A0A5K4F9M7_SCHMA Loading...

SCHIP-1 domain-containing protein AlphaSync

AlphaFold DB , UniProt , Accession A0A5K4F9M7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 672 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters 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	33.8	Very low	31.6	Very low	234 Å²	234	167.5 Å²	167.5	100%	1.153	80%	0.8	S	S	*	*				0	104.6	0	-63.2	148.5	176.2	0	0	105.4
2	I	34.4	Very low	31.8	Very low	147 Å²	147	162.4 Å²	162.4	75%	0.754	80%	0.796	S	S	*	*			cis	86.7	112.4	43.5	-61.7	177.9	0	0	0	112.7
3	R	34.6	Very low	32.1	Very low	222 Å²	222	161.5 Å²	161.5	84%	0.838	80%	0.796	S	S	*	*			trans	72.3	135.9	174.9	-62	159.1	-172.1	168.2	1.4	115.6
4	N	32.3	Very low	32	Very low	144 Å²	144	156.4 Å²	156.4	77%	0.77	78%	0.784	S	S	*	*			cis	112.3	142.7	8.5	-80.4	4.5	0	0	0	114
5	L	31.9	Very low	32.1	Very low	159 Å²	159	154.1 Å²	154.1	83%	0.832	78%	0.782	S	S	*	*			trans	72.2	155	164	-59.9	148.5	0	0	0	115.9
6	K	30	Very low	32.2	Very low	146 Å²	146	155.2 Å²	155.2	64%	0.635	78%	0.783	S	S	*	*			cis	-174.4	131.2	-26.3	172.3	178.1	179	-167.1	0	106.7
7	F	29.1	Very low	32	Very low	214 Å²	214	153.6 Å²	153.6	94%	0.939	78%	0.776	S	S	*	*			trans	-96.6	152.8	160.9	-90	-80	0	0	0	110.9
8	H	31.5	Very low	32	Very low	147 Å²	147	155.4 Å²	155.4	68%	0.681	78%	0.778	S	S	*	*			trans	-110	137.9	-155.7	-142.2	-84	0	0	0	112
9	M	25.8	Very low	31.9	Very low	146 Å²	146	154.5 Å²	154.5	72%	0.719	78%	0.776	S	S	*	*			trans	-72.2	152.8	161.6	-69.1	168.7	60.8	0	0	109.8	D11	M9-D11 VanDerWaalsContact CE-OD2 3.28Å; M9-D11 WeakPolarHBondContact CE-OD2 3.45Å
10	I	36.9	Very low	31.9	Very low	161 Å²	161	152.3 Å²	152.3	83%	0.826	78%	0.776	S	S	*	*			trans	-129.1	125.8	163.4	-60.8	178.8	0	0	0	106.5
11	D	28	Very low	31.9	Very low	122 Å²	122	152.5 Å²	152.5	65%	0.652	78%	0.778	S	S	*	*			trans	-139.2	174.9	176.1	-88	-54	0	0	0	107.7	M9	M9-D11 VanDerWaalsContact CE-OD2 3.28Å; M9-D11 WeakPolarHBondContact CE-OD2 3.45Å
12	S	33.1	Very low	31.7	Very low	107 Å²	107	146.4 Å²	146.4	75%	0.748	76%	0.759	S	S	*	*			trans	88	130.8	-168.3	-35.6	0	0	0	0	111.7
13	D	35.8	Very low	32	Very low	150 Å²	150	144.6 Å²	144.6	80%	0.802	76%	0.756	S	S	*	*			cis	-147.5	177.9	12.2	-83.8	-57	0	0	0	110.4
14	S	31.4	Very low	31.7	Very low	90 Å²	90	140 Å²	140	63%	0.629	75%	0.753	S	S	*	*				-172	153.5	-51.2	63	0	0	0	0	108.5
15	V	33	Very low	31.6	Very low	123 Å²	123	142.3 Å²	142.3	75%	0.745	76%	0.756	S	S	*	*			trans	68.8	143.6	166.9	-178.6	0	0	0	0	114.7
16	E	33.1	Very low	31.6	Very low	171 Å²	171	140 Å²	140	80%	0.799	75%	0.753	S	S	*	*			cis	-141.7	173.7	14.9	-150.4	144.5	-122.6	0	0	114.8
17	L	30	Very low	31.7	Very low	128 Å²	128	144.2 Å²	144.2	67%	0.67	77%	0.765	S	S	*	*			trans	-49.4	143.7	-178.8	-63.6	149.6	0	0	0	117.6
18	F	30.6	Very low	31.8	Very low	187 Å²	187	138 Å²	138	82%	0.82	75%	0.753	S	S	*	*				-173	159.6	93.6	-111	-81.5	0	0	0	114.8
19	N	31.2	Very low	32	Very low	137 Å²	137	138 Å²	138	73%	0.733	76%	0.764	S	S	*	*			trans	-84.8	173.3	179.6	-51	-66.3	0	0	0	111.8
20	S	31.9	Very low	32.3	Very low	110 Å²	110	138.5 Å²	138.5	77%	0.769	76%	0.764	S	S	*	*			cis	-162.8	158.3	10.5	23	0	0	0	0	113.2
21	L	31.7	Very low	32.3	Very low	158 Å²	158	141 Å²	141	83%	0.827	77%	0.769	S	S	*	*			trans	-12.4	141.1	155.5	-90.1	68.9	0	0	0	122.3
22	S	30	Very low	32.4	Very low	106 Å²	106	141.3 Å²	141.3	74%	0.741	77%	0.771	S	S	*	*				88	157	127.1	-67.7	0	0	0	0	122.8
23	P	39.2	Very low	32.5	Very low	108 Å²	108	146.2 Å²	146.2	70%	0.701	78%	0.779	S	S	*	*			trans	-137.3	-179.5	-147.8	38.5	-17.2	0	0	0	118.9
24	T	28.7	Very low	32.2	Very low	127 Å²	127	147.7 Å²	147.7	78%	0.779	78%	0.778	S	S	*	*			trans	95.6	141.1	154.8	70.4	0	0	0	0	123.3
25	K	31.4	Very low	32.2	Very low	192 Å²	192	148.7 Å²	148.7	84%	0.835	79%	0.785	S	S	*	*			trans	81.4	99.1	147.6	-86.5	176.5	176.8	172.7	0	123.4
26	S	31.3	Very low	32	Very low	109 Å²	109	148 Å²	148	76%	0.762	78%	0.781	S	S	*	*				61	134.9	121.9	68.8	0	0	0	0	120.6
27	R	32.7	Very low	31.9	Very low	235 Å²	235	149.8 Å²	149.8	89%	0.887	79%	0.787	S	S	*	*				178.4	133.4	57.5	174.3	174.4	178.1	169.8	0	112.4
28	A	30.3	Very low	31.9	Very low	83 Å²	83	146.8 Å²	146.8	69%	0.686	79%	0.787	S	S	*	*			trans	36	138.6	152.4	0	0	0	0	0	123.9
29	T	36	Very low	32	Very low	147 Å²	147	147 Å²	147	90%	0.902	79%	0.787	S	S	*	*				-157.1	145.7	122.6	7.4	0	0	0	0	112.8
30	E	31	Very low	32	Very low	157 Å²	157	146.2 Å²	146.2	73%	0.734	78%	0.783	S	S	*	*			trans	-72.2	157.1	-165.4	-51.9	161.7	123	0	0	116
31	K	37.2	Very low	32.1	Very low	215 Å²	215	147.8 Å²	147.8	94%	0.935	78%	0.782	S	S	*	*			trans	-142	119.7	139.1	-72.1	-166.3	178.7	174.6	0	110.6
32	N	31.2	Very low	32.2	Very low	127 Å²	127	146.6 Å²	146.6	68%	0.679	78%	0.777	S	S	*	*			trans	-90.9	151.2	178.1	-86.1	-44.6	0	0	0	113
33	K	35.4	Very low	32.1	Very low	211 Å²	211	146.3 Å²	146.3	92%	0.917	78%	0.775	S	S	*	*			trans	-158.4	154.6	143.8	-113.2	172.2	-177.4	-177.2	0	111.3
34	F	28.2	Very low	31.6	Very low	180 Å²	180	148.4 Å²	148.4	79%	0.789	78%	0.778	S	S	*	*			trans	-114	175.8	-159.9	-97.2	-98.5	0	0	0	114.5
35	S	31.4	Very low	31.6	Very low	112 Å²	112	148.7 Å²	148.7	78%	0.783	78%	0.775	S	S	*	*			trans	100.2	120.3	175	70.2	0	0	0	0	114.5
36	T	28.5	Very low	31.7	Very low	107 Å²	107	147.7 Å²	147.7	66%	0.656	77%	0.773	S	S	*	*			cis	96.2	137.2	15.3	-45.8	0	0	0	0	114.8
37	F	31.5	Very low	31.5	Very low	210 Å²	210	149.4 Å²	149.4	92%	0.921	77%	0.773	S	S	*	*			trans	73.2	135.1	-168.7	-56.2	-83.6	0	0	0	115
38	G	30.4	Very low	31.4	Very low	64 Å²	64	145.9 Å²	145.9	66%	0.66	77%	0.77	S	S	*	*			cis	151.1	145.3	-15.7	0	0	0	0	0	114.2
39	K	33.5	Very low	31.2	Very low	193 Å²	193	148 Å²	148	84%	0.839	78%	0.775	S	S	*	*			trans	71.6	155.6	166.6	-61.3	-170.5	160.4	-148.6	0	117.2
40	D	30.3	Very low	30.9	Very low	119 Å²	119	145.8 Å²	145.8	64%	0.636	77%	0.765	S	S	*	*			cis	-165.5	163.6	-17.8	-98.8	-19.4	0	0	0	109.6
41	L	34.5	Very low	30.7	Very low	144 Å²	144	143 Å²	143	75%	0.754	76%	0.764	S	S	*	*			trans	76	116.1	155.8	-65.3	153.7	0	0	0	123.7
42	N	32.6	Very low	30.5	Very low	133 Å²	133	140.3 Å²	140.3	71%	0.711	76%	0.759	S	S	*	*				73	107.5	126.3	-63.4	5.4	0	0	0	125.5
43	S	28.9	Very low	30.2	Very low	100 Å²	100	138.5 Å²	138.5	70%	0.699	76%	0.762	S	S	*	*				71	140.9	117.5	-56	0	0	0	0	124.4
44	I	28.5	Very low	29.9	Very low	152 Å²	152	134.2 Å²	134.2	78%	0.779	76%	0.758	S	S	*	*			trans	73	128.8	148.7	-76	166.2	0	0	0	115.5
45	D	28.2	Very low	29.9	Very low	133 Å²	133	131.4 Å²	131.4	71%	0.711	76%	0.761	S	S	*	*			cis	-159.9	-170.3	2.2	-132.1	-24.8	0	0	0	112.7
46	Q	33.4	Very low	29.7	Very low	171 Å²	171	129 Å²	129	80%	0.799	75%	0.754	S	S	*	*			trans	85.2	109.7	166.9	-51.5	-169.5	9.2	0	0	115.6
47	L	27.7	Very low	29.6	Very low	145 Å²	145	133.9 Å²	133.9	76%	0.759	76%	0.762	S	S	*	*				93.8	99.1	58	-84.4	168.7	0	0	0	113.4
48	I	30	Very low	29.4	Very low	161 Å²	161	135.6 Å²	135.6	83%	0.826	76%	0.763	S	S	*	*			trans	-131.3	123.7	135.6	-61.6	-176.5	0	0	0	107
49	T	26.4	Very low	29.2	Very low	127 Å²	127	140.4 Å²	140.4	78%	0.779	77%	0.768	S	S	*	*			trans	-147.7	104.7	171.2	-62	0	0	0	0	109
50	S	30.6	Very low	28.9	Very low	100 Å²	100	139.1 Å²	139.1	70%	0.699	77%	0.77	S	S	*	*			trans	-174.8	145.9	167.6	56.1	0	0	0	0	109.9
51	S	26.6	Very low	28.8	Very low	100 Å²	100	139 Å²	139	70%	0.699	78%	0.777	S	S	*	*			cis	-176.7	170.7	-25	-108.2	0	0	0	0	108.2
52	N	31.9	Very low	28.4	Very low	157 Å²	157	140 Å²	140	84%	0.84	78%	0.784	S	S	*	*			trans	73.1	156.8	163.9	-55.6	-13.8	0	0	0	118.4
53	A	26.8	Very low	28.1	Very low	90 Å²	90	139 Å²	139	74%	0.744	79%	0.787	S	S	*	*			cis	-174.3	125.5	-36.8	0	0	0	0	0	109.5
54	S	29.1	Very low	28.1	Very low	120 Å²	120	142 Å²	142	84%	0.839	79%	0.794	S	S	*	*			trans	-172.4	95.7	155.2	-166.9	0	0	0	0	106.6
55	S	26.9	Very low	28.3	Very low	122 Å²	122	140.5 Å²	140.5	85%	0.853	79%	0.792	S	S	*	*			cis	74.2	97.6	46.5	-161.3	0	0	0	0	112.9
56	G	28.3	Very low	28.1	Very low	62 Å²	62	140.4 Å²	140.4	64%	0.639	80%	0.797	S	S	*	*			trans	171.2	87.6	177.9	0	0	0	0	0	113.2
57	Y	25.2	Very low	27.8	Very low	209 Å²	209	137 Å²	137	82%	0.82	79%	0.791	S	S	*	*			trans	55.4	91.7	165.1	-68.9	-88.2	0	0	0	118.6
58	W	26.9	Very low	27.7	Very low	245 Å²	245	138.3 Å²	138.3	93%	0.928	79%	0.794	S	S	*	*			trans	-138.7	75.3	144.2	-75.2	106.7	0	0	0	108.7
59	E	26.9	Very low	27.8	Very low	166 Å²	166	140 Å²	140	78%	0.776	79%	0.791	S	S	*	*			trans	-119.5	168.7	165.5	-67.4	179.3	139.6	0	0	107.4
60	D	26.3	Very low	27.7	Very low	165 Å²	165	142.4 Å²	142.4	88%	0.882	80%	0.799	S	S	*	*	S	Bend	trans	66.7	48.5	-172.2	-60.6	-16.4	0	0	0	116.5
61	C	29.4	Very low	27.7	Very low	116 Å²	116	141.5 Å²	141.5	78%	0.784	79%	0.789	S	S	*	*			trans	-133	27.3	164.3	-85.4	0	0	0	0	113.9
62	D	25.9	Very low	27.8	Very low	166 Å²	166	145.1 Å²	145.1	89%	0.888	79%	0.793	S	S	*	*	S	Bend	trans	-145.5	52.5	-179.2	-121.6	-26.6	0	0	0	113.8
63	S	27.1	Very low	27.5	Very low	112 Å²	112	141.6 Å²	141.6	78%	0.783	79%	0.793	S	S	*	*			trans	-164.6	98	160	-173.6	0	0	0	0	112.3
64	L	28.9	Very low	27.5	Very low	163 Å²	163	145.2 Å²	145.2	85%	0.853	79%	0.792	S	S	*	*	S	Bend	trans	-177	131.6	139.9	-102.3	166.5	0	0	0	111.2
65	V	31	Very low	27.4	Very low	120 Å²	120	145.2 Å²	145.2	73%	0.727	78%	0.783	S	S	*	*			trans	54	89.8	165	-165.4	0	0	0	0	116.6
66	T	25.9	Very low	27.4	Very low	132 Å²	132	150.5 Å²	150.5	81%	0.81	79%	0.785	S	S	*	*			trans	-77.9	166.6	139.8	42.2	0	0	0	0	110
67	S	26	Very low	27.3	Very low	98 Å²	98	152.2 Å²	152.2	69%	0.685	78%	0.782	S	S	*	*	S	Bend	trans	77.6	141.2	178.9	74.1	0	0	0	0	117.5
68	E	26.4	Very low	27.3	Very low	174 Å²	174	148.3 Å²	148.3	81%	0.813	78%	0.781	S	S	*	*			trans	57.1	101.8	167.7	-61.9	-179.1	-179.3	0	0	118.1
69	Y	30.6	Very low	27.4	Very low	195 Å²	195	143.3 Å²	143.3	77%	0.765	78%	0.781	S	S	*	*				-167.4	97.7	119.6	-95.9	-63.1	0	0	0	111	V71	Y69-V71 VanDerWaalsContact C-N 3.35Å; Y69-V71 HydrophobicContact CD1-CG2 4.09Å; Y69-V71 PolarHBondContact O-N 3.43Å
70	D	25.7	Very low	27.4	Very low	179 Å²	179	143.4 Å²	143.4	96%	0.957	78%	0.782	S	S	*	*			trans	-76.2	82.9	167.3	-96.3	-45.4	0	0	0	110
71	V	29.6	Very low	27.4	Very low	81 Å²	81	143.4 Å²	143.4	49%	0.491	78%	0.776	S	S	.	*			trans	-132.7	141.1	171.6	-166.5	0	0	0	0	109.6	Y69	Y69-V71 VanDerWaalsContact C-N 3.35Å; Y69-V71 HydrophobicContact CD1-CG2 4.09Å; Y69-V71 PolarHBondContact O-N 3.43Å
72	F	28.6	Very low	27.2	Very low	176 Å²	176	145.2 Å²	145.2	77%	0.772	78%	0.778	S	S	*	*			trans	70.5	60.9	-174.4	-49.1	-67.7	0	0	0	115.7	F74	F72-F74 PolarHBondContact O-N 3.05Å
73	G	26.2	Very low	27.5	Very low	82 Å²	82	144.5 Å²	144.5	85%	0.845	77%	0.774	S	S	*	*			trans	-59	101.9	160.1	0	0	0	0	0	111.9	N75	G73-N75 PolarHBondContact O-N 2.94Å
74	F	26.7	Very low	27.5	Very low	166 Å²	166	150.2 Å²	150.2	73%	0.728	78%	0.779	S	S	*	*			trans	-68.2	94.6	174.5	-94.5	-107.5	0	0	0	111.1	F72 W76	F72-F74 PolarHBondContact O-N 3.05Å; F74-W76 AromaticContact CD1-CD1 3.65Å; F74-W76 PolarHBondContact O-N 3.44Å
75	N	27.2	Very low	27.6	Very low	120 Å²	120	148 Å²	148	64%	0.642	77%	0.772	S	S	*	*			trans	-93.5	79.3	163.8	-171.4	4.1	0	0	0	111.1	G73 T77	G73-N75 PolarHBondContact O-N 2.94Å; N75-T77 PolarHBondContact O-N 3.34Å; N75-T77 PolarHBondContact OD1-N 3.44Å; N75-T77 VanDerWaalsContact OD1-N 3.11Å; N75-T77 PolarHBondContact OD1-O 3.45Å; N75-T77 VanDerWaalsContact OD1-O 3.13Å; N75-T77 PolarHBondContact OD1-OG1 3.01Å
76	W	26.6	Very low	27.3	Very low	234 Å²	234	152.2 Å²	152.2	89%	0.886	78%	0.781	S	S	*	*			trans	-85.8	45.3	168.4	-95.2	75.7	0	0	0	112.3	F74	F74-W76 AromaticContact CD1-CD1 3.65Å; F74-W76 PolarHBondContact O-N 3.44Å
77	T	26.4	Very low	27.4	Very low	97 Å²	97	151.1 Å²	151.1	60%	0.595	78%	0.777	S	S	*	*			trans	-137.4	142.8	169.2	42.3	0	0	0	0	112.2	N75	N75-T77 PolarHBondContact O-N 3.34Å; N75-T77 PolarHBondContact OD1-N 3.44Å; N75-T77 VanDerWaalsContact OD1-N 3.11Å; N75-T77 PolarHBondContact OD1-O 3.45Å; N75-T77 VanDerWaalsContact OD1-O 3.13Å; N75-T77 PolarHBondContact OD1-OG1 3.01Å
78	T	25.3	Very low	27.5	Very low	128 Å²	128	154.6 Å²	154.6	79%	0.785	79%	0.788	S	S	*	*			trans	73.1	66.8	172.1	-34.4	0	0	0	0	116.2
79	C	28	Very low	27.7	Very low	139 Å²	139	155.8 Å²	155.8	94%	0.939	79%	0.79	S	S	*	*			trans	-118.1	47.3	148.5	-151.2	0	0	0	0	111
80	H	27.1	Very low	27.8	Very low	169 Å²	169	155.1 Å²	155.1	78%	0.782	80%	0.799	S	S	*	*			trans	-112.7	157.1	158	-99.2	-87.5	0	0	0	107.7
81	Q	26.2	Very low	28.1	Very low	164 Å²	164	155.8 Å²	155.8	77%	0.766	79%	0.794	S	S	*	*	S	Bend	trans	81.2	138.6	-179.1	-132	69.8	-6.5	0	0	116.4
82	N	26.4	Very low	28.2	Very low	154 Å²	154	161.7 Å²	161.7	82%	0.824	82%	0.815	S	S	*	*			trans	74.5	42.9	166.9	-58.7	-24.8	0	0	0	119.4
83	D	30.8	Very low	28.1	Very low	152 Å²	152	164.6 Å²	164.6	81%	0.813	82%	0.821	S	S	*	*			trans	-93.8	128.7	140.6	-152.7	-19	0	0	0	110.3	T85	D83-T85 VanDerWaalsContact C-N 3.34Å; D83-T85 PolarHBondContact O-N 3.03Å
84	R	27.3	Very low	28.5	Very low	231 Å²	231	165.4 Å²	165.4	87%	0.872	81%	0.811	S	S	*	*			trans	-92.6	58	-151.1	-157.6	174.3	-173	171.9	2.5	113.2	K86	R84-K86 PolarHBondContact O-N 3.2Å
85	T	31.1	Very low	28.5	Very low	117 Å²	117	165.5 Å²	165.5	72%	0.718	82%	0.819	S	S	*	*			trans	-60.5	103.7	-177.2	47.5	0	0	0	0	113.5	D83 C87	D83-T85 VanDerWaalsContact C-N 3.34Å; D83-T85 PolarHBondContact O-N 3.03Å; T85-C87 PolarHBondContact O-N 2.92Å
86	K	26.2	Very low	29	Very low	209 Å²	209	164.3 Å²	164.3	91%	0.909	82%	0.818	S	S	*	*			trans	-73.9	68.9	173.1	-77.8	-177.1	172.7	176.2	0	112.2	R84	R84-K86 PolarHBondContact O-N 3.2Å
87	C	27	Very low	29.1	Very low	108 Å²	108	160.5 Å²	160.5	73%	0.73	81%	0.814	S	S	*	*			trans	-124.9	41.1	-176.3	-79.3	0	0	0	0	114.5	T85 K89	T85-C87 PolarHBondContact O-N 2.92Å; C87-K89 PolarHBondContact O-N 2.71Å
88	N	28.8	Very low	29.4	Very low	172 Å²	172	159.6 Å²	159.6	92%	0.92	82%	0.817	S	S	*	*			trans	-68.8	102.8	173.1	-82.4	-1.1	0	0	0	111.9
89	K	30.6	Very low	29.7	Very low	198 Å²	198	158.5 Å²	158.5	86%	0.861	82%	0.815	S	S	*	*			trans	-130.3	90.9	164.1	-80.9	-177.1	177.4	171.4	0	110.5	C87	C87-K89 PolarHBondContact O-N 2.71Å
90	L	33	Very low	30	Very low	182 Å²	182	159.4 Å²	159.4	95%	0.953	81%	0.81	S	S	*	*			trans	-110.9	134.9	157.6	-83.1	168.8	0	0	0	109
91	K	30.2	Very low	30.1	Very low	193 Å²	193	159.9 Å²	159.9	84%	0.839	81%	0.812	S	S	*	*			trans	-98.2	113.8	-176.7	-68.2	175.1	179.7	172.7	0	110.2
92	H	32	Very low	30.6	Very low	204 Å²	204	156.7 Å²	156.7	94%	0.944	81%	0.806	S	S	*	*			trans	-141.3	159.8	145.5	-84.5	-79.1	0	0	0	109.3
93	R	27.2	Very low	30.7	Very low	238 Å²	238	154.2 Å²	154.2	90%	0.898	80%	0.8	S	S	*	*			trans	-119.9	173.6	-171.1	-105.5	-174.5	-179.5	176.3	-0.2	108.7
94	P	34.5	Very low	30.7	Very low	98 Å²	98	154 Å²	154	64%	0.636	80%	0.799	S	S	*	*			cis	-142	150.7	-19.1	33.4	-14.2	0	0	0	116.6
95	L	26.6	Very low	30.6	Very low	169 Å²	169	148.7 Å²	148.7	89%	0.885	79%	0.791	S	S	*	*			trans	56.1	169.4	145.3	-78.6	145.4	0	0	0	120.2
96	P	38.1	Very low	30.4	Very low	95 Å²	95	154 Å²	154	62%	0.617	80%	0.798	S	S	*	*			cis	-123.5	-170.5	-14.1	40.5	-24.4	0	0	0	114.6
97	D	28.8	Very low	30.4	Very low	153 Å²	153	149.8 Å²	149.8	82%	0.818	79%	0.791	S	S	*	*			trans	69	142.6	156	-63.6	-17.1	0	0	0	120.9
98	A	33.2	Very low	30.3	Very low	79 Å²	79	155.9 Å²	155.9	65%	0.653	80%	0.798	S	S	*	*			cis	-160.4	156.2	-11.9	0	0	0	0	0	113
99	S	31.4	Very low	30.1	Very low	105 Å²	105	151.9 Å²	151.9	73%	0.734	78%	0.783	S	S	*	*			trans	66.1	141	161.5	78.2	0	0	0	0	117.8
100	N	33.8	Very low	29.8	Very low	157 Å²	157	152.3 Å²	152.3	84%	0.84	79%	0.786	S	S	*	*			cis	-139.4	172.4	10.4	-90.3	-52.2	0	0	0	113.5
101	H	28.6	Very low	29.5	Very low	180 Å²	180	151.9 Å²	151.9	83%	0.833	78%	0.778	S	S	*	*			trans	-105.1	-175.9	-172.9	-86	-92.2	0	0	0	113
102	P	37.3	Very low	29.4	Very low	96 Å²	96	147.8 Å²	147.8	62%	0.623	77%	0.77	S	S	*	*				-145.8	-179.9	-52.9	43.4	-26.8	0	0	0	116.2
103	S	27.7	Very low	29.2	Very low	102 Å²	102	147.4 Å²	147.4	71%	0.713	77%	0.765	S	S	*	*			trans	69.9	163.9	145.7	80.7	0	0	0	0	119.3
104	L	32	Very low	29.8	Very low	148 Å²	148	141 Å²	141	78%	0.775	75%	0.754	S	S	*	*			cis	-133.4	145.1	-3.9	-74.6	168.8	0	0	0	107.4
105	V	24.4	Very low	29.6	Very low	119 Å²	119	144.2 Å²	144.2	72%	0.721	76%	0.758	S	S	*	*				56.6	103.6	65.5	-173.8	0	0	0	0	116.5
106	R	28	Very low	29.8	Very low	228 Å²	228	141.4 Å²	141.4	86%	0.86	74%	0.744	S	S	*	*				176	164.6	121.3	-177.2	154.9	-83.6	123.3	-5.5	112
107	T	26.2	Very low	29.4	Very low	122 Å²	122	142.5 Å²	142.5	75%	0.748	75%	0.745	S	S	*	*			trans	-128.1	170.2	-176.9	53.4	0	0	0	0	113
108	R	23.7	Very low	29.7	Very low	236 Å²	236	142 Å²	142	89%	0.891	74%	0.741	S	S	*	*			trans	86.9	116.6	165.5	-62.4	-175.6	169.2	-172.4	-3.5	120.1
109	S	24.7	Very low	29.7	Very low	87 Å²	87	144 Å²	144	61%	0.608	74%	0.741	S	S	*	*				44.4	123.7	123.5	-164.5	0	0	0	0	121.1
110	F	24.7	Very low	29.6	Very low	207 Å²	207	144.8 Å²	144.8	91%	0.908	74%	0.736	S	S	*	*				-175.4	-151.3	103	-95.6	-64.7	0	0	0	111.8
111	H	26	Very low	29.5	Very low	173 Å²	173	143.8 Å²	143.8	80%	0.801	73%	0.731	S	S	*	*			trans	-137.5	162	-145	-162.8	46.6	0	0	0	114.1
112	V	27.4	Very low	29.6	Very low	108 Å²	108	139.8 Å²	139.8	66%	0.655	72%	0.723	S	S	*	*			trans	79.2	102	163.5	-169.5	0	0	0	0	120.1
113	K	29.7	Very low	29.3	Very low	196 Å²	196	144.8 Å²	144.8	85%	0.852	73%	0.731	S	S	*	*				44.5	176	117.6	-86.9	-178	-179.8	-176.3	0	121.8
114	P	39.7	Very low	29.5	Very low	103 Å²	103	146.5 Å²	146.5	67%	0.669	73%	0.728	S	S	*	*			cis	-137.8	-162.3	-7.4	24.7	2.9	0	0	0	115.6
115	K	30.4	Very low	29.4	Very low	166 Å²	166	145.4 Å²	145.4	72%	0.722	72%	0.719	S	S	*	*			trans	82.5	155.1	153.9	-64.3	-162	144.4	-78.6	0	118.7
116	D	29.6	Very low	29.6	Very low	109 Å²	109	148.8 Å²	148.8	58%	0.583	72%	0.72	S	S	*	*			cis	-163.9	168.7	-11.3	-114.9	32.4	0	0	0	108.4
117	N	30.5	Very low	29.7	Very low	118 Å²	118	142.7 Å²	142.7	63%	0.631	71%	0.708	S	S	*	*			cis	-131.2	-105.5	-11.3	-158.8	-68.7	0	0	0	110.3
118	I	35	Very low	29.8	Very low	143 Å²	143	146.7 Å²	146.7	73%	0.733	71%	0.71	S	S	*	*			cis	-145.9	119.3	-9.9	-66.1	169.8	0	0	0	109
119	N	32.2	Very low	29.9	Very low	122 Å²	122	140.2 Å²	140.2	65%	0.652	69%	0.693	S	S	*	*			trans	53.7	146.8	150.5	-64.5	15.3	0	0	0	122.9
120	N	30.9	Very low	30.1	Very low	120 Å²	120	143.6 Å²	143.6	64%	0.642	70%	0.698	S	S	*	*			cis	-156.2	171.5	4.7	-129.3	3.9	0	0	0	115.7
121	N	29.7	Very low	30.2	Very low	137 Å²	137	141.1 Å²	141.1	73%	0.733	69%	0.689	S	S	*	*			trans	75.8	105.9	171.5	-54.2	-7.9	0	0	0	114.4
122	S	31.6	Very low	30.1	Very low	96 Å²	96	137.3 Å²	137.3	67%	0.671	68%	0.683	S	S	*	*			cis	78.7	135.2	40.7	-42.3	0	0	0	0	113
123	Y	31.3	Very low	29.9	Very low	201 Å²	201	139.1 Å²	139.1	79%	0.788	69%	0.688	S	S	*	*			cis	-139.7	157.7	18.4	-105.5	-89.5	0	0	0	113.6
124	E	31.5	Very low	29.7	Very low	138 Å²	138	134.8 Å²	134.8	65%	0.645	68%	0.683	S	S	*	*			trans	4.9	153.6	141.4	-61.6	-169.8	115	0	0	120.7
125	Q	31	Very low	28.9	Very low	125 Å²	125	137.3 Å²	137.3	58%	0.584	69%	0.689	S	S	*	*			cis	-168.2	179.5	16.3	-123.7	170.1	39.7	0	0	107.9
126	Y	28.3	Very low	28.8	Very low	189 Å²	189	136.7 Å²	136.7	74%	0.741	69%	0.693	S	S	*	*			cis	-157.8	-143.5	3.6	-140.6	-16.6	0	0	0	114.3
127	T	30	Very low	28.5	Very low	101 Å²	101	138.6 Å²	138.6	62%	0.62	70%	0.703	S	S	*	*			trans	-80	170.6	-176.6	41.3	0	0	0	0	118.7
128	R	27.4	Very low	28.7	Very low	206 Å²	206	137 Å²	137	78%	0.777	70%	0.699	S	S	*	*			cis	179.2	148	-13.9	176.8	172.2	-155.1	149.1	13.3	113.6
129	D	25.7	Very low	28.3	Very low	100 Å²	100	141.6 Å²	141.6	54%	0.535	71%	0.709	S	S	.	*			trans	30.8	128.2	157.2	-45.9	-21.1	0	0	0	123.6
130	H	29.4	Very low	28.1	Very low	157 Å²	157	144.7 Å²	144.7	73%	0.727	71%	0.713	S	S	*	*				162.2	132.2	105.1	-82.7	-61.8	0	0	0	117.8
131	H	25.9	Very low	28.1	Very low	155 Å²	155	148 Å²	148	72%	0.718	72%	0.721	S	S	*	*			trans	52.7	118.2	142.1	-64.2	-57	0	0	0	127.2
132	S	24.8	Very low	28	Very low	94 Å²	94	146.8 Å²	146.8	66%	0.657	72%	0.715	S	S	*	*				80.8	119.1	116.9	-62.9	0	0	0	0	124.3
133	D	23.5	Very low	27.9	Very low	145 Å²	145	148.2 Å²	148.2	78%	0.775	72%	0.719	S	S	*	*			trans	35.1	139.3	135	-49.9	-32.8	0	0	0	124
134	S	25.2	Very low	27.6	Very low	105 Å²	105	146.9 Å²	146.9	73%	0.734	72%	0.72	S	S	*	*			trans	102.1	115.1	147.4	-50	0	0	0	0	119.9
135	I	23.4	Very low	27.5	Very low	156 Å²	156	147.7 Å²	147.7	80%	0.8	73%	0.728	S	S	*	*			trans	52.5	109.8	141.3	-45	166.2	0	0	0	118.2
136	L	27.1	Very low	27.2	Very low	154 Å²	154	147.2 Å²	147.2	81%	0.806	73%	0.734	S	S	*	*				-175.1	133.5	118.4	-103.6	168	0	0	0	113.7
137	N	24.4	Very low	27.3	Very low	148 Å²	148	147.7 Å²	147.7	79%	0.791	74%	0.74	S	S	*	*			trans	-99.2	122.8	152	170.8	20.5	0	0	0	106.1
138	P	34.4	Very low	27	Very low	85 Å²	85	150.1 Å²	150.1	55%	0.552	75%	0.749	S	S	*	*				-150.6	151.2	121.9	36.4	-20.1	0	0	0	115.5
139	Y	27.6	Very low	27.6	Very low	239 Å²	239	144.9 Å²	144.9	94%	0.937	74%	0.741	S	S	*	*				-129.4	129.3	127.6	-114.7	-90.4	0	0	0	108.2
140	Y	27.4	Very low	27.8	Very low	187 Å²	187	149.7 Å²	149.7	73%	0.733	76%	0.761	S	S	*	*			trans	-147.8	131.9	-170.4	-160	-80.2	0	0	0	111	D142	Y140-D142 WeakPolarHBondContact CE1-OD1 3.46Å
141	K	31.1	Very low	27.6	Very low	189 Å²	189	149.2 Å²	149.2	82%	0.822	76%	0.764	S	S	*	*			trans	-171.1	110.8	155.3	-105.4	163.1	-178.5	179.6	0	105.9
142	D	27.3	Very low	27.9	Very low	113 Å²	113	151.4 Å²	151.4	60%	0.604	77%	0.771	S	S	*	*				66.6	128.8	87.2	-61.8	-43.5	0	0	0	111.2	Y140	Y140-D142 WeakPolarHBondContact CE1-OD1 3.46Å
143	V	29.8	Very low	28.2	Very low	125 Å²	125	151.5 Å²	151.5	76%	0.758	78%	0.778	S	S	*	*			cis	-141.1	142.4	29.9	169.4	0	0	0	0	111.1
144	Q	25.3	Very low	28.4	Very low	174 Å²	174	148.5 Å²	148.5	81%	0.813	77%	0.773	S	S	*	*			trans	-85.1	137.2	156.1	-90.7	-155.3	28.6	0	0	110.5
145	L	29.3	Very low	28.6	Very low	154 Å²	154	150.1 Å²	150.1	81%	0.806	77%	0.773	S	S	*	*			trans	-139.4	103.3	166.2	-146.2	160.7	0	0	0	110.7
146	V	24.8	Very low	28.7	Very low	116 Å²	116	149.9 Å²	149.9	70%	0.703	77%	0.773	S	S	*	*			trans	-77.3	128.7	179.4	173	0	0	0	0	110.6
147	K	28.7	Very low	28.9	Very low	199 Å²	199	150.7 Å²	150.7	87%	0.865	78%	0.777	S	S	*	*			trans	-160.4	136.6	148.7	-110.8	163.5	-170.7	178.7	0	111.4
148	N	24	Very low	29	Very low	151 Å²	151	151.7 Å²	151.7	81%	0.807	78%	0.777	S	S	*	*			trans	-156.9	168.4	-175.2	-150.8	21.1	0	0	0	106.5
149	P	40	Very low	28.9	Very low	96 Å²	96	156.1 Å²	156.1	62%	0.623	79%	0.79	S	S	*	*			cis	-119.9	-176	-36.7	37.9	-24.4	0	0	0	111.6
150	Q	30.2	Very low	28.9	Very low	201 Å²	201	149.5 Å²	149.5	94%	0.939	78%	0.779	S	S	*	*			trans	-160.2	158.6	141.8	-118.1	177.7	19.3	0	0	113.7
151	N	26.5	Very low	28.8	Very low	148 Å²	148	145.5 Å²	145.5	79%	0.791	78%	0.778	S	S	*	*			trans	-111.6	152.3	-164.4	-61.4	-27.6	0	0	0	114.5
152	K	31.7	Very low	28.7	Very low	201 Å²	201	143.9 Å²	143.9	87%	0.874	78%	0.778	S	S	*	*			trans	-171.6	129.9	145.2	-97.8	155.3	-175.5	-177.7	0	106.5
153	A	29.7	Very low	28.6	Very low	96 Å²	96	145.8 Å²	145.8	79%	0.793	78%	0.783	S	S	*	*			cis	69.5	129.1	45.8	0	0	0	0	0	113
154	A	28.4	Very low	28.7	Very low	81 Å²	81	146.8 Å²	146.8	67%	0.669	78%	0.784	S	S	*	*			cis	-164.7	-178.7	-9.2	0	0	0	0	0	111.1
155	D	30.6	Very low	28.9	Very low	140 Å²	140	143.9 Å²	143.9	75%	0.749	77%	0.774	S	S	*	*			trans	67.8	108.3	151.3	-56.2	-40.4	0	0	0	124
156	N	25.3	Very low	28.9	Very low	150 Å²	150	142.7 Å²	142.7	80%	0.802	77%	0.768	S	S	*	*				17.5	125.9	129.1	-52.7	-52.1	0	0	0	121.7
157	I	31.5	Very low	29.3	Very low	171 Å²	171	145.6 Å²	145.6	88%	0.877	77%	0.774	S	S	*	*			trans	-138.9	152	143.1	-68.9	-169.1	0	0	0	109.4
158	Q	26.4	Very low	29.2	Very low	169 Å²	169	141.7 Å²	141.7	79%	0.79	76%	0.762	S	S	*	*			trans	-97.4	-167.8	-178.2	-62.2	-179.7	-37.4	0	0	113.2
159	Q	31.5	Very low	29.6	Very low	179 Å²	179	145.7 Å²	145.7	84%	0.836	77%	0.767	S	S	*	*			trans	80.2	151	165.9	-55.3	176	-7.7	0	0	116.2
160	S	28.4	Very low	29	Very low	99 Å²	99	147 Å²	147	69%	0.692	77%	0.768	S	S	*	*			cis	-170.4	154.5	-30.8	51.6	0	0	0	0	109.3
161	S	25.2	Very low	29.1	Very low	104 Å²	104	142.2 Å²	142.2	73%	0.727	76%	0.763	S	S	*	*			trans	-17.8	141.1	159.8	53.6	0	0	0	0	119.3
162	L	28.8	Very low	29.2	Very low	154 Å²	154	141.6 Å²	141.6	81%	0.806	76%	0.76	S	S	*	*				-164.9	167.8	102.2	-156.5	54.5	0	0	0	111.8
163	E	25.5	Very low	29.2	Very low	153 Å²	153	139.6 Å²	139.6	72%	0.715	76%	0.758	S	S	*	*			trans	-83.3	157.5	173.8	-59	134.5	118.4	0	0	112.5
164	D	30.8	Very low	29.2	Very low	146 Å²	146	140.2 Å²	140.2	78%	0.781	76%	0.757	S	S	*	*				-170.1	110.1	121.8	-113.6	-30.1	0	0	0	115.9
165	N	29.2	Very low	29.5	Very low	114 Å²	114	142.8 Å²	142.8	61%	0.61	77%	0.766	S	S	*	*				32.1	129.6	129	-66.7	-66.5	0	0	0	125
166	N	30	Very low	29.4	Very low	128 Å²	128	140.1 Å²	140.1	68%	0.684	77%	0.772	S	S	*	*			trans	69.4	117.2	132.2	-62.7	-28.9	0	0	0	123.3
167	H	32.8	Very low	29.5	Very low	178 Å²	178	136.9 Å²	136.9	82%	0.824	77%	0.774	S	S	*	*				-177.7	114.2	114.2	-98.7	-75.6	0	0	0	107.6
168	L	27.9	Very low	29.4	Very low	116 Å²	116	138.5 Å²	138.5	61%	0.607	78%	0.775	S	S	*	*				76.9	102.5	50.1	-159.2	171	0	0	0	113.2	I170	L168-I170 HydrophobicContact CD2-CD1 4.01Å; L168-I170 HydrophobicContact CD2-CG1 4.03Å
169	Y	30.7	Very low	29.5	Very low	236 Å²	236	138.5 Å²	138.5	93%	0.925	78%	0.781	S	S	*	*			trans	-139.3	145.3	155.8	-109.8	-83.3	0	0	0	109.9
170	I	27.2	Very low	29.3	Very low	123 Å²	123	137.3 Å²	137.3	63%	0.631	78%	0.779	S	S	*	*			trans	-124.4	141.7	-173	-66.8	168.5	0	0	0	109.7	L168 N172	L168-I170 HydrophobicContact CD2-CD1 4.01Å; L168-I170 HydrophobicContact CD2-CG1 4.03Å; I170-N172 WeakPolarHBondContact CG2-OD1 3.45Å
171	A	32.6	Very low	29.3	Very low	101 Å²	101	139.8 Å²	139.8	84%	0.835	78%	0.783	S	S	*	*			trans	-138.4	143	151.3	0	0	0	0	0	107.8
172	N	29	Very low	29.4	Very low	135 Å²	135	142.8 Å²	142.8	72%	0.722	79%	0.786	S	S	*	*			trans	-100.7	158.6	-171.4	-48.1	-62.9	0	0	0	111.3	I170	I170-N172 WeakPolarHBondContact CG2-OD1 3.45Å
173	D	31.1	Very low	29.4	Very low	159 Å²	159	140.5 Å²	140.5	85%	0.85	78%	0.782	S	S	*	*				-161.5	148	114.8	-106.5	-28.1	0	0	0	114.3
174	S	31.4	Very low	29.6	Very low	108 Å²	108	141 Å²	141	76%	0.755	79%	0.79	S	S	*	*			trans	7.7	136.4	174.2	-61.2	0	0	0	0	123.1
175	P	33.3	Very low	29.4	Very low	135 Å²	135	143 Å²	143	88%	0.877	79%	0.792	S	S	*	*			trans	-92.5	154.9	170.9	38	-34.4	0	0	0	114.1
176	G	28.1	Very low	29.5	Very low	84 Å²	84	145 Å²	145	87%	0.866	80%	0.802	S	S	*	*			trans	171.7	126.5	166.4	0	0	0	0	0	111.9
177	G	28.7	Very low	29.4	Very low	82 Å²	82	146.6 Å²	146.6	85%	0.845	80%	0.803	S	S	*	*			trans	138.5	59.3	-179.2	0	0	0	0	0	115.1
178	F	28.1	Very low	29.2	Very low	206 Å²	206	144.1 Å²	144.1	90%	0.904	81%	0.805	S	S	*	*			trans	-92.1	125.5	150.7	-82.8	-85.4	0	0	0	107.2
179	D	29.7	Very low	29.1	Very low	169 Å²	169	145.4 Å²	145.4	90%	0.904	81%	0.808	S	S	*	*			trans	-156.2	153.1	147	-99.5	-37.1	0	0	0	110.1
180	L	26.5	Very low	29	Very low	153 Å²	153	142 Å²	142	80%	0.801	80%	0.797	S	S	*	*			trans	-124.8	165.5	176.3	-76.1	155.4	0	0	0	107.3
181	I	28.1	Very low	29.1	Very low	151 Å²	151	142.2 Å²	142.2	77%	0.774	81%	0.81	S	S	*	*			trans	74.4	148.9	177.6	-46.2	157.1	0	0	0	110.4
182	E	29	Very low	28.7	Very low	168 Å²	168	143.1 Å²	143.1	79%	0.785	81%	0.809	S	S	*	*			cis	-129.5	149.1	3.8	-131.3	134.3	-179.8	0	0	106.9
183	S	28.4	Very low	28.8	Very low	105 Å²	105	142 Å²	142	73%	0.734	81%	0.811	S	S	*	*				66.2	63.8	52.1	-50.8	0	0	0	0	115.7	F185	S183-F185 PolarHBondContact O-N 3.04Å
184	D	29	Very low	28.6	Very low	165 Å²	165	139.7 Å²	139.7	88%	0.882	81%	0.808	S	S	*	*			trans	-65.2	90.4	166.2	-95.5	-39.5	0	0	0	111.9
185	F	27.3	Very low	28.5	Very low	187 Å²	187	141.2 Å²	141.2	82%	0.82	81%	0.812	S	S	*	*			trans	-134.9	78.7	170.6	-129.8	-75.6	0	0	0	110.7	S183 F187	S183-F185 PolarHBondContact O-N 3.04Å; F185-F187 PolarHBondContact O-N 2.85Å
186	L	30.1	Very low	28.4	Very low	156 Å²	156	143 Å²	143	82%	0.817	81%	0.808	S	S	*	*			trans	-79	92.3	-168.6	-130.4	171.4	0	0	0	112.2
187	F	27.5	Very low	28.4	Very low	162 Å²	162	145.4 Å²	145.4	71%	0.711	80%	0.802	S	S	*	*			trans	-127.3	78.1	178	-139.3	-65.9	0	0	0	112.5	F185 Q189	F185-F187 PolarHBondContact O-N 2.85Å; F187-Q189 HydrophobicContact CD1-CB 4.44Å; F187-Q189 PolarHBondContact O-N 2.92Å
188	C	28.8	Very low	28.2	Very low	126 Å²	126	147.8 Å²	147.8	85%	0.851	79%	0.794	S	S	*	*			trans	-76.3	117.2	167	-84	0	0	0	0	110.5
189	Q	26.3	Very low	28.3	Very low	143 Å²	143	146.2 Å²	146.2	67%	0.668	79%	0.789	S	S	*	*			trans	-117	154.2	-178.7	-157.2	-165.4	54.1	0	0	111.4	F187	F187-Q189 HydrophobicContact CD1-CB 4.44Å; F187-Q189 PolarHBondContact O-N 2.92Å
