A0A3Q0KGG3_SCHMA Loading...

MICOS complex subunit MIC60

Component of the MICOS complex, a large protein complex of the mitochondrial inner membrane that plays crucial roles in the maintenance of crista junctions, inner membrane architecture, and formation of contact sites to the outer membrane.

AlphaFold DB , UniProt , Accession A0A3Q0KGG3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 746 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	41.2	Very low	45.5	Very low	213 Å²	213	148.5 Å²	148.5	100%	1.049	77%	0.774	S	S	*	*				0	75.2	0	-174.6	-170.9	-71.6	0	0	109.7
2	I	47.2	Very low	45.4	Very low	145 Å²	145	147.9 Å²	147.9	74%	0.744	77%	0.77	S	S	*	*			trans	-120.7	-13.4	-164.4	-70.6	167	0	0	0	113.4
3	V	49.1	Very low	45.3	Very low	124 Å²	124	149.8 Å²	149.8	75%	0.752	77%	0.773	S	S	*	*	G	3₁₀ helix	trans	-76.1	-32	-174.2	-178.6	0	0	0	0	113.3	L5 R6	V3-L5 PolarHBondContact O-N 3.26Å; V3-R6 PolarHBondContact O-N 2.91Å
4	L	44.6	Very low	45.1	Very low	150 Å²	150	148.1 Å²	148.1	79%	0.785	76%	0.764	S	S	*	*	G	3₁₀ helix	trans	-67.6	-14.2	-177.1	-81.5	164.6	0	0	0	114.8
5	L	48.6	Very low	44.6	Very low	146 Å²	146	153.3 Å²	153.3	76%	0.764	77%	0.772	S	S	*	*	G	3₁₀ helix	trans	-81.8	-13.8	-179.4	-84.8	159.4	0	0	0	114.3	V3	V3-L5 PolarHBondContact O-N 3.26Å
6	R	47.3	Very low	44.4	Very low	222 Å²	222	155.3 Å²	155.3	84%	0.838	77%	0.774	S	S	*	*	S	Bend	trans	-88.9	-19.8	-176.3	-77.8	-173	171.6	176.7	-1.9	115.7	V3	V3-R6 PolarHBondContact O-N 2.91Å
7	L	43.6	Very low	43.9	Very low	146 Å²	146	159.2 Å²	159.2	76%	0.764	78%	0.78	S	S	*	*	G	3₁₀ helix	trans	-79	-25.8	-177.3	-95.5	72.1	0	0	0	114.6	A9	L7-A9 VanDerWaalsContact C-N 3.28Å; L7-A9 PolarHBondContact O-N 3.4Å
8	K	47	Very low	43.4	Very low	185 Å²	185	160.9 Å²	160.9	80%	0.804	79%	0.788	S	S	*	*	G	3₁₀ helix	trans	-74.3	-11.9	-178.7	-85.9	-172.8	172.3	-177.6	0	114.8
9	A	47	Very low	43	Very low	85 Å²	85	163.5 Å²	163.5	70%	0.702	80%	0.795	S	S	*	*	G	3₁₀ helix	trans	-78	-20.1	-178.6	0	0	0	0	0	114.4	L7	L7-A9 VanDerWaalsContact C-N 3.28Å; L7-A9 PolarHBondContact O-N 3.4Å
10	S	45.1	Very low	42.7	Very low	91 Å²	91	167 Å²	167	64%	0.636	80%	0.801	S	S	*	*	S	Bend	trans	-85.4	-34.9	-170.1	-159.6	0	0	0	0	114.4	I12	S10-I12 VanDerWaalsContact C-N 3.33Å; S10-I12 PolarHBondContact O-N 3.11Å
11	N	40.2	Very low	42.3	Very low	127 Å²	127	164.3 Å²	164.3	68%	0.679	80%	0.8	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.8	7.1	-167.3	-94.4	-3.7	0	0	0	116.1
12	I	44.4	Very low	42.2	Very low	141 Å²	141	161.7 Å²	161.7	72%	0.723	79%	0.788	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.1	-13	-173.9	-68.2	175.3	0	0	0	113.2	S10	S10-I12 VanDerWaalsContact C-N 3.33Å; S10-I12 PolarHBondContact O-N 3.11Å
13	Q	43.2	Very low	41.6	Very low	173 Å²	173	159.7 Å²	159.7	81%	0.808	79%	0.787	S	S	*	*	S	Bend	trans	-79.4	-18.2	176.9	-72.1	-161.2	-11	0	0	114.8	Y15	Q13-Y15 VanDerWaalsContact C-N 3.35Å; Q13-Y15 PolarHBondContact O-N 2.76Å
14	I	42.3	Very low	41.2	Very low	125 Å²	125	159 Å²	159	64%	0.641	78%	0.783	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.4	-23.7	-168.1	-66	175	0	0	0	113.4
15	Y	38.6	Very low	40.7	Very low	227 Å²	227	162.8 Å²	162.8	89%	0.89	79%	0.787	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.7	6.4	-173.3	-98.6	-84.8	0	0	0	116.3	Q13	Q13-Y15 VanDerWaalsContact C-N 3.35Å; Q13-Y15 PolarHBondContact O-N 2.76Å
16	K	40.5	Very low	40.1	Very low	184 Å²	184	163.1 Å²	163.1	80%	0.8	79%	0.789	S	S	*	*	S	Bend	trans	-108.2	8.1	-173.5	-147.7	174.4	-178.9	178.6	0	115.5
17	Y	37	Very low	39.6	Very low	222 Å²	222	157.5 Å²	157.5	87%	0.871	78%	0.783	S	S	*	*	S	Bend	trans	-140.6	29.1	-168.8	-103.6	-72.9	0	0	0	116.5
18	M	33.9	Very low	39.3	Very low	190 Å²	190	158.5 Å²	158.5	94%	0.936	78%	0.781	S	S	*	*			trans	-123.7	150.7	169.9	-85.2	-161.9	170.7	0	0	113.5
19	K	36.1	Very low	38.8	Very low	211 Å²	211	155.3 Å²	155.3	92%	0.917	77%	0.772	S	S	*	*			trans	78.9	46.7	168.8	-141.6	172.4	-170.1	176.8	0	118
20	Y	37.5	Very low	38.3	Very low	232 Å²	232	158 Å²	158	91%	0.91	78%	0.775	S	S	*	*			trans	-95.4	153.4	146.5	-116.4	-87.6	0	0	0	110.1
21	S	34.5	Very low	37.9	Very low	111 Å²	111	159 Å²	159	78%	0.776	78%	0.779	S	S	*	*			trans	76.5	163	172.6	-154.3	0	0	0	0	118.5
22	I	37.7	Very low	37.6	Very low	158 Å²	158	162.2 Å²	162.2	81%	0.81	79%	0.787	S	S	*	*			trans	64.1	84.1	-176.3	-45	176.7	0	0	0	113.1
23	S	36.4	Very low	37	Very low	103 Å²	103	163 Å²	163	72%	0.72	79%	0.793	S	S	*	*				83.9	108.1	53.5	-169.3	0	0	0	0	114.9
24	T	39.4	Very low	36.7	Very low	109 Å²	109	160.3 Å²	160.3	67%	0.669	79%	0.792	S	S	*	*				169.9	137.2	119.1	44.2	0	0	0	0	113
25	R	33.7	Very low	36.2	Very low	231 Å²	231	159.2 Å²	159.2	87%	0.872	80%	0.796	S	S	*	*			trans	49.2	130	137.1	-58.4	171.5	-164.3	-159.9	4.2	118.4
26	L	36	Very low	36	Very low	153 Å²	153	158 Å²	158	80%	0.801	80%	0.796	S	S	*	*			cis	-160.3	172.3	6.6	-91.3	154.1	0	0	0	105.9
27	C	38.2	Very low	35.7	Very low	104 Å²	104	153.5 Å²	153.5	70%	0.703	79%	0.787	S	S	*	*			cis	-131.6	177.8	6.5	-102.7	0	0	0	0	108.3
28	K	36.4	Very low	35.6	Very low	167 Å²	167	149.6 Å²	149.6	73%	0.726	79%	0.787	S	S	*	*			cis	85.6	114	28.3	-144.5	-176.2	-175.6	180	0	115.1
29	D	37.4	Very low	35.4	Very low	118 Å²	118	151.6 Å²	151.6	63%	0.631	78%	0.784	S	S	*	*			cis	-151.1	153.1	-9.2	-99	-19.7	0	0	0	111.4
30	N	35.7	Very low	35.5	Very low	142 Å²	142	147.4 Å²	147.4	76%	0.759	78%	0.776	S	S	*	*			trans	22.4	136	152.2	-54.4	-33.1	0	0	0	123.3
31	P	36.8	Very low	35.3	Very low	110 Å²	110	142.1 Å²	142.1	71%	0.714	77%	0.768	S	S	*	*			trans	-87.3	152	156.7	36.8	-32.4	0	0	0	112.4
32	F	33.8	Very low	35.4	Very low	195 Å²	195	142.1 Å²	142.1	86%	0.855	77%	0.768	S	S	*	*			trans	168.5	156.8	133.3	-106.7	-74.4	0	0	0	113.3
33	L	32.7	Very low	35.4	Very low	159 Å²	159	139.8 Å²	139.8	83%	0.832	77%	0.766	S	S	*	*			trans	75.2	163	159.3	-71.5	169.2	0	0	0	121
34	S	36.9	Very low	35.5	Very low	115 Å²	115	146.2 Å²	146.2	80%	0.804	78%	0.776	S	S	*	*			trans	70.1	96.7	176.5	63.6	0	0	0	0	118.3
35	S	32.1	Very low	35.6	Very low	103 Å²	103	147 Å²	147	72%	0.72	79%	0.786	S	S	*	*			trans	-57.5	146	145.3	51.9	0	0	0	0	111.6
36	F	33.4	Very low	35.7	Very low	202 Å²	202	138.9 Å²	138.9	89%	0.886	77%	0.774	S	S	*	*				-162	164.7	120.7	-128.5	-102.4	0	0	0	113.3
37	S	33.5	Very low	35.9	Very low	88 Å²	88	137.2 Å²	137.2	62%	0.615	78%	0.775	S	S	*	*			trans	-46.6	142.2	-178.8	-169.7	0	0	0	0	116.8
38	T	36.6	Very low	35.9	Very low	140 Å²	140	136.7 Å²	136.7	86%	0.859	78%	0.778	S	S	*	*				-168.9	158.8	105.1	22	0	0	0	0	113.5
39	R	29	Very low	36.2	Very low	232 Å²	232	136.6 Å²	136.6	88%	0.875	78%	0.784	S	S	*	*			trans	-135.8	111.8	-174.5	170.7	-149.9	-73.6	-169.8	-4.9	109.6
40	T	38.1	Very low	36.4	Very low	124 Å²	124	136.5 Å²	136.5	76%	0.761	79%	0.79	S	S	*	*			trans	174.8	151.3	166.5	31.8	0	0	0	0	109.7
41	T	34.3	Very low	36.7	Very low	121 Å²	121	135.3 Å²	135.3	74%	0.742	79%	0.79	S	S	*	*			cis	-171.6	166.6	-24.5	19.2	0	0	0	0	107
42	S	36.6	Very low	36.9	Very low	110 Å²	110	136.9 Å²	136.9	77%	0.769	80%	0.797	S	S	*	*			trans	72.5	156.5	162.5	114.2	0	0	0	0	116.4
43	S	36.9	Very low	37.3	Very low	109 Å²	109	137 Å²	137	76%	0.762	80%	0.798	S	S	*	*			cis	-159.6	161.8	-13.3	28.8	0	0	0	0	112
44	Y	37.7	Very low	38.1	Very low	238 Å²	238	134.4 Å²	134.4	93%	0.933	79%	0.79	S	S	*	*			trans	-64.5	132.7	179	-129.4	-114.4	0	0	0	114.2
45	S	41.2	Very low	38.3	Very low	127 Å²	127	139.9 Å²	139.9	89%	0.888	79%	0.793	S	S	*	*			trans	173.1	134.5	151.2	-175	0	0	0	0	109.3
46	G	37.1	Very low	39.2	Very low	59 Å²	59	146.8 Å²	146.8	61%	0.608	80%	0.803	S	S	*	*			cis	-176.2	175.8	-3	0	0	0	0	0	112.3
47	S	40.2	Very low	40	Very low	119 Å²	119	144.3 Å²	144.3	83%	0.832	80%	0.798	S	S	*	*			trans	44.9	90.6	161.8	61.6	0	0	0	0	121.1
48	A	38.5	Very low	40.3	Very low	92 Å²	92	148.4 Å²	148.4	76%	0.76	81%	0.805	S	S	*	*				52.6	136.3	113	0	0	0	0	0	124
49	I	41.1	Very low	40.8	Very low	166 Å²	166	151.7 Å²	151.7	85%	0.851	80%	0.801	S	S	*	*			trans	84.7	139.6	150.9	-67.8	161	0	0	0	117.8
50	P	42.5	Very low	41.7	Very low	116 Å²	116	149.5 Å²	149.5	75%	0.753	80%	0.798	S	S	*	*			trans	-127.9	-146	-143.4	43.1	-21.9	0	0	0	114.4
51	P	42.1	Very low	42	Very low	117 Å²	117	151 Å²	151	76%	0.76	80%	0.795	S	S	*	*				-125.2	158.4	-111.9	37.2	-18.2	0	0	0	116.6
52	T	41.9	Very low	42.5	Very low	142 Å²	142	149.9 Å²	149.9	87%	0.871	78%	0.783	S	S	*	*			trans	-135.9	150	165.1	53.7	0	0	0	0	113.6
53	K	42.1	Very low	43.1	Very low	199 Å²	199	151.2 Å²	151.2	87%	0.865	78%	0.775	S	S	*	*			trans	-116.8	-170.8	168.8	-55.7	176.2	174.9	170.5	0	106.7
54	P	48	Very low	43.8	Very low	103 Å²	103	152.8 Å²	152.8	67%	0.669	77%	0.774	S	S	*	*			cis	-140.9	-179.8	-5.4	33.4	-9.9	0	0	0	116.6
55	R	41.4	Very low	44.2	Very low	230 Å²	230	145.7 Å²	145.7	87%	0.868	75%	0.753	S	S	*	*			trans	47.6	119	143.9	-70.5	162.6	176.9	171.8	-2.7	120.4
56	R	50.6	Low	44.6	Very low	249 Å²	249	143.5 Å²	143.5	94%	0.94	73%	0.731	S	S	*	*	S	Bend	trans	-141.6	-18.8	151.4	-120.3	178.3	-170.7	-171.8	2.9	118.7
57	I	49.8	Very low	45.4	Very low	149 Å²	149	146.9 Å²	146.9	76%	0.764	73%	0.734	S	S	*	*	S	Bend	trans	-89.3	-28.4	-169	-63.7	171.2	0	0	0	114.1	R59	I57-R59 VanDerWaalsContact C-N 3.28Å; I57-R59 PolarHBondContact O-N 3.04Å
58	F	40.5	Very low	46.3	Very low	174 Å²	174	145.1 Å²	145.1	76%	0.763	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.4	-10	-165.2	-139.7	-94.3	0	0	0	116.6
59	R	47.9	Very low	47.5	Very low	209 Å²	209	144.7 Å²	144.7	79%	0.789	71%	0.705	S	S	*	*	H	α-helix	trans	-80.3	-27.2	-173.4	-81.7	-174.6	172.7	174.2	-2.3	115.2	I57	I57-R59 VanDerWaalsContact C-N 3.28Å; I57-R59 PolarHBondContact O-N 3.04Å
60	K	47.5	Very low	48.6	Very low	186 Å²	186	140.8 Å²	140.8	81%	0.809	69%	0.692	S	S	*	*	H	α-helix	trans	-76	-35.4	-176.6	-72.3	-167.1	175.6	-173.1	0	113.5	L62	K60-L62 VanDerWaalsContact C-N 3.3Å; K60-L62 PolarHBondContact O-N 2.9Å
61	F	43.7	Very low	49.7	Very low	157 Å²	157	139.2 Å²	139.2	69%	0.689	68%	0.684	S	S	*	*	H	α-helix	trans	-72.4	-20.9	176.7	-79	-79.2	0	0	0	113.8	N65	F61-N65 PolarHBondContact O-ND2 3.33Å
62	L	45.6	Very low	50.8	Low	96 Å²	96	138.8 Å²	138.8	50%	0.503	67%	0.67	S	S	.	*	H	α-helix	trans	-71.6	-40	-176.2	-156.1	155.2	0	0	0	111.9	K60 L66	K60-L62 VanDerWaalsContact C-N 3.3Å; K60-L62 PolarHBondContact O-N 2.9Å; L62-L66 PolarHBondContact O-N 2.94Å
63	F	49.4	Very low	51.8	Low	138 Å²	138	135.6 Å²	135.6	61%	0.605	65%	0.647	S	S	*	*	H	α-helix	trans	-73.9	-35.7	-178.2	-75.8	-76.4	0	0	0	114.6	L66	F63-L66 HydrophobicContact CD1-CD2 4.46Å; F63-L66 WeakPolarHBondContact O-CB 3.48Å; F63-L66 PolarHBondContact O-N 3.22Å
64	L	51.4	Low	53.1	Low	142 Å²	142	127.9 Å²	127.9	74%	0.743	62%	0.623	S	S	*	*	H	α-helix	trans	-68.1	-37.7	179	-120.9	74.6	0	0	0	112.2	L66	L64-L66 VanDerWaalsContact C-N 3.31Å; L64-L66 PolarHBondContact O-N 3.18Å
65	N	45.1	Very low	54	Low	90 Å²	90	127.5 Å²	127.5	48%	0.481	62%	0.615	S	S	.	*	H	α-helix	trans	-67.5	-32.1	174.4	-76.1	-71.5	0	0	0	112.1	F61 I67 S68 I69	F61-N65 PolarHBondContact O-ND2 3.33Å; N65-I67 VanDerWaalsContact C-N 3.3Å; N65-I67 PolarHBondContact O-N 2.83Å; N65-S68 PolarHBondContact O-N 3.22Å; N65-S68 VanDerWaalsContact O-N 3.14Å; N65-I69 HydrophobicContact CB-CD1 4.15Å; N65-I69 WeakPolarHBondContact O-CB 3.4Å; N65-I69 WeakPolarHBondContact O-CD1 3.42Å; N65-I69 VanDerWaalsContact O-CG1 3.25Å; N65-I69 WeakPolarHBondContact O-CG1 3.23Å; N65-I69 PolarHBondContact O-N 3.3Å
66	L	50	Low	55	Low	81 Å²	81	116.9 Å²	116.9	42%	0.424	58%	0.576	S	S	.	*	H	α-helix	trans	-56.8	-40.7	-176.8	-150.9	74	0	0	0	112.9	L62 F63 L64 I69 C70	L62-L66 PolarHBondContact O-N 2.94Å; F63-L66 HydrophobicContact CD1-CD2 4.46Å; F63-L66 WeakPolarHBondContact O-CB 3.48Å; F63-L66 PolarHBondContact O-N 3.22Å; L64-L66 VanDerWaalsContact C-N 3.31Å; L64-L66 PolarHBondContact O-N 3.18Å; L66-I69 PolarHBondContact O-N 2.85Å; L66-C70 PolarHBondContact O-N 2.8Å; L66-C70 PolarHBondContact O-SG 2.84Å; L66-C70 VanDerWaalsContact O-SG 3.35Å
