	-166.8	161.8	177.5	0	110.6	M413 E431 Q461 S464 D468	M413-K418 HydrophobicContact CE-CB 4.24Å; M413-K418 HydrophobicContact CE-CD 4.29Å; M413-K418 HydrophobicContact CE-CG 3.89Å; M413-K418 HydrophobicContact SD-CD 3.78Å; M413-K418 HydrophobicContact SD-CG 4.06Å; K418-E431 VanDerWaalsContact CE-O 3.29Å; K418-E431 WeakPolarHBondContact CE-O 3.31Å; K418-E431 PolarHBondContact NZ-O 2.83Å; K418-Q461 PolarHBondContact O-NE2 2.96Å; K418-Q461 VanDerWaalsContact O-NE2 3.15Å; K418-Q461 PolarHBondContact O-OE1 3.4Å; K418-Q461 VanDerWaalsContact O-OE1 3.11Å; K418-S464 WeakPolarHBondContact O-CB 3.45Å; K418-S464 PolarHBondContact O-OG 2.9Å; K418-D468 IonicContact NZ-OD1 2.67Å; K418-D468 PolarHBondContact NZ-OD1 3.31Å; K418-D468 IonicContact NZ-OD2 3.45Å
419	Q	88.7	Confident	85	Confident	154 Å²	154	92.2 Å²	92.2	72%	0.72	46%	0.46	S	S	*	.			trans	-67.7	151.6	172.5	-72.9	-175.1	-16	0	0	112.4	L421 E460	Q419-L421 PolarHBondContact O-N 2.97Å; Q419-E460 WeakPolarHBondContact CA-OE1 3.23Å; Q419-E460 VanDerWaalsContact CB-OE1 3.28Å; Q419-E460 WeakPolarHBondContact CB-OE1 3.47Å; Q419-E460 WeakPolarHBondContact CG-OE1 3.41Å
420	Y	88.4	Confident	85.7	Confident	121 Å²	121	93.4 Å²	93.4	48%	0.475	47%	0.471	S	S	.	.			trans	-78.8	108	178.8	175.3	-112.6	0	0	0	111.3	E460 K463 Q467	Y420-E460 PolarHBondContact N-OE1 3.16Å; Y420-K463 HydrophobicContact CD1-CB 4.38Å; Y420-K463 HydrophobicContact CD2-CB 3.63Å; Y420-K463 WeakPolarHBondContact CD2-O 3.28Å; Y420-K463 HydrophobicContact CE2-CB 4.17Å; Y420-K463 HydrophobicContact CG-CB 3.73Å; Y420-Q467 HydrophobicContact CD2-CB 4.25Å; Y420-Q467 HydrophobicContact CE2-CB 4.02Å
421	L	85.1	Confident	86.1	Confident	64 Å²	64	92.7 Å²	92.7	34%	0.335	46%	0.462	S	S	.	.			trans	-83.8	132.5	-173.7	-176.4	60.3	0	0	0	111.7	Q419 L423 E431 Q467	Q419-L421 PolarHBondContact O-N 2.97Å; L421-L423 HydrophobicContact CD2-CD2 4.38Å; L421-L423 PolarHBondContact O-N 3.22Å; L421-L423 VanDerWaalsContact O-N 3.09Å; L421-E431 VanDerWaalsContact CD2-OE2 3.24Å; L421-E431 WeakPolarHBondContact CD2-OE2 3.43Å; L421-Q467 PolarHBondContact O-NE2 3.2Å; L421-Q467 PolarHBondContact O-OE1 3.26Å
422	R	85.5	Confident	86.5	Confident	208 Å²	208	92.7 Å²	92.7	79%	0.785	46%	0.461	S	S	*	.			trans	-77.4	95.9	166.4	-170.3	-177.1	-177.6	107.4	4.1	109.6	T424	R422-T424 HydrophobicContact CG-CG2 4.42Å; R422-T424 PolarHBondContact O-N 3.04Å; R422-T424 PolarHBondContact O-OG1 3.42Å
423	L	81	Confident	86.7	Confident	77 Å²	77	89 Å²	89	40%	0.403	44%	0.438	S	S	.	.			trans	-52.7	113.5	175.6	-60.9	177.9	0	0	0	110.6	L421 P427 V471	L421-L423 HydrophobicContact CD2-CD2 4.38Å; L421-L423 PolarHBondContact O-N 3.22Å; L421-L423 VanDerWaalsContact O-N 3.09Å; L423-P427 HydrophobicContact CD2-CB 4.16Å; L423-V471 HydrophobicContact CD1-CG2 3.86Å
424	T	84	Confident	86.8	Confident	120 Å²	120	89 Å²	89	74%	0.736	44%	0.44	S	S	*	.			trans	-127.3	3	179	45	0	0	0	0	112.2	R422	R422-T424 HydrophobicContact CG-CG2 4.42Å; R422-T424 PolarHBondContact O-N 3.04Å; R422-T424 PolarHBondContact O-OG1 3.42Å
425	R	83.4	Confident	87	Confident	211 Å²	211	83.6 Å²	83.6	80%	0.796	42%	0.417	S	S	*	.	S	Bend	trans	-140.5	176.9	177.1	-64.2	-177.9	177.5	176.4	-1.1	107.8
426	A	79.8	Confident	87.1	Confident	80 Å²	80	81 Å²	81	66%	0.661	42%	0.416	S	S	*	.	P	Polyproline II helix	trans	-58.7	140.8	158.7	0	0	0	0	0	108.9	D428	A426-D428 PolarHBondContact O-N 2.84Å
427	P	77.7	Confident	87.2	Confident	31 Å²	31	79.2 Å²	79.2	20%	0.201	41%	0.407	C	S	.	.	P	Polyproline II helix	trans	-72.5	121.9	177.4	28	-31.3	0	0	0	109.9	L423 V432 V471	L423-P427 HydrophobicContact CD2-CB 4.16Å; P427-V432 HydrophobicContact CB-CG2 4.26Å; P427-V471 HydrophobicContact CB-CG1 3.81Å; P427-V471 HydrophobicContact CB-CG2 4.33Å; P427-V471 HydrophobicContact CG-CB 4.47Å; P427-V471 HydrophobicContact CG-CG1 3.45Å; P427-V471 VanDerWaalsContact CG-CG1 3.45Å; P427-V471 HydrophobicContact CG-CG2 4.18Å
428	D	81.8	Confident	87.4	Confident	88 Å²	88	75.5 Å²	75.5	47%	0.471	39%	0.39	S	S	.	.	P	Polyproline II helix	trans	-72.4	136.6	174.5	-72.1	-42.7	0	0	0	109.3	A426 T430 E431	A426-D428 PolarHBondContact O-N 2.84Å; D428-T430 PolarHBondContact O-N 3.4Å; D428-E431 HydrophobicContact CB-CG 4.33Å; D428-E431 WeakPolarHBondContact O-CB 3.44Å; D428-E431 PolarHBondContact O-N 3.19Å
429	P	84	Confident	87.6	Confident	56 Å²	56	79.6 Å²	79.6	36%	0.364	41%	0.407	S	S	.	.	G	3₁₀ helix	trans	-56.4	-29.9	-176.2	-27.2	34.6	0	0	0	114	I409 T412 E431 V432	I409-P429 HydrophobicContact CG2-CB 4.44Å; I409-P429 HydrophobicContact CG2-CG 4.08Å; T412-P429 PolarHBondContact N-O 3.02Å; T412-P429 PolarHBondContact OG1-O 3.01Å; P429-E431 VanDerWaalsContact C-N 3.25Å; P429-E431 PolarHBondContact O-N 2.97Å; P429-V432 PolarHBondContact O-N 3.49Å; P429-V432 VanDerWaalsContact O-N 3.15Å
430	T	86.3	Confident	87.9	Confident	98 Å²	98	77 Å²	77	60%	0.601	40%	0.398	S	S	*	.	G	3₁₀ helix	trans	-68.1	-18.2	176	47.1	0	0	0	0	114.3	T412 M413 D428	T412-T430 WeakPolarHBondContact OG1-CA 3.31Å; T412-T430 PolarHBondContact OG1-N 3.1Å; M413-T430 WeakPolarHBondContact CB-O 3.46Å; D428-T430 PolarHBondContact O-N 3.4Å
431	E	87.4	Confident	88.3	Confident	76 Å²	76	71.2 Å²	71.2	36%	0.355	38%	0.376	S	S	.	.	G	3₁₀ helix	trans	-88.8	-4.6	173.2	-61.8	-171.1	145.4	0	0	112.5	M413 K418 L421 D428 P429	M413-E431 VanDerWaalsContact SD-O 3.42Å; K418-E431 VanDerWaalsContact CE-O 3.29Å; K418-E431 WeakPolarHBondContact CE-O 3.31Å; K418-E431 PolarHBondContact NZ-O 2.83Å; L421-E431 VanDerWaalsContact CD2-OE2 3.24Å; L421-E431 WeakPolarHBondContact CD2-OE2 3.43Å; D428-E431 HydrophobicContact CB-CG 4.33Å; D428-E431 WeakPolarHBondContact O-CB 3.44Å; D428-E431 PolarHBondContact O-N 3.19Å; P429-E431 VanDerWaalsContact C-N 3.25Å; P429-E431 PolarHBondContact O-N 2.97Å
432	V	90.4	Very high	88.7	Confident	3 Å²	3	68.4 Å²	68.4	2%	0.018	36%	0.361	C	S	.	.	S	Bend	trans	-116.5	131.7	-171	-176.8	0	0	0	0	110.3	G411 T412 M413 P427 P429 D468 V471 Q472	G411-V432 CarbonylContact C-O 3.22Å; G411-V432 VanDerWaalsContact C-O 3.22Å; G411-V432 WeakPolarHBondContact CA-O 3.25Å; T412-V432 PolarHBondContact N-O 3.43Å; M413-V432 VanDerWaalsContact CB-C 3.47Å; M413-V432 WeakPolarHBondContact CB-O 3.38Å; M413-V432 PolarHBondContact N-O 3.18Å; P427-V432 HydrophobicContact CB-CG2 4.26Å; P429-V432 PolarHBondContact O-N 3.49Å; P429-V432 VanDerWaalsContact O-N 3.15Å; V432-D468 HydrophobicContact CG1-CB 4.14Å; V432-V471 HydrophobicContact CG1-CG1 4.36Å; V432-V471 HydrophobicContact CG2-CG1 3.87Å; V432-Q472 HydrophobicContact CG1-CG 3.65Å
433	R	92.4	Very high	89.2	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	34%	0.343	C	S	.	.			trans	-82.2	130.1	178.4	-68.6	171.2	-65.4	-163.1	-12.7	111.2	M413 E415 I416 I437 L438 S441 S464 I465 D468 Q472	M413-R433 HydrophobicContact CB-CG 4Å; M413-R433 HydrophobicContact CG-CG 4.14Å; M413-R433 HydrophobicContact SD-CG 4.07Å; E415-R433 WeakPolarHBondContact O-CD 3.47Å; E415-R433 WeakPolarHBondContact O-CG 3.24Å; I416-R433 PolarHBondContact O-NH1 3.2Å; R433-I437 HydrophobicContact CB-CB 4.23Å; R433-I437 HydrophobicContact CB-CG2 4.1Å; R433-I437 HydrophobicContact CG-CG2 3.94Å; R433-L438 HydrophobicContact CB-CD2 3.77Å; R433-L438 HydrophobicContact CB-CG 3.94Å; R433-L438 WeakPolarHBondContact O-CD1 3.46Å; R433-L438 WeakPolarHBondContact O-CG 3.37Å; R433-S441 PolarHBondContact NH1-OG 2.98Å; R433-S464 PolarHBondContact NH2-O 3.11Å; R433-S464 PolarHBondContact NH2-OG 2.88Å; R433-I465 VanDerWaalsContact NH2-N 3.18Å; R433-D468 IonicContact CZ-OD2 3.23Å; R433-D468 VanDerWaalsContact CZ-OD2 3.23Å; R433-D468 IonicContact NE-OD2 2.78Å; R433-D468 PolarHBondContact NE-OD2 2.85Å; R433-D468 IonicContact NH2-OD2 2.77Å; R433-D468 PolarHBondContact NH2-OD2 3.49Å; R433-Q472 PolarHBondContact O-NE2 3.25Å; R433-Q472 PolarHBondContact O-OE1 2.95Å
434	P	93	Very high	89.9	Confident	29 Å²	29	61.6 Å²	61.6	19%	0.188	34%	0.336	C	S	.	.			trans	-68.6	161.4	172.6	24.2	-26.4	0	0	0	111.8	V410 G411 M413 A436 I437 L438	V410-P434 HydrophobicContact CG1-CB 4.38Å; G411-P434 VanDerWaalsContact O-CB 3.25Å; G411-P434 WeakPolarHBondContact O-CB 3.18Å; G411-P434 WeakPolarHBondContact O-CD 3.31Å; G411-P434 WeakPolarHBondContact O-CG 3.44Å; M413-P434 WeakPolarHBondContact O-CD 3.29Å; P434-A436 PolarHBondContact O-N 3.32Å; P434-I437 HydrophobicContact CG-CB 4.42Å; P434-I437 HydrophobicContact CG-CG1 3.93Å; P434-I437 PolarHBondContact O-N 3.39Å; P434-L438 PolarHBondContact O-N 3.36Å
435	L	92.8	Very high	90.4	Very high	52 Å²	52	55.9 Å²	55.9	27%	0.272	30%	0.3	S	S	.	.	H	α-helix	trans	-48.5	-36.1	-177.3	-177.4	59.6	0	0	0	114.8	K439 I474 F478	L435-K439 WeakPolarHBondContact O-CG 3.33Å; L435-K439 PolarHBondContact O-N 3.19Å; L435-K439 VanDerWaalsContact O-N 3.11Å; L435-I474 HydrophobicContact CB-CD1 4.4Å; L435-F478 HydrophobicContact CD1-CB 4.43Å; L435-F478 HydrophobicContact CD1-CD1 3.3Å; L435-F478 HydrophobicContact CD1-CE1 3.75Å; L435-F478 HydrophobicContact CD1-CG 3.98Å
436	A	93.3	Very high	90.9	Very high	69 Å²	69	48.2 Å²	48.2	57%	0.57	27%	0.273	S	S	*	.	H	α-helix	trans	-65.2	-43.8	176.6	0	0	0	0	0	112.6	P434 K439 L440	P434-A436 PolarHBondContact O-N 3.32Å; A436-K439 PolarHBondContact O-N 2.84Å; A436-L440 PolarHBondContact O-N 2.86Å
437	I	94.5	Very high	91.5	Very high	29 Å²	29	50.5 Å²	50.5	15%	0.149	27%	0.27	C	S	.	.	H	α-helix	trans	-74.7	-34.1	178.5	-56.2	-64.2	0	0	0	110.4	E415 R433 P434 K439 L440 S441	E415-I437 VanDerWaalsContact O-CG2 3.29Å; E415-I437 WeakPolarHBondContact O-CG2 3.3Å; R433-I437 HydrophobicContact CB-CB 4.23Å; R433-I437 HydrophobicContact CB-CG2 4.1Å; R433-I437 HydrophobicContact CG-CG2 3.94Å; P434-I437 HydrophobicContact CG-CB 4.42Å; P434-I437 HydrophobicContact CG-CG1 3.93Å; P434-I437 PolarHBondContact O-N 3.39Å; I437-K439 VanDerWaalsContact C-N 3.32Å; I437-K439 PolarHBondContact O-N 3.3Å; I437-L440 HydrophobicContact CD1-CD1 4.41Å; I437-L440 PolarHBondContact O-N 3.37Å; I437-S441 WeakPolarHBondContact O-CB 3.3Å; I437-S441 PolarHBondContact O-N 2.82Å; I437-S441 PolarHBondContact O-OG 2.82Å
438	L	95	Very high	92.2	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-61.5	-37.4	173	-69	173.4	0	0	0	112.6	R433 P434 S441 L442 I465 D468 L469 F478	R433-L438 HydrophobicContact CB-CD2 3.77Å; R433-L438 HydrophobicContact CB-CG 3.94Å; R433-L438 WeakPolarHBondContact O-CD1 3.46Å; R433-L438 WeakPolarHBondContact O-CG 3.37Å; P434-L438 PolarHBondContact O-N 3.36Å; L438-S441 WeakPolarHBondContact O-CB 3.31Å; L438-S441 PolarHBondContact O-N 2.92Å; L438-L442 PolarHBondContact O-N 2.95Å; L438-I465 HydrophobicContact CD2-CB 4.42Å; L438-I465 HydrophobicContact CD2-CG1 4.43Å; L438-I465 HydrophobicContact CD2-CG2 4.01Å; L438-D468 HydrophobicContact CD1-CB 4.16Å; L438-D468 HydrophobicContact CD2-CB 3.68Å; L438-D468 HydrophobicContact CG-CB 4.5Å; L438-L469 HydrophobicContact CD1-CD2 4Å; L438-L469 HydrophobicContact CD1-CG 4.29Å; L438-F478 HydrophobicContact CB-CE1 3.85Å; L438-F478 HydrophobicContact CB-CZ 4.06Å
439	K	95.4	Very high	92.7	Very high	105 Å²	105	50.4 Å²	50.4	46%	0.457	26%	0.261	S	S	.	.	H	α-helix	trans	-63.3	-43.5	174.1	-76.2	170.7	179.9	-179.7	0	112.1	L435 A436 I437 L442 E443 F478	L435-K439 WeakPolarHBondContact O-CG 3.33Å; L435-K439 PolarHBondContact O-N 3.19Å; L435-K439 VanDerWaalsContact O-N 3.11Å; A436-K439 PolarHBondContact O-N 2.84Å; I437-K439 VanDerWaalsContact C-N 3.32Å; I437-K439 PolarHBondContact O-N 3.3Å; K439-L442 PolarHBondContact O-N 3.26Å; K439-E443 PolarHBondContact O-N 3.23Å; K439-F478 HydrophobicContact CB-CE2 4.28Å; K439-F478 HydrophobicContact CB-CZ 4.45Å; K439-F478 HydrophobicContact CG-CD2 3.81Å; K439-F478 HydrophobicContact CG-CE1 4.36Å; K439-F478 HydrophobicContact CG-CE2 3.45Å; K439-F478 VanDerWaalsContact CG-CE2 3.45Å; K439-F478 HydrophobicContact CG-CG 4.41Å; K439-F478 HydrophobicContact CG-CZ 3.76Å
440	L	95.4	Very high	93	Very high	100 Å²	100	55.7 Å²	55.7	52%	0.524	27%	0.274	S	S	.	.	H	α-helix	trans	-64.5	-41.2	173.4	-62.2	175.8	0	0	0	111.8	A436 I437 L442 E443 H444	A436-L440 PolarHBondContact O-N 2.86Å; I437-L440 HydrophobicContact CD1-CD1 4.41Å; I437-L440 PolarHBondContact O-N 3.37Å; L440-L442 VanDerWaalsContact C-N 3.34Å; L440-L442 PolarHBondContact O-N 3.25Å; L440-E443 PolarHBondContact O-N 3.02Å; L440-H444 WeakPolarHBondContact O-CB 3.5Å; L440-H444 PolarHBondContact O-N 3.41Å
441	S	95.3	Very high	93.1	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-59.8	-43	177.1	-52.9	0	0	0	0	111.7	I416 R433 I437 L438 V445	I416-S441 PolarHBondContact O-OG 3.4Å; I416-S441 VanDerWaalsContact O-OG 3.07Å; R433-S441 PolarHBondContact NH1-OG 2.98Å; I437-S441 WeakPolarHBondContact O-CB 3.3Å; I437-S441 PolarHBondContact O-N 2.82Å; I437-S441 PolarHBondContact O-OG 2.82Å; L438-S441 WeakPolarHBondContact O-CB 3.31Å; L438-S441 PolarHBondContact O-N 2.92Å; S441-V445 WeakPolarHBondContact O-CB 3.39Å; S441-V445 WeakPolarHBondContact O-CG2 3.21Å; S441-V445 PolarHBondContact O-N 3.3Å
442	L	95.4	Very high	92.8	Very high	4 Å²	4	58.2 Å²	58.2	2%	0.021	29%	0.292	C	S	.	.	H	α-helix	trans	-61.7	-48.7	179.1	178.9	60.5	0	0	0	112.1	L438 K439 L440 V445 K446 F462 F478 V482 A485	L438-L442 PolarHBondContact O-N 2.95Å; K439-L442 PolarHBondContact O-N 3.26Å; L440-L442 VanDerWaalsContact C-N 3.34Å; L440-L442 PolarHBondContact O-N 3.25Å; L442-V445 PolarHBondContact O-N 3.22Å; L442-K446 HydrophobicContact CD1-CD 3.85Å; L442-K446 HydrophobicContact CD1-CG 4.39Å; L442-K446 HydrophobicContact CG-CD 3.8Å; L442-K446 VanDerWaalsContact O-CD 3.32Å; L442-K446 WeakPolarHBondContact O-CD 3.4Å; L442-K446 VanDerWaalsContact O-CG 3.24Å; L442-K446 WeakPolarHBondContact O-CG 3.48Å; L442-K446 PolarHBondContact O-N 2.64Å; L442-F462 HydrophobicContact CD1-CE1 3.73Å; L442-F478 HydrophobicContact CB-CE2 4.43Å; L442-F478 HydrophobicContact CB-CZ 4.43Å; L442-F478 HydrophobicContact CD2-CD2 4.5Å; L442-F478 HydrophobicContact CD2-CE2 3.66Å; L442-F478 HydrophobicContact CD2-CZ 4.27Å; L442-V482 HydrophobicContact CD1-CG2 4.16Å; L442-V482 HydrophobicContact CD2-CG2 3.88Å; L442-V482 HydrophobicContact CG-CG2 4.44Å; L442-A485 HydrophobicContact CD1-CB 4.1Å
443	E	95.6	Very high	92.2	Very high	91 Å²	91	59.9 Å²	59.9	43%	0.425	30%	0.302	S	S	.	.	H	α-helix	trans	-69.4	-38.1	180	-64.4	-51.5	146.9	0	0	112.6	K439 L440 V445 K446 E447	K439-E443 PolarHBondContact O-N 3.23Å; L440-E443 PolarHBondContact O-N 3.02Å; E443-V445 PolarHBondContact O-N 3.05Å; E443-K446 PolarHBondContact O-N 2.99Å; E443-K446 IonicContact OE1-NZ 2.65Å; E443-K446 PolarHBondContact OE1-NZ 3.34Å; E443-K446 VanDerWaalsContact OE2-CE 3.23Å; E443-K446 WeakPolarHBondContact OE2-CE 3.42Å; E443-K446 IonicContact OE2-NZ 2.68Å; E443-K446 PolarHBondContact OE2-NZ 3.35Å; E443-E447 WeakPolarHBondContact O-CB 3.21Å; E443-E447 PolarHBondContact O-N 2.65Å
444	H	94.1	Very high	92.1	Very high	51 Å²	51	65.9 Å²	65.9	24%	0.236	33%	0.334	C	S	.	.	H	α-helix	trans	-58.5	-45	173.7	-178	74	0	0	0	112	I416 E417 L440 K446 E447 K448	I416-H444 HydrophobicContact CG2-CB 3.83Å; E417-H444 IonicContact OE1-CD2 3.77Å; E417-H444 IonicContact OE1-CE1 3.62Å; E417-H444 IonicContact OE1-NE2 2.73Å; E417-H444 PolarHBondContact OE1-NE2 3.2Å; L440-H444 WeakPolarHBondContact O-CB 3.5Å; L440-H444 PolarHBondContact O-N 3.41Å; H444-K446 PolarHBondContact O-N 3.31Å; H444-E447 PolarHBondContact O-N 3.11Å; H444-K448 WeakPolarHBondContact O-CB 3.37Å; H444-K448 WeakPolarHBondContact O-CG 3.39Å; H444-K448 PolarHBondContact O-N 3.16Å
445	V	94.9	Very high	92.1	Very high	0 Å²	0	66.5 Å²	66.5	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-66	-37.9	176.4	174.2	0	0	0	0	111.7	S441 L442 E443 K448 W449 W457 V458 Q461 F462 I465	S441-V445 WeakPolarHBondContact O-CB 3.39Å; S441-V445 WeakPolarHBondContact O-CG2 3.21Å; S441-V445 PolarHBondContact O-N 3.3Å; L442-V445 PolarHBondContact O-N 3.22Å; E443-V445 PolarHBondContact O-N 3.05Å; V445-K448 PolarHBondContact O-N 2.99Å; V445-W449 PolarHBondContact O-N 3.08Å; V445-W457 HydrophobicContact CG2-CH2 4.33Å; V445-W457 HydrophobicContact CG2-CZ3 4.47Å; V445-V458 HydrophobicContact CG1-CG1 3.93Å; V445-Q461 HydrophobicContact CG1-CB 4.26Å; V445-Q461 HydrophobicContact CG2-CB 3.45Å; V445-Q461 VanDerWaalsContact CG2-CB 3.45Å; V445-Q461 HydrophobicContact CG2-CG 4.03Å; V445-F462 HydrophobicContact CG1-CD1 4.46Å; V445-F462 HydrophobicContact CG1-CD2 3.74Å; V445-F462 HydrophobicContact CG1-CE1 4.23Å; V445-F462 HydrophobicContact CG1-CE2 3.47Å; V445-F462 VanDerWaalsContact CG1-CE2 3.47Å; V445-F462 HydrophobicContact CG1-CG 4.24Å; V445-F462 HydrophobicContact CG1-CZ 3.75Å; V445-I465 HydrophobicContact CG2-CD1 4.18Å