190	K	28.4	Very low	28	Very low	163 Å²	163	142.7 Å²	142.7	71%	0.709	78%	0.778	S	S	*	*			trans	87.8	105	162.7	-52.8	177.3	-172.7	174.4	0	118
191	S	29.3	Very low	27.9	Very low	128 Å²	128	141.5 Å²	141.5	90%	0.895	78%	0.781	S	S	*	*				-146.6	149.1	124	-79.1	0	0	0	0	108.2
192	C	25.1	Very low	27.9	Very low	120 Å²	120	142.5 Å²	142.5	81%	0.811	78%	0.782	S	S	*	*			trans	-120.5	137.9	-157.8	-59.1	0	0	0	0	114.7
193	S	30	Very low	28.1	Very low	111 Å²	111	139.1 Å²	139.1	78%	0.776	78%	0.775	S	S	*	*			trans	-178.1	110.7	145.6	29	0	0	0	0	108
194	S	27.4	Very low	28	Very low	111 Å²	111	141.2 Å²	141.2	78%	0.776	78%	0.776	S	S	*	*				66.7	101.1	67.1	76.8	0	0	0	0	115.1
195	V	30.2	Very low	27.7	Very low	140 Å²	140	138.4 Å²	138.4	85%	0.848	77%	0.77	S	S	*	*				-173.3	158.4	119.2	146.1	0	0	0	0	109.6
196	H	30.4	Very low	27.8	Very low	172 Å²	172	134.4 Å²	134.4	80%	0.796	77%	0.765	S	S	*	*			trans	-71.1	174.6	-176.2	-56.2	-48.2	0	0	0	112.8
197	N	27.9	Very low	27.8	Very low	136 Å²	136	136.4 Å²	136.4	73%	0.727	77%	0.767	S	S	*	*			cis	-158.8	165.2	30.4	-150.6	7.4	0	0	0	117.4
198	I	25.5	Very low	27.7	Very low	132 Å²	132	133.8 Å²	133.8	68%	0.677	76%	0.764	S	S	*	*			trans	-41.6	141.3	171.9	-62.1	157.5	0	0	0	115
199	Q	29.4	Very low	27.9	Very low	172 Å²	172	135.6 Å²	135.6	80%	0.804	76%	0.76	S	S	*	*				-179	139.9	110.5	-158.9	82.3	23.3	0	0	111.9
200	S	23.1	Very low	27.9	Very low	96 Å²	96	135.8 Å²	135.8	67%	0.671	77%	0.766	S	S	*	*			trans	-98.4	151	162.2	55.9	0	0	0	0	110.7
201	C	24.7	Very low	27.9	Very low	127 Å²	127	132 Å²	132	86%	0.858	77%	0.765	S	S	*	*			trans	178.6	156.1	142.4	-106	0	0	0	0	114.6
202	Q	28.2	Very low	27.9	Very low	172 Å²	172	135.4 Å²	135.4	80%	0.804	76%	0.763	S	S	*	*			trans	-143.8	167.4	160.7	-87.3	-92.5	-32.5	0	0	105
203	P	33.7	Very low	27.9	Very low	97 Å²	97	137.5 Å²	137.5	63%	0.63	76%	0.761	S	S	*	*			cis	-134.3	-160	-5.8	23.4	3.1	0	0	0	113.5
204	I	25	Very low	28	Very low	150 Å²	150	141.3 Å²	141.3	77%	0.769	76%	0.764	S	S	*	*			trans	113.1	104.9	145.7	-58.1	173.5	0	0	0	119
205	S	24.5	Very low	27.9	Very low	106 Å²	106	142.7 Å²	142.7	74%	0.741	77%	0.768	S	S	*	*			trans	52.2	126.7	138.7	-150	0	0	0	0	121
206	S	28.8	Very low	27.7	Very low	103 Å²	103	144.4 Å²	144.4	72%	0.72	76%	0.764	S	S	*	*				180	160.5	66.9	47.7	0	0	0	0	114.6
207	K	28.6	Very low	27.9	Very low	197 Å²	197	145 Å²	145	86%	0.857	76%	0.764	S	S	*	*			trans	20.8	148.2	146.4	-69.4	-169.2	171.3	179.1	0	120.7
208	V	26.4	Very low	27.8	Very low	108 Å²	108	148.8 Å²	148.8	66%	0.655	77%	0.77	S	S	*	*			cis	-168.4	150.5	3.4	123.4	0	0	0	0	105.9
209	Q	32.3	Very low	27.9	Very low	163 Å²	163	149.8 Å²	149.8	76%	0.762	78%	0.776	S	S	*	*				178.3	137.9	76.5	-150.9	141.7	28.8	0	0	112.3
210	N	26.9	Very low	27.9	Very low	148 Å²	148	149 Å²	149	79%	0.791	78%	0.777	S	S	*	*			trans	38	148.1	138.7	-64.9	4.6	0	0	0	123.2
211	A	28.7	Very low	28.1	Very low	84 Å²	84	153 Å²	153	69%	0.694	79%	0.785	S	S	*	*			cis	-167	158.4	-3.6	0	0	0	0	0	113
212	K	28.6	Very low	28.5	Very low	199 Å²	199	158.6 Å²	158.6	87%	0.865	79%	0.788	S	S	*	*				-167.6	148.8	123.1	-110.2	173	-178.9	176.1	0	112.1
213	E	26	Very low	28.6	Very low	163 Å²	163	157 Å²	157	76%	0.762	79%	0.786	S	S	*	*			trans	-79.2	152.9	-177.2	-46.9	99.1	120.3	0	0	113.6
214	K	32.1	Very low	28.6	Very low	191 Å²	191	159.8 Å²	159.8	83%	0.83	80%	0.795	S	S	*	*			trans	-166.7	100.5	140.9	-110.2	164.3	-174.5	179.5	0	111.3
215	T	24.1	Very low	28.9	Very low	140 Å²	140	156.9 Å²	156.9	86%	0.859	79%	0.788	S	S	*	*			trans	-83.4	128.4	172.9	38	0	0	0	0	111.7
216	F	27.1	Very low	29.4	Very low	177 Å²	177	155 Å²	155	78%	0.776	79%	0.786	S	S	*	*			trans	-163.7	142.2	176.7	-91.3	-72.7	0	0	0	105.4
217	K	33.7	Very low	29.5	Very low	183 Å²	183	157.3 Å²	157.3	80%	0.796	79%	0.79	S	S	*	*			cis	-131.3	164.5	5	-58.8	173.8	-178.6	170.3	0	107.6
218	Y	26.2	Very low	29.8	Very low	217 Å²	217	156.4 Å²	156.4	85%	0.851	79%	0.789	S	S	*	*			cis	66.7	66.6	43.9	-118.8	-65.2	0	0	0	115
219	L	27.6	Very low	30.3	Very low	152 Å²	152	158.6 Å²	158.6	80%	0.796	80%	0.797	S	S	*	*				-170.6	127.7	126	-132.6	74.3	0	0	0	111.6
220	N	30	Very low	30.5	Very low	156 Å²	156	157.8 Å²	157.8	83%	0.834	80%	0.796	S	S	*	*			trans	171	91	139.3	-92.4	-2.6	0	0	0	108.3
221	E	27.4	Very low	31.2	Very low	179 Å²	179	155.3 Å²	155.3	84%	0.836	79%	0.786	S	S	*	*			trans	-107.8	95.9	175.4	-179.5	176.5	-170.4	0	0	107.1
222	W	33.5	Very low	31.5	Very low	245 Å²	245	160.8 Å²	160.8	93%	0.928	80%	0.795	S	S	*	*			trans	-137.2	84.1	167.6	-81.7	86.7	0	0	0	106.6
223	D	29.1	Very low	32.5	Very low	140 Å²	140	154.7 Å²	154.7	75%	0.749	79%	0.788	S	S	*	*			trans	-90.3	113.7	173.1	-174.4	18.9	0	0	0	108.3
224	D	33.6	Very low	34	Very low	155 Å²	155	150 Å²	150	83%	0.829	77%	0.77	S	S	*	*			trans	-152.2	55.1	173	-153	3.7	0	0	0	108.2	G226	D224-G226 VanDerWaalsContact C-N 3.33Å; D224-G226 PolarHBondContact O-N 3.11Å
225	S	31.7	Very low	35.2	Very low	88 Å²	88	147.3 Å²	147.3	62%	0.615	76%	0.761	S	S	*	*			trans	-73.2	82.5	-178.2	66.3	0	0	0	0	111.6	D227	S225-D227 PolarHBondContact O-N 3.3Å
226	G	34.3	Very low	37	Very low	68 Å²	68	143 Å²	143	70%	0.701	74%	0.736	S	S	*	*			trans	-69.5	108.1	156.7	0	0	0	0	0	109.6	D224 E228	D224-G226 VanDerWaalsContact C-N 3.33Å; D224-G226 PolarHBondContact O-N 3.11Å; G226-E228 PolarHBondContact O-N 2.72Å
227	D	31.2	Very low	39.3	Very low	151 Å²	151	143 Å²	143	81%	0.807	74%	0.735	S	S	*	*			trans	-67.6	91.1	178.6	-69.3	-46.9	0	0	0	111.5	S225	S225-D227 PolarHBondContact O-N 3.3Å
228	E	35.2	Very low	41.3	Very low	178 Å²	178	137.5 Å²	137.5	83%	0.832	72%	0.717	S	S	*	*			trans	-85.9	113.9	153.8	-73.5	-161.5	167.7	0	0	109.2	G226 I230	G226-E228 PolarHBondContact O-N 2.72Å; E228-I230 PolarHBondContact O-N 3.47Å
229	D	36.8	Very low	43.4	Very low	153 Å²	153	131.7 Å²	131.7	82%	0.818	70%	0.696	S	S	*	*			trans	-61.2	93.3	175.6	-89.9	-48.9	0	0	0	111	V231	D229-V231 HydrophobicContact CB-CG2 4.37Å; D229-V231 PolarHBondContact O-N 3.34Å
230	I	37.1	Very low	45.3	Very low	147 Å²	147	129.3 Å²	129.3	75%	0.754	68%	0.679	S	S	*	*			trans	-70.2	85.1	170.1	-54.2	179.4	0	0	0	108.2	E228 K232	E228-I230 PolarHBondContact O-N 3.47Å; I230-K232 HydrophobicContact CG2-CB 4.26Å; I230-K232 PolarHBondContact O-N 2.95Å
231	V	40.7	Very low	47.5	Very low	96 Å²	96	124.5 Å²	124.5	58%	0.582	65%	0.652	S	S	*	*			trans	-68.9	77.3	174.3	-175.2	0	0	0	0	109.6	D229 G233 T234	D229-V231 HydrophobicContact CB-CG2 4.37Å; D229-V231 PolarHBondContact O-N 3.34Å; V231-G233 PolarHBondContact O-N 3.33Å; V231-T234 HydrophobicContact CG1-CG2 3.79Å
232	K	36.2	Very low	49.9	Very low	199 Å²	199	117 Å²	117	87%	0.865	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.4	58.7	-171.1	-158.6	173.7	-173.9	173.5	0	112	I230	I230-K232 HydrophobicContact CG2-CB 4.26Å; I230-K232 PolarHBondContact O-N 2.95Å
233	G	49.7	Very low	52	Low	70 Å²	70	106.5 Å²	106.5	72%	0.722	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	177.9	-7.4	-178.4	0	0	0	0	0	117.4	V231 E235	V231-G233 PolarHBondContact O-N 3.33Å; G233-E235 PolarHBondContact O-N 3.49Å
234	T	57.2	Low	54.5	Low	64 Å²	64	103 Å²	103	39%	0.393	57%	0.567	S	S	.	*	P	Polyproline II helix	trans	-69.1	132.2	176.7	32.4	0	0	0	0	112.1	V231 R245	V231-T234 HydrophobicContact CG1-CG2 3.79Å; T234-R245 VanDerWaalsContact O-CZ 3.3Å; T234-R245 PolarHBondContact O-NH1 2.99Å; T234-R245 PolarHBondContact O-NH2 2.95Å
235	E	57.6	Low	56.9	Low	135 Å²	135	99.8 Å²	99.8	63%	0.631	54%	0.543	S	S	*	.	P	Polyproline II helix	trans	-60.9	152.4	166.8	-68.4	-169.4	122.5	0	0	111.5	G233 K237	G233-E235 PolarHBondContact O-N 3.49Å; E235-K237 PolarHBondContact O-N 2.88Å
236	P	61.8	Low	59.3	Low	51 Å²	51	102.8 Å²	102.8	33%	0.331	54%	0.541	S	S	.	.	P	Polyproline II helix	trans	-68.3	123.6	179.5	27.5	-33.4	0	0	0	110.9	T238 E241 A242	P236-T238 PolarHBondContact O-N 3.4Å; P236-E241 HydrophobicContact CB-CB 3.92Å; P236-E241 HydrophobicContact CB-CG 3.96Å; P236-A242 HydrophobicContact CB-CB 3.78Å; P236-A242 HydrophobicContact CG-CB 3.59Å
237	K	73.9	Confident	61.2	Low	175 Å²	175	101.4 Å²	101.4	76%	0.761	52%	0.523	S	S	*	.	S	Bend	trans	-75	-12.5	-175.4	-63.5	170.1	-176.7	167.7	0	113.1	E235 E241	E235-K237 PolarHBondContact O-N 2.88Å; K237-E241 PolarHBondContact N-OE2 3.5Å
238	T	77.6	Confident	63.6	Low	69 Å²	69	99.8 Å²	99.8	42%	0.423	51%	0.51	S	S	.	.	S	Bend	trans	-141.7	157.5	179.3	63.4	0	0	0	0	110.9	P236 F240 E241 A242	P236-T238 PolarHBondContact O-N 3.4Å; T238-F240 PolarHBondContact O-N 3.4Å; T238-E241 PolarHBondContact O-N 3.32Å; T238-E241 WeakPolarHBondContact OG1-CB 3.39Å; T238-E241 PolarHBondContact OG1-N 3.32Å; T238-A242 PolarHBondContact O-N 3.18Å; T238-A242 VanDerWaalsContact O-N 3.09Å
239	K	69.8	Low	66	Low	95 Å²	95	96.3 Å²	96.3	41%	0.413	49%	0.494	S	S	.	.	H	α-helix	trans	-58.3	-35.1	171.1	-66.1	175.6	-170.4	156.6	0	112.1	A242 A243 I597 D601	K239-A242 PolarHBondContact O-N 3.08Å; K239-A243 WeakPolarHBondContact O-CB 3.47Å; K239-A243 PolarHBondContact O-N 3.32Å; K239-I597 HydrophobicContact CB-CG2 3.63Å; K239-I597 HydrophobicContact CD-CG2 4.21Å; K239-D601 WeakPolarHBondContact CD-OD1 3.44Å; K239-D601 WeakPolarHBondContact CE-OD1 3.41Å; K239-D601 IonicContact NZ-OD1 2.81Å; K239-D601 PolarHBondContact NZ-OD1 3.49Å
240	F	66.5	Low	67.9	Low	101 Å²	101	94.2 Å²	94.2	44%	0.443	48%	0.48	S	S	.	.	H	α-helix	trans	-62.4	-48.5	176.4	178.3	-98.8	0	0	0	111.6	T238 A242 A243 L244	T238-F240 PolarHBondContact O-N 3.4Å; F240-A242 VanDerWaalsContact C-N 3.29Å; F240-A242 PolarHBondContact O-N 3.44Å; F240-A243 WeakPolarHBondContact O-CB 3.28Å; F240-A243 PolarHBondContact O-N 3.3Å; F240-A243 VanDerWaalsContact O-N 3.08Å; F240-L244 HydrophobicContact CE1-CD2 4.39Å; F240-L244 WeakPolarHBondContact O-CB 3.39Å; F240-L244 PolarHBondContact O-N 3.12Å
241	E	76.8	Confident	69.7	Low	55 Å²	55	92 Å²	92	26%	0.257	47%	0.469	S	S	.	.	H	α-helix	trans	-61	-39.4	176.2	-168.4	-172.3	160.9	0	0	111.5	P236 K237 T238 A243 L244 R245	P236-E241 HydrophobicContact CB-CB 3.92Å; P236-E241 HydrophobicContact CB-CG 3.96Å; K237-E241 PolarHBondContact N-OE2 3.5Å; T238-E241 PolarHBondContact O-N 3.32Å; T238-E241 WeakPolarHBondContact OG1-CB 3.39Å; T238-E241 PolarHBondContact OG1-N 3.32Å; E241-A243 VanDerWaalsContact C-N 3.32Å; E241-A243 PolarHBondContact O-N 3.02Å; E241-L244 PolarHBondContact O-N 3.14Å; E241-R245 WeakPolarHBondContact O-CG 3.38Å; E241-R245 PolarHBondContact O-N 3.06Å; E241-R245 VanDerWaalsContact O-N 3.11Å; E241-R245 IonicContact OE1-CZ 3.37Å; E241-R245 IonicContact OE1-NE 3.18Å; E241-R245 IonicContact OE1-NH2 3.46Å; E241-R245 PolarHBondContact OE1-NH2 3.34Å
242	A	78.2	Confident	71.9	Confident	22 Å²	22	93.5 Å²	93.5	18%	0.182	47%	0.468	C	S	.	.	H	α-helix	trans	-66	-32.1	174.8	0	0	0	0	0	113.2	P236 T238 K239 F240 R246	P236-A242 HydrophobicContact CB-CB 3.78Å; P236-A242 HydrophobicContact CG-CB 3.59Å; T238-A242 PolarHBondContact O-N 3.18Å; T238-A242 VanDerWaalsContact O-N 3.09Å; K239-A242 PolarHBondContact O-N 3.08Å; F240-A242 VanDerWaalsContact C-N 3.29Å; F240-A242 PolarHBondContact O-N 3.44Å; A242-R246 VanDerWaalsContact O-CZ 3.32Å; A242-R246 PolarHBondContact O-N 3Å; A242-R246 PolarHBondContact O-NE 3.45Å; A242-R246 PolarHBondContact O-NH2 2.97Å
243	A	76.8	Confident	74.3	Confident	24 Å²	24	89 Å²	89	20%	0.198	45%	0.449	C	S	.	.	H	α-helix	trans	-75.8	-42.3	175.8	0	0	0	0	0	111.8	K239 F240 E241 R246 A247 I597	K239-A243 WeakPolarHBondContact O-CB 3.47Å; K239-A243 PolarHBondContact O-N 3.32Å; F240-A243 WeakPolarHBondContact O-CB 3.28Å; F240-A243 PolarHBondContact O-N 3.3Å; F240-A243 VanDerWaalsContact O-N 3.08Å; E241-A243 VanDerWaalsContact C-N 3.32Å; E241-A243 PolarHBondContact O-N 3.02Å; A243-R246 WeakPolarHBondContact O-CB 3.42Å; A243-R246 PolarHBondContact O-N 3.09Å; A243-R246 VanDerWaalsContact O-N 3.16Å; A243-A247 PolarHBondContact O-N 3.38Å; A243-I597 HydrophobicContact CB-CD1 4.41Å
244	L	81.4	Confident	75.4	Confident	68 Å²	68	92.5 Å²	92.5	36%	0.356	44%	0.44	S	S	.	.	H	α-helix	trans	-60.6	-50.2	178.3	-172.7	64.6	0	0	0	111.2	F240 E241 R246 A247 E248	F240-L244 HydrophobicContact CE1-CD2 4.39Å; F240-L244 WeakPolarHBondContact O-CB 3.39Å; F240-L244 PolarHBondContact O-N 3.12Å; E241-L244 PolarHBondContact O-N 3.14Å; L244-R246 PolarHBondContact O-N 3.27Å; L244-A247 WeakPolarHBondContact O-CB 3.4Å; L244-A247 PolarHBondContact O-N 3.47Å; L244-E248 WeakPolarHBondContact O-CG 3.36Å; L244-E248 PolarHBondContact O-N 3.05Å
245	R	84.7	Confident	76.1	Confident	86 Å²	86	94.5 Å²	94.5	33%	0.325	45%	0.446	S	S	.	.	H	α-helix	trans	-57	-36.9	174.4	-67.1	-175.5	-158.1	-174.7	4.9	112.7	T234 E241 E248 E249	T234-R245 VanDerWaalsContact O-CZ 3.3Å; T234-R245 PolarHBondContact O-NH1 2.99Å; T234-R245 PolarHBondContact O-NH2 2.95Å; E241-R245 WeakPolarHBondContact O-CG 3.38Å; E241-R245 PolarHBondContact O-N 3.06Å; E241-R245 VanDerWaalsContact O-N 3.11Å; E241-R245 IonicContact OE1-CZ 3.37Å; E241-R245 IonicContact OE1-NE 3.18Å; E241-R245 IonicContact OE1-NH2 3.46Å; E241-R245 PolarHBondContact OE1-NH2 3.34Å; R245-E248 PolarHBondContact O-N 3.47Å; R245-E249 WeakPolarHBondContact O-CB 3.41Å; R245-E249 PolarHBondContact O-N 3.28Å
246	R	81.3	Confident	77.1	Confident	152 Å²	152	92.7 Å²	92.7	57%	0.574	44%	0.437	S	S	*	.	H	α-helix	trans	-67.1	-39.9	176.4	-108.6	179.9	-76.8	110.4	-2.8	112.2	A242 A243 L244 E250	A242-R246 VanDerWaalsContact O-CZ 3.32Å; A242-R246 PolarHBondContact O-N 3Å; A242-R246 PolarHBondContact O-NE 3.45Å; A242-R246 PolarHBondContact O-NH2 2.97Å; A243-R246 WeakPolarHBondContact O-CB 3.42Å; A243-R246 PolarHBondContact O-N 3.09Å; A243-R246 VanDerWaalsContact O-N 3.16Å; L244-R246 PolarHBondContact O-N 3.27Å; R246-E250 PolarHBondContact O-N 2.93Å
247	A	74.6	Confident	77.6	Confident	38 Å²	38	95 Å²	95	31%	0.314	45%	0.446	S	S	.	.	H	α-helix	trans	-66.7	-41.7	174.4	0	0	0	0	0	111.8	A243 L244 E250 N251	A243-A247 PolarHBondContact O-N 3.38Å; L244-A247 WeakPolarHBondContact O-CB 3.4Å; L244-A247 PolarHBondContact O-N 3.47Å; A247-E250 PolarHBondContact O-N 2.9Å; A247-N251 WeakPolarHBondContact O-CB 3.24Å; A247-N251 PolarHBondContact O-N 2.93Å
248	E	81.9	Confident	77.2	Confident	117 Å²	117	92.1 Å²	92.1	55%	0.547	44%	0.438	S	S	.	.	H	α-helix	trans	-62.4	-44.3	174.2	-69.8	172.4	161.8	0	0	112	L244 R245 N251 K252	L244-E248 WeakPolarHBondContact O-CG 3.36Å; L244-E248 PolarHBondContact O-N 3.05Å; R245-E248 PolarHBondContact O-N 3.47Å; E248-N251 PolarHBondContact O-N 3.35Å; E248-K252 WeakPolarHBondContact O-CB 3.34Å; E248-K252 PolarHBondContact O-N 3.32Å
249	E	84.6	Confident	76.8	Confident	106 Å²	106	94.2 Å²	94.2	50%	0.495	45%	0.451	S	S	.	.	H	α-helix	trans	-61.8	-43.1	173.8	-88.9	-166	-144.3	0	0	112.7	R245 K252 K253	R245-E249 WeakPolarHBondContact O-CB 3.41Å; R245-E249 PolarHBondContact O-N 3.28Å; E249-K252 PolarHBondContact O-N 3.15Å; E249-K253 WeakPolarHBondContact O-CB 3.13Å; E249-K253 VanDerWaalsContact O-CD 3.31Å; E249-K253 WeakPolarHBondContact O-CD 3.5Å; E249-K253 WeakPolarHBondContact O-CG 3.3Å; E249-K253 PolarHBondContact O-N 3.42Å; E249-K253 IonicContact OE2-NZ 2.71Å; E249-K253 PolarHBondContact OE2-NZ 3.34Å
250	E	78.4	Confident	76.4	Confident	109 Å²	109	93.8 Å²	93.8	51%	0.509	46%	0.46	S	S	.	.	H	α-helix	trans	-64.3	-43.5	174.7	-87.3	-156.6	-162.3	0	0	112	R246 A247 K252 K253 R254	R246-E250 PolarHBondContact O-N 2.93Å; A247-E250 PolarHBondContact O-N 2.9Å; E250-K252 VanDerWaalsContact C-N 3.33Å; E250-K252 PolarHBondContact O-N 3.46Å; E250-K253 PolarHBondContact O-N 3.26Å; E250-R254 VanDerWaalsContact O-CG 3.3Å; E250-R254 WeakPolarHBondContact O-CG 3.42Å; E250-R254 PolarHBondContact O-N 3.29Å; E250-R254 IonicContact OE2-NH2 3Å; E250-R254 PolarHBondContact OE2-NH2 2.82Å; E250-R254 VanDerWaalsContact OE2-NH2 3.12Å
251	N	74	Confident	75.5	Confident	99 Å²	99	94 Å²	94	53%	0.529	46%	0.461	S	S	.	.	H	α-helix	trans	-61.6	-44	177.1	-167.6	19.4	0	0	0	110.6	A247 E248 K253 R254 M255	A247-N251 WeakPolarHBondContact O-CB 3.24Å; A247-N251 PolarHBondContact O-N 2.93Å; E248-N251 PolarHBondContact O-N 3.35Å; N251-K253 PolarHBondContact O-N 2.78Å; N251-R254 WeakPolarHBondContact O-CB 3.47Å; N251-R254 PolarHBondContact O-N 3.22Å; N251-M255 WeakPolarHBondContact O-CG 3.48Å; N251-M255 PolarHBondContact O-N 3.49Å
252	K	87.5	Confident	73.5	Confident	128 Å²	128	99.1 Å²	99.1	56%	0.557	49%	0.49	S	S	*	.	H	α-helix	trans	-60.1	-45.2	174	-166.2	-176	-175.9	-122.7	0	112.1	E248 E249 E250 R254 M255 E256	E248-K252 WeakPolarHBondContact O-CB 3.34Å; E248-K252 PolarHBondContact O-N 3.32Å; E249-K252 PolarHBondContact O-N 3.15Å; E250-K252 VanDerWaalsContact C-N 3.33Å; E250-K252 PolarHBondContact O-N 3.46Å; K252-R254 VanDerWaalsContact C-N 3.31Å; K252-R254 PolarHBondContact O-N 2.92Å; K252-M255 PolarHBondContact O-N 2.96Å; K252-E256 WeakPolarHBondContact CE-OE1 3.22Å; K252-E256 IonicContact NZ-OE1 2.67Å; K252-E256 PolarHBondContact NZ-OE1 3.27Å; K252-E256 WeakPolarHBondContact O-CB 3.44Å; K252-E256 WeakPolarHBondContact O-CG 3.27Å; K252-E256 PolarHBondContact O-N 2.66Å
253	K	86.2	Confident	71.4	Confident	106 Å²	106	105.6 Å²	105.6	46%	0.461	51%	0.514	S	S	.	.	H	α-helix	trans	-61.9	-36.4	175.5	-71.8	159.3	-166.1	162.1	0	112	E249 E250 N251 L257	E249-K253 WeakPolarHBondContact O-CB 3.13Å; E249-K253 VanDerWaalsContact O-CD 3.31Å; E249-K253 WeakPolarHBondContact O-CD 3.5Å; E249-K253 WeakPolarHBondContact O-CG 3.3Å; E249-K253 PolarHBondContact O-N 3.42Å; E249-K253 IonicContact OE2-NZ 2.71Å; E249-K253 PolarHBondContact OE2-NZ 3.34Å; E250-K253 PolarHBondContact O-N 3.26Å; N251-K253 PolarHBondContact O-N 2.78Å; K253-L257 WeakPolarHBondContact O-CB 3.25Å; K253-L257 PolarHBondContact O-N 3.03Å
254	R	72.6	Confident	69.3	Low	143 Å²	143	109.4 Å²	109.4	54%	0.54	54%	0.537	S	S	.	.	H	α-helix	trans	-65.6	-45.2	173	-70.3	172.4	-165.8	-151.9	7.1	111.5	E250 N251 K252 L257 I258	E250-R254 VanDerWaalsContact O-CG 3.3Å; E250-R254 WeakPolarHBondContact O-CG 3.42Å; E250-R254 PolarHBondContact O-N 3.29Å; E250-R254 IonicContact OE2-NH2 3Å; E250-R254 PolarHBondContact OE2-NH2 2.82Å; E250-R254 VanDerWaalsContact OE2-NH2 3.12Å; N251-R254 WeakPolarHBondContact O-CB 3.47Å; N251-R254 PolarHBondContact O-N 3.22Å; K252-R254 VanDerWaalsContact C-N 3.31Å; K252-R254 PolarHBondContact O-N 2.92Å; R254-L257 WeakPolarHBondContact O-CB 3.38Å; R254-L257 PolarHBondContact O-N 3.23Å; R254-I258 WeakPolarHBondContact O-CG1 3.24Å; R254-I258 PolarHBondContact O-N 2.94Å
255	M	72.1	Confident	67	Low	105 Å²	105	113.6 Å²	113.6	52%	0.517	57%	0.566	S	S	.	*	H	α-helix	trans	-64.7	-44.6	176.8	-66.6	-58.9	-70.3	0	0	111.8	N251 K252 L257 I258 T259	N251-M255 WeakPolarHBondContact O-CG 3.48Å; N251-M255 PolarHBondContact O-N 3.49Å; K252-M255 PolarHBondContact O-N 2.96Å; M255-L257 VanDerWaalsContact C-N 3.27Å; M255-L257 PolarHBondContact O-N 2.89Å; M255-I258 WeakPolarHBondContact O-CB 3.49Å; M255-I258 PolarHBondContact O-N 3.03Å; M255-I258 HydrophobicContact SD-CD1 4.2Å; M255-T259 PolarHBondContact O-N 3.15Å; M255-T259 PolarHBondContact O-OG1 3.31Å
256	E	78.9	Confident	64.5	Low	97 Å²	97	113.7 Å²	113.7	45%	0.453	58%	0.58	S	S	.	*	H	α-helix	trans	-61	-34.6	173.3	-71.2	173.1	-175	0	0	111.7	K252 I258 S260	K252-E256 WeakPolarHBondContact CE-OE1 3.22Å; K252-E256 IonicContact NZ-OE1 2.67Å; K252-E256 PolarHBondContact NZ-OE1 3.27Å; K252-E256 WeakPolarHBondContact O-CB 3.44Å; K252-E256 WeakPolarHBondContact O-CG 3.27Å; K252-E256 PolarHBondContact O-N 2.66Å; E256-I258 VanDerWaalsContact C-N 3.34Å; E256-I258 PolarHBondContact O-N 3.31Å; E256-S260 WeakPolarHBondContact O-CB 3.46Å; E256-S260 PolarHBondContact O-N 2.92Å; E256-S260 PolarHBondContact O-OG 3.09Å
257	L	72.3	Confident	62.1	Low	99 Å²	99	112.9 Å²	112.9	52%	0.518	59%	0.587	S	S	.	*	H	α-helix	trans	-69.8	-23	172.3	-100.7	164.4	0	0	0	114.8	K253 R254 M255 S260	K253-L257 WeakPolarHBondContact O-CB 3.25Å; K253-L257 PolarHBondContact O-N 3.03Å; R254-L257 WeakPolarHBondContact O-CB 3.38Å; R254-L257 PolarHBondContact O-N 3.23Å; M255-L257 VanDerWaalsContact C-N 3.27Å; M255-L257 PolarHBondContact O-N 2.89Å; L257-S260 WeakPolarHBondContact CA-OG 3.47Å
258	I	65.1	Low	60.1	Low	116 Å²	116	121.1 Å²	121.1	60%	0.595	62%	0.616	S	S	*	*	H	α-helix	trans	-82.4	-47.8	173.3	-68.1	161.9	0	0	0	109.3	R254 M255 E256 S260 K261	R254-I258 WeakPolarHBondContact O-CG1 3.24Å; R254-I258 PolarHBondContact O-N 2.94Å; M255-I258 WeakPolarHBondContact O-CB 3.49Å; M255-I258 PolarHBondContact O-N 3.03Å; M255-I258 HydrophobicContact SD-CD1 4.2Å; E256-I258 VanDerWaalsContact C-N 3.34Å; E256-I258 PolarHBondContact O-N 3.31Å; I258-S260 VanDerWaalsContact C-N 3.34Å; I258-S260 PolarHBondContact O-N 2.85Å; I258-K261 PolarHBondContact O-N 2.85Å
259	T	68.7	Low	57.7	Low	113 Å²	113	123.5 Å²	123.5	69%	0.693	62%	0.624	S	S	*	*	H	α-helix	trans	-68	-28.8	179.7	-50	0	0	0	0	113.3	M255 K261	M255-T259 PolarHBondContact O-N 3.15Å; M255-T259 PolarHBondContact O-OG1 3.31Å; T259-K261 PolarHBondContact O-N 3.42Å
260	S	62.7	Low	55	Low	86 Å²	86	126.2 Å²	126.2	60%	0.601	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.6	4.7	177.2	54.9	0	0	0	0	114.5	E256 L257 I258	E256-S260 WeakPolarHBondContact O-CB 3.46Å; E256-S260 PolarHBondContact O-N 2.92Å; E256-S260 PolarHBondContact O-OG 3.09Å; L257-S260 WeakPolarHBondContact CA-OG 3.47Å; I258-S260 VanDerWaalsContact C-N 3.34Å; I258-S260 PolarHBondContact O-N 2.85Å
261	K	46.2	Very low	52.8	Low	104 Å²	104	125.7 Å²	125.7	45%	0.452	65%	0.645	S	S	.	*			trans	-129.1	78.5	-175.5	-96.5	163	168.9	170.7	0	112.5	I258 T259 F263	I258-K261 PolarHBondContact O-N 2.85Å; T259-K261 PolarHBondContact O-N 3.42Å; K261-F263 HydrophobicContact CB-CD2 3.87Å; K261-F263 HydrophobicContact CB-CE2 3.74Å; K261-F263 HydrophobicContact CB-CZ 4.38Å; K261-F263 HydrophobicContact CD-CE2 3.67Å; K261-F263 HydrophobicContact CD-CZ 3.77Å; K261-F263 HydrophobicContact CG-CD2 4.39Å; K261-F263 HydrophobicContact CG-CE2 3.87Å; K261-F263 HydrophobicContact CG-CZ 4.02Å; K261-F263 PolarHBondContact O-N 3.04Å
262	D	36.1	Very low	51	Low	163 Å²	163	128.4 Å²	128.4	87%	0.872	65%	0.654	S	S	*	*			trans	-60.7	83.3	158	-69.1	-45.1	0	0	0	110	P264	D262-P264 WeakPolarHBondContact O-CD 3.37Å
263	F	33.8	Very low	48.3	Very low	158 Å²	158	132.7 Å²	132.7	69%	0.693	67%	0.667	S	S	*	*			trans	-83.1	118.6	175.1	-81.9	-62.2	0	0	0	110.5	K261	K261-F263 HydrophobicContact CB-CD2 3.87Å; K261-F263 HydrophobicContact CB-CE2 3.74Å; K261-F263 HydrophobicContact CB-CZ 4.38Å; K261-F263 HydrophobicContact CD-CE2 3.67Å; K261-F263 HydrophobicContact CD-CZ 3.77Å; K261-F263 HydrophobicContact CG-CD2 4.39Å; K261-F263 HydrophobicContact CG-CE2 3.87Å; K261-F263 HydrophobicContact CG-CZ 4.02Å; K261-F263 PolarHBondContact O-N 3.04Å
264	P	32	Very low	45.4	Very low	104 Å²	104	131.3 Å²	131.3	68%	0.675	68%	0.683	S	S	*	*			trans	-66.9	137.6	169.7	28.7	-33.7	0	0	0	110	D262 S266	D262-P264 WeakPolarHBondContact O-CD 3.37Å; P264-S266 PolarHBondContact O-N 3.12Å
265	T	34.2	Very low	43.4	Very low	157 Å²	157	129 Å²	129	96%	0.963	69%	0.688	S	S	*	*	S	Bend	trans	-77.2	60.6	-176.3	40.1	0	0	0	0	113.2
266	S	31.6	Very low	41.3	Very low	88 Å²	88	129.9 Å²	129.9	62%	0.615	70%	0.702	S	S	*	*	S	Bend	trans	-151.3	123.3	168.8	61.5	0	0	0	0	111.6	P264	P264-S266 PolarHBondContact O-N 3.12Å
267	D	30	Very low	38.9	Very low	135 Å²	135	131.3 Å²	131.3	72%	0.722	71%	0.712	S	S	*	*	S	Bend	trans	50.3	78.8	161.4	-60.2	-27.1	0	0	0	119
268	K	33.9	Very low	36.7	Very low	211 Å²	211	135.9 Å²	135.9	92%	0.917	73%	0.73	S	S	*	*			trans	-153.4	157.6	134.4	-103.2	119.9	-148.2	155.6	0	113.3
269	K	31.6	Very low	35	Very low	166 Å²	166	136.6 Å²	136.6	72%	0.722	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-56.6	142.2	177.4	-65.4	174.4	170	-174.3	0	111.7	E272	K269-E272 IonicContact NZ-OE1 3.39Å; K269-E272 PolarHBondContact NZ-OE1 3.31Å
270	M	26.4	Very low	33	Very low	163 Å²	163	141 Å²	141	80%	0.803	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-60.9	147.5	162.8	-161.6	148.1	59.4	0	0	110.4
271	P	33	Very low	31.4	Very low	99 Å²	99	146 Å²	146	64%	0.643	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-55.3	139.9	179.5	-27.2	36.2	0	0	0	112.4	W273	P271-W273 VanDerWaalsContact C-N 3.27Å; P271-W273 PolarHBondContact O-N 3.01Å
272	E	36.4	Very low	30.4	Very low	155 Å²	155	150.7 Å²	150.7	72%	0.724	77%	0.774	S	S	*	*			trans	-78.1	74.1	-171.9	-59.6	-167.7	179.7	0	0	111.4	K269 G274	K269-E272 IonicContact NZ-OE1 3.39Å; K269-E272 PolarHBondContact NZ-OE1 3.31Å; E272-G274 PolarHBondContact O-N 2.85Å
273	W	29.6	Very low	30.1	Very low	219 Å²	219	147.5 Å²	147.5	83%	0.83	77%	0.771	S	S	*	*			trans	-59.1	102.6	162.2	-68.1	94.4	0	0	0	108.2	P271 S275	P271-W273 VanDerWaalsContact C-N 3.27Å; P271-W273 PolarHBondContact O-N 3.01Å; W273-S275 PolarHBondContact O-N 3.02Å; W273-S275 PolarHBondContact O-OG 3.27Å
274	G	27	Very low	29.8	Very low	76 Å²	76	147.8 Å²	147.8	78%	0.784	78%	0.78	S	S	*	*			trans	-61.5	90.5	-163.4	0	0	0	0	0	114.6	E272 P276	E272-G274 PolarHBondContact O-N 2.85Å; G274-P276 WeakPolarHBondContact O-CD 3.43Å
275	S	30.3	Very low	29.5	Very low	94 Å²	94	151.9 Å²	151.9	66%	0.657	79%	0.79	S	S	*	*			trans	-78.7	120.4	175.3	-66.6	0	0	0	0	110.6	W273 I277	W273-S275 PolarHBondContact O-N 3.02Å; W273-S275 PolarHBondContact O-OG 3.27Å; S275-I277 PolarHBondContact O-N 2.9Å
276	P	27.5	Very low	29.1	Very low	124 Å²	124	149.3 Å²	149.3	81%	0.805	78%	0.778	S	S	*	*			trans	-78.6	56.1	-179.6	33.6	-36.5	0	0	0	112	G274	G274-P276 WeakPolarHBondContact O-CD 3.43Å
277	I	27.4	Very low	28.9	Very low	128 Å²	128	153.7 Å²	153.7	66%	0.656	79%	0.786	S	S	*	*			trans	-125	103.2	176.2	-54.1	-179.5	0	0	0	108.1	S275 I279	S275-I277 PolarHBondContact O-N 2.9Å; I277-I279 VanDerWaalsContact C-N 3.27Å; I277-I279 HydrophobicContact CG2-CG1 3.93Å; I277-I279 PolarHBondContact O-N 3.45Å
278	Q	27.9	Very low	28.9	Very low	194 Å²	194	156.8 Å²	156.8	91%	0.907	79%	0.794	S	S	*	*			trans	-74.5	76.5	178.1	-67.2	-170.9	8.8	0	0	111.5	K280	Q278-K280 PolarHBondContact O-N 3.03Å
279	I	29.4	Very low	28.5	Very low	131 Å²	131	154.1 Å²	154.1	67%	0.672	79%	0.786	S	S	*	*			trans	-67.3	106.3	169.9	-56.4	-179.9	0	0	0	108.2	I277 K281	I277-I279 VanDerWaalsContact C-N 3.27Å; I277-I279 HydrophobicContact CG2-CG1 3.93Å; I277-I279 PolarHBondContact O-N 3.45Å; I279-K281 PolarHBondContact O-N 2.98Å
280	K	25.6	Very low	28.1	Very low	205 Å²	205	154.3 Å²	154.3	89%	0.891	79%	0.789	S	S	*	*			trans	-61	97.7	176.1	-73.5	-178.9	176.9	176.1	0	110.5	Q278	Q278-K280 PolarHBondContact O-N 3.03Å
281	K	28.9	Very low	28.1	Very low	192 Å²	192	152.8 Å²	152.8	84%	0.835	79%	0.793	S	S	*	*			trans	-76.1	123.9	172.7	-71.2	-178.9	178.3	176	0	110.6	I279	I279-K281 PolarHBondContact O-N 2.98Å
282	K	26.3	Very low	27.6	Very low	202 Å²	202	153.6 Å²	153.6	88%	0.878	80%	0.802	S	S	*	*			trans	-137	164.8	160.5	-93.6	-163.6	172.2	-169.3	0	108
283	A	29.5	Very low	27.2	Very low	96 Å²	96	154.5 Å²	154.5	79%	0.793	81%	0.811	S	S	*	*	S	Bend	trans	74.9	150.1	-174.4	0	0	0	0	0	115
284	D	28.2	Very low	26.9	Very low	165 Å²	165	149.5 Å²	149.5	88%	0.882	81%	0.809	S	S	*	*			trans	-106.8	170.1	-149.8	-65.3	-83.1	0	0	0	114.6
285	Q	25.8	Very low	27	Very low	190 Å²	190	153.5 Å²	153.5	89%	0.888	81%	0.812	S	S	*	*			trans	-82	123.9	174.2	-59.5	169.9	3.2	0	0	110.4
286	S	25.5	Very low	26.7	Very low	102 Å²	102	156 Å²	156	71%	0.713	82%	0.817	S	S	*	*			trans	-179.2	140	136.2	49.5	0	0	0	0	113
287	K	27.9	Very low	26.6	Very low	181 Å²	181	157.3 Å²	157.3	79%	0.787	82%	0.816	S	S	*	*			trans	67.1	144.7	174.7	-51.7	170.2	-175.4	174.8	0	113.6
288	F	28.8	Very low	26.6	Very low	200 Å²	200	156.7 Å²	156.7	88%	0.877	82%	0.821	S	S	*	*			cis	-120.1	168.9	11.7	-79.2	-97.8	0	0	0	113.4
289	M	25.2	Very low	26.4	Very low	155 Å²	155	154.2 Å²	154.2	76%	0.764	82%	0.818	S	S	*	*			trans	-105.3	169.7	173.6	-115.9	-67.4	-172.5	0	0	110.2
290	E	23.5	Very low	26.2	Very low	169 Å²	169	152.3 Å²	152.3	79%	0.79	82%	0.817	S	S	*	*			trans	58.2	110.5	159.7	-67.3	172.8	118.2	0	0	119.4
291	C	25.6	Very low	26.3	Very low	131 Å²	131	149.7 Å²	149.7	89%	0.885	81%	0.812	S	S	*	*				-160.3	105.2	114.4	-97.2	0	0	0	0	110.2
292	S	23	Very low	26.2	Very low	117 Å²	117	147.8 Å²	147.8	82%	0.818	82%	0.817	S	S	*	*			trans	-95.3	124.9	171.2	-57.9	0	0	0	0	109.9
293	L	28.1	Very low	26.2	Very low	174 Å²	174	143 Å²	143	91%	0.911	81%	0.809	S	S	*	*			trans	-135.1	112.6	167.2	-75.7	176.4	0	0	0	109.8
294	S	22.8	Very low	26	Very low	114 Å²	114	143.8 Å²	143.8	80%	0.797	81%	0.809	S	S	*	*			trans	-80.6	138.9	170	-52.8	0	0	0	0	110.1