67	I	55	Low	55.9	Low	130 Å²	130	110.7 Å²	110.7	67%	0.667	55%	0.553	S	S	*	*	H	α-helix	trans	-68.8	-41	179.8	-58.1	172.8	0	0	0	110.9	N65 C70 S71	N65-I67 VanDerWaalsContact C-N 3.3Å; N65-I67 PolarHBondContact O-N 2.83Å; I67-C70 PolarHBondContact O-N 3.37Å; I67-S71 PolarHBondContact O-N 3.29Å
68	S	59.3	Low	56.9	Low	81 Å²	81	109.7 Å²	109.7	57%	0.566	55%	0.554	S	S	*	*	H	α-helix	trans	-66.1	-38.8	175.1	-167.5	0	0	0	0	111.9	N65 S71 F72	N65-S68 PolarHBondContact O-N 3.22Å; N65-S68 VanDerWaalsContact O-N 3.14Å; S68-S71 PolarHBondContact O-N 2.83Å; S68-F72 PolarHBondContact O-N 2.92Å
69	I	63.4	Low	58.4	Low	84 Å²	84	102.6 Å²	102.6	43%	0.431	53%	0.526	S	S	.	.	H	α-helix	trans	-62.9	-42	177.4	-72.5	163.9	0	0	0	110.7	N65 L66 S71 F72 I73	N65-I69 HydrophobicContact CB-CD1 4.15Å; N65-I69 WeakPolarHBondContact O-CB 3.4Å; N65-I69 WeakPolarHBondContact O-CD1 3.42Å; N65-I69 VanDerWaalsContact O-CG1 3.25Å; N65-I69 WeakPolarHBondContact O-CG1 3.23Å; N65-I69 PolarHBondContact O-N 3.3Å; L66-I69 PolarHBondContact O-N 2.85Å; I69-S71 PolarHBondContact O-N 3.46Å; I69-F72 PolarHBondContact O-N 2.91Å; I69-I73 HydrophobicContact CG2-CD1 3.65Å; I69-I73 HydrophobicContact CG2-CG1 4.32Å; I69-I73 WeakPolarHBondContact O-CB 3.29Å; I69-I73 VanDerWaalsContact O-CG1 3.26Å; I69-I73 WeakPolarHBondContact O-CG1 3.29Å; I69-I73 PolarHBondContact O-N 2.83Å
70	C	64.5	Low	59.5	Low	84 Å²	84	98.9 Å²	98.9	57%	0.568	52%	0.517	S	S	*	.	H	α-helix	trans	-61.3	-41.2	175.3	-69.2	0	0	0	0	113.1	L66 I67 I73 G74	L66-C70 PolarHBondContact O-N 2.8Å; L66-C70 PolarHBondContact O-SG 2.84Å; L66-C70 VanDerWaalsContact O-SG 3.35Å; I67-C70 PolarHBondContact O-N 3.37Å; C70-I73 PolarHBondContact O-N 3.4Å; C70-G74 PolarHBondContact O-N 3.48Å; C70-G74 VanDerWaalsContact O-N 3.11Å
71	S	65.1	Low	60.8	Low	83 Å²	83	95 Å²	95	58%	0.58	51%	0.509	S	S	*	.	H	α-helix	trans	-64.9	-42.3	175.7	-173.8	0	0	0	0	111.9	I67 S68 I69 G74 L75	I67-S71 PolarHBondContact O-N 3.29Å; S68-S71 PolarHBondContact O-N 2.83Å; I69-S71 PolarHBondContact O-N 3.46Å; S71-G74 PolarHBondContact O-N 3.42Å; S71-L75 PolarHBondContact O-N 3.12Å; S71-L75 VanDerWaalsContact O-N 3.15Å
72	F	63.8	Low	61.8	Low	108 Å²	108	89.8 Å²	89.8	47%	0.474	49%	0.488	S	S	.	.	H	α-helix	trans	-63.6	-42.1	175.9	-168.6	-100.9	0	0	0	112.2	S68 I69 G74 L75 V76 L86	S68-F72 PolarHBondContact O-N 2.92Å; I69-F72 PolarHBondContact O-N 2.91Å; F72-G74 VanDerWaalsContact C-N 3.33Å; F72-G74 PolarHBondContact O-N 3.47Å; F72-L75 PolarHBondContact O-N 2.79Å; F72-V76 HydrophobicContact CD1-CG2 3.92Å; F72-V76 HydrophobicContact CE1-CG2 3.69Å; F72-V76 HydrophobicContact CZ-CG2 4.17Å; F72-V76 VanDerWaalsContact O-CG2 3.3Å; F72-V76 WeakPolarHBondContact O-CG2 3.36Å; F72-V76 PolarHBondContact O-N 3.32Å; F72-L86 HydrophobicContact CE1-CD1 4.32Å; F72-L86 HydrophobicContact CE1-CD2 4.33Å; F72-L86 HydrophobicContact CZ-CD1 4.47Å
73	I	64.5	Low	62.7	Low	75 Å²	75	89 Å²	89	39%	0.385	48%	0.478	S	S	.	.	H	α-helix	trans	-59.7	-42.2	175.3	-73.6	167.7	0	0	0	111.2	I69 C70 L75 V76 Y77	I69-I73 HydrophobicContact CG2-CD1 3.65Å; I69-I73 HydrophobicContact CG2-CG1 4.32Å; I69-I73 WeakPolarHBondContact O-CB 3.29Å; I69-I73 VanDerWaalsContact O-CG1 3.26Å; I69-I73 WeakPolarHBondContact O-CG1 3.29Å; I69-I73 PolarHBondContact O-N 2.83Å; C70-I73 PolarHBondContact O-N 3.4Å; I73-L75 PolarHBondContact O-N 3.19Å; I73-V76 PolarHBondContact O-N 2.79Å; I73-Y77 WeakPolarHBondContact O-CB 3.47Å; I73-Y77 PolarHBondContact O-N 3.07Å
74	G	68.7	Low	63.7	Low	36 Å²	36	86.6 Å²	86.6	37%	0.371	47%	0.472	S	S	.	.	H	α-helix	trans	-60	-43.4	174.2	0	0	0	0	0	113	C70 S71 F72 Y77 V78	C70-G74 PolarHBondContact O-N 3.48Å; C70-G74 VanDerWaalsContact O-N 3.11Å; S71-G74 PolarHBondContact O-N 3.42Å; F72-G74 VanDerWaalsContact C-N 3.33Å; F72-G74 PolarHBondContact O-N 3.47Å; G74-Y77 PolarHBondContact O-N 2.81Å; G74-V78 WeakPolarHBondContact O-CG2 3.24Å; G74-V78 PolarHBondContact O-N 3.01Å; G74-V78 VanDerWaalsContact O-N 3.11Å
75	L	66.7	Low	64.7	Low	96 Å²	96	86 Å²	86	50%	0.503	47%	0.465	S	S	.	.	H	α-helix	trans	-65.5	-39.1	176.9	-107.2	155.8	0	0	0	113.2	S71 F72 I73 S79 I82	S71-L75 PolarHBondContact O-N 3.12Å; S71-L75 VanDerWaalsContact O-N 3.15Å; F72-L75 PolarHBondContact O-N 2.79Å; I73-L75 PolarHBondContact O-N 3.19Å; L75-S79 PolarHBondContact O-N 3.44Å; L75-S79 VanDerWaalsContact O-N 3.11Å; L75-S79 PolarHBondContact O-OG 3.17Å; L75-I82 HydrophobicContact CD2-CD1 3.93Å
76	V	63.1	Low	65.7	Low	6 Å²	6	84 Å²	84	4%	0.036	45%	0.454	C	S	.	.	H	α-helix	trans	-68.4	-32.6	174.9	171.3	0	0	0	0	112	F72 I73 I82 L86 L97	F72-V76 HydrophobicContact CD1-CG2 3.92Å; F72-V76 HydrophobicContact CE1-CG2 3.69Å; F72-V76 HydrophobicContact CZ-CG2 4.17Å; F72-V76 VanDerWaalsContact O-CG2 3.3Å; F72-V76 WeakPolarHBondContact O-CG2 3.36Å; F72-V76 PolarHBondContact O-N 3.32Å; I73-V76 PolarHBondContact O-N 2.79Å; V76-I82 HydrophobicContact CG2-CG2 3.94Å; V76-L86 HydrophobicContact CG1-CD2 3.98Å; V76-L86 HydrophobicContact CG2-CD2 3.97Å; V76-L97 HydrophobicContact CG1-CD2 4Å
77	Y	69.3	Low	66.5	Low	120 Å²	120	82.1 Å²	82.1	47%	0.471	44%	0.444	S	S	.	.	H	α-helix	trans	-70.9	-44.9	177	-162	-99.3	0	0	0	111.8	I73 G74 R83	I73-Y77 WeakPolarHBondContact O-CB 3.47Å; I73-Y77 PolarHBondContact O-N 3.07Å; G74-Y77 PolarHBondContact O-N 2.81Å; Y77-R83 PolarHBondContact O-NH1 3.33Å
78	V	70.8	Confident	67.5	Low	127 Å²	127	80.2 Å²	80.2	77%	0.77	44%	0.443	S	S	*	.	H	α-helix	trans	-76.3	-33.2	-175	172.3	0	0	0	0	113.6	G74	G74-V78 WeakPolarHBondContact O-CG2 3.24Å; G74-V78 PolarHBondContact O-N 3.01Å; G74-V78 VanDerWaalsContact O-N 3.11Å
79	S	72.4	Confident	68.1	Low	25 Å²	25	86.2 Å²	86.2	18%	0.175	45%	0.454	C	S	.	.			trans	-110.3	113.7	-173.3	64.6	0	0	0	0	113.6	L75 T81 I82 R83	L75-S79 PolarHBondContact O-N 3.44Å; L75-S79 VanDerWaalsContact O-N 3.11Å; L75-S79 PolarHBondContact O-OG 3.17Å; S79-T81 PolarHBondContact O-N 3.48Å; S79-I82 PolarHBondContact O-N 2.87Å; S79-I82 WeakPolarHBondContact OG-CB 3.49Å; S79-I82 WeakPolarHBondContact OG-CD1 3.2Å; S79-I82 VanDerWaalsContact OG-CG1 3.24Å; S79-I82 WeakPolarHBondContact OG-CG1 3.49Å; S79-R83 WeakPolarHBondContact O-CB 3.29Å; S79-R83 PolarHBondContact O-N 2.84Å
80	E	71.3	Confident	68.3	Low	131 Å²	131	89 Å²	89	61%	0.612	46%	0.46	S	S	*	.	H	α-helix	trans	-63.8	-25.9	177.8	-169.3	170.2	-153.7	0	0	112.8	N84	E80-N84 WeakPolarHBondContact O-CB 3.44Å; E80-N84 PolarHBondContact O-N 2.86Å; E80-N84 VanDerWaalsContact O-N 3.07Å; E80-N84 PolarHBondContact O-ND2 3.18Å
81	T	73.1	Confident	68.2	Low	104 Å²	104	89.1 Å²	89.1	64%	0.638	46%	0.46	S	S	*	.	H	α-helix	trans	-63.2	-55.9	172.2	46.8	0	0	0	0	112	S79 R83 N84 E85	S79-T81 PolarHBondContact O-N 3.48Å; T81-R83 VanDerWaalsContact C-N 3.3Å; T81-R83 PolarHBondContact O-N 2.96Å; T81-N84 PolarHBondContact O-N 3.46Å; T81-E85 WeakPolarHBondContact O-CB 3.47Å; T81-E85 PolarHBondContact O-N 3.28Å
82	I	65.4	Low	68.3	Low	49 Å²	49	88.5 Å²	88.5	25%	0.251	45%	0.454	S	S	.	.	H	α-helix	trans	-67.4	-34.2	-179.9	-54.3	-179.2	0	0	0	110.3	L75 V76 S79 N84 E85 L86	L75-I82 HydrophobicContact CD2-CD1 3.93Å; V76-I82 HydrophobicContact CG2-CG2 3.94Å; S79-I82 PolarHBondContact O-N 2.87Å; S79-I82 WeakPolarHBondContact OG-CB 3.49Å; S79-I82 WeakPolarHBondContact OG-CD1 3.2Å; S79-I82 VanDerWaalsContact OG-CG1 3.24Å; S79-I82 WeakPolarHBondContact OG-CG1 3.49Å; I82-N84 VanDerWaalsContact C-N 3.33Å; I82-N84 PolarHBondContact O-N 2.89Å; I82-E85 PolarHBondContact O-N 3.29Å; I82-L86 WeakPolarHBondContact O-CB 3.34Å; I82-L86 PolarHBondContact O-N 3Å
83	R	65.2	Low	68.4	Low	78 Å²	78	83.9 Å²	83.9	29%	0.294	44%	0.435	S	S	.	.	H	α-helix	trans	-53	-50.6	171	-159.9	-154.2	-40.9	-69.3	-1.2	111.2	Y77 S79 T81 I87	Y77-R83 PolarHBondContact O-NH1 3.33Å; S79-R83 WeakPolarHBondContact O-CB 3.29Å; S79-R83 PolarHBondContact O-N 2.84Å; T81-R83 VanDerWaalsContact C-N 3.3Å; T81-R83 PolarHBondContact O-N 2.96Å; R83-I87 HydrophobicContact CG-CD1 4.27Å; R83-I87 WeakPolarHBondContact O-CB 3.2Å; R83-I87 WeakPolarHBondContact O-CD1 3.32Å; R83-I87 WeakPolarHBondContact O-CG1 3.27Å; R83-I87 PolarHBondContact O-N 3.02Å
84	N	69.3	Low	68.3	Low	88 Å²	88	85.7 Å²	85.7	47%	0.471	44%	0.44	S	S	.	.	H	α-helix	trans	-73.6	-35.3	-177.6	-68.9	-19.7	0	0	0	112.6	E80 T81 I82 I87 S88	E80-N84 WeakPolarHBondContact O-CB 3.44Å; E80-N84 PolarHBondContact O-N 2.86Å; E80-N84 VanDerWaalsContact O-N 3.07Å; E80-N84 PolarHBondContact O-ND2 3.18Å; T81-N84 PolarHBondContact O-N 3.46Å; I82-N84 VanDerWaalsContact C-N 3.33Å; I82-N84 PolarHBondContact O-N 2.89Å; N84-I87 PolarHBondContact O-N 2.81Å; N84-S88 PolarHBondContact O-N 2.86Å
85	E	73.8	Confident	68.2	Low	130 Å²	130	91.7 Å²	91.7	61%	0.607	46%	0.459	S	S	*	.	H	α-helix	trans	-68.1	-43.1	176.5	-166.3	165.4	-154.6	0	0	111.6	T81 I82 S88 Y89	T81-E85 WeakPolarHBondContact O-CB 3.47Å; T81-E85 PolarHBondContact O-N 3.28Å; I82-E85 PolarHBondContact O-N 3.29Å; E85-S88 PolarHBondContact O-N 3.49Å; E85-S88 VanDerWaalsContact O-N 3.16Å; E85-S88 PolarHBondContact O-OG 3.2Å; E85-Y89 PolarHBondContact O-N 2.84Å
86	L	65.9	Low	68.1	Low	47 Å²	47	92.1 Å²	92.1	25%	0.246	46%	0.461	C	S	.	.	H	α-helix	trans	-64.8	-39	173.8	-170.3	69.1	0	0	0	112	F72 V76 I82 S88 Y89 Y90	F72-L86 HydrophobicContact CE1-CD1 4.32Å; F72-L86 HydrophobicContact CE1-CD2 4.33Å; F72-L86 HydrophobicContact CZ-CD1 4.47Å; V76-L86 HydrophobicContact CG1-CD2 3.98Å; V76-L86 HydrophobicContact CG2-CD2 3.97Å; I82-L86 WeakPolarHBondContact O-CB 3.34Å; I82-L86 PolarHBondContact O-N 3Å; L86-S88 VanDerWaalsContact C-N 3.29Å; L86-S88 PolarHBondContact O-N 2.96Å; L86-Y89 PolarHBondContact O-N 3.1Å; L86-Y90 PolarHBondContact O-N 2.8Å
87	I	66.1	Low	68.1	Low	42 Å²	42	94.1 Å²	94.1	22%	0.215	47%	0.471	C	S	.	.	H	α-helix	trans	-63.5	-34.1	173	-77	168.4	0	0	0	111.9	R83 N84 K94	R83-I87 HydrophobicContact CG-CD1 4.27Å; R83-I87 WeakPolarHBondContact O-CB 3.2Å; R83-I87 WeakPolarHBondContact O-CD1 3.32Å; R83-I87 WeakPolarHBondContact O-CG1 3.27Å; R83-I87 PolarHBondContact O-N 3.02Å; N84-I87 PolarHBondContact O-N 2.81Å; I87-K94 HydrophobicContact CD1-CG 4.44Å; I87-K94 HydrophobicContact CG1-CG 4.17Å
88	S	75.2	Confident	67.9	Low	90 Å²	90	94.8 Å²	94.8	63%	0.629	48%	0.476	S	S	*	.	H	α-helix	trans	-73.5	-36.7	176.9	78.6	0	0	0	0	113	N84 E85 L86	N84-S88 PolarHBondContact O-N 2.86Å; E85-S88 PolarHBondContact O-N 3.49Å; E85-S88 VanDerWaalsContact O-N 3.16Å; E85-S88 PolarHBondContact O-OG 3.2Å; L86-S88 VanDerWaalsContact C-N 3.29Å; L86-S88 PolarHBondContact O-N 2.96Å
89	Y	72.5	Confident	67.6	Low	208 Å²	208	94.9 Å²	94.9	82%	0.816	47%	0.471	S	S	*	.	H	α-helix	trans	-89.3	-25.7	-174.6	-139.6	-83.6	0	0	0	113.6	E85 L86	E85-Y89 PolarHBondContact O-N 2.84Å; L86-Y89 PolarHBondContact O-N 3.1Å
90	Y	66.9	Low	67.1	Low	142 Å²	142	96.1 Å²	96.1	56%	0.557	48%	0.476	S	S	*	.			trans	-144.7	81.9	179.1	-160.5	-105.9	0	0	0	112.8	L86 P92 S93	L86-Y90 PolarHBondContact O-N 2.8Å; Y90-P92 VanDerWaalsContact C-N 3.35Å; Y90-P92 HydrophobicContact CD1-CB 4.24Å; Y90-P92 HydrophobicContact CD1-CG 4.32Å; Y90-P92 HydrophobicContact CE1-CB 3.76Å; Y90-P92 HydrophobicContact CE1-CG 3.91Å; Y90-P92 VanDerWaalsContact O-N 3.16Å; Y90-S93 VanDerWaalsContact O-CB 3.24Å; Y90-S93 WeakPolarHBondContact O-CB 3.31Å; Y90-S93 PolarHBondContact O-N 3.29Å; Y90-S93 PolarHBondContact O-OG 3.09Å
91	P	62.6	Low	66.6	Low	87 Å²	87	95.5 Å²	95.5	57%	0.565	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-30.4	-175.6	12.5	-23.6	0	0	0	117	S93 K94	P91-S93 PolarHBondContact O-N 3.05Å; P91-S93 VanDerWaalsContact O-N 3.1Å; P91-K94 PolarHBondContact O-N 2.89Å
92	P	66.7	Low	66.3	Low	70 Å²	70	97.1 Å²	97.1	46%	0.455	48%	0.478	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-14.8	174.5	-22.8	33.9	0	0	0	114.6	Y90 K94 E95	Y90-P92 VanDerWaalsContact C-N 3.35Å; Y90-P92 HydrophobicContact CD1-CB 4.24Å; Y90-P92 HydrophobicContact CD1-CG 4.32Å; Y90-P92 HydrophobicContact CE1-CB 3.76Å; Y90-P92 HydrophobicContact CE1-CG 3.91Å; Y90-P92 VanDerWaalsContact O-N 3.16Å; P92-K94 PolarHBondContact O-N 3.07Å; P92-E95 PolarHBondContact O-N 2.74Å