446	K	93.7	Very high	92	Very high	50 Å²	50	71.5 Å²	71.5	22%	0.217	36%	0.355	C	S	.	.	H	α-helix	trans	-67.3	-36	174.8	-71.2	159.3	65.2	-170	0	112.4	L442 E443 H444 R450 A485	L442-K446 HydrophobicContact CD1-CD 3.85Å; L442-K446 HydrophobicContact CD1-CG 4.39Å; L442-K446 HydrophobicContact CG-CD 3.8Å; L442-K446 VanDerWaalsContact O-CD 3.32Å; L442-K446 WeakPolarHBondContact O-CD 3.4Å; L442-K446 VanDerWaalsContact O-CG 3.24Å; L442-K446 WeakPolarHBondContact O-CG 3.48Å; L442-K446 PolarHBondContact O-N 2.64Å; E443-K446 PolarHBondContact O-N 2.99Å; E443-K446 IonicContact OE1-NZ 2.65Å; E443-K446 PolarHBondContact OE1-NZ 3.34Å; E443-K446 VanDerWaalsContact OE2-CE 3.23Å; E443-K446 WeakPolarHBondContact OE2-CE 3.42Å; E443-K446 IonicContact OE2-NZ 2.68Å; E443-K446 PolarHBondContact OE2-NZ 3.35Å; H444-K446 PolarHBondContact O-N 3.31Å; K446-R450 VanDerWaalsContact O-CG 3.25Å; K446-R450 WeakPolarHBondContact O-CG 3.4Å; K446-R450 PolarHBondContact O-N 2.9Å; K446-R450 VanDerWaalsContact O-N 3.12Å; K446-A485 HydrophobicContact CD-CB 4.47Å
447	E	93.3	Very high	92.1	Very high	128 Å²	128	70.9 Å²	70.9	60%	0.598	34%	0.338	S	S	*	.	H	α-helix	trans	-70.1	-41.2	173.9	-176.8	165.2	-134.4	0	0	112.1	E443 H444 W449 R450 S451	E443-E447 WeakPolarHBondContact O-CB 3.21Å; E443-E447 PolarHBondContact O-N 2.65Å; H444-E447 PolarHBondContact O-N 3.11Å; E447-W449 VanDerWaalsContact C-N 3.35Å; E447-W449 PolarHBondContact O-N 2.87Å; E447-R450 PolarHBondContact O-N 3.23Å; E447-S451 PolarHBondContact O-N 3.01Å; E447-S451 PolarHBondContact O-OG 3.42Å
448	K	91.8	Very high	92.1	Very high	65 Å²	65	69.5 Å²	69.5	28%	0.283	33%	0.33	S	S	.	.	H	α-helix	trans	-60.1	-40.9	172.1	-71.8	-88.5	-173.8	157.2	0	112.4	E417 H444 V445 S451 T453 W457	E417-K448 IonicContact OE1-NZ 3.57Å; H444-K448 WeakPolarHBondContact O-CB 3.37Å; H444-K448 WeakPolarHBondContact O-CG 3.39Å; H444-K448 PolarHBondContact O-N 3.16Å; V445-K448 PolarHBondContact O-N 2.99Å; K448-S451 VanDerWaalsContact CA-OG 3.31Å; K448-S451 WeakPolarHBondContact CA-OG 3.37Å; K448-S451 PolarHBondContact O-N 3.34Å; K448-S451 PolarHBondContact O-OG 2.84Å; K448-S451 VanDerWaalsContact O-OG 3.06Å; K448-T453 HydrophobicContact CD-CG2 4.5Å; K448-T453 WeakPolarHBondContact O-CB 3.44Å; K448-T453 PolarHBondContact O-N 2.91Å; K448-T453 PolarHBondContact O-OG1 3.42Å; K448-W457 HydrophobicContact CB-CE3 4.4Å; K448-W457 HydrophobicContact CB-CH2 4.01Å; K448-W457 HydrophobicContact CB-CZ3 3.49Å; K448-W457 VanDerWaalsContact CB-CZ3 3.49Å; K448-W457 HydrophobicContact CD-CH2 4.01Å; K448-W457 HydrophobicContact CD-CZ3 4.12Å; K448-W457 HydrophobicContact CG-CH2 3.67Å; K448-W457 HydrophobicContact CG-CZ3 3.71Å
449	W	92.6	Very high	92	Very high	52 Å²	52	69.8 Å²	69.8	20%	0.197	33%	0.332	C	S	.	.	H	α-helix	trans	-63.6	-47.9	173.3	-176.9	-118	0	0	0	112.1	V445 E447 S451 N452 Y455 V458 V489 E492 A493	V445-W449 PolarHBondContact O-N 3.08Å; E447-W449 VanDerWaalsContact C-N 3.35Å; E447-W449 PolarHBondContact O-N 2.87Å; W449-S451 PolarHBondContact O-N 3.36Å; W449-N452 PolarHBondContact O-N 3.06Å; W449-Y455 HydrophobicContact CH2-CD2 4.15Å; W449-Y455 HydrophobicContact CZ3-CD2 4.08Å; W449-V458 HydrophobicContact CB-CG1 4.32Å; W449-V458 HydrophobicContact CB-CG2 4.45Å; W449-V458 HydrophobicContact CE3-CB 4.39Å; W449-V458 HydrophobicContact CE3-CG1 4.25Å; W449-V458 HydrophobicContact CE3-CG2 4.09Å; W449-V489 HydrophobicContact CD2-CG1 3.88Å; W449-V489 HydrophobicContact CD2-CG2 4.37Å; W449-V489 HydrophobicContact CE3-CG1 4.23Å; W449-V489 HydrophobicContact CG-CG1 4.31Å; W449-V489 HydrophobicContact CG-CG2 3.99Å; W449-V489 HydrophobicContact CH2-CG1 4.41Å; W449-V489 HydrophobicContact CZ2-CG1 4.09Å; W449-V489 HydrophobicContact CZ3-CG1 4.48Å; W449-E492 HydrophobicContact CZ2-CB 3.99Å; W449-E492 PolarHBondContact NE1-OE2 3.38Å; W449-A493 HydrophobicContact CH2-CB 4.27Å
450	R	89.7	Confident	92	Very high	168 Å²	168	67.9 Å²	67.9	63%	0.634	33%	0.325	S	S	*	.	H	α-helix	trans	-60.5	-25.5	176.9	-69.9	167.3	-170.7	137.7	-3.9	114	K446 E447 N452	K446-R450 VanDerWaalsContact O-CG 3.25Å; K446-R450 WeakPolarHBondContact O-CG 3.4Å; K446-R450 PolarHBondContact O-N 2.9Å; K446-R450 VanDerWaalsContact O-N 3.12Å; E447-R450 PolarHBondContact O-N 3.23Å; R450-N452 VanDerWaalsContact C-N 3.3Å
451	S	89.8	Confident	92	Very high	76 Å²	76	63.4 Å²	63.4	53%	0.531	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	13	174.8	45.8	0	0	0	0	113.7	E447 K448 W449	E447-S451 PolarHBondContact O-N 3.01Å; E447-S451 PolarHBondContact O-OG 3.42Å; K448-S451 VanDerWaalsContact CA-OG 3.31Å; K448-S451 WeakPolarHBondContact CA-OG 3.37Å; K448-S451 PolarHBondContact O-N 3.34Å; K448-S451 PolarHBondContact O-OG 2.84Å; K448-S451 VanDerWaalsContact O-OG 3.06Å; W449-S451 PolarHBondContact O-N 3.36Å
452	N	81.4	Confident	92	Very high	151 Å²	151	63.4 Å²	63.4	81%	0.807	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.3	42.1	179.4	-56.5	-62.2	0	0	0	114.1	W449 R450	W449-N452 PolarHBondContact O-N 3.06Å; R450-N452 VanDerWaalsContact C-N 3.3Å
453	T	76.8	Confident	92	Very high	37 Å²	37	65.7 Å²	65.7	23%	0.227	31%	0.311	C	S	.	.			trans	-69.4	150.2	168.8	-56.8	0	0	0	0	111.2	K448 Y455 W457 V458	K448-T453 HydrophobicContact CD-CG2 4.5Å; K448-T453 WeakPolarHBondContact O-CB 3.44Å; K448-T453 PolarHBondContact O-N 2.91Å; K448-T453 PolarHBondContact O-OG1 3.42Å; T453-Y455 PolarHBondContact O-N 2.86Å; T453-W457 HydrophobicContact CG2-CD2 4.17Å; T453-W457 HydrophobicContact CG2-CE3 3.69Å; T453-W457 HydrophobicContact CG2-CZ3 4.33Å; T453-V458 HydrophobicContact CG2-CG2 4.41Å
454	D	90.9	Very high	91.9	Very high	126 Å²	126	61.3 Å²	61.3	67%	0.674	29%	0.291	S	S	*	.			trans	-45.4	123.9	177.6	-68.1	-46.1	0	0	0	113.6	H456 W457 V458	D454-H456 PolarHBondContact O-N 2.84Å; D454-H456 VanDerWaalsContact O-N 3.15Å; D454-W457 HydrophobicContact CB-CB 4.44Å; D454-W457 PolarHBondContact O-N 2.83Å; D454-V458 PolarHBondContact O-N 2.75Å; D454-V458 VanDerWaalsContact O-N 3.13Å
455	Y	92	Very high	92	Very high	43 Å²	43	58.9 Å²	58.9	17%	0.169	28%	0.28	C	S	.	.	H	α-helix	trans	-53.6	-37.5	178	172.6	-109.3	0	0	0	112.7	W449 T453 W457 V458 C459 V489 A493 D495	W449-Y455 HydrophobicContact CH2-CD2 4.15Å; W449-Y455 HydrophobicContact CZ3-CD2 4.08Å; T453-Y455 PolarHBondContact O-N 2.86Å; Y455-W457 PolarHBondContact O-N 3.03Å; Y455-V458 PolarHBondContact O-N 3.42Å; Y455-C459 HydrophobicContact CE1-CB 4.29Å; Y455-C459 HydrophobicContact CE2-CB 4.16Å; Y455-C459 VanDerWaalsContact O-CB 3.24Å; Y455-C459 WeakPolarHBondContact O-CB 3.46Å; Y455-C459 PolarHBondContact O-N 2.93Å; Y455-V489 HydrophobicContact CD2-CG1 4.21Å; Y455-V489 HydrophobicContact CE2-CG1 4.08Å; Y455-A493 HydrophobicContact CD1-CB 4.1Å; Y455-A493 HydrophobicContact CD2-CB 3.36Å; Y455-A493 HydrophobicContact CE1-CB 4.16Å; Y455-A493 HydrophobicContact CE2-CB 3.43Å; Y455-A493 VanDerWaalsContact CE2-CB 3.43Å; Y455-A493 HydrophobicContact CG-CB 3.73Å; Y455-D495 HydrophobicContact CE1-CB 4.16Å; Y455-D495 WeakPolarHBondContact OH-CB 3.45Å; Y455-D495 PolarHBondContact OH-OD2 2.93Å
456	H	92.2	Very high	92	Very high	157 Å²	157	60 Å²	60	73%	0.727	28%	0.284	S	S	*	.	H	α-helix	trans	-60.9	-43	178.4	-69.9	-55.8	0	0	0	112.8	D454 E460	D454-H456 PolarHBondContact O-N 2.84Å; D454-H456 VanDerWaalsContact O-N 3.15Å; H456-E460 WeakPolarHBondContact O-CB 3.32Å; H456-E460 PolarHBondContact O-N 3.45Å
457	W	93.7	Very high	92	Very high	56 Å²	56	58.4 Å²	58.4	21%	0.212	28%	0.277	C	S	.	.	H	α-helix	trans	-66.9	-44.7	176.1	177.5	93.9	0	0	0	110.8	E417 V445 K448 T453 D454 Y455 C459 E460 Q461	E417-W457 HydrophobicContact CG-CZ2 3.98Å; V445-W457 HydrophobicContact CG2-CH2 4.33Å; V445-W457 HydrophobicContact CG2-CZ3 4.47Å; K448-W457 HydrophobicContact CB-CE3 4.4Å; K448-W457 HydrophobicContact CB-CH2 4.01Å; K448-W457 HydrophobicContact CB-CZ3 3.49Å; K448-W457 VanDerWaalsContact CB-CZ3 3.49Å; K448-W457 HydrophobicContact CD-CH2 4.01Å; K448-W457 HydrophobicContact CD-CZ3 4.12Å; K448-W457 HydrophobicContact CG-CH2 3.67Å; K448-W457 HydrophobicContact CG-CZ3 3.71Å; T453-W457 HydrophobicContact CG2-CD2 4.17Å; T453-W457 HydrophobicContact CG2-CE3 3.69Å; T453-W457 HydrophobicContact CG2-CZ3 4.33Å; D454-W457 HydrophobicContact CB-CB 4.44Å; D454-W457 PolarHBondContact O-N 2.83Å; Y455-W457 PolarHBondContact O-N 3.03Å; W457-C459 PolarHBondContact O-N 3.46Å; W457-E460 PolarHBondContact O-N 3.42Å; W457-Q461 HydrophobicContact CD2-CG 3.97Å; W457-Q461 HydrophobicContact CE3-CG 4.12Å; W457-Q461 HydrophobicContact CH2-CG 3.71Å; W457-Q461 HydrophobicContact CZ2-CG 3.57Å; W457-Q461 HydrophobicContact CZ3-CG 3.98Å; W457-Q461 WeakPolarHBondContact O-CG 3.24Å; W457-Q461 PolarHBondContact O-N 3.42Å
458	V	94.5	Very high	92	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-60.8	-46	179.1	172.8	0	0	0	0	111	V445 W449 T453 D454 Y455 E460 Q461 F462 V489	V445-V458 HydrophobicContact CG1-CG1 3.93Å; W449-V458 HydrophobicContact CB-CG1 4.32Å; W449-V458 HydrophobicContact CB-CG2 4.45Å; W449-V458 HydrophobicContact CE3-CB 4.39Å; W449-V458 HydrophobicContact CE3-CG1 4.25Å; W449-V458 HydrophobicContact CE3-CG2 4.09Å; T453-V458 HydrophobicContact CG2-CG2 4.41Å; D454-V458 PolarHBondContact O-N 2.75Å; D454-V458 VanDerWaalsContact O-N 3.13Å; Y455-V458 PolarHBondContact O-N 3.42Å; V458-E460 PolarHBondContact O-N 3.04Å; V458-Q461 PolarHBondContact O-N 3.08Å; V458-F462 HydrophobicContact CG1-CD2 3.73Å; V458-F462 HydrophobicContact CG1-CE2 3.55Å; V458-F462 WeakPolarHBondContact O-CD2 3.48Å; V458-F462 PolarHBondContact O-N 3.26Å; V458-V489 HydrophobicContact CG1-CG1 3.86Å
459	C	94.1	Very high	92	Very high	6 Å²	6	49.3 Å²	49.3	4%	0.041	24%	0.235	C	C	.	.	H	α-helix	trans	-61.8	-39.8	175.5	-174.5	0	0	0	0	112.2	Y455 W457 F462 K463	Y455-C459 HydrophobicContact CE1-CB 4.29Å; Y455-C459 HydrophobicContact CE2-CB 4.16Å; Y455-C459 VanDerWaalsContact O-CB 3.24Å; Y455-C459 WeakPolarHBondContact O-CB 3.46Å; Y455-C459 PolarHBondContact O-N 2.93Å; W457-C459 PolarHBondContact O-N 3.46Å; C459-F462 PolarHBondContact O-N 3.04Å; C459-K463 WeakPolarHBondContact O-CB 3.4Å; C459-K463 WeakPolarHBondContact O-CD 3.47Å; C459-K463 VanDerWaalsContact O-CG 3.24Å; C459-K463 WeakPolarHBondContact O-CG 3.17Å; C459-K463 PolarHBondContact O-N 3.45Å; C459-K463 VanDerWaalsContact SG-CE 3.52Å; C459-K463 PolarHBondContact SG-NZ 3.4Å
460	E	94	Very high	91.9	Very high	64 Å²	64	51.4 Å²	51.4	30%	0.299	25%	0.254	S	S	.	.	H	α-helix	trans	-65.1	-42.3	175.7	-162.3	-171.1	157.1	0	0	112.1	Q419 Y420 H456 W457 V458 K463 S464	Q419-E460 WeakPolarHBondContact CA-OE1 3.23Å; Q419-E460 VanDerWaalsContact CB-OE1 3.28Å; Q419-E460 WeakPolarHBondContact CB-OE1 3.47Å; Q419-E460 WeakPolarHBondContact CG-OE1 3.41Å; Y420-E460 PolarHBondContact N-OE1 3.16Å; H456-E460 WeakPolarHBondContact O-CB 3.32Å; H456-E460 PolarHBondContact O-N 3.45Å; W457-E460 PolarHBondContact O-N 3.42Å; V458-E460 PolarHBondContact O-N 3.04Å; E460-K463 WeakPolarHBondContact O-CA 3.48Å; E460-K463 WeakPolarHBondContact O-CB 3.46Å; E460-K463 PolarHBondContact O-N 3.31Å; E460-K463 VanDerWaalsContact O-N 3.13Å; E460-S464 PolarHBondContact O-N 3.03Å
461	Q	95.7	Very high	91.9	Very high	7 Å²	7	45 Å²	45	3%	0.033	23%	0.234	C	C	.	.	H	α-helix	trans	-64.5	-42.5	175.7	-64.7	-53.4	-48.7	0	0	112.1	K418 V445 W457 V458 K463 S464 I465	K418-Q461 PolarHBondContact O-NE2 2.96Å; K418-Q461 VanDerWaalsContact O-NE2 3.15Å; K418-Q461 PolarHBondContact O-OE1 3.4Å; K418-Q461 VanDerWaalsContact O-OE1 3.11Å; V445-Q461 HydrophobicContact CG1-CB 4.26Å; V445-Q461 HydrophobicContact CG2-CB 3.45Å; V445-Q461 VanDerWaalsContact CG2-CB 3.45Å; V445-Q461 HydrophobicContact CG2-CG 4.03Å; W457-Q461 HydrophobicContact CD2-CG 3.97Å; W457-Q461 HydrophobicContact CE3-CG 4.12Å; W457-Q461 HydrophobicContact CH2-CG 3.71Å; W457-Q461 HydrophobicContact CZ2-CG 3.57Å; W457-Q461 HydrophobicContact CZ3-CG 3.98Å; W457-Q461 WeakPolarHBondContact O-CG 3.24Å; W457-Q461 PolarHBondContact O-N 3.42Å; V458-Q461 PolarHBondContact O-N 3.08Å; Q461-K463 VanDerWaalsContact C-N 3.27Å; Q461-K463 PolarHBondContact O-N 2.83Å; Q461-S464 PolarHBondContact O-N 2.95Å; Q461-S464 PolarHBondContact O-OG 3.13Å; Q461-I465 VanDerWaalsContact O-CG1 3.28Å; Q461-I465 WeakPolarHBondContact O-CG1 3.46Å; Q461-I465 PolarHBondContact O-N 3.47Å
462	F	96	Very high	91.9	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-63.5	-32.1	172.1	-79.4	-66	0	0	0	112.6	L442 V445 V458 C459 R466 A485 H486 V489	L442-F462 HydrophobicContact CD1-CE1 3.73Å; V445-F462 HydrophobicContact CG1-CD1 4.46Å; V445-F462 HydrophobicContact CG1-CD2 3.74Å; V445-F462 HydrophobicContact CG1-CE1 4.23Å; V445-F462 HydrophobicContact CG1-CE2 3.47Å; V445-F462 VanDerWaalsContact CG1-CE2 3.47Å; V445-F462 HydrophobicContact CG1-CG 4.24Å; V445-F462 HydrophobicContact CG1-CZ 3.75Å; V458-F462 HydrophobicContact CG1-CD2 3.73Å; V458-F462 HydrophobicContact CG1-CE2 3.55Å; V458-F462 WeakPolarHBondContact O-CD2 3.48Å; V458-F462 PolarHBondContact O-N 3.26Å; C459-F462 PolarHBondContact O-N 3.04Å; F462-R466 WeakPolarHBondContact O-CB 3.34Å; F462-R466 VanDerWaalsContact O-CG 3.22Å; F462-R466 WeakPolarHBondContact O-CG 2.93Å; F462-R466 PolarHBondContact O-N 3.18Å; F462-R466 PolarHBondContact O-NE 3.27Å; F462-A485 HydrophobicContact CE1-CB 3.98Å; F462-A485 HydrophobicContact CZ-CB 4.2Å; F462-H486 HydrophobicContact CB-CB 3.91Å; F462-H486 WeakPolarHBondContact CB-CD2 3.26Å; F462-H486 VanDerWaalsContact CB-CG 3.46Å; F462-H486 HydrophobicContact CD1-CB 3.68Å; F462-H486 HydrophobicContact CD2-CB 4.21Å; F462-H486 AromaticContact CD2-CD2 3.32Å; F462-H486 WeakPolarHBondContact CD2-CD2 3.46Å; F462-H486 HydrophobicContact CE1-CB 4.16Å; F462-H486 HydrophobicContact CG-CB 3.7Å; F462-H486 AromaticContact CG-CD2 3.37Å; F462-H486 WeakPolarHBondContact CG-CD2 3.22Å; F462-H486 AromaticContact CG-CG 3.67Å; F462-V489 HydrophobicContact CE2-CB 4.19Å; F462-V489 HydrophobicContact CE2-CG1 4.3Å; F462-V489 HydrophobicContact CE2-CG2 3.94Å; F462-V489 HydrophobicContact CZ-CG2 4.25Å
463	K	94.7	Very high	92.2	Very high	51 Å²	51	36.8 Å²	36.8	22%	0.222	20%	0.195	C	C	.	.	H	α-helix	trans	-65.3	-43.7	171.9	-77.7	164.2	173.8	164.8	0	111.8	Y420 C459 E460 Q461 Q467 E498	Y420-K463 HydrophobicContact CD1-CB 4.38Å; Y420-K463 HydrophobicContact CD2-CB 3.63Å; Y420-K463 WeakPolarHBondContact CD2-O 3.28Å; Y420-K463 HydrophobicContact CE2-CB 4.17Å; Y420-K463 HydrophobicContact CG-CB 3.73Å; C459-K463 WeakPolarHBondContact O-CB 3.4Å; C459-K463 WeakPolarHBondContact O-CD 3.47Å; C459-K463 VanDerWaalsContact O-CG 3.24Å; C459-K463 WeakPolarHBondContact O-CG 3.17Å; C459-K463 PolarHBondContact O-N 3.45Å; C459-K463 VanDerWaalsContact SG-CE 3.52Å; C459-K463 PolarHBondContact SG-NZ 3.4Å; E460-K463 WeakPolarHBondContact O-CA 3.48Å; E460-K463 WeakPolarHBondContact O-CB 3.46Å; E460-K463 PolarHBondContact O-N 3.31Å; E460-K463 VanDerWaalsContact O-N 3.13Å; Q461-K463 VanDerWaalsContact C-N 3.27Å; Q461-K463 PolarHBondContact O-N 2.83Å; K463-Q467 WeakPolarHBondContact O-CB 3.35Å; K463-Q467 PolarHBondContact O-N 3.35Å; K463-E498 WeakPolarHBondContact CE-OE1 3.42Å; K463-E498 WeakPolarHBondContact CE-OE2 3.33Å; K463-E498 IonicContact NZ-OE1 2.84Å; K463-E498 PolarHBondContact NZ-OE1 3.23Å; K463-E498 IonicContact NZ-OE2 2.64Å
464	S	94.7	Very high	92.8	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-68	-38.4	176.9	72.3	0	0	0	0	112.5	K418 R433 E460 Q461 Q467 D468	K418-S464 WeakPolarHBondContact O-CB 3.45Å; K418-S464 PolarHBondContact O-OG 2.9Å; R433-S464 PolarHBondContact NH2-O 3.11Å; R433-S464 PolarHBondContact NH2-OG 2.88Å; E460-S464 PolarHBondContact O-N 3.03Å; Q461-S464 PolarHBondContact O-N 2.95Å; Q461-S464 PolarHBondContact O-OG 3.13Å; S464-Q467 WeakPolarHBondContact O-CB 3.38Å; S464-Q467 PolarHBondContact O-N 3.29Å; S464-D468 PolarHBondContact O-N 3.39Å