295	L	29.6	Very low	26	Very low	160 Å²	160	141.4 Å²	141.4	84%	0.838	80%	0.802	S	S	*	*			trans	-155.8	104	155.2	-146.1	69.7	0	0	0	112.7
296	D	24.3	Very low	26	Very low	145 Å²	145	141.6 Å²	141.6	78%	0.775	80%	0.8	S	S	*	*			trans	33.2	130.1	142.6	-50.2	-28.7	0	0	0	122.2
297	I	26.1	Very low	26.1	Very low	152 Å²	152	144.9 Å²	144.9	78%	0.779	81%	0.808	S	S	*	*			trans	-90.5	133	173.8	-58.8	163.2	0	0	0	110.8	V299	I297-V299 HydrophobicContact CG2-CG2 4.04Å
298	P	25.8	Very low	26	Very low	116 Å²	116	141.2 Å²	141.2	75%	0.753	81%	0.805	S	S	*	*			trans	-94.9	125.9	156.2	33.2	-28	0	0	0	111.5	S300	P298-S300 PolarHBondContact O-N 3.25Å
299	V	25.5	Very low	26.3	Very low	142 Å²	142	142.3 Å²	142.3	86%	0.861	80%	0.804	S	S	*	*			trans	-91.7	99.2	-176.2	178.9	0	0	0	0	112.3	I297	I297-V299 HydrophobicContact CG2-CG2 4.04Å
300	S	24.7	Very low	26.7	Very low	91 Å²	91	140.3 Å²	140.3	64%	0.636	80%	0.802	S	S	*	*			trans	-170.4	128.6	159	55.2	0	0	0	0	108	P298	P298-S300 PolarHBondContact O-N 3.25Å
301	N	28.3	Very low	27.6	Very low	149 Å²	149	136.2 Å²	136.2	80%	0.797	79%	0.792	S	S	*	*				-150.6	153.1	65.2	-75.4	-46.1	0	0	0	113.9	S303	N301-S303 PolarHBondContact O-N 2.62Å
302	T	25	Very low	28.6	Very low	152 Å²	152	133.9 Å²	133.9	93%	0.933	77%	0.771	S	S	*	*			trans	-85.2	93.1	177.6	50.5	0	0	0	0	112.6
303	S	27.4	Very low	29.6	Very low	102 Å²	102	134.5 Å²	134.5	71%	0.713	76%	0.764	S	S	*	*			trans	-155.4	76.9	164	62.6	0	0	0	0	112.5	N301	N301-S303 PolarHBondContact O-N 2.62Å
304	S	25	Very low	30.2	Very low	112 Å²	112	130.2 Å²	130.2	78%	0.783	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-59.2	127.9	168.5	-49.5	0	0	0	0	109.8	K306	S304-K306 PolarHBondContact O-N 2.71Å
305	P	27.2	Very low	31.7	Very low	116 Å²	116	130 Å²	130	75%	0.753	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-63.9	120.1	168.9	27.2	-32.2	0	0	0	108	I307	P305-I307 PolarHBondContact O-N 3.5Å; P305-I307 VanDerWaalsContact O-N 3.14Å
306	K	26	Very low	32.5	Very low	194 Å²	194	126.6 Å²	126.6	84%	0.843	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-64.7	116.7	176.5	-69.4	179.1	179.4	176.3	0	108.2	S304 S308	S304-K306 PolarHBondContact O-N 2.71Å; K306-S308 VanDerWaalsContact C-N 3.33Å; K306-S308 WeakPolarHBondContact O-CB 3.49Å; K306-S308 PolarHBondContact O-N 3.04Å
307	I	28	Very low	33.6	Very low	170 Å²	170	122.9 Å²	122.9	87%	0.872	69%	0.692	S	S	*	*			trans	-63.2	95.8	173.8	-61.8	172.3	0	0	0	107.5	P305 R309	P305-I307 PolarHBondContact O-N 3.5Å; P305-I307 VanDerWaalsContact O-N 3.14Å; I307-R309 VanDerWaalsContact C-N 3.34Å; I307-R309 PolarHBondContact O-N 2.84Å; I307-R309 VanDerWaalsContact O-N 3.09Å
308	S	27.3	Very low	34.7	Very low	105 Å²	105	121.3 Å²	121.3	73%	0.734	68%	0.681	S	S	*	*			trans	-94.1	64.4	-160.9	-175.1	0	0	0	0	112.2	K306	K306-S308 VanDerWaalsContact C-N 3.33Å; K306-S308 WeakPolarHBondContact O-CB 3.49Å; K306-S308 PolarHBondContact O-N 3.04Å
309	R	33.5	Very low	36.1	Very low	222 Å²	222	121.7 Å²	121.7	84%	0.838	67%	0.673	S	S	*	*			trans	71.8	156	178.8	-59	175	174.3	160.1	-1.4	113.9	I307	I307-R309 VanDerWaalsContact C-N 3.34Å; I307-R309 PolarHBondContact O-N 2.84Å; I307-R309 VanDerWaalsContact O-N 3.09Å
310	P	34.2	Very low	37.6	Very low	114 Å²	114	118.8 Å²	118.8	74%	0.74	65%	0.647	S	S	*	*			trans	-59.1	139.3	170.7	25.3	-35.2	0	0	0	110.3	D312	P310-D312 PolarHBondContact O-N 3.35Å
311	S	43.1	Very low	38.6	Very low	82 Å²	82	117.9 Å²	117.9	57%	0.573	63%	0.634	S	S	*	*			trans	-60.1	130.8	162.5	27	0	0	0	0	108.5	L313 E316	S311-L313 PolarHBondContact O-N 3.42Å; S311-E316 WeakPolarHBondContact CB-OE1 3.32Å
312	D	45.6	Very low	39.9	Very low	82 Å²	82	119.1 Å²	119.1	44%	0.439	64%	0.636	S	S	.	*			trans	-89.2	108	176.9	-170.4	-18.8	0	0	0	105.4	P310 C314 R315 E316	P310-D312 PolarHBondContact O-N 3.35Å; D312-C314 PolarHBondContact O-N 2.85Å; D312-C314 VanDerWaalsContact O-N 3.09Å; D312-R315 HydrophobicContact CB-CB 4.12Å; D312-R315 VanDerWaalsContact CB-CZ 3.46Å; D312-R315 VanDerWaalsContact CB-NH2 3.32Å; D312-R315 WeakPolarHBondContact O-CA 3.47Å; D312-R315 WeakPolarHBondContact O-CB 3.46Å; D312-R315 PolarHBondContact O-N 3.4Å; D312-R315 IonicContact OD2-NH1 2.76Å; D312-R315 PolarHBondContact OD2-NH1 3.04Å; D312-E316 PolarHBondContact O-N 3.22Å
313	L	43.5	Very low	41.1	Very low	130 Å²	130	115.9 Å²	115.9	68%	0.681	62%	0.619	S	S	*	*	H	α-helix	trans	-53.9	-34.5	-173	-176.8	65.2	0	0	0	111.4	S311 R315 E316 V317	S311-L313 PolarHBondContact O-N 3.42Å; L313-R315 VanDerWaalsContact C-N 3.35Å; L313-R315 PolarHBondContact O-N 2.9Å; L313-E316 PolarHBondContact O-N 3.22Å; L313-V317 WeakPolarHBondContact O-CB 3.44Å; L313-V317 VanDerWaalsContact O-CG2 3.28Å; L313-V317 WeakPolarHBondContact O-CG2 3.48Å; L313-V317 PolarHBondContact O-N 2.97Å
314	C	42	Very low	42.2	Very low	85 Å²	85	116.8 Å²	116.8	57%	0.574	61%	0.607	S	S	*	*	H	α-helix	trans	-61.1	-39.7	174.5	-65.6	0	0	0	0	112.7	D312 V317 E318	D312-C314 PolarHBondContact O-N 2.85Å; D312-C314 VanDerWaalsContact O-N 3.09Å; C314-V317 PolarHBondContact O-N 3.41Å; C314-E318 WeakPolarHBondContact O-CB 3.07Å; C314-E318 VanDerWaalsContact O-CG 3.31Å; C314-E318 WeakPolarHBondContact O-CG 3.41Å; C314-E318 PolarHBondContact O-N 2.9Å
315	R	53	Low	43.1	Very low	110 Å²	110	114.6 Å²	114.6	42%	0.415	59%	0.59	S	S	.	*	H	α-helix	trans	-72	-39.1	178.4	178.8	172.9	55.6	-95.3	-5.9	112.6	D312 L313 V317 E318 E319	D312-R315 HydrophobicContact CB-CB 4.12Å; D312-R315 VanDerWaalsContact CB-CZ 3.46Å; D312-R315 VanDerWaalsContact CB-NH2 3.32Å; D312-R315 WeakPolarHBondContact O-CA 3.47Å; D312-R315 WeakPolarHBondContact O-CB 3.46Å; D312-R315 PolarHBondContact O-N 3.4Å; D312-R315 IonicContact OD2-NH1 2.76Å; D312-R315 PolarHBondContact OD2-NH1 3.04Å; L313-R315 VanDerWaalsContact C-N 3.35Å; L313-R315 PolarHBondContact O-N 2.9Å; R315-V317 VanDerWaalsContact C-N 3.31Å; R315-E318 PolarHBondContact O-N 3.01Å; R315-E319 PolarHBondContact O-N 3.3Å
316	E	46.5	Very low	43.9	Very low	87 Å²	87	114.2 Å²	114.2	41%	0.407	59%	0.59	S	S	.	*	H	α-helix	trans	-66.8	-35.8	174.5	-70.7	-164.8	-156.4	0	0	111.5	S311 D312 L313 W320	S311-E316 WeakPolarHBondContact CB-OE1 3.32Å; D312-E316 PolarHBondContact O-N 3.22Å; L313-E316 PolarHBondContact O-N 3.22Å; E316-W320 VanDerWaalsContact O-CB 3.27Å; E316-W320 WeakPolarHBondContact O-CB 3.21Å; E316-W320 PolarHBondContact O-N 3.35Å
317	V	48.9	Very low	44.9	Very low	68 Å²	68	110.7 Å²	110.7	41%	0.412	57%	0.571	S	S	.	*	H	α-helix	trans	-67.9	-38.8	171.5	170.2	0	0	0	0	111.4	L313 C314 R315 W320 L321	L313-V317 WeakPolarHBondContact O-CB 3.44Å; L313-V317 VanDerWaalsContact O-CG2 3.28Å; L313-V317 WeakPolarHBondContact O-CG2 3.48Å; L313-V317 PolarHBondContact O-N 2.97Å; C314-V317 PolarHBondContact O-N 3.41Å; R315-V317 VanDerWaalsContact C-N 3.31Å; V317-W320 PolarHBondContact O-N 3.42Å; V317-L321 HydrophobicContact CG1-CD1 3.77Å; V317-L321 HydrophobicContact CG1-CG 4.27Å; V317-L321 VanDerWaalsContact O-CB 3.3Å; V317-L321 WeakPolarHBondContact O-CB 3.48Å; V317-L321 WeakPolarHBondContact O-CD1 3.32Å; V317-L321 WeakPolarHBondContact O-CG 3.41Å; V317-L321 PolarHBondContact O-N 2.94Å
318	E	47.5	Very low	45.7	Very low	118 Å²	118	104.3 Å²	104.3	55%	0.551	54%	0.539	S	S	*	.	H	α-helix	trans	-64.7	-48.5	174.1	-78.4	176.3	158.4	0	0	112	C314 R315 W320 L321 E322	C314-E318 WeakPolarHBondContact O-CB 3.07Å; C314-E318 VanDerWaalsContact O-CG 3.31Å; C314-E318 WeakPolarHBondContact O-CG 3.41Å; C314-E318 PolarHBondContact O-N 2.9Å; R315-E318 PolarHBondContact O-N 3.01Å; E318-W320 VanDerWaalsContact C-N 3.28Å; E318-W320 PolarHBondContact O-N 2.88Å; E318-L321 CarbonylContact O-C 3.59Å; E318-L321 PolarHBondContact O-N 3.49Å; E318-L321 VanDerWaalsContact O-N 3.08Å; E318-E322 PolarHBondContact O-N 2.91Å
319	E	55.9	Low	46.5	Very low	124 Å²	124	105 Å²	105	58%	0.579	53%	0.534	S	S	*	.	H	α-helix	trans	-58.8	-39.5	175	-74.4	-176.2	164	0	0	111.6	R315 E322 S323	R315-E319 PolarHBondContact O-N 3.3Å; E319-E322 PolarHBondContact O-N 2.89Å; E319-S323 VanDerWaalsContact O-CB 3.27Å; E319-S323 WeakPolarHBondContact O-CB 3.48Å; E319-S323 PolarHBondContact O-N 3.43Å; E319-S323 PolarHBondContact O-OG 2.79Å; E319-S323 VanDerWaalsContact O-OG 3.06Å
320	W	56.7	Low	46.8	Very low	81 Å²	81	101.3 Å²	101.3	31%	0.307	53%	0.527	S	S	.	.	H	α-helix	trans	-67.5	-36.5	174.1	-177	87.9	0	0	0	113.3	E316 V317 E318 M512	E316-W320 VanDerWaalsContact O-CB 3.27Å; E316-W320 WeakPolarHBondContact O-CB 3.21Å; E316-W320 PolarHBondContact O-N 3.35Å; V317-W320 PolarHBondContact O-N 3.42Å; E318-W320 VanDerWaalsContact C-N 3.28Å; E318-W320 PolarHBondContact O-N 2.88Å; W320-M512 HydrophobicContact CH2-CE 3.93Å; W320-M512 HydrophobicContact CH2-CG 4.35Å; W320-M512 HydrophobicContact CH2-SD 3.42Å; W320-M512 WeakPolarHBondContact CH2-SD 3.39Å; W320-M512 HydrophobicContact CZ2-CE 4.41Å; W320-M512 HydrophobicContact CZ2-CG 4.28Å; W320-M512 HydrophobicContact CZ2-SD 3.93Å; W320-M512 HydrophobicContact CZ3-CE 4.13Å; W320-M512 HydrophobicContact CZ3-SD 4.13Å
321	L	47	Very low	47	Very low	72 Å²	72	103.9 Å²	103.9	38%	0.377	53%	0.526	S	S	.	.	H	α-helix	trans	-72.5	-27.8	176.3	-75.8	168.6	0	0	0	113	V317 E318 R324	V317-L321 HydrophobicContact CG1-CD1 3.77Å; V317-L321 HydrophobicContact CG1-CG 4.27Å; V317-L321 VanDerWaalsContact O-CB 3.3Å; V317-L321 WeakPolarHBondContact O-CB 3.48Å; V317-L321 WeakPolarHBondContact O-CD1 3.32Å; V317-L321 WeakPolarHBondContact O-CG 3.41Å; V317-L321 PolarHBondContact O-N 2.94Å; E318-L321 CarbonylContact O-C 3.59Å; E318-L321 PolarHBondContact O-N 3.49Å; E318-L321 VanDerWaalsContact O-N 3.08Å; L321-R324 WeakPolarHBondContact O-CG 3.4Å; L321-R324 PolarHBondContact O-NE 2.62Å
322	E	54.2	Low	46.7	Very low	176 Å²	176	108.6 Å²	108.6	82%	0.822	54%	0.539	S	S	*	.	H	α-helix	trans	-82.6	-36.1	173	-68.8	-163.3	158.1	0	0	112.2	E318 E319 R324	E318-E322 PolarHBondContact O-N 2.91Å; E319-E322 PolarHBondContact O-N 2.89Å; E322-R324 PolarHBondContact O-N 2.8Å; E322-R324 VanDerWaalsContact O-N 3.15Å
323	S	50.5	Low	46.5	Very low	84 Å²	84	113.4 Å²	113.4	59%	0.587	56%	0.559	S	S	*	*	S	Bend	trans	-83.6	25.7	-178.7	75.6	0	0	0	0	114.9	E319 P325	E319-S323 VanDerWaalsContact O-CB 3.27Å; E319-S323 WeakPolarHBondContact O-CB 3.48Å; E319-S323 PolarHBondContact O-N 3.43Å; E319-S323 PolarHBondContact O-OG 2.79Å; E319-S323 VanDerWaalsContact O-OG 3.06Å; S323-P325 WeakPolarHBondContact O-CD 3.35Å
324	R	51.5	Low	46.3	Very low	120 Å²	120	115.9 Å²	115.9	45%	0.453	56%	0.564	S	S	.	*			trans	-54.5	126.1	-172.3	-80.7	175.5	-170.8	-128	-2.6	113.6	L321 E322 S326	L321-R324 WeakPolarHBondContact O-CG 3.4Å; L321-R324 PolarHBondContact O-NE 2.62Å; E322-R324 PolarHBondContact O-N 2.8Å; E322-R324 VanDerWaalsContact O-N 3.15Å; R324-S326 PolarHBondContact O-N 3.23Å
325	P	43.9	Very low	46.2	Very low	67 Å²	67	119.4 Å²	119.4	44%	0.435	58%	0.577	S	S	.	*			trans	-60.8	130.8	164.7	-25.7	36.7	0	0	0	112	S323 W327 I328	S323-P325 WeakPolarHBondContact O-CD 3.35Å; P325-W327 PolarHBondContact O-N 3.34Å; P325-I328 PolarHBondContact O-N 3.02Å; P325-I328 VanDerWaalsContact O-N 3.1Å
326	S	43.9	Very low	45.7	Very low	107 Å²	107	117.4 Å²	117.4	75%	0.748	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.4	-2.5	-171.5	56.3	0	0	0	0	116.4	R324 I328	R324-S326 PolarHBondContact O-N 3.23Å; S326-I328 VanDerWaalsContact C-N 3.34Å
327	W	47.3	Very low	45.8	Very low	120 Å²	120	117.5 Å²	117.5	46%	0.455	58%	0.582	S	S	.	*	T	Hydrogen-bonded Turn	trans	-77.5	-19.1	172	65.7	-98.5	0	0	0	113.2	P325 D329 Q330 A338 L339	P325-W327 PolarHBondContact O-N 3.34Å; W327-D329 VanDerWaalsContact C-N 3.3Å; W327-D329 PolarHBondContact O-N 3.49Å; W327-Q330 PolarHBondContact O-N 3.34Å; W327-A338 HydrophobicContact CH2-CB 4.17Å; W327-A338 HydrophobicContact CZ3-CB 4.43Å; W327-L339 HydrophobicContact CE3-CD2 4.26Å; W327-L339 HydrophobicContact CZ3-CD2 3.74Å; W327-L339 HydrophobicContact CZ3-CG 4.26Å
328	I	42.9	Very low	45.3	Very low	37 Å²	37	116.1 Å²	116.1	19%	0.19	58%	0.578	C	S	.	*	T	Hydrogen-bonded Turn	trans	-67.4	-30.9	179.5	-67.7	174.5	0	0	0	111.6	P325 S326 Q330	P325-I328 PolarHBondContact O-N 3.02Å; P325-I328 VanDerWaalsContact O-N 3.1Å; S326-I328 VanDerWaalsContact C-N 3.34Å; I328-Q330 VanDerWaalsContact C-N 3.28Å; I328-Q330 PolarHBondContact O-N 2.85Å
329	D	45.2	Very low	44.9	Very low	118 Å²	118	112 Å²	112	63%	0.631	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.8	3.2	-179.8	-66	-41.7	0	0	0	114.1	W327 K331	W327-D329 VanDerWaalsContact C-N 3.3Å; W327-D329 PolarHBondContact O-N 3.49Å; D329-K331 VanDerWaalsContact C-N 3.35Å; D329-K331 PolarHBondContact O-N 2.96Å
330	Q	40.5	Very low	44.5	Very low	146 Å²	146	112.4 Å²	112.4	68%	0.682	56%	0.562	S	S	*	*			trans	-73.6	85.4	175.9	-71.2	-163.4	-7.5	0	0	112	W327 I328 H332	W327-Q330 PolarHBondContact O-N 3.34Å; I328-Q330 VanDerWaalsContact C-N 3.28Å; I328-Q330 PolarHBondContact O-N 2.85Å; Q330-H332 PolarHBondContact O-N 3.01Å
331	K	36.8	Very low	44.1	Very low	168 Å²	168	111.4 Å²	111.4	73%	0.73	56%	0.562	S	S	*	*			trans	-38.1	121.8	174.2	-85.9	-170	167.4	-167.9	0	114.5	D329 Q333	D329-K331 VanDerWaalsContact C-N 3.35Å; D329-K331 PolarHBondContact O-N 2.96Å; K331-Q333 PolarHBondContact O-N 2.82Å
332	H	37	Very low	43.9	Very low	180 Å²	180	111.3 Å²	111.3	83%	0.833	57%	0.566	S	S	*	*	S	Bend	trans	53.9	-10.5	146	-61.6	-75.6	0	0	0	121.3	Q330	Q330-H332 PolarHBondContact O-N 3.01Å
333	Q	41.8	Very low	43.7	Very low	184 Å²	184	109.7 Å²	109.7	86%	0.86	56%	0.557	S	S	*	*	S	Bend	trans	-93.5	-5.3	-167.3	-74.1	-166	-17.6	0	0	116.1	K331	K331-Q333 PolarHBondContact O-N 2.82Å
334	K	38.8	Very low	44	Very low	182 Å²	182	108.3 Å²	108.3	79%	0.791	54%	0.543	S	S	*	.	S	Bend	trans	-140.7	134.6	172.7	-69	-171.8	178.9	178.9	0	111.9	N336	K334-N336 VanDerWaalsContact C-N 3.29Å; K334-N336 PolarHBondContact O-N 2.75Å
335	N	40.5	Very low	44.6	Very low	159 Å²	159	107 Å²	107	85%	0.85	54%	0.544	S	S	*	.			trans	-69.6	83.2	172.7	-69.6	-13.9	0	0	0	110
336	N	42.2	Very low	45.5	Very low	67 Å²	67	110 Å²	110	36%	0.358	56%	0.556	S	S	.	*			trans	-98.1	115.4	172.8	-174.6	-4.6	0	0	0	108.8	K334 A338 L339	K334-N336 VanDerWaalsContact C-N 3.29Å; K334-N336 PolarHBondContact O-N 2.75Å; N336-A338 PolarHBondContact O-N 3.18Å; N336-A338 VanDerWaalsContact O-N 3.16Å; N336-A338 PolarHBondContact OD1-N 2.86Å; N336-L339 HydrophobicContact CB-CD1 4.19Å; N336-L339 HydrophobicContact CB-CG 4.25Å; N336-L339 PolarHBondContact O-N 3.46Å
337	P	48.4	Very low	46.2	Very low	89 Å²	89	108.7 Å²	108.7	58%	0.578	55%	0.546	S	S	*	.	H	α-helix	trans	-60.3	-28.3	-176	23.4	-33.6	0	0	0	112.8	L339 Q340	P337-L339 PolarHBondContact O-N 3.47Å; P337-Q340 PolarHBondContact O-N 2.9Å; P337-Q340 VanDerWaalsContact O-N 3.15Å
338	A	38.9	Very low	47	Very low	39 Å²	39	103.5 Å²	103.5	32%	0.322	53%	0.527	S	S	.	.	H	α-helix	trans	-60.9	-28.6	174.6	0	0	0	0	0	113.4	W327 N336	W327-A338 HydrophobicContact CH2-CB 4.17Å; W327-A338 HydrophobicContact CZ3-CB 4.43Å; N336-A338 PolarHBondContact O-N 3.18Å; N336-A338 VanDerWaalsContact O-N 3.16Å; N336-A338 PolarHBondContact OD1-N 2.86Å
339	L	38.8	Very low	47.9	Very low	32 Å²	32	106.5 Å²	106.5	17%	0.168	54%	0.54	C	S	.	.	H	α-helix	trans	-80.9	-27.5	177.1	-65.3	177.4	0	0	0	112.5	W327 N336 P337 I341 C342 F343	W327-L339 HydrophobicContact CE3-CD2 4.26Å; W327-L339 HydrophobicContact CZ3-CD2 3.74Å; W327-L339 HydrophobicContact CZ3-CG 4.26Å; N336-L339 HydrophobicContact CB-CD1 4.19Å; N336-L339 HydrophobicContact CB-CG 4.25Å; N336-L339 PolarHBondContact O-N 3.46Å; P337-L339 PolarHBondContact O-N 3.47Å; L339-I341 PolarHBondContact O-N 2.83Å; L339-C342 PolarHBondContact O-N 3.47Å; L339-F343 WeakPolarHBondContact O-CD2 3.35Å
340	Q	47.5	Very low	48.6	Very low	132 Å²	132	105.8 Å²	105.8	62%	0.617	54%	0.536	S	S	*	.	H	α-helix	trans	-67	-27	177.1	-69.4	-179.1	-33	0	0	112.5	P337 C342 F343	P337-Q340 PolarHBondContact O-N 2.9Å; P337-Q340 VanDerWaalsContact O-N 3.15Å; Q340-C342 PolarHBondContact O-N 2.88Å; Q340-F343 PolarHBondContact O-N 3.24Å
341	I	48.7	Very low	49.6	Very low	60 Å²	60	100.8 Å²	100.8	31%	0.308	51%	0.514	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-30.6	176.2	-61.9	174.1	0	0	0	111.4	L339 F343 K508 M512	L339-I341 PolarHBondContact O-N 2.83Å; I341-F343 PolarHBondContact O-N 2.85Å; I341-K508 HydrophobicContact CG2-CB 3.9Å; I341-K508 WeakPolarHBondContact CG2-O 3.37Å; I341-M512 HydrophobicContact CG2-CB 4.31Å
342	C	42.5	Very low	51	Low	70 Å²	70	95 Å²	95	47%	0.473	49%	0.489	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-4.3	-175.4	-61	0	0	0	0	114.8	L339 Q340	L339-C342 PolarHBondContact O-N 3.47Å; Q340-C342 PolarHBondContact O-N 2.88Å
343	F	50.9	Low	52.5	Low	142 Å²	142	89.6 Å²	89.6	62%	0.623	47%	0.472	S	S	*	.	S	Bend	trans	-117.7	142.4	-176.9	-64.4	-71	0	0	0	112.4	L339 Q340 I341 K508	L339-F343 WeakPolarHBondContact O-CD2 3.35Å; Q340-F343 PolarHBondContact O-N 3.24Å; I341-F343 PolarHBondContact O-N 2.85Å; F343-K508 PolarHBondContact O-NZ 2.97Å
344	L	55.2	Low	53.6	Low	56 Å²	56	83.5 Å²	83.5	29%	0.293	45%	0.45	S	S	.	.			trans	-70.8	126	169.7	-60.1	174.5	0	0	0	108.6	E348 Q349 F352	L344-E348 WeakPolarHBondContact CA-OE2 3.44Å; L344-E348 HydrophobicContact CB-CB 3.89Å; L344-E348 HydrophobicContact CD2-CB 4.11Å; L344-E348 WeakPolarHBondContact CD2-OE2 3.23Å; L344-Q349 HydrophobicContact CB-CG 3.74Å; L344-Q349 PolarHBondContact O-NE2 3.36Å; L344-F352 HydrophobicContact CD1-CD2 3.57Å; L344-F352 HydrophobicContact CD1-CE2 3.55Å; L344-F352 HydrophobicContact CD1-CG 4.32Å; L344-F352 HydrophobicContact CD1-CZ 4.32Å; L344-F352 HydrophobicContact CD2-CD2 4.44Å; L344-F352 HydrophobicContact CD2-CE2 3.9Å; L344-F352 HydrophobicContact CG-CE2 4.41Å
345	N	65	Low	55.1	Low	91 Å²	91	76.6 Å²	76.6	49%	0.487	42%	0.42	S	S	.	.			trans	-66.1	165.4	170.7	-67	-59.2	0	0	0	110.5	S347 E348 Q349	N345-S347 PolarHBondContact O-N 3.03Å; N345-E348 VanDerWaalsContact CB-OE1 3.27Å; N345-E348 WeakPolarHBondContact CB-OE1 3.44Å; N345-E348 PolarHBondContact N-OE1 3.38Å; N345-E348 PolarHBondContact ND2-OE1 2.96Å; N345-E348 WeakPolarHBondContact O-CA 3.33Å; N345-E348 WeakPolarHBondContact O-CB 3.35Å; N345-E348 PolarHBondContact O-N 3.27Å; N345-Q349 PolarHBondContact O-N 2.91Å
346	I	61.7	Low	56.2	Low	132 Å²	132	74 Å²	74	68%	0.677	40%	0.404	S	S	*	.	H	α-helix	trans	-55.3	-38.6	-178	-63.1	166.2	0	0	0	111.7	Q349 N350	I346-Q349 PolarHBondContact O-N 3.3Å; I346-N350 PolarHBondContact O-N 3.26Å; I346-N350 PolarHBondContact O-ND2 2.87Å; I346-N350 PolarHBondContact O-OD1 3.14Å
347	S	60.5	Low	57.5	Low	78 Å²	78	74 Å²	74	55%	0.545	41%	0.413	S	S	.	.	H	α-helix	trans	-63.5	-37.6	173.7	47	0	0	0	0	113.8	N345 L351	N345-S347 PolarHBondContact O-N 3.03Å; S347-L351 PolarHBondContact O-N 3.39Å
348	E	63	Low	58.3	Low	12 Å²	12	71.8 Å²	71.8	6%	0.056	40%	0.395	C	S	.	.	H	α-helix	trans	-72.5	-38.9	177.1	-65.6	161.6	-120.2	0	0	111.1	L344 N345 N350 L351 F352 I504 K508	L344-E348 WeakPolarHBondContact CA-OE2 3.44Å; L344-E348 HydrophobicContact CB-CB 3.89Å; L344-E348 HydrophobicContact CD2-CB 4.11Å; L344-E348 WeakPolarHBondContact CD2-OE2 3.23Å; N345-E348 VanDerWaalsContact CB-OE1 3.27Å; N345-E348 WeakPolarHBondContact CB-OE1 3.44Å; N345-E348 PolarHBondContact N-OE1 3.38Å; N345-E348 PolarHBondContact ND2-OE1 2.96Å; N345-E348 WeakPolarHBondContact O-CA 3.33Å; N345-E348 WeakPolarHBondContact O-CB 3.35Å; N345-E348 PolarHBondContact O-N 3.27Å; E348-N350 VanDerWaalsContact C-N 3.33Å; E348-N350 PolarHBondContact O-N 3.01Å; E348-L351 PolarHBondContact O-N 2.86Å; E348-F352 WeakPolarHBondContact O-CD2 3.39Å; E348-F352 PolarHBondContact O-N 3.1Å; E348-F352 VanDerWaalsContact O-N 3.07Å; E348-I504 HydrophobicContact CG-CG2 3.61Å; E348-K508 IonicContact OE1-NZ 2.69Å; E348-K508 PolarHBondContact OE1-NZ 3.41Å; E348-K508 IonicContact OE2-NZ 3.16Å; E348-K508 PolarHBondContact OE2-NZ 3.47Å
349	Q	61.7	Low	59.1	Low	99 Å²	99	73.7 Å²	73.7	46%	0.463	40%	0.403	S	S	.	.	H	α-helix	trans	-62.1	-41	173.6	-65.4	178.6	33	0	0	111.1	L344 N345 I346 L351 F352 S353	L344-Q349 HydrophobicContact CB-CG 3.74Å; L344-Q349 PolarHBondContact O-NE2 3.36Å; N345-Q349 PolarHBondContact O-N 2.91Å; I346-Q349 PolarHBondContact O-N 3.3Å; Q349-L351 VanDerWaalsContact C-N 3.31Å; Q349-L351 PolarHBondContact O-N 2.97Å; Q349-F352 WeakPolarHBondContact O-CB 3.33Å; Q349-F352 PolarHBondContact O-N 3.16Å; Q349-S353 PolarHBondContact O-N 3.47Å; Q349-S353 PolarHBondContact O-OG 3.43Å
350	N	60.6	Low	59.6	Low	103 Å²	103	75.5 Å²	75.5	55%	0.551	42%	0.422	S	S	*	.	H	α-helix	trans	-62	-35.5	175.2	-68.9	-12.9	0	0	0	112.8	I346 E348 S354	I346-N350 PolarHBondContact O-N 3.26Å; I346-N350 PolarHBondContact O-ND2 2.87Å; I346-N350 PolarHBondContact O-OD1 3.14Å; E348-N350 VanDerWaalsContact C-N 3.33Å; E348-N350 PolarHBondContact O-N 3.01Å; N350-S354 WeakPolarHBondContact O-CB 3.19Å; N350-S354 PolarHBondContact O-N 2.96Å
351	L	61.8	Low	59.6	Low	42 Å²	42	75.3 Å²	75.3	22%	0.22	42%	0.422	C	S	.	.	H	α-helix	trans	-67.7	-40.7	173.5	-72.2	167.9	0	0	0	112	S347 E348 Q349 S354 M355 I501 I504	S347-L351 PolarHBondContact O-N 3.39Å; E348-L351 PolarHBondContact O-N 2.86Å; Q349-L351 VanDerWaalsContact C-N 3.31Å; Q349-L351 PolarHBondContact O-N 2.97Å; L351-S354 PolarHBondContact O-N 3.36Å; L351-M355 PolarHBondContact O-N 3.14Å; L351-I501 HydrophobicContact CB-CD1 4.45Å; L351-I501 HydrophobicContact CB-CG1 4.04Å; L351-I504 HydrophobicContact CD1-CD1 3.44Å; L351-I504 VanDerWaalsContact CD1-CD1 3.44Å
352	F	65.4	Low	59.1	Low	45 Å²	45	77.3 Å²	77.3	20%	0.197	44%	0.439	C	S	.	.	H	α-helix	trans	-60.9	-48.1	172.2	-92.7	-87.7	0	0	0	112.1	L344 E348 Q349 S354 M355 E356 I501	L344-F352 HydrophobicContact CD1-CD2 3.57Å; L344-F352 HydrophobicContact CD1-CE2 3.55Å; L344-F352 HydrophobicContact CD1-CG 4.32Å; L344-F352 HydrophobicContact CD1-CZ 4.32Å; L344-F352 HydrophobicContact CD2-CD2 4.44Å; L344-F352 HydrophobicContact CD2-CE2 3.9Å; L344-F352 HydrophobicContact CG-CE2 4.41Å; E348-F352 WeakPolarHBondContact O-CD2 3.39Å; E348-F352 PolarHBondContact O-N 3.1Å; E348-F352 VanDerWaalsContact O-N 3.07Å; Q349-F352 WeakPolarHBondContact O-CB 3.33Å; Q349-F352 PolarHBondContact O-N 3.16Å; F352-S354 PolarHBondContact O-N 3.2Å; F352-M355 HydrophobicContact CD1-CE 3.7Å; F352-M355 HydrophobicContact CE1-CE 3.88Å; F352-M355 WeakPolarHBondContact O-CB 3.3Å; F352-M355 PolarHBondContact O-N 2.62Å; F352-M355 VanDerWaalsContact O-N 3.09Å; F352-E356 PolarHBondContact O-N 3.28Å; F352-I501 HydrophobicContact CD1-CD1 4.23Å; F352-I501 HydrophobicContact CD2-CD1 3.9Å; F352-I501 HydrophobicContact CD2-CG1 4.15Å; F352-I501 HydrophobicContact CD2-CG2 4.23Å; F352-I501 HydrophobicContact CE1-CD1 4.38Å; F352-I501 HydrophobicContact CE1-CG2 4.38Å; F352-I501 HydrophobicContact CE2-CB 4.38Å; F352-I501 HydrophobicContact CE2-CD1 4.07Å; F352-I501 HydrophobicContact CE2-CG1 4.12Å; F352-I501 HydrophobicContact CE2-CG2 3.37Å; F352-I501 HydrophobicContact CG-CD1 4Å; F352-I501 HydrophobicContact CZ-CD1 4.31Å; F352-I501 HydrophobicContact CZ-CG2 3.46Å; F352-I501 VanDerWaalsContact CZ-CG2 3.46Å
353	S	68.8	Low	58.4	Low	68 Å²	68	82.7 Å²	82.7	48%	0.476	46%	0.456	S	S	.	.	H	α-helix	trans	-60.8	-34.4	175.7	-56.7	0	0	0	0	112.4	Q349 E356 A357	Q349-S353 PolarHBondContact O-N 3.47Å; Q349-S353 PolarHBondContact O-OG 3.43Å; S353-E356 PolarHBondContact O-N 2.99Å; S353-A357 WeakPolarHBondContact O-CB 3.42Å; S353-A357 PolarHBondContact O-N 2.81Å
354	S	65.8	Low	57.6	Low	56 Å²	56	82.8 Å²	82.8	39%	0.392	46%	0.463	S	S	.	.	H	α-helix	trans	-69.2	-37.3	174.1	-171.2	0	0	0	0	112.3	N350 L351 F352 A357 I358	N350-S354 WeakPolarHBondContact O-CB 3.19Å; N350-S354 PolarHBondContact O-N 2.96Å; L351-S354 PolarHBondContact O-N 3.36Å; F352-S354 PolarHBondContact O-N 3.2Å; S354-A357 PolarHBondContact O-N 3.04Å; S354-I358 WeakPolarHBondContact O-CD1 3.17Å; S354-I358 VanDerWaalsContact O-CG1 3.31Å; S354-I358 WeakPolarHBondContact O-CG1 3.31Å; S354-I358 PolarHBondContact O-N 3.37Å; S354-I358 VanDerWaalsContact O-N 3.1Å
355	M	69.7	Low	56.3	Low	36 Å²	36	86.9 Å²	86.9	18%	0.177	49%	0.485	C	S	.	.	H	α-helix	trans	-65.9	-41.6	172.9	-176.4	179.9	61.8	0	0	111.5	L351 F352 A357 I358 V359 E498 I501	L351-M355 PolarHBondContact O-N 3.14Å; F352-M355 HydrophobicContact CD1-CE 3.7Å; F352-M355 HydrophobicContact CE1-CE 3.88Å; F352-M355 WeakPolarHBondContact O-CB 3.3Å; F352-M355 PolarHBondContact O-N 2.62Å; F352-M355 VanDerWaalsContact O-N 3.09Å; M355-A357 VanDerWaalsContact C-N 3.34Å; M355-A357 PolarHBondContact O-N 3.46Å; M355-I358 PolarHBondContact O-N 3.18Å; M355-V359 WeakPolarHBondContact O-CG2 3.37Å; M355-V359 PolarHBondContact O-N 3.16Å; M355-E498 HydrophobicContact SD-CB 4.19Å; M355-I501 HydrophobicContact CB-CD1 4.29Å; M355-I501 HydrophobicContact CE-CD1 3.85Å; M355-I501 HydrophobicContact SD-CD1 3.92Å
356	E	62.6	Low	54.5	Low	106 Å²	106	90.1 Å²	90.1	50%	0.495	50%	0.502	S	S	.	.	H	α-helix	trans	-61.7	-41.2	173.2	-70.9	-174.1	163.3	0	0	111.6	F352 S353 I358 V359 A360	F352-E356 PolarHBondContact O-N 3.28Å; S353-E356 PolarHBondContact O-N 2.99Å; E356-I358 VanDerWaalsContact C-N 3.32Å; E356-I358 PolarHBondContact O-N 2.86Å; E356-V359 PolarHBondContact O-N 3.3Å; E356-V359 VanDerWaalsContact O-N 3.1Å; E356-A360 WeakPolarHBondContact O-CB 3.35Å; E356-A360 PolarHBondContact O-N 2.79Å
357	A	70.7	Confident	52.9	Low	67 Å²	67	89 Å²	89	55%	0.554	50%	0.502	S	S	*	.	H	α-helix	trans	-65.5	-28.7	175.8	0	0	0	0	0	114	S353 S354 M355 V359	S353-A357 WeakPolarHBondContact O-CB 3.42Å; S353-A357 PolarHBondContact O-N 2.81Å; S354-A357 PolarHBondContact O-N 3.04Å; M355-A357 VanDerWaalsContact C-N 3.34Å; M355-A357 PolarHBondContact O-N 3.46Å; A357-V359 VanDerWaalsContact C-N 3.33Å
358	I	64.4	Low	51.3	Low	41 Å²	41	92.8 Å²	92.8	21%	0.21	52%	0.516	C	S	.	.	H	α-helix	trans	-72.7	-27.6	172.8	-68	160.6	0	0	0	111.5	S354 M355 E356 K490 K493 R494 T497	S354-I358 WeakPolarHBondContact O-CD1 3.17Å; S354-I358 VanDerWaalsContact O-CG1 3.31Å; S354-I358 WeakPolarHBondContact O-CG1 3.31Å; S354-I358 PolarHBondContact O-N 3.37Å; S354-I358 VanDerWaalsContact O-N 3.1Å; M355-I358 PolarHBondContact O-N 3.18Å; E356-I358 VanDerWaalsContact C-N 3.32Å; E356-I358 PolarHBondContact O-N 2.86Å; I358-K490 HydrophobicContact CG2-CG 4.36Å; I358-K493 HydrophobicContact CD1-CB 4.21Å; I358-R494 HydrophobicContact CG2-CB 3.98Å; I358-T497 HydrophobicContact CD1-CG2 3.91Å
359	V	56.6	Low	49.5	Very low	79 Å²	79	103.7 Å²	103.7	48%	0.479	56%	0.558	S	S	.	*	H	α-helix	trans	-87	-28.2	178.4	174.8	0	0	0	0	112.2	M355 E356 A357 E361	M355-V359 WeakPolarHBondContact O-CG2 3.37Å; M355-V359 PolarHBondContact O-N 3.16Å; E356-V359 PolarHBondContact O-N 3.3Å; E356-V359 VanDerWaalsContact O-N 3.1Å; A357-V359 VanDerWaalsContact C-N 3.33Å; V359-E361 PolarHBondContact O-N 2.86Å; V359-E361 VanDerWaalsContact O-N 3.1Å
360	A	49.1	Very low	47.9	Very low	70 Å²	70	109.5 Å²	109.5	58%	0.579	58%	0.576	S	S	*	*			trans	-78.6	87	179.5	0	0	0	0	0	112.4	E356	E356-A360 WeakPolarHBondContact O-CB 3.35Å; E356-A360 PolarHBondContact O-N 2.79Å
361	E	46.9	Very low	46.2	Very low	129 Å²	129	110.6 Å²	110.6	60%	0.603	59%	0.586	S	S	*	*			trans	-73	133.5	176.7	-172.5	162.2	-88.3	0	0	112.4	V359 K490	V359-E361 PolarHBondContact O-N 2.86Å; V359-E361 VanDerWaalsContact O-N 3.1Å; E361-K490 IonicContact OE1-NZ 3.9Å; E361-K490 PolarHBondContact OE1-NZ 2.7Å
362	P	37.8	Very low	44.6	Very low	102 Å²	102	117.2 Å²	117.2	66%	0.662	62%	0.616	S	S	*	*			trans	-72.2	136.3	169.7	30.4	-33.8	0	0	0	110.3	L364	P362-L364 PolarHBondContact O-N 3.47Å
363	H	29.4	Very low	42.8	Very low	182 Å²	182	123.7 Å²	123.7	84%	0.843	65%	0.647	S	S	*	*			trans	-61.2	109.1	174.2	-87.5	-93.7	0	0	0	111	D365	H363-D365 PolarHBondContact O-N 2.67Å; H363-D365 VanDerWaalsContact O-N 3.11Å
364	L	32.5	Very low	40.9	Very low	145 Å²	145	127.4 Å²	127.4	76%	0.759	66%	0.661	S	S	*	*			trans	-79.5	82.2	172	-81.4	166.4	0	0	0	110.7	P362 N366	P362-L364 PolarHBondContact O-N 3.47Å; L364-N366 PolarHBondContact O-N 2.78Å; L364-N366 PolarHBondContact O-ND2 2.68Å
365	D	29	Very low	38.9	Very low	141 Å²	141	131.9 Å²	131.9	75%	0.754	68%	0.681	S	S	*	*			trans	-67.2	110.4	166.9	-84.9	-33.6	0	0	0	110	H363 T367	H363-D365 PolarHBondContact O-N 2.67Å; H363-D365 VanDerWaalsContact O-N 3.11Å; D365-T367 VanDerWaalsContact C-N 3.27Å; D365-T367 PolarHBondContact O-N 3.24Å
366	N	26	Very low	37.1	Very low	160 Å²	160	138.3 Å²	138.3	86%	0.856	71%	0.714	S	S	*	*			trans	-80.9	64.1	-176.3	-83.7	-72.3	0	0	0	112.5	L364	L364-N366 PolarHBondContact O-N 2.78Å; L364-N366 PolarHBondContact O-ND2 2.68Å