93	S	66.4	Low	65.9	Low	11 Å²	11	99.3 Å²	99.3	8%	0.077	50%	0.497	C	S	.	.	H	α-helix	trans	-58.7	-26.7	172.7	60.9	0	0	0	0	113.1	Y90 P91 E95 I96 L97	Y90-S93 VanDerWaalsContact O-CB 3.24Å; Y90-S93 WeakPolarHBondContact O-CB 3.31Å; Y90-S93 PolarHBondContact O-N 3.29Å; Y90-S93 PolarHBondContact O-OG 3.09Å; P91-S93 PolarHBondContact O-N 3.05Å; P91-S93 VanDerWaalsContact O-N 3.1Å; S93-E95 VanDerWaalsContact C-N 3.31Å; S93-E95 PolarHBondContact O-N 2.66Å; S93-I96 PolarHBondContact O-N 2.8Å; S93-L97 WeakPolarHBondContact O-CB 3.38Å; S93-L97 VanDerWaalsContact O-CG 3.25Å; S93-L97 WeakPolarHBondContact O-CG 3.29Å; S93-L97 PolarHBondContact O-N 3.23Å
94	K	62.7	Low	65.4	Low	113 Å²	113	100 Å²	100	49%	0.491	51%	0.51	S	S	.	.	H	α-helix	trans	-57.5	-38.4	-179.5	-85.3	-177.6	168.9	170.3	0	113.8	I87 P91 P92 K98	I87-K94 HydrophobicContact CD1-CG 4.44Å; I87-K94 HydrophobicContact CG1-CG 4.17Å; P91-K94 PolarHBondContact O-N 2.89Å; P92-K94 PolarHBondContact O-N 3.07Å; K94-K98 WeakPolarHBondContact O-CB 3.4Å; K94-K98 WeakPolarHBondContact O-CG 3.49Å; K94-K98 PolarHBondContact O-N 2.81Å
95	E	67.7	Low	64.1	Low	161 Å²	161	98.2 Å²	98.2	75%	0.752	51%	0.512	S	S	*	.	H	α-helix	trans	-76	-40.7	-179.4	-62.8	-163.5	151.2	0	0	111.7	P92 S93 K98 L99	P92-E95 PolarHBondContact O-N 2.74Å; S93-E95 VanDerWaalsContact C-N 3.31Å; S93-E95 PolarHBondContact O-N 2.66Å; E95-K98 PolarHBondContact O-N 2.77Å; E95-L99 WeakPolarHBondContact O-CB 3.28Å; E95-L99 PolarHBondContact O-N 3.45Å
96	I	64.4	Low	62.6	Low	106 Å²	106	95.6 Å²	95.6	54%	0.544	52%	0.52	S	S	.	.	H	α-helix	trans	-63.3	-43.9	176.3	-57.7	173.8	0	0	0	110.1	S93 L99 I100	S93-I96 PolarHBondContact O-N 2.8Å; I96-L99 PolarHBondContact O-N 3.48Å; I96-I100 HydrophobicContact CG2-CD1 4.05Å; I96-I100 VanDerWaalsContact O-CG1 3.3Å; I96-I100 WeakPolarHBondContact O-CG1 3.19Å; I96-I100 PolarHBondContact O-N 2.94Å
97	L	62.7	Low	61.1	Low	47 Å²	47	104.8 Å²	104.8	25%	0.246	55%	0.552	C	S	.	*	H	α-helix	trans	-64.2	-44.2	176.4	-71.3	168.9	0	0	0	111.7	V76 S93 L99 I100 E101	V76-L97 HydrophobicContact CG1-CD2 4Å; S93-L97 WeakPolarHBondContact O-CB 3.38Å; S93-L97 VanDerWaalsContact O-CG 3.25Å; S93-L97 WeakPolarHBondContact O-CG 3.29Å; S93-L97 PolarHBondContact O-N 3.23Å; L97-L99 VanDerWaalsContact C-N 3.34Å; L97-L99 PolarHBondContact O-N 3.41Å; L97-I100 PolarHBondContact O-N 3.23Å; L97-E101 VanDerWaalsContact O-CB 3.28Å; L97-E101 WeakPolarHBondContact O-CB 3.24Å; L97-E101 PolarHBondContact O-N 3.18Å
98	K	64	Low	59.7	Low	134 Å²	134	113.4 Å²	113.4	58%	0.583	58%	0.583	S	S	*	*	H	α-helix	trans	-62.5	-36.7	173.9	-81	-177.3	171.8	-169	0	113.3	K94 E95 I100 E101 N102	K94-K98 WeakPolarHBondContact O-CB 3.4Å; K94-K98 WeakPolarHBondContact O-CG 3.49Å; K94-K98 PolarHBondContact O-N 2.81Å; E95-K98 PolarHBondContact O-N 2.77Å; K98-I100 VanDerWaalsContact C-N 3.34Å; K98-E101 PolarHBondContact O-N 3.14Å; K98-N102 VanDerWaalsContact O-CB 3.31Å; K98-N102 WeakPolarHBondContact O-CB 3.37Å; K98-N102 VanDerWaalsContact O-CG 3.26Å; K98-N102 PolarHBondContact O-N 2.83Å
99	L	65	Low	57.9	Low	129 Å²	129	114.2 Å²	114.2	68%	0.675	59%	0.589	S	S	*	*	H	α-helix	trans	-66.2	-38.7	176.8	-163.2	80.5	0	0	0	111.3	E95 I96 L97 S103	E95-L99 WeakPolarHBondContact O-CB 3.28Å; E95-L99 PolarHBondContact O-N 3.45Å; I96-L99 PolarHBondContact O-N 3.48Å; L97-L99 VanDerWaalsContact C-N 3.34Å; L97-L99 PolarHBondContact O-N 3.41Å; L99-S103 WeakPolarHBondContact O-CB 3.14Å; L99-S103 PolarHBondContact O-N 2.63Å; L99-S103 PolarHBondContact O-OG 3.1Å
100	I	62.8	Low	55.9	Low	51 Å²	51	108.3 Å²	108.3	26%	0.262	59%	0.591	S	S	.	*	H	α-helix	trans	-68.5	-46.4	174	-67	165.2	0	0	0	110.3	I96 L97 K98 N102 S103 V104	I96-I100 HydrophobicContact CG2-CD1 4.05Å; I96-I100 VanDerWaalsContact O-CG1 3.3Å; I96-I100 WeakPolarHBondContact O-CG1 3.19Å; I96-I100 PolarHBondContact O-N 2.94Å; L97-I100 PolarHBondContact O-N 3.23Å; K98-I100 VanDerWaalsContact C-N 3.34Å; I100-N102 VanDerWaalsContact C-N 3.35Å; I100-N102 PolarHBondContact O-N 2.9Å; I100-S103 WeakPolarHBondContact CA-OG 3.24Å; I100-S103 PolarHBondContact O-N 3.4Å; I100-S103 PolarHBondContact O-OG 2.82Å; I100-V104 HydrophobicContact CG2-CG2 4.04Å; I100-V104 WeakPolarHBondContact O-CB 3.25Å; I100-V104 VanDerWaalsContact O-CG2 3.3Å; I100-V104 WeakPolarHBondContact O-CG2 3.36Å; I100-V104 PolarHBondContact O-N 3.49Å
101	E	60.9	Low	54.1	Low	118 Å²	118	107 Å²	107	55%	0.551	60%	0.603	S	S	*	*	H	α-helix	trans	-58.9	-43.6	178.8	-170.4	166.9	-144.8	0	0	111.9	L97 K98 S103	L97-E101 VanDerWaalsContact O-CB 3.28Å; L97-E101 WeakPolarHBondContact O-CB 3.24Å; L97-E101 PolarHBondContact O-N 3.18Å; K98-E101 PolarHBondContact O-N 3.14Å; E101-S103 VanDerWaalsContact C-N 3.34Å; E101-S103 PolarHBondContact O-N 2.94Å
102	N	65.7	Low	52.8	Low	139 Å²	139	111.9 Å²	111.9	74%	0.743	62%	0.615	S	S	*	*	H	α-helix	trans	-70.5	-21.9	175	-73.1	-9.5	0	0	0	114.3	K98 I100	K98-N102 VanDerWaalsContact O-CB 3.31Å; K98-N102 WeakPolarHBondContact O-CB 3.37Å; K98-N102 VanDerWaalsContact O-CG 3.26Å; K98-N102 PolarHBondContact O-N 2.83Å; I100-N102 VanDerWaalsContact C-N 3.35Å; I100-N102 PolarHBondContact O-N 2.9Å
103	S	58.2	Low	51	Low	95 Å²	95	115.1 Å²	115.1	66%	0.664	63%	0.634	S	S	*	*	H	α-helix	trans	-99.3	-15.4	-178.7	52.8	0	0	0	0	114.4	L99 I100 E101	L99-S103 WeakPolarHBondContact O-CB 3.14Å; L99-S103 PolarHBondContact O-N 2.63Å; L99-S103 PolarHBondContact O-OG 3.1Å; I100-S103 WeakPolarHBondContact CA-OG 3.24Å; I100-S103 PolarHBondContact O-N 3.4Å; I100-S103 PolarHBondContact O-OG 2.82Å; E101-S103 VanDerWaalsContact C-N 3.34Å; E101-S103 PolarHBondContact O-N 2.94Å
104	V	54.2	Low	49.4	Very low	91 Å²	91	123.3 Å²	123.3	55%	0.552	67%	0.671	S	S	*	*	H	α-helix	trans	-96.6	-9.8	-178.9	175.6	0	0	0	0	113.3	I100	I100-V104 HydrophobicContact CG2-CG2 4.04Å; I100-V104 WeakPolarHBondContact O-CB 3.25Å; I100-V104 VanDerWaalsContact O-CG2 3.3Å; I100-V104 WeakPolarHBondContact O-CG2 3.36Å; I100-V104 PolarHBondContact O-N 3.49Å
105	G	42.4	Very low	47.8	Very low	51 Å²	51	126.4 Å²	126.4	53%	0.526	69%	0.687	S	S	.	*			trans	72.7	62.7	150.9	0	0	0	0	0	117.6
106	G	41.3	Very low	46.1	Very low	75 Å²	75	123.5 Å²	123.5	77%	0.773	69%	0.685	S	S	*	*			trans	58.8	76.2	147	0	0	0	0	0	118.5
107	W	35.9	Very low	44.6	Very low	241 Å²	241	125.1 Å²	125.1	91%	0.913	70%	0.699	S	S	*	*			trans	-120.8	13.7	173.9	-93.7	68.8	0	0	0	115.5
108	Y	35	Very low	43.5	Very low	222 Å²	222	128 Å²	128	87%	0.871	72%	0.719	S	S	*	*			trans	-117.3	103.2	167.5	-100.6	-92	0	0	0	110.3
109	S	38.5	Very low	42	Very low	108 Å²	108	126.7 Å²	126.7	76%	0.755	72%	0.724	S	S	*	*			trans	-72	148.6	168.8	51.2	0	0	0	0	110.7	S111	S109-S111 PolarHBondContact O-N 3.06Å; S109-S111 VanDerWaalsContact O-N 3.08Å
110	G	30.8	Very low	40.4	Very low	84 Å²	84	128 Å²	128	87%	0.866	74%	0.736	S	S	*	*			trans	-71.8	101.4	-174.2	0	0	0	0	0	113.3
111	S	29.4	Very low	38.8	Very low	114 Å²	114	130 Å²	130	80%	0.797	76%	0.755	S	S	*	*			trans	-100.5	43.4	163.2	55	0	0	0	0	112	S109	S109-S111 PolarHBondContact O-N 3.06Å; S109-S111 VanDerWaalsContact O-N 3.08Å
112	K	33.6	Very low	37.6	Very low	189 Å²	189	132.2 Å²	132.2	82%	0.822	77%	0.771	S	S	*	*			trans	-105.4	113	162	-80.8	-175.2	176.5	176.5	0	108.9	E114	K112-E114 VanDerWaalsContact C-N 3.28Å; K112-E114 PolarHBondContact O-N 2.99Å
113	T	29.4	Very low	36.4	Very low	139 Å²	139	135.4 Å²	135.4	85%	0.853	78%	0.778	S	S	*	*			trans	-67.3	86.8	166.9	11.3	0	0	0	0	109.1	Q115	T113-Q115 PolarHBondContact O-N 3.44Å
114	E	32.1	Very low	35.5	Very low	183 Å²	183	137 Å²	137	86%	0.855	79%	0.787	S	S	*	*			trans	-65.6	103.2	160	-69.8	-169.6	146.9	0	0	107.6	K112 S116	K112-E114 VanDerWaalsContact C-N 3.28Å; K112-E114 PolarHBondContact O-N 2.99Å; E114-S116 VanDerWaalsContact C-N 3.33Å; E114-S116 PolarHBondContact O-N 2.78Å
115	Q	29.8	Very low	34.8	Very low	178 Å²	178	140.3 Å²	140.3	83%	0.832	80%	0.8	S	S	*	*			trans	-66.7	97.9	168.9	-70.2	-179.2	-84	0	0	107.6	T113 V117	T113-Q115 PolarHBondContact O-N 3.44Å; Q115-V117 PolarHBondContact O-N 3.48Å
116	S	32.6	Very low	34.8	Very low	100 Å²	100	142.8 Å²	142.8	70%	0.699	81%	0.807	S	S	*	*			trans	-51.5	122.6	167.3	-176.5	0	0	0	0	108.6	E114 V118	E114-S116 VanDerWaalsContact C-N 3.33Å; E114-S116 PolarHBondContact O-N 2.78Å; S116-V118 PolarHBondContact O-N 3.09Å
117	V	32.8	Very low	34.6	Very low	139 Å²	139	144.5 Å²	144.5	84%	0.842	81%	0.805	S	S	*	*			trans	-77.5	80.3	178.4	-177.3	0	0	0	0	107.9	Q115	Q115-V117 PolarHBondContact O-N 3.48Å
118	V	40.2	Very low	34.3	Very low	109 Å²	109	142.1 Å²	142.1	66%	0.661	80%	0.801	S	S	*	*			trans	-59.3	136.8	168.2	-179.7	0	0	0	0	108.1	S116	S116-V118 PolarHBondContact O-N 3.09Å
119	P	31.1	Very low	34.2	Very low	105 Å²	105	142.9 Å²	142.9	68%	0.682	80%	0.802	S	S	*	*			trans	-60.6	158.1	179.3	24.8	-35.1	0	0	0	112.7	S121	P119-S121 PolarHBondContact O-N 2.92Å
120	V	31	Very low	33.8	Very low	156 Å²	156	144.3 Å²	144.3	95%	0.945	80%	0.801	S	S	*	*	S	Bend	trans	-72.8	88.2	-170.9	-176.5	0	0	0	0	111.9
121	S	31.1	Very low	33.8	Very low	94 Å²	94	146 Å²	146	66%	0.657	80%	0.8	S	S	*	*			trans	-163.6	97.1	163.7	57.2	0	0	0	0	111.8	P119	P119-S121 PolarHBondContact O-N 2.92Å
122	D	35.1	Very low	34	Very low	164 Å²	164	149 Å²	149	88%	0.877	80%	0.801	S	S	*	*			trans	-177.1	112.5	146.1	-98.5	-21.9	0	0	0	110.4
123	F	39.1	Very low	33.7	Very low	206 Å²	206	144.9 Å²	144.9	90%	0.904	80%	0.797	S	S	*	*			trans	-100.8	117.2	171.3	-97.9	-80.8	0	0	0	109.5	L125	F123-L125 PolarHBondContact O-N 3.26Å; F123-L125 VanDerWaalsContact O-N 3.1Å
124	P	41.2	Very low	33.7	Very low	129 Å²	129	143.9 Å²	143.9	84%	0.838	79%	0.79	S	S	*	*			trans	-75.8	103.2	179.4	-4.7	19	0	0	0	111.8
125	L	38.1	Very low	33.7	Very low	160 Å²	160	140.8 Å²	140.8	84%	0.838	79%	0.789	S	S	*	*			trans	-87.3	157.1	149.5	-73.4	165	0	0	0	108.7	F123	F123-L125 PolarHBondContact O-N 3.26Å; F123-L125 VanDerWaalsContact O-N 3.1Å
126	P	43	Very low	33.8	Very low	104 Å²	104	140.7 Å²	140.7	68%	0.675	79%	0.788	S	S	*	*			cis	-122.2	-153	-13	32.6	-10	0	0	0	110.3
127	P	36.2	Very low	33.8	Very low	110 Å²	110	143 Å²	143	71%	0.714	80%	0.798	S	S	*	*				-135.7	142.3	81.3	36.5	-24.3	0	0	0	113.9	R129	P127-R129 PolarHBondContact O-N 3.34Å
128	K	30.4	Very low	33.9	Very low	191 Å²	191	145.4 Å²	145.4	83%	0.83	80%	0.797	S	S	*	*			trans	-64.3	116.9	159	-74.3	-176.2	176.3	-178.8	0	107.4	N130	K128-N130 PolarHBondContact O-N 3Å
129	R	32.6	Very low	33.3	Very low	238 Å²	238	145.8 Å²	145.8	90%	0.898	81%	0.805	S	S	*	*			trans	-78.2	114.1	167.5	-85.8	-172.8	171.8	170.7	-1.3	108.8	P127	P127-R129 PolarHBondContact O-N 3.34Å
130	N	29.7	Very low	33.4	Very low	138 Å²	138	147.9 Å²	147.9	74%	0.738	82%	0.815	S	S	*	*			trans	-63	137.1	170.4	-59.7	-21.3	0	0	0	109.2	K128 E132	K128-N130 PolarHBondContact O-N 3Å; N130-E132 PolarHBondContact O-N 3.39Å
131	S	31.5	Very low	33.5	Very low	120 Å²	120	144.5 Å²	144.5	84%	0.839	80%	0.803	S	S	*	*			trans	-83	90.2	171.9	53.2	0	0	0	0	109.7	S133	S131-S133 PolarHBondContact O-N 2.83Å; S131-S133 VanDerWaalsContact O-N 3.16Å
132	E	33.9	Very low	33.4	Very low	176 Å²	176	145.7 Å²	145.7	82%	0.822	81%	0.812	S	S	*	*			trans	-73.2	105.4	175.6	-70.1	-174.9	140	0	0	111.5	N130	N130-E132 PolarHBondContact O-N 3.39Å
133	S	27.4	Very low	33.5	Very low	104 Å²	104	143.6 Å²	143.6	73%	0.727	81%	0.807	S	S	*	*			trans	26.5	137	134.4	-52.4	0	0	0	0	121.1	S131	S131-S133 PolarHBondContact O-N 2.83Å; S131-S133 VanDerWaalsContact O-N 3.16Å
134	T	28.6	Very low	33.3	Very low	117 Å²	117	142.7 Å²	142.7	72%	0.718	81%	0.806	S	S	*	*			trans	91.6	104.8	149.4	-35.5	0	0	0	0	117.9
135	S	32.8	Very low	33	Very low	119 Å²	119	142.2 Å²	142.2	83%	0.832	80%	0.803	S	S	*	*			trans	-159.4	96.5	130.2	-85.7	0	0	0	0	112.4
136	Q	30.7	Very low	32.8	Very low	175 Å²	175	140.2 Å²	140.2	82%	0.818	80%	0.797	S	S	*	*			trans	-9.3	128.1	155.8	-56.4	171.5	0.8	0	0	117.9
137	V	32.4	Very low	32	Very low	149 Å²	149	143 Å²	143	90%	0.903	80%	0.804	S	S	*	*			trans	-121.8	143.8	143.7	180	0	0	0	0	107.6
138	K	35.8	Very low	31.8	Very low	190 Å²	190	144.5 Å²	144.5	83%	0.826	81%	0.805	S	S	*	*			trans	-81.2	150.1	-162	-67.7	174.7	178.5	174.5	0	113.6
139	S	28.4	Very low	31.6	Very low	117 Å²	117	145 Å²	145	82%	0.818	81%	0.807	S	S	*	*			trans	-71.1	146.2	160.8	47.8	0	0	0	0	111.9