465	I	95.4	Very high	92.6	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-65.8	-46.4	175.9	-62.6	167.4	0	0	0	110.8	R433 L438 V445 Q461 Q467 D468 L469 V482	R433-I465 VanDerWaalsContact NH2-N 3.18Å; L438-I465 HydrophobicContact CD2-CB 4.42Å; L438-I465 HydrophobicContact CD2-CG1 4.43Å; L438-I465 HydrophobicContact CD2-CG2 4.01Å; V445-I465 HydrophobicContact CG2-CD1 4.18Å; Q461-I465 VanDerWaalsContact O-CG1 3.28Å; Q461-I465 WeakPolarHBondContact O-CG1 3.46Å; Q461-I465 PolarHBondContact O-N 3.47Å; I465-Q467 VanDerWaalsContact C-N 3.28Å; I465-Q467 PolarHBondContact O-N 3.3Å; I465-D468 PolarHBondContact O-N 3.3Å; I465-L469 WeakPolarHBondContact O-CG 3.49Å; I465-L469 PolarHBondContact O-N 3.33Å; I465-L469 VanDerWaalsContact O-N 3.07Å; I465-V482 HydrophobicContact CB-CG1 4.36Å; I465-V482 HydrophobicContact CG2-CB 4.44Å; I465-V482 HydrophobicContact CG2-CG1 3.63Å; I465-V482 HydrophobicContact CG2-CG2 3.89Å
466	R	94.8	Very high	92.5	Very high	23 Å²	23	35.2 Å²	35.2	9%	0.087	19%	0.185	C	C	.	.	H	α-helix	trans	-60.2	-37.3	175.6	-73.4	-177.3	-61.8	162.3	2.4	112.1	F462 T470 V482 Y483 H486 E498 C502	F462-R466 WeakPolarHBondContact O-CB 3.34Å; F462-R466 VanDerWaalsContact O-CG 3.22Å; F462-R466 WeakPolarHBondContact O-CG 2.93Å; F462-R466 PolarHBondContact O-N 3.18Å; F462-R466 PolarHBondContact O-NE 3.27Å; R466-T470 WeakPolarHBondContact O-CB 3.36Å; R466-T470 PolarHBondContact O-N 3.3Å; R466-T470 PolarHBondContact O-OG1 2.84Å; R466-V482 HydrophobicContact CG-CG1 3.98Å; R466-Y483 HydrophobicContact CB-CE1 4.28Å; R466-Y483 HydrophobicContact CG-CD1 4.09Å; R466-Y483 HydrophobicContact CG-CE1 3.73Å; R466-H486 PolarHBondContact NE-ND1 3.24Å; R466-H486 PolarHBondContact NH2-CE1 3.47Å; R466-H486 PolarHBondContact NH2-ND1 3.09Å; R466-E498 IonicContact CZ-OE2 2.81Å; R466-E498 IonicContact NH1-OE2 3.21Å; R466-E498 IonicContact NH2-OE2 3.42Å; R466-E498 PolarHBondContact NH2-OE2 3.25Å; R466-C502 PolarHBondContact NH1-SG 2.73Å
467	Q	93.3	Very high	92.4	Very high	16 Å²	16	32.5 Å²	32.5	8%	0.075	18%	0.176	C	C	.	.	H	α-helix	trans	-64.4	-48	174.5	166.1	168.9	85.6	0	0	112.3	Y420 L421 K463 S464 I465 L469 T470 V471	Y420-Q467 HydrophobicContact CD2-CB 4.25Å; Y420-Q467 HydrophobicContact CE2-CB 4.02Å; L421-Q467 PolarHBondContact O-NE2 3.2Å; L421-Q467 PolarHBondContact O-OE1 3.26Å; K463-Q467 WeakPolarHBondContact O-CB 3.35Å; K463-Q467 PolarHBondContact O-N 3.35Å; S464-Q467 WeakPolarHBondContact O-CB 3.38Å; S464-Q467 PolarHBondContact O-N 3.29Å; I465-Q467 VanDerWaalsContact C-N 3.28Å; I465-Q467 PolarHBondContact O-N 3.3Å; Q467-L469 VanDerWaalsContact C-N 3.29Å; Q467-L469 PolarHBondContact O-N 2.93Å; Q467-T470 PolarHBondContact O-N 3.09Å; Q467-T470 VanDerWaalsContact O-N 3.11Å; Q467-V471 HydrophobicContact CG-CG2 4.4Å; Q467-V471 WeakPolarHBondContact O-CG2 3.5Å; Q467-V471 PolarHBondContact O-N 2.87Å
468	D	93.5	Very high	92.4	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-62.7	-36.3	-179.6	-65.9	-25.4	0	0	0	111.8	K418 V432 R433 L438 S464 I465 Q472	K418-D468 IonicContact NZ-OD1 2.67Å; K418-D468 PolarHBondContact NZ-OD1 3.31Å; K418-D468 IonicContact NZ-OD2 3.45Å; V432-D468 HydrophobicContact CG1-CB 4.14Å; R433-D468 IonicContact CZ-OD2 3.23Å; R433-D468 VanDerWaalsContact CZ-OD2 3.23Å; R433-D468 IonicContact NE-OD2 2.78Å; R433-D468 PolarHBondContact NE-OD2 2.85Å; R433-D468 IonicContact NH2-OD2 2.77Å; R433-D468 PolarHBondContact NH2-OD2 3.49Å; L438-D468 HydrophobicContact CD1-CB 4.16Å; L438-D468 HydrophobicContact CD2-CB 3.68Å; L438-D468 HydrophobicContact CG-CB 4.5Å; S464-D468 PolarHBondContact O-N 3.39Å; I465-D468 PolarHBondContact O-N 3.3Å; D468-Q472 WeakPolarHBondContact O-CB 3.35Å; D468-Q472 VanDerWaalsContact O-CG 3.24Å; D468-Q472 WeakPolarHBondContact O-CG 3.32Å; D468-Q472 PolarHBondContact O-N 2.88Å; D468-Q472 PolarHBondContact O-NE2 3.41Å
469	L	92.6	Very high	92.3	Very high	2 Å²	2	31.2 Å²	31.2	1%	0.01	17%	0.173	C	C	.	.	H	α-helix	trans	-63.1	-47	170.5	-71.4	170.3	0	0	0	112.1	L438 I465 Q467 V471 Q472 G473 I474 F478 A479 V482	L438-L469 HydrophobicContact CD1-CD2 4Å; L438-L469 HydrophobicContact CD1-CG 4.29Å; I465-L469 WeakPolarHBondContact O-CG 3.49Å; I465-L469 PolarHBondContact O-N 3.33Å; I465-L469 VanDerWaalsContact O-N 3.07Å; Q467-L469 VanDerWaalsContact C-N 3.29Å; Q467-L469 PolarHBondContact O-N 2.93Å; L469-V471 VanDerWaalsContact C-N 3.35Å; L469-V471 PolarHBondContact O-N 3.15Å; L469-Q472 PolarHBondContact O-N 2.82Å; L469-G473 PolarHBondContact O-N 3.35Å; L469-I474 HydrophobicContact CD2-CB 3.81Å; L469-I474 HydrophobicContact CD2-CD1 4.39Å; L469-I474 HydrophobicContact CD2-CG2 3.72Å; L469-I474 PolarHBondContact O-N 3.39Å; L469-F478 HydrophobicContact CD2-CD1 3.99Å; L469-F478 HydrophobicContact CD2-CE1 4Å; L469-A479 HydrophobicContact CD1-CB 4.04Å; L469-A479 HydrophobicContact CD2-CB 4.36Å; L469-V482 HydrophobicContact CD1-CB 3.92Å; L469-V482 HydrophobicContact CD1-CG1 4.01Å; L469-V482 HydrophobicContact CD1-CG2 3.97Å
470	T	91	Very high	92.2	Very high	97 Å²	97	31.1 Å²	31.1	60%	0.595	17%	0.172	S	C	*	.	H	α-helix	trans	-63.4	-39.8	-179	-53.9	0	0	0	0	111.8	R466 Q467 G473	R466-T470 WeakPolarHBondContact O-CB 3.36Å; R466-T470 PolarHBondContact O-N 3.3Å; R466-T470 PolarHBondContact O-OG1 2.84Å; Q467-T470 PolarHBondContact O-N 3.09Å; Q467-T470 VanDerWaalsContact O-N 3.11Å; T470-G473 PolarHBondContact O-N 3.48Å
471	V	89.8	Confident	92.2	Very high	34 Å²	34	30 Å²	30	21%	0.206	17%	0.171	C	C	.	.	H	α-helix	trans	-67.6	-38.8	178	165.7	0	0	0	0	112	L423 P427 V432 Q467 L469 G473	L423-V471 HydrophobicContact CD1-CG2 3.86Å; P427-V471 HydrophobicContact CB-CG1 3.81Å; P427-V471 HydrophobicContact CB-CG2 4.33Å; P427-V471 HydrophobicContact CG-CB 4.47Å; P427-V471 HydrophobicContact CG-CG1 3.45Å; P427-V471 VanDerWaalsContact CG-CG1 3.45Å; P427-V471 HydrophobicContact CG-CG2 4.18Å; V432-V471 HydrophobicContact CG1-CG1 4.36Å; V432-V471 HydrophobicContact CG2-CG1 3.87Å; Q467-V471 HydrophobicContact CG-CG2 4.4Å; Q467-V471 WeakPolarHBondContact O-CG2 3.5Å; Q467-V471 PolarHBondContact O-N 2.87Å; L469-V471 VanDerWaalsContact C-N 3.35Å; L469-V471 PolarHBondContact O-N 3.15Å; V471-G473 VanDerWaalsContact C-N 3.28Å
472	Q	89.7	Confident	92.2	Very high	6 Å²	6	29.7 Å²	29.7	3%	0.028	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-1.3	178.6	-62.1	174.8	100.8	0	0	112.8	Q408 I409 V432 R433 D468 L469 I474	Q408-Q472 WeakPolarHBondContact CG-O 3.18Å; Q408-Q472 PolarHBondContact NE2-O 3.28Å; I409-Q472 VanDerWaalsContact O-CG 3.3Å; I409-Q472 WeakPolarHBondContact O-CG 3.42Å; V432-Q472 HydrophobicContact CG1-CG 3.65Å; R433-Q472 PolarHBondContact O-NE2 3.25Å; R433-Q472 PolarHBondContact O-OE1 2.95Å; D468-Q472 WeakPolarHBondContact O-CB 3.35Å; D468-Q472 VanDerWaalsContact O-CG 3.24Å; D468-Q472 WeakPolarHBondContact O-CG 3.32Å; D468-Q472 PolarHBondContact O-N 2.88Å; D468-Q472 PolarHBondContact O-NE2 3.41Å; L469-Q472 PolarHBondContact O-N 2.82Å; Q472-I474 HydrophobicContact CB-CD1 3.65Å; Q472-I474 HydrophobicContact CB-CG1 3.73Å; Q472-I474 HydrophobicContact CG-CD1 4.4Å; Q472-I474 PolarHBondContact O-N 3.35Å
473	G	87.9	Confident	92.1	Very high	47 Å²	47	30.6 Å²	30.6	49%	0.485	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.8	28.4	-175.7	0	0	0	0	0	113.9	L469 T470 V471 E475	L469-G473 PolarHBondContact O-N 3.35Å; T470-G473 PolarHBondContact O-N 3.48Å; V471-G473 VanDerWaalsContact C-N 3.28Å; G473-E475 PolarHBondContact O-N 2.79Å
474	I	88.5	Confident	92	Very high	17 Å²	17	29.1 Å²	29.1	9%	0.087	17%	0.167	C	C	.	.			trans	-84.4	108.4	-177.4	-62.9	169.7	0	0	0	108.8	L435 L469 Q472 D476 A479	L435-I474 HydrophobicContact CB-CD1 4.4Å; L469-I474 HydrophobicContact CD2-CB 3.81Å; L469-I474 HydrophobicContact CD2-CD1 4.39Å; L469-I474 HydrophobicContact CD2-CG2 3.72Å; L469-I474 PolarHBondContact O-N 3.39Å; Q472-I474 HydrophobicContact CB-CD1 3.65Å; Q472-I474 HydrophobicContact CB-CG1 3.73Å; Q472-I474 HydrophobicContact CG-CD1 4.4Å; Q472-I474 PolarHBondContact O-N 3.35Å; I474-D476 HydrophobicContact CG2-CB 4.45Å; I474-A479 WeakPolarHBondContact O-CB 3.38Å
475	E	87.2	Confident	91.9	Very high	71 Å²	71	29.9 Å²	29.9	33%	0.332	17%	0.173	S	C	.	.			trans	-122.2	42.9	-177.5	-59.2	-167.9	131.6	0	0	111	G473 R508 L509 L514	G473-E475 PolarHBondContact O-N 2.79Å; E475-R508 IonicContact OE1-CZ 3.91Å; E475-R508 VanDerWaalsContact OE1-CZ 3.27Å; E475-R508 IonicContact OE1-NH1 2.83Å; E475-R508 PolarHBondContact OE1-NH1 3.48Å; E475-R508 IonicContact OE1-NH2 3.23Å; E475-R508 PolarHBondContact OE1-NH2 3.35Å; E475-R508 IonicContact OE2-CZ 4Å; E475-R508 IonicContact OE2-NH1 2.75Å; E475-R508 PolarHBondContact OE2-NH1 3.39Å; E475-R508 IonicContact OE2-NH2 3.2Å; E475-R508 PolarHBondContact OE2-NH2 3.45Å; E475-L509 HydrophobicContact CB-CD2 3.89Å; E475-L509 HydrophobicContact CG-CD2 4.35Å; E475-L514 WeakPolarHBondContact O-CD1 3.1Å
476	D	88.4	Confident	91.9	Very high	85 Å²	85	29.9 Å²	29.9	46%	0.455	17%	0.173	S	C	.	.	S	Bend	trans	-84.9	174.9	176.6	-59.4	-36.9	0	0	0	113.1	I474 F478 A479 V480	I474-D476 HydrophobicContact CG2-CB 4.45Å; D476-F478 PolarHBondContact O-N 2.65Å; D476-F478 VanDerWaalsContact O-N 3.11Å; D476-A479 WeakPolarHBondContact O-CA 3.46Å; D476-A479 VanDerWaalsContact O-CB 3.31Å; D476-A479 WeakPolarHBondContact O-CB 3.49Å; D476-A479 PolarHBondContact O-N 3.45Å; D476-V480 PolarHBondContact O-N 2.81Å
477	D	90.9	Very high	91.8	Very high	100 Å²	100	28.8 Å²	28.8	54%	0.535	17%	0.169	S	C	.	.	H	α-helix	trans	-53.3	-27.9	165.3	-79.7	-40.9	0	0	0	113.1	V480 S481 G515	D477-V480 WeakPolarHBondContact O-CB 3.37Å; D477-V480 PolarHBondContact O-N 2.87Å; D477-S481 PolarHBondContact O-N 2.91Å; D477-G515 PolarHBondContact OD1-N 2.68Å
478	F	92.8	Very high	91.6	Very high	28 Å²	28	29.3 Å²	29.3	12%	0.123	17%	0.173	C	C	.	.	H	α-helix	trans	-64.3	-41.8	171.3	176.3	-107.4	0	0	0	111.8	L435 L438 K439 L442 L469 D476 V480 S481 V482	L435-F478 HydrophobicContact CD1-CB 4.43Å; L435-F478 HydrophobicContact CD1-CD1 3.3Å; L435-F478 HydrophobicContact CD1-CE1 3.75Å; L435-F478 HydrophobicContact CD1-CG 3.98Å; L438-F478 HydrophobicContact CB-CE1 3.85Å; L438-F478 HydrophobicContact CB-CZ 4.06Å; K439-F478 HydrophobicContact CB-CE2 4.28Å; K439-F478 HydrophobicContact CB-CZ 4.45Å; K439-F478 HydrophobicContact CG-CD2 3.81Å; K439-F478 HydrophobicContact CG-CE1 4.36Å; K439-F478 HydrophobicContact CG-CE2 3.45Å; K439-F478 VanDerWaalsContact CG-CE2 3.45Å; K439-F478 HydrophobicContact CG-CG 4.41Å; K439-F478 HydrophobicContact CG-CZ 3.76Å; L442-F478 HydrophobicContact CB-CE2 4.43Å; L442-F478 HydrophobicContact CB-CZ 4.43Å; L442-F478 HydrophobicContact CD2-CD2 4.5Å; L442-F478 HydrophobicContact CD2-CE2 3.66Å; L442-F478 HydrophobicContact CD2-CZ 4.27Å; L469-F478 HydrophobicContact CD2-CD1 3.99Å; L469-F478 HydrophobicContact CD2-CE1 4Å; D476-F478 PolarHBondContact O-N 2.65Å; D476-F478 VanDerWaalsContact O-N 3.11Å; F478-V480 VanDerWaalsContact C-N 3.34Å; F478-V480 PolarHBondContact O-N 3.19Å; F478-S481 PolarHBondContact O-N 3.49Å; F478-S481 PolarHBondContact O-OG 3.13Å; F478-V482 HydrophobicContact CE1-CG2 3.95Å; F478-V482 HydrophobicContact CE2-CG2 4.08Å; F478-V482 HydrophobicContact CZ-CG2 3.69Å; F478-V482 PolarHBondContact O-N 3Å; F478-V482 VanDerWaalsContact O-N 3.12Å
479	A	93.2	Very high	91.5	Very high	2 Å²	2	29.7 Å²	29.7	2%	0.017	18%	0.175	C	C	.	.	H	α-helix	trans	-62.1	-44.5	176.3	0	0	0	0	0	110.5	L469 I474 D476 S481 V482 Y483	L469-A479 HydrophobicContact CD1-CB 4.04Å; L469-A479 HydrophobicContact CD2-CB 4.36Å; I474-A479 WeakPolarHBondContact O-CB 3.38Å; D476-A479 WeakPolarHBondContact O-CA 3.46Å; D476-A479 VanDerWaalsContact O-CB 3.31Å; D476-A479 WeakPolarHBondContact O-CB 3.49Å; D476-A479 PolarHBondContact O-N 3.45Å; A479-S481 VanDerWaalsContact C-N 3.34Å; A479-S481 PolarHBondContact O-N 3.13Å; A479-V482 PolarHBondContact O-N 2.96Å; A479-V482 VanDerWaalsContact O-N 3.15Å; A479-Y483 WeakPolarHBondContact O-CD2 3.4Å; A479-Y483 PolarHBondContact O-N 2.85Å; A479-Y483 VanDerWaalsContact O-N 3.1Å
480	V	93	Very high	91.4	Very high	4 Å²	4	29.6 Å²	29.6	2%	0.024	18%	0.175	C	C	.	.	H	α-helix	trans	-51.1	-54	171	176	0	0	0	0	110.5	D476 D477 F478 V482 Y483 E484 L506 L509 L514	D476-V480 PolarHBondContact O-N 2.81Å; D477-V480 WeakPolarHBondContact O-CB 3.37Å; D477-V480 PolarHBondContact O-N 2.87Å; F478-V480 VanDerWaalsContact C-N 3.34Å; F478-V480 PolarHBondContact O-N 3.19Å; V480-V482 PolarHBondContact O-N 3.05Å; V480-V482 VanDerWaalsContact O-N 3.13Å; V480-Y483 PolarHBondContact O-N 2.73Å; V480-E484 HydrophobicContact CG1-CG 3.9Å; V480-E484 WeakPolarHBondContact O-CG 3.47Å; V480-E484 PolarHBondContact O-N 3.21Å; V480-L506 HydrophobicContact CG1-CD2 3.95Å; V480-L509 HydrophobicContact CG2-CB 3.8Å; V480-L509 HydrophobicContact CG2-CD1 3.78Å; V480-L509 HydrophobicContact CG2-CG 4.33Å; V480-L514 HydrophobicContact CG2-CB 3.78Å
481	S	93	Very high	91.2	Very high	41 Å²	41	25.8 Å²	25.8	29%	0.287	15%	0.151	S	C	.	.	H	α-helix	trans	-57.6	-30.4	-178.1	78.8	0	0	0	0	114.1	D477 F478 A479 A485	D477-S481 PolarHBondContact O-N 2.91Å; F478-S481 PolarHBondContact O-N 3.49Å; F478-S481 PolarHBondContact O-OG 3.13Å; A479-S481 VanDerWaalsContact C-N 3.34Å; A479-S481 PolarHBondContact O-N 3.13Å; S481-A485 VanDerWaalsContact O-CB 3.24Å; S481-A485 WeakPolarHBondContact O-CB 3.37Å; S481-A485 PolarHBondContact O-N 2.67Å
482	V	95.1	Very high	91	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-71.9	-46.8	173.5	170.9	0	0	0	0	111.4	L442 I465 R466 L469 F478 A479 V480 E484 A485 H486	L442-V482 HydrophobicContact CD1-CG2 4.16Å; L442-V482 HydrophobicContact CD2-CG2 3.88Å; L442-V482 HydrophobicContact CG-CG2 4.44Å; I465-V482 HydrophobicContact CB-CG1 4.36Å; I465-V482 HydrophobicContact CG2-CB 4.44Å; I465-V482 HydrophobicContact CG2-CG1 3.63Å; I465-V482 HydrophobicContact CG2-CG2 3.89Å; R466-V482 HydrophobicContact CG-CG1 3.98Å; L469-V482 HydrophobicContact CD1-CB 3.92Å; L469-V482 HydrophobicContact CD1-CG1 4.01Å; L469-V482 HydrophobicContact CD1-CG2 3.97Å; F478-V482 HydrophobicContact CE1-CG2 3.95Å; F478-V482 HydrophobicContact CE2-CG2 4.08Å; F478-V482 HydrophobicContact CZ-CG2 3.69Å; F478-V482 PolarHBondContact O-N 3Å; F478-V482 VanDerWaalsContact O-N 3.12Å; A479-V482 PolarHBondContact O-N 2.96Å; A479-V482 VanDerWaalsContact O-N 3.15Å; V480-V482 PolarHBondContact O-N 3.05Å; V480-V482 VanDerWaalsContact O-N 3.13Å; V482-E484 VanDerWaalsContact C-N 3.35Å; V482-A485 PolarHBondContact O-N 3.2Å; V482-H486 PolarHBondContact O-N 2.79Å
483	Y	94.6	Very high	90.8	Very high	18 Å²	18	29.8 Å²	29.8	7%	0.071	17%	0.174	C	C	.	.	H	α-helix	trans	-65.7	-38.1	178.1	-76.8	-78	0	0	0	112.1	R466 A479 V480 A487 Q505 L509	R466-Y483 HydrophobicContact CB-CE1 4.28Å; R466-Y483 HydrophobicContact CG-CD1 4.09Å; R466-Y483 HydrophobicContact CG-CE1 3.73Å; A479-Y483 WeakPolarHBondContact O-CD2 3.4Å; A479-Y483 PolarHBondContact O-N 2.85Å; A479-Y483 VanDerWaalsContact O-N 3.1Å; V480-Y483 PolarHBondContact O-N 2.73Å; Y483-A487 VanDerWaalsContact O-CB 3.25Å; Y483-A487 WeakPolarHBondContact O-CB 3.49Å; Y483-A487 PolarHBondContact O-N 3.2Å; Y483-Q505 HydrophobicContact CD1-CB 4.03Å; Y483-Q505 HydrophobicContact CD1-CG 4.12Å; Y483-Q505 HydrophobicContact CD2-CG 4.14Å; Y483-Q505 HydrophobicContact CE1-CB 3.77Å; Y483-Q505 HydrophobicContact CE1-CG 3.65Å; Y483-Q505 HydrophobicContact CE2-CG 3.74Å; Y483-Q505 HydrophobicContact CG-CG 4.37Å; Y483-Q505 VanDerWaalsContact CZ-CG 3.5Å; Y483-L509 HydrophobicContact CD2-CD1 3.89Å; Y483-L509 HydrophobicContact CE2-CD1 4.34Å
484	E	92.7	Very high	90.6	Very high	20 Å²	20	28.8 Å²	28.8	9%	0.093	16%	0.164	C	C	.	.	H	α-helix	trans	-61.8	-52.4	172.9	-72.2	-169.2	169.1	0	0	112.1	V480 V482 H486 A487 D488 L506 R518 F522	V480-E484 HydrophobicContact CG1-CG 3.9Å; V480-E484 WeakPolarHBondContact O-CG 3.47Å; V480-E484 PolarHBondContact O-N 3.21Å; V482-E484 VanDerWaalsContact C-N 3.35Å; E484-H486 VanDerWaalsContact C-N 3.3Å; E484-H486 PolarHBondContact O-N 3.1Å; E484-A487 WeakPolarHBondContact O-CB 3.28Å; E484-A487 PolarHBondContact O-N 3.05Å; E484-D488 PolarHBondContact O-N 3.16Å; E484-L506 HydrophobicContact CG-CD1 4.44Å; E484-L506 HydrophobicContact CG-CD2 3.93Å; E484-R518 WeakPolarHBondContact OE1-CB 3.4Å; E484-R518 VanDerWaalsContact OE2-CD 3.31Å; E484-R518 WeakPolarHBondContact OE2-CD 3.3Å; E484-R518 IonicContact OE2-CZ 3.55Å; E484-R518 IonicContact OE2-NH1 2.74Å; E484-R518 PolarHBondContact OE2-NH1 3.42Å; E484-F522 HydrophobicContact CB-CE2 4.12Å; E484-F522 HydrophobicContact CB-CZ 4.13Å; E484-F522 HydrophobicContact CG-CD2 4.41Å; E484-F522 HydrophobicContact CG-CE2 3.61Å; E484-F522 HydrophobicContact CG-CZ 4.05Å