367	T	28	Very low	35.4	Very low	108 Å²	108	141.9 Å²	141.9	66%	0.663	73%	0.731	S	S	*	*			trans	-140.7	88.4	169.6	53.9	0	0	0	0	111.5	D365	D365-T367 VanDerWaalsContact C-N 3.27Å; D365-T367 PolarHBondContact O-N 3.24Å
368	D	28.5	Very low	33.3	Very low	157 Å²	157	145 Å²	145	84%	0.84	74%	0.743	S	S	*	*				170.3	122.8	106.1	-87.8	-15	0	0	0	112.9
369	Y	25.2	Very low	31.4	Very low	241 Å²	241	150.4 Å²	150.4	95%	0.945	77%	0.773	S	S	*	*			trans	-98.4	112.3	156.4	-77.6	-84	0	0	0	108.7
370	R	26.8	Very low	30	Very low	222 Å²	222	154.6 Å²	154.6	84%	0.838	79%	0.791	S	S	*	*				151.4	128.6	119.9	-174	-173.7	-114.8	-146	-3.2	113.2
371	T	25.7	Very low	28.9	Very low	125 Å²	125	161.3 Å²	161.3	77%	0.767	81%	0.808	S	S	*	*			trans	63.6	147.3	167.4	38.2	0	0	0	0	116.1
372	E	28.4	Very low	28	Very low	182 Å²	182	160.4 Å²	160.4	85%	0.85	82%	0.816	S	S	*	*			cis	-118.7	168.5	14.7	-67.3	-176.7	147.5	0	0	114.1
373	Q	27.1	Very low	27.4	Very low	181 Å²	181	161.6 Å²	161.6	85%	0.846	82%	0.817	S	S	*	*			trans	-93.2	132.4	173.6	-60.9	165.3	-89.6	0	0	110
374	N	28.1	Very low	27.3	Very low	145 Å²	145	159.9 Å²	159.9	78%	0.775	82%	0.819	S	S	*	*			trans	-165	105.7	150.3	-96.9	-42.7	0	0	0	112.7
375	N	24.9	Very low	27	Very low	151 Å²	151	159 Å²	159	81%	0.807	82%	0.815	S	S	*	*			trans	28.3	94.6	142.8	-49.6	-15.2	0	0	0	119.2
376	I	32.1	Very low	26.9	Very low	171 Å²	171	157.5 Å²	157.5	88%	0.877	81%	0.814	S	S	*	*			trans	-127.3	144.5	136.8	-64.9	-174.8	0	0	0	107.2
377	E	27.1	Very low	26.9	Very low	180 Å²	180	157.2 Å²	157.2	84%	0.841	81%	0.811	S	S	*	*			trans	-77.4	154.9	-165.6	-63.7	173.7	129	0	0	114.1	N379	E377-N379 PolarHBondContact O-N 3.47Å
378	T	25.4	Very low	26.6	Very low	133 Å²	133	161.2 Å²	161.2	82%	0.816	82%	0.819	S	S	*	*			trans	-67.6	110.2	175.4	48.3	0	0	0	0	111.7
379	N	25.3	Very low	26.6	Very low	155 Å²	155	159.2 Å²	159.2	83%	0.829	81%	0.812	S	S	*	*			trans	-158.4	80.5	159.1	-95.2	-41.9	0	0	0	111.2	E377	E377-N379 PolarHBondContact O-N 3.47Å
380	L	26.9	Very low	26.5	Very low	166 Å²	166	155.1 Å²	155.1	87%	0.869	81%	0.807	S	S	*	*			trans	-120.7	46.4	168.6	-153.2	79.5	0	0	0	111.9
381	F	25	Very low	26.6	Very low	211 Å²	211	151.5 Å²	151.5	93%	0.925	80%	0.804	S	S	*	*			trans	-128.3	75.5	163.9	-92.8	-79.1	0	0	0	108.8
382	S	28.2	Very low	26.6	Very low	110 Å²	110	152.1 Å²	152.1	77%	0.769	80%	0.802	S	S	*	*			trans	-99.2	127.9	166	57.2	0	0	0	0	109
383	N	26.3	Very low	26.6	Very low	127 Å²	127	150.9 Å²	150.9	68%	0.679	80%	0.799	S	S	*	*			trans	-40.3	150.2	-172	-57.7	-30.5	0	0	0	116.6	D385	N383-D385 PolarHBondContact O-N 3.48Å
384	V	27.4	Very low	26.4	Very low	146 Å²	146	150.6 Å²	150.6	89%	0.885	80%	0.798	S	S	*	*			trans	-66.1	92.6	143.8	177.7	0	0	0	0	106.9	C386	V384-C386 PolarHBondContact O-N 3.16Å; V384-C386 VanDerWaalsContact O-N 3.14Å
385	D	26.2	Very low	26.1	Very low	128 Å²	128	149.7 Å²	149.7	68%	0.684	80%	0.798	S	S	*	*			trans	-68.3	111.4	176	-84.7	-27.7	0	0	0	109.9	N383 I387	N383-D385 PolarHBondContact O-N 3.48Å; D385-I387 PolarHBondContact O-N 2.9Å; D385-I387 VanDerWaalsContact O-N 3.16Å
386	C	25.7	Very low	26.1	Very low	108 Å²	108	148 Å²	148	73%	0.73	80%	0.798	S	S	*	*			trans	-56.7	119.8	174.1	-68.7	0	0	0	0	110.2	V384 K388	V384-C386 PolarHBondContact O-N 3.16Å; V384-C386 VanDerWaalsContact O-N 3.14Å; C386-K388 PolarHBondContact O-N 3.11Å
387	I	26.2	Very low	25.6	Very low	154 Å²	154	145.2 Å²	145.2	79%	0.79	79%	0.793	S	S	*	*			trans	-59.5	98.8	179.4	-62.7	174.4	0	0	0	109.9	D385 T389	D385-I387 PolarHBondContact O-N 2.9Å; D385-I387 VanDerWaalsContact O-N 3.16Å; I387-T389 HydrophobicContact CG2-CG2 3.78Å; I387-T389 PolarHBondContact O-N 3.36Å
388	K	23.1	Very low	25.6	Very low	193 Å²	193	141.8 Å²	141.8	84%	0.839	79%	0.789	S	S	*	*			trans	-92.8	75.5	170.1	-74	-178.3	178.5	174.8	0	109.7	C386 N390	C386-K388 PolarHBondContact O-N 3.11Å; K388-N390 PolarHBondContact O-N 3.06Å
389	T	27.2	Very low	25.5	Very low	114 Å²	114	144.3 Å²	144.3	70%	0.699	79%	0.789	S	S	*	*			trans	-68.7	93.3	166.5	44.8	0	0	0	0	109.7	I387	I387-T389 HydrophobicContact CG2-CG2 3.78Å; I387-T389 PolarHBondContact O-N 3.36Å
390	N	24	Very low	25.6	Very low	155 Å²	155	144.5 Å²	144.5	83%	0.829	79%	0.79	S	S	*	*			trans	-130.1	45.9	176.5	-110.5	20	0	0	0	110.9	K388 I392	K388-N390 PolarHBondContact O-N 3.06Å; N390-I392 PolarHBondContact O-N 2.96Å
391	D	28.4	Very low	25.5	Very low	147 Å²	147	145 Å²	145	79%	0.786	79%	0.789	S	S	*	*			trans	-80.6	95.2	173.1	-81.4	-47.3	0	0	0	111.6
392	I	25	Very low	25.7	Very low	138 Å²	138	142.9 Å²	142.9	71%	0.708	79%	0.786	S	S	*	*			trans	41.4	85.5	138.6	-45.5	176	0	0	0	115.7	N390 Q394	N390-I392 PolarHBondContact O-N 2.96Å; I392-Q394 HydrophobicContact CG2-CG 4.29Å
393	I	28.3	Very low	25.4	Very low	156 Å²	156	146.2 Å²	146.2	80%	0.8	79%	0.79	S	S	*	*			trans	-96	130.2	140.8	-67.2	179.2	0	0	0	107.2	T395	I393-T395 PolarHBondContact O-N 3.12Å
394	Q	23.6	Very low	25.5	Very low	175 Å²	175	147.5 Å²	147.5	82%	0.818	80%	0.795	S	S	*	*			trans	-73.4	96	-175.3	-67.7	174	-46	0	0	111.6	I392 S396	I392-Q394 HydrophobicContact CG2-CG 4.29Å; Q394-S396 PolarHBondContact O-N 2.97Å
395	T	22.3	Very low	25.3	Very low	125 Å²	125	146.4 Å²	146.4	77%	0.767	78%	0.784	S	S	*	*			trans	-94.6	83.2	165.2	55.2	0	0	0	0	110	I393 S397	I393-T395 PolarHBondContact O-N 3.12Å; T395-S397 VanDerWaalsContact C-N 3.34Å; T395-S397 PolarHBondContact O-N 2.84Å
396	S	25.2	Very low	25.5	Very low	116 Å²	116	148.5 Å²	148.5	81%	0.811	80%	0.795	S	S	*	*			trans	-73.1	87.2	169.2	53	0	0	0	0	110.1	Q394 S398	Q394-S396 PolarHBondContact O-N 2.97Å; S396-S398 PolarHBondContact O-N 2.99Å
397	S	21.3	Very low	25.4	Very low	112 Å²	112	149.1 Å²	149.1	78%	0.783	79%	0.791	S	S	*	*			trans	-76.6	109.8	171.5	54.7	0	0	0	0	110.5	T395	T395-S397 VanDerWaalsContact C-N 3.34Å; T395-S397 PolarHBondContact O-N 2.84Å
398	S	26.4	Very low	25.2	Very low	109 Å²	109	148.9 Å²	148.9	76%	0.762	79%	0.791	S	S	*	*			trans	-101.7	138.5	160.4	57.3	0	0	0	0	109.9	S396	S396-S398 PolarHBondContact O-N 2.99Å
399	F	24.1	Very low	25.5	Very low	185 Å²	185	147.8 Å²	147.8	81%	0.811	79%	0.793	S	S	*	*			trans	-50.1	156.8	164.5	-51.3	-96	0	0	0	110.5
400	D	27	Very low	25.4	Very low	159 Å²	159	150.6 Å²	150.6	85%	0.85	80%	0.798	S	S	*	*			cis	-139.7	172.7	38.8	-75.3	-59.3	0	0	0	114.8
401	E	24.2	Very low	25.5	Very low	178 Å²	178	150.3 Å²	150.3	83%	0.832	80%	0.796	S	S	*	*			trans	-76.4	155.3	170.9	-57.6	-174.7	159.2	0	0	112.5
402	N	28.7	Very low	25.4	Very low	165 Å²	165	150.6 Å²	150.6	88%	0.882	79%	0.793	S	S	*	*			trans	-175.4	136.3	135.2	-99.1	-67.2	0	0	0	110.1
403	E	22.8	Very low	25.4	Very low	180 Å²	180	150 Å²	150	84%	0.841	79%	0.791	S	S	*	*			trans	-78.9	159.3	163.5	-61.8	-176	115.4	0	0	110.7
404	I	29.1	Very low	25.3	Very low	154 Å²	154	148.5 Å²	148.5	79%	0.79	78%	0.784	S	S	*	*				170.6	133.5	125.5	-88.9	157.9	0	0	0	111.8
405	N	22.8	Very low	25.2	Very low	123 Å²	123	146.8 Å²	146.8	66%	0.658	78%	0.781	S	S	*	*			trans	6	137.5	161.9	-65.3	-75	0	0	0	121.5
406	L	29.7	Very low	25.3	Very low	173 Å²	173	146 Å²	146	91%	0.906	78%	0.781	S	S	*	*				-154.8	144.5	110.5	-109.8	156.8	0	0	0	111.6
407	N	23.7	Very low	25.3	Very low	120 Å²	120	148.9 Å²	148.9	64%	0.642	78%	0.781	S	S	*	*			trans	-106.4	154.8	-175.7	-69.2	-53.8	0	0	0	112
408	N	22.7	Very low	25.6	Very low	149 Å²	149	151 Å²	151	80%	0.797	78%	0.784	S	S	*	*			trans	43.6	132	149.1	-56.2	1.2	0	0	0	120.8
409	I	29.4	Very low	25.4	Very low	171 Å²	171	154 Å²	154	88%	0.877	79%	0.79	S	S	*	*				-164.7	152	118.4	-99.7	154.3	0	0	0	109.1
410	E	24.4	Very low	25.6	Very low	173 Å²	173	149.5 Å²	149.5	81%	0.808	79%	0.788	S	S	*	*			trans	-94.7	158.4	-178	-63.2	160.8	113.7	0	0	111.1
411	D	27.2	Very low	25.5	Very low	148 Å²	148	150.7 Å²	150.7	79%	0.791	79%	0.793	S	S	*	*				177.1	134.3	119.1	-96.7	-29.9	0	0	0	116.6
412	H	25.3	Very low	25.6	Very low	154 Å²	154	149 Å²	149	71%	0.713	79%	0.79	S	S	*	*			trans	22.9	132.4	147.6	-78.9	-70.8	0	0	0	126.4
413	N	24.6	Very low	25.4	Very low	125 Å²	125	144.3 Å²	144.3	67%	0.668	78%	0.78	S	S	*	*			trans	66.4	158.9	134.8	-70.8	37.6	0	0	0	120
414	D	25.6	Very low	25.5	Very low	124 Å²	124	142.7 Å²	142.7	66%	0.663	78%	0.777	S	S	*	*			cis	-145.3	-176.1	0.8	-139.2	-56.6	0	0	0	112.6
415	N	23	Very low	25.4	Very low	139 Å²	139	139.5 Å²	139.5	74%	0.743	77%	0.768	S	S	*	*			trans	-58.4	137.7	-178.4	-69.7	-92.9	0	0	0	115.5
416	S	24.3	Very low	25.5	Very low	110 Å²	110	138.9 Å²	138.9	77%	0.769	77%	0.773	S	S	*	*				179.6	142.9	116.9	-83	0	0	0	0	115.4
417	Q	24.9	Very low	25.3	Very low	175 Å²	175	140.9 Å²	140.9	82%	0.818	77%	0.77	S	S	*	*			trans	18.2	124.9	155.8	-54.7	-174.7	9.9	0	0	120.4
418	N	28.1	Very low	25.5	Very low	157 Å²	157	140.7 Å²	140.7	84%	0.84	77%	0.767	S	S	*	*				-161.3	155.1	117.9	-111.8	-61.2	0	0	0	113.2
419	L	22.5	Very low	25.6	Very low	171 Å²	171	141 Å²	141	90%	0.895	77%	0.769	S	S	*	*			trans	-82.9	128.7	170.6	-74.5	76.4	0	0	0	109.3
420	A	26.6	Very low	25.5	Very low	92 Å²	92	140.8 Å²	140.8	76%	0.76	76%	0.764	S	S	*	*			trans	-139.5	98.6	167.8	0	0	0	0	0	110.5	N422	A420-N422 PolarHBondContact O-N 2.83Å
421	L	24.8	Very low	25.7	Very low	184 Å²	184	141.7 Å²	141.7	96%	0.963	77%	0.765	S	S	*	*			trans	-69.6	104.7	160.9	-77.2	168.6	0	0	0	107.8
422	N	26.7	Very low	25.7	Very low	143 Å²	143	142.7 Å²	142.7	77%	0.765	77%	0.77	S	S	*	*			trans	-144.7	118.4	164.5	-148.1	-0.6	0	0	0	110	A420	A420-N422 PolarHBondContact O-N 2.83Å
423	G	24.1	Very low	25.8	Very low	65 Å²	65	144 Å²	144	67%	0.67	78%	0.777	S	S	*	*			trans	-82.8	140	175	0	0	0	0	0	109.8
424	N	26.6	Very low	25.9	Very low	147 Å²	147	149 Å²	149	79%	0.786	79%	0.786	S	S	*	*			trans	-147.2	140.5	163.9	-109.6	-36.6	0	0	0	113.1
425	S	25.9	Very low	26.1	Very low	86 Å²	86	151.1 Å²	151.1	60%	0.601	80%	0.798	S	S	*	*			trans	-23.6	123.8	164.9	180	0	0	0	0	116.3	Y427	S425-Y427 WeakPolarHBondContact OG-CD2 3.41Å; S425-Y427 PolarHBondContact OG-N 3.49Å
426	C	25.5	Very low	26.4	Very low	111 Å²	111	148.9 Å²	148.9	75%	0.75	79%	0.793	S	S	*	*			trans	-111.5	67.9	156.7	-79.5	0	0	0	0	110.8	I428	C426-I428 HydrophobicContact CB-CD1 4.25Å; C426-I428 HydrophobicContact CB-CG1 4.14Å; C426-I428 PolarHBondContact O-N 3.18Å
427	Y	24.5	Very low	26.9	Very low	215 Å²	215	148.3 Å²	148.3	84%	0.843	79%	0.789	S	S	*	*			trans	-67.6	82.9	153.8	-91	-89.8	0	0	0	109	S425	S425-Y427 WeakPolarHBondContact OG-CD2 3.41Å; S425-Y427 PolarHBondContact OG-N 3.49Å
428	I	28.8	Very low	27.7	Very low	115 Å²	115	146.1 Å²	146.1	59%	0.59	79%	0.787	S	S	*	*			trans	-89.3	114.9	174.5	-64.3	178.4	0	0	0	109	C426 H430	C426-I428 HydrophobicContact CB-CD1 4.25Å; C426-I428 HydrophobicContact CB-CG1 4.14Å; C426-I428 PolarHBondContact O-N 3.18Å; I428-H430 PolarHBondContact O-N 3.47Å
429	N	24.4	Very low	28.2	Very low	156 Å²	156	144.1 Å²	144.1	83%	0.834	79%	0.786	S	S	*	*			trans	-68.3	84.9	176	-77.7	-49.6	0	0	0	111.7	K431	N429-K431 PolarHBondContact O-N 2.92Å
430	H	27.8	Very low	28.8	Very low	167 Å²	167	139.1 Å²	139.1	77%	0.773	78%	0.776	S	S	*	*			trans	-76	92.3	166.1	-84.1	-75.9	0	0	0	110.8	I428	I428-H430 PolarHBondContact O-N 3.47Å
431	K	27.5	Very low	29.5	Very low	192 Å²	192	139 Å²	139	84%	0.835	76%	0.756	S	S	*	*			trans	-56.4	146.1	163.3	-74.2	-179.2	175.1	177.8	0	109.8	N429 Q433	N429-K431 PolarHBondContact O-N 2.92Å; K431-Q433 PolarHBondContact O-N 3.43Å; K431-Q433 VanDerWaalsContact O-N 3.07Å
432	N	27.5	Very low	30.8	Very low	168 Å²	168	133.5 Å²	133.5	90%	0.898	73%	0.732	S	S	*	*			trans	-49.1	111.8	-177.6	-71.9	-40.8	0	0	0	113.1
433	Q	28.6	Very low	32.3	Very low	182 Å²	182	130.2 Å²	130.2	85%	0.85	72%	0.72	S	S	*	*			trans	-127.5	103.3	160.9	-143.8	167.1	20.6	0	0	107.7	K431	K431-Q433 PolarHBondContact O-N 3.43Å; K431-Q433 VanDerWaalsContact O-N 3.07Å
434	R	26.4	Very low	33.4	Very low	230 Å²	230	131.9 Å²	131.9	87%	0.868	71%	0.714	S	S	*	*			trans	-65.9	153.4	169.9	-67.5	174.5	176.1	152.4	-3	108.1
435	N	29	Very low	34.5	Very low	168 Å²	168	128.7 Å²	128.7	90%	0.898	70%	0.696	S	S	*	*			trans	81.7	77.6	-169.4	-46.1	-13.2	0	0	0	113.4
436	S	30.7	Very low	36	Very low	93 Å²	93	129.1 Å²	129.1	65%	0.65	69%	0.691	S	S	*	*			trans	-120.7	144.9	163	60.4	0	0	0	0	110.5
437	S	34.2	Very low	37.4	Very low	98 Å²	98	125.5 Å²	125.5	69%	0.685	67%	0.669	S	S	*	*			trans	-72.1	146.3	-171.6	46.6	0	0	0	0	113	S439	S437-S439 PolarHBondContact O-N 2.89Å
438	V	41.5	Very low	38.9	Very low	128 Å²	128	120 Å²	120	78%	0.776	65%	0.65	S	S	*	*	S	Bend	trans	-64.3	-24.1	-175.7	-177.5	0	0	0	0	113	G440	V438-G440 PolarHBondContact O-N 3.03Å
439	S	37.7	Very low	40.4	Very low	116 Å²	116	119 Å²	119	81%	0.811	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.1	82.1	-176.9	176.7	0	0	0	0	113.1	S437	S437-S439 PolarHBondContact O-N 2.89Å
440	G	37	Very low	42.4	Very low	66 Å²	66	113.1 Å²	113.1	68%	0.68	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	149.9	3.8	167.7	0	0	0	0	0	117.5	V438 S442	V438-G440 PolarHBondContact O-N 3.03Å; G440-S442 PolarHBondContact O-N 3.5Å
441	R	41.1	Very low	44.3	Very low	90 Å²	90	106 Å²	106	34%	0.34	58%	0.583	S	S	.	*			trans	-61.2	130	173.8	-61.6	175.1	114	80.3	-14.4	109.5	L445 L446 E449	R441-L445 HydrophobicContact CB-CD2 4.01Å; R441-L445 HydrophobicContact CG-CD2 3.94Å; R441-L446 HydrophobicContact CB-CD2 4.15Å; R441-L446 HydrophobicContact CB-CG 4.26Å; R441-E449 IonicContact CZ-OE1 2.65Å; R441-E449 IonicContact CZ-OE2 2.92Å; R441-E449 VanDerWaalsContact CZ-OE2 3.26Å; R441-E449 IonicContact NE-OE1 3.56Å; R441-E449 IonicContact NE-OE2 2.75Å; R441-E449 PolarHBondContact NE-OE2 3.01Å; R441-E449 IonicContact NH2-OE1 2.64Å; R441-E449 PolarHBondContact NH2-OE1 3.45Å; R441-E449 IonicContact NH2-OE2 3.88Å; R441-E449 PolarHBondContact NH2-OE2 3.16Å
442	S	51	Low	46.1	Very low	67 Å²	67	100.7 Å²	100.7	47%	0.469	57%	0.566	S	S	.	*			trans	-70.6	157.2	175.1	68.7	0	0	0	0	110.9	G440 L444 L445 L446	G440-S442 PolarHBondContact O-N 3.5Å; S442-L444 PolarHBondContact O-N 3.43Å; S442-L445 WeakPolarHBondContact O-CA 3.44Å; S442-L445 WeakPolarHBondContact O-CB 3.37Å; S442-L445 PolarHBondContact O-N 3.34Å; S442-L445 PolarHBondContact OG-N 2.75Å; S442-L446 PolarHBondContact O-N 2.88Å; S442-L446 VanDerWaalsContact O-N 3.08Å
443	S	58.4	Low	48.6	Very low	74 Å²	74	96.7 Å²	96.7	52%	0.517	55%	0.545	S	S	.	.	H	α-helix	trans	-55.9	-37.8	176.8	47.8	0	0	0	0	112.6	L445 L446 A447	S443-L445 VanDerWaalsContact C-N 3.32Å; S443-L445 PolarHBondContact O-N 3.06Å; S443-L446 PolarHBondContact O-N 2.93Å; S443-A447 PolarHBondContact O-N 3.12Å
444	L	48.3	Very low	51.4	Low	101 Å²	101	90.2 Å²	90.2	53%	0.529	52%	0.515	S	S	.	.	H	α-helix	trans	-63.1	-35.2	173.7	-68.6	172.1	0	0	0	112.8	S442 F448	S442-L444 PolarHBondContact O-N 3.43Å; L444-F448 PolarHBondContact O-N 3.14Å
445	L	49.6	Very low	54.4	Low	80 Å²	80	81 Å²	81	42%	0.419	48%	0.483	S	S	.	.	H	α-helix	trans	-71.1	-38.5	176.2	-163.2	76.6	0	0	0	111.3	R441 S442 S443 F448 E449	R441-L445 HydrophobicContact CB-CD2 4.01Å; R441-L445 HydrophobicContact CG-CD2 3.94Å; S442-L445 WeakPolarHBondContact O-CA 3.44Å; S442-L445 WeakPolarHBondContact O-CB 3.37Å; S442-L445 PolarHBondContact O-N 3.34Å; S442-L445 PolarHBondContact OG-N 2.75Å; S443-L445 VanDerWaalsContact C-N 3.32Å; S443-L445 PolarHBondContact O-N 3.06Å; L445-F448 WeakPolarHBondContact O-CB 3.3Å; L445-F448 PolarHBondContact O-N 3.49Å; L445-E449 WeakPolarHBondContact O-CB 3.44Å; L445-E449 PolarHBondContact O-N 3.3Å
446	L	55.5	Low	57.2	Low	95 Å²	95	77.2 Å²	77.2	50%	0.497	46%	0.463	S	S	.	.	H	α-helix	trans	-66	-39.7	174.6	-65.4	173.6	0	0	0	111.8	R441 S442 S443 E449 S450	R441-L446 HydrophobicContact CB-CD2 4.15Å; R441-L446 HydrophobicContact CB-CG 4.26Å; S442-L446 PolarHBondContact O-N 2.88Å; S442-L446 VanDerWaalsContact O-N 3.08Å; S443-L446 PolarHBondContact O-N 2.93Å; L446-E449 PolarHBondContact O-N 3.25Å; L446-S450 PolarHBondContact O-N 2.7Å
447	A	55.6	Low	60.1	Low	34 Å²	34	73.1 Å²	73.1	28%	0.281	43%	0.434	S	S	.	.	H	α-helix	trans	-60.5	-46	172.2	0	0	0	0	0	111.4	S443 E449 S450 S451	S443-A447 PolarHBondContact O-N 3.12Å; A447-E449 PolarHBondContact O-N 2.87Å; A447-S450 PolarHBondContact O-N 3.09Å; A447-S450 PolarHBondContact O-OG 2.82Å; A447-S451 PolarHBondContact O-N 3Å
448	F	56.6	Low	62.9	Low	100 Å²	100	68.4 Å²	68.4	44%	0.439	40%	0.401	S	S	.	.	H	α-helix	trans	-57.2	-45	171.4	-106.1	-67.5	0	0	0	113	L444 L445 S450 S451 V452 P507	L444-F448 PolarHBondContact O-N 3.14Å; L445-F448 WeakPolarHBondContact O-CB 3.3Å; L445-F448 PolarHBondContact O-N 3.49Å; F448-S450 VanDerWaalsContact C-N 3.29Å; F448-S450 PolarHBondContact O-N 3.2Å; F448-S451 PolarHBondContact O-N 3.44Å; F448-S451 VanDerWaalsContact O-N 3.07Å; F448-S451 PolarHBondContact O-OG 3.18Å; F448-V452 PolarHBondContact O-N 3.47Å; F448-V452 VanDerWaalsContact O-N 3.1Å; F448-P507 HydrophobicContact CD2-CG 4.45Å; F448-P507 HydrophobicContact CE1-CG 3.98Å; F448-P507 HydrophobicContact CE2-CB 3.92Å; F448-P507 HydrophobicContact CE2-CG 3.49Å; F448-P507 VanDerWaalsContact CE2-CG 3.49Å; F448-P507 HydrophobicContact CZ-CB 3.95Å; F448-P507 HydrophobicContact CZ-CG 3.21Å
449	E	60.9	Low	65.3	Low	94 Å²	94	65.9 Å²	65.9	44%	0.439	38%	0.383	S	S	.	.	H	α-helix	trans	-66.8	-33.7	-177.7	-163.6	151.9	-151.2	0	0	111.4	R441 L445 L446 A447	R441-E449 IonicContact CZ-OE1 2.65Å; R441-E449 IonicContact CZ-OE2 2.92Å; R441-E449 VanDerWaalsContact CZ-OE2 3.26Å; R441-E449 IonicContact NE-OE1 3.56Å; R441-E449 IonicContact NE-OE2 2.75Å; R441-E449 PolarHBondContact NE-OE2 3.01Å; R441-E449 IonicContact NH2-OE1 2.64Å; R441-E449 PolarHBondContact NH2-OE1 3.45Å; R441-E449 IonicContact NH2-OE2 3.88Å; R441-E449 PolarHBondContact NH2-OE2 3.16Å; L445-E449 WeakPolarHBondContact O-CB 3.44Å; L445-E449 PolarHBondContact O-N 3.3Å; L446-E449 PolarHBondContact O-N 3.25Å; A447-E449 PolarHBondContact O-N 2.87Å
450	S	66.1	Low	67.9	Low	33 Å²	33	63 Å²	63	23%	0.231	36%	0.356	C	S	.	.	H	α-helix	trans	-69.2	-31.5	169.7	76.8	0	0	0	0	113.7	L446 A447 F448 L454 Q592	L446-S450 PolarHBondContact O-N 2.7Å; A447-S450 PolarHBondContact O-N 3.09Å; A447-S450 PolarHBondContact O-OG 2.82Å; F448-S450 VanDerWaalsContact C-N 3.29Å; F448-S450 PolarHBondContact O-N 3.2Å; S450-L454 PolarHBondContact O-N 3.46Å; S450-L454 VanDerWaalsContact O-N 3.17Å; S450-Q592 PolarHBondContact OG-NE2 3.09Å
451	S	66.4	Low	70.6	Confident	18 Å²	18	59.9 Å²	59.9	13%	0.126	32%	0.324	C	S	.	.	H	α-helix	trans	-78.1	-29.3	-178	74.9	0	0	0	0	113.1	A447 F448 L454 I455 I503	A447-S451 PolarHBondContact O-N 3Å; F448-S451 PolarHBondContact O-N 3.44Å; F448-S451 VanDerWaalsContact O-N 3.07Å; F448-S451 PolarHBondContact O-OG 3.18Å; S451-L454 PolarHBondContact O-N 3.45Å; S451-I455 WeakPolarHBondContact O-CG1 3.21Å; S451-I455 PolarHBondContact O-N 2.88Å; S451-I503 WeakPolarHBondContact OG-CG2 3.39Å
452	V	65.3	Low	73	Confident	80 Å²	80	56.8 Å²	56.8	49%	0.485	32%	0.315	S	S	.	.	H	α-helix	trans	-61.8	-48.6	168.9	176	0	0	0	0	110.4	F448 L454 I455 D456	F448-V452 PolarHBondContact O-N 3.47Å; F448-V452 VanDerWaalsContact O-N 3.1Å; V452-L454 VanDerWaalsContact C-N 3.29Å; V452-L454 PolarHBondContact O-N 2.85Å; V452-I455 PolarHBondContact O-N 3.08Å; V452-D456 PolarHBondContact O-N 3.01Å
453	N	81.3	Confident	75	Confident	84 Å²	84	57.3 Å²	57.3	45%	0.449	31%	0.311	S	S	.	.	H	α-helix	trans	-57.5	-40.4	176.6	-172.2	-0.8	0	0	0	112	I455 D456 L457	N453-I455 VanDerWaalsContact C-N 3.35Å; N453-I455 PolarHBondContact O-N 2.92Å; N453-D456 PolarHBondContact O-N 2.83Å; N453-L457 VanDerWaalsContact O-CB 3.27Å; N453-L457 WeakPolarHBondContact O-CB 3.49Å; N453-L457 PolarHBondContact O-N 3.33Å
454	L	87.7	Confident	76.6	Confident	45 Å²	45	54.6 Å²	54.6	24%	0.236	29%	0.289	C	S	.	.	H	α-helix	trans	-61.2	-38.9	174.6	179.1	57.4	0	0	0	113	S450 S451 V452 L458 T499 I503 L596 L599	S450-L454 PolarHBondContact O-N 3.46Å; S450-L454 VanDerWaalsContact O-N 3.17Å; S451-L454 PolarHBondContact O-N 3.45Å; V452-L454 VanDerWaalsContact C-N 3.29Å; V452-L454 PolarHBondContact O-N 2.85Å; L454-L458 HydrophobicContact CD1-CD1 4.28Å; L454-L458 HydrophobicContact CD1-CG 4.41Å; L454-L458 HydrophobicContact CG-CD1 4.32Å; L454-L458 VanDerWaalsContact O-CG 3.27Å; L454-L458 WeakPolarHBondContact O-CG 3.29Å; L454-L458 PolarHBondContact O-N 3.28Å; L454-L458 VanDerWaalsContact O-N 3.09Å; L454-T499 HydrophobicContact CD2-CG2 3.9Å; L454-T499 HydrophobicContact CG-CG2 4.2Å; L454-I503 HydrophobicContact CD2-CD1 4.3Å; L454-L596 HydrophobicContact CD1-CD1 4.28Å; L454-L599 HydrophobicContact CD1-CD2 3.4Å; L454-L599 VanDerWaalsContact CD1-CD2 3.4Å
455	I	87.7	Confident	78.7	Confident	36 Å²	36	51.1 Å²	51.1	19%	0.185	27%	0.269	C	S	.	.	H	α-helix	trans	-67.6	-42.5	176.6	-67.5	167.5	0	0	0	110.9	S451 V452 N453 L458 N459 Q500 I503	S451-I455 WeakPolarHBondContact O-CG1 3.21Å; S451-I455 PolarHBondContact O-N 2.88Å; V452-I455 PolarHBondContact O-N 3.08Å; N453-I455 VanDerWaalsContact C-N 3.35Å; N453-I455 PolarHBondContact O-N 2.92Å; I455-L458 PolarHBondContact O-N 3.06Å; I455-N459 PolarHBondContact O-N 3.15Å; I455-N459 PolarHBondContact O-ND2 3.35Å; I455-Q500 HydrophobicContact CD1-CG 4.24Å; I455-Q500 HydrophobicContact CG1-CG 4.16Å; I455-Q500 HydrophobicContact CG2-CG 4.46Å; I455-I503 HydrophobicContact CD1-CD1 3.83Å; I455-I503 HydrophobicContact CD1-CG2 4.19Å; I455-I503 HydrophobicContact CG1-CD1 3.69Å
456	D	89.2	Confident	80.8	Confident	90 Å²	90	50.1 Å²	50.1	48%	0.481	26%	0.262	S	S	.	.	H	α-helix	trans	-66.7	-38.6	178.1	-68.8	-29.7	0	0	0	112.3	V452 N453 L458 N459 E460	V452-D456 PolarHBondContact O-N 3.01Å; N453-D456 PolarHBondContact O-N 2.83Å; D456-L458 PolarHBondContact O-N 2.89Å; D456-N459 WeakPolarHBondContact O-CB 3.46Å; D456-N459 PolarHBondContact O-N 3.43Å; D456-E460 PolarHBondContact O-N 2.78Å
457	L	91.1	Very high	82.4	Confident	6 Å²	6	51.8 Å²	51.8	3%	0.031	26%	0.262	C	S	.	.	H	α-helix	trans	-59.9	-43.1	171.9	175.7	55.4	0	0	0	111.9	N453 E460 I461 L596 L599 E600 K603	N453-L457 VanDerWaalsContact O-CB 3.27Å; N453-L457 WeakPolarHBondContact O-CB 3.49Å; N453-L457 PolarHBondContact O-N 3.33Å; L457-E460 PolarHBondContact O-N 3.31Å; L457-I461 HydrophobicContact CD1-CD1 4.17Å; L457-I461 HydrophobicContact CG-CD1 4.29Å; L457-I461 VanDerWaalsContact O-CG1 3.29Å; L457-I461 WeakPolarHBondContact O-CG1 3.38Å; L457-I461 PolarHBondContact O-N 3.38Å; L457-L596 HydrophobicContact CD2-CD1 3.59Å; L457-L596 HydrophobicContact CD2-CG 4.46Å; L457-L599 HydrophobicContact CD2-CB 4.03Å; L457-L599 HydrophobicContact CD2-CD2 3.69Å; L457-L599 HydrophobicContact CD2-CG 3.77Å; L457-L599 HydrophobicContact CG-CD2 3.93Å; L457-L599 HydrophobicContact CG-CG 3.99Å; L457-E600 HydrophobicContact CD1-CG 4.5Å; L457-E600 HydrophobicContact CD2-CG 4.19Å; L457-K603 HydrophobicContact CD1-CB 4Å; L457-K603 HydrophobicContact CD1-CD 3.31Å; L457-K603 HydrophobicContact CD1-CG 4.25Å
458	L	92.9	Very high	84	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-68.8	-33.8	176	-69.9	169	0	0	0	112.9	L454 I455 D456 N462 H492 F495 Q496 T499 L599	L454-L458 HydrophobicContact CD1-CD1 4.28Å; L454-L458 HydrophobicContact CD1-CG 4.41Å; L454-L458 HydrophobicContact CG-CD1 4.32Å; L454-L458 VanDerWaalsContact O-CG 3.27Å; L454-L458 WeakPolarHBondContact O-CG 3.29Å; L454-L458 PolarHBondContact O-N 3.28Å; L454-L458 VanDerWaalsContact O-N 3.09Å; I455-L458 PolarHBondContact O-N 3.06Å; D456-L458 PolarHBondContact O-N 2.89Å; L458-N462 PolarHBondContact O-N 3.3Å; L458-H492 PolarHBondContact O-NE2 3.44Å; L458-F495 HydrophobicContact CD2-CD1 4.01Å; L458-F495 HydrophobicContact CD2-CE1 3.85Å; L458-Q496 HydrophobicContact CB-CG 4.02Å; L458-Q496 HydrophobicContact CD1-CG 4.4Å; L458-T499 HydrophobicContact CD1-CG2 3.78Å; L458-L599 HydrophobicContact CD2-CD1 4.24Å; L458-L599 HydrophobicContact CD2-CD2 3.83Å; L458-L599 HydrophobicContact CG-CD2 4.19Å
459	N	91.8	Very high	85.5	Confident	74 Å²	74	46.7 Å²	46.7	40%	0.396	23%	0.234	S	C	.	.	H	α-helix	trans	-62.9	-46.6	171.6	-76.2	-39.2	0	0	0	111.5	I455 D456 I461 N462 M463 Q496	I455-N459 PolarHBondContact O-N 3.15Å; I455-N459 PolarHBondContact O-ND2 3.35Å; D456-N459 WeakPolarHBondContact O-CB 3.46Å; D456-N459 PolarHBondContact O-N 3.43Å; N459-I461 VanDerWaalsContact C-N 3.35Å; N459-I461 PolarHBondContact O-N 3.45Å; N459-N462 PolarHBondContact O-N 3.46Å; N459-M463 PolarHBondContact O-N 3.44Å; N459-Q496 PolarHBondContact OD1-NE2 2.98Å
460	E	92.4	Very high	86.8	Confident	55 Å²	55	46.6 Å²	46.6	26%	0.257	24%	0.237	S	C	.	.	H	α-helix	trans	-65.4	-38.4	179.6	-156.8	-167.6	143	0	0	111.7	D456 L457 M463 Y464 K603	D456-E460 PolarHBondContact O-N 2.78Å; L457-E460 PolarHBondContact O-N 3.31Å; E460-M463 HydrophobicContact CG-CE 4.05Å; E460-M463 WeakPolarHBondContact O-CB 2.97Å; E460-M463 PolarHBondContact O-N 3.09Å; E460-Y464 HydrophobicContact CG-CD2 4.36Å; E460-Y464 HydrophobicContact CG-CE2 3.62Å; E460-Y464 WeakPolarHBondContact O-CD2 3.48Å; E460-Y464 PolarHBondContact O-N 3.37Å; E460-Y464 VanDerWaalsContact O-N 3.09Å; E460-Y464 WeakPolarHBondContact OE1-CE2 3.26Å; E460-Y464 VanDerWaalsContact OE1-CZ 3.25Å; E460-Y464 PolarHBondContact OE1-OH 3.06Å; E460-K603 VanDerWaalsContact CD-CE 3.44Å; E460-K603 WeakPolarHBondContact OE1-CE 3.4Å; E460-K603 IonicContact OE1-NZ 2.7Å; E460-K603 PolarHBondContact OE1-NZ 3.47Å; E460-K603 WeakPolarHBondContact OE2-CE 3.45Å; E460-K603 IonicContact OE2-NZ 3.94Å; E460-K603 PolarHBondContact OE2-NZ 3.4Å
461	I	93.1	Very high	87.8	Confident	1 Å²	1	45.9 Å²	45.9	1%	0.005	23%	0.23	C	C	.	.	H	α-helix	trans	-61.5	-45.6	172.7	-69.5	166.5	0	0	0	111.2	L457 N459 M463 Y464 Y465 H492 L599 K603 I606	L457-I461 HydrophobicContact CD1-CD1 4.17Å; L457-I461 HydrophobicContact CG-CD1 4.29Å; L457-I461 VanDerWaalsContact O-CG1 3.29Å; L457-I461 WeakPolarHBondContact O-CG1 3.38Å; L457-I461 PolarHBondContact O-N 3.38Å; N459-I461 VanDerWaalsContact C-N 3.35Å; N459-I461 PolarHBondContact O-N 3.45Å; I461-M463 VanDerWaalsContact C-N 3.32Å; I461-M463 PolarHBondContact O-N 2.92Å; I461-Y464 PolarHBondContact O-N 3.08Å; I461-Y465 HydrophobicContact CG2-CD2 3.79Å; I461-Y465 HydrophobicContact CG2-CE2 3.56Å; I461-Y465 WeakPolarHBondContact O-CD2 3.49Å; I461-Y465 PolarHBondContact O-N 2.85Å; I461-Y465 VanDerWaalsContact O-N 3.09Å; I461-H492 WeakPolarHBondContact CG2-CE1 3.42Å; I461-L599 HydrophobicContact CD1-CD1 3.44Å; I461-L599 VanDerWaalsContact CD1-CD1 3.44Å; I461-L599 HydrophobicContact CD1-CD2 4.48Å; I461-L599 HydrophobicContact CD1-CG 3.72Å; I461-K603 HydrophobicContact CD1-CB 4Å; I461-K603 HydrophobicContact CG1-CB 3.66Å; I461-K603 HydrophobicContact CG1-CG 4.24Å; I461-I606 HydrophobicContact CG2-CD1 3.7Å
462	N	92.3	Very high	88.6	Confident	26 Å²	26	45 Å²	45	14%	0.139	22%	0.224	C	C	.	.	H	α-helix	trans	-59.5	-44.9	177	-169.4	81.5	0	0	0	110.7	L458 N459 Y464 Y465 E466 K493	L458-N462 PolarHBondContact O-N 3.3Å; N459-N462 PolarHBondContact O-N 3.46Å; N462-Y464 VanDerWaalsContact C-N 3.32Å; N462-Y464 PolarHBondContact O-N 2.92Å; N462-Y465 PolarHBondContact O-N 2.83Å; N462-Y465 VanDerWaalsContact O-N 3.13Å; N462-E466 PolarHBondContact ND2-OE1 2.99Å; N462-E466 WeakPolarHBondContact O-CG 3.42Å; N462-E466 PolarHBondContact O-N 3.07Å; N462-K493 VanDerWaalsContact OD1-CE 3.28Å; N462-K493 WeakPolarHBondContact OD1-CE 3.5Å; N462-K493 WeakPolarHBondContact OD1-CG 3.48Å
463	M	93.1	Very high	89.6	Confident	77 Å²	77	45.8 Å²	45.8	38%	0.379	22%	0.224	S	C	.	.	H	α-helix	trans	-56.4	-41.8	176.2	-178.2	-157.6	61.8	0	0	112.5	N459 E460 I461 R467	N459-M463 PolarHBondContact O-N 3.44Å; E460-M463 HydrophobicContact CG-CE 4.05Å; E460-M463 WeakPolarHBondContact O-CB 2.97Å; E460-M463 PolarHBondContact O-N 3.09Å; I461-M463 VanDerWaalsContact C-N 3.32Å; I461-M463 PolarHBondContact O-N 2.92Å; M463-R467 VanDerWaalsContact O-CG 3.26Å; M463-R467 WeakPolarHBondContact O-CG 3.49Å; M463-R467 PolarHBondContact O-N 2.96Å
464	Y	92.6	Very high	89.6	Confident	18 Å²	18	47.8 Å²	47.8	7%	0.071	23%	0.231	C	C	.	.	H	α-helix	trans	-68.8	-35.4	177.1	-65.3	-56.9	0	0	0	112.9	E460 I461 N462 L468 K603 K607	E460-Y464 HydrophobicContact CG-CD2 4.36Å; E460-Y464 HydrophobicContact CG-CE2 3.62Å; E460-Y464 WeakPolarHBondContact O-CD2 3.48Å; E460-Y464 PolarHBondContact O-N 3.37Å; E460-Y464 VanDerWaalsContact O-N 3.09Å; E460-Y464 WeakPolarHBondContact OE1-CE2 3.26Å; E460-Y464 VanDerWaalsContact OE1-CZ 3.25Å; E460-Y464 PolarHBondContact OE1-OH 3.06Å; I461-Y464 PolarHBondContact O-N 3.08Å; N462-Y464 VanDerWaalsContact C-N 3.32Å; N462-Y464 PolarHBondContact O-N 2.92Å; Y464-L468 WeakPolarHBondContact O-CB 3.28Å; Y464-L468 PolarHBondContact O-N 2.98Å; Y464-L468 VanDerWaalsContact O-N 3.07Å; Y464-K603 HydrophobicContact CD2-CG 4.49Å; Y464-K603 HydrophobicContact CE2-CG 4.1Å; Y464-K607 HydrophobicContact CD1-CB 4.3Å; Y464-K607 HydrophobicContact CD1-CG 4.34Å; Y464-K607 HydrophobicContact CD2-CB 4.14Å; Y464-K607 HydrophobicContact CE1-CB 4.09Å; Y464-K607 HydrophobicContact CE1-CD 4.19Å; Y464-K607 HydrophobicContact CE1-CG 3.74Å; Y464-K607 HydrophobicContact CE2-CB 3.93Å; Y464-K607 HydrophobicContact CE2-CD 4.23Å; Y464-K607 HydrophobicContact CE2-CG 4.21Å; Y464-K607 HydrophobicContact CG-CB 4.35Å; Y464-K607 WeakPolarHBondContact OH-CD 3.33Å; Y464-K607 WeakPolarHBondContact OH-CE 3.36Å; Y464-K607 PolarHBondContact OH-NZ 2.62Å