140	V	32.2	Very low	31.5	Very low	148 Å²	148	143.2 Å²	143.2	90%	0.897	81%	0.806	S	S	*	*			trans	-136	143.2	157.3	179.4	0	0	0	0	105.6
141	A	32.5	Very low	31.4	Very low	85 Å²	85	145.9 Å²	145.9	70%	0.702	81%	0.811	S	S	*	*			trans	-128.4	156.6	-165.5	0	0	0	0	0	113.7
142	S	30.8	Very low	31.3	Very low	120 Å²	120	149.5 Å²	149.5	84%	0.839	81%	0.814	S	S	*	*			trans	68.9	160.9	166.7	-67.3	0	0	0	0	117.8
143	P	36.2	Very low	31.5	Very low	120 Å²	120	145.4 Å²	145.4	78%	0.779	81%	0.805	S	S	*	*			cis	-117.6	178.1	-3.2	26.8	-6	0	0	0	114.6
144	E	34.9	Very low	32	Very low	186 Å²	186	142.8 Å²	142.8	87%	0.869	78%	0.783	S	S	*	*			trans	-60.2	162.4	170.7	-56.6	176.2	116.6	0	0	112.9
145	P	35.4	Very low	32.4	Very low	119 Å²	119	139.5 Å²	139.5	77%	0.773	76%	0.764	S	S	*	*				-141.9	137.9	117.3	34.2	-20.3	0	0	0	116.7
146	V	32.5	Very low	32.7	Very low	118 Å²	118	137.1 Å²	137.1	72%	0.715	74%	0.744	S	S	*	*			trans	62.5	112.4	140.7	-175.7	0	0	0	0	119	I148	V146-I148 HydrophobicContact CG1-CG1 4.2Å; V146-I148 PolarHBondContact O-N 2.8Å
147	I	27.1	Very low	33.5	Very low	162 Å²	162	131.5 Å²	131.5	83%	0.831	72%	0.721	S	S	*	*			trans	-60.5	114.5	166.9	-60	159.6	0	0	0	110.9
148	I	32.5	Very low	34.3	Very low	143 Å²	143	129.3 Å²	129.3	73%	0.733	70%	0.701	S	S	*	*			trans	-117.4	117.6	164.6	-59.4	-177.9	0	0	0	109	V146 K150	V146-I148 HydrophobicContact CG1-CG1 4.2Å; V146-I148 PolarHBondContact O-N 2.8Å; I148-K150 PolarHBondContact O-N 3.47Å
149	K	25.8	Very low	34.9	Very low	201 Å²	201	125.3 Å²	125.3	87%	0.874	69%	0.685	S	S	*	*			trans	-65.9	101.1	178.7	-65.2	175	179.6	176.2	0	110.5
150	K	29.4	Very low	35.9	Very low	201 Å²	201	122.2 Å²	122.2	87%	0.874	66%	0.662	S	S	*	*			trans	-92.9	136.2	170.7	-118.1	175.7	-179.9	178.4	0	110.6	I148	I148-K150 PolarHBondContact O-N 3.47Å
151	K	28	Very low	36.7	Very low	193 Å²	193	120.5 Å²	120.5	84%	0.839	64%	0.642	S	S	*	*			trans	-85.3	166.5	175.4	-65.1	178.6	178.6	178.8	0	110.1	S153	K151-S153 PolarHBondContact O-N 3.13Å
152	H	29.3	Very low	37.3	Very low	197 Å²	197	120.5 Å²	120.5	91%	0.912	63%	0.63	S	S	*	*			trans	-38.4	129.1	-172.7	-58.1	-65.4	0	0	0	115.5
153	S	38.3	Very low	37.5	Very low	90 Å²	90	120.1 Å²	120.1	63%	0.629	62%	0.617	S	S	*	*			trans	-135.8	147.4	156.1	51.2	0	0	0	0	106.6	K151	K151-S153 PolarHBondContact O-N 3.13Å
154	L	38.4	Very low	37.9	Very low	48 Å²	48	117 Å²	117	25%	0.251	60%	0.596	S	S	.	*	P	Polyproline II helix	trans	-46.6	140.8	170	-77.2	140.4	0	0	0	110.5	T156 E242 Q303	L154-T156 PolarHBondContact O-N 3.45Å; L154-E242 HydrophobicContact CD1-CG 4.26Å; L154-E242 HydrophobicContact CD2-CG 3.96Å; L154-E242 HydrophobicContact CG-CG 3.97Å; L154-Q303 HydrophobicContact CD1-CG 3.99Å
155	P	36.6	Very low	38.2	Very low	49 Å²	49	114 Å²	114	32%	0.318	58%	0.582	S	S	.	*	P	Polyproline II helix	trans	-60.8	134.6	176	27.1	-34.4	0	0	0	109.5	V160	P155-V160 HydrophobicContact CB-CG2 3.86Å; P155-V160 HydrophobicContact CG-CG2 3.83Å
156	T	39.8	Very low	38.3	Very low	69 Å²	69	116.4 Å²	116.4	42%	0.423	58%	0.58	S	S	.	*	P	Polyproline II helix	trans	-60.1	146	177.6	-45.8	0	0	0	0	109	L154 E158 E159 V160	L154-T156 PolarHBondContact O-N 3.45Å; T156-E158 HydrophobicContact CG2-CB 4.33Å; T156-E158 PolarHBondContact O-N 3.06Å; T156-E159 WeakPolarHBondContact CB-OE2 3.25Å; T156-E159 PolarHBondContact N-OE2 3.29Å; T156-E159 WeakPolarHBondContact O-CA 3.39Å; T156-E159 WeakPolarHBondContact O-CB 3.39Å; T156-E159 PolarHBondContact O-N 2.85Å; T156-E159 PolarHBondContact OG1-OE2 2.75Å; T156-V160 PolarHBondContact O-N 3Å
157	V	48.3	Very low	38.4	Very low	56 Å²	56	117.4 Å²	117.4	34%	0.339	57%	0.571	S	S	.	*	H	α-helix	trans	-55.4	-27.7	176.6	-178.6	0	0	0	0	111.6	K161 I296 E398	V157-K161 WeakPolarHBondContact O-CB 3.17Å; V157-K161 PolarHBondContact O-N 3.06Å; V157-I296 HydrophobicContact CG2-CG2 4.32Å; V157-E398 WeakPolarHBondContact CG2-OE1 3.33Å
158	E	47.2	Very low	38.8	Very low	104 Å²	104	116 Å²	116	49%	0.486	57%	0.565	S	S	.	*	H	α-helix	trans	-77	-32.2	174.1	-58.1	-174.3	147.5	0	0	112.8	T156 K161 D162 K401	T156-E158 HydrophobicContact CG2-CB 4.33Å; T156-E158 PolarHBondContact O-N 3.06Å; E158-K161 PolarHBondContact O-N 3.37Å; E158-D162 WeakPolarHBondContact O-CB 3.15Å; E158-D162 PolarHBondContact O-N 3.41Å; E158-K401 IonicContact OE1-NZ 3.91Å; E158-K401 PolarHBondContact OE1-NZ 3.3Å
159	E	48.9	Very low	39	Very low	105 Å²	105	117.9 Å²	117.9	49%	0.491	57%	0.57	S	S	.	*	H	α-helix	trans	-72.8	-38	171.6	-69.7	171.4	114.6	0	0	112.3	T156 K161 D162 M163	T156-E159 WeakPolarHBondContact CB-OE2 3.25Å; T156-E159 PolarHBondContact N-OE2 3.29Å; T156-E159 WeakPolarHBondContact O-CA 3.39Å; T156-E159 WeakPolarHBondContact O-CB 3.39Å; T156-E159 PolarHBondContact O-N 2.85Å; T156-E159 PolarHBondContact OG1-OE2 2.75Å; E159-K161 PolarHBondContact O-N 2.96Å; E159-D162 PolarHBondContact O-N 3.05Å; E159-M163 WeakPolarHBondContact O-CB 3.38Å; E159-M163 WeakPolarHBondContact O-CG 3.5Å; E159-M163 PolarHBondContact O-N 3Å
160	V	50.9	Low	40	Very low	53 Å²	53	113.1 Å²	113.1	32%	0.321	56%	0.558	S	S	.	*	H	α-helix	trans	-59.8	-37	171.9	179.8	0	0	0	0	110.2	P155 T156 M163 T164	P155-V160 HydrophobicContact CB-CG2 3.86Å; P155-V160 HydrophobicContact CG-CG2 3.83Å; T156-V160 PolarHBondContact O-N 3Å; V160-M163 PolarHBondContact O-N 2.77Å; V160-T164 PolarHBondContact O-N 3.48Å
161	K	48.1	Very low	40.6	Very low	111 Å²	111	109.1 Å²	109.1	48%	0.483	56%	0.555	S	S	.	*	H	α-helix	trans	-75.9	-40.8	177.4	-168.1	169	-179.5	-69.6	0	113.3	V157 E158 E159 M163 T164 E165	V157-K161 WeakPolarHBondContact O-CB 3.17Å; V157-K161 PolarHBondContact O-N 3.06Å; E158-K161 PolarHBondContact O-N 3.37Å; E159-K161 PolarHBondContact O-N 2.96Å; K161-M163 PolarHBondContact O-N 3.43Å; K161-T164 PolarHBondContact O-N 3.17Å; K161-T164 PolarHBondContact O-OG1 3.13Å; K161-E165 IonicContact NZ-OE1 2.84Å; K161-E165 PolarHBondContact NZ-OE1 3.46Å; K161-E165 PolarHBondContact O-N 3.48Å
162	D	44.2	Very low	41.4	Very low	85 Å²	85	102.1 Å²	102.1	46%	0.455	53%	0.529	S	S	.	.	H	α-helix	trans	-64.7	-20.7	171.4	-85.1	27.9	0	0	0	112.6	E158 E159 K166	E158-D162 WeakPolarHBondContact O-CB 3.15Å; E158-D162 PolarHBondContact O-N 3.41Å; E159-D162 PolarHBondContact O-N 3.05Å; D162-K166 WeakPolarHBondContact O-CD 3.35Å; D162-K166 WeakPolarHBondContact O-CG 3.36Å
163	M	36.9	Very low	42.3	Very low	113 Å²	113	100.3 Å²	100.3	56%	0.557	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	-14.1	169.9	-76.5	-163.2	72.3	0	0	114.2	E159 V160 K161 R167	E159-M163 WeakPolarHBondContact O-CB 3.38Å; E159-M163 WeakPolarHBondContact O-CG 3.5Å; E159-M163 PolarHBondContact O-N 3Å; V160-M163 PolarHBondContact O-N 2.77Å; K161-M163 PolarHBondContact O-N 3.43Å; M163-R167 WeakPolarHBondContact O-CG 3.23Å; M163-R167 PolarHBondContact O-NH1 3.47Å
164	T	43.5	Very low	43	Very low	55 Å²	55	101.4 Å²	101.4	34%	0.337	53%	0.53	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.7	-35.1	168.4	51.8	0	0	0	0	111.9	V160 K161 K166 R167	V160-T164 PolarHBondContact O-N 3.48Å; K161-T164 PolarHBondContact O-N 3.17Å; K161-T164 PolarHBondContact O-OG1 3.13Å; T164-K166 PolarHBondContact O-N 2.86Å; T164-R167 PolarHBondContact O-N 2.67Å
165	E	40.5	Very low	44	Very low	123 Å²	123	100.4 Å²	100.4	58%	0.575	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-7.2	171.9	-71.7	-173.9	-165.2	0	0	114.4	K161	K161-E165 IonicContact NZ-OE1 2.84Å; K161-E165 PolarHBondContact NZ-OE1 3.46Å; K161-E165 PolarHBondContact O-N 3.48Å
166	K	38.9	Very low	45.2	Very low	169 Å²	169	103.6 Å²	103.6	74%	0.735	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.6	13.6	171	-71.3	171.6	-173.5	141.9	0	113.6	D162 T164	D162-K166 WeakPolarHBondContact O-CD 3.35Å; D162-K166 WeakPolarHBondContact O-CG 3.36Å; T164-K166 PolarHBondContact O-N 2.86Å
167	R	35.1	Very low	46.3	Very low	138 Å²	138	101.2 Å²	101.2	52%	0.521	52%	0.524	S	S	.	.			trans	-119.4	46.2	179.2	-70.6	-176.4	173.1	116.1	-16.8	112.6	M163 T164	M163-R167 WeakPolarHBondContact O-CG 3.23Å; M163-R167 PolarHBondContact O-NH1 3.47Å; T164-R167 PolarHBondContact O-N 2.67Å
168	D	34.9	Very low	47.1	Very low	132 Å²	132	107.1 Å²	107.1	71%	0.706	54%	0.542	S	S	*	.			trans	-52.2	149.2	154.8	-74	-39.1	0	0	0	109.9
169	H	37.2	Very low	48.3	Very low	184 Å²	184	107 Å²	107	85%	0.852	54%	0.541	S	S	*	.			trans	80.2	38.7	177.8	-33.8	-29	0	0	0	117.1	S171	H169-S171 PolarHBondContact O-N 3.01Å
170	V	46.5	Very low	49.7	Very low	100 Å²	100	102 Å²	102	61%	0.606	52%	0.518	S	S	*	.			trans	-69.2	120.4	155.8	179.9	0	0	0	0	109	V172	V170-V172 HydrophobicContact CG1-CG2 4.18Å; V170-V172 PolarHBondContact O-N 3.12Å; V170-V172 VanDerWaalsContact O-N 3.11Å
171	S	41.2	Very low	51.1	Low	118 Å²	118	101.8 Å²	101.8	83%	0.825	52%	0.517	S	S	*	.			trans	-81.9	86.3	180	-180	0	0	0	0	110.8	H169 M173	H169-S171 PolarHBondContact O-N 3.01Å; S171-M173 PolarHBondContact O-N 3.1Å
172	V	44.9	Very low	52.7	Low	46 Å²	46	101.1 Å²	101.1	28%	0.279	52%	0.519	S	S	.	.			trans	-68.6	127.8	-173.5	174.7	0	0	0	0	112.1	V170 I262	V170-V172 HydrophobicContact CG1-CG2 4.18Å; V170-V172 PolarHBondContact O-N 3.12Å; V170-V172 VanDerWaalsContact O-N 3.11Å; V172-I262 HydrophobicContact CG1-CG1 4.41Å
173	M	48.3	Very low	54.6	Low	158 Å²	158	98.7 Å²	98.7	78%	0.778	51%	0.507	S	S	*	.			trans	-65.1	135.1	167.8	-75.5	165.8	47.9	0	0	109.9	S171 V175	S171-M173 PolarHBondContact O-N 3.1Å; M173-V175 VanDerWaalsContact C-N 3.31Å; M173-V175 PolarHBondContact O-N 3.35Å
174	S	52.4	Low	56.9	Low	113 Å²	113	93.8 Å²	93.8	79%	0.79	48%	0.483	S	S	*	.			trans	-70.5	87.5	171.7	55.9	0	0	0	0	110.1
175	V	59.5	Low	59	Low	27 Å²	27	96.9 Å²	96.9	16%	0.164	49%	0.492	C	S	.	.			trans	-69.9	135.1	172	177.4	0	0	0	0	108.9	M173 E179 V183 I262 H266	M173-V175 VanDerWaalsContact C-N 3.31Å; M173-V175 PolarHBondContact O-N 3.35Å; V175-E179 HydrophobicContact CG1-CB 3.79Å; V175-V183 HydrophobicContact CG1-CG2 4Å; V175-I262 HydrophobicContact CG2-CD1 4.06Å; V175-H266 PolarHBondContact O-CE1 3.43Å
176	D	62.4	Low	61.2	Low	116 Å²	116	93.7 Å²	93.7	62%	0.62	48%	0.479	S	S	*	.			trans	-73.4	145.2	177.6	-100.2	-28.2	0	0	0	111	Y178 E179	D176-Y178 PolarHBondContact O-N 3.4Å; D176-E179 HydrophobicContact CB-CG 4.13Å; D176-E179 PolarHBondContact N-OE2 2.93Å; D176-E179 WeakPolarHBondContact O-CB 3.12Å; D176-E179 PolarHBondContact O-N 3.47Å
177	F	62.5	Low	63.6	Low	20 Å²	20	85.7 Å²	85.7	9%	0.088	44%	0.444	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-28	-173.3	-177	-118.7	0	0	0	114.4	H266 I277 I278	F177-H266 HydrophobicContact CD2-CB 4.39Å; F177-I277 HydrophobicContact CE1-CD1 4.09Å; F177-I277 HydrophobicContact CE2-CG2 4.46Å; F177-I277 HydrophobicContact CZ-CB 4.08Å; F177-I277 HydrophobicContact CZ-CD1 4.48Å; F177-I277 HydrophobicContact CZ-CG2 4.41Å; F177-I278 HydrophobicContact CE2-CD1 3.82Å; F177-I278 HydrophobicContact CE2-CG1 3.74Å; F177-I278 HydrophobicContact CZ-CD1 4.32Å; F177-I278 HydrophobicContact CZ-CG1 4.2Å
178	Y	65.4	Low	66.3	Low	180 Å²	180	82.6 Å²	82.6	71%	0.706	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85	-11.6	178.5	-63	-79.5	0	0	0	114.1	D176 P181 I277	D176-Y178 PolarHBondContact O-N 3.4Å; Y178-P181 WeakPolarHBondContact O-CD 3.32Å; Y178-I277 HydrophobicContact CD1-CD1 4.4Å
179	E	72.9	Confident	68.8	Low	102 Å²	102	79.6 Å²	79.6	48%	0.477	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-15.7	175.8	-58.9	-170.7	131.7	0	0	112.5	V175 D176 P181 N182 V183	V175-E179 HydrophobicContact CG1-CB 3.79Å; D176-E179 HydrophobicContact CB-CG 4.13Å; D176-E179 PolarHBondContact N-OE2 2.93Å; D176-E179 WeakPolarHBondContact O-CB 3.12Å; D176-E179 PolarHBondContact O-N 3.47Å; E179-P181 VanDerWaalsContact C-CD 3.46Å; E179-P181 VanDerWaalsContact C-N 3.34Å; E179-N182 WeakPolarHBondContact O-CA 3.48Å; E179-N182 WeakPolarHBondContact O-CB 3.42Å; E179-N182 PolarHBondContact O-N 2.93Å; E179-V183 PolarHBondContact O-N 3.18Å