485	A	93.2	Very high	90.5	Very high	16 Å²	16	30.1 Å²	30.1	13%	0.132	17%	0.172	C	C	.	.	H	α-helix	trans	-61.1	-39.6	-178.8	0	0	0	0	0	111.8	L442 K446 F462 S481 V482 V489	L442-A485 HydrophobicContact CD1-CB 4.1Å; K446-A485 HydrophobicContact CD-CB 4.47Å; F462-A485 HydrophobicContact CE1-CB 3.98Å; F462-A485 HydrophobicContact CZ-CB 4.2Å; S481-A485 VanDerWaalsContact O-CB 3.24Å; S481-A485 WeakPolarHBondContact O-CB 3.37Å; S481-A485 PolarHBondContact O-N 2.67Å; V482-A485 PolarHBondContact O-N 3.2Å; A485-V489 WeakPolarHBondContact O-CG2 3.39Å; A485-V489 PolarHBondContact O-N 3.08Å; A485-V489 VanDerWaalsContact O-N 3.12Å
486	H	94.6	Very high	90.3	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-68.4	-36.1	174.1	-171.1	-133.2	0	0	0	112.5	F462 R466 V482 E484 V489 A490 E498 C502	F462-H486 HydrophobicContact CB-CB 3.91Å; F462-H486 WeakPolarHBondContact CB-CD2 3.26Å; F462-H486 VanDerWaalsContact CB-CG 3.46Å; F462-H486 HydrophobicContact CD1-CB 3.68Å; F462-H486 HydrophobicContact CD2-CB 4.21Å; F462-H486 AromaticContact CD2-CD2 3.32Å; F462-H486 WeakPolarHBondContact CD2-CD2 3.46Å; F462-H486 HydrophobicContact CE1-CB 4.16Å; F462-H486 HydrophobicContact CG-CB 3.7Å; F462-H486 AromaticContact CG-CD2 3.37Å; F462-H486 WeakPolarHBondContact CG-CD2 3.22Å; F462-H486 AromaticContact CG-CG 3.67Å; R466-H486 PolarHBondContact NE-ND1 3.24Å; R466-H486 PolarHBondContact NH2-CE1 3.47Å; R466-H486 PolarHBondContact NH2-ND1 3.09Å; V482-H486 PolarHBondContact O-N 2.79Å; E484-H486 VanDerWaalsContact C-N 3.3Å; E484-H486 PolarHBondContact O-N 3.1Å; H486-V489 PolarHBondContact O-N 3.04Å; H486-A490 VanDerWaalsContact O-CB 3.29Å; H486-A490 WeakPolarHBondContact O-CB 3.37Å; H486-A490 PolarHBondContact O-N 3.22Å; H486-E498 IonicContact CE1-OE2 3.9Å; H486-E498 PolarHBondContact CE1-OE2 3.45Å; H486-C502 PolarHBondContact ND1-SG 3.2Å
487	A	92.1	Very high	90.2	Very high	0 Å²	0	30 Å²	30	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-67	-39.9	176.6	0	0	0	0	0	112.4	Y483 E484 A490 L491 F499 C502 L506 F522	Y483-A487 VanDerWaalsContact O-CB 3.25Å; Y483-A487 WeakPolarHBondContact O-CB 3.49Å; Y483-A487 PolarHBondContact O-N 3.2Å; E484-A487 WeakPolarHBondContact O-CB 3.28Å; E484-A487 PolarHBondContact O-N 3.05Å; A487-A490 PolarHBondContact O-N 2.85Å; A487-L491 VanDerWaalsContact O-CG 3.31Å; A487-L491 WeakPolarHBondContact O-CG 3.17Å; A487-L491 PolarHBondContact O-N 3.39Å; A487-F499 HydrophobicContact CB-CD2 3.95Å; A487-F499 HydrophobicContact CB-CE2 4.24Å; A487-C502 HydrophobicContact CB-CB 3.78Å; A487-L506 HydrophobicContact CB-CD1 4.48Å; A487-F522 HydrophobicContact CB-CE1 3.63Å; A487-F522 HydrophobicContact CB-CZ 4.06Å
488	D	90.2	Very high	90.1	Very high	28 Å²	28	25.9 Å²	25.9	15%	0.15	15%	0.145	C	C	.	.	H	α-helix	trans	-61.3	-48	173.3	-71.2	-43.2	0	0	0	110.6	E484 A490 L491 E492 R518	E484-D488 PolarHBondContact O-N 3.16Å; D488-A490 PolarHBondContact O-N 3.3Å; D488-L491 WeakPolarHBondContact O-CB 3.24Å; D488-L491 PolarHBondContact O-N 2.88Å; D488-E492 WeakPolarHBondContact O-CG 3.5Å; D488-E492 PolarHBondContact O-N 3.48Å; D488-R518 VanDerWaalsContact CG-NH2 3.32Å; D488-R518 IonicContact OD1-CZ 2.67Å; D488-R518 IonicContact OD1-NH1 3.53Å; D488-R518 IonicContact OD1-NH2 3.69Å; D488-R518 PolarHBondContact OD1-NH2 3.39Å; D488-R518 IonicContact OD2-CZ 2.74Å; D488-R518 VanDerWaalsContact OD2-CZ 3.3Å; D488-R518 IonicContact OD2-NH1 2.8Å; D488-R518 PolarHBondContact OD2-NH1 2.99Å; D488-R518 IonicContact OD2-NH2 3.61Å; D488-R518 PolarHBondContact OD2-NH2 2.87Å
489	V	91.4	Very high	90	Very high	8 Å²	8	24.7 Å²	24.7	5%	0.048	14%	0.14	C	C	.	.	H	α-helix	trans	-63.1	-39.1	177.7	171.8	0	0	0	0	112.2	W449 Y455 V458 F462 A485 H486 E492 A493	W449-V489 HydrophobicContact CD2-CG1 3.88Å; W449-V489 HydrophobicContact CD2-CG2 4.37Å; W449-V489 HydrophobicContact CE3-CG1 4.23Å; W449-V489 HydrophobicContact CG-CG1 4.31Å; W449-V489 HydrophobicContact CG-CG2 3.99Å; W449-V489 HydrophobicContact CH2-CG1 4.41Å; W449-V489 HydrophobicContact CZ2-CG1 4.09Å; W449-V489 HydrophobicContact CZ3-CG1 4.48Å; Y455-V489 HydrophobicContact CD2-CG1 4.21Å; Y455-V489 HydrophobicContact CE2-CG1 4.08Å; V458-V489 HydrophobicContact CG1-CG1 3.86Å; F462-V489 HydrophobicContact CE2-CB 4.19Å; F462-V489 HydrophobicContact CE2-CG1 4.3Å; F462-V489 HydrophobicContact CE2-CG2 3.94Å; F462-V489 HydrophobicContact CZ-CG2 4.25Å; A485-V489 WeakPolarHBondContact O-CG2 3.39Å; A485-V489 PolarHBondContact O-N 3.08Å; A485-V489 VanDerWaalsContact O-N 3.12Å; H486-V489 PolarHBondContact O-N 3.04Å; V489-E492 PolarHBondContact O-N 2.9Å; V489-A493 WeakPolarHBondContact O-CB 3.46Å; V489-A493 PolarHBondContact O-N 3.39Å
490	A	90.2	Very high	89.7	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-64.6	-38.2	174.2	0	0	0	0	0	112.2	H486 A487 D488 A493 G494 D495 E498 F499	H486-A490 VanDerWaalsContact O-CB 3.29Å; H486-A490 WeakPolarHBondContact O-CB 3.37Å; H486-A490 PolarHBondContact O-N 3.22Å; A487-A490 PolarHBondContact O-N 2.85Å; D488-A490 PolarHBondContact O-N 3.3Å; A490-A493 PolarHBondContact O-N 2.99Å; A490-G494 PolarHBondContact O-N 2.91Å; A490-D495 HydrophobicContact CB-CB 4.46Å; A490-D495 PolarHBondContact O-N 3.33Å; A490-E498 HydrophobicContact CB-CB 4.16Å; A490-F499 HydrophobicContact CB-CB 4.14Å
491	L	86.3	Confident	89.6	Confident	17 Å²	17	31 Å²	31	9%	0.089	17%	0.169	C	C	.	.	H	α-helix	trans	-67.6	-33.6	173.4	-73.2	171.2	0	0	0	112.9	A487 D488 F499 Y525	A487-L491 VanDerWaalsContact O-CG 3.31Å; A487-L491 WeakPolarHBondContact O-CG 3.17Å; A487-L491 PolarHBondContact O-N 3.39Å; D488-L491 WeakPolarHBondContact O-CB 3.24Å; D488-L491 PolarHBondContact O-N 2.88Å; L491-F499 HydrophobicContact CD1-CD2 3.85Å; L491-F499 HydrophobicContact CD1-CE2 3.74Å; L491-F499 HydrophobicContact CD2-CB 4.5Å; L491-F499 HydrophobicContact CD2-CD1 4.24Å; L491-F499 HydrophobicContact CD2-CD2 3.78Å; L491-F499 HydrophobicContact CD2-CE2 4.12Å; L491-F499 HydrophobicContact CD2-CG 3.88Å; L491-F499 HydrophobicContact CD2-CZ 4.5Å; L491-F499 HydrophobicContact CG-CD2 3.57Å; L491-F499 HydrophobicContact CG-CE2 3.98Å; L491-F499 HydrophobicContact CG-CG 4.1Å; L491-Y525 HydrophobicContact CD1-CD1 4.02Å; L491-Y525 HydrophobicContact CD1-CD2 4.02Å; L491-Y525 HydrophobicContact CD1-CE1 3.85Å; L491-Y525 HydrophobicContact CD1-CE2 3.86Å; L491-Y525 HydrophobicContact CD1-CG 4.11Å
492	E	86.4	Confident	89.6	Confident	78 Å²	78	29.1 Å²	29.1	36%	0.364	16%	0.156	S	C	.	.	H	α-helix	trans	-73.7	-34.2	175.5	-69.1	-170.5	150.1	0	0	112.8	W449 D488 V489	W449-E492 HydrophobicContact CZ2-CB 3.99Å; W449-E492 PolarHBondContact NE1-OE2 3.38Å; D488-E492 WeakPolarHBondContact O-CG 3.5Å; D488-E492 PolarHBondContact O-N 3.48Å; V489-E492 PolarHBondContact O-N 2.9Å
493	A	85.7	Confident	89.3	Confident	45 Å²	45	29.5 Å²	29.5	37%	0.372	16%	0.157	S	C	.	.	H	α-helix	trans	-81.8	-16.2	174.9	0	0	0	0	0	114.2	W449 Y455 V489 A490	W449-A493 HydrophobicContact CH2-CB 4.27Å; Y455-A493 HydrophobicContact CD1-CB 4.1Å; Y455-A493 HydrophobicContact CD2-CB 3.36Å; Y455-A493 HydrophobicContact CE1-CB 4.16Å; Y455-A493 HydrophobicContact CE2-CB 3.43Å; Y455-A493 VanDerWaalsContact CE2-CB 3.43Å; Y455-A493 HydrophobicContact CG-CB 3.73Å; V489-A493 WeakPolarHBondContact O-CB 3.46Å; V489-A493 PolarHBondContact O-N 3.39Å; A490-A493 PolarHBondContact O-N 2.99Å
494	G	83.2	Confident	89	Confident	26 Å²	26	31.4 Å²	31.4	27%	0.268	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.5	16.1	-176.4	0	0	0	0	0	115	A490 F496	A490-G494 PolarHBondContact O-N 2.91Å; G494-F496 WeakPolarHBondContact O-CD2 3.23Å; G494-F496 WeakPolarHBondContact O-CE2 3.49Å; G494-F496 PolarHBondContact O-N 3.15Å
495	D	86.4	Confident	88.9	Confident	46 Å²	46	32.6 Å²	32.6	25%	0.246	18%	0.179	C	C	.	.			trans	-84.5	88.3	176.5	-167.5	-30	0	0	0	110.8	Y455 A490 E497 E498 F499	Y455-D495 HydrophobicContact CE1-CB 4.16Å; Y455-D495 WeakPolarHBondContact OH-CB 3.45Å; Y455-D495 PolarHBondContact OH-OD2 2.93Å; A490-D495 HydrophobicContact CB-CB 4.46Å; A490-D495 PolarHBondContact O-N 3.33Å; D495-E497 PolarHBondContact O-N 2.95Å; D495-E497 PolarHBondContact OD1-N 3.01Å; D495-E498 HydrophobicContact CB-CB 4.44Å; D495-E498 PolarHBondContact OD1-N 2.7Å; D495-F499 WeakPolarHBondContact O-CB 3.4Å; D495-F499 PolarHBondContact O-N 3Å; D495-F499 VanDerWaalsContact O-N 3.09Å
496	F	83.5	Confident	88.8	Confident	28 Å²	28	31.9 Å²	31.9	12%	0.123	17%	0.173	C	C	.	.	H	α-helix	trans	-68.3	-19.2	179	-55	-64.5	0	0	0	113.8	F288 G494 H500 F586 L590	F288-F496 HydrophobicContact CE1-CD2 4.2Å; F288-F496 AromaticContact CZ-CD2 3.8Å; F288-F496 HydrophobicContact CZ-CD2 3.8Å; F288-F496 HydrophobicContact CZ-CE2 4.11Å; G494-F496 WeakPolarHBondContact O-CD2 3.23Å; G494-F496 WeakPolarHBondContact O-CE2 3.49Å; G494-F496 PolarHBondContact O-N 3.15Å; F496-H500 VanDerWaalsContact O-CB 3.31Å; F496-H500 WeakPolarHBondContact O-CB 3.42Å; F496-H500 PolarHBondContact O-N 3.26Å; F496-F586 HydrophobicContact CE1-CE1 4.14Å; F496-F586 AromaticContact CE1-CZ 3.71Å; F496-F586 HydrophobicContact CE1-CZ 3.71Å; F496-F586 HydrophobicContact CZ-CE1 4.01Å; F496-F586 AromaticContact CZ-CZ 3.61Å; F496-F586 HydrophobicContact CZ-CZ 3.61Å; F496-L590 HydrophobicContact CZ-CD2 4.45Å
497	E	85.8	Confident	88.4	Confident	124 Å²	124	34 Å²	34	58%	0.579	18%	0.184	S	C	*	.	H	α-helix	trans	-81.3	-45.1	-177.8	-170.5	63.4	-148.7	0	0	110.4	D495 F499 H500 Q501	D495-E497 PolarHBondContact O-N 2.95Å; D495-E497 PolarHBondContact OD1-N 3.01Å; E497-F499 VanDerWaalsContact C-N 3.34Å; E497-H500 WeakPolarHBondContact O-CB 3.25Å; E497-H500 PolarHBondContact O-N 2.84Å; E497-Q501 WeakPolarHBondContact O-CG 3.35Å; E497-Q501 PolarHBondContact O-N 3.13Å; E497-Q501 PolarHBondContact O-NE2 3.34Å
498	E	89.3	Confident	88.2	Confident	14 Å²	14	38.3 Å²	38.3	7%	0.065	20%	0.2	C	C	.	.	H	α-helix	trans	-66.4	-36.3	170.4	-71.3	-60.2	145.2	0	0	112	K463 R466 H486 A490 D495 Q501 C502	K463-E498 WeakPolarHBondContact CE-OE1 3.42Å; K463-E498 WeakPolarHBondContact CE-OE2 3.33Å; K463-E498 IonicContact NZ-OE1 2.84Å; K463-E498 PolarHBondContact NZ-OE1 3.23Å; K463-E498 IonicContact NZ-OE2 2.64Å; R466-E498 IonicContact CZ-OE2 2.81Å; R466-E498 IonicContact NH1-OE2 3.21Å; R466-E498 IonicContact NH2-OE2 3.42Å; R466-E498 PolarHBondContact NH2-OE2 3.25Å; H486-E498 IonicContact CE1-OE2 3.9Å; H486-E498 PolarHBondContact CE1-OE2 3.45Å; A490-E498 HydrophobicContact CB-CB 4.16Å; D495-E498 HydrophobicContact CB-CB 4.44Å; D495-E498 PolarHBondContact OD1-N 2.7Å; E498-Q501 PolarHBondContact O-N 2.86Å; E498-Q501 PolarHBondContact OE1-NE2 3.08Å; E498-C502 PolarHBondContact O-N 3.47Å; E498-C502 PolarHBondContact O-SG 2.82Å; E498-C502 VanDerWaalsContact O-SG 3.36Å
499	F	89.4	Confident	88.1	Confident	4 Å²	4	37 Å²	37	2%	0.018	19%	0.193	C	C	.	.	H	α-helix	trans	-59.7	-44.2	169.6	172.7	-101.1	0	0	0	111.8	A487 A490 L491 D495 E497 Q501 C502 Q503 F522 Y525	A487-F499 HydrophobicContact CB-CD2 3.95Å; A487-F499 HydrophobicContact CB-CE2 4.24Å; A490-F499 HydrophobicContact CB-CB 4.14Å; L491-F499 HydrophobicContact CD1-CD2 3.85Å; L491-F499 HydrophobicContact CD1-CE2 3.74Å; L491-F499 HydrophobicContact CD2-CB 4.5Å; L491-F499 HydrophobicContact CD2-CD1 4.24Å; L491-F499 HydrophobicContact CD2-CD2 3.78Å; L491-F499 HydrophobicContact CD2-CE2 4.12Å; L491-F499 HydrophobicContact CD2-CG 3.88Å; L491-F499 HydrophobicContact CD2-CZ 4.5Å; L491-F499 HydrophobicContact CG-CD2 3.57Å; L491-F499 HydrophobicContact CG-CE2 3.98Å; L491-F499 HydrophobicContact CG-CG 4.1Å; D495-F499 WeakPolarHBondContact O-CB 3.4Å; D495-F499 PolarHBondContact O-N 3Å; D495-F499 VanDerWaalsContact O-N 3.09Å; E497-F499 VanDerWaalsContact C-N 3.34Å; F499-Q501 PolarHBondContact O-N 2.86Å; F499-C502 PolarHBondContact O-N 3.38Å; F499-Q503 HydrophobicContact CE1-CB 4.38Å; F499-Q503 HydrophobicContact CZ-CB 4.23Å; F499-Q503 HydrophobicContact CZ-CG 4.32Å; F499-Q503 VanDerWaalsContact O-CB 3.3Å; F499-Q503 WeakPolarHBondContact O-CB 3.28Å; F499-Q503 PolarHBondContact O-N 3.26Å; F499-F522 HydrophobicContact CE2-CD1 4.32Å; F499-F522 HydrophobicContact CE2-CE1 4.16Å; F499-Y525 HydrophobicContact CE2-CD2 4.47Å; F499-Y525 HydrophobicContact CZ-CG 4.34Å
500	H	88.4	Confident	87.8	Confident	58 Å²	58	38 Å²	38	27%	0.269	20%	0.197	S	C	.	.	H	α-helix	trans	-61.9	-43.8	177.7	-165.9	123.3	0	0	0	111.9	F496 E497 Q503 S504 Y529	F496-H500 VanDerWaalsContact O-CB 3.31Å; F496-H500 WeakPolarHBondContact O-CB 3.42Å; F496-H500 PolarHBondContact O-N 3.26Å; E497-H500 WeakPolarHBondContact O-CB 3.25Å; E497-H500 PolarHBondContact O-N 2.84Å; H500-Q503 PolarHBondContact O-N 2.86Å; H500-S504 PolarHBondContact CD2-OG 2.94Å; H500-S504 WeakPolarHBondContact O-CB 3.31Å; H500-S504 PolarHBondContact O-N 3.49Å; H500-S504 PolarHBondContact O-OG 3.3Å; H500-Y529 AromaticContact CE1-CE1 3.62Å; H500-Y529 AromaticContact CE1-CZ 3.65Å; H500-Y529 PolarHBondContact CE1-OH 3.25Å; H500-Y529 AromaticContact ND1-CE1 3.5Å; H500-Y529 WeakPolarHBondContact ND1-CE1 3.29Å; H500-Y529 AromaticContact ND1-CE2 3.71Å; H500-Y529 AromaticContact ND1-CZ 3.1Å; H500-Y529 PolarHBondContact ND1-OH 2.97Å
501	Q	90.9	Very high	87.4	Confident	81 Å²	81	45 Å²	45	38%	0.379	23%	0.228	S	C	.	.	H	α-helix	trans	-58.7	-48	175.3	-71.3	172.1	61.9	0	0	111.3	E497 E498 F499 S504 Q505	E497-Q501 WeakPolarHBondContact O-CG 3.35Å; E497-Q501 PolarHBondContact O-N 3.13Å; E497-Q501 PolarHBondContact O-NE2 3.34Å; E498-Q501 PolarHBondContact O-N 2.86Å; E498-Q501 PolarHBondContact OE1-NE2 3.08Å; F499-Q501 PolarHBondContact O-N 2.86Å; Q501-S504 PolarHBondContact O-N 3.28Å; Q501-Q505 PolarHBondContact O-N 3.19Å
502	C	92.2	Very high	87.3	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-63.5	-46.3	176.7	-68.1	0	0	0	0	112.3	R466 H486 A487 E498 F499 S504 Q505 L506	R466-C502 PolarHBondContact NH1-SG 2.73Å; H486-C502 PolarHBondContact ND1-SG 3.2Å; A487-C502 HydrophobicContact CB-CB 3.78Å; E498-C502 PolarHBondContact O-N 3.47Å; E498-C502 PolarHBondContact O-SG 2.82Å; E498-C502 VanDerWaalsContact O-SG 3.36Å; F499-C502 PolarHBondContact O-N 3.38Å; C502-S504 PolarHBondContact O-N 3.37Å; C502-Q505 PolarHBondContact O-N 3.11Å; C502-L506 WeakPolarHBondContact O-CB 3.4Å; C502-L506 WeakPolarHBondContact O-CG 3.15Å; C502-L506 PolarHBondContact O-N 3.04Å
503	Q	88.9	Confident	86.9	Confident	8 Å²	8	47.3 Å²	47.3	4%	0.037	25%	0.251	C	S	.	.	H	α-helix	trans	-57.1	-37	177.2	-170.8	-146.7	116.2	0	0	112.1	F499 H500 L507 R526	F499-Q503 HydrophobicContact CE1-CB 4.38Å; F499-Q503 HydrophobicContact CZ-CB 4.23Å; F499-Q503 HydrophobicContact CZ-CG 4.32Å; F499-Q503 VanDerWaalsContact O-CB 3.3Å; F499-Q503 WeakPolarHBondContact O-CB 3.28Å; F499-Q503 PolarHBondContact O-N 3.26Å; H500-Q503 PolarHBondContact O-N 2.86Å; Q503-L507 VanDerWaalsContact O-CB 3.28Å; Q503-L507 WeakPolarHBondContact O-CB 3.31Å; Q503-L507 PolarHBondContact O-N 3.39Å; Q503-R526 HydrophobicContact CG-CB 4.3Å
504	S	88.2	Confident	86.5	Confident	58 Å²	58	47.1 Å²	47.1	41%	0.406	24%	0.244	S	C	.	.	H	α-helix	trans	-67.8	-37.1	179.9	-61.9	0	0	0	0	112.8	H500 Q501 C502	H500-S504 PolarHBondContact CD2-OG 2.94Å; H500-S504 WeakPolarHBondContact O-CB 3.31Å; H500-S504 PolarHBondContact O-N 3.49Å; H500-S504 PolarHBondContact O-OG 3.3Å; Q501-S504 PolarHBondContact O-N 3.28Å; C502-S504 PolarHBondContact O-N 3.37Å
505	Q	90.7	Very high	86.1	Confident	46 Å²	46	46.1 Å²	46.1	22%	0.215	23%	0.233	C	C	.	.	H	α-helix	trans	-81.4	-37	175.4	-175.7	59.6	21.2	0	0	112.3	Y483 Q501 C502 L507 R508 L509	Y483-Q505 HydrophobicContact CD1-CB 4.03Å; Y483-Q505 HydrophobicContact CD1-CG 4.12Å; Y483-Q505 HydrophobicContact CD2-CG 4.14Å; Y483-Q505 HydrophobicContact CE1-CB 3.77Å; Y483-Q505 HydrophobicContact CE1-CG 3.65Å; Y483-Q505 HydrophobicContact CE2-CG 3.74Å; Y483-Q505 HydrophobicContact CG-CG 4.37Å; Y483-Q505 VanDerWaalsContact CZ-CG 3.5Å; Q501-Q505 PolarHBondContact O-N 3.19Å; C502-Q505 PolarHBondContact O-N 3.11Å; Q505-L507 VanDerWaalsContact C-N 3.26Å; Q505-L507 PolarHBondContact O-N 2.72Å; Q505-R508 WeakPolarHBondContact O-CA 3.3Å; Q505-R508 WeakPolarHBondContact O-CB 3.13Å; Q505-R508 PolarHBondContact O-N 3.33Å; Q505-L509 HydrophobicContact CG-CD1 4.43Å; Q505-L509 PolarHBondContact O-N 3.42Å; Q505-L509 VanDerWaalsContact O-N 3.09Å