465	Y	92.3	Very high	88.7	Confident	28 Å²	28	46.8 Å²	46.8	11%	0.11	23%	0.226	C	C	.	.	H	α-helix	trans	-65.9	-46.2	175.2	-79.3	-56.7	0	0	0	112.8	I461 N462 R467 L468 L469 L488 I489 H492 I606	I461-Y465 HydrophobicContact CG2-CD2 3.79Å; I461-Y465 HydrophobicContact CG2-CE2 3.56Å; I461-Y465 WeakPolarHBondContact O-CD2 3.49Å; I461-Y465 PolarHBondContact O-N 2.85Å; I461-Y465 VanDerWaalsContact O-N 3.09Å; N462-Y465 PolarHBondContact O-N 2.83Å; N462-Y465 VanDerWaalsContact O-N 3.13Å; Y465-R467 VanDerWaalsContact C-N 3.31Å; Y465-R467 PolarHBondContact O-N 3.3Å; Y465-L468 WeakPolarHBondContact O-CB 3.4Å; Y465-L468 PolarHBondContact O-N 2.94Å; Y465-L468 VanDerWaalsContact O-N 3.1Å; Y465-L469 PolarHBondContact O-N 2.75Å; Y465-L488 HydrophobicContact CE1-CB 4.48Å; Y465-L488 HydrophobicContact CE1-CD1 4.36Å; Y465-I489 HydrophobicContact CG-CG1 4.33Å; Y465-H492 HydrophobicContact CD2-CB 4.25Å; Y465-H492 HydrophobicContact CE2-CB 4.05Å; Y465-H492 AromaticContact CE2-CG 3.92Å; Y465-H492 AromaticContact CE2-ND1 3.95Å; Y465-I606 HydrophobicContact CD1-CG2 4Å; Y465-I606 HydrophobicContact CD2-CD1 4.4Å; Y465-I606 HydrophobicContact CE1-CD1 3.88Å; Y465-I606 HydrophobicContact CE1-CG1 4.18Å; Y465-I606 HydrophobicContact CE1-CG2 4.15Å; Y465-I606 HydrophobicContact CE2-CD1 3.71Å; Y465-I606 HydrophobicContact CG-CG2 4.37Å; Y465-I606 VanDerWaalsContact CZ-CD1 3.42Å; Y465-I606 WeakPolarHBondContact OH-CD1 3.29Å
466	E	91.8	Very high	87.9	Confident	59 Å²	59	46.2 Å²	46.2	28%	0.276	23%	0.225	S	C	.	.	H	α-helix	trans	-59.8	-43.8	178.4	-57.1	-75.3	-162.5	0	0	110.5	N462 L468 L469 D470 K493	N462-E466 PolarHBondContact ND2-OE1 2.99Å; N462-E466 WeakPolarHBondContact O-CG 3.42Å; N462-E466 PolarHBondContact O-N 3.07Å; E466-L468 VanDerWaalsContact C-N 3.27Å; E466-L468 PolarHBondContact O-N 3.27Å; E466-L469 WeakPolarHBondContact O-CB 3.36Å; E466-L469 PolarHBondContact O-N 2.69Å; E466-L469 VanDerWaalsContact O-N 3.14Å; E466-D470 PolarHBondContact O-N 2.86Å; E466-K493 WeakPolarHBondContact OE1-CE 3.41Å; E466-K493 IonicContact OE1-NZ 2.78Å; E466-K493 PolarHBondContact OE1-NZ 3.45Å
467	R	90.1	Very high	86.8	Confident	129 Å²	129	50.9 Å²	50.9	49%	0.487	24%	0.241	S	C	.	.	H	α-helix	trans	-64.6	-29	176.6	-69	175.7	68.7	136.5	7.6	113.4	M463 Y465 Q471 N610	M463-R467 VanDerWaalsContact O-CG 3.26Å; M463-R467 WeakPolarHBondContact O-CG 3.49Å; M463-R467 PolarHBondContact O-N 2.96Å; Y465-R467 VanDerWaalsContact C-N 3.31Å; Y465-R467 PolarHBondContact O-N 3.3Å; R467-Q471 VanDerWaalsContact O-CG 3.25Å; R467-Q471 WeakPolarHBondContact O-CG 3.3Å; R467-Q471 PolarHBondContact O-N 2.83Å; R467-Q471 PolarHBondContact O-NE2 3Å; R467-N610 WeakPolarHBondContact CB-OD1 3.28Å
468	L	88.5	Confident	85.9	Confident	9 Å²	9	53.1 Å²	53.1	5%	0.047	25%	0.253	C	S	.	.	H	α-helix	trans	-75.2	-36.7	174.3	-175.6	65	0	0	0	111.3	Y464 Y465 E466 Q471 C472 L485 S613 F623	Y464-L468 WeakPolarHBondContact O-CB 3.28Å; Y464-L468 PolarHBondContact O-N 2.98Å; Y464-L468 VanDerWaalsContact O-N 3.07Å; Y465-L468 WeakPolarHBondContact O-CB 3.4Å; Y465-L468 PolarHBondContact O-N 2.94Å; Y465-L468 VanDerWaalsContact O-N 3.1Å; E466-L468 VanDerWaalsContact C-N 3.27Å; E466-L468 PolarHBondContact O-N 3.27Å; L468-Q471 PolarHBondContact O-N 3.47Å; L468-C472 PolarHBondContact O-N 2.89Å; L468-L485 HydrophobicContact CD2-CD2 3.72Å; L468-L485 HydrophobicContact CG-CD1 4.29Å; L468-L485 HydrophobicContact CG-CD2 4.07Å; L468-S613 VanDerWaalsContact CD1-OG 3.28Å; L468-S613 WeakPolarHBondContact CD1-OG 3.19Å; L468-F623 HydrophobicContact CD1-CE1 4.05Å; L468-F623 HydrophobicContact CD1-CZ 3.74Å; L468-F623 HydrophobicContact CG-CE1 4.36Å; L468-F623 HydrophobicContact CG-CZ 4.3Å
469	L	89.1	Confident	85.3	Confident	18 Å²	18	56.1 Å²	56.1	9%	0.094	28%	0.278	C	S	.	.	H	α-helix	trans	-64.2	-49	172.7	176.8	63.5	0	0	0	111.4	Y465 E466 Q471 C472 I473 I482 L485 Q486 I489	Y465-L469 PolarHBondContact O-N 2.75Å; E466-L469 WeakPolarHBondContact O-CB 3.36Å; E466-L469 PolarHBondContact O-N 2.69Å; E466-L469 VanDerWaalsContact O-N 3.14Å; L469-Q471 PolarHBondContact O-N 3.13Å; L469-C472 PolarHBondContact O-N 3.2Å; L469-I473 HydrophobicContact CD1-CD1 3.99Å; L469-I473 HydrophobicContact CD1-CG1 4.27Å; L469-I473 HydrophobicContact CG-CD1 3.86Å; L469-I473 WeakPolarHBondContact O-CG1 3.41Å; L469-I473 PolarHBondContact O-N 2.99Å; L469-I482 HydrophobicContact CD1-CG2 3.88Å; L469-L485 HydrophobicContact CB-CB 4.49Å; L469-L485 HydrophobicContact CD1-CB 3.97Å; L469-Q486 HydrophobicContact CD1-CG 3.97Å; L469-Q486 HydrophobicContact CD2-CG 3.97Å; L469-I489 HydrophobicContact CB-CD1 3.82Å; L469-I489 HydrophobicContact CD2-CD1 3.65Å; L469-I489 HydrophobicContact CG-CD1 4.3Å
470	D	88.8	Confident	84.8	Confident	92 Å²	92	60.2 Å²	60.2	49%	0.492	29%	0.288	S	S	.	.	H	α-helix	trans	-52.1	-43.7	174.7	-77.2	-28	0	0	0	112	E466 I473 Q474	E466-D470 PolarHBondContact O-N 2.86Å; D470-I473 PolarHBondContact O-N 3.03Å; D470-Q474 WeakPolarHBondContact O-CG 3.47Å; D470-Q474 PolarHBondContact O-N 2.95Å
471	Q	85.7	Confident	84.2	Confident	19 Å²	19	57.8 Å²	57.8	9%	0.089	28%	0.277	C	S	.	.	H	α-helix	trans	-70.8	-33.7	179.6	-73.2	167.8	54.3	0	0	112.7	R467 L468 L469 N610 S613 R619	R467-Q471 VanDerWaalsContact O-CG 3.25Å; R467-Q471 WeakPolarHBondContact O-CG 3.3Å; R467-Q471 PolarHBondContact O-N 2.83Å; R467-Q471 PolarHBondContact O-NE2 3Å; L468-Q471 PolarHBondContact O-N 3.47Å; L469-Q471 PolarHBondContact O-N 3.13Å; Q471-N610 PolarHBondContact NE2-OD1 3.12Å; Q471-N610 PolarHBondContact OE1-O 3.25Å; Q471-S613 PolarHBondContact OE1-O 3.06Å; Q471-S613 PolarHBondContact OE1-OG 3.07Å; Q471-R619 WeakPolarHBondContact O-CD 3.32Å
472	C	84.6	Confident	83.9	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-67.3	-46.5	171.8	-174.4	0	0	0	0	110.9	L468 L469 Q474 D475 C476 I482 L485 F623	L468-C472 PolarHBondContact O-N 2.89Å; L469-C472 PolarHBondContact O-N 3.2Å; C472-Q474 PolarHBondContact O-N 3.26Å; C472-D475 PolarHBondContact O-N 2.7Å; C472-C476 VanDerWaalsContact C-SG 3.58Å; C472-C476 WeakPolarHBondContact CA-SG 3.42Å; C472-C476 HydrophobicContact CB-CB 4.3Å; C472-C476 WeakPolarHBondContact CB-SG 3.27Å; C472-C476 WeakPolarHBondContact O-CA 3.45Å; C472-C476 WeakPolarHBondContact O-CB 3.27Å; C472-C476 PolarHBondContact O-N 3.19Å; C472-C476 PolarHBondContact O-SG 3.16Å; C472-C476 WeakPolarHBondContact SG-CB 3.31Å; C472-C476 CovalentContact SG-SG 2.05Å; C472-C476 PolarHBondContact SG-SG 3.24Å; C472-I482 HydrophobicContact CB-CG1 4.42Å; C472-I482 WeakPolarHBondContact SG-CG1 3.28Å; C472-L485 HydrophobicContact CB-CD1 3.84Å; C472-F623 HydrophobicContact CB-CD1 4.36Å; C472-F623 HydrophobicContact CB-CD2 4.03Å; C472-F623 HydrophobicContact CB-CE1 4.04Å; C472-F623 HydrophobicContact CB-CE2 3.64Å; C472-F623 HydrophobicContact CB-CG 4.37Å; C472-F623 HydrophobicContact CB-CZ 3.66Å
473	I	85.6	Confident	83.6	Confident	95 Å²	95	62.2 Å²	62.2	49%	0.487	30%	0.303	S	S	.	.	H	α-helix	trans	-55.5	-28.5	-179.8	-68.4	167.3	0	0	0	112.5	L469 D470 I482	L469-I473 HydrophobicContact CD1-CD1 3.99Å; L469-I473 HydrophobicContact CD1-CG1 4.27Å; L469-I473 HydrophobicContact CG-CD1 3.86Å; L469-I473 WeakPolarHBondContact O-CG1 3.41Å; L469-I473 PolarHBondContact O-N 2.99Å; D470-I473 PolarHBondContact O-N 3.03Å; I473-I482 HydrophobicContact CG1-CD1 4.29Å; I473-I482 HydrophobicContact CG1-CG1 4.46Å; I473-I482 HydrophobicContact CG1-CG2 4.06Å
474	Q	80.9	Confident	83.3	Confident	127 Å²	127	63.3 Å²	63.3	59%	0.593	30%	0.304	S	S	*	.	H	α-helix	trans	-75.7	-26.5	177.6	-70.1	167.2	20.8	0	0	115.7	D470 C472	D470-Q474 WeakPolarHBondContact O-CG 3.47Å; D470-Q474 PolarHBondContact O-N 2.95Å; C472-Q474 PolarHBondContact O-N 3.26Å
475	D	69.7	Low	83.1	Confident	24 Å²	24	62.6 Å²	62.6	13%	0.128	30%	0.301	C	S	.	.	H	α-helix	trans	-138	-8.4	-168.7	-86.7	-82.2	0	0	0	115.1	C472 F477 R619 R620	C472-D475 PolarHBondContact O-N 2.7Å; D475-F477 WeakPolarHBondContact O-CD2 3.47Å; D475-F477 PolarHBondContact O-N 2.86Å; D475-R619 VanDerWaalsContact CB-CD 3.48Å; D475-R619 HydrophobicContact CB-CG 4.26Å; D475-R619 WeakPolarHBondContact OD2-CD 3.09Å; D475-R619 IonicContact OD2-CZ 2.97Å; D475-R619 IonicContact OD2-NE 3.26Å; D475-R619 IonicContact OD2-NH1 2.73Å; D475-R619 PolarHBondContact OD2-NH1 3.07Å; D475-R620 HydrophobicContact CB-CG 4.28Å; D475-R620 IonicContact OD1-CZ 2.74Å; D475-R620 IonicContact OD1-NE 3.83Å; D475-R620 PolarHBondContact OD1-NE 2.94Å; D475-R620 IonicContact OD1-NH2 2.69Å; D475-R620 PolarHBondContact OD1-NH2 3.21Å
476	C	69.7	Low	83	Confident	24 Å²	24	65.8 Å²	65.8	16%	0.162	32%	0.317	C	S	.	.			trans	-80	108.6	-179.8	-72	0	0	0	0	110.8	C472 I482 F623	C472-C476 VanDerWaalsContact C-SG 3.58Å; C472-C476 WeakPolarHBondContact CA-SG 3.42Å; C472-C476 HydrophobicContact CB-CB 4.3Å; C472-C476 WeakPolarHBondContact CB-SG 3.27Å; C472-C476 WeakPolarHBondContact O-CA 3.45Å; C472-C476 WeakPolarHBondContact O-CB 3.27Å; C472-C476 PolarHBondContact O-N 3.19Å; C472-C476 PolarHBondContact O-SG 3.16Å; C472-C476 WeakPolarHBondContact SG-CB 3.31Å; C472-C476 CovalentContact SG-SG 2.05Å; C472-C476 PolarHBondContact SG-SG 3.24Å; C476-I482 HydrophobicContact CB-CD1 4.15Å; C476-I482 HydrophobicContact CB-CG1 4.1Å; C476-F623 VanDerWaalsContact SG-CB 3.56Å; C476-F623 WeakPolarHBondContact SG-CD2 3.18Å; C476-F623 WeakPolarHBondContact SG-CG 3.43Å
477	F	67.1	Low	82.9	Confident	187 Å²	187	66.7 Å²	66.7	82%	0.82	32%	0.321	S	S	*	.	S	Bend	trans	-80.7	-14.3	174	-63.4	-86.2	0	0	0	114	D475	D475-F477 WeakPolarHBondContact O-CD2 3.47Å; D475-F477 PolarHBondContact O-N 2.86Å
478	D	71.6	Confident	82.9	Confident	54 Å²	54	62.9 Å²	62.9	29%	0.289	31%	0.311	S	S	.	.	S	Bend	trans	-102.2	138.8	168.9	-169.5	-22.5	0	0	0	108.2	R480 P481	D478-R480 VanDerWaalsContact C-N 3.31Å; D478-R480 WeakPolarHBondContact OD1-CB 3.44Å; D478-R480 PolarHBondContact OD1-N 3.1Å; D478-R480 IonicContact OD1-NE 3.66Å; D478-R480 IonicContact OD2-CZ 2.68Å; D478-R480 IonicContact OD2-NE 2.7Å; D478-R480 PolarHBondContact OD2-NE 3.48Å; D478-R480 IonicContact OD2-NH2 3.13Å; D478-R480 PolarHBondContact OD2-NH2 3.41Å; D478-P481 WeakPolarHBondContact O-CD 3.49Å
479	A	80.2	Confident	83.1	Confident	63 Å²	63	62.9 Å²	62.9	52%	0.521	31%	0.31	S	S	.	.	S	Bend	trans	-73.3	-21.1	175.6	0	0	0	0	0	112.9	I482 V483	A479-I482 WeakPolarHBondContact O-CB 3.42Å; A479-I482 PolarHBondContact O-N 2.91Å; A479-I482 VanDerWaalsContact O-N 3.12Å; A479-V483 PolarHBondContact O-N 3.25Å
480	R	81.4	Confident	83.2	Confident	160 Å²	160	64.8 Å²	64.8	60%	0.604	32%	0.318	S	S	*	.	H	α-helix	trans	-56	-47.4	-175.3	-80.6	-177.6	-83.6	-148.6	-7.4	114.7	D478 I482 V483 Y484	D478-R480 VanDerWaalsContact C-N 3.31Å; D478-R480 WeakPolarHBondContact OD1-CB 3.44Å; D478-R480 PolarHBondContact OD1-N 3.1Å; D478-R480 IonicContact OD1-NE 3.66Å; D478-R480 IonicContact OD2-CZ 2.68Å; D478-R480 IonicContact OD2-NE 2.7Å; D478-R480 PolarHBondContact OD2-NE 3.48Å; D478-R480 IonicContact OD2-NH2 3.13Å; D478-R480 PolarHBondContact OD2-NH2 3.41Å; R480-I482 VanDerWaalsContact C-N 3.29Å; R480-I482 PolarHBondContact O-N 3.32Å; R480-V483 PolarHBondContact O-N 3.05Å; R480-Y484 WeakPolarHBondContact O-CB 3.39Å; R480-Y484 PolarHBondContact O-N 3.45Å
481	P	80.9	Confident	83.2	Confident	4 Å²	4	64.1 Å²	64.1	3%	0.026	31%	0.314	C	S	.	.	H	α-helix	trans	-65.8	-31.1	177.7	-21.9	35.3	0	0	0	112.9	D478 L485 F623 L626 S627	D478-P481 WeakPolarHBondContact O-CD 3.49Å; P481-L485 WeakPolarHBondContact O-CB 3.44Å; P481-L485 VanDerWaalsContact O-CG 3.28Å; P481-L485 WeakPolarHBondContact O-CG 3.3Å; P481-L485 PolarHBondContact O-N 3.02Å; P481-F623 HydrophobicContact CB-CB 4.08Å; P481-F623 HydrophobicContact CB-CD1 4.27Å; P481-F623 HydrophobicContact CB-CG 4.48Å; P481-F623 HydrophobicContact CG-CB 4.18Å; P481-F623 WeakPolarHBondContact CG-O 3.46Å; P481-L626 HydrophobicContact CB-CD2 4.35Å; P481-S627 WeakPolarHBondContact CG-OG 3.41Å
482	I	85.3	Confident	83.5	Confident	32 Å²	32	64 Å²	64	16%	0.164	31%	0.314	C	S	.	.	H	α-helix	trans	-66.3	-51.4	176.6	-57.1	174.6	0	0	0	109.8	L469 C472 I473 C476 A479 R480 Y484 L485 Q486	L469-I482 HydrophobicContact CD1-CG2 3.88Å; C472-I482 HydrophobicContact CB-CG1 4.42Å; C472-I482 WeakPolarHBondContact SG-CG1 3.28Å; I473-I482 HydrophobicContact CG1-CD1 4.29Å; I473-I482 HydrophobicContact CG1-CG1 4.46Å; I473-I482 HydrophobicContact CG1-CG2 4.06Å; C476-I482 HydrophobicContact CB-CD1 4.15Å; C476-I482 HydrophobicContact CB-CG1 4.1Å; A479-I482 WeakPolarHBondContact O-CB 3.42Å; A479-I482 PolarHBondContact O-N 2.91Å; A479-I482 VanDerWaalsContact O-N 3.12Å; R480-I482 VanDerWaalsContact C-N 3.29Å; R480-I482 PolarHBondContact O-N 3.32Å; I482-Y484 VanDerWaalsContact C-N 3.31Å; I482-Y484 PolarHBondContact O-N 3.5Å; I482-L485 PolarHBondContact O-N 3.49Å; I482-Q486 WeakPolarHBondContact O-CG 3.42Å; I482-Q486 PolarHBondContact O-N 3.3Å
483	V	87.4	Confident	83.8	Confident	87 Å²	87	67.2 Å²	67.2	53%	0.527	33%	0.328	S	S	.	.	H	α-helix	trans	-61	-40.2	177.9	175.5	0	0	0	0	111.4	A479 R480 Q486 E487	A479-V483 PolarHBondContact O-N 3.25Å; R480-V483 PolarHBondContact O-N 3.05Å; V483-Q486 PolarHBondContact O-N 2.98Å; V483-E487 PolarHBondContact O-N 3.33Å
484	Y	86.1	Confident	84	Confident	101 Å²	101	67.7 Å²	67.7	40%	0.396	32%	0.323	S	S	.	.	H	α-helix	trans	-64.5	-42.1	176.6	178	-104.9	0	0	0	112.8	R480 I482 E487 L488 L626	R480-Y484 WeakPolarHBondContact O-CB 3.39Å; R480-Y484 PolarHBondContact O-N 3.45Å; I482-Y484 VanDerWaalsContact C-N 3.31Å; I482-Y484 PolarHBondContact O-N 3.5Å; Y484-E487 PolarHBondContact O-N 3.3Å; Y484-L488 HydrophobicContact CD1-CD1 4.04Å; Y484-L488 HydrophobicContact CE1-CD1 3.44Å; Y484-L488 VanDerWaalsContact CE1-CD1 3.44Å; Y484-L488 HydrophobicContact CE1-CG 4.15Å; Y484-L488 HydrophobicContact CE2-CG 4.47Å; Y484-L488 PolarHBondContact O-N 3.02Å; Y484-L626 HydrophobicContact CD1-CD2 3.75Å; Y484-L626 HydrophobicContact CD1-CG 4.19Å; Y484-L626 HydrophobicContact CE1-CD2 4.11Å; Y484-L626 HydrophobicContact CE1-CG 4.26Å
485	L	88	Confident	84.4	Confident	3 Å²	3	66.4 Å²	66.4	2%	0.016	32%	0.316	C	S	.	.	H	α-helix	trans	-66.3	-38.5	174.9	-73.8	170.1	0	0	0	112.1	L468 L469 C472 P481 I482 L488 I489 F623	L468-L485 HydrophobicContact CD2-CD2 3.72Å; L468-L485 HydrophobicContact CG-CD1 4.29Å; L468-L485 HydrophobicContact CG-CD2 4.07Å; L469-L485 HydrophobicContact CB-CB 4.49Å; L469-L485 HydrophobicContact CD1-CB 3.97Å; C472-L485 HydrophobicContact CB-CD1 3.84Å; P481-L485 WeakPolarHBondContact O-CB 3.44Å; P481-L485 VanDerWaalsContact O-CG 3.28Å; P481-L485 WeakPolarHBondContact O-CG 3.3Å; P481-L485 PolarHBondContact O-N 3.02Å; I482-L485 PolarHBondContact O-N 3.49Å; L485-L488 HydrophobicContact CD2-CD1 4.44Å; L485-L488 PolarHBondContact O-N 3.29Å; L485-I489 WeakPolarHBondContact O-CB 3.09Å; L485-I489 WeakPolarHBondContact O-CD1 3.3Å; L485-I489 VanDerWaalsContact O-CG1 3.31Å; L485-I489 WeakPolarHBondContact O-CG1 3.39Å; L485-I489 PolarHBondContact O-N 3.45Å; L485-F623 HydrophobicContact CD1-CE1 3.88Å; L485-F623 HydrophobicContact CD1-CZ 4.42Å
486	Q	90.6	Very high	85.4	Confident	95 Å²	95	66.1 Å²	66.1	44%	0.444	31%	0.314	S	S	.	.	H	α-helix	trans	-61.2	-43.8	174.1	-73.5	171.2	-23.1	0	0	112	L469 I482 V483 I489 K490	L469-Q486 HydrophobicContact CD1-CG 3.97Å; L469-Q486 HydrophobicContact CD2-CG 3.97Å; I482-Q486 WeakPolarHBondContact O-CG 3.42Å; I482-Q486 PolarHBondContact O-N 3.3Å; V483-Q486 PolarHBondContact O-N 2.98Å; Q486-I489 PolarHBondContact O-N 2.93Å; Q486-K490 WeakPolarHBondContact O-CB 3.09Å; Q486-K490 PolarHBondContact O-N 3.45Å
487	E	90.2	Very high	86.2	Confident	78 Å²	78	65.5 Å²	65.5	36%	0.364	31%	0.31	S	S	.	.	H	α-helix	trans	-68.8	-35.6	176.5	-175	59.1	-155.6	0	0	112	V483 Y484 K490 N491	V483-E487 PolarHBondContact O-N 3.33Å; Y484-E487 PolarHBondContact O-N 3.3Å; E487-K490 PolarHBondContact O-N 2.93Å; E487-K490 IonicContact OE1-NZ 3.45Å; E487-K490 WeakPolarHBondContact OE2-CD 3.28Å; E487-K490 IonicContact OE2-NZ 2.7Å; E487-K490 PolarHBondContact OE2-NZ 3.18Å; E487-N491 PolarHBondContact O-N 3.08Å; E487-N491 PolarHBondContact O-ND2 3Å; E487-N491 PolarHBondContact OE1-ND2 2.82Å
488	L	89.5	Confident	86.9	Confident	49 Å²	49	60.9 Å²	60.9	26%	0.257	29%	0.29	S	S	.	.	H	α-helix	trans	-61.2	-45.5	169.9	-79.6	177	0	0	0	112.1	Y465 Y484 L485 N491 H492	Y465-L488 HydrophobicContact CE1-CB 4.48Å; Y465-L488 HydrophobicContact CE1-CD1 4.36Å; Y484-L488 HydrophobicContact CD1-CD1 4.04Å; Y484-L488 HydrophobicContact CE1-CD1 3.44Å; Y484-L488 VanDerWaalsContact CE1-CD1 3.44Å; Y484-L488 HydrophobicContact CE1-CG 4.15Å; Y484-L488 HydrophobicContact CE2-CG 4.47Å; Y484-L488 PolarHBondContact O-N 3.02Å; L485-L488 HydrophobicContact CD2-CD1 4.44Å; L485-L488 PolarHBondContact O-N 3.29Å; L488-N491 PolarHBondContact O-N 3.5Å; L488-H492 WeakPolarHBondContact O-CB 3.48Å; L488-H492 PolarHBondContact O-N 3.28Å
489	I	92	Very high	87.7	Confident	8 Å²	8	59 Å²	59	4%	0.041	28%	0.281	C	S	.	.	H	α-helix	trans	-62.1	-43.4	177.4	-74.4	159.4	0	0	0	111.3	Y465 L469 L485 Q486 H492 K493	Y465-I489 HydrophobicContact CG-CG1 4.33Å; L469-I489 HydrophobicContact CB-CD1 3.82Å; L469-I489 HydrophobicContact CD2-CD1 3.65Å; L469-I489 HydrophobicContact CG-CD1 4.3Å; L485-I489 WeakPolarHBondContact O-CB 3.09Å; L485-I489 WeakPolarHBondContact O-CD1 3.3Å; L485-I489 VanDerWaalsContact O-CG1 3.31Å; L485-I489 WeakPolarHBondContact O-CG1 3.39Å; L485-I489 PolarHBondContact O-N 3.45Å; Q486-I489 PolarHBondContact O-N 2.93Å; I489-H492 PolarHBondContact O-N 3.46Å; I489-K493 HydrophobicContact CG2-CD 3.84Å; I489-K493 VanDerWaalsContact CG2-CE 3.46Å; I489-K493 HydrophobicContact CG2-CG 4.5Å; I489-K493 VanDerWaalsContact CG2-NZ 3.27Å; I489-K493 WeakPolarHBondContact O-CB 3.32Å; I489-K493 WeakPolarHBondContact O-CG 3.48Å; I489-K493 PolarHBondContact O-N 3.26Å
490	K	91.3	Very high	88	Confident	59 Å²	59	57.9 Å²	57.9	26%	0.257	27%	0.265	S	S	.	.	H	α-helix	trans	-60.6	-45.7	176.3	177.6	174.9	152.3	-147.7	0	111.8	I358 E361 Q486 E487 K493 R494	I358-K490 HydrophobicContact CG2-CG 4.36Å; E361-K490 IonicContact OE1-NZ 3.9Å; E361-K490 PolarHBondContact OE1-NZ 2.7Å; Q486-K490 WeakPolarHBondContact O-CB 3.09Å; Q486-K490 PolarHBondContact O-N 3.45Å; E487-K490 PolarHBondContact O-N 2.93Å; E487-K490 IonicContact OE1-NZ 3.45Å; E487-K490 WeakPolarHBondContact OE2-CD 3.28Å; E487-K490 IonicContact OE2-NZ 2.7Å; E487-K490 PolarHBondContact OE2-NZ 3.18Å; K490-K493 PolarHBondContact O-N 3.43Å; K490-R494 WeakPolarHBondContact O-CB 3.48Å; K490-R494 PolarHBondContact O-N 3.3Å
491	N	90.3	Very high	88	Confident	77 Å²	77	50.8 Å²	50.8	41%	0.412	24%	0.239	S	C	.	.	H	α-helix	trans	-68.7	-36.8	176.1	-75.2	-70.5	0	0	0	112.9	E487 L488 R494 F495	E487-N491 PolarHBondContact O-N 3.08Å; E487-N491 PolarHBondContact O-ND2 3Å; E487-N491 PolarHBondContact OE1-ND2 2.82Å; L488-N491 PolarHBondContact O-N 3.5Å; N491-R494 PolarHBondContact O-N 3.45Å; N491-F495 WeakPolarHBondContact O-CB 3.41Å; N491-F495 PolarHBondContact O-N 3.37Å
492	H	91.2	Very high	88.2	Confident	17 Å²	17	53.3 Å²	53.3	8%	0.079	26%	0.257	C	S	.	.	H	α-helix	trans	-63.5	-46.2	173.7	-176.3	75.1	0	0	0	111.9	L458 I461 Y465 L488 I489 R494 F495 Q496	L458-H492 PolarHBondContact O-NE2 3.44Å; I461-H492 WeakPolarHBondContact CG2-CE1 3.42Å; Y465-H492 HydrophobicContact CD2-CB 4.25Å; Y465-H492 HydrophobicContact CE2-CB 4.05Å; Y465-H492 AromaticContact CE2-CG 3.92Å; Y465-H492 AromaticContact CE2-ND1 3.95Å; L488-H492 WeakPolarHBondContact O-CB 3.48Å; L488-H492 PolarHBondContact O-N 3.28Å; I489-H492 PolarHBondContact O-N 3.46Å; H492-R494 VanDerWaalsContact C-N 3.33Å; H492-R494 PolarHBondContact O-N 2.96Å; H492-F495 PolarHBondContact O-N 3Å; H492-Q496 WeakPolarHBondContact O-CB 3.13Å; H492-Q496 PolarHBondContact O-N 3.45Å
493	K	91	Very high	88	Confident	68 Å²	68	52.9 Å²	52.9	30%	0.296	26%	0.255	S	S	.	.	H	α-helix	trans	-63.4	-36.1	176.3	-73.1	170.4	178.9	168.1	0	112.7	I358 N462 E466 I489 K490 T497	I358-K493 HydrophobicContact CD1-CB 4.21Å; N462-K493 VanDerWaalsContact OD1-CE 3.28Å; N462-K493 WeakPolarHBondContact OD1-CE 3.5Å; N462-K493 WeakPolarHBondContact OD1-CG 3.48Å; E466-K493 WeakPolarHBondContact OE1-CE 3.41Å; E466-K493 IonicContact OE1-NZ 2.78Å; E466-K493 PolarHBondContact OE1-NZ 3.45Å; I489-K493 HydrophobicContact CG2-CD 3.84Å; I489-K493 VanDerWaalsContact CG2-CE 3.46Å; I489-K493 HydrophobicContact CG2-CG 4.5Å; I489-K493 VanDerWaalsContact CG2-NZ 3.27Å; I489-K493 WeakPolarHBondContact O-CB 3.32Å; I489-K493 WeakPolarHBondContact O-CG 3.48Å; I489-K493 PolarHBondContact O-N 3.26Å; K490-K493 PolarHBondContact O-N 3.43Å; K493-T497 PolarHBondContact O-N 2.73Å; K493-T497 PolarHBondContact O-OG1 3.22Å
494	R	89.7	Confident	87.7	Confident	104 Å²	104	51.8 Å²	51.8	39%	0.392	25%	0.245	S	C	.	.	H	α-helix	trans	-63	-51	170.6	-178.1	-178.1	166.9	174.5	-0.8	111.5	I358 K490 N491 H492 Q496 T497 E498	I358-R494 HydrophobicContact CG2-CB 3.98Å; K490-R494 WeakPolarHBondContact O-CB 3.48Å; K490-R494 PolarHBondContact O-N 3.3Å; N491-R494 PolarHBondContact O-N 3.45Å; H492-R494 VanDerWaalsContact C-N 3.33Å; H492-R494 PolarHBondContact O-N 2.96Å; R494-Q496 VanDerWaalsContact C-N 3.26Å; R494-Q496 PolarHBondContact O-N 2.89Å; R494-T497 PolarHBondContact O-N 3.44Å; R494-T497 PolarHBondContact O-OG1 3.38Å; R494-E498 WeakPolarHBondContact O-CB 3.41Å; R494-E498 PolarHBondContact O-N 3.35Å
495	F	89.6	Confident	87.4	Confident	100 Å²	100	49.5 Å²	49.5	44%	0.439	24%	0.238	S	C	.	.	H	α-helix	trans	-60.6	-37.4	177.9	176.6	-116.7	0	0	0	112.1	L458 N491 H492 T499	L458-F495 HydrophobicContact CD2-CD1 4.01Å; L458-F495 HydrophobicContact CD2-CE1 3.85Å; N491-F495 WeakPolarHBondContact O-CB 3.41Å; N491-F495 PolarHBondContact O-N 3.37Å; H492-F495 PolarHBondContact O-N 3Å; F495-T499 VanDerWaalsContact O-CB 3.26Å; F495-T499 WeakPolarHBondContact O-CB 3.39Å; F495-T499 PolarHBondContact O-N 3.21Å; F495-T499 PolarHBondContact O-OG1 3.48Å
496	Q	90.5	Very high	87	Confident	18 Å²	18	53 Å²	53	8%	0.084	26%	0.259	C	S	.	.	H	α-helix	trans	-65	-45.5	176	-173.6	178.9	20	0	0	112.5	L458 N459 H492 R494 T499 Q500	L458-Q496 HydrophobicContact CB-CG 4.02Å; L458-Q496 HydrophobicContact CD1-CG 4.4Å; N459-Q496 PolarHBondContact OD1-NE2 2.98Å; H492-Q496 WeakPolarHBondContact O-CB 3.13Å; H492-Q496 PolarHBondContact O-N 3.45Å; R494-Q496 VanDerWaalsContact C-N 3.26Å; R494-Q496 PolarHBondContact O-N 2.89Å; Q496-T499 PolarHBondContact O-N 2.68Å; Q496-Q500 WeakPolarHBondContact O-CB 3.3Å; Q496-Q500 VanDerWaalsContact O-CG 3.31Å; Q496-Q500 WeakPolarHBondContact O-CG 3.4Å; Q496-Q500 PolarHBondContact O-N 3.06Å
497	T	85.8	Confident	86.3	Confident	12 Å²	12	50.4 Å²	50.4	7%	0.074	25%	0.251	C	S	.	.	H	α-helix	trans	-67.6	-41.1	177.8	43.3	0	0	0	0	112	I358 K493 R494 T499 Q500 I501	I358-T497 HydrophobicContact CD1-CG2 3.91Å; K493-T497 PolarHBondContact O-N 2.73Å; K493-T497 PolarHBondContact O-OG1 3.22Å; R494-T497 PolarHBondContact O-N 3.44Å; R494-T497 PolarHBondContact O-OG1 3.38Å; T497-T499 VanDerWaalsContact C-N 3.32Å; T497-T499 PolarHBondContact O-N 3.4Å; T497-Q500 PolarHBondContact O-N 3.13Å; T497-I501 WeakPolarHBondContact O-CB 3.37Å; T497-I501 VanDerWaalsContact O-CG1 3.28Å; T497-I501 WeakPolarHBondContact O-CG1 3.33Å; T497-I501 PolarHBondContact O-N 3.11Å
498	E	83.3	Confident	85.7	Confident	89 Å²	89	48.7 Å²	48.7	42%	0.416	24%	0.242	S	C	.	.	H	α-helix	trans	-60.1	-40.6	172.6	-172.3	169.6	172.3	0	0	112	M355 R494 S502	M355-E498 HydrophobicContact SD-CB 4.19Å; R494-E498 WeakPolarHBondContact O-CB 3.41Å; R494-E498 PolarHBondContact O-N 3.35Å; E498-S502 WeakPolarHBondContact O-CB 3.48Å; E498-S502 PolarHBondContact O-N 3.42Å; E498-S502 PolarHBondContact O-OG 3.03Å
499	T	87.9	Confident	85.1	Confident	16 Å²	16	50.6 Å²	50.6	10%	0.098	25%	0.252	C	S	.	.	H	α-helix	trans	-66.9	-45.8	174.9	-61.6	0	0	0	0	112.1	L454 L458 F495 Q496 T497 S502 I503	L454-T499 HydrophobicContact CD2-CG2 3.9Å; L454-T499 HydrophobicContact CG-CG2 4.2Å; L458-T499 HydrophobicContact CD1-CG2 3.78Å; F495-T499 VanDerWaalsContact O-CB 3.26Å; F495-T499 WeakPolarHBondContact O-CB 3.39Å; F495-T499 PolarHBondContact O-N 3.21Å; F495-T499 PolarHBondContact O-OG1 3.48Å; Q496-T499 PolarHBondContact O-N 2.68Å; T497-T499 VanDerWaalsContact C-N 3.32Å; T497-T499 PolarHBondContact O-N 3.4Å; T499-S502 PolarHBondContact O-N 2.99Å; T499-I503 HydrophobicContact CG2-CD1 3.71Å; T499-I503 HydrophobicContact CG2-CG1 4.41Å; T499-I503 WeakPolarHBondContact O-CB 3.39Å; T499-I503 VanDerWaalsContact O-CG1 3.27Å; T499-I503 WeakPolarHBondContact O-CG1 3.42Å; T499-I503 PolarHBondContact O-N 3.01Å
500	Q	85.8	Confident	84.5	Confident	39 Å²	39	52.1 Å²	52.1	18%	0.182	26%	0.263	C	S	.	.	H	α-helix	trans	-60.8	-45.9	177	-76.2	171.1	-9	0	0	111.9	I455 Q496 T497 S502 I503 I504	I455-Q500 HydrophobicContact CD1-CG 4.24Å; I455-Q500 HydrophobicContact CG1-CG 4.16Å; I455-Q500 HydrophobicContact CG2-CG 4.46Å; Q496-Q500 WeakPolarHBondContact O-CB 3.3Å; Q496-Q500 VanDerWaalsContact O-CG 3.31Å; Q496-Q500 WeakPolarHBondContact O-CG 3.4Å; Q496-Q500 PolarHBondContact O-N 3.06Å; T497-Q500 PolarHBondContact O-N 3.13Å; Q500-S502 VanDerWaalsContact C-N 3.34Å; Q500-S502 PolarHBondContact O-N 2.93Å; Q500-I503 PolarHBondContact O-N 2.91Å; Q500-I504 WeakPolarHBondContact O-CD1 3.46Å; Q500-I504 VanDerWaalsContact O-CG1 3.28Å; Q500-I504 WeakPolarHBondContact O-CG1 3.26Å; Q500-I504 PolarHBondContact O-N 3.28Å
501	I	82	Confident	83.8	Confident	11 Å²	11	51.7 Å²	51.7	6%	0.056	27%	0.27	C	S	.	.	H	α-helix	trans	-55.7	-50.2	174.1	-76.1	166	0	0	0	110.4	L351 F352 M355 T497 I503 I504 Q505	L351-I501 HydrophobicContact CB-CD1 4.45Å; L351-I501 HydrophobicContact CB-CG1 4.04Å; F352-I501 HydrophobicContact CD1-CD1 4.23Å; F352-I501 HydrophobicContact CD2-CD1 3.9Å; F352-I501 HydrophobicContact CD2-CG1 4.15Å; F352-I501 HydrophobicContact CD2-CG2 4.23Å; F352-I501 HydrophobicContact CE1-CD1 4.38Å; F352-I501 HydrophobicContact CE1-CG2 4.38Å; F352-I501 HydrophobicContact CE2-CB 4.38Å; F352-I501 HydrophobicContact CE2-CD1 4.07Å; F352-I501 HydrophobicContact CE2-CG1 4.12Å; F352-I501 HydrophobicContact CE2-CG2 3.37Å; F352-I501 HydrophobicContact CG-CD1 4Å; F352-I501 HydrophobicContact CZ-CD1 4.31Å; F352-I501 HydrophobicContact CZ-CG2 3.46Å; F352-I501 VanDerWaalsContact CZ-CG2 3.46Å; M355-I501 HydrophobicContact CB-CD1 4.29Å; M355-I501 HydrophobicContact CE-CD1 3.85Å; M355-I501 HydrophobicContact SD-CD1 3.92Å; T497-I501 WeakPolarHBondContact O-CB 3.37Å; T497-I501 VanDerWaalsContact O-CG1 3.28Å; T497-I501 WeakPolarHBondContact O-CG1 3.33Å; T497-I501 PolarHBondContact O-N 3.11Å; I501-I503 PolarHBondContact O-N 3.34Å; I501-I504 PolarHBondContact O-N 2.95Å; I501-Q505 WeakPolarHBondContact O-CG 3.39Å; I501-Q505 PolarHBondContact O-N 3.46Å
502	S	84	Confident	83.3	Confident	57 Å²	57	50.7 Å²	50.7	40%	0.399	26%	0.264	S	S	.	.	H	α-helix	trans	-59.7	-45.5	-179.9	-59.2	0	0	0	0	111.8	E498 T499 Q500 I504 Q505 V506	E498-S502 WeakPolarHBondContact O-CB 3.48Å; E498-S502 PolarHBondContact O-N 3.42Å; E498-S502 PolarHBondContact O-OG 3.03Å; T499-S502 PolarHBondContact O-N 2.99Å; Q500-S502 VanDerWaalsContact C-N 3.34Å; Q500-S502 PolarHBondContact O-N 2.93Å; S502-I504 VanDerWaalsContact C-N 3.34Å; S502-I504 PolarHBondContact O-N 3.21Å; S502-Q505 PolarHBondContact O-N 3.15Å; S502-Q505 VanDerWaalsContact O-N 3.15Å; S502-V506 WeakPolarHBondContact O-CG2 3.37Å; S502-V506 PolarHBondContact O-N 2.9Å