180	L	77.8	Confident	71.3	Confident	0 Å²	0	75.7 Å²	75.7	0%	0	40%	0.403	C	S	.	.	H	α-helix	trans	-50.8	-41.7	178.6	-175	58.5	0	0	0	113.7	N182 V183 V184 L259 I262 I277 S281	L180-N182 PolarHBondContact O-N 2.71Å; L180-V183 PolarHBondContact O-N 3.48Å; L180-V184 WeakPolarHBondContact O-CG2 3.48Å; L180-V184 PolarHBondContact O-N 3.48Å; L180-L259 HydrophobicContact CD1-CD1 3.76Å; L180-I262 HydrophobicContact CD1-CG2 3.78Å; L180-I277 HydrophobicContact CB-CG2 4.37Å; L180-I277 HydrophobicContact CD2-CG2 4.18Å; L180-S281 WeakPolarHBondContact CD2-OG 3.45Å
181	P	79.9	Confident	73.4	Confident	47 Å²	47	71 Å²	71	31%	0.305	37%	0.374	S	S	.	.	H	α-helix	trans	-67.3	-14.4	174.1	-20.5	34.3	0	0	0	115.2	Y178 E179 K185 I277	Y178-P181 WeakPolarHBondContact O-CD 3.32Å; E179-P181 VanDerWaalsContact C-CD 3.46Å; E179-P181 VanDerWaalsContact C-N 3.34Å; P181-K185 WeakPolarHBondContact O-CD 3.24Å; P181-K185 VanDerWaalsContact O-CE 3.28Å; P181-K185 WeakPolarHBondContact O-CE 3.17Å; P181-K185 VanDerWaalsContact O-CG 3.32Å; P181-K185 WeakPolarHBondContact O-CG 3.05Å; P181-I277 HydrophobicContact CG-CG2 4.09Å
182	N	82.5	Confident	75.7	Confident	97 Å²	97	69.3 Å²	69.3	52%	0.519	35%	0.354	S	S	.	.	H	α-helix	trans	-89.9	-37.3	172.6	-62.6	-28.8	0	0	0	110.9	E179 L180 K185 D186	E179-N182 WeakPolarHBondContact O-CA 3.48Å; E179-N182 WeakPolarHBondContact O-CB 3.42Å; E179-N182 PolarHBondContact O-N 2.93Å; L180-N182 PolarHBondContact O-N 2.71Å; N182-K185 PolarHBondContact O-N 2.97Å; N182-D186 PolarHBondContact O-N 3.23Å; N182-D186 VanDerWaalsContact O-N 3.15Å
183	V	83.3	Confident	77.8	Confident	35 Å²	35	69.6 Å²	69.6	21%	0.212	36%	0.358	C	S	.	.	H	α-helix	trans	-59	-48	169.5	-179.2	0	0	0	0	110.1	V175 E179 L180 K185 D186 V187 L259 I262	V175-V183 HydrophobicContact CG1-CG2 4Å; E179-V183 PolarHBondContact O-N 3.18Å; L180-V183 PolarHBondContact O-N 3.48Å; V183-K185 VanDerWaalsContact C-N 3.26Å; V183-K185 PolarHBondContact O-N 3.4Å; V183-D186 PolarHBondContact O-N 3.45Å; V183-D186 VanDerWaalsContact O-N 3.11Å; V183-V187 HydrophobicContact CG1-CG2 4.44Å; V183-V187 WeakPolarHBondContact O-CG2 3.49Å; V183-V187 PolarHBondContact O-N 3.46Å; V183-L259 HydrophobicContact CG1-CD1 4.21Å; V183-I262 HydrophobicContact CG1-CD1 4.33Å
184	V	86.7	Confident	79.8	Confident	9 Å²	9	62.1 Å²	62.1	6%	0.055	32%	0.321	C	S	.	.	H	α-helix	trans	-52.6	-43.3	175.8	169.4	0	0	0	0	111.6	L180 V187 E188 L259	L180-V184 WeakPolarHBondContact O-CG2 3.48Å; L180-V184 PolarHBondContact O-N 3.48Å; V184-V187 PolarHBondContact O-N 3.29Å; V184-E188 HydrophobicContact CG1-CG 4.25Å; V184-E188 WeakPolarHBondContact CG1-OE1 3.39Å; V184-E188 WeakPolarHBondContact O-CB 3.36Å; V184-E188 VanDerWaalsContact O-CG 3.27Å; V184-E188 WeakPolarHBondContact O-CG 3.5Å; V184-E188 PolarHBondContact O-N 2.8Å; V184-L259 HydrophobicContact CG2-CD1 3.88Å; V184-L259 HydrophobicContact CG2-CD2 4.28Å
185	K	86.9	Confident	81.6	Confident	120 Å²	120	58 Å²	58	52%	0.522	29%	0.289	S	S	.	.	H	α-helix	trans	-68.1	-35.2	179.1	-70.5	166.1	-166.4	158.5	0	114.2	P181 N182 V183 S189	P181-K185 WeakPolarHBondContact O-CD 3.24Å; P181-K185 VanDerWaalsContact O-CE 3.28Å; P181-K185 WeakPolarHBondContact O-CE 3.17Å; P181-K185 VanDerWaalsContact O-CG 3.32Å; P181-K185 WeakPolarHBondContact O-CG 3.05Å; N182-K185 PolarHBondContact O-N 2.97Å; V183-K185 VanDerWaalsContact C-N 3.26Å; V183-K185 PolarHBondContact O-N 3.4Å; K185-S189 PolarHBondContact O-N 3.33Å; K185-S189 VanDerWaalsContact O-N 3.08Å
186	D	87	Confident	83.1	Confident	57 Å²	57	60 Å²	60	31%	0.305	30%	0.301	S	S	.	.	H	α-helix	trans	-63.3	-49.5	172.2	176.4	43.5	0	0	0	109.6	N182 V183 E188 S189 R190 Q255	N182-D186 PolarHBondContact O-N 3.23Å; N182-D186 VanDerWaalsContact O-N 3.15Å; V183-D186 PolarHBondContact O-N 3.45Å; V183-D186 VanDerWaalsContact O-N 3.11Å; D186-E188 PolarHBondContact O-N 2.91Å; D186-S189 WeakPolarHBondContact O-CB 3.37Å; D186-S189 PolarHBondContact O-N 2.81Å; D186-S189 PolarHBondContact O-OG 2.95Å; D186-R190 WeakPolarHBondContact O-CG 3.31Å; D186-R190 PolarHBondContact O-N 2.76Å; D186-R190 IonicContact OD1-CZ 3.19Å; D186-R190 IonicContact OD1-NE 2.8Å; D186-R190 PolarHBondContact OD1-NE 2.88Å; D186-R190 IonicContact OD1-NH2 2.84Å; D186-R190 PolarHBondContact OD1-NH2 3.4Å; D186-R190 IonicContact OD2-CZ 3.68Å; D186-R190 IonicContact OD2-NE 2.86Å; D186-R190 IonicContact OD2-NH2 2.66Å; D186-R190 PolarHBondContact OD2-NH2 3.4Å; D186-Q255 PolarHBondContact OD2-NE2 3.17Å
187	V	89	Confident	84.4	Confident	1 Å²	1	57.1 Å²	57.1	1%	0.006	28%	0.283	C	S	.	.	H	α-helix	trans	-61.5	-41.3	177.7	-174.1	0	0	0	0	112	V183 V184 S189 R190 V191 Q255 L256 L259 L288	V183-V187 HydrophobicContact CG1-CG2 4.44Å; V183-V187 WeakPolarHBondContact O-CG2 3.49Å; V183-V187 PolarHBondContact O-N 3.46Å; V184-V187 PolarHBondContact O-N 3.29Å; V187-S189 VanDerWaalsContact C-N 3.3Å; V187-S189 PolarHBondContact O-N 3.29Å; V187-R190 PolarHBondContact O-N 3.02Å; V187-V191 HydrophobicContact CG1-CG2 4.08Å; V187-V191 WeakPolarHBondContact O-CB 3.45Å; V187-V191 VanDerWaalsContact O-CG2 3.29Å; V187-V191 WeakPolarHBondContact O-CG2 3.22Å; V187-V191 PolarHBondContact O-N 3.15Å; V187-Q255 HydrophobicContact CG1-CB 4.35Å; V187-Q255 HydrophobicContact CG2-CB 4.08Å; V187-L256 HydrophobicContact CG1-CD2 3.76Å; V187-L256 HydrophobicContact CG1-CG 4.04Å; V187-L259 HydrophobicContact CB-CD2 4.19Å; V187-L259 HydrophobicContact CG1-CD2 4.18Å; V187-L259 HydrophobicContact CG2-CB 4.24Å; V187-L259 HydrophobicContact CG2-CD2 4.17Å; V187-L288 HydrophobicContact CG1-CD1 4.25Å
188	E	90.7	Very high	85.8	Confident	72 Å²	72	56.4 Å²	56.4	34%	0.336	28%	0.28	S	S	.	.	H	α-helix	trans	-53.8	-46.6	171.4	-76	173.1	173.6	0	0	111.2	V184 D186 E192 S284 L288	V184-E188 HydrophobicContact CG1-CG 4.25Å; V184-E188 WeakPolarHBondContact CG1-OE1 3.39Å; V184-E188 WeakPolarHBondContact O-CB 3.36Å; V184-E188 VanDerWaalsContact O-CG 3.27Å; V184-E188 WeakPolarHBondContact O-CG 3.5Å; V184-E188 PolarHBondContact O-N 2.8Å; D186-E188 PolarHBondContact O-N 2.91Å; E188-E192 PolarHBondContact O-N 2.98Å; E188-S284 PolarHBondContact OE1-OG 3.28Å; E188-L288 HydrophobicContact CB-CD2 4.42Å; E188-L288 HydrophobicContact CG-CD1 3.77Å; E188-L288 HydrophobicContact CG-CD2 4Å; E188-L288 HydrophobicContact CG-CG 4.36Å
189	S	89	Confident	87	Confident	69 Å²	69	52.8 Å²	52.8	48%	0.483	27%	0.268	S	S	.	.	H	α-helix	trans	-65.4	-40	179.9	83.4	0	0	0	0	112.8	K185 D186 V187 S193	K185-S189 PolarHBondContact O-N 3.33Å; K185-S189 VanDerWaalsContact O-N 3.08Å; D186-S189 WeakPolarHBondContact O-CB 3.37Å; D186-S189 PolarHBondContact O-N 2.81Å; D186-S189 PolarHBondContact O-OG 2.95Å; V187-S189 VanDerWaalsContact C-N 3.3Å; V187-S189 PolarHBondContact O-N 3.29Å; S189-S193 PolarHBondContact O-N 3.31Å
190	R	88.3	Confident	87.8	Confident	102 Å²	102	51.9 Å²	51.9	39%	0.385	26%	0.264	S	S	.	.	H	α-helix	trans	-77.8	-33.6	-178.1	-52.8	-147.3	-148.2	149.3	9.2	112	D186 V187 S193 A194 Q255	D186-R190 WeakPolarHBondContact O-CG 3.31Å; D186-R190 PolarHBondContact O-N 2.76Å; D186-R190 IonicContact OD1-CZ 3.19Å; D186-R190 IonicContact OD1-NE 2.8Å; D186-R190 PolarHBondContact OD1-NE 2.88Å; D186-R190 IonicContact OD1-NH2 2.84Å; D186-R190 PolarHBondContact OD1-NH2 3.4Å; D186-R190 IonicContact OD2-CZ 3.68Å; D186-R190 IonicContact OD2-NE 2.86Å; D186-R190 IonicContact OD2-NH2 2.66Å; D186-R190 PolarHBondContact OD2-NH2 3.4Å; V187-R190 PolarHBondContact O-N 3.02Å; R190-S193 WeakPolarHBondContact O-CB 3.31Å; R190-S193 PolarHBondContact O-N 2.95Å; R190-S193 PolarHBondContact O-OG 3.3Å; R190-A194 PolarHBondContact O-N 3.48Å; R190-Q255 VanDerWaalsContact CZ-NE2 3.28Å; R190-Q255 VanDerWaalsContact NH1-CD 3.31Å; R190-Q255 VanDerWaalsContact NH2-NE2 3.17Å
191	V	90.2	Very high	88.5	Confident	1 Å²	1	51.9 Å²	51.9	1%	0.006	26%	0.264	C	S	.	.	H	α-helix	trans	-65.6	-40.7	171.7	170.5	0	0	0	0	111.3	V187 S193 A194 K195 A252 L256 L288 L292	V187-V191 HydrophobicContact CG1-CG2 4.08Å; V187-V191 WeakPolarHBondContact O-CB 3.45Å; V187-V191 VanDerWaalsContact O-CG2 3.29Å; V187-V191 WeakPolarHBondContact O-CG2 3.22Å; V187-V191 PolarHBondContact O-N 3.15Å; V191-S193 VanDerWaalsContact C-N 3.32Å; V191-S193 PolarHBondContact O-N 2.9Å; V191-A194 PolarHBondContact O-N 3Å; V191-K195 VanDerWaalsContact O-CB 3.23Å; V191-K195 WeakPolarHBondContact O-CB 3.4Å; V191-K195 PolarHBondContact O-N 3.26Å; V191-A252 HydrophobicContact CG2-CB 4.41Å; V191-L256 HydrophobicContact CG2-CD1 4.01Å; V191-L256 HydrophobicContact CG2-CD2 4.4Å; V191-L256 HydrophobicContact CG2-CG 4.2Å; V191-L288 HydrophobicContact CB-CD2 3.94Å; V191-L288 HydrophobicContact CG1-CB 4.38Å; V191-L288 HydrophobicContact CG1-CD2 3.82Å; V191-L288 HydrophobicContact CG2-CB 4.41Å; V191-L288 HydrophobicContact CG2-CD2 4.36Å; V191-L292 HydrophobicContact CG1-CB 4.36Å
192	E	90.4	Very high	88.9	Confident	84 Å²	84	51.4 Å²	51.4	39%	0.393	26%	0.257	S	S	.	.	H	α-helix	trans	-65.8	-32.9	171.2	-75.5	-62.7	162.5	0	0	112.7	E188 A194 K195 T196	E188-E192 PolarHBondContact O-N 2.98Å; E192-A194 PolarHBondContact O-N 3.28Å; E192-K195 PolarHBondContact O-N 2.98Å; E192-K195 WeakPolarHBondContact OE1-CE 3.3Å; E192-K195 IonicContact OE1-NZ 2.65Å; E192-K195 PolarHBondContact OE1-NZ 3.15Å; E192-K195 WeakPolarHBondContact OE2-CD 3.33Å; E192-K195 WeakPolarHBondContact OE2-CE 3.37Å; E192-K195 IonicContact OE2-NZ 2.9Å; E192-T196 WeakPolarHBondContact O-CG2 3.2Å; E192-T196 PolarHBondContact O-N 2.88Å; E192-T196 PolarHBondContact O-OG1 3.35Å
193	S	89	Confident	89.3	Confident	52 Å²	52	52 Å²	52	36%	0.364	26%	0.257	S	S	.	.	H	α-helix	trans	-63.2	-39.3	171.6	88.8	0	0	0	0	112.5	S189 R190 V191 T196 K197	S189-S193 PolarHBondContact O-N 3.31Å; R190-S193 WeakPolarHBondContact O-CB 3.31Å; R190-S193 PolarHBondContact O-N 2.95Å; R190-S193 PolarHBondContact O-OG 3.3Å; V191-S193 VanDerWaalsContact C-N 3.32Å; V191-S193 PolarHBondContact O-N 2.9Å; S193-T196 PolarHBondContact O-OG1 2.94Å; S193-K197 WeakPolarHBondContact O-CG 3.38Å; S193-K197 PolarHBondContact O-N 3.45Å
194	A	90.3	Very high	89.6	Confident	1 Å²	1	51.3 Å²	51.3	1%	0.008	25%	0.253	C	S	.	.	H	α-helix	trans	-69.2	-43.3	174.1	0	0	0	0	0	111.9	R190 V191 E192 T196 K197 L198 I248 V249 A252 L292	R190-A194 PolarHBondContact O-N 3.48Å; V191-A194 PolarHBondContact O-N 3Å; E192-A194 PolarHBondContact O-N 3.28Å; A194-T196 PolarHBondContact O-N 3.38Å; A194-K197 PolarHBondContact O-N 3.14Å; A194-L198 WeakPolarHBondContact O-CB 3.43Å; A194-L198 VanDerWaalsContact O-CG 3.31Å; A194-L198 WeakPolarHBondContact O-CG 3.31Å; A194-L198 PolarHBondContact O-N 2.92Å; A194-I248 HydrophobicContact CB-CG2 3.95Å; A194-V249 HydrophobicContact CB-CG2 4.49Å; A194-A252 HydrophobicContact CB-CB 3.87Å; A194-L292 HydrophobicContact CB-CD1 4Å
195	K	90.5	Very high	89.8	Confident	27 Å²	27	50.9 Å²	50.9	12%	0.117	25%	0.25	C	S	.	.	H	α-helix	trans	-65.9	-33.1	179.9	178.8	169.9	155.4	-169.9	0	113.2	V191 E192 K199 D291	V191-K195 VanDerWaalsContact O-CB 3.23Å; V191-K195 WeakPolarHBondContact O-CB 3.4Å; V191-K195 PolarHBondContact O-N 3.26Å; E192-K195 PolarHBondContact O-N 2.98Å; E192-K195 WeakPolarHBondContact OE1-CE 3.3Å; E192-K195 IonicContact OE1-NZ 2.65Å; E192-K195 PolarHBondContact OE1-NZ 3.15Å; E192-K195 WeakPolarHBondContact OE2-CD 3.33Å; E192-K195 WeakPolarHBondContact OE2-CE 3.37Å; E192-K195 IonicContact OE2-NZ 2.9Å; K195-K199 WeakPolarHBondContact O-CD 3.45Å; K195-K199 VanDerWaalsContact O-CG 3.29Å; K195-K199 WeakPolarHBondContact O-CG 3.3Å; K195-K199 PolarHBondContact O-N 2.87Å; K195-D291 HydrophobicContact CD-CB 4.47Å; K195-D291 IonicContact NZ-OD2 3.37Å; K195-D291 PolarHBondContact NZ-OD2 3.35Å
196	T	90.9	Very high	89.9	Confident	67 Å²	67	49 Å²	49	41%	0.411	24%	0.244	S	C	.	.	H	α-helix	trans	-70.6	-42.5	170.2	47.4	0	0	0	0	112	E192 S193 A194 K199 E200	E192-T196 WeakPolarHBondContact O-CG2 3.2Å; E192-T196 PolarHBondContact O-N 2.88Å; E192-T196 PolarHBondContact O-OG1 3.35Å; S193-T196 PolarHBondContact O-OG1 2.94Å; A194-T196 PolarHBondContact O-N 3.38Å; T196-K199 PolarHBondContact O-N 2.92Å; T196-E200 PolarHBondContact O-N 2.86Å