506	L	90.7	Very high	85.5	Confident	1 Å²	1	48.9 Å²	48.9	1%	0.005	25%	0.252	C	S	.	.	H	α-helix	trans	-57.4	-40.8	170.1	-72.9	168.5	0	0	0	110.9	V480 E484 A487 C502 R508 L509 H510 F522	V480-L506 HydrophobicContact CG1-CD2 3.95Å; E484-L506 HydrophobicContact CG-CD1 4.44Å; E484-L506 HydrophobicContact CG-CD2 3.93Å; A487-L506 HydrophobicContact CB-CD1 4.48Å; C502-L506 WeakPolarHBondContact O-CB 3.4Å; C502-L506 WeakPolarHBondContact O-CG 3.15Å; C502-L506 PolarHBondContact O-N 3.04Å; L506-R508 PolarHBondContact O-N 2.56Å; L506-R508 VanDerWaalsContact O-N 3.15Å; L506-L509 PolarHBondContact O-N 3.44Å; L506-H510 WeakPolarHBondContact O-CB 3.35Å; L506-H510 PolarHBondContact O-CD2 3.08Å; L506-H510 VanDerWaalsContact O-CD2 3.3Å; L506-H510 PolarHBondContact O-N 2.9Å; L506-F522 HydrophobicContact CD1-CD1 3.67Å; L506-F522 HydrophobicContact CD1-CD2 4.32Å; L506-F522 HydrophobicContact CD1-CE1 3.63Å; L506-F522 HydrophobicContact CD1-CE2 4.29Å; L506-F522 HydrophobicContact CD1-CG 4.04Å; L506-F522 HydrophobicContact CD1-CZ 3.97Å
507	L	86.7	Confident	85.1	Confident	43 Å²	43	52.7 Å²	52.7	23%	0.225	28%	0.282	C	S	.	.	H	α-helix	trans	-59.2	-23	171.8	174.1	62.1	0	0	0	113.9	Q503 Q505 K511	Q503-L507 VanDerWaalsContact O-CB 3.28Å; Q503-L507 WeakPolarHBondContact O-CB 3.31Å; Q503-L507 PolarHBondContact O-N 3.39Å; Q505-L507 VanDerWaalsContact C-N 3.26Å; Q505-L507 PolarHBondContact O-N 2.72Å; L507-K511 VanDerWaalsContact O-CD 3.31Å; L507-K511 WeakPolarHBondContact O-CD 3.48Å; L507-K511 VanDerWaalsContact O-CE 3.25Å; L507-K511 WeakPolarHBondContact O-CE 3.36Å; L507-K511 VanDerWaalsContact O-CG 3.28Å; L507-K511 WeakPolarHBondContact O-CG 3.36Å
508	R	87.7	Confident	84.8	Confident	92 Å²	92	47.9 Å²	47.9	35%	0.347	26%	0.258	S	S	.	.	H	α-helix	trans	-79.5	-57.7	172.7	-178.7	174.5	169	-125.1	-30.8	110.2	E475 Q505 L506 H510 K511 E512	E475-R508 IonicContact OE1-CZ 3.91Å; E475-R508 VanDerWaalsContact OE1-CZ 3.27Å; E475-R508 IonicContact OE1-NH1 2.83Å; E475-R508 PolarHBondContact OE1-NH1 3.48Å; E475-R508 IonicContact OE1-NH2 3.23Å; E475-R508 PolarHBondContact OE1-NH2 3.35Å; E475-R508 IonicContact OE2-CZ 4Å; E475-R508 IonicContact OE2-NH1 2.75Å; E475-R508 PolarHBondContact OE2-NH1 3.39Å; E475-R508 IonicContact OE2-NH2 3.2Å; E475-R508 PolarHBondContact OE2-NH2 3.45Å; Q505-R508 WeakPolarHBondContact O-CA 3.3Å; Q505-R508 WeakPolarHBondContact O-CB 3.13Å; Q505-R508 PolarHBondContact O-N 3.33Å; L506-R508 PolarHBondContact O-N 2.56Å; L506-R508 VanDerWaalsContact O-N 3.15Å; R508-H510 PolarHBondContact O-N 3.24Å; R508-K511 WeakPolarHBondContact O-CB 3.15Å; R508-K511 PolarHBondContact O-N 3.33Å; R508-E512 WeakPolarHBondContact CG-OE1 3.46Å; R508-E512 IonicContact CZ-OE1 3.3Å; R508-E512 VanDerWaalsContact CZ-OE1 3.23Å; R508-E512 IonicContact NE-OE1 3.52Å; R508-E512 PolarHBondContact NE-OE1 2.98Å; R508-E512 IonicContact NE-OE2 2.68Å; R508-E512 IonicContact NH2-OE1 2.74Å; R508-E512 PolarHBondContact NH2-OE1 3.08Å; R508-E512 IonicContact NH2-OE2 2.66Å; R508-E512 PolarHBondContact O-N 3.35Å
509	L	87.8	Confident	84.4	Confident	1 Å²	1	48.4 Å²	48.4	1%	0.005	26%	0.262	C	S	.	.	H	α-helix	trans	-55.4	-38.7	-179.5	-59.6	169.9	0	0	0	112.3	E475 V480 Y483 Q505 L506 K511 E512 G513 L514	E475-L509 HydrophobicContact CB-CD2 3.89Å; E475-L509 HydrophobicContact CG-CD2 4.35Å; V480-L509 HydrophobicContact CG2-CB 3.8Å; V480-L509 HydrophobicContact CG2-CD1 3.78Å; V480-L509 HydrophobicContact CG2-CG 4.33Å; Y483-L509 HydrophobicContact CD2-CD1 3.89Å; Y483-L509 HydrophobicContact CE2-CD1 4.34Å; Q505-L509 HydrophobicContact CG-CD1 4.43Å; Q505-L509 PolarHBondContact O-N 3.42Å; Q505-L509 VanDerWaalsContact O-N 3.09Å; L506-L509 PolarHBondContact O-N 3.44Å; L509-K511 VanDerWaalsContact C-N 3.26Å; L509-K511 PolarHBondContact O-N 3.07Å; L509-E512 WeakPolarHBondContact CA-OE2 3.47Å; L509-E512 PolarHBondContact N-OE2 3.44Å; L509-E512 PolarHBondContact O-N 3.3Å; L509-E512 VanDerWaalsContact O-N 3.08Å; L509-G513 PolarHBondContact O-N 2.99Å; L509-L514 HydrophobicContact CD2-CD1 4.45Å; L509-L514 PolarHBondContact O-N 3.43Å
510	H	86.2	Confident	83.7	Confident	28 Å²	28	50 Å²	50	13%	0.13	27%	0.27	C	S	.	.	H	α-helix	trans	-70	-13.3	176.6	-66.3	-178.2	0	0	0	114.7	L506 R508 L514 L519	L506-H510 WeakPolarHBondContact O-CB 3.35Å; L506-H510 PolarHBondContact O-CD2 3.08Å; L506-H510 VanDerWaalsContact O-CD2 3.3Å; L506-H510 PolarHBondContact O-N 2.9Å; R508-H510 PolarHBondContact O-N 3.24Å; H510-L514 PolarHBondContact CD2-O 3.3Å; H510-L514 VanDerWaalsContact CD2-O 3.3Å; H510-L519 HydrophobicContact CB-CD1 3.77Å; H510-L519 WeakPolarHBondContact ND1-CD1 3.37Å
511	K	81.8	Confident	83.4	Confident	147 Å²	147	47.7 Å²	47.7	64%	0.639	26%	0.259	S	S	*	.	H	α-helix	trans	-88.1	-27.6	168.3	-64.8	161.8	-174.3	167.1	0	111.9	L507 R508 L509 G513	L507-K511 VanDerWaalsContact O-CD 3.31Å; L507-K511 WeakPolarHBondContact O-CD 3.48Å; L507-K511 VanDerWaalsContact O-CE 3.25Å; L507-K511 WeakPolarHBondContact O-CE 3.36Å; L507-K511 VanDerWaalsContact O-CG 3.28Å; L507-K511 WeakPolarHBondContact O-CG 3.36Å; R508-K511 WeakPolarHBondContact O-CB 3.15Å; R508-K511 PolarHBondContact O-N 3.33Å; L509-K511 VanDerWaalsContact C-N 3.26Å; L509-K511 PolarHBondContact O-N 3.07Å; K511-G513 PolarHBondContact O-N 3Å
512	E	83	Confident	83	Confident	93 Å²	93	44.2 Å²	44.2	44%	0.435	24%	0.243	S	C	.	.	H	α-helix	trans	-78.3	-6.8	177.8	-70.6	145.6	175.6	0	0	111.3	R508 L509	R508-E512 WeakPolarHBondContact CG-OE1 3.46Å; R508-E512 IonicContact CZ-OE1 3.3Å; R508-E512 VanDerWaalsContact CZ-OE1 3.23Å; R508-E512 IonicContact NE-OE1 3.52Å; R508-E512 PolarHBondContact NE-OE1 2.98Å; R508-E512 IonicContact NE-OE2 2.68Å; R508-E512 IonicContact NH2-OE1 2.74Å; R508-E512 PolarHBondContact NH2-OE1 3.08Å; R508-E512 IonicContact NH2-OE2 2.66Å; R508-E512 PolarHBondContact O-N 3.35Å; L509-E512 WeakPolarHBondContact CA-OE2 3.47Å; L509-E512 PolarHBondContact N-OE2 3.44Å; L509-E512 PolarHBondContact O-N 3.3Å; L509-E512 VanDerWaalsContact O-N 3.08Å
513	G	78.7	Confident	82.3	Confident	50 Å²	50	45.3 Å²	45.3	52%	0.515	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	108.9	-1.9	168.6	0	0	0	0	0	114.7	L509 K511 V516	L509-G513 PolarHBondContact O-N 2.99Å; K511-G513 PolarHBondContact O-N 3Å; G513-V516 VanDerWaalsContact O-CG2 3.3Å; G513-V516 WeakPolarHBondContact O-CG2 3.35Å
514	L	76.6	Confident	81.8	Confident	42 Å²	42	44.9 Å²	44.9	22%	0.22	25%	0.248	C	C	.	.			trans	-90.7	161.9	-172.3	-57.5	159.9	0	0	0	111.6	E475 V480 L509 H510 V516	E475-L514 WeakPolarHBondContact O-CD1 3.1Å; V480-L514 HydrophobicContact CG2-CB 3.78Å; L509-L514 HydrophobicContact CD2-CD1 4.45Å; L509-L514 PolarHBondContact O-N 3.43Å; H510-L514 PolarHBondContact CD2-O 3.3Å; H510-L514 VanDerWaalsContact CD2-O 3.3Å; L514-V516 VanDerWaalsContact C-N 3.34Å; L514-V516 PolarHBondContact O-N 3.09Å
515	G	74.2	Confident	81.4	Confident	4 Å²	4	42.4 Å²	42.4	4%	0.041	23%	0.229	C	C	.	.			trans	71.2	21.2	174	0	0	0	0	0	116.3	D477 S517 R518 L519	D477-G515 PolarHBondContact OD1-N 2.68Å; G515-S517 PolarHBondContact O-N 2.85Å; G515-R518 PolarHBondContact O-N 3.13Å; G515-L519 PolarHBondContact O-N 3Å
516	V	74	Confident	80.8	Confident	104 Å²	104	42.3 Å²	42.3	63%	0.63	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.1	-30.7	-174.8	-173.2	0	0	0	0	113.1	G513 L514 R518 L519	G513-V516 VanDerWaalsContact O-CG2 3.3Å; G513-V516 WeakPolarHBondContact O-CG2 3.35Å; L514-V516 VanDerWaalsContact C-N 3.34Å; L514-V516 PolarHBondContact O-N 3.09Å; V516-R518 PolarHBondContact O-N 3.18Å; V516-L519 WeakPolarHBondContact O-CB 3.48Å
517	S	76.4	Confident	80	Confident	108 Å²	108	42.5 Å²	42.5	76%	0.755	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-35.7	-177.3	55.6	0	0	0	0	114.7	G515	G515-S517 PolarHBondContact O-N 2.85Å
518	R	79.2	Confident	79.4	Confident	23 Å²	23	41 Å²	41	9%	0.087	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-120.8	7.4	-179	-60.8	-179.6	68.3	-158.7	1.8	113.5	E484 D488 G515 V516 L520 E521 F522	E484-R518 WeakPolarHBondContact OE1-CB 3.4Å; E484-R518 VanDerWaalsContact OE2-CD 3.31Å; E484-R518 WeakPolarHBondContact OE2-CD 3.3Å; E484-R518 IonicContact OE2-CZ 3.55Å; E484-R518 IonicContact OE2-NH1 2.74Å; E484-R518 PolarHBondContact OE2-NH1 3.42Å; D488-R518 VanDerWaalsContact CG-NH2 3.32Å; D488-R518 IonicContact OD1-CZ 2.67Å; D488-R518 IonicContact OD1-NH1 3.53Å; D488-R518 IonicContact OD1-NH2 3.69Å; D488-R518 PolarHBondContact OD1-NH2 3.39Å; D488-R518 IonicContact OD2-CZ 2.74Å; D488-R518 VanDerWaalsContact OD2-CZ 3.3Å; D488-R518 IonicContact OD2-NH1 2.8Å; D488-R518 PolarHBondContact OD2-NH1 2.99Å; D488-R518 IonicContact OD2-NH2 3.61Å; D488-R518 PolarHBondContact OD2-NH2 2.87Å; G515-R518 PolarHBondContact O-N 3.13Å; V516-R518 PolarHBondContact O-N 3.18Å; R518-L520 PolarHBondContact O-N 3.09Å; R518-L520 VanDerWaalsContact O-N 3.08Å; R518-E521 HydrophobicContact CB-CB 4.37Å; R518-E521 HydrophobicContact CB-CG 4.49Å; R518-E521 IonicContact CZ-OE2 3.83Å; R518-E521 VanDerWaalsContact CZ-OE2 3.23Å; R518-E521 IonicContact NE-OE1 2.62Å; R518-E521 IonicContact NE-OE2 3.02Å; R518-E521 PolarHBondContact NE-OE2 3.09Å; R518-E521 IonicContact NH2-OE2 3.37Å; R518-E521 PolarHBondContact NH2-OE2 3.44Å; R518-E521 WeakPolarHBondContact O-CB 3.24Å; R518-E521 PolarHBondContact O-N 3.3Å; R518-F522 HydrophobicContact CB-CD2 4.05Å; R518-F522 HydrophobicContact CB-CE2 4.16Å; R518-F522 WeakPolarHBondContact O-CD2 3.45Å; R518-F522 PolarHBondContact O-N 3.37Å
519	L	79.8	Confident	78.7	Confident	26 Å²	26	38.9 Å²	38.9	14%	0.136	21%	0.213	C	C	.	.	H	α-helix	trans	-44.4	-39.6	170.6	178	52.2	0	0	0	113.3	H510 G515 V516 T523 Y549	H510-L519 HydrophobicContact CB-CD1 3.77Å; H510-L519 WeakPolarHBondContact ND1-CD1 3.37Å; G515-L519 PolarHBondContact O-N 3Å; V516-L519 WeakPolarHBondContact O-CB 3.48Å; L519-T523 VanDerWaalsContact O-CB 3.28Å; L519-T523 WeakPolarHBondContact O-CB 3.31Å; L519-T523 PolarHBondContact O-N 2.93Å; L519-T523 PolarHBondContact O-OG1 2.92Å; L519-Y549 HydrophobicContact CD2-CE1 4.31Å; L519-Y549 WeakPolarHBondContact CD2-OH 3.48Å
520	L	76	Confident	78	Confident	36 Å²	36	40.5 Å²	40.5	19%	0.188	22%	0.219	C	C	.	.	H	α-helix	trans	-74.5	-41.1	176.8	-65.5	175.5	0	0	0	113.2	R518 T523 A524 L546 Y549 Q554 F556	R518-L520 PolarHBondContact O-N 3.09Å; R518-L520 VanDerWaalsContact O-N 3.08Å; L520-T523 PolarHBondContact O-N 3.3Å; L520-A524 WeakPolarHBondContact O-CB 3.26Å; L520-A524 PolarHBondContact O-N 3.23Å; L520-L546 HydrophobicContact CD2-CD2 4.45Å; L520-Y549 HydrophobicContact CD2-CD1 4.4Å; L520-Y549 HydrophobicContact CD2-CE1 4.44Å; L520-Q554 HydrophobicContact CD1-CB 4.24Å; L520-Q554 VanDerWaalsContact CD1-CD 3.5Å; L520-Q554 HydrophobicContact CD1-CG 3.93Å; L520-F556 HydrophobicContact CB-CD1 4.4Å; L520-F556 HydrophobicContact CB-CE1 3.99Å
521	E	81.2	Confident	77.2	Confident	11 Å²	11	40.5 Å²	40.5	5%	0.051	22%	0.22	C	C	.	.	H	α-helix	trans	-58.5	-49	173.1	-65.7	-174.9	-156.8	0	0	110.6	R518 T523 A524 Y525 T557 R559	R518-E521 HydrophobicContact CB-CB 4.37Å; R518-E521 HydrophobicContact CB-CG 4.49Å; R518-E521 IonicContact CZ-OE2 3.83Å; R518-E521 VanDerWaalsContact CZ-OE2 3.23Å; R518-E521 IonicContact NE-OE1 2.62Å; R518-E521 IonicContact NE-OE2 3.02Å; R518-E521 PolarHBondContact NE-OE2 3.09Å; R518-E521 IonicContact NH2-OE2 3.37Å; R518-E521 PolarHBondContact NH2-OE2 3.44Å; R518-E521 WeakPolarHBondContact O-CB 3.24Å; R518-E521 PolarHBondContact O-N 3.3Å; E521-T523 PolarHBondContact O-N 3.01Å; E521-A524 WeakPolarHBondContact O-CB 3.41Å; E521-A524 PolarHBondContact O-N 3.43Å; E521-A524 VanDerWaalsContact O-N 3.13Å; E521-Y525 HydrophobicContact CB-CE2 4.27Å; E521-Y525 VanDerWaalsContact O-CD2 3.26Å; E521-Y525 WeakPolarHBondContact O-CD2 3.42Å; E521-Y525 PolarHBondContact O-N 3.23Å; E521-T557 VanDerWaalsContact CD-O 3.22Å; E521-T557 PolarHBondContact OE1-OG1 2.62Å; E521-R559 IonicContact OE1-CZ 2.7Å; E521-R559 IonicContact OE1-NH1 3.79Å; E521-R559 PolarHBondContact OE1-NH1 3.36Å
522	F	82.7	Confident	76.4	Confident	7 Å²	7	35.4 Å²	35.4	3%	0.031	20%	0.197	C	C	.	.	H	α-helix	trans	-71.2	-29.6	-179.9	-76.8	-75.8	0	0	0	113.6	E484 A487 F499 L506 R518 A524 Y525 R526	E484-F522 HydrophobicContact CB-CE2 4.12Å; E484-F522 HydrophobicContact CB-CZ 4.13Å; E484-F522 HydrophobicContact CG-CD2 4.41Å; E484-F522 HydrophobicContact CG-CE2 3.61Å; E484-F522 HydrophobicContact CG-CZ 4.05Å; A487-F522 HydrophobicContact CB-CE1 3.63Å; A487-F522 HydrophobicContact CB-CZ 4.06Å; F499-F522 HydrophobicContact CE2-CD1 4.32Å; F499-F522 HydrophobicContact CE2-CE1 4.16Å; L506-F522 HydrophobicContact CD1-CD1 3.67Å; L506-F522 HydrophobicContact CD1-CD2 4.32Å; L506-F522 HydrophobicContact CD1-CE1 3.63Å; L506-F522 HydrophobicContact CD1-CE2 4.29Å; L506-F522 HydrophobicContact CD1-CG 4.04Å; L506-F522 HydrophobicContact CD1-CZ 3.97Å; R518-F522 HydrophobicContact CB-CD2 4.05Å; R518-F522 HydrophobicContact CB-CE2 4.16Å; R518-F522 WeakPolarHBondContact O-CD2 3.45Å; R518-F522 PolarHBondContact O-N 3.37Å; F522-A524 VanDerWaalsContact C-N 3.34Å; F522-Y525 AromaticContact CD1-CD2 4Å; F522-Y525 HydrophobicContact CD1-CD2 4Å; F522-Y525 HydrophobicContact CE1-CD2 4.13Å; F522-Y525 HydrophobicContact CE1-CE2 4.42Å; F522-Y525 HydrophobicContact CG-CD2 4.46Å; F522-R526 VanDerWaalsContact O-CB 3.24Å; F522-R526 WeakPolarHBondContact O-CB 3.48Å; F522-R526 PolarHBondContact O-N 3.29Å
523	T	78.9	Confident	75.7	Confident	23 Å²	23	33.4 Å²	33.4	14%	0.141	19%	0.192	C	C	.	.	H	α-helix	trans	-67.5	-36.3	169.2	-59.6	0	0	0	0	111.2	L519 L520 E521 L527 L546	L519-T523 VanDerWaalsContact O-CB 3.28Å; L519-T523 WeakPolarHBondContact O-CB 3.31Å; L519-T523 PolarHBondContact O-N 2.93Å; L519-T523 PolarHBondContact O-OG1 2.92Å; L520-T523 PolarHBondContact O-N 3.3Å; E521-T523 PolarHBondContact O-N 3.01Å; T523-L527 HydrophobicContact CG2-CD1 4.28Å; T523-L527 WeakPolarHBondContact O-CB 3.46Å; T523-L527 PolarHBondContact O-N 3Å; T523-L546 HydrophobicContact CG2-CD2 3.68Å; T523-L546 HydrophobicContact CG2-CG 4.11Å
524	A	77	Confident	74.9	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-67.5	-49.4	174.9	0	0	0	0	0	112.5	L520 E521 F522 R526 L527 L528 F556 F558 F575	L520-A524 WeakPolarHBondContact O-CB 3.26Å; L520-A524 PolarHBondContact O-N 3.23Å; E521-A524 WeakPolarHBondContact O-CB 3.41Å; E521-A524 PolarHBondContact O-N 3.43Å; E521-A524 VanDerWaalsContact O-N 3.13Å; F522-A524 VanDerWaalsContact C-N 3.34Å; A524-R526 VanDerWaalsContact C-N 3.26Å; A524-R526 PolarHBondContact O-N 3.45Å; A524-L527 PolarHBondContact O-N 3.01Å; A524-L527 VanDerWaalsContact O-N 3.15Å; A524-L528 PolarHBondContact O-N 2.86Å; A524-F556 HydrophobicContact CB-CD1 4.03Å; A524-F556 HydrophobicContact CB-CE1 4.26Å; A524-F558 HydrophobicContact CB-CE1 3.83Å; A524-F558 HydrophobicContact CB-CZ 3.72Å; A524-F575 HydrophobicContact CB-CE2 4.3Å; A524-F575 HydrophobicContact CB-CZ 3.65Å
525	Y	80	Confident	74.4	Confident	5 Å²	5	35 Å²	35	2%	0.02	19%	0.188	C	C	.	.	H	α-helix	trans	-59	-38	174.8	-64.3	-51.5	0	0	0	111.8	L491 F499 E521 F522 L528 Y529 F558 R559 F563	L491-Y525 HydrophobicContact CD1-CD1 4.02Å; L491-Y525 HydrophobicContact CD1-CD2 4.02Å; L491-Y525 HydrophobicContact CD1-CE1 3.85Å; L491-Y525 HydrophobicContact CD1-CE2 3.86Å; L491-Y525 HydrophobicContact CD1-CG 4.11Å; F499-Y525 HydrophobicContact CE2-CD2 4.47Å; F499-Y525 HydrophobicContact CZ-CG 4.34Å; E521-Y525 HydrophobicContact CB-CE2 4.27Å; E521-Y525 VanDerWaalsContact O-CD2 3.26Å; E521-Y525 WeakPolarHBondContact O-CD2 3.42Å; E521-Y525 PolarHBondContact O-N 3.23Å; F522-Y525 AromaticContact CD1-CD2 4Å; F522-Y525 HydrophobicContact CD1-CD2 4Å; F522-Y525 HydrophobicContact CE1-CD2 4.13Å; F522-Y525 HydrophobicContact CE1-CE2 4.42Å; F522-Y525 HydrophobicContact CG-CD2 4.46Å; Y525-L528 PolarHBondContact O-N 3.2Å; Y525-Y529 WeakPolarHBondContact O-CB 3.42Å; Y525-Y529 PolarHBondContact O-N 3.11Å; Y525-F558 HydrophobicContact CD1-CD1 4.14Å; Y525-F558 HydrophobicContact CD1-CE1 4.33Å; Y525-F558 AromaticContact CE1-CD1 3.72Å; Y525-F558 HydrophobicContact CE1-CD1 3.72Å; Y525-F558 HydrophobicContact CE1-CE1 4.36Å; Y525-R559 PolarHBondContact OH-N 3.06Å; Y525-F563 HydrophobicContact CE1-CD2 4.46Å