503	I	83.1	Confident	82.8	Confident	23 Å²	23	53.6 Å²	53.6	12%	0.118	28%	0.277	C	S	.	.	H	α-helix	trans	-61.4	-39.3	178.3	-71.5	166.9	0	0	0	112	S451 L454 I455 T499 Q500 I501 Q505 P507	S451-I503 WeakPolarHBondContact OG-CG2 3.39Å; L454-I503 HydrophobicContact CD2-CD1 4.3Å; I455-I503 HydrophobicContact CD1-CD1 3.83Å; I455-I503 HydrophobicContact CD1-CG2 4.19Å; I455-I503 HydrophobicContact CG1-CD1 3.69Å; T499-I503 HydrophobicContact CG2-CD1 3.71Å; T499-I503 HydrophobicContact CG2-CG1 4.41Å; T499-I503 WeakPolarHBondContact O-CB 3.39Å; T499-I503 VanDerWaalsContact O-CG1 3.27Å; T499-I503 WeakPolarHBondContact O-CG1 3.42Å; T499-I503 PolarHBondContact O-N 3.01Å; Q500-I503 PolarHBondContact O-N 2.91Å; I501-I503 PolarHBondContact O-N 3.34Å; I503-Q505 VanDerWaalsContact C-N 3.31Å; I503-P507 WeakPolarHBondContact O-CD 3.3Å
504	I	79.7	Confident	82.1	Confident	64 Å²	64	51.8 Å²	51.8	33%	0.328	28%	0.275	S	S	.	.	H	α-helix	trans	-73.4	-26.3	178.7	-61.6	160.5	0	0	0	111.5	E348 L351 Q500 I501 S502	E348-I504 HydrophobicContact CG-CG2 3.61Å; L351-I504 HydrophobicContact CD1-CD1 3.44Å; L351-I504 VanDerWaalsContact CD1-CD1 3.44Å; Q500-I504 WeakPolarHBondContact O-CD1 3.46Å; Q500-I504 VanDerWaalsContact O-CG1 3.28Å; Q500-I504 WeakPolarHBondContact O-CG1 3.26Å; Q500-I504 PolarHBondContact O-N 3.28Å; I501-I504 PolarHBondContact O-N 2.95Å; S502-I504 VanDerWaalsContact C-N 3.34Å; S502-I504 PolarHBondContact O-N 3.21Å
505	Q	79.7	Confident	81.4	Confident	53 Å²	53	51.9 Å²	51.9	25%	0.248	28%	0.28	C	S	.	.	H	α-helix	trans	-81.3	-35.6	176.3	-71	177.6	0.1	0	0	113.8	I501 S502 I503 P507 K508 I509	I501-Q505 WeakPolarHBondContact O-CG 3.39Å; I501-Q505 PolarHBondContact O-N 3.46Å; S502-Q505 PolarHBondContact O-N 3.15Å; S502-Q505 VanDerWaalsContact O-N 3.15Å; I503-Q505 VanDerWaalsContact C-N 3.31Å; Q505-P507 VanDerWaalsContact C-CD 3.42Å; Q505-P507 VanDerWaalsContact C-N 3.32Å; Q505-P507 VanDerWaalsContact O-N 3.14Å; Q505-K508 WeakPolarHBondContact O-CB 3.19Å; Q505-K508 PolarHBondContact O-N 3.18Å; Q505-I509 HydrophobicContact CB-CD1 3.93Å; Q505-I509 WeakPolarHBondContact O-CG1 3.48Å; Q505-I509 PolarHBondContact O-N 3.35Å
506	V	79.4	Confident	80.8	Confident	76 Å²	76	48.4 Å²	48.4	46%	0.461	27%	0.267	S	S	.	.	H	α-helix	trans	-45.7	-44.6	-178.4	157.4	0	0	0	0	114.1	S502 I509 S510	S502-V506 WeakPolarHBondContact O-CG2 3.37Å; S502-V506 PolarHBondContact O-N 2.9Å; V506-I509 PolarHBondContact O-N 3.26Å; V506-S510 VanDerWaalsContact O-CB 3.26Å; V506-S510 WeakPolarHBondContact O-CB 3.27Å; V506-S510 PolarHBondContact O-N 2.86Å; V506-S510 PolarHBondContact O-OG 3.34Å
507	P	77.5	Confident	80.2	Confident	41 Å²	41	51.8 Å²	51.8	27%	0.266	28%	0.283	S	S	.	.	H	α-helix	trans	-65.5	-38.6	178.2	-21.4	32.4	0	0	0	113.5	F448 I503 Q505 A511	F448-P507 HydrophobicContact CD2-CG 4.45Å; F448-P507 HydrophobicContact CE1-CG 3.98Å; F448-P507 HydrophobicContact CE2-CB 3.92Å; F448-P507 HydrophobicContact CE2-CG 3.49Å; F448-P507 VanDerWaalsContact CE2-CG 3.49Å; F448-P507 HydrophobicContact CZ-CB 3.95Å; F448-P507 HydrophobicContact CZ-CG 3.21Å; I503-P507 WeakPolarHBondContact O-CD 3.3Å; Q505-P507 VanDerWaalsContact C-CD 3.42Å; Q505-P507 VanDerWaalsContact C-N 3.32Å; Q505-P507 VanDerWaalsContact O-N 3.14Å; P507-A511 WeakPolarHBondContact O-CB 3.21Å; P507-A511 PolarHBondContact O-N 3.07Å
508	K	75.8	Confident	79.6	Confident	42 Å²	42	58.4 Å²	58.4	18%	0.183	31%	0.306	C	S	.	.	H	α-helix	trans	-66.4	-47.2	176.8	-67.1	179.1	177.7	-178	0	110.4	I341 F343 E348 Q505 A511 M512	I341-K508 HydrophobicContact CG2-CB 3.9Å; I341-K508 WeakPolarHBondContact CG2-O 3.37Å; F343-K508 PolarHBondContact O-NZ 2.97Å; E348-K508 IonicContact OE1-NZ 2.69Å; E348-K508 PolarHBondContact OE1-NZ 3.41Å; E348-K508 IonicContact OE2-NZ 3.16Å; E348-K508 PolarHBondContact OE2-NZ 3.47Å; Q505-K508 WeakPolarHBondContact O-CB 3.19Å; Q505-K508 PolarHBondContact O-N 3.18Å; K508-A511 PolarHBondContact O-N 3.05Å; K508-M512 WeakPolarHBondContact O-CB 3.37Å; K508-M512 PolarHBondContact O-N 2.69Å
509	I	78.1	Confident	78.8	Confident	89 Å²	89	59.3 Å²	59.3	46%	0.456	32%	0.318	S	S	.	.	H	α-helix	trans	-61.5	-45.5	176.8	-63.5	168.7	0	0	0	110.3	Q505 V506 A511 M512 Q513	Q505-I509 HydrophobicContact CB-CD1 3.93Å; Q505-I509 WeakPolarHBondContact O-CG1 3.48Å; Q505-I509 PolarHBondContact O-N 3.35Å; V506-I509 PolarHBondContact O-N 3.26Å; I509-A511 PolarHBondContact O-N 3.17Å; I509-M512 PolarHBondContact O-N 3.48Å; I509-Q513 VanDerWaalsContact O-CB 3.32Å; I509-Q513 WeakPolarHBondContact O-CB 3.35Å; I509-Q513 PolarHBondContact O-N 3.02Å
510	S	78.2	Confident	77.9	Confident	40 Å²	40	64.8 Å²	64.8	28%	0.28	34%	0.34	S	S	.	.	H	α-helix	trans	-61.8	-42.3	178.2	-58.8	0	0	0	0	112.4	V506 A514	V506-S510 VanDerWaalsContact O-CB 3.26Å; V506-S510 WeakPolarHBondContact O-CB 3.27Å; V506-S510 PolarHBondContact O-N 2.86Å; V506-S510 PolarHBondContact O-OG 3.34Å; S510-A514 VanDerWaalsContact O-CB 3.28Å; S510-A514 WeakPolarHBondContact O-CB 3.17Å; S510-A514 PolarHBondContact O-N 3.38Å
511	A	77.2	Confident	77	Confident	49 Å²	49	67.7 Å²	67.7	41%	0.405	36%	0.356	S	S	.	.	H	α-helix	trans	-66	-40.8	176.9	0	0	0	0	0	112.1	P507 K508 I509 E515	P507-A511 WeakPolarHBondContact O-CB 3.21Å; P507-A511 PolarHBondContact O-N 3.07Å; K508-A511 PolarHBondContact O-N 3.05Å; I509-A511 PolarHBondContact O-N 3.17Å; A511-E515 PolarHBondContact O-N 3.2Å
512	M	80	Confident	75.9	Confident	57 Å²	57	69.5 Å²	69.5	28%	0.281	37%	0.37	S	S	.	.	H	α-helix	trans	-64.5	-48.7	175.8	-174.3	-179.9	78	0	0	111.8	W320 I341 K508 I509 E515 V516	W320-M512 HydrophobicContact CH2-CE 3.93Å; W320-M512 HydrophobicContact CH2-CG 4.35Å; W320-M512 HydrophobicContact CH2-SD 3.42Å; W320-M512 WeakPolarHBondContact CH2-SD 3.39Å; W320-M512 HydrophobicContact CZ2-CE 4.41Å; W320-M512 HydrophobicContact CZ2-CG 4.28Å; W320-M512 HydrophobicContact CZ2-SD 3.93Å; W320-M512 HydrophobicContact CZ3-CE 4.13Å; W320-M512 HydrophobicContact CZ3-SD 4.13Å; I341-M512 HydrophobicContact CG2-CB 4.31Å; K508-M512 WeakPolarHBondContact O-CB 3.37Å; K508-M512 PolarHBondContact O-N 2.69Å; I509-M512 PolarHBondContact O-N 3.48Å; M512-E515 PolarHBondContact O-N 3.11Å; M512-V516 WeakPolarHBondContact O-CG2 3.39Å; M512-V516 PolarHBondContact O-N 3.22Å
513	Q	79.7	Confident	74.8	Confident	78 Å²	78	68.5 Å²	68.5	36%	0.364	36%	0.363	S	S	.	.	H	α-helix	trans	-60.8	-46.6	178.8	-179.1	65.1	13.4	0	0	111.5	I509 E515 V516 E517	I509-Q513 VanDerWaalsContact O-CB 3.32Å; I509-Q513 WeakPolarHBondContact O-CB 3.35Å; I509-Q513 PolarHBondContact O-N 3.02Å; Q513-E515 PolarHBondContact O-N 3.21Å; Q513-V516 WeakPolarHBondContact O-CB 3.41Å; Q513-V516 PolarHBondContact O-N 3.31Å; Q513-V516 VanDerWaalsContact O-N 3.13Å; Q513-E517 WeakPolarHBondContact CG-OE1 3.38Å; Q513-E517 PolarHBondContact NE2-OE1 3.47Å; Q513-E517 WeakPolarHBondContact O-CG 3.4Å; Q513-E517 PolarHBondContact O-N 3.02Å
514	A	77.1	Confident	73.8	Confident	30 Å²	30	67.7 Å²	67.7	25%	0.248	36%	0.358	C	S	.	.	H	α-helix	trans	-61.8	-29.8	178	0	0	0	0	0	112.9	S510 R518	S510-A514 VanDerWaalsContact O-CB 3.28Å; S510-A514 WeakPolarHBondContact O-CB 3.17Å; S510-A514 PolarHBondContact O-N 3.38Å; A514-R518 VanDerWaalsContact O-CG 3.3Å; A514-R518 WeakPolarHBondContact O-CG 3.47Å; A514-R518 PolarHBondContact O-N 3.25Å; A514-R518 VanDerWaalsContact O-N 3.14Å
515	E	75.4	Confident	73.2	Confident	106 Å²	106	66.3 Å²	66.3	50%	0.495	35%	0.353	S	S	.	.	H	α-helix	trans	-77.2	-39.2	174	-163.9	62	-162.4	0	0	112	A511 M512 Q513 E517 R518 T519	A511-E515 PolarHBondContact O-N 3.2Å; M512-E515 PolarHBondContact O-N 3.11Å; Q513-E515 PolarHBondContact O-N 3.21Å; E515-E517 VanDerWaalsContact C-N 3.32Å; E515-E517 PolarHBondContact O-N 3.44Å; E515-R518 PolarHBondContact O-N 3.06Å; E515-R518 WeakPolarHBondContact OE2-CD 3.24Å; E515-R518 IonicContact OE2-CZ 3.57Å; E515-R518 IonicContact OE2-NE 2.68Å; E515-R518 IonicContact OE2-NH1 3.68Å; E515-R518 PolarHBondContact OE2-NH1 2.95Å; E515-T519 PolarHBondContact O-N 3.15Å
516	V	77	Confident	72.6	Confident	26 Å²	26	68.3 Å²	68.3	16%	0.158	37%	0.371	C	S	.	.	H	α-helix	trans	-57.6	-46.2	171	170.3	0	0	0	0	110.6	M512 Q513 R518 T519 K520	M512-V516 WeakPolarHBondContact O-CG2 3.39Å; M512-V516 PolarHBondContact O-N 3.22Å; Q513-V516 WeakPolarHBondContact O-CB 3.41Å; Q513-V516 PolarHBondContact O-N 3.31Å; Q513-V516 VanDerWaalsContact O-N 3.13Å; V516-R518 PolarHBondContact O-N 2.93Å; V516-T519 PolarHBondContact O-N 2.75Å; V516-T519 VanDerWaalsContact O-N 3.09Å; V516-T519 PolarHBondContact O-OG1 2.74Å; V516-K520 PolarHBondContact O-N 3.4Å; V516-K520 VanDerWaalsContact O-N 3.14Å
517	E	77.2	Confident	72	Confident	90 Å²	90	70.6 Å²	70.6	42%	0.421	38%	0.38	S	S	.	.	H	α-helix	trans	-63.8	-39.9	178	-73.7	168.9	-171.9	0	0	112.8	Q513 E515 T519 K520 I521	Q513-E517 WeakPolarHBondContact CG-OE1 3.38Å; Q513-E517 PolarHBondContact NE2-OE1 3.47Å; Q513-E517 WeakPolarHBondContact O-CG 3.4Å; Q513-E517 PolarHBondContact O-N 3.02Å; E515-E517 VanDerWaalsContact C-N 3.32Å; E515-E517 PolarHBondContact O-N 3.44Å; E517-T519 PolarHBondContact O-N 3.34Å; E517-K520 WeakPolarHBondContact O-CB 3.31Å; E517-K520 PolarHBondContact O-N 3.24Å; E517-I521 WeakPolarHBondContact O-CG1 3.47Å; E517-I521 PolarHBondContact O-N 3.36Å
518	R	72.5	Confident	71.6	Confident	151 Å²	151	68.8 Å²	68.8	57%	0.57	37%	0.368	S	S	*	.	H	α-helix	trans	-56.6	-35.5	171.2	-76.4	172.4	-161.8	115.1	15.5	112.6	A514 E515 V516	A514-R518 VanDerWaalsContact O-CG 3.3Å; A514-R518 WeakPolarHBondContact O-CG 3.47Å; A514-R518 PolarHBondContact O-N 3.25Å; A514-R518 VanDerWaalsContact O-N 3.14Å; E515-R518 PolarHBondContact O-N 3.06Å; E515-R518 WeakPolarHBondContact OE2-CD 3.24Å; E515-R518 IonicContact OE2-CZ 3.57Å; E515-R518 IonicContact OE2-NE 2.68Å; E515-R518 IonicContact OE2-NH1 3.68Å; E515-R518 PolarHBondContact OE2-NH1 2.95Å; V516-R518 PolarHBondContact O-N 2.93Å
519	T	68	Low	71.2	Confident	107 Å²	107	67.6 Å²	67.6	66%	0.656	37%	0.367	S	S	*	.	H	α-helix	trans	-74.9	-28.5	175.6	68.7	0	0	0	0	113.7	E515 V516 E517 I521	E515-T519 PolarHBondContact O-N 3.15Å; V516-T519 PolarHBondContact O-N 2.75Å; V516-T519 VanDerWaalsContact O-N 3.09Å; V516-T519 PolarHBondContact O-OG1 2.74Å; E517-T519 PolarHBondContact O-N 3.34Å; T519-I521 VanDerWaalsContact C-N 3.34Å
520	K	69.6	Low	70.8	Confident	132 Å²	132	67.1 Å²	67.1	57%	0.574	37%	0.368	S	S	*	.	H	α-helix	trans	-68.9	-30.5	175.5	-68.9	176.9	176.5	178.5	0	112.1	V516 E517 S522	V516-K520 PolarHBondContact O-N 3.4Å; V516-K520 VanDerWaalsContact O-N 3.14Å; E517-K520 WeakPolarHBondContact O-CB 3.31Å; E517-K520 PolarHBondContact O-N 3.24Å; K520-S522 VanDerWaalsContact C-N 3.31Å; K520-S522 PolarHBondContact O-N 3.38Å
521	I	65.6	Low	70.4	Confident	99 Å²	99	67.1 Å²	67.1	51%	0.508	37%	0.365	S	S	.	.			trans	-80	73	179.1	-53.7	168.5	0	0	0	110.7	E517 T519 S523 L574	E517-I521 WeakPolarHBondContact O-CG1 3.47Å; E517-I521 PolarHBondContact O-N 3.36Å; T519-I521 VanDerWaalsContact C-N 3.34Å; I521-S523 PolarHBondContact O-N 3.48Å; I521-L574 HydrophobicContact CG2-CD2 4.36Å
522	S	60.1	Low	69.8	Low	50 Å²	50	64.9 Å²	64.9	35%	0.35	35%	0.346	S	S	.	.			trans	-58.1	129.8	169.5	177.9	0	0	0	0	110.4	K520 I524 R570	K520-S522 VanDerWaalsContact C-N 3.31Å; K520-S522 PolarHBondContact O-N 3.38Å; S522-I524 PolarHBondContact O-N 3.45Å; S522-I524 PolarHBondContact OG-O 3.25Å; S522-R570 VanDerWaalsContact O-CZ 3.24Å; S522-R570 PolarHBondContact O-NH1 3.29Å; S522-R570 PolarHBondContact O-NH2 3.43Å
523	S	61	Low	69.2	Low	35 Å²	35	65.8 Å²	65.8	25%	0.245	35%	0.354	C	S	.	.	S	Bend	trans	-71.4	-20.4	-178.2	79.9	0	0	0	0	113.3	I521 I542 K544 F545	I521-S523 PolarHBondContact O-N 3.48Å; S523-I542 PolarHBondContact N-O 2.97Å; S523-I542 PolarHBondContact OG-O 3.42Å; S523-K544 PolarHBondContact OG-N 3.34Å; S523-F545 WeakPolarHBondContact O-CD2 3.45Å; S523-F545 PolarHBondContact OG-N 3.16Å; S523-F545 VanDerWaalsContact OG-N 3.16Å
524	I	61.9	Low	68.4	Low	6 Å²	6	68.5 Å²	68.5	3%	0.031	37%	0.371	C	S	.	.	S	Bend	trans	-125.2	134.5	-178.1	-65.3	175.1	0	0	0	110.1	S522 I528 A529 L532 V540 I542 F545	S522-I524 PolarHBondContact O-N 3.45Å; S522-I524 PolarHBondContact OG-O 3.25Å; I524-I528 HydrophobicContact CG2-CB 3.94Å; I524-I528 HydrophobicContact CG2-CG2 3.8Å; I524-A529 HydrophobicContact CG2-CB 3.86Å; I524-L532 HydrophobicContact CD1-CD1 3.93Å; I524-V540 HydrophobicContact CD1-CG1 3.72Å; I524-I542 HydrophobicContact CB-CG2 4.01Å; I524-F545 HydrophobicContact CD1-CD2 4.11Å; I524-F545 HydrophobicContact CD1-CE2 4.41Å; I524-F545 HydrophobicContact CG1-CD2 3.41Å; I524-F545 VanDerWaalsContact CG1-CD2 3.41Å; I524-F545 HydrophobicContact CG1-CE2 3.72Å; I524-F545 HydrophobicContact CG1-CG 4.47Å
525	T	66.9	Low	67.6	Low	35 Å²	35	69.8 Å²	69.8	22%	0.215	38%	0.376	C	S	.	.			trans	-71.6	136.4	169.4	-51.4	0	0	0	0	109.5	N527 I528 A529 D566	T525-N527 PolarHBondContact O-N 3.15Å; T525-I528 PolarHBondContact O-N 3.01Å; T525-A529 PolarHBondContact O-N 2.96Å; T525-A529 VanDerWaalsContact O-N 3.12Å; T525-D566 WeakPolarHBondContact CB-OD1 3.45Å; T525-D566 VanDerWaalsContact CB-OD2 3.25Å; T525-D566 WeakPolarHBondContact CB-OD2 3.27Å; T525-D566 WeakPolarHBondContact CG2-OD1 3.38Å; T525-D566 PolarHBondContact OG1-OD1 3.05Å; T525-D566 PolarHBondContact OG1-OD2 2.67Å
526	P	66.9	Low	66.8	Low	95 Å²	95	66.2 Å²	66.2	62%	0.617	36%	0.36	S	S	*	.	H	α-helix	trans	-57.7	-28.1	-171.5	19.5	-32.9	0	0	0	114.7	I528 A529 T530	P526-I528 VanDerWaalsContact C-N 3.29Å; P526-I528 PolarHBondContact O-N 2.71Å; P526-A529 PolarHBondContact O-N 2.88Å; P526-T530 PolarHBondContact O-N 3.31Å; P526-T530 PolarHBondContact O-OG1 3.49Å; P526-T530 VanDerWaalsContact O-OG1 3.06Å
527	N	67.2	Low	65.7	Low	125 Å²	125	74.2 Å²	74.2	67%	0.668	39%	0.393	S	S	*	.	H	α-helix	trans	-65	-29.9	174.2	-65.5	-9	0	0	0	113	T525 T530 L531	T525-N527 PolarHBondContact O-N 3.15Å; N527-T530 PolarHBondContact O-OG1 3.24Å; N527-T530 VanDerWaalsContact O-OG1 3.12Å; N527-L531 PolarHBondContact O-N 2.7Å
528	I	69.1	Low	64.5	Low	2 Å²	2	72 Å²	72	1%	0.01	38%	0.384	C	S	.	.	H	α-helix	trans	-82.7	-39.3	171	-73.8	-177.4	0	0	0	110.8	I524 T525 P526 T530 L531 L532 I563 D566	I524-I528 HydrophobicContact CG2-CB 3.94Å; I524-I528 HydrophobicContact CG2-CG2 3.8Å; T525-I528 PolarHBondContact O-N 3.01Å; P526-I528 VanDerWaalsContact C-N 3.29Å; P526-I528 PolarHBondContact O-N 2.71Å; I528-T530 VanDerWaalsContact C-N 3.28Å; I528-T530 PolarHBondContact O-N 2.7Å; I528-L531 WeakPolarHBondContact O-CA 3.27Å; I528-L531 WeakPolarHBondContact O-CB 3.48Å; I528-L531 PolarHBondContact O-N 2.97Å; I528-L532 HydrophobicContact CG2-CD1 3.78Å; I528-L532 HydrophobicContact CG2-CD2 4.36Å; I528-L532 HydrophobicContact CG2-CG 3.81Å; I528-L532 WeakPolarHBondContact O-CG 3.26Å; I528-L532 PolarHBondContact O-N 2.74Å; I528-I563 HydrophobicContact CD1-CB 4.26Å; I528-I563 HydrophobicContact CD1-CG1 4.1Å; I528-I563 HydrophobicContact CD1-CG2 4.36Å; I528-I563 HydrophobicContact CG1-CG1 4.48Å; I528-D566 HydrophobicContact CD1-CB 3.33Å; I528-D566 HydrophobicContact CG1-CB 4.3Å
529	A	67.3	Low	63.4	Low	18 Å²	18	76.9 Å²	76.9	15%	0.149	40%	0.402	C	S	.	.	H	α-helix	trans	-54.3	-47.5	177.3	0	0	0	0	0	111.2	I524 T525 P526 L531 L532 T533	I524-A529 HydrophobicContact CG2-CB 3.86Å; T525-A529 PolarHBondContact O-N 2.96Å; T525-A529 VanDerWaalsContact O-N 3.12Å; P526-A529 PolarHBondContact O-N 2.88Å; A529-L531 PolarHBondContact O-N 3.49Å; A529-L532 PolarHBondContact O-N 3.33Å; A529-T533 WeakPolarHBondContact O-CB 3.45Å; A529-T533 PolarHBondContact O-N 3.41Å; A529-T533 PolarHBondContact O-OG1 2.89Å
530	T	68.8	Low	62.6	Low	79 Å²	79	73.1 Å²	73.1	49%	0.485	38%	0.379	S	S	.	.	H	α-helix	trans	-63	-38.1	174.5	49.8	0	0	0	0	113.3	P526 N527 I528 N534	P526-T530 PolarHBondContact O-N 3.31Å; P526-T530 PolarHBondContact O-OG1 3.49Å; P526-T530 VanDerWaalsContact O-OG1 3.06Å; N527-T530 PolarHBondContact O-OG1 3.24Å; N527-T530 VanDerWaalsContact O-OG1 3.12Å; I528-T530 VanDerWaalsContact C-N 3.28Å; I528-T530 PolarHBondContact O-N 2.7Å; T530-N534 VanDerWaalsContact O-CB 3.3Å; T530-N534 WeakPolarHBondContact O-CB 3.4Å; T530-N534 PolarHBondContact O-N 2.96Å; T530-N534 PolarHBondContact O-ND2 2.9Å
531	L	69.1	Low	61.7	Low	40 Å²	40	70.1 Å²	70.1	21%	0.209	37%	0.37	C	S	.	.	H	α-helix	trans	-62.8	-51.3	176.2	-141.7	170.8	0	0	0	111.2	N527 I528 A529 T533 N534 T535 F555 Q559 V562	N527-L531 PolarHBondContact O-N 2.7Å; I528-L531 WeakPolarHBondContact O-CA 3.27Å; I528-L531 WeakPolarHBondContact O-CB 3.48Å; I528-L531 PolarHBondContact O-N 2.97Å; A529-L531 PolarHBondContact O-N 3.49Å; L531-T533 PolarHBondContact O-N 3.21Å; L531-N534 PolarHBondContact O-N 2.9Å; L531-T535 HydrophobicContact CD2-CG2 3.83Å; L531-T535 WeakPolarHBondContact O-CG2 3.27Å; L531-T535 PolarHBondContact O-N 3.43Å; L531-T535 VanDerWaalsContact O-N 3.09Å; L531-T535 PolarHBondContact O-OG1 2.89Å; L531-T535 VanDerWaalsContact O-OG1 3.05Å; L531-F555 HydrophobicContact CD2-CE1 4.39Å; L531-Q559 HydrophobicContact CD2-CB 4.44Å; L531-Q559 HydrophobicContact CD2-CG 4.11Å; L531-V562 HydrophobicContact CD1-CG1 4.12Å
532	L	66.1	Low	61.1	Low	2 Å²	2	69.3 Å²	69.3	1%	0.01	37%	0.366	C	S	.	.	H	α-helix	trans	-61	-41.2	177.9	-60.4	176.8	0	0	0	112.2	I524 I528 A529 I536 V540 I547 F555 I563	I524-L532 HydrophobicContact CD1-CD1 3.93Å; I528-L532 HydrophobicContact CG2-CD1 3.78Å; I528-L532 HydrophobicContact CG2-CD2 4.36Å; I528-L532 HydrophobicContact CG2-CG 3.81Å; I528-L532 WeakPolarHBondContact O-CG 3.26Å; I528-L532 PolarHBondContact O-N 2.74Å; A529-L532 PolarHBondContact O-N 3.33Å; L532-I536 PolarHBondContact O-N 2.87Å; L532-V540 HydrophobicContact CB-CG2 4.17Å; L532-V540 HydrophobicContact CD1-CG1 4.35Å; L532-V540 HydrophobicContact CD1-CG2 4.15Å; L532-I547 HydrophobicContact CD1-CD1 4.04Å; L532-I547 HydrophobicContact CD2-CD1 3.94Å; L532-F555 HydrophobicContact CD2-CE1 3.9Å; L532-F555 HydrophobicContact CD2-CE2 4.05Å; L532-F555 HydrophobicContact CD2-CZ 3.3Å; L532-I563 HydrophobicContact CD2-CD1 4.23Å
533	T	66.6	Low	60.7	Low	75 Å²	75	76.2 Å²	76.2	46%	0.46	38%	0.384	S	S	.	.	H	α-helix	trans	-64.5	-42.4	177.1	-57.5	0	0	0	0	111.5	A529 L531 F537	A529-T533 WeakPolarHBondContact O-CB 3.45Å; A529-T533 PolarHBondContact O-N 3.41Å; A529-T533 PolarHBondContact O-OG1 2.89Å; L531-T533 PolarHBondContact O-N 3.21Å; T533-F537 WeakPolarHBondContact O-CA 3.29Å; T533-F537 PolarHBondContact O-N 3.3Å
534	N	64.2	Low	60.4	Low	135 Å²	135	81.2 Å²	81.2	72%	0.722	40%	0.401	S	S	*	.	H	α-helix	trans	-74.4	-27.9	-176.9	-73.3	-13.7	0	0	0	114	T530 L531	T530-N534 VanDerWaalsContact O-CB 3.3Å; T530-N534 WeakPolarHBondContact O-CB 3.4Å; T530-N534 PolarHBondContact O-N 2.96Å; T530-N534 PolarHBondContact O-ND2 2.9Å; L531-N534 PolarHBondContact O-N 2.9Å
535	T	59	Low	60.3	Low	57 Å²	57	83.9 Å²	83.9	35%	0.35	41%	0.413	S	S	.	.	H	α-helix	trans	-91.6	-36.2	-175.1	52.1	0	0	0	0	114.8	L531 F555	L531-T535 HydrophobicContact CD2-CG2 3.83Å; L531-T535 WeakPolarHBondContact O-CG2 3.27Å; L531-T535 PolarHBondContact O-N 3.43Å; L531-T535 VanDerWaalsContact O-N 3.09Å; L531-T535 PolarHBondContact O-OG1 2.89Å; L531-T535 VanDerWaalsContact O-OG1 3.05Å; T535-F555 HydrophobicContact CG2-CE1 4.34Å; T535-F555 WeakPolarHBondContact OG1-CE1 3.48Å
536	I	59.2	Low	60	Low	31 Å²	31	89.9 Å²	89.9	16%	0.159	44%	0.438	C	S	.	.	H	α-helix	trans	-126.1	4.3	-171.9	-46.9	-179.7	0	0	0	112	L532 L538 E551 Q554 F555	L532-I536 PolarHBondContact O-N 2.87Å; I536-L538 HydrophobicContact CB-CD1 3.77Å; I536-L538 HydrophobicContact CB-CG 3.76Å; I536-L538 HydrophobicContact CD1-CD1 4.26Å; I536-L538 HydrophobicContact CG2-CD1 3.85Å; I536-L538 HydrophobicContact CG2-CD2 4.11Å; I536-L538 HydrophobicContact CG2-CG 3.67Å; I536-L538 PolarHBondContact O-N 3.42Å; I536-E551 HydrophobicContact CD1-CB 4.24Å; I536-E551 WeakPolarHBondContact CD1-O 3.26Å; I536-Q554 HydrophobicContact CD1-CB 3.87Å; I536-Q554 HydrophobicContact CG1-CB 4.44Å; I536-F555 HydrophobicContact CD1-CD2 3.99Å; I536-F555 HydrophobicContact CD1-CE1 4.35Å; I536-F555 HydrophobicContact CD1-CE2 3.29Å; I536-F555 HydrophobicContact CD1-CZ 3.48Å; I536-F555 VanDerWaalsContact CD1-CZ 3.48Å; I536-F555 HydrophobicContact CG1-CE2 4.38Å; I536-F555 HydrophobicContact CG1-CZ 4.11Å
537	F	52.7	Low	60	Low	195 Å²	195	87 Å²	87	86%	0.855	42%	0.417	S	S	*	.			trans	58.7	17.7	-179.4	-118.9	-84.9	0	0	0	114.1	T533	T533-F537 WeakPolarHBondContact O-CA 3.29Å; T533-F537 PolarHBondContact O-N 3.3Å
538	L	53	Low	60.2	Low	42 Å²	42	82.9 Å²	82.9	22%	0.22	40%	0.398	C	S	.	.			trans	-70.4	134.1	-170.7	-72.2	166.4	0	0	0	112.6	I536 V540 E551	I536-L538 HydrophobicContact CB-CD1 3.77Å; I536-L538 HydrophobicContact CB-CG 3.76Å; I536-L538 HydrophobicContact CD1-CD1 4.26Å; I536-L538 HydrophobicContact CG2-CD1 3.85Å; I536-L538 HydrophobicContact CG2-CD2 4.11Å; I536-L538 HydrophobicContact CG2-CG 3.67Å; I536-L538 PolarHBondContact O-N 3.42Å; L538-V540 HydrophobicContact CB-CG2 3.51Å; L538-V540 HydrophobicContact CD1-CG2 4.17Å; L538-V540 HydrophobicContact CG-CG2 4.49Å; L538-V540 PolarHBondContact O-N 2.73Å; L538-E551 HydrophobicContact CD1-CB 4.3Å; L538-E551 HydrophobicContact CD1-CG 3.82Å; L538-E551 HydrophobicContact CD2-CG 4.06Å
539	R	50	Low	60.6	Low	254 Å²	254	89.8 Å²	89.8	96%	0.958	43%	0.428	S	S	*	.			trans	-78	64.4	159.6	-67.5	-175.5	177.1	-174.4	-0.1	110.3	D541	R539-D541 PolarHBondContact O-N 2.97Å
540	V	50.1	Low	61	Low	28 Å²	28	94.6 Å²	94.6	17%	0.17	45%	0.447	C	S	.	.			trans	-61.2	122.8	176.9	-172.9	0	0	0	0	109.3	I524 L532 L538 I542	I524-V540 HydrophobicContact CD1-CG1 3.72Å; L532-V540 HydrophobicContact CB-CG2 4.17Å; L532-V540 HydrophobicContact CD1-CG1 4.35Å; L532-V540 HydrophobicContact CD1-CG2 4.15Å; L538-V540 HydrophobicContact CB-CG2 3.51Å; L538-V540 HydrophobicContact CD1-CG2 4.17Å; L538-V540 HydrophobicContact CG-CG2 4.49Å; L538-V540 PolarHBondContact O-N 2.73Å; V540-I542 VanDerWaalsContact C-N 3.35Å; V540-I542 WeakPolarHBondContact O-CG1 3.49Å; V540-I542 PolarHBondContact O-N 3.16Å
541	D	51.4	Low	61.1	Low	69 Å²	69	92.8 Å²	92.8	37%	0.369	43%	0.433	S	S	.	.			trans	-73.1	94.8	168.3	-169.1	-11.4	0	0	0	108.3	R539 R543 K544	R539-D541 PolarHBondContact O-N 2.97Å; D541-R543 PolarHBondContact O-N 3.47Å; D541-R543 IonicContact OD1-CZ 2.71Å; D541-R543 IonicContact OD1-NE 3.48Å; D541-R543 PolarHBondContact OD1-NE 3.34Å; D541-R543 IonicContact OD1-NH2 2.64Å; D541-R543 PolarHBondContact OD1-NH2 3.37Å; D541-R543 IonicContact OD2-CZ 2.86Å; D541-R543 IonicContact OD2-NE 2.78Å; D541-R543 IonicContact OD2-NH2 2.67Å; D541-R543 PolarHBondContact OD2-NH2 3.09Å; D541-K544 PolarHBondContact O-N 3.49Å
542	I	52	Low	61.4	Low	83 Å²	83	94.5 Å²	94.5	43%	0.426	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53	-12.7	-172.5	-46.5	-177.8	0	0	0	113	S523 I524 V540	S523-I542 PolarHBondContact N-O 2.97Å; S523-I542 PolarHBondContact OG-O 3.42Å; I524-I542 HydrophobicContact CB-CG2 4.01Å; V540-I542 VanDerWaalsContact C-N 3.35Å; V540-I542 WeakPolarHBondContact O-CG1 3.49Å; V540-I542 PolarHBondContact O-N 3.16Å
543	R	51.4	Low	62.2	Low	194 Å²	194	100.3 Å²	100.3	73%	0.732	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.9	-8.6	-179	-59.6	170.8	-62.9	173.3	6.6	114.8	D541	D541-R543 PolarHBondContact O-N 3.47Å; D541-R543 IonicContact OD1-CZ 2.71Å; D541-R543 IonicContact OD1-NE 3.48Å; D541-R543 PolarHBondContact OD1-NE 3.34Å; D541-R543 IonicContact OD1-NH2 2.64Å; D541-R543 PolarHBondContact OD1-NH2 3.37Å; D541-R543 IonicContact OD2-CZ 2.86Å; D541-R543 IonicContact OD2-NE 2.78Å; D541-R543 IonicContact OD2-NH2 2.67Å; D541-R543 PolarHBondContact OD2-NH2 3.09Å
544	K	56.2	Low	62.8	Low	141 Å²	141	102.6 Å²	102.6	61%	0.613	48%	0.478	S	S	*	.	S	Bend	trans	-128.1	-4.3	-169	-69.5	-169.2	175.9	-177.3	0	117.4	S523 D541 H546	S523-K544 PolarHBondContact OG-N 3.34Å; D541-K544 PolarHBondContact O-N 3.49Å; K544-H546 PolarHBondContact O-N 3.28Å
545	F	60.1	Low	63.5	Low	61 Å²	61	96.7 Å²	96.7	27%	0.268	45%	0.446	S	S	.	.			trans	41.7	35	-176.2	-146.5	-84.2	0	0	0	115.3	S523 I524 I547 I563 L567	S523-F545 WeakPolarHBondContact O-CD2 3.45Å; S523-F545 PolarHBondContact OG-N 3.16Å; S523-F545 VanDerWaalsContact OG-N 3.16Å; I524-F545 HydrophobicContact CD1-CD2 4.11Å; I524-F545 HydrophobicContact CD1-CE2 4.41Å; I524-F545 HydrophobicContact CG1-CD2 3.41Å; I524-F545 VanDerWaalsContact CG1-CD2 3.41Å; I524-F545 HydrophobicContact CG1-CE2 3.72Å; I524-F545 HydrophobicContact CG1-CG 4.47Å; F545-I547 HydrophobicContact CE1-CD1 3.94Å; F545-I547 HydrophobicContact CZ-CD1 4.09Å; F545-I547 PolarHBondContact O-N 3.03Å; F545-I563 HydrophobicContact CZ-CG2 4.36Å; F545-L567 HydrophobicContact CE1-CD1 4.2Å; F545-L567 HydrophobicContact CE1-CD2 4.28Å; F545-L567 HydrophobicContact CE2-CD2 3.92Å; F545-L567 HydrophobicContact CZ-CD1 3.99Å; F545-L567 HydrophobicContact CZ-CD2 3.78Å; F545-L567 HydrophobicContact CZ-CG 4.18Å
546	H	60.1	Low	64.8	Low	162 Å²	162	96.7 Å²	96.7	75%	0.75	45%	0.448	S	S	*	.			trans	-88.2	91.3	173.2	-90.3	-74.7	0	0	0	109.6	K544	K544-H546 PolarHBondContact O-N 3.28Å
547	I	66.2	Low	66.1	Low	33 Å²	33	102.1 Å²	102.1	17%	0.169	48%	0.476	C	S	.	.			trans	-95.8	127.3	164	-62	173.4	0	0	0	106.6	L532 F545 E551 L552	L532-I547 HydrophobicContact CD1-CD1 4.04Å; L532-I547 HydrophobicContact CD2-CD1 3.94Å; F545-I547 HydrophobicContact CE1-CD1 3.94Å; F545-I547 HydrophobicContact CZ-CD1 4.09Å; F545-I547 PolarHBondContact O-N 3.03Å; I547-E551 WeakPolarHBondContact CA-OE2 3.35Å; I547-E551 HydrophobicContact CG2-CB 3.91Å; I547-L552 HydrophobicContact CG2-CB 4.34Å; I547-L552 HydrophobicContact CG2-CD1 4.27Å
548	S	71.8	Confident	67.7	Low	40 Å²	40	97.2 Å²	97.2	28%	0.28	46%	0.464	S	S	.	.			trans	-74	161.3	176.3	70.2	0	0	0	0	111.6	E550 E551 L552	S548-E550 PolarHBondContact O-N 3.31Å; S548-E551 VanDerWaalsContact CB-OE1 3.3Å; S548-E551 WeakPolarHBondContact CB-OE1 3.42Å; S548-E551 PolarHBondContact N-OE2 3.18Å; S548-E551 PolarHBondContact O-N 3.1Å; S548-E551 WeakPolarHBondContact OG-CG 3.35Å; S548-E551 PolarHBondContact OG-N 2.87Å; S548-E551 VanDerWaalsContact OG-N 3.15Å; S548-E551 PolarHBondContact OG-OE1 3.4Å; S548-L552 WeakPolarHBondContact O-CB 3.31Å; S548-L552 PolarHBondContact O-N 3.4Å
549	K	76.6	Confident	69.2	Low	146 Å²	146	97.7 Å²	97.7	64%	0.635	47%	0.465	S	S	*	.	H	α-helix	trans	-63.5	-34.3	176.4	-179.2	-168.4	174.8	-166.6	0	110.4	L552 I553	K549-L552 PolarHBondContact O-N 3.44Å; K549-I553 HydrophobicContact CG-CD1 4.16Å; K549-I553 WeakPolarHBondContact O-CD1 3.28Å; K549-I553 VanDerWaalsContact O-CG1 3.27Å; K549-I553 WeakPolarHBondContact O-CG1 3.49Å; K549-I553 PolarHBondContact O-N 3.27Å
550	E	75.6	Confident	70.9	Confident	119 Å²	119	88.5 Å²	88.5	56%	0.556	43%	0.434	S	S	*	.	H	α-helix	trans	-70.9	-31.5	-178.6	-64.8	60.2	-133.5	0	0	111.7	S548 Q554	S548-E550 PolarHBondContact O-N 3.31Å; E550-Q554 PolarHBondContact O-NE2 3.05Å
551	E	72.6	Confident	72.7	Confident	41 Å²	41	93.8 Å²	93.8	19%	0.192	46%	0.455	C	S	.	.	H	α-helix	trans	-73.6	-43.2	166.1	-68.9	148.9	-135.3	0	0	111.4	I536 L538 I547 S548 I553 Q554 F555	I536-E551 HydrophobicContact CD1-CB 4.24Å; I536-E551 WeakPolarHBondContact CD1-O 3.26Å; L538-E551 HydrophobicContact CD1-CB 4.3Å; L538-E551 HydrophobicContact CD1-CG 3.82Å; L538-E551 HydrophobicContact CD2-CG 4.06Å; I547-E551 WeakPolarHBondContact CA-OE2 3.35Å; I547-E551 HydrophobicContact CG2-CB 3.91Å; S548-E551 VanDerWaalsContact CB-OE1 3.3Å; S548-E551 WeakPolarHBondContact CB-OE1 3.42Å; S548-E551 PolarHBondContact N-OE2 3.18Å; S548-E551 PolarHBondContact O-N 3.1Å; S548-E551 WeakPolarHBondContact OG-CG 3.35Å; S548-E551 PolarHBondContact OG-N 2.87Å; S548-E551 VanDerWaalsContact OG-N 3.15Å; S548-E551 PolarHBondContact OG-OE1 3.4Å; E551-I553 VanDerWaalsContact C-N 3.26Å; E551-I553 PolarHBondContact O-N 2.82Å; E551-Q554 WeakPolarHBondContact O-CB 3.5Å; E551-Q554 PolarHBondContact O-N 3.23Å; E551-F555 WeakPolarHBondContact O-CD2 3.39Å
552	L	74.7	Confident	74.4	Confident	77 Å²	77	94.2 Å²	94.2	40%	0.403	46%	0.46	S	S	.	.	H	α-helix	trans	-61.5	-34.7	-176.7	-162.9	70.6	0	0	0	112.5	I547 S548 K549 Q554 F555 L560	I547-L552 HydrophobicContact CG2-CB 4.34Å; I547-L552 HydrophobicContact CG2-CD1 4.27Å; S548-L552 WeakPolarHBondContact O-CB 3.31Å; S548-L552 PolarHBondContact O-N 3.4Å; K549-L552 PolarHBondContact O-N 3.44Å; L552-Q554 PolarHBondContact O-N 3.43Å; L552-F555 PolarHBondContact O-N 2.92Å; L552-L560 HydrophobicContact CD1-CD2 3.5Å; L552-L560 HydrophobicContact CG-CD2 3.86Å
553	I	81.8	Confident	75.9	Confident	123 Å²	123	90.7 Å²	90.7	63%	0.631	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-23	176.1	-73.2	163	0	0	0	112.9	K549 E551 F555	K549-I553 HydrophobicContact CG-CD1 4.16Å; K549-I553 WeakPolarHBondContact O-CD1 3.28Å; K549-I553 VanDerWaalsContact O-CG1 3.27Å; K549-I553 WeakPolarHBondContact O-CG1 3.49Å; K549-I553 PolarHBondContact O-N 3.27Å; E551-I553 VanDerWaalsContact C-N 3.26Å; E551-I553 PolarHBondContact O-N 2.82Å; I553-F555 VanDerWaalsContact C-N 3.33Å