197	K	89.5	Confident	90	Very high	56 Å²	56	50.9 Å²	50.9	24%	0.243	25%	0.249	C	C	.	.	H	α-helix	trans	-67.3	-36.7	176.3	-69.7	-73.2	165.2	-142	0	113.7	S193 A194 K199 E200 F201 V245 I248	S193-K197 WeakPolarHBondContact O-CG 3.38Å; S193-K197 PolarHBondContact O-N 3.45Å; A194-K197 PolarHBondContact O-N 3.14Å; K197-K199 VanDerWaalsContact C-N 3.31Å; K197-K199 PolarHBondContact O-N 3.47Å; K197-E200 IonicContact NZ-OE1 3.26Å; K197-E200 PolarHBondContact NZ-OE1 2.9Å; K197-E200 IonicContact NZ-OE2 3.67Å; K197-E200 PolarHBondContact NZ-OE2 3.34Å; K197-E200 PolarHBondContact O-N 3.42Å; K197-F201 WeakPolarHBondContact O-CB 3.38Å; K197-F201 PolarHBondContact O-N 2.9Å; K197-V245 HydrophobicContact CB-CG2 4.25Å; K197-I248 HydrophobicContact CD-CD1 4.33Å; K197-I248 HydrophobicContact CG-CD1 3.85Å
198	L	91.5	Very high	89.9	Confident	6 Å²	6	51 Å²	51	3%	0.031	25%	0.249	C	C	.	.	H	α-helix	trans	-61.6	-37.8	172.1	-76.4	163.9	0	0	0	111.7	A194 F201 E202 V245 V249 L292 I296 V299	A194-L198 WeakPolarHBondContact O-CB 3.43Å; A194-L198 VanDerWaalsContact O-CG 3.31Å; A194-L198 WeakPolarHBondContact O-CG 3.31Å; A194-L198 PolarHBondContact O-N 2.92Å; L198-F201 PolarHBondContact O-N 3.3Å; L198-E202 WeakPolarHBondContact O-CB 3.13Å; L198-E202 PolarHBondContact O-N 3.28Å; L198-V245 HydrophobicContact CD2-CG1 3.58Å; L198-V245 HydrophobicContact CG-CG1 4.25Å; L198-V249 HydrophobicContact CD1-CG2 4.04Å; L198-V249 HydrophobicContact CD2-CG2 4.15Å; L198-V249 HydrophobicContact CG-CG2 4.16Å; L198-L292 HydrophobicContact CD1-CD1 3.97Å; L198-I296 HydrophobicContact CD1-CG1 4.19Å; L198-V299 HydrophobicContact CD2-CB 4.47Å; L198-V299 HydrophobicContact CD2-CG2 3.89Å
199	K	91.2	Very high	89.7	Confident	103 Å²	103	48.6 Å²	48.6	45%	0.448	24%	0.238	S	C	.	.	H	α-helix	trans	-70.2	-38	174.1	-70.9	166.8	-176.6	172.9	0	113.3	K195 T196 K197 F201 H203	K195-K199 WeakPolarHBondContact O-CD 3.45Å; K195-K199 VanDerWaalsContact O-CG 3.29Å; K195-K199 WeakPolarHBondContact O-CG 3.3Å; K195-K199 PolarHBondContact O-N 2.87Å; T196-K199 PolarHBondContact O-N 2.92Å; K197-K199 VanDerWaalsContact C-N 3.31Å; K197-K199 PolarHBondContact O-N 3.47Å; K199-F201 PolarHBondContact O-N 3.44Å; K199-H203 WeakPolarHBondContact O-CB 3.46Å; K199-H203 PolarHBondContact O-N 2.94Å; K199-H203 VanDerWaalsContact O-N 3.09Å
200	E	89.9	Confident	89.6	Confident	83 Å²	83	49.9 Å²	49.9	39%	0.388	24%	0.24	S	C	.	.	H	α-helix	trans	-59.5	-37.3	171.6	-73	176	-154.6	0	0	111.3	T196 K197 V204	T196-E200 PolarHBondContact O-N 2.86Å; K197-E200 IonicContact NZ-OE1 3.26Å; K197-E200 PolarHBondContact NZ-OE1 2.9Å; K197-E200 IonicContact NZ-OE2 3.67Å; K197-E200 PolarHBondContact NZ-OE2 3.34Å; K197-E200 PolarHBondContact O-N 3.42Å; E200-V204 WeakPolarHBondContact O-CG2 3.42Å; E200-V204 PolarHBondContact O-N 2.9Å
201	F	91	Very high	89.5	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-76.9	-43.1	178.5	-171.9	-127.7	0	0	0	113	K197 L198 K199 H203 V204 I205 K238 L241 E242 V245 V299	K197-F201 WeakPolarHBondContact O-CB 3.38Å; K197-F201 PolarHBondContact O-N 2.9Å; L198-F201 PolarHBondContact O-N 3.3Å; K199-F201 PolarHBondContact O-N 3.44Å; F201-H203 VanDerWaalsContact C-N 3.27Å; F201-H203 PolarHBondContact O-N 2.98Å; F201-V204 PolarHBondContact O-N 3.24Å; F201-I205 HydrophobicContact CD1-CD1 3.85Å; F201-I205 HydrophobicContact CD2-CD1 4.41Å; F201-I205 HydrophobicContact CD2-CG1 4.43Å; F201-I205 HydrophobicContact CE1-CD1 3.66Å; F201-I205 HydrophobicContact CE2-CD1 4.23Å; F201-I205 HydrophobicContact CE2-CG1 4.27Å; F201-I205 HydrophobicContact CG-CD1 4.23Å; F201-I205 HydrophobicContact CZ-CD1 3.84Å; F201-I205 HydrophobicContact CZ-CG1 4.32Å; F201-I205 WeakPolarHBondContact O-CG1 3.43Å; F201-I205 PolarHBondContact O-N 2.97Å; F201-K238 HydrophobicContact CE2-CG 3.93Å; F201-L241 HydrophobicContact CD2-CB 3.79Å; F201-L241 HydrophobicContact CE2-CB 4.36Å; F201-E242 HydrophobicContact CE2-CB 3.88Å; F201-E242 HydrophobicContact CE2-CG 4.39Å; F201-E242 HydrophobicContact CZ-CB 3.78Å; F201-E242 HydrophobicContact CZ-CG 3.78Å; F201-E242 WeakPolarHBondContact CZ-OE2 3.47Å; F201-V245 HydrophobicContact CB-CG2 3.82Å; F201-V245 HydrophobicContact CD1-CG1 4.45Å; F201-V245 HydrophobicContact CD1-CG2 4.34Å; F201-V245 HydrophobicContact CG-CG2 4.1Å; F201-V299 HydrophobicContact CD1-CG1 3.56Å; F201-V299 HydrophobicContact CD1-CG2 4.23Å; F201-V299 HydrophobicContact CE1-CG1 3.48Å; F201-V299 VanDerWaalsContact CE1-CG1 3.48Å
202	E	89.5	Confident	89.1	Confident	37 Å²	37	45.5 Å²	45.5	17%	0.173	23%	0.225	C	C	.	.	H	α-helix	trans	-46.6	-53	169.6	-169.9	173.8	-158.1	0	0	109.6	L198 V204 I205 E206 K298 L302	L198-E202 WeakPolarHBondContact O-CB 3.13Å; L198-E202 PolarHBondContact O-N 3.28Å; E202-V204 PolarHBondContact O-N 3.45Å; E202-I205 PolarHBondContact O-N 3.25Å; E202-E206 WeakPolarHBondContact O-CG 3.17Å; E202-E206 PolarHBondContact O-N 3.3Å; E202-K298 IonicContact OE1-NZ 2.64Å; E202-K298 PolarHBondContact OE1-NZ 2.93Å; E202-K298 IonicContact OE2-NZ 3.93Å; E202-K298 PolarHBondContact OE2-NZ 3.45Å; E202-L302 HydrophobicContact CB-CD1 4.4Å; E202-L302 HydrophobicContact CG-CD1 3.69Å
203	H	91.3	Very high	88.7	Confident	109 Å²	109	44.8 Å²	44.8	51%	0.505	22%	0.223	S	C	.	.	H	α-helix	trans	-67.4	-27.1	-179.9	-171	51	0	0	0	115.3	K199 F201 E206 K207	K199-H203 WeakPolarHBondContact O-CB 3.46Å; K199-H203 PolarHBondContact O-N 2.94Å; K199-H203 VanDerWaalsContact O-N 3.09Å; F201-H203 VanDerWaalsContact C-N 3.27Å; F201-H203 PolarHBondContact O-N 2.98Å; H203-E206 IonicContact CE1-OE2 2.63Å; H203-E206 PolarHBondContact CE1-OE2 3.45Å; H203-E206 IonicContact ND1-OE2 2.62Å; H203-K207 WeakPolarHBondContact O-CG 3.37Å; H203-K207 PolarHBondContact O-N 2.86Å
204	V	89.8	Confident	88.4	Confident	22 Å²	22	46.5 Å²	46.5	13%	0.133	23%	0.228	C	C	.	.	H	α-helix	trans	-82.2	-32.2	175.1	167.4	0	0	0	0	111.5	E200 F201 E202 Y208 K237 K238 L241	E200-V204 WeakPolarHBondContact O-CG2 3.42Å; E200-V204 PolarHBondContact O-N 2.9Å; F201-V204 PolarHBondContact O-N 3.24Å; E202-V204 PolarHBondContact O-N 3.45Å; V204-Y208 VanDerWaalsContact O-CB 3.31Å; V204-Y208 WeakPolarHBondContact O-CB 3.28Å; V204-Y208 PolarHBondContact O-N 3.32Å; V204-K237 HydrophobicContact CG1-CB 4.38Å; V204-K238 HydrophobicContact CG1-CB 4.29Å; V204-L241 HydrophobicContact CB-CD1 4.05Å; V204-L241 HydrophobicContact CG1-CD1 4.17Å; V204-L241 HydrophobicContact CG2-CD1 3.69Å
205	I	89.3	Confident	87.8	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-67.6	-45.3	171.6	-63.1	165	0	0	0	110.5	F201 E202 K207 Y208 L209 V299 L302 V306	F201-I205 HydrophobicContact CD1-CD1 3.85Å; F201-I205 HydrophobicContact CD2-CD1 4.41Å; F201-I205 HydrophobicContact CD2-CG1 4.43Å; F201-I205 HydrophobicContact CE1-CD1 3.66Å; F201-I205 HydrophobicContact CE2-CD1 4.23Å; F201-I205 HydrophobicContact CE2-CG1 4.27Å; F201-I205 HydrophobicContact CG-CD1 4.23Å; F201-I205 HydrophobicContact CZ-CD1 3.84Å; F201-I205 HydrophobicContact CZ-CG1 4.32Å; F201-I205 WeakPolarHBondContact O-CG1 3.43Å; F201-I205 PolarHBondContact O-N 2.97Å; E202-I205 PolarHBondContact O-N 3.25Å; I205-K207 PolarHBondContact O-N 3.47Å; I205-Y208 CarbonylContact O-C 3.54Å; I205-Y208 WeakPolarHBondContact O-CA 3.5Å; I205-Y208 WeakPolarHBondContact O-CB 3.29Å; I205-Y208 PolarHBondContact O-N 3.21Å; I205-L209 HydrophobicContact CG2-CD1 4.1Å; I205-L209 HydrophobicContact CG2-CG 4.25Å; I205-L209 WeakPolarHBondContact O-CG 3.3Å; I205-L209 PolarHBondContact O-N 3.49Å; I205-V299 HydrophobicContact CD1-CG1 4.29Å; I205-L302 HydrophobicContact CB-CB 4.35Å; I205-L302 HydrophobicContact CD1-CB 4.38Å; I205-L302 HydrophobicContact CG2-CB 3.71Å; I205-V306 HydrophobicContact CG2-CG2 3.53Å
206	E	90.2	Very high	87.1	Confident	81 Å²	81	49.5 Å²	49.5	38%	0.379	25%	0.248	S	C	.	.	H	α-helix	trans	-53.6	-50.9	174.8	-72.6	176.4	151.2	0	0	111.6	E202 H203 Y208 L209 D210 L302	E202-E206 WeakPolarHBondContact O-CG 3.17Å; E202-E206 PolarHBondContact O-N 3.3Å; H203-E206 IonicContact CE1-OE2 2.63Å; H203-E206 PolarHBondContact CE1-OE2 3.45Å; H203-E206 IonicContact ND1-OE2 2.62Å; E206-Y208 PolarHBondContact O-N 2.9Å; E206-L209 WeakPolarHBondContact O-CB 3.37Å; E206-L209 PolarHBondContact O-N 3.18Å; E206-L209 VanDerWaalsContact O-N 3.15Å; E206-D210 PolarHBondContact O-N 3.09Å; E206-L302 HydrophobicContact CG-CD1 4.22Å
207	K	89.2	Confident	86.3	Confident	96 Å²	96	53 Å²	53	42%	0.417	26%	0.26	S	S	.	.	H	α-helix	trans	-61.9	-30.3	176.6	-76.7	171.9	169.5	167.8	0	113.7	H203 I205 A211 L234	H203-K207 WeakPolarHBondContact O-CG 3.37Å; H203-K207 PolarHBondContact O-N 2.86Å; I205-K207 PolarHBondContact O-N 3.47Å; K207-A211 VanDerWaalsContact O-CB 3.32Å; K207-A211 WeakPolarHBondContact O-CB 3.33Å; K207-A211 PolarHBondContact O-N 2.91Å; K207-A211 VanDerWaalsContact O-N 3.1Å; K207-L234 HydrophobicContact CB-CD2 4.38Å; K207-L234 WeakPolarHBondContact O-CD1 3.45Å
208	Y	86.6	Confident	85.4	Confident	3 Å²	3	52.7 Å²	52.7	1%	0.012	26%	0.261	C	S	.	.	H	α-helix	trans	-76	-37.2	175.9	179.1	-107.6	0	0	0	111.9	V204 I205 E206 A211 L212 V231 L234 E235 K238 V306 K310	V204-Y208 VanDerWaalsContact O-CB 3.31Å; V204-Y208 WeakPolarHBondContact O-CB 3.28Å; V204-Y208 PolarHBondContact O-N 3.32Å; I205-Y208 CarbonylContact O-C 3.54Å; I205-Y208 WeakPolarHBondContact O-CA 3.5Å; I205-Y208 WeakPolarHBondContact O-CB 3.29Å; I205-Y208 PolarHBondContact O-N 3.21Å; E206-Y208 PolarHBondContact O-N 2.9Å; Y208-A211 PolarHBondContact O-N 3.01Å; Y208-L212 HydrophobicContact CD1-CD1 3.92Å; Y208-L212 HydrophobicContact CD1-CG 4.49Å; Y208-L212 HydrophobicContact CE1-CD1 3.44Å; Y208-L212 VanDerWaalsContact CE1-CD1 3.44Å; Y208-L212 HydrophobicContact CE1-CG 4.16Å; Y208-L212 HydrophobicContact CE2-CD1 4.45Å; Y208-L212 HydrophobicContact CE2-CG 4.32Å; Y208-L212 WeakPolarHBondContact O-CB 3.47Å; Y208-L212 WeakPolarHBondContact O-CG 3.35Å; Y208-L212 PolarHBondContact O-N 3.34Å; Y208-V231 HydrophobicContact CE2-CG1 3.86Å; Y208-L234 HydrophobicContact CD2-CB 3.85Å; Y208-E235 HydrophobicContact CE2-CB 3.84Å; Y208-E235 HydrophobicContact CE2-CG 4.43Å; Y208-E235 PolarHBondContact OH-OE1 3.49Å; Y208-K238 HydrophobicContact CD1-CD 4.35Å; Y208-K238 HydrophobicContact CE1-CD 4.4Å; Y208-V306 HydrophobicContact CD1-CG1 4.29Å; Y208-V306 HydrophobicContact CD1-CG2 3.93Å; Y208-V306 HydrophobicContact CE1-CG1 3.8Å; Y208-V306 HydrophobicContact CE1-CG2 4.28Å; Y208-K310 WeakPolarHBondContact OH-CE 3.48Å; Y208-K310 PolarHBondContact OH-NZ 3.47Å
209	L	86.3	Confident	83.9	Confident	21 Å²	21	60 Å²	60	11%	0.11	30%	0.3	C	S	.	.	H	α-helix	trans	-60.8	-49.5	170.5	-70.9	168.2	0	0	0	110.9	I205 E206 A211 L212 L213 L302 D305 V306 L309	I205-L209 HydrophobicContact CG2-CD1 4.1Å; I205-L209 HydrophobicContact CG2-CG 4.25Å; I205-L209 WeakPolarHBondContact O-CG 3.3Å; I205-L209 PolarHBondContact O-N 3.49Å; E206-L209 WeakPolarHBondContact O-CB 3.37Å; E206-L209 PolarHBondContact O-N 3.18Å; E206-L209 VanDerWaalsContact O-N 3.15Å; L209-A211 PolarHBondContact O-N 2.97Å; L209-L212 PolarHBondContact O-N 3.46Å; L209-L213 WeakPolarHBondContact O-CG 3.42Å; L209-L213 PolarHBondContact O-N 2.71Å; L209-L302 HydrophobicContact CD1-CD2 4.02Å; L209-D305 HydrophobicContact CD1-CB 4.38Å; L209-D305 HydrophobicContact CD2-CB 4.29Å; L209-V306 HydrophobicContact CD2-CB 4.26Å; L209-V306 HydrophobicContact CD2-CG2 3.49Å; L209-V306 VanDerWaalsContact CD2-CG2 3.49Å; L209-V306 HydrophobicContact CG-CG2 3.84Å; L209-L309 HydrophobicContact CD2-CD1 3.66Å; L209-L309 HydrophobicContact CD2-CG 4.4Å
210	D	87.4	Confident	82.6	Confident	96 Å²	96	60 Å²	60	51%	0.513	31%	0.305	S	S	.	.	H	α-helix	trans	-57.5	-48.3	176.3	-71.9	-23	0	0	0	111.6	E206 L212 L213 I214	E206-D210 PolarHBondContact O-N 3.09Å; D210-L212 PolarHBondContact O-N 3.5Å; D210-L213 PolarHBondContact O-N 2.74Å; D210-I214 VanDerWaalsContact O-CG1 3.3Å; D210-I214 WeakPolarHBondContact O-CG1 3.35Å; D210-I214 PolarHBondContact O-N 2.91Å