526	R	79	Confident	74	Confident	45 Å²	45	38.5 Å²	38.5	17%	0.17	21%	0.205	C	C	.	.	H	α-helix	trans	-66.3	-40.8	174.4	178.1	171.8	-172	-172.6	5.8	113.1	Q503 F522 A524 L528 Y529 Y530	Q503-R526 HydrophobicContact CG-CB 4.3Å; F522-R526 VanDerWaalsContact O-CB 3.24Å; F522-R526 WeakPolarHBondContact O-CB 3.48Å; F522-R526 PolarHBondContact O-N 3.29Å; A524-R526 VanDerWaalsContact C-N 3.26Å; A524-R526 PolarHBondContact O-N 3.45Å; R526-L528 VanDerWaalsContact C-N 3.33Å; R526-Y529 WeakPolarHBondContact O-CB 3.48Å; R526-Y529 PolarHBondContact O-N 2.97Å; R526-Y530 HydrophobicContact CG-CD2 3.93Å; R526-Y530 HydrophobicContact CG-CE2 3.57Å; R526-Y530 PolarHBondContact NE-OH 2.86Å; R526-Y530 VanDerWaalsContact NE-OH 3.13Å; R526-Y530 PolarHBondContact NH2-OH 3.29Å; R526-Y530 WeakPolarHBondContact O-CD2 2.95Å; R526-Y530 PolarHBondContact O-N 2.83Å
527	L	73.9	Confident	73.4	Confident	4 Å²	4	37.1 Å²	37.1	2%	0.021	19%	0.194	C	C	.	.	H	α-helix	trans	-63.8	-40.8	174	-88.2	161.3	0	0	0	111.4	T523 A524 Y529 Y530 I531 A542 I543 L546 F575 L579	T523-L527 HydrophobicContact CG2-CD1 4.28Å; T523-L527 WeakPolarHBondContact O-CB 3.46Å; T523-L527 PolarHBondContact O-N 3Å; A524-L527 PolarHBondContact O-N 3.01Å; A524-L527 VanDerWaalsContact O-N 3.15Å; L527-Y529 VanDerWaalsContact C-N 3.34Å; L527-Y530 PolarHBondContact O-N 2.98Å; L527-I531 WeakPolarHBondContact O-CB 3.16Å; L527-I531 WeakPolarHBondContact O-CD1 3.46Å; L527-I531 VanDerWaalsContact O-CG1 3.23Å; L527-I531 WeakPolarHBondContact O-CG1 3.43Å; L527-I531 PolarHBondContact O-N 3.42Å; L527-A542 HydrophobicContact CD1-CB 4.3Å; L527-A542 HydrophobicContact CD2-CB 3.48Å; L527-A542 VanDerWaalsContact CD2-CB 3.48Å; L527-A542 HydrophobicContact CG-CB 3.69Å; L527-I543 HydrophobicContact CD2-CG1 3.88Å; L527-L546 HydrophobicContact CD1-CD1 3.31Å; L527-L546 HydrophobicContact CD1-CG 3.87Å; L527-F575 HydrophobicContact CB-CE1 4.48Å; L527-F575 HydrophobicContact CD1-CE1 3.78Å; L527-L579 HydrophobicContact CB-CD1 3.89Å
528	L	73.3	Confident	72.9	Confident	12 Å²	12	32.2 Å²	32.2	6%	0.063	16%	0.161	C	C	.	.	H	α-helix	trans	-62.3	-41.3	172.4	-172.6	62.1	0	0	0	111.6	A524 Y525 R526 Y530 I531 F532 F563 L579 I582 K583	A524-L528 PolarHBondContact O-N 2.86Å; Y525-L528 PolarHBondContact O-N 3.2Å; R526-L528 VanDerWaalsContact C-N 3.33Å; L528-Y530 PolarHBondContact O-N 3.06Å; L528-I531 WeakPolarHBondContact O-CB 3.29Å; L528-I531 PolarHBondContact O-N 3.49Å; L528-F532 VanDerWaalsContact O-CB 3.22Å; L528-F532 WeakPolarHBondContact O-CB 3.36Å; L528-F532 PolarHBondContact O-N 2.86Å; L528-F563 HydrophobicContact CD2-CD1 4.37Å; L528-F563 HydrophobicContact CD2-CE1 3.47Å; L528-F563 VanDerWaalsContact CD2-CE1 3.47Å; L528-F563 HydrophobicContact CD2-CE2 4.34Å; L528-F563 HydrophobicContact CD2-CZ 3.44Å; L528-F563 VanDerWaalsContact CD2-CZ 3.44Å; L528-L579 HydrophobicContact CB-CD2 4.49Å; L528-I582 HydrophobicContact CD1-CG2 4.45Å; L528-I582 HydrophobicContact CD2-CG2 4.2Å; L528-K583 HydrophobicContact CD1-CB 4.34Å
529	Y	73.4	Confident	72.3	Confident	47 Å²	47	33.2 Å²	33.2	18%	0.184	17%	0.165	C	C	.	.	H	α-helix	trans	-60.9	-41.8	174.1	-178.5	-88.2	0	0	0	112.7	H500 Y525 R526 L527 F532 T533	H500-Y529 AromaticContact CE1-CE1 3.62Å; H500-Y529 AromaticContact CE1-CZ 3.65Å; H500-Y529 PolarHBondContact CE1-OH 3.25Å; H500-Y529 AromaticContact ND1-CE1 3.5Å; H500-Y529 WeakPolarHBondContact ND1-CE1 3.29Å; H500-Y529 AromaticContact ND1-CE2 3.71Å; H500-Y529 AromaticContact ND1-CZ 3.1Å; H500-Y529 PolarHBondContact ND1-OH 2.97Å; Y525-Y529 WeakPolarHBondContact O-CB 3.42Å; Y525-Y529 PolarHBondContact O-N 3.11Å; R526-Y529 WeakPolarHBondContact O-CB 3.48Å; R526-Y529 PolarHBondContact O-N 2.97Å; L527-Y529 VanDerWaalsContact C-N 3.34Å; Y529-F532 PolarHBondContact O-N 3.31Å; Y529-T533 HydrophobicContact CD1-CG2 4.15Å; Y529-T533 HydrophobicContact CD2-CG2 4.44Å; Y529-T533 HydrophobicContact CE1-CG2 3.53Å; Y529-T533 HydrophobicContact CE2-CG2 3.88Å; Y529-T533 WeakPolarHBondContact O-CB 3.45Å; Y529-T533 PolarHBondContact O-N 3.37Å; Y529-T533 PolarHBondContact O-OG1 3.08Å
530	Y	72.3	Confident	71.6	Confident	35 Å²	35	36.8 Å²	36.8	14%	0.137	18%	0.184	C	C	.	.	H	α-helix	trans	-72.5	-32.4	174.4	-67.3	-44.8	0	0	0	113.3	R526 L527 L528 F532 L534 D535 G538 K539 A542	R526-Y530 HydrophobicContact CG-CD2 3.93Å; R526-Y530 HydrophobicContact CG-CE2 3.57Å; R526-Y530 PolarHBondContact NE-OH 2.86Å; R526-Y530 VanDerWaalsContact NE-OH 3.13Å; R526-Y530 PolarHBondContact NH2-OH 3.29Å; R526-Y530 WeakPolarHBondContact O-CD2 2.95Å; R526-Y530 PolarHBondContact O-N 2.83Å; L527-Y530 PolarHBondContact O-N 2.98Å; L528-Y530 PolarHBondContact O-N 3.06Å; Y530-F532 VanDerWaalsContact C-N 3.3Å; Y530-L534 CarbonylContact O-C 3.56Å; Y530-L534 WeakPolarHBondContact O-CA 3.49Å; Y530-L534 PolarHBondContact O-N 2.94Å; Y530-D535 HydrophobicContact CD1-CB 4.03Å; Y530-D535 PolarHBondContact O-N 3.26Å; Y530-G538 VanDerWaalsContact CD2-O 3.31Å; Y530-G538 WeakPolarHBondContact CD2-O 3.46Å; Y530-K539 WeakPolarHBondContact O-CE 3.3Å; Y530-A542 HydrophobicContact CD2-CB 4.24Å; Y530-A542 HydrophobicContact CE2-CB 4.39Å
531	I	70.1	Confident	71.3	Confident	29 Å²	29	39.4 Å²	39.4	15%	0.149	20%	0.197	C	C	.	.	H	α-helix	trans	-60.6	-43.7	169.9	-74.4	164.5	0	0	0	110.3	L527 L528 K539 L579 K583	L527-I531 WeakPolarHBondContact O-CB 3.16Å; L527-I531 WeakPolarHBondContact O-CD1 3.46Å; L527-I531 VanDerWaalsContact O-CG1 3.23Å; L527-I531 WeakPolarHBondContact O-CG1 3.43Å; L527-I531 PolarHBondContact O-N 3.42Å; L528-I531 WeakPolarHBondContact O-CB 3.29Å; L528-I531 PolarHBondContact O-N 3.49Å; I531-K539 HydrophobicContact CG1-CD 3.9Å; I531-K539 HydrophobicContact CG1-CG 4.07Å; I531-L579 HydrophobicContact CD1-CB 3.78Å; I531-L579 HydrophobicContact CD1-CD1 3.77Å; I531-L579 HydrophobicContact CD1-CG 4.45Å; I531-K583 HydrophobicContact CG2-CB 4.41Å; I531-K583 HydrophobicContact CG2-CD 3.75Å; I531-K583 HydrophobicContact CG2-CG 4.23Å
532	F	65.5	Low	70.6	Confident	39 Å²	39	39 Å²	39	17%	0.171	20%	0.197	C	C	.	.	H	α-helix	trans	-73.1	-48.7	-178.3	176.7	-93.9	0	0	0	114.1	F284 L528 Y529 Y530 L534 F587	F284-F532 HydrophobicContact CD1-CZ 4.2Å; F284-F532 HydrophobicContact CD2-CZ 4.33Å; F284-F532 HydrophobicContact CE1-CE2 4.18Å; F284-F532 AromaticContact CE1-CZ 3.6Å; F284-F532 HydrophobicContact CE1-CZ 3.6Å; F284-F532 AromaticContact CE2-CE2 3.9Å; F284-F532 HydrophobicContact CE2-CE2 3.9Å; F284-F532 AromaticContact CE2-CZ 3.73Å; F284-F532 HydrophobicContact CE2-CZ 3.73Å; F284-F532 AromaticContact CZ-CE2 3.51Å; F284-F532 HydrophobicContact CZ-CE2 3.51Å; F284-F532 AromaticContact CZ-CZ 3.34Å; F284-F532 HydrophobicContact CZ-CZ 3.34Å; L528-F532 VanDerWaalsContact O-CB 3.22Å; L528-F532 WeakPolarHBondContact O-CB 3.36Å; L528-F532 PolarHBondContact O-N 2.86Å; Y529-F532 PolarHBondContact O-N 3.31Å; Y530-F532 VanDerWaalsContact C-N 3.3Å; F532-L534 WeakPolarHBondContact O-CD1 3.37Å; F532-L534 PolarHBondContact O-N 3.15Å; F532-F587 HydrophobicContact CD2-CE2 4.25Å; F532-F587 AromaticContact CD2-CZ 3.97Å; F532-F587 HydrophobicContact CD2-CZ 3.97Å; F532-F587 HydrophobicContact CE2-CE1 4.32Å; F532-F587 HydrophobicContact CE2-CE2 4.49Å; F532-F587 AromaticContact CE2-CZ 3.87Å; F532-F587 HydrophobicContact CE2-CZ 3.87Å
533	T	68.3	Low	69.9	Low	52 Å²	52	40.6 Å²	40.6	32%	0.319	21%	0.205	S	C	.	.	S	Bend	trans	-73.9	-3.5	173.7	52.6	0	0	0	0	113.6	Y529 D535	Y529-T533 HydrophobicContact CD1-CG2 4.15Å; Y529-T533 HydrophobicContact CD2-CG2 4.44Å; Y529-T533 HydrophobicContact CE1-CG2 3.53Å; Y529-T533 HydrophobicContact CE2-CG2 3.88Å; Y529-T533 WeakPolarHBondContact O-CB 3.45Å; Y529-T533 PolarHBondContact O-N 3.37Å; Y529-T533 PolarHBondContact O-OG1 3.08Å; T533-D535 PolarHBondContact O-N 3.13Å; T533-D535 VanDerWaalsContact O-N 3.11Å
534	L	61.9	Low	69.5	Low	60 Å²	60	49.1 Å²	49.1	31%	0.314	23%	0.234	S	C	.	.			trans	66.4	2.3	175.3	-65.1	128	0	0	0	116.3	P277 Y530 F532 I536 K539	P277-L534 HydrophobicContact CB-CD1 4.04Å; P277-L534 HydrophobicContact CG-CD1 3.58Å; P277-L534 HydrophobicContact CG-CD2 3.7Å; P277-L534 HydrophobicContact CG-CG 4.18Å; Y530-L534 CarbonylContact O-C 3.56Å; Y530-L534 WeakPolarHBondContact O-CA 3.49Å; Y530-L534 PolarHBondContact O-N 2.94Å; F532-L534 WeakPolarHBondContact O-CD1 3.37Å; F532-L534 PolarHBondContact O-N 3.15Å; L534-I536 WeakPolarHBondContact O-CG1 3.31Å; L534-I536 PolarHBondContact O-N 3.14Å; L534-K539 VanDerWaalsContact C-NZ 3.33Å; L534-K539 WeakPolarHBondContact O-CE 3.26Å; L534-K539 PolarHBondContact O-NZ 2.95Å
535	D	65.7	Low	69	Low	64 Å²	64	53.9 Å²	53.9	34%	0.342	26%	0.255	S	S	.	.			trans	-51.5	100.6	172.3	-179.7	6.7	0	0	0	112.3	Y530 T533 L537 G538 K539	Y530-D535 HydrophobicContact CD1-CB 4.03Å; Y530-D535 PolarHBondContact O-N 3.26Å; T533-D535 PolarHBondContact O-N 3.13Å; T533-D535 VanDerWaalsContact O-N 3.11Å; D535-L537 VanDerWaalsContact C-N 3.32Å; D535-L537 PolarHBondContact OD1-N 3.08Å; D535-G538 PolarHBondContact OD1-N 3.4Å; D535-G538 VanDerWaalsContact OD2-CA 3.29Å; D535-G538 WeakPolarHBondContact OD2-CA 3.49Å; D535-G538 PolarHBondContact OD2-N 3.1Å; D535-K539 VanDerWaalsContact C-CE 3.41Å; D535-K539 WeakPolarHBondContact O-CB 3.38Å; D535-K539 WeakPolarHBondContact O-CE 3.33Å; D535-K539 PolarHBondContact O-N 3.07Å
536	I	64.6	Low	68.3	Low	79 Å²	79	54.4 Å²	54.4	41%	0.405	26%	0.258	S	S	.	.	H	α-helix	trans	-66.9	-36.8	-179.3	-55.9	178	0	0	0	110.3	I251 L534 K539 L540	I251-I536 HydrophobicContact CG2-CD1 4.4Å; L534-I536 WeakPolarHBondContact O-CG1 3.31Å; L534-I536 PolarHBondContact O-N 3.14Å; I536-K539 WeakPolarHBondContact O-CB 3.46Å; I536-L540 HydrophobicContact CG2-CD1 4.11Å; I536-L540 WeakPolarHBondContact O-CB 3.44Å; I536-L540 WeakPolarHBondContact O-CG 3.3Å; I536-L540 PolarHBondContact O-N 2.98Å
537	L	62	Low	67.6	Low	75 Å²	75	57.8 Å²	57.8	39%	0.393	28%	0.279	S	S	.	.	H	α-helix	trans	-71.7	-45.6	-180	-169.2	74.3	0	0	0	110.7	D535 K539 L540 I541	D535-L537 VanDerWaalsContact C-N 3.32Å; D535-L537 PolarHBondContact OD1-N 3.08Å; L537-K539 VanDerWaalsContact C-N 3.34Å; L537-K539 PolarHBondContact O-N 3.23Å; L537-L540 PolarHBondContact O-N 3.1Å; L537-I541 HydrophobicContact CD1-CD1 4.48Å; L537-I541 HydrophobicContact CD2-CD1 4.3Å; L537-I541 HydrophobicContact CG-CD1 3.88Å; L537-I541 WeakPolarHBondContact O-CB 3.42Å; L537-I541 VanDerWaalsContact O-CG1 3.3Å; L537-I541 WeakPolarHBondContact O-CG1 3.33Å; L537-I541 PolarHBondContact O-N 2.95Å
538	G	65.5	Low	67.1	Low	5 Å²	5	67.7 Å²	67.7	5%	0.052	32%	0.318	C	S	.	.	H	α-helix	trans	-57.6	-44	172.8	0	0	0	0	0	112.6	Y530 D535 A542	Y530-G538 VanDerWaalsContact CD2-O 3.31Å; Y530-G538 WeakPolarHBondContact CD2-O 3.46Å; D535-G538 PolarHBondContact OD1-N 3.4Å; D535-G538 VanDerWaalsContact OD2-CA 3.29Å; D535-G538 WeakPolarHBondContact OD2-CA 3.49Å; D535-G538 PolarHBondContact OD2-N 3.1Å; G538-A542 VanDerWaalsContact O-CB 3.31Å; G538-A542 WeakPolarHBondContact O-CB 3.34Å; G538-A542 PolarHBondContact O-N 3.42Å
539	K	67.5	Low	66.3	Low	43 Å²	43	71.3 Å²	71.3	19%	0.187	33%	0.331	C	S	.	.	H	α-helix	trans	-55.5	-55.3	170	-88.1	171.1	-84.5	-164.6	0	111.7	Y530 I531 L534 D535 I536 L537 I541 A542 I543	Y530-K539 WeakPolarHBondContact O-CE 3.3Å; I531-K539 HydrophobicContact CG1-CD 3.9Å; I531-K539 HydrophobicContact CG1-CG 4.07Å; L534-K539 VanDerWaalsContact C-NZ 3.33Å; L534-K539 WeakPolarHBondContact O-CE 3.26Å; L534-K539 PolarHBondContact O-NZ 2.95Å; D535-K539 VanDerWaalsContact C-CE 3.41Å; D535-K539 WeakPolarHBondContact O-CB 3.38Å; D535-K539 WeakPolarHBondContact O-CE 3.33Å; D535-K539 PolarHBondContact O-N 3.07Å; I536-K539 WeakPolarHBondContact O-CB 3.46Å; L537-K539 VanDerWaalsContact C-N 3.34Å; L537-K539 PolarHBondContact O-N 3.23Å; K539-I541 PolarHBondContact O-N 2.91Å; K539-A542 PolarHBondContact O-N 3.16Å; K539-I543 WeakPolarHBondContact O-CB 3.41Å; K539-I543 VanDerWaalsContact O-CG1 3.24Å; K539-I543 WeakPolarHBondContact O-CG1 3.36Å; K539-I543 PolarHBondContact O-N 2.94Å
540	L	64.9	Low	65.6	Low	102 Å²	102	74.3 Å²	74.3	53%	0.534	36%	0.356	S	S	.	.	H	α-helix	trans	-59.1	-45.2	-178.8	-80.1	164.5	0	0	0	112.7	I536 L537 R544	I536-L540 HydrophobicContact CG2-CD1 4.11Å; I536-L540 WeakPolarHBondContact O-CB 3.44Å; I536-L540 WeakPolarHBondContact O-CG 3.3Å; I536-L540 PolarHBondContact O-N 2.98Å; L537-L540 PolarHBondContact O-N 3.1Å; L540-R544 WeakPolarHBondContact O-CB 3.33Å; L540-R544 PolarHBondContact O-N 3.27Å
541	I	69.9	Low	64.6	Low	90 Å²	90	79.8 Å²	79.8	46%	0.462	39%	0.394	S	S	.	.	H	α-helix	trans	-64.4	-41.9	179.4	-68.9	168.7	0	0	0	111	L537 K539 K545	L537-I541 HydrophobicContact CD1-CD1 4.48Å; L537-I541 HydrophobicContact CD2-CD1 4.3Å; L537-I541 HydrophobicContact CG-CD1 3.88Å; L537-I541 WeakPolarHBondContact O-CB 3.42Å; L537-I541 VanDerWaalsContact O-CG1 3.3Å; L537-I541 WeakPolarHBondContact O-CG1 3.33Å; L537-I541 PolarHBondContact O-N 2.95Å; K539-I541 PolarHBondContact O-N 2.91Å; I541-K545 WeakPolarHBondContact O-CG 3.24Å; I541-K545 PolarHBondContact O-N 3.26Å; I541-K545 VanDerWaalsContact O-N 3.16Å
542	A	66.8	Low	63.8	Low	4 Å²	4	80.8 Å²	80.8	3%	0.033	41%	0.411	C	S	.	.	H	α-helix	trans	-75.1	-35	-179.9	0	0	0	0	0	112.9	L527 Y530 G538 K539 K545 L546	L527-A542 HydrophobicContact CD1-CB 4.3Å; L527-A542 HydrophobicContact CD2-CB 3.48Å; L527-A542 VanDerWaalsContact CD2-CB 3.48Å; L527-A542 HydrophobicContact CG-CB 3.69Å; Y530-A542 HydrophobicContact CD2-CB 4.24Å; Y530-A542 HydrophobicContact CE2-CB 4.39Å; G538-A542 VanDerWaalsContact O-CB 3.31Å; G538-A542 WeakPolarHBondContact O-CB 3.34Å; G538-A542 PolarHBondContact O-N 3.42Å; K539-A542 PolarHBondContact O-N 3.16Å; A542-K545 WeakPolarHBondContact O-CB 3.43Å; A542-K545 PolarHBondContact O-N 3.46Å; A542-L546 PolarHBondContact O-N 2.95Å
543	I	68.3	Low	63	Low	39 Å²	39	81.9 Å²	81.9	20%	0.2	43%	0.427	C	S	.	.	H	α-helix	trans	-63.1	-44.6	170.4	-69.4	164.5	0	0	0	110.3	L527 K539 K545 L546 L547 V572 I576	L527-I543 HydrophobicContact CD2-CG1 3.88Å; K539-I543 WeakPolarHBondContact O-CB 3.41Å; K539-I543 VanDerWaalsContact O-CG1 3.24Å; K539-I543 WeakPolarHBondContact O-CG1 3.36Å; K539-I543 PolarHBondContact O-N 2.94Å; I543-K545 PolarHBondContact O-N 3.21Å; I543-L546 PolarHBondContact O-N 3.41Å; I543-L546 VanDerWaalsContact O-N 3.1Å; I543-L547 HydrophobicContact CG2-CD1 3.9Å; I543-L547 HydrophobicContact CG2-CG 4.37Å; I543-L547 WeakPolarHBondContact O-CG 3.33Å; I543-L547 PolarHBondContact O-N 2.81Å; I543-V572 HydrophobicContact CG2-CG1 4.2Å; I543-I576 HydrophobicContact CD1-CD1 3.74Å; I543-I576 HydrophobicContact CD1-CG1 4.4Å; I543-I576 HydrophobicContact CG1-CD1 4.1Å; I543-I576 HydrophobicContact CG2-CD1 4.43Å
544	R	69.3	Low	62.3	Low	202 Å²	202	82.9 Å²	82.9	76%	0.762	43%	0.428	S	S	*	.	H	α-helix	trans	-59.8	-29.8	175.4	-175.8	174.5	178.3	177.4	1	112.7	L540	L540-R544 WeakPolarHBondContact O-CB 3.33Å; L540-R544 PolarHBondContact O-N 3.27Å
545	K	67.5	Low	61.8	Low	100 Å²	100	84.8 Å²	84.8	44%	0.435	44%	0.438	S	S	.	.	H	α-helix	trans	-72.3	-44.6	171.9	-74.2	-173.9	174.7	-156.6	0	112.5	I541 A542 I543 L547 Y548 Y549	I541-K545 WeakPolarHBondContact O-CG 3.24Å; I541-K545 PolarHBondContact O-N 3.26Å; I541-K545 VanDerWaalsContact O-N 3.16Å; A542-K545 WeakPolarHBondContact O-CB 3.43Å; A542-K545 PolarHBondContact O-N 3.46Å; I543-K545 PolarHBondContact O-N 3.21Å; K545-L547 VanDerWaalsContact C-N 3.28Å; K545-L547 PolarHBondContact O-N 2.96Å; K545-Y548 PolarHBondContact O-N 3.26Å; K545-Y548 VanDerWaalsContact O-N 3.1Å; K545-Y549 VanDerWaalsContact O-CD2 3.26Å; K545-Y549 WeakPolarHBondContact O-CD2 3.22Å