554	Q	80.6	Confident	77.6	Confident	123 Å²	123	86.6 Å²	86.6	58%	0.575	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-10.4	-178.6	-63.3	171.6	55.3	0	0	113.2	I536 E550 E551 L552	I536-Q554 HydrophobicContact CD1-CB 3.87Å; I536-Q554 HydrophobicContact CG1-CB 4.44Å; E550-Q554 PolarHBondContact O-NE2 3.05Å; E551-Q554 WeakPolarHBondContact O-CB 3.5Å; E551-Q554 PolarHBondContact O-N 3.23Å; L552-Q554 PolarHBondContact O-N 3.43Å
555	F	79.4	Confident	79.2	Confident	12 Å²	12	84 Å²	84	5%	0.053	43%	0.425	C	S	.	.	S	Bend	trans	-82.6	136.2	175.7	-69.7	-83.2	0	0	0	112	L531 L532 T535 I536 E551 L552 I553 Q559 L560 I563	L531-F555 HydrophobicContact CD2-CE1 4.39Å; L532-F555 HydrophobicContact CD2-CE1 3.9Å; L532-F555 HydrophobicContact CD2-CE2 4.05Å; L532-F555 HydrophobicContact CD2-CZ 3.3Å; T535-F555 HydrophobicContact CG2-CE1 4.34Å; T535-F555 WeakPolarHBondContact OG1-CE1 3.48Å; I536-F555 HydrophobicContact CD1-CD2 3.99Å; I536-F555 HydrophobicContact CD1-CE1 4.35Å; I536-F555 HydrophobicContact CD1-CE2 3.29Å; I536-F555 HydrophobicContact CD1-CZ 3.48Å; I536-F555 VanDerWaalsContact CD1-CZ 3.48Å; I536-F555 HydrophobicContact CG1-CE2 4.38Å; I536-F555 HydrophobicContact CG1-CZ 4.11Å; E551-F555 WeakPolarHBondContact O-CD2 3.39Å; L552-F555 PolarHBondContact O-N 2.92Å; I553-F555 VanDerWaalsContact C-N 3.33Å; F555-Q559 HydrophobicContact CB-CB 4.26Å; F555-Q559 HydrophobicContact CD1-CB 3.92Å; F555-L560 HydrophobicContact CB-CD2 3.69Å; F555-L560 HydrophobicContact CB-CG 3.73Å; F555-L560 HydrophobicContact CD2-CD2 4.49Å; F555-L560 HydrophobicContact CG-CD2 4.33Å; F555-I563 HydrophobicContact CD1-CD1 4.24Å; F555-I563 HydrophobicContact CE1-CD1 4.27Å; F555-I563 HydrophobicContact CG-CD1 4.46Å
556	S	84.8	Confident	80.4	Confident	57 Å²	57	82.9 Å²	82.9	40%	0.399	42%	0.422	S	S	.	.			trans	-67	152.9	168.6	65.8	0	0	0	0	111.4	P558 Q559 L560	S556-P558 VanDerWaalsContact C-CD 3.45Å; S556-P558 VanDerWaalsContact C-N 3.31Å; S556-Q559 WeakPolarHBondContact O-CB 3.28Å; S556-Q559 PolarHBondContact O-N 2.99Å; S556-Q559 WeakPolarHBondContact OG-CG 3.42Å; S556-Q559 PolarHBondContact OG-OE1 3.48Å; S556-L560 PolarHBondContact O-N 3.27Å
557	I	87.4	Confident	81.6	Confident	145 Å²	145	78 Å²	78	74%	0.744	40%	0.401	S	S	*	.	H	α-helix	trans	-51	-41.4	-179.4	-61.7	167.9	0	0	0	113	Q559 L560 K561	I557-Q559 PolarHBondContact O-N 2.78Å; I557-L560 PolarHBondContact O-N 2.75Å; I557-K561 PolarHBondContact O-N 3.45Å
558	P	86.4	Confident	82.7	Confident	92 Å²	92	81.3 Å²	81.3	60%	0.597	42%	0.416	S	S	*	.	H	α-helix	trans	-61.4	-39.1	174.2	-25.1	36	0	0	0	113.9	S556 K561 V562	S556-P558 VanDerWaalsContact C-CD 3.45Å; S556-P558 VanDerWaalsContact C-N 3.31Å; P558-K561 PolarHBondContact O-N 3.34Å; P558-V562 WeakPolarHBondContact O-CG2 3.46Å; P558-V562 PolarHBondContact O-N 3.42Å
559	Q	83.6	Confident	83.5	Confident	52 Å²	52	82.8 Å²	82.8	24%	0.243	43%	0.426	C	S	.	.	H	α-helix	trans	-69.6	-41.8	179.2	-66	162.7	-40.9	0	0	111.1	L531 F555 S556 I557 K561 V562 I563	L531-Q559 HydrophobicContact CD2-CB 4.44Å; L531-Q559 HydrophobicContact CD2-CG 4.11Å; F555-Q559 HydrophobicContact CB-CB 4.26Å; F555-Q559 HydrophobicContact CD1-CB 3.92Å; S556-Q559 WeakPolarHBondContact O-CB 3.28Å; S556-Q559 PolarHBondContact O-N 2.99Å; S556-Q559 WeakPolarHBondContact OG-CG 3.42Å; S556-Q559 PolarHBondContact OG-OE1 3.48Å; I557-Q559 PolarHBondContact O-N 2.78Å; Q559-K561 VanDerWaalsContact C-N 3.28Å; Q559-K561 PolarHBondContact O-N 2.93Å; Q559-V562 PolarHBondContact O-N 3.36Å; Q559-I563 WeakPolarHBondContact O-CG1 3.43Å; Q559-I563 PolarHBondContact O-N 3.34Å
560	L	86.4	Confident	83.9	Confident	61 Å²	61	78.4 Å²	78.4	32%	0.319	41%	0.405	S	S	.	.	H	α-helix	trans	-59	-39.6	172.2	-68.5	175	0	0	0	111.8	L552 F555 S556 I557 I563 M564	L552-L560 HydrophobicContact CD1-CD2 3.5Å; L552-L560 HydrophobicContact CG-CD2 3.86Å; F555-L560 HydrophobicContact CB-CD2 3.69Å; F555-L560 HydrophobicContact CB-CG 3.73Å; F555-L560 HydrophobicContact CD2-CD2 4.49Å; F555-L560 HydrophobicContact CG-CD2 4.33Å; S556-L560 PolarHBondContact O-N 3.27Å; I557-L560 PolarHBondContact O-N 2.75Å; L560-I563 PolarHBondContact O-N 2.86Å; L560-M564 WeakPolarHBondContact O-CB 3.47Å; L560-M564 PolarHBondContact O-N 2.96Å
561	K	88.1	Confident	84.5	Confident	139 Å²	139	77.2 Å²	77.2	60%	0.604	40%	0.402	S	S	*	.	H	α-helix	trans	-67.4	-36.1	176.1	-167.7	169.7	-176.1	175	0	112.8	I557 P558 Q559 N565	I557-K561 PolarHBondContact O-N 3.45Å; P558-K561 PolarHBondContact O-N 3.34Å; Q559-K561 VanDerWaalsContact C-N 3.28Å; Q559-K561 PolarHBondContact O-N 2.93Å; K561-N565 WeakPolarHBondContact O-CB 3.45Å; K561-N565 PolarHBondContact O-N 3.44Å; K561-N565 PolarHBondContact O-OD1 3.32Å
562	V	86.8	Confident	85.4	Confident	77 Å²	77	81.2 Å²	81.2	47%	0.467	42%	0.421	S	S	.	.	H	α-helix	trans	-63.7	-45	171.6	171	0	0	0	0	110.9	L531 P558 Q559 M564 N565 D566	L531-V562 HydrophobicContact CD1-CG1 4.12Å; P558-V562 WeakPolarHBondContact O-CG2 3.46Å; P558-V562 PolarHBondContact O-N 3.42Å; Q559-V562 PolarHBondContact O-N 3.36Å; V562-M564 PolarHBondContact O-N 3Å; V562-N565 PolarHBondContact O-N 3.36Å; V562-D566 PolarHBondContact O-N 2.99Å; V562-D566 VanDerWaalsContact O-N 3.08Å
563	I	83.1	Confident	86.1	Confident	10 Å²	10	80.9 Å²	80.9	5%	0.051	42%	0.424	C	S	.	.	H	α-helix	trans	-61.7	-45	177.5	-65.7	165.2	0	0	0	111.1	I528 L532 F545 F555 Q559 L560 N565 D566 L567	I528-I563 HydrophobicContact CD1-CB 4.26Å; I528-I563 HydrophobicContact CD1-CG1 4.1Å; I528-I563 HydrophobicContact CD1-CG2 4.36Å; I528-I563 HydrophobicContact CG1-CG1 4.48Å; L532-I563 HydrophobicContact CD2-CD1 4.23Å; F545-I563 HydrophobicContact CZ-CG2 4.36Å; F555-I563 HydrophobicContact CD1-CD1 4.24Å; F555-I563 HydrophobicContact CE1-CD1 4.27Å; F555-I563 HydrophobicContact CG-CD1 4.46Å; Q559-I563 WeakPolarHBondContact O-CG1 3.43Å; Q559-I563 PolarHBondContact O-N 3.34Å; L560-I563 PolarHBondContact O-N 2.86Å; I563-N565 PolarHBondContact O-N 2.91Å; I563-D566 PolarHBondContact O-N 2.88Å; I563-L567 HydrophobicContact CG2-CD1 4.03Å; I563-L567 WeakPolarHBondContact O-CB 3.49Å; I563-L567 WeakPolarHBondContact O-CG 3.37Å; I563-L567 PolarHBondContact O-N 2.76Å
564	M	86.6	Confident	86.4	Confident	107 Å²	107	78.3 Å²	78.3	53%	0.527	41%	0.412	S	S	.	.	H	α-helix	trans	-61.4	-42.7	177	-176.9	172.1	179	0	0	112.3	L560 V562 L567 H568	L560-M564 WeakPolarHBondContact O-CB 3.47Å; L560-M564 PolarHBondContact O-N 2.96Å; V562-M564 PolarHBondContact O-N 3Å; M564-L567 PolarHBondContact O-N 3.27Å; M564-H568 VanDerWaalsContact CE-NE2 3.28Å; M564-H568 WeakPolarHBondContact CE-NE2 3.47Å; M564-H568 PolarHBondContact O-CD2 2.85Å; M564-H568 PolarHBondContact O-N 3.01Å
565	N	90.1	Very high	86.9	Confident	87 Å²	87	76.9 Å²	76.9	47%	0.465	41%	0.408	S	S	.	.	H	α-helix	trans	-66.2	-40.7	179	-75.1	4.1	0	0	0	112.7	K561 V562 I563 H568 S569	K561-N565 WeakPolarHBondContact O-CB 3.45Å; K561-N565 PolarHBondContact O-N 3.44Å; K561-N565 PolarHBondContact O-OD1 3.32Å; V562-N565 PolarHBondContact O-N 3.36Å; I563-N565 PolarHBondContact O-N 2.91Å; N565-H568 PolarHBondContact O-N 2.88Å; N565-S569 WeakPolarHBondContact O-CB 3.44Å; N565-S569 PolarHBondContact O-N 2.93Å; N565-S569 PolarHBondContact O-OG 3.18Å
566	D	84.9	Confident	87.6	Confident	37 Å²	37	80.1 Å²	80.1	20%	0.198	43%	0.426	C	S	.	.	H	α-helix	trans	-65.4	-42.4	175.1	-167	90.3	0	0	0	111	T525 I528 V562 I563 H568 S569 R570	T525-D566 WeakPolarHBondContact CB-OD1 3.45Å; T525-D566 VanDerWaalsContact CB-OD2 3.25Å; T525-D566 WeakPolarHBondContact CB-OD2 3.27Å; T525-D566 WeakPolarHBondContact CG2-OD1 3.38Å; T525-D566 PolarHBondContact OG1-OD1 3.05Å; T525-D566 PolarHBondContact OG1-OD2 2.67Å; I528-D566 HydrophobicContact CD1-CB 3.33Å; I528-D566 HydrophobicContact CG1-CB 4.3Å; V562-D566 PolarHBondContact O-N 2.99Å; V562-D566 VanDerWaalsContact O-N 3.08Å; I563-D566 PolarHBondContact O-N 2.88Å; D566-H568 PolarHBondContact O-N 2.73Å; D566-S569 PolarHBondContact O-N 2.73Å; D566-R570 VanDerWaalsContact O-CB 3.22Å; D566-R570 WeakPolarHBondContact O-CB 3.16Å; D566-R570 PolarHBondContact O-N 2.71Å
567	L	85.4	Confident	87.8	Confident	59 Å²	59	80.5 Å²	80.5	31%	0.309	43%	0.429	S	S	.	.	H	α-helix	trans	-60.8	-44.4	175.4	-75.1	173	0	0	0	112.1	F545 I563 M564 R570 I571	F545-L567 HydrophobicContact CE1-CD1 4.2Å; F545-L567 HydrophobicContact CE1-CD2 4.28Å; F545-L567 HydrophobicContact CE2-CD2 3.92Å; F545-L567 HydrophobicContact CZ-CD1 3.99Å; F545-L567 HydrophobicContact CZ-CD2 3.78Å; F545-L567 HydrophobicContact CZ-CG 4.18Å; I563-L567 HydrophobicContact CG2-CD1 4.03Å; I563-L567 WeakPolarHBondContact O-CB 3.49Å; I563-L567 WeakPolarHBondContact O-CG 3.37Å; I563-L567 PolarHBondContact O-N 2.76Å; M564-L567 PolarHBondContact O-N 3.27Å; L567-R570 PolarHBondContact O-N 2.9Å; L567-I571 WeakPolarHBondContact O-CB 3.34Å; L567-I571 WeakPolarHBondContact O-CD1 3.38Å; L567-I571 VanDerWaalsContact O-CG1 3.24Å; L567-I571 WeakPolarHBondContact O-CG1 3.49Å; L567-I571 PolarHBondContact O-N 2.86Å
568	H	89.6	Confident	88.1	Confident	104 Å²	104	78.5 Å²	78.5	48%	0.481	42%	0.419	S	S	.	.	H	α-helix	trans	-60.9	-49.5	173.2	-77.7	-60.8	0	0	0	112	M564 N565 D566 R570 I571 E572	M564-H568 VanDerWaalsContact CE-NE2 3.28Å; M564-H568 WeakPolarHBondContact CE-NE2 3.47Å; M564-H568 PolarHBondContact O-CD2 2.85Å; M564-H568 PolarHBondContact O-N 3.01Å; N565-H568 PolarHBondContact O-N 2.88Å; D566-H568 PolarHBondContact O-N 2.73Å; H568-R570 PolarHBondContact O-N 3.3Å; H568-I571 PolarHBondContact O-N 3.21Å; H568-E572 PolarHBondContact O-N 2.64Å
569	S	88.8	Confident	88.5	Confident	71 Å²	71	78.7 Å²	78.7	50%	0.497	41%	0.413	S	S	.	.	H	α-helix	trans	-58.6	-35.6	177.8	-53.5	0	0	0	0	111.9	N565 D566 S573	N565-S569 WeakPolarHBondContact O-CB 3.44Å; N565-S569 PolarHBondContact O-N 2.93Å; N565-S569 PolarHBondContact O-OG 3.18Å; D566-S569 PolarHBondContact O-N 2.73Å; S569-S573 VanDerWaalsContact O-CB 3.24Å; S569-S573 WeakPolarHBondContact O-CB 3.41Å; S569-S573 PolarHBondContact O-N 3.48Å
570	R	85.4	Confident	89	Confident	54 Å²	54	81.5 Å²	81.5	20%	0.204	43%	0.429	C	S	.	.	H	α-helix	trans	-77.2	-37.4	179.4	-173.7	58.6	-179.5	-70.9	-4.6	112.8	S522 D566 L567 H568 E572 S573 L574	S522-R570 VanDerWaalsContact O-CZ 3.24Å; S522-R570 PolarHBondContact O-NH1 3.29Å; S522-R570 PolarHBondContact O-NH2 3.43Å; D566-R570 VanDerWaalsContact O-CB 3.22Å; D566-R570 WeakPolarHBondContact O-CB 3.16Å; D566-R570 PolarHBondContact O-N 2.71Å; L567-R570 PolarHBondContact O-N 2.9Å; H568-R570 PolarHBondContact O-N 3.3Å; R570-E572 VanDerWaalsContact C-N 3.34Å; R570-S573 PolarHBondContact O-N 2.96Å; R570-L574 HydrophobicContact CG-CD1 4.03Å; R570-L574 HydrophobicContact CG-CG 4.38Å; R570-L574 WeakPolarHBondContact O-CB 3.11Å; R570-L574 VanDerWaalsContact O-CG 3.23Å; R570-L574 WeakPolarHBondContact O-CG 3.21Å; R570-L574 PolarHBondContact O-N 2.84Å
571	I	88.3	Confident	89.1	Confident	94 Å²	94	81.6 Å²	81.6	48%	0.482	44%	0.435	S	S	.	.	H	α-helix	trans	-61.7	-45.6	171.7	-71.2	162.4	0	0	0	109.7	L567 H568 L574 N575	L567-I571 WeakPolarHBondContact O-CB 3.34Å; L567-I571 WeakPolarHBondContact O-CD1 3.38Å; L567-I571 VanDerWaalsContact O-CG1 3.24Å; L567-I571 WeakPolarHBondContact O-CG1 3.49Å; L567-I571 PolarHBondContact O-N 2.86Å; H568-I571 PolarHBondContact O-N 3.21Å; I571-L574 PolarHBondContact O-N 3.28Å; I571-N575 WeakPolarHBondContact O-CB 3.18Å; I571-N575 PolarHBondContact O-N 2.81Å; I571-N575 PolarHBondContact O-ND2 3.31Å
572	E	91.5	Very high	89.3	Confident	125 Å²	125	78.2 Å²	78.2	58%	0.584	42%	0.423	S	S	*	.	H	α-helix	trans	-62	-47.5	175.8	-174.2	176.1	-178.5	0	0	111.9	H568 R570 L574 N575 N576	H568-E572 PolarHBondContact O-N 2.64Å; R570-E572 VanDerWaalsContact C-N 3.34Å; E572-L574 PolarHBondContact O-N 3.05Å; E572-N575 PolarHBondContact O-N 3.4Å; E572-N576 WeakPolarHBondContact O-CB 3.43Å; E572-N576 PolarHBondContact O-N 2.94Å; E572-N576 PolarHBondContact O-ND2 3.38Å
573	S	89.1	Confident	89.5	Confident	69 Å²	69	77.8 Å²	77.8	48%	0.483	42%	0.421	S	S	.	.	H	α-helix	trans	-58.5	-43.8	175.8	175.5	0	0	0	0	113	S569 R570 N576 S577	S569-S573 VanDerWaalsContact O-CB 3.24Å; S569-S573 WeakPolarHBondContact O-CB 3.41Å; S569-S573 PolarHBondContact O-N 3.48Å; R570-S573 PolarHBondContact O-N 2.96Å; S573-N576 PolarHBondContact O-N 2.58Å; S573-S577 WeakPolarHBondContact O-CB 3.47Å; S573-S577 PolarHBondContact O-N 3.22Å
574	L	87.6	Confident	89.9	Confident	69 Å²	69	82.7 Å²	82.7	36%	0.361	44%	0.443	S	S	.	.	H	α-helix	trans	-69.9	-37.8	177.8	-72.2	171.4	0	0	0	112.2	I521 R570 I571 E572 S577 L578	I521-L574 HydrophobicContact CG2-CD2 4.36Å; R570-L574 HydrophobicContact CG-CD1 4.03Å; R570-L574 HydrophobicContact CG-CG 4.38Å; R570-L574 WeakPolarHBondContact O-CB 3.11Å; R570-L574 VanDerWaalsContact O-CG 3.23Å; R570-L574 WeakPolarHBondContact O-CG 3.21Å; R570-L574 PolarHBondContact O-N 2.84Å; I571-L574 PolarHBondContact O-N 3.28Å; E572-L574 PolarHBondContact O-N 3.05Å; L574-S577 PolarHBondContact O-N 3.11Å; L574-L578 VanDerWaalsContact O-CB 3.29Å; L574-L578 WeakPolarHBondContact O-CB 3.48Å; L574-L578 PolarHBondContact O-N 3.09Å
575	N	92.2	Very high	90	Very high	94 Å²	94	82.5 Å²	82.5	50%	0.503	44%	0.436	S	S	.	.	H	α-helix	trans	-64.6	-42.1	174.6	-73.4	-17	0	0	0	111.6	I571 E572 L578 M579	I571-N575 WeakPolarHBondContact O-CB 3.18Å; I571-N575 PolarHBondContact O-N 2.81Å; I571-N575 PolarHBondContact O-ND2 3.31Å; E572-N575 PolarHBondContact O-N 3.4Å; N575-L578 PolarHBondContact O-N 3.31Å; N575-M579 WeakPolarHBondContact O-CB 3.49Å; N575-M579 PolarHBondContact O-N 2.93Å
576	N	92.7	Very high	90	Very high	79 Å²	79	82.1 Å²	82.1	42%	0.422	43%	0.434	S	S	.	.	H	α-helix	trans	-65.7	-41.8	175.5	-72.9	-27.4	0	0	0	111.6	E572 S573 M579 L580	E572-N576 WeakPolarHBondContact O-CB 3.43Å; E572-N576 PolarHBondContact O-N 2.94Å; E572-N576 PolarHBondContact O-ND2 3.38Å; S573-N576 PolarHBondContact O-N 2.58Å; N576-M579 PolarHBondContact O-N 3.42Å; N576-L580 WeakPolarHBondContact O-CG 3.4Å; N576-L580 PolarHBondContact O-N 3.03Å
577	S	90.1	Very high	90.3	Very high	66 Å²	66	86.5 Å²	86.5	46%	0.462	45%	0.454	S	S	.	.	H	α-helix	trans	-62.4	-43.2	173.8	-168.4	0	0	0	0	112.2	S573 L574 L580 S581	S573-S577 WeakPolarHBondContact O-CB 3.47Å; S573-S577 PolarHBondContact O-N 3.22Å; L574-S577 PolarHBondContact O-N 3.11Å; S577-L580 PolarHBondContact O-N 3.02Å; S577-S581 PolarHBondContact O-N 3.34Å; S577-S581 PolarHBondContact O-OG 3.09Å
578	L	92.6	Very high	90.4	Very high	103 Å²	103	88.2 Å²	88.2	54%	0.539	46%	0.463	S	S	.	.	H	α-helix	trans	-63.4	-42.1	176.7	175.1	61.9	0	0	0	111.5	L574 N575 S581 L582	L574-L578 VanDerWaalsContact O-CB 3.29Å; L574-L578 WeakPolarHBondContact O-CB 3.48Å; L574-L578 PolarHBondContact O-N 3.09Å; N575-L578 PolarHBondContact O-N 3.31Å; L578-S581 PolarHBondContact O-N 3.13Å; L578-L582 HydrophobicContact CD1-CD1 4.03Å; L578-L582 HydrophobicContact CD1-CG 4.16Å; L578-L582 HydrophobicContact CG-CD1 3.97Å; L578-L582 WeakPolarHBondContact O-CB 3.41Å; L578-L582 WeakPolarHBondContact O-CG 3.5Å; L578-L582 PolarHBondContact O-N 3.19Å
579	M	95.6	Very high	90.1	Very high	95 Å²	95	87.2 Å²	87.2	47%	0.468	46%	0.458	S	S	.	.	H	α-helix	trans	-61.4	-45.6	176.4	178	-85.7	-67.1	0	0	111.4	N575 N576 L582 V583	N575-M579 WeakPolarHBondContact O-CB 3.49Å; N575-M579 PolarHBondContact O-N 2.93Å; N576-M579 PolarHBondContact O-N 3.42Å; M579-L582 PolarHBondContact O-N 3.25Å; M579-V583 WeakPolarHBondContact O-CG2 3.28Å; M579-V583 PolarHBondContact O-N 3.4Å; M579-V583 HydrophobicContact SD-CG2 4.32Å
580	L	94.1	Very high	90	Very high	111 Å²	111	88.2 Å²	88.2	58%	0.581	46%	0.457	S	S	*	.	H	α-helix	trans	-61.6	-48.3	176.2	-70	170	0	0	0	112.2	N576 S577 L582 V583 E584	N576-L580 WeakPolarHBondContact O-CG 3.4Å; N576-L580 PolarHBondContact O-N 3.03Å; S577-L580 PolarHBondContact O-N 3.02Å; L580-L582 VanDerWaalsContact C-N 3.25Å; L580-L582 PolarHBondContact O-N 3.48Å; L580-V583 PolarHBondContact O-N 2.96Å; L580-V583 VanDerWaalsContact O-N 3.14Å; L580-E584 WeakPolarHBondContact O-CB 3.33Å; L580-E584 PolarHBondContact O-N 3.05Å
581	S	88.6	Confident	90.1	Very high	63 Å²	63	90.5 Å²	90.5	44%	0.441	47%	0.47	S	S	.	.	H	α-helix	trans	-66.8	-23.6	177.9	-60.2	0	0	0	0	113.7	S577 L578 R585	S577-S581 PolarHBondContact O-N 3.34Å; S577-S581 PolarHBondContact O-OG 3.09Å; L578-S581 PolarHBondContact O-N 3.13Å; S581-R585 VanDerWaalsContact O-CB 3.28Å; S581-R585 WeakPolarHBondContact O-CB 3.41Å; S581-R585 PolarHBondContact O-N 2.94Å; S581-R585 VanDerWaalsContact O-N 3.12Å
582	L	91.4	Very high	90	Very high	68 Å²	68	89.8 Å²	89.8	36%	0.356	47%	0.465	S	S	.	.	H	α-helix	trans	-75.5	-37	171.4	-74.9	169.7	0	0	0	112.2	L578 M579 L580 R585 D586	L578-L582 HydrophobicContact CD1-CD1 4.03Å; L578-L582 HydrophobicContact CD1-CG 4.16Å; L578-L582 HydrophobicContact CG-CD1 3.97Å; L578-L582 WeakPolarHBondContact O-CB 3.41Å; L578-L582 WeakPolarHBondContact O-CG 3.5Å; L578-L582 PolarHBondContact O-N 3.19Å; M579-L582 PolarHBondContact O-N 3.25Å; L580-L582 VanDerWaalsContact C-N 3.25Å; L580-L582 PolarHBondContact O-N 3.48Å; L582-R585 VanDerWaalsContact CD2-NH1 3.34Å; L582-D586 PolarHBondContact O-N 3.26Å; L582-D586 VanDerWaalsContact O-N 3.16Å
583	V	92.7	Very high	89.6	Confident	69 Å²	69	85.3 Å²	85.3	42%	0.418	45%	0.452	S	S	.	.	H	α-helix	trans	-65.7	-49.9	172.8	172	0	0	0	0	110.4	M579 L580 R585 D586 E587	M579-V583 WeakPolarHBondContact O-CG2 3.28Å; M579-V583 PolarHBondContact O-N 3.4Å; M579-V583 HydrophobicContact SD-CG2 4.32Å; L580-V583 PolarHBondContact O-N 2.96Å; L580-V583 VanDerWaalsContact O-N 3.14Å; V583-R585 VanDerWaalsContact C-N 3.31Å; V583-R585 PolarHBondContact O-N 2.99Å; V583-D586 PolarHBondContact O-N 2.95Å; V583-E587 HydrophobicContact CG1-CG 4.4Å; V583-E587 WeakPolarHBondContact O-CG 3.31Å; V583-E587 PolarHBondContact O-N 2.92Å
584	E	91.7	Very high	89.4	Confident	113 Å²	113	82.5 Å²	82.5	53%	0.528	43%	0.434	S	S	.	.	H	α-helix	trans	-55.9	-43.7	176.8	-179.4	179.2	-160.8	0	0	112	L580 D586 E587 L588	L580-E584 WeakPolarHBondContact O-CB 3.33Å; L580-E584 PolarHBondContact O-N 3.05Å; E584-D586 VanDerWaalsContact C-N 3.33Å; E584-D586 PolarHBondContact O-N 2.91Å; E584-E587 PolarHBondContact O-N 3.33Å; E584-L588 HydrophobicContact CG-CD1 4.1Å; E584-L588 WeakPolarHBondContact O-CB 3.44Å; E584-L588 VanDerWaalsContact O-CG 3.26Å; E584-L588 WeakPolarHBondContact O-CG 3.47Å; E584-L588 PolarHBondContact O-N 3.44Å
585	R	88.3	Confident	89.5	Confident	102 Å²	102	85 Å²	85	39%	0.385	44%	0.442	S	S	.	.	H	α-helix	trans	-58.5	-43.3	173.7	-177.6	-155.6	68.7	-171.8	-3.9	112.2	S581 L582 V583 L588 H589	S581-R585 VanDerWaalsContact O-CB 3.28Å; S581-R585 WeakPolarHBondContact O-CB 3.41Å; S581-R585 PolarHBondContact O-N 2.94Å; S581-R585 VanDerWaalsContact O-N 3.12Å; L582-R585 VanDerWaalsContact CD2-NH1 3.34Å; V583-R585 VanDerWaalsContact C-N 3.31Å; V583-R585 PolarHBondContact O-N 2.99Å; R585-L588 PolarHBondContact O-N 3.24Å; R585-H589 PolarHBondContact O-CD2 3.25Å; R585-H589 VanDerWaalsContact O-CD2 3.27Å; R585-H589 PolarHBondContact O-N 3.41Å
586	D	89.2	Confident	89.2	Confident	79 Å²	79	82.6 Å²	82.6	42%	0.422	43%	0.429	S	S	.	.	H	α-helix	trans	-75.1	-33.2	-176.5	-71.8	0	0	0	0	111.8	L582 V583 E584 H589 L590	L582-D586 PolarHBondContact O-N 3.26Å; L582-D586 VanDerWaalsContact O-N 3.16Å; V583-D586 PolarHBondContact O-N 2.95Å; E584-D586 VanDerWaalsContact C-N 3.33Å; E584-D586 PolarHBondContact O-N 2.91Å; D586-H589 PolarHBondContact O-N 2.95Å; D586-L590 PolarHBondContact O-N 2.99Å
587	E	91.5	Very high	89	Confident	129 Å²	129	80.7 Å²	80.7	60%	0.603	42%	0.419	S	S	*	.	H	α-helix	trans	-63.2	-46.4	168.5	-71.4	179.1	180	0	0	111.6	V583 E584 H589 L590 E591	V583-E587 HydrophobicContact CG1-CG 4.4Å; V583-E587 WeakPolarHBondContact O-CG 3.31Å; V583-E587 PolarHBondContact O-N 2.92Å; E584-E587 PolarHBondContact O-N 3.33Å; E587-H589 PolarHBondContact O-N 2.79Å; E587-L590 WeakPolarHBondContact O-CB 3.47Å; E587-L590 PolarHBondContact O-N 3Å; E587-E591 PolarHBondContact O-N 2.9Å
588	L	87.5	Confident	89	Confident	96 Å²	96	80 Å²	80	50%	0.503	42%	0.417	S	S	.	.	H	α-helix	trans	-64.7	-36.5	176.6	-71.8	169.8	0	0	0	112.5	E584 R585 E591 Q592	E584-L588 HydrophobicContact CG-CD1 4.1Å; E584-L588 WeakPolarHBondContact O-CB 3.44Å; E584-L588 VanDerWaalsContact O-CG 3.26Å; E584-L588 WeakPolarHBondContact O-CG 3.47Å; E584-L588 PolarHBondContact O-N 3.44Å; R585-L588 PolarHBondContact O-N 3.24Å; L588-E591 PolarHBondContact O-N 3Å; L588-Q592 VanDerWaalsContact O-CB 3.3Å; L588-Q592 WeakPolarHBondContact O-CB 3.28Å; L588-Q592 PolarHBondContact O-N 2.91Å
589	H	83.7	Confident	88.8	Confident	82 Å²	82	76.2 Å²	76.2	38%	0.38	40%	0.397	S	S	.	.	H	α-helix	trans	-66.2	-36.7	172.2	-80.1	-46.4	0	0	0	112.6	R585 D586 E587 Q592 G593	R585-H589 PolarHBondContact O-CD2 3.25Å; R585-H589 VanDerWaalsContact O-CD2 3.27Å; R585-H589 PolarHBondContact O-N 3.41Å; D586-H589 PolarHBondContact O-N 2.95Å; E587-H589 PolarHBondContact O-N 2.79Å; H589-Q592 PolarHBondContact ND1-OE1 2.97Å; H589-G593 PolarHBondContact O-N 2.99Å
590	L	85.6	Confident	88.5	Confident	92 Å²	92	75 Å²	75	48%	0.482	39%	0.391	S	S	.	.	H	α-helix	trans	-66.4	-43.5	174	-178.5	61.9	0	0	0	111.4	D586 E587 G593 G594	D586-L590 PolarHBondContact O-N 2.99Å; E587-L590 WeakPolarHBondContact O-CB 3.47Å; E587-L590 PolarHBondContact O-N 3Å; L590-G593 PolarHBondContact O-N 3.42Å; L590-G594 PolarHBondContact O-N 3.4Å
591	E	87.6	Confident	88.3	Confident	102 Å²	102	72.2 Å²	72.2	48%	0.477	38%	0.376	S	S	.	.	H	α-helix	trans	-63.2	-42	175.8	-158.3	-150.4	-179.2	0	0	111.6	E587 L588 G594 K595	E587-E591 PolarHBondContact O-N 2.9Å; L588-E591 PolarHBondContact O-N 3Å; E591-G594 PolarHBondContact O-N 2.94Å; E591-K595 VanDerWaalsContact CD-CE 3.43Å; E591-K595 WeakPolarHBondContact O-CG 3.39Å; E591-K595 PolarHBondContact O-N 2.81Å; E591-K595 WeakPolarHBondContact OE1-CE 3.45Å; E591-K595 IonicContact OE1-NZ 3.51Å; E591-K595 PolarHBondContact OE1-NZ 3.37Å; E591-K595 IonicContact OE2-NZ 2.9Å; E591-K595 PolarHBondContact OE2-NZ 3.32Å
592	Q	86.1	Confident	88.4	Confident	79 Å²	79	73 Å²	73	37%	0.369	38%	0.375	S	S	.	.	H	α-helix	trans	-59	-46.3	173.8	-172.1	-167.5	3.1	0	0	111.5	S450 L588 H589 G594 K595 L596	S450-Q592 PolarHBondContact OG-NE2 3.09Å; L588-Q592 VanDerWaalsContact O-CB 3.3Å; L588-Q592 WeakPolarHBondContact O-CB 3.28Å; L588-Q592 PolarHBondContact O-N 2.91Å; H589-Q592 PolarHBondContact ND1-OE1 2.97Å; Q592-G594 PolarHBondContact O-N 3.49Å; Q592-K595 PolarHBondContact O-N 2.65Å; Q592-L596 PolarHBondContact O-N 3.25Å
593	G	83.3	Confident	88.4	Confident	31 Å²	31	72.2 Å²	72.2	32%	0.32	37%	0.368	S	S	.	.	H	α-helix	trans	-61	-42.3	176.1	0	0	0	0	0	112.5	H589 L590 L596 I597	H589-G593 PolarHBondContact O-N 2.99Å; L590-G593 PolarHBondContact O-N 3.42Å; G593-L596 PolarHBondContact O-N 3.4Å; G593-I597 WeakPolarHBondContact O-CG1 3.37Å; G593-I597 PolarHBondContact O-N 3.1Å
594	G	86.4	Confident	88.3	Confident	10 Å²	10	71.5 Å²	71.5	10%	0.103	37%	0.367	C	S	.	.	H	α-helix	trans	-61.2	-43.7	175.2	0	0	0	0	0	113.3	L590 E591 Q592 L596 I597 A598	L590-G594 PolarHBondContact O-N 3.4Å; E591-G594 PolarHBondContact O-N 2.94Å; Q592-G594 PolarHBondContact O-N 3.49Å; G594-L596 PolarHBondContact O-N 2.9Å; G594-I597 PolarHBondContact O-N 3.25Å; G594-A598 PolarHBondContact O-N 3.49Å
595	K	87.9	Confident	88.3	Confident	121 Å²	121	73.7 Å²	73.7	53%	0.526	37%	0.37	S	S	.	.	H	α-helix	trans	-62.6	-39.8	175.3	-72.1	166.8	-179	166.9	0	112.3	E591 Q592 A598 L599	E591-K595 VanDerWaalsContact CD-CE 3.43Å; E591-K595 WeakPolarHBondContact O-CG 3.39Å; E591-K595 PolarHBondContact O-N 2.81Å; E591-K595 WeakPolarHBondContact OE1-CE 3.45Å; E591-K595 IonicContact OE1-NZ 3.51Å; E591-K595 PolarHBondContact OE1-NZ 3.37Å; E591-K595 IonicContact OE2-NZ 2.9Å; E591-K595 PolarHBondContact OE2-NZ 3.32Å; Q592-K595 PolarHBondContact O-N 2.65Å; K595-A598 PolarHBondContact O-N 2.93Å; K595-L599 PolarHBondContact O-N 3.4Å
596	L	87.5	Confident	88.4	Confident	44 Å²	44	68.9 Å²	68.9	23%	0.23	35%	0.352	C	S	.	.	H	α-helix	trans	-66	-44.5	177.3	-169.2	68.9	0	0	0	111.7	L454 L457 Q592 G593 G594 A598 L599 E600	L454-L596 HydrophobicContact CD1-CD1 4.28Å; L457-L596 HydrophobicContact CD2-CD1 3.59Å; L457-L596 HydrophobicContact CD2-CG 4.46Å; Q592-L596 PolarHBondContact O-N 3.25Å; G593-L596 PolarHBondContact O-N 3.4Å; G594-L596 PolarHBondContact O-N 2.9Å; L596-A598 PolarHBondContact O-N 3.09Å; L596-L599 PolarHBondContact O-N 3.28Å; L596-L599 VanDerWaalsContact O-N 3.15Å; L596-E600 PolarHBondContact O-N 2.95Å
597	I	88.1	Confident	88.5	Confident	39 Å²	39	69.3 Å²	69.3	20%	0.2	35%	0.35	C	S	.	.	H	α-helix	trans	-59.8	-44.1	176.2	-69.5	166	0	0	0	111.2	K239 A243 G593 G594 L599 E600 D601	K239-I597 HydrophobicContact CB-CG2 3.63Å; K239-I597 HydrophobicContact CD-CG2 4.21Å; A243-I597 HydrophobicContact CB-CD1 4.41Å; G593-I597 WeakPolarHBondContact O-CG1 3.37Å; G593-I597 PolarHBondContact O-N 3.1Å; G594-I597 PolarHBondContact O-N 3.25Å; I597-L599 VanDerWaalsContact C-N 3.26Å; I597-L599 PolarHBondContact O-N 3.32Å; I597-E600 PolarHBondContact O-N 3.07Å; I597-D601 PolarHBondContact O-N 3.18Å
598	A	89.1	Confident	88.4	Confident	52 Å²	52	66.7 Å²	66.7	43%	0.43	34%	0.338	S	S	.	.	H	α-helix	trans	-60.2	-37.4	176.7	0	0	0	0	0	112.2	G594 K595 L596 D601 I602	G594-A598 PolarHBondContact O-N 3.49Å; K595-A598 PolarHBondContact O-N 2.93Å; L596-A598 PolarHBondContact O-N 3.09Å; A598-D601 PolarHBondContact O-N 3.22Å; A598-I602 VanDerWaalsContact O-CG1 3.3Å; A598-I602 WeakPolarHBondContact O-CG1 3.49Å; A598-I602 PolarHBondContact O-N 3.01Å
599	L	88.7	Confident	88.3	Confident	24 Å²	24	63.5 Å²	63.5	13%	0.126	32%	0.321	C	S	.	.	H	α-helix	trans	-74	-33.6	176.9	-170.1	62.3	0	0	0	112.8	L454 L457 L458 I461 K595 L596 I597 I602 K603	L454-L599 HydrophobicContact CD1-CD2 3.4Å; L454-L599 VanDerWaalsContact CD1-CD2 3.4Å; L457-L599 HydrophobicContact CD2-CB 4.03Å; L457-L599 HydrophobicContact CD2-CD2 3.69Å; L457-L599 HydrophobicContact CD2-CG 3.77Å; L457-L599 HydrophobicContact CG-CD2 3.93Å; L457-L599 HydrophobicContact CG-CG 3.99Å; L458-L599 HydrophobicContact CD2-CD1 4.24Å; L458-L599 HydrophobicContact CD2-CD2 3.83Å; L458-L599 HydrophobicContact CG-CD2 4.19Å; I461-L599 HydrophobicContact CD1-CD1 3.44Å; I461-L599 VanDerWaalsContact CD1-CD1 3.44Å; I461-L599 HydrophobicContact CD1-CD2 4.48Å; I461-L599 HydrophobicContact CD1-CG 3.72Å; K595-L599 PolarHBondContact O-N 3.4Å; L596-L599 PolarHBondContact O-N 3.28Å; L596-L599 VanDerWaalsContact O-N 3.15Å; I597-L599 VanDerWaalsContact C-N 3.26Å; I597-L599 PolarHBondContact O-N 3.32Å; L599-I602 PolarHBondContact O-N 3.41Å; L599-K603 WeakPolarHBondContact O-CB 3.31Å; L599-K603 PolarHBondContact O-N 2.91Å
600	E	89.5	Confident	88.4	Confident	70 Å²	70	60.2 Å²	60.2	33%	0.327	31%	0.306	S	S	.	.	H	α-helix	trans	-64.7	-38.1	169.4	-74.7	-175	-173.9	0	0	112.8	L457 L596 I597 K603 S604	L457-E600 HydrophobicContact CD1-CG 4.5Å; L457-E600 HydrophobicContact CD2-CG 4.19Å; L596-E600 PolarHBondContact O-N 2.95Å; I597-E600 PolarHBondContact O-N 3.07Å; E600-K603 WeakPolarHBondContact O-CB 3.33Å; E600-K603 PolarHBondContact O-N 2.9Å; E600-S604 WeakPolarHBondContact O-CB 3.41Å; E600-S604 PolarHBondContact O-N 3.1Å; E600-S604 PolarHBondContact O-OG 2.96Å
601	D	90	Very high	88.5	Confident	52 Å²	52	59.9 Å²	59.9	28%	0.278	30%	0.304	S	S	.	.	H	α-helix	trans	-70.6	-38.1	177	-73.2	-16.4	0	0	0	110.8	K239 I597 A598 S604 W605	K239-D601 WeakPolarHBondContact CD-OD1 3.44Å; K239-D601 WeakPolarHBondContact CE-OD1 3.41Å; K239-D601 IonicContact NZ-OD1 2.81Å; K239-D601 PolarHBondContact NZ-OD1 3.49Å; I597-D601 PolarHBondContact O-N 3.18Å; A598-D601 PolarHBondContact O-N 3.22Å; D601-S604 PolarHBondContact O-N 3.38Å; D601-W605 PolarHBondContact O-N 3.26Å
602	I	89.9	Confident	88.3	Confident	80 Å²	80	60.9 Å²	60.9	41%	0.41	30%	0.304	S	S	.	.	H	α-helix	trans	-59.9	-49.4	168.6	-71.9	165.7	0	0	0	111.2	A598 L599 S604 W605 I606	A598-I602 VanDerWaalsContact O-CG1 3.3Å; A598-I602 WeakPolarHBondContact O-CG1 3.49Å; A598-I602 PolarHBondContact O-N 3.01Å; L599-I602 PolarHBondContact O-N 3.41Å; I602-S604 VanDerWaalsContact C-N 3.27Å; I602-S604 PolarHBondContact O-N 2.89Å; I602-W605 PolarHBondContact O-N 3.49Å; I602-I606 HydrophobicContact CG2-CD1 3.62Å; I602-I606 HydrophobicContact CG2-CG1 4.38Å; I602-I606 VanDerWaalsContact O-CG1 3.31Å; I602-I606 WeakPolarHBondContact O-CG1 3.47Å; I602-I606 PolarHBondContact O-N 3.35Å