211	A	85.1	Confident	81.1	Confident	6 Å²	6	64.5 Å²	64.5	5%	0.05	32%	0.324	C	S	.	.	H	α-helix	trans	-64.3	-37.2	179	0	0	0	0	0	112.7	K207 Y208 L209 A215 L230 V231 L234	K207-A211 VanDerWaalsContact O-CB 3.32Å; K207-A211 WeakPolarHBondContact O-CB 3.33Å; K207-A211 PolarHBondContact O-N 2.91Å; K207-A211 VanDerWaalsContact O-N 3.1Å; Y208-A211 PolarHBondContact O-N 3.01Å; L209-A211 PolarHBondContact O-N 2.97Å; A211-A215 WeakPolarHBondContact O-CB 3.28Å; A211-A215 PolarHBondContact O-N 3.24Å; A211-L230 HydrophobicContact CB-CD2 4.21Å; A211-L230 HydrophobicContact CB-CG 4.44Å; A211-V231 HydrophobicContact CB-CG2 3.9Å; A211-V231 WeakPolarHBondContact O-CG2 3.42Å; A211-L234 HydrophobicContact CB-CD1 3.49Å; A211-L234 VanDerWaalsContact CB-CD1 3.49Å
212	L	81.5	Confident	79.7	Confident	5 Å²	5	70.6 Å²	70.6	3%	0.026	36%	0.355	C	S	.	.	H	α-helix	trans	-65.1	-45	173.1	-80.4	177.4	0	0	0	111.8	Y208 L209 D210 A215 V216 V231	Y208-L212 HydrophobicContact CD1-CD1 3.92Å; Y208-L212 HydrophobicContact CD1-CG 4.49Å; Y208-L212 HydrophobicContact CE1-CD1 3.44Å; Y208-L212 VanDerWaalsContact CE1-CD1 3.44Å; Y208-L212 HydrophobicContact CE1-CG 4.16Å; Y208-L212 HydrophobicContact CE2-CD1 4.45Å; Y208-L212 HydrophobicContact CE2-CG 4.32Å; Y208-L212 WeakPolarHBondContact O-CB 3.47Å; Y208-L212 WeakPolarHBondContact O-CG 3.35Å; Y208-L212 PolarHBondContact O-N 3.34Å; L209-L212 PolarHBondContact O-N 3.46Å; D210-L212 PolarHBondContact O-N 3.5Å; L212-A215 PolarHBondContact O-N 2.89Å; L212-V216 WeakPolarHBondContact O-CB 3.2Å; L212-V216 VanDerWaalsContact O-CG2 3.28Å; L212-V216 WeakPolarHBondContact O-CG2 3.43Å; L212-V216 PolarHBondContact O-N 3.37Å; L212-V231 HydrophobicContact CD2-CG1 3.78Å; L212-V231 HydrophobicContact CD2-CG2 4.31Å
213	L	82.2	Confident	78.5	Confident	69 Å²	69	70.9 Å²	70.9	36%	0.361	36%	0.361	S	S	.	.	H	α-helix	trans	-61.2	-46.1	178.7	-72.6	169.2	0	0	0	111.1	L209 D210 V216 Q217 L309	L209-L213 WeakPolarHBondContact O-CG 3.42Å; L209-L213 PolarHBondContact O-N 2.71Å; D210-L213 PolarHBondContact O-N 2.74Å; L213-V216 PolarHBondContact O-N 3.16Å; L213-Q217 WeakPolarHBondContact O-CB 3.32Å; L213-Q217 VanDerWaalsContact O-CG 3.3Å; L213-Q217 WeakPolarHBondContact O-CG 3.37Å; L213-Q217 PolarHBondContact O-N 3.45Å; L213-L309 HydrophobicContact CD2-CD1 3.88Å; L213-L309 HydrophobicContact CD2-CD2 4.02Å; L213-L309 HydrophobicContact CG-CD1 3.91Å
214	I	82.9	Confident	77.3	Confident	89 Å²	89	70.5 Å²	70.5	46%	0.456	36%	0.358	S	S	.	.	H	α-helix	trans	-62.3	-45.9	175.6	-65.2	164.3	0	0	0	110.7	D210 V216 Q217 D218	D210-I214 VanDerWaalsContact O-CG1 3.3Å; D210-I214 WeakPolarHBondContact O-CG1 3.35Å; D210-I214 PolarHBondContact O-N 2.91Å; I214-V216 VanDerWaalsContact C-N 3.25Å; I214-V216 PolarHBondContact O-N 2.89Å; I214-Q217 PolarHBondContact O-N 2.87Å; I214-D218 WeakPolarHBondContact O-CB 3.39Å; I214-D218 PolarHBondContact O-N 2.75Å
215	A	78.6	Confident	76.5	Confident	3 Å²	3	76.6 Å²	76.6	3%	0.025	39%	0.385	C	S	.	.	H	α-helix	trans	-66.1	-22.4	179.1	0	0	0	0	0	114.4	A211 L212 N227 W228 V231	A211-A215 WeakPolarHBondContact O-CB 3.28Å; A211-A215 PolarHBondContact O-N 3.24Å; L212-A215 PolarHBondContact O-N 2.89Å; A215-N227 HydrophobicContact CB-CB 3.99Å; A215-W228 HydrophobicContact CB-CD2 4.38Å; A215-W228 HydrophobicContact CB-CH2 4.23Å; A215-W228 HydrophobicContact CB-CZ2 4.06Å; A215-W228 HydrophobicContact CB-CZ3 4.5Å; A215-V231 HydrophobicContact CB-CG2 3.94Å
216	V	74.2	Confident	75.9	Confident	88 Å²	88	83.2 Å²	83.2	53%	0.533	41%	0.414	S	S	.	.	H	α-helix	trans	-87	-32.7	174.7	168.4	0	0	0	0	112.2	L212 L213 I214 R313	L212-V216 WeakPolarHBondContact O-CB 3.2Å; L212-V216 VanDerWaalsContact O-CG2 3.28Å; L212-V216 WeakPolarHBondContact O-CG2 3.43Å; L212-V216 PolarHBondContact O-N 3.37Å; L213-V216 PolarHBondContact O-N 3.16Å; I214-V216 VanDerWaalsContact C-N 3.25Å; I214-V216 PolarHBondContact O-N 2.89Å; V216-R313 HydrophobicContact CG2-CG 4.22Å
217	Q	75.3	Confident	75.3	Confident	141 Å²	141	80.7 Å²	80.7	66%	0.659	40%	0.402	S	S	*	.	H	α-helix	trans	-84.8	-26.4	-179.2	-69.4	176	9.1	0	0	113.9	L213 I214 N219	L213-Q217 WeakPolarHBondContact O-CB 3.32Å; L213-Q217 VanDerWaalsContact O-CG 3.3Å; L213-Q217 WeakPolarHBondContact O-CG 3.37Å; L213-Q217 PolarHBondContact O-N 3.45Å; I214-Q217 PolarHBondContact O-N 2.87Å; Q217-N219 PolarHBondContact O-N 3.43Å; Q217-N219 VanDerWaalsContact O-N 3.12Å
218	D	70.2	Confident	74.9	Confident	48 Å²	48	80 Å²	80	26%	0.257	40%	0.397	S	S	.	.			trans	-74.7	102.1	-174.7	-110.2	-10.2	0	0	0	113.4	I214 N220 S223 N227	I214-D218 WeakPolarHBondContact O-CB 3.39Å; I214-D218 PolarHBondContact O-N 2.75Å; D218-N220 PolarHBondContact O-N 3.01Å; D218-S223 WeakPolarHBondContact OD2-CB 3.45Å; D218-N227 PolarHBondContact OD2-ND2 3.32Å
219	N	59.3	Low	74.7	Confident	161 Å²	161	84.1 Å²	84.1	86%	0.861	42%	0.419	S	S	*	.			trans	-71.5	-10.1	170.5	-72.3	-51.7	0	0	0	113.7	Q217 F221	Q217-N219 PolarHBondContact O-N 3.43Å; Q217-N219 VanDerWaalsContact O-N 3.12Å; N219-F221 PolarHBondContact O-N 2.83Å
220	N	64.3	Low	74.5	Confident	102 Å²	102	87.3 Å²	87.3	55%	0.545	44%	0.436	S	S	.	.			trans	-80.9	111.2	-175.4	-74.4	-42.7	0	0	0	112.2	D218 I222 S223 K224	D218-N220 PolarHBondContact O-N 3.01Å; N220-I222 VanDerWaalsContact C-N 3.29Å; N220-I222 PolarHBondContact O-N 3.49Å; N220-I222 VanDerWaalsContact O-N 3.15Å; N220-S223 PolarHBondContact O-N 2.93Å; N220-K224 WeakPolarHBondContact O-CB 3.26Å; N220-K224 PolarHBondContact O-N 3.2Å
221	F	58.3	Low	74.4	Confident	178 Å²	178	83 Å²	83	78%	0.781	41%	0.413	S	S	*	.	H	α-helix	trans	-50.3	-42.6	-175.7	-165.1	-87.2	0	0	0	114.2	N219 K224	N219-F221 PolarHBondContact O-N 2.83Å; F221-K224 PolarHBondContact O-N 3.26Å
222	I	62.1	Low	74.5	Confident	128 Å²	128	84.1 Å²	84.1	66%	0.656	43%	0.426	S	S	*	.	H	α-helix	trans	-75	-29.8	-178	-57.9	172.9	0	0	0	112.5	N220	N220-I222 VanDerWaalsContact C-N 3.29Å; N220-I222 PolarHBondContact O-N 3.49Å; N220-I222 VanDerWaalsContact O-N 3.15Å
223	S	64.1	Low	74.8	Confident	42 Å²	42	89.1 Å²	89.1	29%	0.294	45%	0.447	S	S	.	.	H	α-helix	trans	-75.6	-40.7	172.7	-56.3	0	0	0	0	110.8	D218 N220 E225 K226 N227	D218-S223 WeakPolarHBondContact OD2-CB 3.45Å; N220-S223 PolarHBondContact O-N 2.93Å; S223-E225 PolarHBondContact O-N 3.26Å; S223-K226 PolarHBondContact O-N 3.26Å; S223-K226 VanDerWaalsContact O-N 3.09Å; S223-N227 PolarHBondContact O-N 3.1Å; S223-N227 PolarHBondContact O-OD1 2.58Å
224	K	65.9	Low	75.1	Confident	101 Å²	101	86.7 Å²	86.7	44%	0.439	44%	0.435	S	S	.	.	H	α-helix	trans	-51.9	-50.8	-174.9	-171.3	166	-176.2	169.6	0	112.3	N220 F221 K226 N227 W228	N220-K224 WeakPolarHBondContact O-CB 3.26Å; N220-K224 PolarHBondContact O-N 3.2Å; F221-K224 PolarHBondContact O-N 3.26Å; K224-K226 PolarHBondContact O-N 3.04Å; K224-N227 PolarHBondContact O-N 3.48Å; K224-W228 PolarHBondContact O-N 2.93Å
225	E	72.8	Confident	75.1	Confident	150 Å²	150	85.3 Å²	85.3	70%	0.701	43%	0.426	S	S	*	.	H	α-helix	trans	-56.8	-50.4	177.9	-173.1	172.9	-148.2	0	0	111.7	S223 N227 W228 D229	S223-E225 PolarHBondContact O-N 3.26Å; E225-N227 VanDerWaalsContact C-N 3.29Å; E225-N227 PolarHBondContact O-N 2.93Å; E225-W228 PolarHBondContact O-N 3.33Å; E225-D229 WeakPolarHBondContact O-CB 3.3Å; E225-D229 PolarHBondContact O-N 2.95Å
226	K	76.9	Confident	75.5	Confident	140 Å²	140	90.3 Å²	90.3	61%	0.609	45%	0.45	S	S	*	.	H	α-helix	trans	-62.2	-33.5	178.4	-62.5	177.2	-177	175.6	0	113.1	S223 K224 D229 L230	S223-K226 PolarHBondContact O-N 3.26Å; S223-K226 VanDerWaalsContact O-N 3.09Å; K224-K226 PolarHBondContact O-N 3.04Å; K226-D229 WeakPolarHBondContact O-CB 3.49Å; K226-D229 PolarHBondContact O-N 3.04Å; K226-L230 PolarHBondContact O-N 3.15Å
227	N	77.7	Confident	76.1	Confident	27 Å²	27	91.7 Å²	91.7	14%	0.144	45%	0.449	C	S	.	.	H	α-helix	trans	-72.3	-42.2	177.4	-63	-12.3	0	0	0	111.2	A215 D218 S223 K224 E225 D229 L230 V231	A215-N227 HydrophobicContact CB-CB 3.99Å; D218-N227 PolarHBondContact OD2-ND2 3.32Å; S223-N227 PolarHBondContact O-N 3.1Å; S223-N227 PolarHBondContact O-OD1 2.58Å; K224-N227 PolarHBondContact O-N 3.48Å; E225-N227 VanDerWaalsContact C-N 3.29Å; E225-N227 PolarHBondContact O-N 2.93Å; N227-D229 VanDerWaalsContact C-N 3.29Å; N227-D229 PolarHBondContact O-N 3.2Å; N227-L230 WeakPolarHBondContact O-CB 3.47Å; N227-L230 PolarHBondContact O-N 3.46Å; N227-V231 WeakPolarHBondContact O-CG2 3.48Å; N227-V231 PolarHBondContact O-N 3.43Å
228	W	80.5	Confident	76.7	Confident	81 Å²	81	85.5 Å²	85.5	31%	0.307	42%	0.42	S	S	.	.	H	α-helix	trans	-64.8	-35.8	171.9	-69.5	109.2	0	0	0	111.9	A215 K224 E225 L230 V231 G232 R313	A215-W228 HydrophobicContact CB-CD2 4.38Å; A215-W228 HydrophobicContact CB-CH2 4.23Å; A215-W228 HydrophobicContact CB-CZ2 4.06Å; A215-W228 HydrophobicContact CB-CZ3 4.5Å; K224-W228 PolarHBondContact O-N 2.93Å; E225-W228 PolarHBondContact O-N 3.33Å; W228-L230 VanDerWaalsContact C-N 3.29Å; W228-L230 PolarHBondContact O-N 2.86Å; W228-V231 HydrophobicContact CE3-CB 4.39Å; W228-V231 HydrophobicContact CE3-CG1 4.27Å; W228-V231 HydrophobicContact CZ3-CG1 4.34Å; W228-V231 PolarHBondContact O-N 3.3Å; W228-G232 PolarHBondContact O-N 3.41Å; W228-R313 HydrophobicContact CH2-CG 4.17Å
229	D	82.6	Confident	77.5	Confident	90 Å²	90	86.7 Å²	86.7	48%	0.481	43%	0.427	S	S	.	.	H	α-helix	trans	-62.8	-35.2	173.5	-142.9	36.9	0	0	0	111.8	E225 K226 N227 K233	E225-D229 WeakPolarHBondContact O-CB 3.3Å; E225-D229 PolarHBondContact O-N 2.95Å; K226-D229 WeakPolarHBondContact O-CB 3.49Å; K226-D229 PolarHBondContact O-N 3.04Å; N227-D229 VanDerWaalsContact C-N 3.29Å; N227-D229 PolarHBondContact O-N 3.2Å; D229-K233 VanDerWaalsContact CG-NZ 3.27Å; D229-K233 WeakPolarHBondContact O-CB 3.41Å; D229-K233 WeakPolarHBondContact O-CD 3.44Å; D229-K233 VanDerWaalsContact O-CE 3.31Å; D229-K233 WeakPolarHBondContact O-CE 3.48Å; D229-K233 WeakPolarHBondContact O-CG 3.5Å; D229-K233 PolarHBondContact O-N 2.82Å; D229-K233 IonicContact OD1-NZ 2.71Å; D229-K233 IonicContact OD2-NZ 3.01Å; D229-K233 PolarHBondContact OD2-NZ 3.07Å
230	L	83.4	Confident	78.9	Confident	88 Å²	88	86.5 Å²	86.5	46%	0.461	41%	0.414	S	S	.	.	H	α-helix	trans	-72.3	-45.9	172.2	-177	67.8	0	0	0	112	A211 K226 N227 W228 G232 K233 L234	A211-L230 HydrophobicContact CB-CD2 4.21Å; A211-L230 HydrophobicContact CB-CG 4.44Å; K226-L230 PolarHBondContact O-N 3.15Å; N227-L230 WeakPolarHBondContact O-CB 3.47Å; N227-L230 PolarHBondContact O-N 3.46Å; W228-L230 VanDerWaalsContact C-N 3.29Å; W228-L230 PolarHBondContact O-N 2.86Å; L230-G232 PolarHBondContact O-N 2.8Å; L230-K233 CarbonylContact O-C 3.59Å; L230-K233 PolarHBondContact O-N 3.13Å; L230-L234 HydrophobicContact CD1-CD1 4.31Å; L230-L234 HydrophobicContact CG-CD1 3.97Å; L230-L234 WeakPolarHBondContact O-CG 3.32Å; L230-L234 PolarHBondContact O-N 3.48Å
231	V	85.4	Confident	80.1	Confident	5 Å²	5	83 Å²	83	3%	0.03	40%	0.395	C	S	.	.	H	α-helix	trans	-57.6	-46.4	176.5	168.3	0	0	0	0	110.6	Y208 A211 L212 A215 N227 W228 K233 L234 E235	Y208-V231 HydrophobicContact CE2-CG1 3.86Å; A211-V231 HydrophobicContact CB-CG2 3.9Å; A211-V231 WeakPolarHBondContact O-CG2 3.42Å; L212-V231 HydrophobicContact CD2-CG1 3.78Å; L212-V231 HydrophobicContact CD2-CG2 4.31Å; A215-V231 HydrophobicContact CB-CG2 3.94Å; N227-V231 WeakPolarHBondContact O-CG2 3.48Å; N227-V231 PolarHBondContact O-N 3.43Å; W228-V231 HydrophobicContact CE3-CB 4.39Å; W228-V231 HydrophobicContact CE3-CG1 4.27Å; W228-V231 HydrophobicContact CZ3-CG1 4.34Å; W228-V231 PolarHBondContact O-N 3.3Å; V231-K233 PolarHBondContact O-N 3.24Å; V231-L234 CarbonylContact O-C 3.59Å; V231-L234 PolarHBondContact O-N 3Å; V231-L234 VanDerWaalsContact O-N 3.13Å; V231-E235 WeakPolarHBondContact O-CB 3.39Å; V231-E235 PolarHBondContact O-N 3.4Å
232	G	86.2	Confident	81.5	Confident	31 Å²	31	75.6 Å²	75.6	32%	0.32	36%	0.363	S	S	.	.	H	α-helix	trans	-63.9	-38.5	176.1	0	0	0	0	0	113.3	W228 L230 L234 E235 M236	W228-G232 PolarHBondContact O-N 3.41Å; L230-G232 PolarHBondContact O-N 2.8Å; G232-L234 VanDerWaalsContact C-N 3.26Å; G232-L234 PolarHBondContact O-N 3.4Å; G232-E235 PolarHBondContact O-N 3.42Å; G232-M236 WeakPolarHBondContact O-CB 3.44Å; G232-M236 VanDerWaalsContact O-CG 3.32Å; G232-M236 WeakPolarHBondContact O-CG 3.49Å; G232-M236 PolarHBondContact O-N 2.93Å