546	L	65.1	Low	61.4	Low	17 Å²	17	82.4 Å²	82.4	9%	0.089	43%	0.425	C	S	.	.	H	α-helix	trans	-59.9	-39	174.8	-75	-171.5	0	0	0	112.3	L520 T523 L527 A542 I543 Y548 Y549 F575	L520-L546 HydrophobicContact CD2-CD2 4.45Å; T523-L546 HydrophobicContact CG2-CD2 3.68Å; T523-L546 HydrophobicContact CG2-CG 4.11Å; L527-L546 HydrophobicContact CD1-CD1 3.31Å; L527-L546 HydrophobicContact CD1-CG 3.87Å; A542-L546 PolarHBondContact O-N 2.95Å; I543-L546 PolarHBondContact O-N 3.41Å; I543-L546 VanDerWaalsContact O-N 3.1Å; L546-Y548 PolarHBondContact O-N 2.96Å; L546-Y548 VanDerWaalsContact O-N 3.08Å; L546-Y549 HydrophobicContact CD2-CD2 4.47Å; L546-Y549 PolarHBondContact O-N 3.27Å; L546-Y549 VanDerWaalsContact O-N 3.14Å; L546-F575 HydrophobicContact CD1-CD1 3.73Å; L546-F575 HydrophobicContact CD1-CE1 3.57Å; L546-F575 HydrophobicContact CD1-CG 4.48Å; L546-F575 HydrophobicContact CD1-CZ 4.24Å
547	L	63.3	Low	60.9	Low	116 Å²	116	81 Å²	81	61%	0.607	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-6.4	176	-71.9	167.9	0	0	0	114.8	I543 K545 V572	I543-L547 HydrophobicContact CG2-CD1 3.9Å; I543-L547 HydrophobicContact CG2-CG 4.37Å; I543-L547 WeakPolarHBondContact O-CG 3.33Å; I543-L547 PolarHBondContact O-N 2.81Å; K545-L547 VanDerWaalsContact C-N 3.28Å; K545-L547 PolarHBondContact O-N 2.96Å; L547-V572 HydrophobicContact CD2-CB 4.21Å; L547-V572 HydrophobicContact CD2-CG1 4.38Å; L547-V572 HydrophobicContact CD2-CG2 3.9Å; L547-V572 HydrophobicContact CG-CG2 4.46Å
548	Y	63.8	Low	60.9	Low	212 Å²	212	77.9 Å²	77.9	83%	0.831	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.6	-2.4	176	-155.6	-97.8	0	0	0	113.4	K545 L546	K545-Y548 PolarHBondContact O-N 3.26Å; K545-Y548 VanDerWaalsContact O-N 3.1Å; L546-Y548 PolarHBondContact O-N 2.96Å; L546-Y548 VanDerWaalsContact O-N 3.08Å
549	Y	57.2	Low	60.7	Low	87 Å²	87	84.4 Å²	84.4	34%	0.341	43%	0.426	S	S	.	.	S	Bend	trans	-77.1	145.1	166.9	-75.5	-92.3	0	0	0	109.8	L519 L520 K545 L546 T551	L519-Y549 HydrophobicContact CD2-CE1 4.31Å; L519-Y549 WeakPolarHBondContact CD2-OH 3.48Å; L520-Y549 HydrophobicContact CD2-CD1 4.4Å; L520-Y549 HydrophobicContact CD2-CE1 4.44Å; K545-Y549 VanDerWaalsContact O-CD2 3.26Å; K545-Y549 WeakPolarHBondContact O-CD2 3.22Å; L546-Y549 HydrophobicContact CD2-CD2 4.47Å; L546-Y549 PolarHBondContact O-N 3.27Å; L546-Y549 VanDerWaalsContact O-N 3.14Å; Y549-T551 PolarHBondContact O-N 3.46Å
550	P	57.1	Low	60.1	Low	110 Å²	110	82.5 Å²	82.5	71%	0.714	42%	0.418	S	S	*	.			trans	-59.4	132.3	-180	24.2	-33.8	0	0	0	110.9	G552	P550-G552 PolarHBondContact O-N 3.26Å; P550-G552 VanDerWaalsContact O-N 3.08Å
551	T	51.7	Low	59.3	Low	151 Å²	151	80.7 Å²	80.7	93%	0.926	42%	0.415	S	S	*	.	S	Bend	trans	-69.1	103.5	-175.8	47.3	0	0	0	0	111.6	Y549	Y549-T551 PolarHBondContact O-N 3.46Å
552	G	53.4	Low	58.1	Low	49 Å²	49	77.8 Å²	77.8	51%	0.505	40%	0.404	S	S	.	.	S	Bend	trans	-153.6	161	167.8	0	0	0	0	0	109	P550 Q554	P550-G552 PolarHBondContact O-N 3.26Å; P550-G552 VanDerWaalsContact O-N 3.08Å; G552-Q554 PolarHBondContact O-N 2.81Å
553	A	49.1	Very low	57.4	Low	63 Å²	63	78.7 Å²	78.7	52%	0.521	41%	0.407	S	S	.	.			trans	-64.5	105.5	-178.6	0	0	0	0	0	110.6	L568	A553-L568 HydrophobicContact CB-CD1 4.46Å
554	Q	54.4	Low	56.6	Low	72 Å²	72	87.6 Å²	87.6	34%	0.336	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	124.5	178.1	-67.9	-64.1	-12.5	0	0	109.8	L520 G552 F556	L520-Q554 HydrophobicContact CD1-CB 4.24Å; L520-Q554 VanDerWaalsContact CD1-CD 3.5Å; L520-Q554 HydrophobicContact CD1-CG 3.93Å; G552-Q554 PolarHBondContact O-N 2.81Å; Q554-F556 HydrophobicContact CB-CD2 4.25Å; Q554-F556 HydrophobicContact CB-CE2 3.74Å; Q554-F556 HydrophobicContact CB-CZ 4.15Å; Q554-F556 WeakPolarHBondContact O-CD2 3.3Å; Q554-F556 PolarHBondContact O-N 3.14Å
555	L	50.4	Low	55.7	Low	100 Å²	100	79.8 Å²	79.8	52%	0.524	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	90.5	179.4	-165.1	80	0	0	0	110	T557 I566 L568	L555-T557 HydrophobicContact CD2-CG2 4.13Å; L555-T557 HydrophobicContact CG-CG2 4.36Å; L555-T557 PolarHBondContact O-N 3.02Å; L555-I566 HydrophobicContact CD1-CG2 3.46Å; L555-I566 VanDerWaalsContact CD1-CG2 3.46Å; L555-I566 HydrophobicContact CG-CG2 3.99Å; L555-L568 HydrophobicContact CD1-CD1 4.08Å
556	F	57.9	Low	55	Low	15 Å²	15	80.3 Å²	80.3	7%	0.066	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	99.7	178.3	-66.8	-89.7	0	0	0	110.2	L520 A524 Q554 F558 L567 V569 F575	L520-F556 HydrophobicContact CB-CD1 4.4Å; L520-F556 HydrophobicContact CB-CE1 3.99Å; A524-F556 HydrophobicContact CB-CD1 4.03Å; A524-F556 HydrophobicContact CB-CE1 4.26Å; Q554-F556 HydrophobicContact CB-CD2 4.25Å; Q554-F556 HydrophobicContact CB-CE2 3.74Å; Q554-F556 HydrophobicContact CB-CZ 4.15Å; Q554-F556 WeakPolarHBondContact O-CD2 3.3Å; Q554-F556 PolarHBondContact O-N 3.14Å; F556-F558 HydrophobicContact CB-CD2 4.23Å; F556-F558 HydrophobicContact CB-CE2 3.67Å; F556-F558 HydrophobicContact CB-CZ 4.43Å; F556-F558 PolarHBondContact O-N 3.42Å; F556-L567 HydrophobicContact CB-CB 4.21Å; F556-L567 PolarHBondContact N-O 2.97Å; F556-L567 VanDerWaalsContact N-O 3.08Å; F556-L567 PolarHBondContact O-N 2.87Å; F556-V569 HydrophobicContact CD2-CB 4.32Å; F556-V569 HydrophobicContact CD2-CG2 4.16Å; F556-V569 HydrophobicContact CE2-CB 4.29Å; F556-F575 AromaticContact CD1-CE2 3.75Å; F556-F575 HydrophobicContact CD1-CE2 3.75Å; F556-F575 HydrophobicContact CD1-CZ 4.33Å; F556-F575 HydrophobicContact CD2-CD2 4.01Å; F556-F575 AromaticContact CD2-CE2 3.78Å; F556-F575 HydrophobicContact CD2-CE2 3.78Å; F556-F575 HydrophobicContact CE1-CD2 4.41Å; F556-F575 AromaticContact CE1-CE2 3.57Å; F556-F575 HydrophobicContact CE1-CE2 3.57Å; F556-F575 AromaticContact CE1-CZ 3.97Å; F556-F575 HydrophobicContact CE1-CZ 3.97Å; F556-F575 AromaticContact CE2-CD2 3.67Å; F556-F575 HydrophobicContact CE2-CD2 3.67Å; F556-F575 AromaticContact CE2-CE2 3.6Å; F556-F575 HydrophobicContact CE2-CE2 3.6Å; F556-F575 AromaticContact CG-CE2 3.85Å; F556-F575 HydrophobicContact CG-CE2 3.85Å; F556-F575 AromaticContact CZ-CD2 3.89Å; F556-F575 HydrophobicContact CZ-CD2 3.89Å; F556-F575 AromaticContact CZ-CE2 3.49Å; F556-F575 HydrophobicContact CZ-CE2 3.49Å; F556-F575 VanDerWaalsContact CZ-CE2 3.49Å; F556-F575 HydrophobicContact CZ-CZ 4.14Å
557	T	54.5	Low	54.6	Low	48 Å²	48	81 Å²	81	29%	0.294	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	96.3	175.2	45.3	0	0	0	0	110.3	E521 L555 R559 I566	E521-T557 VanDerWaalsContact CD-O 3.22Å; E521-T557 PolarHBondContact OE1-OG1 2.62Å; L555-T557 HydrophobicContact CD2-CG2 4.13Å; L555-T557 HydrophobicContact CG-CG2 4.36Å; L555-T557 PolarHBondContact O-N 3.02Å; T557-R559 PolarHBondContact O-N 2.91Å; T557-I566 HydrophobicContact CG2-CG1 4.4Å
558	F	61.9	Low	54	Low	10 Å²	10	80.5 Å²	80.5	4%	0.044	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	119.8	175.2	-68.9	-95.8	0	0	0	109.4	A524 Y525 F556 F563 R564 G565 L567 L579	A524-F558 HydrophobicContact CB-CE1 3.83Å; A524-F558 HydrophobicContact CB-CZ 3.72Å; Y525-F558 HydrophobicContact CD1-CD1 4.14Å; Y525-F558 HydrophobicContact CD1-CE1 4.33Å; Y525-F558 AromaticContact CE1-CD1 3.72Å; Y525-F558 HydrophobicContact CE1-CD1 3.72Å; Y525-F558 HydrophobicContact CE1-CE1 4.36Å; F556-F558 HydrophobicContact CB-CD2 4.23Å; F556-F558 HydrophobicContact CB-CE2 3.67Å; F556-F558 HydrophobicContact CB-CZ 4.43Å; F556-F558 PolarHBondContact O-N 3.42Å; F558-F563 HydrophobicContact CB-CB 3.91Å; F558-F563 WeakPolarHBondContact CB-O 3.12Å; F558-F563 HydrophobicContact CD1-CB 4.44Å; F558-R564 WeakPolarHBondContact O-CA 3.4Å; F558-G565 PolarHBondContact N-O 2.68Å; F558-G565 PolarHBondContact O-N 3.25Å; F558-L567 HydrophobicContact CD2-CG 4.46Å; F558-L567 HydrophobicContact CE2-CB 4.33Å; F558-L567 HydrophobicContact CE2-CD1 3.78Å; F558-L567 HydrophobicContact CE2-CG 3.93Å; F558-L567 HydrophobicContact CZ-CD1 4.3Å; F558-L579 HydrophobicContact CZ-CD2 4.17Å
559	R	60	Low	53.7	Low	143 Å²	143	70.8 Å²	70.8	54%	0.54	39%	0.39	S	S	.	.			trans	-92.2	-35.9	-168.7	-78.1	-179.9	141.2	86.1	1.4	115.1	E521 Y525 T557	E521-R559 IonicContact OE1-CZ 2.7Å; E521-R559 IonicContact OE1-NH1 3.79Å; E521-R559 PolarHBondContact OE1-NH1 3.36Å; Y525-R559 PolarHBondContact OH-N 3.06Å; T557-R559 PolarHBondContact O-N 2.91Å
560	G	54.9	Low	53.8	Low	2 Å²	2	72.9 Å²	72.9	2%	0.021	41%	0.407	C	S	.	.	S	Bend	trans	-63.8	150	-172	0	0	0	0	0	114.3	A562 F563 R564	G560-A562 PolarHBondContact O-N 3.32Å; G560-F563 CarbonylContact O-C 3.57Å; G560-F563 PolarHBondContact O-N 3.41Å; G560-R564 PolarHBondContact O-N 3.1Å; G560-R564 VanDerWaalsContact O-N 3.09Å
561	S	48	Very low	54.2	Low	65 Å²	65	70.7 Å²	70.7	46%	0.455	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-25.3	179.9	68.8	0	0	0	0	115.2	K589	S561-K589 PolarHBondContact O-NZ 3.3Å
562	A	45.7	Very low	54.7	Low	28 Å²	28	65.2 Å²	65.2	23%	0.231	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-30.6	172.8	0	0	0	0	0	113.7	G560 F586	G560-A562 PolarHBondContact O-N 3.32Å; A562-F586 HydrophobicContact CB-CD2 4.34Å; A562-F586 HydrophobicContact CB-CE2 3.93Å
563	F	52.4	Low	55.2	Low	24 Å²	24	65.7 Å²	65.7	11%	0.105	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-123.9	10.1	-162.5	-65	-71.3	0	0	0	115.2	Y525 L528 F558 G560 G565 I582 F586	Y525-F563 HydrophobicContact CE1-CD2 4.46Å; L528-F563 HydrophobicContact CD2-CD1 4.37Å; L528-F563 HydrophobicContact CD2-CE1 3.47Å; L528-F563 VanDerWaalsContact CD2-CE1 3.47Å; L528-F563 HydrophobicContact CD2-CE2 4.34Å; L528-F563 HydrophobicContact CD2-CZ 3.44Å; L528-F563 VanDerWaalsContact CD2-CZ 3.44Å; F558-F563 HydrophobicContact CB-CB 3.91Å; F558-F563 WeakPolarHBondContact CB-O 3.12Å; F558-F563 HydrophobicContact CD1-CB 4.44Å; G560-F563 CarbonylContact O-C 3.57Å; G560-F563 PolarHBondContact O-N 3.41Å; F563-G565 PolarHBondContact O-N 2.66Å; F563-I582 HydrophobicContact CD1-CG2 3.69Å; F563-I582 HydrophobicContact CE1-CG2 3.57Å; F563-F586 HydrophobicContact CE1-CB 4.1Å; F563-F586 AromaticContact CE1-CD2 3.56Å; F563-F586 HydrophobicContact CE1-CD2 3.56Å; F563-F586 HydrophobicContact CE1-CE2 4.06Å; F563-F586 AromaticContact CE1-CG 3.86Å; F563-F586 HydrophobicContact CE1-CG 3.86Å; F563-F586 AromaticContact CE2-CD2 3.97Å; F563-F586 HydrophobicContact CE2-CD2 3.97Å; F563-F586 AromaticContact CE2-CE2 3.59Å; F563-F586 HydrophobicContact CE2-CE2 3.59Å; F563-F586 HydrophobicContact CE2-CZ 4.06Å; F563-F586 HydrophobicContact CZ-CB 4.39Å; F563-F586 HydrophobicContact CZ-CD1 4.09Å; F563-F586 AromaticContact CZ-CD2 3.22Å; F563-F586 HydrophobicContact CZ-CD2 3.22Å; F563-F586 HydrophobicContact CZ-CE1 4.1Å; F563-F586 AromaticContact CZ-CE2 3.24Å; F563-F586 HydrophobicContact CZ-CE2 3.24Å; F563-F586 AromaticContact CZ-CG 3.66Å; F563-F586 HydrophobicContact CZ-CG 3.66Å; F563-F586 AromaticContact CZ-CZ 3.69Å; F563-F586 HydrophobicContact CZ-CZ 3.69Å
564	R	51.8	Low	56.1	Low	226 Å²	226	65 Å²	65	85%	0.853	35%	0.351	S	S	*	.			trans	-55.1	100.9	-172	-163.3	175.8	-171.2	177.1	2.9	112.7	F558 G560	F558-R564 WeakPolarHBondContact O-CA 3.4Å; G560-R564 PolarHBondContact O-N 3.1Å; G560-R564 VanDerWaalsContact O-N 3.09Å
565	G	50.3	Low	56.7	Low	37 Å²	37	61.7 Å²	61.7	38%	0.381	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-173.6	154.4	-171.1	0	0	0	0	0	112.3	F558 F563	F558-G565 PolarHBondContact N-O 2.68Å; F558-G565 PolarHBondContact O-N 3.25Å; F563-G565 PolarHBondContact O-N 2.66Å
566	I	52.9	Low	57.4	Low	112 Å²	112	60.1 Å²	60.1	57%	0.574	33%	0.327	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.1	118.4	175.8	-63.5	175.4	0	0	0	107.1	L555 T557	L555-I566 HydrophobicContact CD1-CG2 3.46Å; L555-I566 VanDerWaalsContact CD1-CG2 3.46Å; L555-I566 HydrophobicContact CG-CG2 3.99Å; T557-I566 HydrophobicContact CG2-CG1 4.4Å
567	L	55	Low	57.9	Low	30 Å²	30	65 Å²	65	16%	0.157	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	106.4	160.4	-63.3	-175.5	0	0	0	108.3	F556 F558 V569 S578 I582	F556-L567 HydrophobicContact CB-CB 4.21Å; F556-L567 PolarHBondContact N-O 2.97Å; F556-L567 VanDerWaalsContact N-O 3.08Å; F556-L567 PolarHBondContact O-N 2.87Å; F558-L567 HydrophobicContact CD2-CG 4.46Å; F558-L567 HydrophobicContact CE2-CB 4.33Å; F558-L567 HydrophobicContact CE2-CD1 3.78Å; F558-L567 HydrophobicContact CE2-CG 3.93Å; F558-L567 HydrophobicContact CZ-CD1 4.3Å; L567-V569 HydrophobicContact CB-CG2 3.66Å; L567-S578 VanDerWaalsContact CD1-CB 3.43Å; L567-I582 HydrophobicContact CD1-CD1 3.76Å; L567-I582 HydrophobicContact CD2-CD1 4.26Å; L567-I582 HydrophobicContact CG-CD1 4.16Å
568	L	51.7	Low	58.6	Low	106 Å²	106	64 Å²	64	56%	0.555	35%	0.349	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.1	126.2	158.1	-172.6	78.1	0	0	0	107.4	A553 L555	A553-L568 HydrophobicContact CB-CD1 4.46Å; L555-L568 HydrophobicContact CD1-CD1 4.08Å
569	V	58.3	Low	58.8	Low	9 Å²	9	63.6 Å²	63.6	6%	0.055	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	108.3	-170.4	-178.6	0	0	0	0	111.8	F556 L567 S571 F575	F556-V569 HydrophobicContact CD2-CB 4.32Å; F556-V569 HydrophobicContact CD2-CG2 4.16Å; F556-V569 HydrophobicContact CE2-CB 4.29Å; L567-V569 HydrophobicContact CB-CG2 3.66Å; V569-S571 WeakPolarHBondContact CG1-O 3.2Å; V569-F575 HydrophobicContact CG1-CB 3.76Å; V569-F575 HydrophobicContact CG1-CD2 4.27Å; V569-F575 HydrophobicContact CG2-CD2 4.2Å
570	D	59.3	Low	59.2	Low	130 Å²	130	63.2 Å²	63.2	70%	0.695	35%	0.349	S	S	*	.	S	Bend	trans	-87	-7.9	-179.5	-43.5	-61.4	0	0	0	113.1
571	S	63.8	Low	59.9	Low	64 Å²	64	67.3 Å²	67.3	45%	0.448	37%	0.374	S	S	.	.	S	Bend	trans	-156.7	144.2	-179.2	173.9	0	0	0	0	112.5	V569 A573 S574 F575	V569-S571 WeakPolarHBondContact CG1-O 3.2Å; S571-A573 PolarHBondContact O-N 3.32Å; S571-A573 VanDerWaalsContact O-N 3.13Å; S571-A573 PolarHBondContact OG-N 3.34Å; S571-S574 WeakPolarHBondContact O-CA 3.48Å; S571-S574 WeakPolarHBondContact O-CB 3.27Å; S571-S574 PolarHBondContact O-N 2.94Å; S571-F575 PolarHBondContact O-N 3.25Å
572	V	64.2	Low	60.7	Low	37 Å²	37	65.6 Å²	65.6	22%	0.224	36%	0.359	C	S	.	.	H	α-helix	trans	-57.3	-26.8	174.1	-179.6	0	0	0	0	112.2	I543 L547 F575 I576	I543-V572 HydrophobicContact CG2-CG1 4.2Å; L547-V572 HydrophobicContact CD2-CB 4.21Å; L547-V572 HydrophobicContact CD2-CG1 4.38Å; L547-V572 HydrophobicContact CD2-CG2 3.9Å; L547-V572 HydrophobicContact CG-CG2 4.46Å; V572-F575 WeakPolarHBondContact O-CB 3.3Å; V572-F575 PolarHBondContact O-N 3.42Å; V572-I576 HydrophobicContact CG1-CD1 3.99Å; V572-I576 WeakPolarHBondContact O-CD1 3.34Å; V572-I576 VanDerWaalsContact O-CG1 3.31Å; V572-I576 WeakPolarHBondContact O-CG1 3.3Å; V572-I576 PolarHBondContact O-N 2.9Å; V572-I576 VanDerWaalsContact O-N 3.09Å
573	A	63.7	Low	61.7	Low	59 Å²	59	66.4 Å²	66.4	49%	0.488	36%	0.357	S	S	.	.	H	α-helix	trans	-65.9	-44.8	172.2	0	0	0	0	0	112	S571 F575 I576 L577	S571-A573 PolarHBondContact O-N 3.32Å; S571-A573 VanDerWaalsContact O-N 3.13Å; S571-A573 PolarHBondContact OG-N 3.34Å; A573-F575 VanDerWaalsContact C-N 3.35Å; A573-I576 PolarHBondContact O-N 3.39Å; A573-L577 WeakPolarHBondContact O-CG 3.47Å; A573-L577 PolarHBondContact O-N 3.41Å; A573-L577 VanDerWaalsContact O-N 3.09Å
574	S	66.2	Low	62.1	Low	47 Å²	47	68.8 Å²	68.8	33%	0.329	37%	0.371	S	S	.	.	H	α-helix	trans	-62.2	-42.9	173.3	-177.1	0	0	0	0	110.7	S571 I576 L577 S578	S571-S574 WeakPolarHBondContact O-CA 3.48Å; S571-S574 WeakPolarHBondContact O-CB 3.27Å; S571-S574 PolarHBondContact O-N 2.94Å; S574-I576 VanDerWaalsContact C-N 3.34Å; S574-I576 PolarHBondContact O-N 2.85Å; S574-L577 PolarHBondContact O-N 3.29Å; S574-S578 PolarHBondContact O-N 3.36Å; S574-S578 PolarHBondContact O-OG 3.48Å; S574-S578 VanDerWaalsContact O-OG 3.13Å