603	K	91.8	Very high	88	Confident	50 Å²	50	57.1 Å²	57.1	22%	0.217	29%	0.286	C	S	.	.	H	α-helix	trans	-53.1	-46.3	173.6	166.4	-179.7	143.2	175	0	111.4	L457 E460 I461 Y464 L599 E600 W605 I606 K607	L457-K603 HydrophobicContact CD1-CB 4Å; L457-K603 HydrophobicContact CD1-CD 3.31Å; L457-K603 HydrophobicContact CD1-CG 4.25Å; E460-K603 VanDerWaalsContact CD-CE 3.44Å; E460-K603 WeakPolarHBondContact OE1-CE 3.4Å; E460-K603 IonicContact OE1-NZ 2.7Å; E460-K603 PolarHBondContact OE1-NZ 3.47Å; E460-K603 WeakPolarHBondContact OE2-CE 3.45Å; E460-K603 IonicContact OE2-NZ 3.94Å; E460-K603 PolarHBondContact OE2-NZ 3.4Å; I461-K603 HydrophobicContact CD1-CB 4Å; I461-K603 HydrophobicContact CG1-CB 3.66Å; I461-K603 HydrophobicContact CG1-CG 4.24Å; Y464-K603 HydrophobicContact CD2-CG 4.49Å; Y464-K603 HydrophobicContact CE2-CG 4.1Å; L599-K603 WeakPolarHBondContact O-CB 3.31Å; L599-K603 PolarHBondContact O-N 2.91Å; E600-K603 WeakPolarHBondContact O-CB 3.33Å; E600-K603 PolarHBondContact O-N 2.9Å; K603-W605 VanDerWaalsContact C-N 3.35Å; K603-W605 PolarHBondContact O-N 2.9Å; K603-I606 PolarHBondContact O-N 3.31Å; K603-K607 VanDerWaalsContact O-CB 3.24Å; K603-K607 WeakPolarHBondContact O-CB 3.47Å; K603-K607 PolarHBondContact O-N 3.17Å
604	S	91.4	Very high	88	Confident	55 Å²	55	58.6 Å²	58.6	39%	0.385	29%	0.291	S	S	.	.	H	α-helix	trans	-63.5	-41.4	-178.3	-57.9	0	0	0	0	111.4	E600 D601 I602 E608	E600-S604 WeakPolarHBondContact O-CB 3.41Å; E600-S604 PolarHBondContact O-N 3.1Å; E600-S604 PolarHBondContact O-OG 2.96Å; D601-S604 PolarHBondContact O-N 3.38Å; I602-S604 VanDerWaalsContact C-N 3.27Å; I602-S604 PolarHBondContact O-N 2.89Å; S604-E608 WeakPolarHBondContact O-CB 3.4Å; S604-E608 PolarHBondContact O-N 3.1Å
605	W	91	Very high	87.8	Confident	159 Å²	159	62.2 Å²	62.2	60%	0.602	31%	0.308	S	S	*	.	H	α-helix	trans	-65.4	-45.8	175.3	178.6	76	0	0	0	113	D601 I602 K603 K607 E608 L609	D601-W605 PolarHBondContact O-N 3.26Å; I602-W605 PolarHBondContact O-N 3.49Å; K603-W605 VanDerWaalsContact C-N 3.35Å; K603-W605 PolarHBondContact O-N 2.9Å; W605-K607 VanDerWaalsContact C-N 3.35Å; W605-K607 PolarHBondContact O-N 3.16Å; W605-E608 PolarHBondContact O-N 3.13Å; W605-L609 HydrophobicContact CD2-CD1 4.11Å; W605-L609 HydrophobicContact CD2-CG 4.47Å; W605-L609 HydrophobicContact CE3-CD1 4.16Å; W605-L609 HydrophobicContact CH2-CD1 3.66Å; W605-L609 HydrophobicContact CZ2-CD1 3.61Å; W605-L609 HydrophobicContact CZ2-CG 4.42Å; W605-L609 HydrophobicContact CZ3-CD1 3.94Å; W605-L609 WeakPolarHBondContact O-CG 3.5Å; W605-L609 PolarHBondContact O-N 2.9Å
606	I	90	Very high	87.2	Confident	1 Å²	1	59.8 Å²	59.8	1%	0.005	30%	0.304	C	S	.	.	H	α-helix	trans	-66.7	-38.5	178.4	-56.2	160.7	0	0	0	110.6	I461 Y465 I602 K603 L609 N610	I461-I606 HydrophobicContact CG2-CD1 3.7Å; Y465-I606 HydrophobicContact CD1-CG2 4Å; Y465-I606 HydrophobicContact CD2-CD1 4.4Å; Y465-I606 HydrophobicContact CE1-CD1 3.88Å; Y465-I606 HydrophobicContact CE1-CG1 4.18Å; Y465-I606 HydrophobicContact CE1-CG2 4.15Å; Y465-I606 HydrophobicContact CE2-CD1 3.71Å; Y465-I606 HydrophobicContact CG-CG2 4.37Å; Y465-I606 VanDerWaalsContact CZ-CD1 3.42Å; Y465-I606 WeakPolarHBondContact OH-CD1 3.29Å; I602-I606 HydrophobicContact CG2-CD1 3.62Å; I602-I606 HydrophobicContact CG2-CG1 4.38Å; I602-I606 VanDerWaalsContact O-CG1 3.31Å; I602-I606 WeakPolarHBondContact O-CG1 3.47Å; I602-I606 PolarHBondContact O-N 3.35Å; K603-I606 PolarHBondContact O-N 3.31Å; I606-L609 PolarHBondContact O-N 3.49Å; I606-N610 WeakPolarHBondContact O-CB 3.49Å; I606-N610 PolarHBondContact O-N 2.88Å
607	K	91.1	Very high	86.6	Confident	88 Å²	88	65.6 Å²	65.6	38%	0.383	33%	0.33	S	S	.	.	H	α-helix	trans	-58.8	-46.8	173.4	-178.6	176.2	-171.4	166.4	0	111.5	Y464 K603 W605 N610 I611	Y464-K607 HydrophobicContact CD1-CB 4.3Å; Y464-K607 HydrophobicContact CD1-CG 4.34Å; Y464-K607 HydrophobicContact CD2-CB 4.14Å; Y464-K607 HydrophobicContact CE1-CB 4.09Å; Y464-K607 HydrophobicContact CE1-CD 4.19Å; Y464-K607 HydrophobicContact CE1-CG 3.74Å; Y464-K607 HydrophobicContact CE2-CB 3.93Å; Y464-K607 HydrophobicContact CE2-CD 4.23Å; Y464-K607 HydrophobicContact CE2-CG 4.21Å; Y464-K607 HydrophobicContact CG-CB 4.35Å; Y464-K607 WeakPolarHBondContact OH-CD 3.33Å; Y464-K607 WeakPolarHBondContact OH-CE 3.36Å; Y464-K607 PolarHBondContact OH-NZ 2.62Å; K603-K607 VanDerWaalsContact O-CB 3.24Å; K603-K607 WeakPolarHBondContact O-CB 3.47Å; K603-K607 PolarHBondContact O-N 3.17Å; W605-K607 VanDerWaalsContact C-N 3.35Å; W605-K607 PolarHBondContact O-N 3.16Å; K607-N610 PolarHBondContact O-N 3.02Å; K607-I611 HydrophobicContact CG-CD1 4.1Å; K607-I611 WeakPolarHBondContact O-CG1 3.31Å; K607-I611 PolarHBondContact O-N 3.18Å
608	E	89.6	Confident	85.9	Confident	73 Å²	73	66.5 Å²	66.5	34%	0.341	34%	0.337	S	S	.	.	H	α-helix	trans	-64.7	-39.6	177	177	62.7	-178.8	0	0	112.2	S604 W605 I611 R612	S604-E608 WeakPolarHBondContact O-CB 3.4Å; S604-E608 PolarHBondContact O-N 3.1Å; W605-E608 PolarHBondContact O-N 3.13Å; E608-I611 PolarHBondContact O-N 3.49Å; E608-R612 WeakPolarHBondContact O-CB 3.48Å; E608-R612 WeakPolarHBondContact O-CG 3.41Å; E608-R612 PolarHBondContact O-N 3.07Å; E608-R612 IonicContact OE1-CZ 3.12Å; E608-R612 IonicContact OE1-NE 3.69Å; E608-R612 PolarHBondContact OE1-NE 2.82Å; E608-R612 IonicContact OE1-NH2 3.83Å; E608-R612 PolarHBondContact OE1-NH2 3.06Å
609	L	86.5	Confident	85.3	Confident	30 Å²	30	65 Å²	65	16%	0.157	32%	0.32	C	S	.	.	H	α-helix	trans	-59.1	-48.4	171.4	-74.2	-176.3	0	0	0	111.9	W605 I606 I611 R612 S613 L622	W605-L609 HydrophobicContact CD2-CD1 4.11Å; W605-L609 HydrophobicContact CD2-CG 4.47Å; W605-L609 HydrophobicContact CE3-CD1 4.16Å; W605-L609 HydrophobicContact CH2-CD1 3.66Å; W605-L609 HydrophobicContact CZ2-CD1 3.61Å; W605-L609 HydrophobicContact CZ2-CG 4.42Å; W605-L609 HydrophobicContact CZ3-CD1 3.94Å; W605-L609 WeakPolarHBondContact O-CG 3.5Å; W605-L609 PolarHBondContact O-N 2.9Å; I606-L609 PolarHBondContact O-N 3.49Å; L609-I611 VanDerWaalsContact C-N 3.29Å; L609-I611 PolarHBondContact O-N 3.02Å; L609-R612 PolarHBondContact O-N 3.19Å; L609-S613 WeakPolarHBondContact O-CB 3.3Å; L609-S613 PolarHBondContact O-N 3.22Å; L609-S613 PolarHBondContact O-OG 3.38Å; L609-S613 VanDerWaalsContact O-OG 3.05Å; L609-L622 HydrophobicContact CD2-CD1 4.19Å; L609-L622 HydrophobicContact CD2-CD2 4.08Å
610	N	85.9	Confident	84.5	Confident	12 Å²	12	69.6 Å²	69.6	6%	0.064	34%	0.336	C	S	.	.	H	α-helix	trans	-62.5	-32.2	177.5	161.3	67.2	0	0	0	112.8	R467 Q471 I606 K607 S613 S614	R467-N610 WeakPolarHBondContact CB-OD1 3.28Å; Q471-N610 PolarHBondContact NE2-OD1 3.12Å; Q471-N610 PolarHBondContact OE1-O 3.25Å; I606-N610 WeakPolarHBondContact O-CB 3.49Å; I606-N610 PolarHBondContact O-N 2.88Å; K607-N610 PolarHBondContact O-N 3.02Å; N610-S613 WeakPolarHBondContact CA-OG 3.35Å; N610-S613 PolarHBondContact O-OG 3.32Å; N610-S614 PolarHBondContact O-N 3.1Å
611	I	87.2	Confident	83.7	Confident	85 Å²	85	71.7 Å²	71.7	44%	0.436	35%	0.346	S	S	.	.	H	α-helix	trans	-70	-47.5	171.6	-69.2	164.3	0	0	0	110.3	K607 E608 L609 S613 S614	K607-I611 HydrophobicContact CG-CD1 4.1Å; K607-I611 WeakPolarHBondContact O-CG1 3.31Å; K607-I611 PolarHBondContact O-N 3.18Å; E608-I611 PolarHBondContact O-N 3.49Å; L609-I611 VanDerWaalsContact C-N 3.29Å; L609-I611 PolarHBondContact O-N 3.02Å; I611-S613 PolarHBondContact O-N 3.36Å; I611-S614 VanDerWaalsContact O-CB 3.29Å; I611-S614 WeakPolarHBondContact O-CB 3.36Å; I611-S614 PolarHBondContact O-N 2.65Å; I611-S614 VanDerWaalsContact O-N 3.13Å; I611-S614 PolarHBondContact O-OG 3.21Å
612	R	82.7	Confident	82.9	Confident	123 Å²	123	71 Å²	71	46%	0.464	34%	0.342	S	S	.	.	H	α-helix	trans	-63.5	-41.4	178.8	-72.2	177.8	-172.5	-160.8	3.7	112.9	E608 L609 S614 I615 V618 L622	E608-R612 WeakPolarHBondContact O-CB 3.48Å; E608-R612 WeakPolarHBondContact O-CG 3.41Å; E608-R612 PolarHBondContact O-N 3.07Å; E608-R612 IonicContact OE1-CZ 3.12Å; E608-R612 IonicContact OE1-NE 3.69Å; E608-R612 PolarHBondContact OE1-NE 2.82Å; E608-R612 IonicContact OE1-NH2 3.83Å; E608-R612 PolarHBondContact OE1-NH2 3.06Å; L609-R612 PolarHBondContact O-N 3.19Å; R612-S614 PolarHBondContact O-N 2.74Å; R612-I615 PolarHBondContact O-N 3.31Å; R612-V618 HydrophobicContact CB-CG1 4.14Å; R612-V618 WeakPolarHBondContact O-CB 3.42Å; R612-V618 WeakPolarHBondContact O-CG1 3.26Å; R612-L622 HydrophobicContact CB-CD1 4.01Å
613	S	81.2	Confident	82	Confident	0 Å²	0	67.7 Å²	67.7	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-68.9	-16.1	176.3	60.9	0	0	0	0	112.8	L468 Q471 L609 N610 I611 I615 R619	L468-S613 VanDerWaalsContact CD1-OG 3.28Å; L468-S613 WeakPolarHBondContact CD1-OG 3.19Å; Q471-S613 PolarHBondContact OE1-O 3.06Å; Q471-S613 PolarHBondContact OE1-OG 3.07Å; L609-S613 WeakPolarHBondContact O-CB 3.3Å; L609-S613 PolarHBondContact O-N 3.22Å; L609-S613 PolarHBondContact O-OG 3.38Å; L609-S613 VanDerWaalsContact O-OG 3.05Å; N610-S613 WeakPolarHBondContact CA-OG 3.35Å; N610-S613 PolarHBondContact O-OG 3.32Å; I611-S613 PolarHBondContact O-N 3.36Å; S613-I615 PolarHBondContact O-N 3.22Å; S613-R619 VanDerWaalsContact O-CB 3.3Å; S613-R619 WeakPolarHBondContact O-CB 3.35Å; S613-R619 VanDerWaalsContact O-CG 3.31Å; S613-R619 WeakPolarHBondContact O-CG 3.21Å; S613-R619 PolarHBondContact O-NE 3.47Å
614	S	82.1	Confident	80.7	Confident	62 Å²	62	70.6 Å²	70.6	43%	0.434	34%	0.342	S	S	.	.	H	α-helix	trans	-61.3	-34.5	175.2	76.1	0	0	0	0	111.3	N610 I611 R612 P616 R619	N610-S614 PolarHBondContact O-N 3.1Å; I611-S614 VanDerWaalsContact O-CB 3.29Å; I611-S614 WeakPolarHBondContact O-CB 3.36Å; I611-S614 PolarHBondContact O-N 2.65Å; I611-S614 VanDerWaalsContact O-N 3.13Å; I611-S614 PolarHBondContact O-OG 3.21Å; R612-S614 PolarHBondContact O-N 2.74Å; S614-P616 WeakPolarHBondContact O-CD 3.39Å; S614-R619 PolarHBondContact O-NH2 2.05Å; S614-R619 VanDerWaalsContact O-NH2 3.09Å
615	I	82.5	Confident	79.2	Confident	87 Å²	87	72 Å²	72	45%	0.446	35%	0.345	S	S	.	.	S	Bend	trans	-77.4	112.7	179.6	-54.7	173.4	0	0	0	110.1	R612 S613 Q617 V618 R619	R612-I615 PolarHBondContact O-N 3.31Å; S613-I615 PolarHBondContact O-N 3.22Å; I615-Q617 VanDerWaalsContact C-N 3.29Å; I615-Q617 PolarHBondContact O-N 3.4Å; I615-Q617 VanDerWaalsContact O-N 3.12Å; I615-V618 HydrophobicContact CB-CB 4.17Å; I615-V618 HydrophobicContact CB-CG2 4.08Å; I615-V618 HydrophobicContact CD1-CG2 4.48Å; I615-V618 HydrophobicContact CG2-CB 4.39Å; I615-V618 HydrophobicContact CG2-CG2 3.92Å; I615-V618 PolarHBondContact O-N 3.33Å; I615-R619 WeakPolarHBondContact O-CB 3.16Å; I615-R619 PolarHBondContact O-N 3.01Å
616	P	75.6	Confident	77.9	Confident	69 Å²	69	66.8 Å²	66.8	45%	0.448	33%	0.329	S	S	.	.	H	α-helix	trans	-60.6	-30.9	-169.6	-27.4	36.1	0	0	0	115.6	S614 R620	S614-P616 WeakPolarHBondContact O-CD 3.39Å; P616-R620 WeakPolarHBondContact O-CG 3.49Å; P616-R620 PolarHBondContact O-N 3.23Å
617	Q	74.2	Confident	75.9	Confident	166 Å²	166	68.2 Å²	68.2	78%	0.776	34%	0.339	S	S	*	.	H	α-helix	trans	-67.9	-42.2	176.1	-65.7	178.7	-5.1	0	0	111.9	I615	I615-Q617 VanDerWaalsContact C-N 3.29Å; I615-Q617 PolarHBondContact O-N 3.4Å; I615-Q617 VanDerWaalsContact O-N 3.12Å
618	V	74.1	Confident	73.7	Confident	59 Å²	59	66.7 Å²	66.7	36%	0.358	34%	0.34	S	S	.	.	H	α-helix	trans	-72.9	-46.4	178.7	179.3	0	0	0	0	109.8	R612 I615 R620 Q621 L622	R612-V618 HydrophobicContact CB-CG1 4.14Å; R612-V618 WeakPolarHBondContact O-CB 3.42Å; R612-V618 WeakPolarHBondContact O-CG1 3.26Å; I615-V618 HydrophobicContact CB-CB 4.17Å; I615-V618 HydrophobicContact CB-CG2 4.08Å; I615-V618 HydrophobicContact CD1-CG2 4.48Å; I615-V618 HydrophobicContact CG2-CB 4.39Å; I615-V618 HydrophobicContact CG2-CG2 3.92Å; I615-V618 PolarHBondContact O-N 3.33Å; V618-R620 VanDerWaalsContact C-N 3.3Å; V618-R620 PolarHBondContact O-N 3.14Å; V618-Q621 PolarHBondContact O-N 2.91Å; V618-L622 HydrophobicContact CG1-CD1 4.42Å; V618-L622 WeakPolarHBondContact O-CB 3.06Å; V618-L622 PolarHBondContact O-N 3.39Å
619	R	77.1	Confident	71.4	Confident	19 Å²	19	67.9 Å²	67.9	7%	0.072	35%	0.348	C	S	.	.	H	α-helix	trans	-41.6	-53.2	175.3	-168.2	-171.1	-70.8	-158.3	-7.8	112.9	Q471 D475 S613 S614 I615 Q621 L622 F623	Q471-R619 WeakPolarHBondContact O-CD 3.32Å; D475-R619 VanDerWaalsContact CB-CD 3.48Å; D475-R619 HydrophobicContact CB-CG 4.26Å; D475-R619 WeakPolarHBondContact OD2-CD 3.09Å; D475-R619 IonicContact OD2-CZ 2.97Å; D475-R619 IonicContact OD2-NE 3.26Å; D475-R619 IonicContact OD2-NH1 2.73Å; D475-R619 PolarHBondContact OD2-NH1 3.07Å; S613-R619 VanDerWaalsContact O-CB 3.3Å; S613-R619 WeakPolarHBondContact O-CB 3.35Å; S613-R619 VanDerWaalsContact O-CG 3.31Å; S613-R619 WeakPolarHBondContact O-CG 3.21Å; S613-R619 PolarHBondContact O-NE 3.47Å; S614-R619 PolarHBondContact O-NH2 2.05Å; S614-R619 VanDerWaalsContact O-NH2 3.09Å; I615-R619 WeakPolarHBondContact O-CB 3.16Å; I615-R619 PolarHBondContact O-N 3.01Å; R619-Q621 PolarHBondContact O-N 2.64Å; R619-L622 PolarHBondContact O-N 2.88Å; R619-F623 HydrophobicContact CG-CD2 3.93Å; R619-F623 HydrophobicContact CG-CE2 3.62Å; R619-F623 WeakPolarHBondContact O-CD2 3.43Å; R619-F623 PolarHBondContact O-N 3.03Å; R619-F623 VanDerWaalsContact O-N 3.11Å
620	R	70.9	Confident	69.2	Low	121 Å²	121	71.2 Å²	71.2	46%	0.457	37%	0.366	S	S	.	.	H	α-helix	trans	-64.1	-40.9	-178.6	-68.8	173.8	-176.4	-161.5	-0.1	112.4	D475 P616 V618 L624	D475-R620 HydrophobicContact CB-CG 4.28Å; D475-R620 IonicContact OD1-CZ 2.74Å; D475-R620 IonicContact OD1-NE 3.83Å; D475-R620 PolarHBondContact OD1-NE 2.94Å; D475-R620 IonicContact OD1-NH2 2.69Å; D475-R620 PolarHBondContact OD1-NH2 3.21Å; P616-R620 WeakPolarHBondContact O-CG 3.49Å; P616-R620 PolarHBondContact O-N 3.23Å; V618-R620 VanDerWaalsContact C-N 3.3Å; V618-R620 PolarHBondContact O-N 3.14Å; R620-L624 WeakPolarHBondContact O-CB 3.35Å; R620-L624 WeakPolarHBondContact O-CD1 3.42Å; R620-L624 WeakPolarHBondContact O-CG 3.35Å; R620-L624 PolarHBondContact O-N 3.12Å
621	Q	73.5	Confident	66.8	Low	115 Å²	115	75.3 Å²	75.3	54%	0.537	40%	0.395	S	S	.	.	H	α-helix	trans	-69	-38.8	175.3	-62.4	-65.1	-9.5	0	0	112	V618 R619 N625	V618-Q621 PolarHBondContact O-N 2.91Å; R619-Q621 PolarHBondContact O-N 2.64Å; Q621-N625 WeakPolarHBondContact O-CB 3.4Å; Q621-N625 PolarHBondContact O-N 3.41Å; Q621-N625 PolarHBondContact O-ND2 2.87Å
622	L	72.4	Confident	64.2	Low	38 Å²	38	77.1 Å²	77.1	20%	0.199	41%	0.406	C	S	.	.	H	α-helix	trans	-62.8	-48.4	-178.1	-135.3	169.3	0	0	0	111	L609 R612 V618 R619 N625 L626	L609-L622 HydrophobicContact CD2-CD1 4.19Å; L609-L622 HydrophobicContact CD2-CD2 4.08Å; R612-L622 HydrophobicContact CB-CD1 4.01Å; V618-L622 HydrophobicContact CG1-CD1 4.42Å; V618-L622 WeakPolarHBondContact O-CB 3.06Å; V618-L622 PolarHBondContact O-N 3.39Å; R619-L622 PolarHBondContact O-N 2.88Å; L622-N625 PolarHBondContact O-N 3.2Å; L622-L626 PolarHBondContact O-N 2.78Å
623	F	71.7	Confident	61.6	Low	9 Å²	9	76.4 Å²	76.4	4%	0.039	41%	0.411	C	S	.	.	H	α-helix	trans	-76.5	-29.5	-178.7	-62.7	-52.2	0	0	0	114.3	L468 C472 C476 P481 L485 R619 L626 S627	L468-F623 HydrophobicContact CD1-CE1 4.05Å; L468-F623 HydrophobicContact CD1-CZ 3.74Å; L468-F623 HydrophobicContact CG-CE1 4.36Å; L468-F623 HydrophobicContact CG-CZ 4.3Å; C472-F623 HydrophobicContact CB-CD1 4.36Å; C472-F623 HydrophobicContact CB-CD2 4.03Å; C472-F623 HydrophobicContact CB-CE1 4.04Å; C472-F623 HydrophobicContact CB-CE2 3.64Å; C472-F623 HydrophobicContact CB-CG 4.37Å; C472-F623 HydrophobicContact CB-CZ 3.66Å; C476-F623 VanDerWaalsContact SG-CB 3.56Å; C476-F623 WeakPolarHBondContact SG-CD2 3.18Å; C476-F623 WeakPolarHBondContact SG-CG 3.43Å; P481-F623 HydrophobicContact CB-CB 4.08Å; P481-F623 HydrophobicContact CB-CD1 4.27Å; P481-F623 HydrophobicContact CB-CG 4.48Å; P481-F623 HydrophobicContact CG-CB 4.18Å; P481-F623 WeakPolarHBondContact CG-O 3.46Å; L485-F623 HydrophobicContact CD1-CE1 3.88Å; L485-F623 HydrophobicContact CD1-CZ 4.42Å; R619-F623 HydrophobicContact CG-CD2 3.93Å; R619-F623 HydrophobicContact CG-CE2 3.62Å; R619-F623 WeakPolarHBondContact O-CD2 3.43Å; R619-F623 PolarHBondContact O-N 3.03Å; R619-F623 VanDerWaalsContact O-N 3.11Å; F623-L626 HydrophobicContact CD1-CD2 4.15Å; F623-L626 WeakPolarHBondContact O-CB 3.13Å; F623-L626 PolarHBondContact O-N 3.37Å; F623-S627 PolarHBondContact O-N 2.69Å
624	L	63.2	Low	59.2	Low	112 Å²	112	81.8 Å²	81.8	59%	0.586	44%	0.444	S	S	*	.	H	α-helix	trans	-62.1	-44.8	167.8	-75	170.7	0	0	0	111.2	R620 L626 S627 S628	R620-L624 WeakPolarHBondContact O-CB 3.35Å; R620-L624 WeakPolarHBondContact O-CD1 3.42Å; R620-L624 WeakPolarHBondContact O-CG 3.35Å; R620-L624 PolarHBondContact O-N 3.12Å; L624-L626 VanDerWaalsContact C-N 3.34Å; L624-L626 PolarHBondContact O-N 2.73Å; L624-S627 PolarHBondContact O-N 3.02Å; L624-S628 PolarHBondContact O-N 3.07Å
625	N	61.1	Low	56.6	Low	84 Å²	84	88.7 Å²	88.7	45%	0.449	46%	0.462	S	S	.	.	H	α-helix	trans	-69.7	-29.4	178.1	-72.6	-41.2	0	0	0	113	Q621 L622 S627 S628 N629	Q621-N625 WeakPolarHBondContact O-CB 3.4Å; Q621-N625 PolarHBondContact O-N 3.41Å; Q621-N625 PolarHBondContact O-ND2 2.87Å; L622-N625 PolarHBondContact O-N 3.2Å; N625-S627 PolarHBondContact O-N 3.11Å; N625-S628 WeakPolarHBondContact CA-OG 3.35Å; N625-S628 PolarHBondContact O-N 3.02Å; N625-S628 PolarHBondContact O-OG 3.32Å; N625-N629 PolarHBondContact O-N 3.29Å; N625-N629 VanDerWaalsContact O-N 3.16Å; N625-N629 PolarHBondContact O-ND2 3.09Å
626	L	62.9	Low	53.9	Low	49 Å²	49	88.7 Å²	88.7	26%	0.257	47%	0.47	S	S	.	.	H	α-helix	trans	-58.2	-37.6	172.8	-148.6	70.7	0	0	0	111.8	P481 Y484 L622 F623 L624	P481-L626 HydrophobicContact CB-CD2 4.35Å; Y484-L626 HydrophobicContact CD1-CD2 3.75Å; Y484-L626 HydrophobicContact CD1-CG 4.19Å; Y484-L626 HydrophobicContact CE1-CD2 4.11Å; Y484-L626 HydrophobicContact CE1-CG 4.26Å; L622-L626 PolarHBondContact O-N 2.78Å; F623-L626 HydrophobicContact CD1-CD2 4.15Å; F623-L626 WeakPolarHBondContact O-CB 3.13Å; F623-L626 PolarHBondContact O-N 3.37Å; L624-L626 VanDerWaalsContact C-N 3.34Å; L624-L626 PolarHBondContact O-N 2.73Å
627	S	48.2	Very low	51.6	Low	32 Å²	32	92 Å²	92	22%	0.224	48%	0.484	C	S	.	.	H	α-helix	trans	-71.3	-27.1	172.5	-62.1	0	0	0	0	113.6	P481 F623 L624 N625	P481-S627 WeakPolarHBondContact CG-OG 3.41Å; F623-S627 PolarHBondContact O-N 2.69Å; L624-S627 PolarHBondContact O-N 3.02Å; N625-S627 PolarHBondContact O-N 3.11Å
628	S	44.6	Very low	49.4	Very low	56 Å²	56	89.8 Å²	89.8	39%	0.392	48%	0.477	S	S	.	.	H	α-helix	trans	-77.2	-41	-177.1	75.7	0	0	0	0	113.3	L624 N625 L630 S631	L624-S628 PolarHBondContact O-N 3.07Å; N625-S628 WeakPolarHBondContact CA-OG 3.35Å; N625-S628 PolarHBondContact O-N 3.02Å; N625-S628 PolarHBondContact O-OG 3.32Å; S628-L630 PolarHBondContact O-N 3.26Å; S628-S631 WeakPolarHBondContact O-CB 3.25Å; S628-S631 PolarHBondContact O-N 3.33Å; S628-S631 VanDerWaalsContact O-N 3.11Å
629	N	40.9	Very low	47.5	Very low	98 Å²	98	93.6 Å²	93.6	52%	0.524	50%	0.5	S	S	.	.	H	α-helix	trans	-61.8	-27.6	176	-71	-46.3	0	0	0	112	N625 S631 N632 N633	N625-N629 PolarHBondContact O-N 3.29Å; N625-N629 VanDerWaalsContact O-N 3.16Å; N625-N629 PolarHBondContact O-ND2 3.09Å; N629-S631 PolarHBondContact O-N 3.44Å; N629-N632 PolarHBondContact O-N 2.77Å; N629-N633 PolarHBondContact O-N 2.94Å
630	L	40.7	Very low	45.1	Very low	99 Å²	99	100.9 Å²	100.9	52%	0.518	53%	0.533	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-19.9	178.4	-159.2	66.7	0	0	0	113.4	S628 N632	S628-L630 PolarHBondContact O-N 3.26Å; L630-N632 VanDerWaalsContact C-N 3.32Å
631	S	35.8	Very low	42.9	Very low	98 Å²	98	103.2 Å²	103.2	69%	0.685	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.7	-21.1	174.7	-171	0	0	0	0	113.5	S628 N629	S628-S631 WeakPolarHBondContact O-CB 3.25Å; S628-S631 PolarHBondContact O-N 3.33Å; S628-S631 VanDerWaalsContact O-N 3.11Å; N629-S631 PolarHBondContact O-N 3.44Å
632	N	32.1	Very low	40.6	Very low	123 Å²	123	106.7 Å²	106.7	66%	0.658	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.5	-21.3	-173	-66	-13	0	0	0	112.8	N629 L630 T634	N629-N632 PolarHBondContact O-N 2.77Å; L630-N632 VanDerWaalsContact C-N 3.32Å; N632-T634 PolarHBondContact O-N 3.02Å
633	N	29.8	Very low	38.5	Very low	109 Å²	109	110.2 Å²	110.2	58%	0.583	59%	0.592	S	S	*	*			trans	-97.5	38.9	-177.7	-72.4	11	0	0	0	113.6	N629 Y635	N629-N633 PolarHBondContact O-N 2.94Å; N633-Y635 PolarHBondContact O-N 2.96Å
634	T	29.3	Very low	36.3	Very low	112 Å²	112	118.7 Å²	118.7	69%	0.687	63%	0.632	S	S	*	*	S	Bend	trans	-71.6	119.7	142.9	44.8	0	0	0	0	106.6	N632	N632-T634 PolarHBondContact O-N 3.02Å
635	Y	28.4	Very low	34.8	Very low	208 Å²	208	119.6 Å²	119.6	82%	0.816	64%	0.642	S	S	*	*			trans	73.6	92.8	-162.1	-59.1	-93.7	0	0	0	116	N633	N633-Y635 PolarHBondContact O-N 2.96Å
636	S	26.4	Very low	33.2	Very low	86 Å²	86	125.1 Å²	125.1	60%	0.601	66%	0.662	S	S	*	*				-156.1	111.6	123.2	-81.2	0	0	0	0	109.1	D638	S636-D638 VanDerWaalsContact C-N 3.26Å; S636-D638 VanDerWaalsContact C-OD2 3.22Å; S636-D638 WeakPolarHBondContact CA-OD2 3.49Å; S636-D638 VanDerWaalsContact CB-OD2 3.3Å; S636-D638 WeakPolarHBondContact CB-OD2 3.4Å
637	N	27.3	Very low	31.4	Very low	140 Å²	140	131.4 Å²	131.4	75%	0.749	69%	0.69	S	S	*	*			trans	-98.1	31.3	176.1	-79.4	-71.5	0	0	0	110.5
638	D	27.5	Very low	30.5	Very low	119 Å²	119	137.9 Å²	137.9	64%	0.636	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.3	10.1	-154.8	-55.3	-76	0	0	0	113.6	S636 F640	S636-D638 VanDerWaalsContact C-N 3.26Å; S636-D638 VanDerWaalsContact C-OD2 3.22Å; S636-D638 WeakPolarHBondContact CA-OD2 3.49Å; S636-D638 VanDerWaalsContact CB-OD2 3.3Å; S636-D638 WeakPolarHBondContact CB-OD2 3.4Å; D638-F640 VanDerWaalsContact C-N 3.27Å
639	V	33.4	Very low	29.7	Very low	138 Å²	138	141.2 Å²	141.2	84%	0.836	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.2	-16.8	165.2	-178.1	0	0	0	0	111.3
640	F	26.8	Very low	29.1	Very low	173 Å²	173	145 Å²	145	76%	0.759	76%	0.759	S	S	*	*	S	Bend	trans	-118.2	115.5	167.4	-77.1	-84.1	0	0	0	109.8	D638 K642	D638-F640 VanDerWaalsContact C-N 3.27Å; F640-K642 PolarHBondContact O-N 3Å
641	L	25.7	Very low	28.5	Very low	170 Å²	170	145.3 Å²	145.3	89%	0.89	77%	0.77	S	S	*	*			trans	-59.3	107.4	173.3	-101.9	74.4	0	0	0	110	P643	L641-P643 WeakPolarHBondContact O-CD 3.28Å
642	K	24.9	Very low	28.2	Very low	188 Å²	188	149 Å²	149	82%	0.817	77%	0.774	S	S	*	*			trans	-79.7	115.1	174.5	-162.8	169.7	-170.9	169	0	108.6	F640 Q644	F640-K642 PolarHBondContact O-N 3Å; K642-Q644 PolarHBondContact O-N 3.14Å; K642-Q644 VanDerWaalsContact O-N 3.16Å
643	P	27.7	Very low	28.1	Very low	111 Å²	111	152 Å²	152	72%	0.721	78%	0.78	S	S	*	*			trans	-64	120.5	-174.6	24.5	-33.5	0	0	0	110.4	L641 T645	L641-P643 WeakPolarHBondContact O-CD 3.28Å; P643-T645 PolarHBondContact O-N 3.16Å; P643-T645 VanDerWaalsContact O-N 3.1Å
644	Q	25.2	Very low	28	Very low	187 Å²	187	151.6 Å²	151.6	87%	0.874	78%	0.784	S	S	*	*			trans	-69.2	109	179.2	-74	-157.1	29.4	0	0	110.8	K642	K642-Q644 PolarHBondContact O-N 3.14Å; K642-Q644 VanDerWaalsContact O-N 3.16Å
645	T	31.2	Very low	28	Very low	132 Å²	132	152.4 Å²	152.4	81%	0.81	78%	0.78	S	S	*	*			trans	-120.7	131.6	160.6	48.1	0	0	0	0	109.2	P643	P643-T645 PolarHBondContact O-N 3.16Å; P643-T645 VanDerWaalsContact O-N 3.1Å
646	K	28.6	Very low	28.3	Very low	199 Å²	199	151.3 Å²	151.3	87%	0.865	78%	0.775	S	S	*	*			trans	-72.8	149.1	-174.1	-69.4	173.1	-179.2	173.3	0	110.5	N648	K646-N648 PolarHBondContact O-N 2.86Å
647	H	25.1	Very low	28.6	Very low	181 Å²	181	153.8 Å²	153.8	84%	0.838	78%	0.778	S	S	*	*			trans	-46.2	133.3	-171.8	-61.6	-90.4	0	0	0	115
648	N	28.9	Very low	28.8	Very low	169 Å²	169	151.7 Å²	151.7	90%	0.904	77%	0.771	S	S	*	*			trans	-143.5	147.2	137.1	-100.5	-37.6	0	0	0	109.2	K646	K646-N648 PolarHBondContact O-N 2.86Å
649	T	28.3	Very low	29.1	Very low	125 Å²	125	150.1 Å²	150.1	77%	0.767	77%	0.769	S	S	*	*			trans	-101	118.4	-161.7	50.9	0	0	0	0	113.6
650	L	27.7	Very low	29.1	Very low	177 Å²	177	150.6 Å²	150.6	93%	0.927	77%	0.766	S	S	*	*			trans	-153.3	154	144.3	-149.6	62.3	0	0	0	112.4
651	S	28.1	Very low	29.4	Very low	106 Å²	106	149.2 Å²	149.2	74%	0.741	76%	0.76	S	S	*	*			trans	-86.9	132.6	-176.7	160.4	0	0	0	0	112.9
652	K	30.6	Very low	29.6	Very low	176 Å²	176	144 Å²	144	77%	0.765	75%	0.748	S	S	*	*			trans	-172.2	158.1	137.4	-102.6	157.2	-172.7	-177.3	0	111.7
653	K	28.2	Very low	30	Very low	185 Å²	185	146.2 Å²	146.2	80%	0.804	75%	0.751	S	S	*	*			trans	-67.8	152.7	167.4	-78.1	-177.3	172.8	-177.2	0	110.2	Q655	K653-Q655 PolarHBondContact O-N 3.42Å
654	P	28.8	Very low	30.1	Very low	102 Å²	102	145.2 Å²	145.2	66%	0.662	75%	0.752	S	S	*	*			trans	-63.1	117.1	170.2	26.4	-33.3	0	0	0	110.3
655	Q	29.4	Very low	30.4	Very low	128 Å²	128	142.1 Å²	142.1	60%	0.598	75%	0.751	S	S	*	*			trans	-89.7	-0.5	-175.6	-71.7	-169.5	-121	0	0	114.3	K653 M657 T658	K653-Q655 PolarHBondContact O-N 3.42Å; Q655-M657 VanDerWaalsContact C-N 3.25Å; Q655-M657 PolarHBondContact O-N 2.97Å; Q655-T658 PolarHBondContact O-N 3.18Å; Q655-T658 PolarHBondContact O-OG1 3.04Å
656	W	35.4	Very low	30.2	Very low	186 Å²	186	144.5 Å²	144.5	71%	0.705	75%	0.753	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.9	-24.4	-174.2	67.3	-96.8	0	0	0	114.4	T658 S659	W656-T658 VanDerWaalsContact C-N 3.33Å; W656-T658 PolarHBondContact O-N 3.01Å; W656-S659 PolarHBondContact O-OG 3.5Å
657	M	30.7	Very low	30.2	Very low	137 Å²	137	145.8 Å²	145.8	68%	0.675	75%	0.752	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.6	-9.8	174.8	-71.8	-174.8	72.1	0	0	114.9	Q655	Q655-M657 VanDerWaalsContact C-N 3.25Å; Q655-M657 PolarHBondContact O-N 2.97Å
658	T	32.8	Very low	30.3	Very low	97 Å²	97	146.3 Å²	146.3	60%	0.595	76%	0.755	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.1	-4.4	-176.1	23.6	0	0	0	0	115.2	Q655 W656	Q655-T658 PolarHBondContact O-N 3.18Å; Q655-T658 PolarHBondContact O-OG1 3.04Å; W656-T658 VanDerWaalsContact C-N 3.33Å; W656-T658 PolarHBondContact O-N 3.01Å
659	S	33.4	Very low	30.3	Very low	85 Å²	85	144.5 Å²	144.5	59%	0.594	75%	0.75	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.6	-35.5	178.6	53.8	0	0	0	0	113.8	W656	W656-S659 PolarHBondContact O-OG 3.5Å
660	L	32.6	Very low	30.1	Very low	149 Å²	149	147.2 Å²	147.2	78%	0.78	76%	0.759	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.7	-40.5	-175.8	-78.5	165.1	0	0	0	114
661	F	34.4	Very low	30.2	Very low	144 Å²	144	143.9 Å²	143.9	63%	0.632	75%	0.75	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.3	-11.4	-174.9	-69.6	-89.4	0	0	0	114.1	R663	F661-R663 VanDerWaalsContact C-N 3.34Å; F661-R663 PolarHBondContact O-N 3.4Å
662	G	29.4	Very low	30.2	Very low	61 Å²	61	150.7 Å²	150.7	63%	0.629	78%	0.777	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.3	-1.1	-171.7	0	0	0	0	0	117.5
663	R	32.6	Very low	30.1	Very low	233 Å²	233	149.5 Å²	149.5	88%	0.879	78%	0.778	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.8	4.5	-172.8	-70.2	-166.9	177.3	-160.4	1.9	116.6	F661	F661-R663 VanDerWaalsContact C-N 3.34Å; F661-R663 PolarHBondContact O-N 3.4Å
664	A	30.9	Very low	30.2	Very low	91 Å²	91	147.6 Å²	147.6	75%	0.752	78%	0.777	S	S	*	*	S	Bend	trans	-81.5	-35.3	175.6	0	0	0	0	0	113.4	Q666	A664-Q666 PolarHBondContact O-N 3.25Å
665	S	31.3	Very low	30.3	Very low	122 Å²	122	150.1 Å²	150.1	85%	0.853	78%	0.783	S	S	*	*	S	Bend	trans	-93	46.6	-166.4	-167	0	0	0	0	114.9
666	Q	27.9	Very low	30.4	Very low	182 Å²	182	151.4 Å²	151.4	85%	0.85	79%	0.794	S	S	*	*	S	Bend	trans	-149.2	32.2	178.4	-137.5	175.1	34.9	0	0	115.4	A664	A664-Q666 PolarHBondContact O-N 3.25Å
667	R	27.6	Very low	30.1	Very low	225 Å²	225	149.3 Å²	149.3	85%	0.849	80%	0.799	S	S	*	*			trans	-133.8	37.4	179.6	-70.1	-169.5	179.1	-115.1	6.4	115.1
668	H	28.4	Very low	30	Very low	192 Å²	192	150.1 Å²	150.1	89%	0.889	81%	0.808	S	S	*	*			trans	-136.3	42.9	175.5	-92.2	-74.9	0	0	0	114.7
669	T	27.2	Very low	29.8	Very low	131 Å²	131	153.9 Å²	153.9	80%	0.804	82%	0.823	S	S	*	*			trans	-144	99.4	163.4	52.1	0	0	0	0	109.9
670	L	25	Very low	29.5	Very low	182 Å²	182	159.2 Å²	159.2	95%	0.953	84%	0.841	S	S	*	*	S	Bend	trans	155.5	72.7	159.7	-89.6	168.6	0	0	0	111.2
671	S	28.6	Very low	29.3	Very low	107 Å²	107	160 Å²	160	75%	0.748	85%	0.846	S	S	*	*			trans	177.1	119.9	153.7	175.5	0	0	0	0	109.3
672	L	28.4	Very low	28.8	Very low	250 Å²	250	161.5 Å²	161.5	100%	1.309	87%	0.865	S	S	*	*			trans	61.9	0	179.7	-67.7	162.1	0	0	0	114.8

Retrieved 672 of 672 residues in 144.7 ms (Link to these results)

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