575	F	67.1	Low	62.7	Low	3 Å²	3	63 Å²	63	1%	0.013	36%	0.356	C	S	.	.	H	α-helix	trans	-52	-49.6	174.7	-165.9	-109.6	0	0	0	112.9	A524 L527 L546 F556 V569 S571 V572 A573 S578 L579	A524-F575 HydrophobicContact CB-CE2 4.3Å; A524-F575 HydrophobicContact CB-CZ 3.65Å; L527-F575 HydrophobicContact CB-CE1 4.48Å; L527-F575 HydrophobicContact CD1-CE1 3.78Å; L546-F575 HydrophobicContact CD1-CD1 3.73Å; L546-F575 HydrophobicContact CD1-CE1 3.57Å; L546-F575 HydrophobicContact CD1-CG 4.48Å; L546-F575 HydrophobicContact CD1-CZ 4.24Å; F556-F575 AromaticContact CD1-CE2 3.75Å; F556-F575 HydrophobicContact CD1-CE2 3.75Å; F556-F575 HydrophobicContact CD1-CZ 4.33Å; F556-F575 HydrophobicContact CD2-CD2 4.01Å; F556-F575 AromaticContact CD2-CE2 3.78Å; F556-F575 HydrophobicContact CD2-CE2 3.78Å; F556-F575 HydrophobicContact CE1-CD2 4.41Å; F556-F575 AromaticContact CE1-CE2 3.57Å; F556-F575 HydrophobicContact CE1-CE2 3.57Å; F556-F575 AromaticContact CE1-CZ 3.97Å; F556-F575 HydrophobicContact CE1-CZ 3.97Å; F556-F575 AromaticContact CE2-CD2 3.67Å; F556-F575 HydrophobicContact CE2-CD2 3.67Å; F556-F575 AromaticContact CE2-CE2 3.6Å; F556-F575 HydrophobicContact CE2-CE2 3.6Å; F556-F575 AromaticContact CG-CE2 3.85Å; F556-F575 HydrophobicContact CG-CE2 3.85Å; F556-F575 AromaticContact CZ-CD2 3.89Å; F556-F575 HydrophobicContact CZ-CD2 3.89Å; F556-F575 AromaticContact CZ-CE2 3.49Å; F556-F575 HydrophobicContact CZ-CE2 3.49Å; F556-F575 VanDerWaalsContact CZ-CE2 3.49Å; F556-F575 HydrophobicContact CZ-CZ 4.14Å; V569-F575 HydrophobicContact CG1-CB 3.76Å; V569-F575 HydrophobicContact CG1-CD2 4.27Å; V569-F575 HydrophobicContact CG2-CD2 4.2Å; S571-F575 PolarHBondContact O-N 3.25Å; V572-F575 WeakPolarHBondContact O-CB 3.3Å; V572-F575 PolarHBondContact O-N 3.42Å; A573-F575 VanDerWaalsContact C-N 3.35Å; F575-S578 PolarHBondContact O-N 2.69Å; F575-L579 HydrophobicContact CD1-CD1 3.88Å; F575-L579 HydrophobicContact CD1-CG 4.31Å; F575-L579 HydrophobicContact CE1-CD1 3.33Å; F575-L579 HydrophobicContact CE1-CG 4Å; F575-L579 HydrophobicContact CZ-CD1 3.82Å; F575-L579 HydrophobicContact CZ-CD2 4.49Å; F575-L579 HydrophobicContact CZ-CG 4.18Å; F575-L579 WeakPolarHBondContact O-CB 3.37Å; F575-L579 WeakPolarHBondContact O-CG 3.15Å; F575-L579 PolarHBondContact O-N 2.79Å
576	I	66.7	Low	63	Low	68 Å²	68	62.1 Å²	62.1	35%	0.349	34%	0.342	S	S	.	.	H	α-helix	trans	-69.3	-37.3	-177	-67.7	164.8	0	0	0	111	I543 V572 A573 S574 K580	I543-I576 HydrophobicContact CD1-CD1 3.74Å; I543-I576 HydrophobicContact CD1-CG1 4.4Å; I543-I576 HydrophobicContact CG1-CD1 4.1Å; I543-I576 HydrophobicContact CG2-CD1 4.43Å; V572-I576 HydrophobicContact CG1-CD1 3.99Å; V572-I576 WeakPolarHBondContact O-CD1 3.34Å; V572-I576 VanDerWaalsContact O-CG1 3.31Å; V572-I576 WeakPolarHBondContact O-CG1 3.3Å; V572-I576 PolarHBondContact O-N 2.9Å; V572-I576 VanDerWaalsContact O-N 3.09Å; A573-I576 PolarHBondContact O-N 3.39Å; S574-I576 VanDerWaalsContact C-N 3.34Å; S574-I576 PolarHBondContact O-N 2.85Å; I576-K580 WeakPolarHBondContact O-CB 3.31Å; I576-K580 PolarHBondContact O-N 2.95Å
577	L	67.6	Low	63.1	Low	117 Å²	117	59.7 Å²	59.7	61%	0.613	33%	0.327	S	S	*	.	H	α-helix	trans	-64.5	-47.6	173.6	-70.9	170.2	0	0	0	111.4	A573 S574 L579 K580 V581	A573-L577 WeakPolarHBondContact O-CG 3.47Å; A573-L577 PolarHBondContact O-N 3.41Å; A573-L577 VanDerWaalsContact O-N 3.09Å; S574-L577 PolarHBondContact O-N 3.29Å; L577-L579 PolarHBondContact O-N 3.37Å; L577-K580 WeakPolarHBondContact O-CB 3.33Å; L577-K580 PolarHBondContact O-N 3.48Å; L577-K580 VanDerWaalsContact O-N 3.09Å; L577-V581 PolarHBondContact O-N 2.92Å
578	S	68.5	Low	62.8	Low	28 Å²	28	67 Å²	67	20%	0.196	35%	0.354	C	S	.	.	H	α-helix	trans	-61.7	-42.1	176	-59.5	0	0	0	0	112.3	L567 S574 F575 K580 V581 I582	L567-S578 VanDerWaalsContact CD1-CB 3.43Å; S574-S578 PolarHBondContact O-N 3.36Å; S574-S578 PolarHBondContact O-OG 3.48Å; S574-S578 VanDerWaalsContact O-OG 3.13Å; F575-S578 PolarHBondContact O-N 2.69Å; S578-K580 VanDerWaalsContact C-N 3.28Å; S578-K580 PolarHBondContact O-N 2.99Å; S578-V581 PolarHBondContact O-N 2.84Å; S578-I582 WeakPolarHBondContact O-CB 3.25Å; S578-I582 WeakPolarHBondContact O-CG1 3.35Å; S578-I582 PolarHBondContact O-N 3.16Å
579	L	67.5	Low	62.7	Low	1 Å²	1	66.4 Å²	66.4	1%	0.005	35%	0.347	C	S	.	.	H	α-helix	trans	-64.1	-30.9	173.3	-75.4	-170.9	0	0	0	112.8	L527 L528 I531 F558 F575 L577 K583	L527-L579 HydrophobicContact CB-CD1 3.89Å; L528-L579 HydrophobicContact CB-CD2 4.49Å; I531-L579 HydrophobicContact CD1-CB 3.78Å; I531-L579 HydrophobicContact CD1-CD1 3.77Å; I531-L579 HydrophobicContact CD1-CG 4.45Å; F558-L579 HydrophobicContact CZ-CD2 4.17Å; F575-L579 HydrophobicContact CD1-CD1 3.88Å; F575-L579 HydrophobicContact CD1-CG 4.31Å; F575-L579 HydrophobicContact CE1-CD1 3.33Å; F575-L579 HydrophobicContact CE1-CG 4Å; F575-L579 HydrophobicContact CZ-CD1 3.82Å; F575-L579 HydrophobicContact CZ-CD2 4.49Å; F575-L579 HydrophobicContact CZ-CG 4.18Å; F575-L579 WeakPolarHBondContact O-CB 3.37Å; F575-L579 WeakPolarHBondContact O-CG 3.15Å; F575-L579 PolarHBondContact O-N 2.79Å; L577-L579 PolarHBondContact O-N 3.37Å; L579-K583 WeakPolarHBondContact O-CB 3.48Å; L579-K583 PolarHBondContact O-N 2.92Å
580	K	67.6	Low	62.2	Low	135 Å²	135	68.4 Å²	68.4	59%	0.587	36%	0.357	S	S	*	.	H	α-helix	trans	-68.6	-44.7	173.9	-168.9	177.3	178.8	-176.3	0	111.3	I576 L577 S578 K583 D584	I576-K580 WeakPolarHBondContact O-CB 3.31Å; I576-K580 PolarHBondContact O-N 2.95Å; L577-K580 WeakPolarHBondContact O-CB 3.33Å; L577-K580 PolarHBondContact O-N 3.48Å; L577-K580 VanDerWaalsContact O-N 3.09Å; S578-K580 VanDerWaalsContact C-N 3.28Å; S578-K580 PolarHBondContact O-N 2.99Å; K580-K583 WeakPolarHBondContact O-CB 3.33Å; K580-K583 PolarHBondContact O-N 3.01Å; K580-D584 PolarHBondContact O-N 2.79Å
581	V	68.7	Low	61.4	Low	88 Å²	88	68 Å²	68	53%	0.533	35%	0.354	S	S	.	.	H	α-helix	trans	-61.5	-45.3	173.4	175.5	0	0	0	0	111.1	L577 S578 K583 D584 I585	L577-V581 PolarHBondContact O-N 2.92Å; S578-V581 PolarHBondContact O-N 2.84Å; V581-K583 VanDerWaalsContact C-N 3.33Å; V581-K583 PolarHBondContact O-N 2.86Å; V581-D584 PolarHBondContact O-N 3.23Å; V581-D584 VanDerWaalsContact O-N 3.16Å; V581-I585 HydrophobicContact CG1-CD1 3.95Å; V581-I585 WeakPolarHBondContact O-CG1 3.04Å; V581-I585 PolarHBondContact O-N 3.1Å
582	I	66.6	Low	60.5	Low	29 Å²	29	68 Å²	68	15%	0.149	35%	0.354	C	S	.	.	H	α-helix	trans	-60.6	-40.7	176.2	-74.6	173.2	0	0	0	111.6	L528 F563 L567 S578 D584 I585 F586	L528-I582 HydrophobicContact CD1-CG2 4.45Å; L528-I582 HydrophobicContact CD2-CG2 4.2Å; F563-I582 HydrophobicContact CD1-CG2 3.69Å; F563-I582 HydrophobicContact CE1-CG2 3.57Å; L567-I582 HydrophobicContact CD1-CD1 3.76Å; L567-I582 HydrophobicContact CD2-CD1 4.26Å; L567-I582 HydrophobicContact CG-CD1 4.16Å; S578-I582 WeakPolarHBondContact O-CB 3.25Å; S578-I582 WeakPolarHBondContact O-CG1 3.35Å; S578-I582 PolarHBondContact O-N 3.16Å; I582-D584 VanDerWaalsContact C-N 3.31Å; I582-D584 PolarHBondContact O-N 3.05Å; I582-I585 PolarHBondContact O-N 3.24Å; I582-F586 VanDerWaalsContact O-CB 3.23Å; I582-F586 WeakPolarHBondContact O-CB 3.18Å; I582-F586 PolarHBondContact O-N 3.22Å
583	K	65.7	Low	59.5	Low	45 Å²	45	71.2 Å²	71.2	20%	0.196	37%	0.369	C	S	.	.	H	α-helix	trans	-55.7	-46.6	174.3	-177.5	-157.4	67.7	64.6	0	110.8	L528 I531 L579 K580 V581 F586 F587	L528-K583 HydrophobicContact CD1-CB 4.34Å; I531-K583 HydrophobicContact CG2-CB 4.41Å; I531-K583 HydrophobicContact CG2-CD 3.75Å; I531-K583 HydrophobicContact CG2-CG 4.23Å; L579-K583 WeakPolarHBondContact O-CB 3.48Å; L579-K583 PolarHBondContact O-N 2.92Å; K580-K583 WeakPolarHBondContact O-CB 3.33Å; K580-K583 PolarHBondContact O-N 3.01Å; V581-K583 VanDerWaalsContact C-N 3.33Å; V581-K583 PolarHBondContact O-N 2.86Å; K583-F586 PolarHBondContact O-N 2.9Å; K583-F587 HydrophobicContact CD-CE2 4.33Å; K583-F587 HydrophobicContact CG-CD2 4.03Å; K583-F587 HydrophobicContact CG-CE2 3.87Å; K583-F587 VanDerWaalsContact O-CD2 3.24Å; K583-F587 WeakPolarHBondContact O-CD2 3.39Å; K583-F587 PolarHBondContact O-N 2.92Å
584	D	61.2	Low	58.4	Low	74 Å²	74	71.4 Å²	71.4	40%	0.396	38%	0.376	S	S	.	.	H	α-helix	trans	-68.2	-40.5	-178.8	-66.4	-41.6	0	0	0	112.3	K580 V581 I582 F586 F587 Y588	K580-D584 PolarHBondContact O-N 2.79Å; V581-D584 PolarHBondContact O-N 3.23Å; V581-D584 VanDerWaalsContact O-N 3.16Å; I582-D584 VanDerWaalsContact C-N 3.31Å; I582-D584 PolarHBondContact O-N 3.05Å; D584-F586 VanDerWaalsContact C-N 3.33Å; D584-F586 PolarHBondContact O-N 2.82Å; D584-F587 PolarHBondContact O-N 2.81Å; D584-Y588 PolarHBondContact O-N 3.22Å
585	I	63.6	Low	57.2	Low	103 Å²	103	73.7 Å²	73.7	53%	0.528	39%	0.393	S	S	.	.	H	α-helix	trans	-60.8	-41.6	171.1	-65	167.7	0	0	0	111.3	V581 I582 Y588 K589	V581-I585 HydrophobicContact CG1-CD1 3.95Å; V581-I585 WeakPolarHBondContact O-CG1 3.04Å; V581-I585 PolarHBondContact O-N 3.1Å; I582-I585 PolarHBondContact O-N 3.24Å; I585-Y588 WeakPolarHBondContact O-CB 3.34Å; I585-Y588 PolarHBondContact O-N 3.2Å; I585-K589 PolarHBondContact O-N 3.08Å
586	F	57.8	Low	55.8	Low	19 Å²	19	80.5 Å²	80.5	8%	0.083	43%	0.428	C	S	.	.	H	α-helix	trans	-65.9	-39.4	-178.7	-171.1	-121.3	0	0	0	112.1	F496 A562 F563 I582 K583 D584 K589 L590	F496-F586 HydrophobicContact CE1-CE1 4.14Å; F496-F586 AromaticContact CE1-CZ 3.71Å; F496-F586 HydrophobicContact CE1-CZ 3.71Å; F496-F586 HydrophobicContact CZ-CE1 4.01Å; F496-F586 AromaticContact CZ-CZ 3.61Å; F496-F586 HydrophobicContact CZ-CZ 3.61Å; A562-F586 HydrophobicContact CB-CD2 4.34Å; A562-F586 HydrophobicContact CB-CE2 3.93Å; F563-F586 HydrophobicContact CE1-CB 4.1Å; F563-F586 AromaticContact CE1-CD2 3.56Å; F563-F586 HydrophobicContact CE1-CD2 3.56Å; F563-F586 HydrophobicContact CE1-CE2 4.06Å; F563-F586 AromaticContact CE1-CG 3.86Å; F563-F586 HydrophobicContact CE1-CG 3.86Å; F563-F586 AromaticContact CE2-CD2 3.97Å; F563-F586 HydrophobicContact CE2-CD2 3.97Å; F563-F586 AromaticContact CE2-CE2 3.59Å; F563-F586 HydrophobicContact CE2-CE2 3.59Å; F563-F586 HydrophobicContact CE2-CZ 4.06Å; F563-F586 HydrophobicContact CZ-CB 4.39Å; F563-F586 HydrophobicContact CZ-CD1 4.09Å; F563-F586 AromaticContact CZ-CD2 3.22Å; F563-F586 HydrophobicContact CZ-CD2 3.22Å; F563-F586 HydrophobicContact CZ-CE1 4.1Å; F563-F586 AromaticContact CZ-CE2 3.24Å; F563-F586 HydrophobicContact CZ-CE2 3.24Å; F563-F586 AromaticContact CZ-CG 3.66Å; F563-F586 HydrophobicContact CZ-CG 3.66Å; F563-F586 AromaticContact CZ-CZ 3.69Å; F563-F586 HydrophobicContact CZ-CZ 3.69Å; I582-F586 VanDerWaalsContact O-CB 3.23Å; I582-F586 WeakPolarHBondContact O-CB 3.18Å; I582-F586 PolarHBondContact O-N 3.22Å; K583-F586 PolarHBondContact O-N 2.9Å; D584-F586 VanDerWaalsContact C-N 3.33Å; D584-F586 PolarHBondContact O-N 2.82Å; F586-K589 PolarHBondContact O-N 3.36Å; F586-L590 HydrophobicContact CD1-CD1 3.82Å; F586-L590 HydrophobicContact CE1-CD1 3.54Å; F586-L590 HydrophobicContact CE1-CG 4.32Å; F586-L590 HydrophobicContact CE2-CD1 4.47Å; F586-L590 HydrophobicContact CE2-CG 4.4Å; F586-L590 HydrophobicContact CG-CD1 4.42Å; F586-L590 HydrophobicContact CZ-CD1 3.91Å; F586-L590 HydrophobicContact CZ-CD2 4.48Å; F586-L590 HydrophobicContact CZ-CG 4.26Å; F586-L590 WeakPolarHBondContact O-CB 3.48Å; F586-L590 WeakPolarHBondContact O-CG 3.32Å; F586-L590 PolarHBondContact O-N 3.23Å
587	F	54.6	Low	54.2	Low	62 Å²	62	83 Å²	83	27%	0.272	45%	0.451	S	S	.	.	H	α-helix	trans	-61.1	-41.7	171.1	-87.3	-73	0	0	0	112.3	F284 F532 K583 D584 L590 L591	F284-F587 AromaticContact CE2-CE1 3.79Å; F284-F587 HydrophobicContact CE2-CE1 3.79Å; F284-F587 HydrophobicContact CE2-CZ 4.11Å; F284-F587 AromaticContact CZ-CE1 3.72Å; F284-F587 HydrophobicContact CZ-CE1 3.72Å; F284-F587 HydrophobicContact CZ-CZ 4.27Å; F532-F587 HydrophobicContact CD2-CE2 4.25Å; F532-F587 AromaticContact CD2-CZ 3.97Å; F532-F587 HydrophobicContact CD2-CZ 3.97Å; F532-F587 HydrophobicContact CE2-CE1 4.32Å; F532-F587 HydrophobicContact CE2-CE2 4.49Å; F532-F587 AromaticContact CE2-CZ 3.87Å; F532-F587 HydrophobicContact CE2-CZ 3.87Å; K583-F587 HydrophobicContact CD-CE2 4.33Å; K583-F587 HydrophobicContact CG-CD2 4.03Å; K583-F587 HydrophobicContact CG-CE2 3.87Å; K583-F587 VanDerWaalsContact O-CD2 3.24Å; K583-F587 WeakPolarHBondContact O-CD2 3.39Å; K583-F587 PolarHBondContact O-N 2.92Å; D584-F587 PolarHBondContact O-N 2.81Å; F587-L590 PolarHBondContact O-N 3.14Å; F587-L591 WeakPolarHBondContact O-CB 3.48Å; F587-L591 VanDerWaalsContact O-CG 3.29Å; F587-L591 WeakPolarHBondContact O-CG 3.17Å; F587-L591 PolarHBondContact O-N 3.04Å
588	Y	47.5	Very low	53.5	Low	183 Å²	183	81.3 Å²	81.3	72%	0.718	44%	0.443	S	S	*	.	H	α-helix	trans	-61.9	-43.5	174	-95.5	-82.5	0	0	0	112.8	D584 I585 L591 S592	D584-Y588 PolarHBondContact O-N 3.22Å; I585-Y588 WeakPolarHBondContact O-CB 3.34Å; I585-Y588 PolarHBondContact O-N 3.2Å; Y588-L591 PolarHBondContact O-N 3.4Å; Y588-S592 WeakPolarHBondContact O-CB 3.48Å; Y588-S592 PolarHBondContact O-N 3.34Å
589	K	51.5	Low	52.7	Low	94 Å²	94	84.1 Å²	84.1	41%	0.409	46%	0.456	S	S	.	.	H	α-helix	trans	-67.1	-40.4	179.3	-149.3	175.8	-170.3	177.5	0	111.7	S561 I585 F586 S592 I593	S561-K589 PolarHBondContact O-NZ 3.3Å; I585-K589 PolarHBondContact O-N 3.08Å; F586-K589 PolarHBondContact O-N 3.36Å; K589-S592 PolarHBondContact O-N 3.39Å; K589-I593 HydrophobicContact CG-CD1 4.29Å; K589-I593 WeakPolarHBondContact O-CD1 3Å; K589-I593 VanDerWaalsContact O-CG1 3.28Å; K589-I593 WeakPolarHBondContact O-CG1 3.48Å; K589-I593 PolarHBondContact O-N 2.92Å
590	L	47.3	Very low	51.9	Low	51 Å²	51	88.7 Å²	88.7	27%	0.267	48%	0.481	S	S	.	.	H	α-helix	trans	-66.1	-41	174.3	-75.5	175.1	0	0	0	113.1	F496 F586 F587 S592 G594	F496-L590 HydrophobicContact CZ-CD2 4.45Å; F586-L590 HydrophobicContact CD1-CD1 3.82Å; F586-L590 HydrophobicContact CE1-CD1 3.54Å; F586-L590 HydrophobicContact CE1-CG 4.32Å; F586-L590 HydrophobicContact CE2-CD1 4.47Å; F586-L590 HydrophobicContact CE2-CG 4.4Å; F586-L590 HydrophobicContact CG-CD1 4.42Å; F586-L590 HydrophobicContact CZ-CD1 3.91Å; F586-L590 HydrophobicContact CZ-CD2 4.48Å; F586-L590 HydrophobicContact CZ-CG 4.26Å; F586-L590 WeakPolarHBondContact O-CB 3.48Å; F586-L590 WeakPolarHBondContact O-CG 3.32Å; F586-L590 PolarHBondContact O-N 3.23Å; F587-L590 PolarHBondContact O-N 3.14Å; L590-S592 VanDerWaalsContact C-N 3.33Å; L590-G594 PolarHBondContact O-N 3.32Å
591	L	41	Very low	51	Low	122 Å²	122	85.9 Å²	85.9	64%	0.639	48%	0.475	S	S	*	.	H	α-helix	trans	-63.3	-39.7	174.9	-78.9	165	0	0	0	111.7	F587 Y588 S595	F587-L591 WeakPolarHBondContact O-CB 3.48Å; F587-L591 VanDerWaalsContact O-CG 3.29Å; F587-L591 WeakPolarHBondContact O-CG 3.17Å; F587-L591 PolarHBondContact O-N 3.04Å; Y588-L591 PolarHBondContact O-N 3.4Å; L591-S595 WeakPolarHBondContact O-CB 3.43Å; L591-S595 PolarHBondContact O-N 2.66Å; L591-S595 VanDerWaalsContact O-N 3.16Å
592	S	45.1	Very low	49.8	Very low	64 Å²	64	85.8 Å²	85.8	45%	0.448	47%	0.472	S	S	.	.	H	α-helix	trans	-67.2	-48.4	177.4	-170.7	0	0	0	0	112	Y588 K589 L590 G594 S595 L596	Y588-S592 WeakPolarHBondContact O-CB 3.48Å; Y588-S592 PolarHBondContact O-N 3.34Å; K589-S592 PolarHBondContact O-N 3.39Å; L590-S592 VanDerWaalsContact C-N 3.33Å; S592-G594 VanDerWaalsContact C-N 3.34Å; S592-G594 PolarHBondContact O-N 2.65Å; S592-S595 CarbonylContact O-C 3.57Å; S592-S595 PolarHBondContact O-N 3.43Å; S592-L596 WeakPolarHBondContact O-CG 3.5Å; S592-L596 PolarHBondContact O-N 3.33Å
593	I	44.5	Very low	48.7	Very low	104 Å²	104	89.6 Å²	89.6	53%	0.533	49%	0.493	S	S	.	.	H	α-helix	trans	-62.2	-41.6	176.3	-66.1	163.8	0	0	0	111	K589 S595 L596 S597	K589-I593 HydrophobicContact CG-CD1 4.29Å; K589-I593 WeakPolarHBondContact O-CD1 3Å; K589-I593 VanDerWaalsContact O-CG1 3.28Å; K589-I593 WeakPolarHBondContact O-CG1 3.48Å; K589-I593 PolarHBondContact O-N 2.92Å; I593-S595 PolarHBondContact O-N 2.77Å; I593-L596 PolarHBondContact O-N 2.82Å; I593-S597 PolarHBondContact O-N 2.82Å
594	G	40.7	Very low	47.5	Very low	62 Å²	62	92.8 Å²	92.8	64%	0.639	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-2.1	175.1	0	0	0	0	0	115.4	L590 S592	L590-G594 PolarHBondContact O-N 3.32Å; S592-G594 VanDerWaalsContact C-N 3.34Å; S592-G594 PolarHBondContact O-N 2.65Å
595	S	40	Very low	46.5	Very low	96 Å²	96	94.2 Å²	94.2	67%	0.671	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.6	4.4	174	-173.1	0	0	0	0	112.6	L591 S592 I593	L591-S595 WeakPolarHBondContact O-CB 3.43Å; L591-S595 PolarHBondContact O-N 2.66Å; L591-S595 VanDerWaalsContact O-N 3.16Å; S592-S595 CarbonylContact O-C 3.57Å; S592-S595 PolarHBondContact O-N 3.43Å; I593-S595 PolarHBondContact O-N 2.77Å
596	L	39.1	Very low	45	Very low	145 Å²	145	93.5 Å²	93.5	76%	0.759	52%	0.523	S	S	*	.			trans	-125.3	15.5	180	-68	169.3	0	0	0	111.8	S592 I593	S592-L596 WeakPolarHBondContact O-CG 3.5Å; S592-L596 PolarHBondContact O-N 3.33Å; I593-L596 PolarHBondContact O-N 2.82Å
597	S	31.4	Very low	43.9	Very low	120 Å²	120	100.3 Å²	100.3	84%	0.839	56%	0.563	S	S	*	*			trans	-139.3	0	177	165.9	0	0	0	0	110.8	R291 I593	R291-S597 PolarHBondContact NH2-OG 3.37Å; I593-S597 PolarHBondContact O-N 2.82Å

Retrieved 597 of 597 residues in 147 ms (Link to these results)

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