233	K	88	Confident	82.7	Confident	109 Å²	109	74.6 Å²	74.6	47%	0.474	36%	0.355	S	S	.	.	H	α-helix	trans	-68.8	-21.7	173.7	-72.2	162.7	-159.3	160.7	0	113.3	D229 L230 V231 K237	D229-K233 VanDerWaalsContact CG-NZ 3.27Å; D229-K233 WeakPolarHBondContact O-CB 3.41Å; D229-K233 WeakPolarHBondContact O-CD 3.44Å; D229-K233 VanDerWaalsContact O-CE 3.31Å; D229-K233 WeakPolarHBondContact O-CE 3.48Å; D229-K233 WeakPolarHBondContact O-CG 3.5Å; D229-K233 PolarHBondContact O-N 2.82Å; D229-K233 IonicContact OD1-NZ 2.71Å; D229-K233 IonicContact OD2-NZ 3.01Å; D229-K233 PolarHBondContact OD2-NZ 3.07Å; L230-K233 CarbonylContact O-C 3.59Å; L230-K233 PolarHBondContact O-N 3.13Å; V231-K233 PolarHBondContact O-N 3.24Å; K233-K237 WeakPolarHBondContact O-CD 3.42Å; K233-K237 VanDerWaalsContact O-CG 3.27Å; K233-K237 WeakPolarHBondContact O-CG 3.45Å
234	L	87.8	Confident	83.9	Confident	18 Å²	18	77.1 Å²	77.1	9%	0.094	36%	0.362	C	S	.	.	H	α-helix	trans	-89.4	-38.2	174.8	-73.3	167.2	0	0	0	111.8	K207 Y208 A211 L230 V231 G232 K237 K238	K207-L234 HydrophobicContact CB-CD2 4.38Å; K207-L234 WeakPolarHBondContact O-CD1 3.45Å; Y208-L234 HydrophobicContact CD2-CB 3.85Å; A211-L234 HydrophobicContact CB-CD1 3.49Å; A211-L234 VanDerWaalsContact CB-CD1 3.49Å; L230-L234 HydrophobicContact CD1-CD1 4.31Å; L230-L234 HydrophobicContact CG-CD1 3.97Å; L230-L234 WeakPolarHBondContact O-CG 3.32Å; L230-L234 PolarHBondContact O-N 3.48Å; V231-L234 CarbonylContact O-C 3.59Å; V231-L234 PolarHBondContact O-N 3Å; V231-L234 VanDerWaalsContact O-N 3.13Å; G232-L234 VanDerWaalsContact C-N 3.26Å; G232-L234 PolarHBondContact O-N 3.4Å; L234-K237 HydrophobicContact CD2-CD 4.49Å; L234-K237 CarbonylContact O-C 3.56Å; L234-K237 WeakPolarHBondContact O-CA 3.31Å; L234-K237 WeakPolarHBondContact O-CB 3.46Å; L234-K237 PolarHBondContact O-N 2.92Å; L234-K238 WeakPolarHBondContact O-CB 3.14Å; L234-K238 PolarHBondContact O-N 3.26Å
235	E	83.3	Confident	85	Confident	60 Å²	60	72.6 Å²	72.6	28%	0.28	34%	0.344	S	S	.	.	H	α-helix	trans	-60.2	-48.2	172.7	-169	152	-129.7	0	0	110.8	Y208 V231 G232 K237 K238 D239 K310	Y208-E235 HydrophobicContact CE2-CB 3.84Å; Y208-E235 HydrophobicContact CE2-CG 4.43Å; Y208-E235 PolarHBondContact OH-OE1 3.49Å; V231-E235 WeakPolarHBondContact O-CB 3.39Å; V231-E235 PolarHBondContact O-N 3.4Å; G232-E235 PolarHBondContact O-N 3.42Å; E235-K237 PolarHBondContact O-N 3.05Å; E235-K238 PolarHBondContact O-N 2.94Å; E235-K238 VanDerWaalsContact O-N 3.15Å; E235-D239 PolarHBondContact O-N 2.95Å; E235-K310 IonicContact OE1-NZ 2.74Å; E235-K310 PolarHBondContact OE1-NZ 3.24Å
236	M	86.4	Confident	85.8	Confident	108 Å²	108	68.9 Å²	68.9	53%	0.532	33%	0.326	S	S	.	.	H	α-helix	trans	-62.9	-12.8	172.9	-70.6	-62.6	-58.6	0	0	114.6	G232 R240	G232-M236 WeakPolarHBondContact O-CB 3.44Å; G232-M236 VanDerWaalsContact O-CG 3.32Å; G232-M236 WeakPolarHBondContact O-CG 3.49Å; G232-M236 PolarHBondContact O-N 2.93Å; M236-R240 WeakPolarHBondContact O-CD 3.29Å; M236-R240 VanDerWaalsContact O-CG 3.24Å; M236-R240 WeakPolarHBondContact O-CG 3.29Å; M236-R240 PolarHBondContact O-NE 2.92Å
237	K	88.2	Confident	86.4	Confident	118 Å²	118	67.2 Å²	67.2	51%	0.513	32%	0.319	S	S	.	.	H	α-helix	trans	-94	-43.8	170.8	-75.3	171.6	-177.1	178.6	0	111.7	V204 K233 L234 E235 R240 L241	V204-K237 HydrophobicContact CG1-CB 4.38Å; K233-K237 WeakPolarHBondContact O-CD 3.42Å; K233-K237 VanDerWaalsContact O-CG 3.27Å; K233-K237 WeakPolarHBondContact O-CG 3.45Å; L234-K237 HydrophobicContact CD2-CD 4.49Å; L234-K237 CarbonylContact O-C 3.56Å; L234-K237 WeakPolarHBondContact O-CA 3.31Å; L234-K237 WeakPolarHBondContact O-CB 3.46Å; L234-K237 PolarHBondContact O-N 2.92Å; E235-K237 PolarHBondContact O-N 3.05Å; K237-R240 PolarHBondContact O-N 2.87Å; K237-L241 WeakPolarHBondContact O-CG 3.47Å; K237-L241 PolarHBondContact O-N 2.63Å
238	K	87.5	Confident	87	Confident	11 Å²	11	67.7 Å²	67.7	5%	0.048	32%	0.321	C	S	.	.	H	α-helix	trans	-52.5	-56.5	173.6	174.9	-163.9	158.1	-65.9	0	109.5	F201 V204 Y208 L234 E235 R240 L241 E242 Q303	F201-K238 HydrophobicContact CE2-CG 3.93Å; V204-K238 HydrophobicContact CG1-CB 4.29Å; Y208-K238 HydrophobicContact CD1-CD 4.35Å; Y208-K238 HydrophobicContact CE1-CD 4.4Å; L234-K238 WeakPolarHBondContact O-CB 3.14Å; L234-K238 PolarHBondContact O-N 3.26Å; E235-K238 PolarHBondContact O-N 2.94Å; E235-K238 VanDerWaalsContact O-N 3.15Å; K238-R240 VanDerWaalsContact C-N 3.3Å; K238-R240 PolarHBondContact O-N 2.97Å; K238-L241 CarbonylContact O-C 3.52Å; K238-L241 WeakPolarHBondContact O-CA 3.43Å; K238-L241 PolarHBondContact O-N 3.39Å; K238-E242 WeakPolarHBondContact CE-OE2 3.34Å; K238-E242 IonicContact NZ-OE1 2.58Å; K238-E242 IonicContact NZ-OE2 2.74Å; K238-E242 PolarHBondContact NZ-OE2 3.36Å; K238-E242 WeakPolarHBondContact O-CB 3.36Å; K238-E242 PolarHBondContact O-N 3.36Å; K238-Q303 VanDerWaalsContact CE-OE1 3.26Å
239	D	87.7	Confident	87.4	Confident	73 Å²	73	65.1 Å²	65.1	39%	0.39	31%	0.314	S	S	.	.	H	α-helix	trans	-65.6	-33.8	-172.6	-61.9	-12.1	0	0	0	112.2	E235 E242 E243	E235-D239 PolarHBondContact O-N 2.95Å; D239-E242 PolarHBondContact O-N 3.25Å; D239-E243 PolarHBondContact O-N 3.11Å
240	R	88.1	Confident	87.7	Confident	156 Å²	156	64.3 Å²	64.3	59%	0.589	31%	0.308	S	S	*	.	H	α-helix	trans	-68.8	-30.9	172.4	-70.8	178.4	-174.3	178.7	0.9	113.6	M236 K237 K238 Q244	M236-R240 WeakPolarHBondContact O-CD 3.29Å; M236-R240 VanDerWaalsContact O-CG 3.24Å; M236-R240 WeakPolarHBondContact O-CG 3.29Å; M236-R240 PolarHBondContact O-NE 2.92Å; K237-R240 PolarHBondContact O-N 2.87Å; K238-R240 VanDerWaalsContact C-N 3.3Å; K238-R240 PolarHBondContact O-N 2.97Å; R240-Q244 WeakPolarHBondContact O-CG 3.42Å
241	L	88.7	Confident	87.9	Confident	29 Å²	29	65.2 Å²	65.2	15%	0.152	31%	0.309	C	S	.	.	H	α-helix	trans	-82.4	-33	175.1	-73.9	170.3	0	0	0	111.4	F201 V204 K237 K238 E243 Q244 V245	F201-L241 HydrophobicContact CD2-CB 3.79Å; F201-L241 HydrophobicContact CE2-CB 4.36Å; V204-L241 HydrophobicContact CB-CD1 4.05Å; V204-L241 HydrophobicContact CG1-CD1 4.17Å; V204-L241 HydrophobicContact CG2-CD1 3.69Å; K237-L241 WeakPolarHBondContact O-CG 3.47Å; K237-L241 PolarHBondContact O-N 2.63Å; K238-L241 CarbonylContact O-C 3.52Å; K238-L241 WeakPolarHBondContact O-CA 3.43Å; K238-L241 PolarHBondContact O-N 3.39Å; L241-E243 VanDerWaalsContact C-N 3.34Å; L241-E243 PolarHBondContact O-N 3.48Å; L241-Q244 PolarHBondContact O-N 3.03Å; L241-Q244 VanDerWaalsContact O-N 3.12Å; L241-V245 WeakPolarHBondContact O-CB 3.4Å; L241-V245 VanDerWaalsContact O-CG2 3.3Å; L241-V245 WeakPolarHBondContact O-CG2 3.31Å; L241-V245 PolarHBondContact O-N 3.42Å
242	E	87.4	Confident	88.1	Confident	22 Å²	22	65 Å²	65	10%	0.103	31%	0.308	C	S	.	.	H	α-helix	trans	-58.7	-46.7	174.5	-161.2	158.7	140.7	0	0	110	L154 F201 K238 D239 Q244 V245 E246 Q303	L154-E242 HydrophobicContact CD1-CG 4.26Å; L154-E242 HydrophobicContact CD2-CG 3.96Å; L154-E242 HydrophobicContact CG-CG 3.97Å; F201-E242 HydrophobicContact CE2-CB 3.88Å; F201-E242 HydrophobicContact CE2-CG 4.39Å; F201-E242 HydrophobicContact CZ-CB 3.78Å; F201-E242 HydrophobicContact CZ-CG 3.78Å; F201-E242 WeakPolarHBondContact CZ-OE2 3.47Å; K238-E242 WeakPolarHBondContact CE-OE2 3.34Å; K238-E242 IonicContact NZ-OE1 2.58Å; K238-E242 IonicContact NZ-OE2 2.74Å; K238-E242 PolarHBondContact NZ-OE2 3.36Å; K238-E242 WeakPolarHBondContact O-CB 3.36Å; K238-E242 PolarHBondContact O-N 3.36Å; D239-E242 PolarHBondContact O-N 3.25Å; E242-Q244 VanDerWaalsContact C-N 3.31Å; E242-Q244 PolarHBondContact O-N 3.4Å; E242-V245 PolarHBondContact O-N 2.97Å; E242-E246 VanDerWaalsContact O-CB 3.32Å; E242-E246 WeakPolarHBondContact O-CB 3.47Å; E242-E246 PolarHBondContact O-N 2.98Å; E242-Q303 VanDerWaalsContact CD-NE2 3.33Å; E242-Q303 PolarHBondContact OE1-NE2 3.48Å; E242-Q303 PolarHBondContact OE2-NE2 2.81Å
243	E	88.7	Confident	88.2	Confident	108 Å²	108	64.9 Å²	64.9	51%	0.505	30%	0.302	S	S	.	.	H	α-helix	trans	-64.7	-28.6	175.1	-158.2	-157.6	155.5	0	0	113.8	D239 L241 K247	D239-E243 PolarHBondContact O-N 3.11Å; L241-E243 VanDerWaalsContact C-N 3.34Å; L241-E243 PolarHBondContact O-N 3.48Å; E243-K247 VanDerWaalsContact O-CD 3.31Å; E243-K247 WeakPolarHBondContact O-CD 3.44Å; E243-K247 WeakPolarHBondContact O-CE 3.22Å; E243-K247 WeakPolarHBondContact O-CG 2.95Å; E243-K247 IonicContact OE1-NZ 3.78Å; E243-K247 PolarHBondContact OE1-NZ 3.5Å
244	Q	88.4	Confident	88.3	Confident	94 Å²	94	64 Å²	64	44%	0.439	30%	0.3	S	S	.	.	H	α-helix	trans	-81.6	-43.4	177	-72.8	177	20	0	0	111.9	R240 L241 E242 K247 I248	R240-Q244 WeakPolarHBondContact O-CG 3.42Å; L241-Q244 PolarHBondContact O-N 3.03Å; L241-Q244 VanDerWaalsContact O-N 3.12Å; E242-Q244 VanDerWaalsContact C-N 3.31Å; E242-Q244 PolarHBondContact O-N 3.4Å; Q244-K247 PolarHBondContact O-N 2.99Å; Q244-I248 VanDerWaalsContact O-CG1 3.32Å; Q244-I248 WeakPolarHBondContact O-CG1 3.48Å; Q244-I248 PolarHBondContact O-N 3.32Å; Q244-I248 VanDerWaalsContact O-N 3.13Å
245	V	89.8	Confident	88.1	Confident	7 Å²	7	63.7 Å²	63.7	4%	0.042	30%	0.298	C	S	.	.	H	α-helix	trans	-62.4	-45.7	176	167.1	0	0	0	0	110.1	K197 L198 F201 L241 E242 K247 I248 V249	K197-V245 HydrophobicContact CB-CG2 4.25Å; L198-V245 HydrophobicContact CD2-CG1 3.58Å; L198-V245 HydrophobicContact CG-CG1 4.25Å; F201-V245 HydrophobicContact CB-CG2 3.82Å; F201-V245 HydrophobicContact CD1-CG1 4.45Å; F201-V245 HydrophobicContact CD1-CG2 4.34Å; F201-V245 HydrophobicContact CG-CG2 4.1Å; L241-V245 WeakPolarHBondContact O-CB 3.4Å; L241-V245 VanDerWaalsContact O-CG2 3.3Å; L241-V245 WeakPolarHBondContact O-CG2 3.31Å; L241-V245 PolarHBondContact O-N 3.42Å; E242-V245 PolarHBondContact O-N 2.97Å; V245-K247 VanDerWaalsContact C-N 3.34Å; V245-K247 PolarHBondContact O-N 3.29Å; V245-I248 PolarHBondContact O-N 3.18Å; V245-V249 HydrophobicContact CG1-CG2 3.91Å; V245-V249 VanDerWaalsContact O-CB 3.3Å; V245-V249 WeakPolarHBondContact O-CB 3.47Å; V245-V249 VanDerWaalsContact O-CG2 3.26Å; V245-V249 WeakPolarHBondContact O-CG2 3.48Å; V245-V249 PolarHBondContact O-N 2.87Å
246	E	88.9	Confident	88.4	Confident	72 Å²	72	61.2 Å²	61.2	34%	0.336	29%	0.286	S	S	.	.	H	α-helix	trans	-55.1	-49	178.5	-179.2	176.3	-174.2	0	0	111.4	E242 I248 V249 Q250	E242-E246 VanDerWaalsContact O-CB 3.32Å; E242-E246 WeakPolarHBondContact O-CB 3.47Å; E242-E246 PolarHBondContact O-N 2.98Å; E246-I248 PolarHBondContact O-N 2.79Å; E246-V249 PolarHBondContact O-N 3.15Å; E246-Q250 VanDerWaalsContact CG-NE2 3.27Å; E246-Q250 WeakPolarHBondContact O-CB 3.13Å; E246-Q250 WeakPolarHBondContact O-CG 3.41Å; E246-Q250 PolarHBondContact O-N 3.02Å; E246-Q250 PolarHBondContact OE1-NE2 3.05Å
247	K	90.2	Very high	88.3	Confident	104 Å²	104	59.5 Å²	59.5	45%	0.452	28%	0.28	S	S	.	.	H	α-helix	trans	-63.3	-42.7	179.7	-68.6	169.1	-169.4	170.3	0	112.8	E243 Q244 V245 Q251	E243-K247 VanDerWaalsContact O-CD 3.31Å; E243-K247 WeakPolarHBondContact O-CD 3.44Å; E243-K247 WeakPolarHBondContact O-CE 3.22Å; E243-K247 WeakPolarHBondContact O-CG 2.95Å; E243-K247 IonicContact OE1-NZ 3.78Å; E243-K247 PolarHBondContact OE1-NZ 3.5Å; Q244-K247 PolarHBondContact O-N 2.99Å; V245-K247 VanDerWaalsContact C-N 3.34Å; V245-K247 PolarHBondContact O-N 3.29Å; K247-Q251 VanDerWaalsContact O-CG 3.31Å; K247-Q251 WeakPolarHBondContact O-CG 3.42Å; K247-Q251 PolarHBondContact O-N 3.37Å
248	I	89.4	Confident	88.3	Confident	38 Å²	38	58.5 Å²	58.5	20%	0.195	28%	0.277	C	S	.	.	H	α-helix	trans	-75.1	-35.6	-177.2	-64.2	170.5	0	0	0	110.9	A194 K197 Q244 V245 E246 Q251 A252	A194-I248 HydrophobicContact CB-CG2 3.95Å; K197-I248 HydrophobicContact CD-CD1 4.33Å; K197-I248 HydrophobicContact CG-CD1 3.85Å; Q244-I248 VanDerWaalsContact O-CG1 3.32Å; Q244-I248 WeakPolarHBondContact O-CG1 3.48Å; Q244-I248 PolarHBondContact O-N 3.32Å; Q244-I248 VanDerWaalsContact O-N 3.13Å; V245-I248 PolarHBondContact O-N 3.18Å; E246-I248 PolarHBondContact O-N 2.79Å; I248-Q251 PolarHBondContact O-N 3.04Å; I248-A252 WeakPolarHBondContact O-CB 3.27Å; I248-A252 PolarHBondContact O-N 3.29Å
249	V	89.2	Confident	88.3	Confident	26 Å²	26	58 Å²	58	16%	0.158	27%	0.274	C	S	.	.	H	α-helix	trans	-67.6	-40.9	172.9	171.5	0	0	0	0	111	A194 L198 V245 E246 Q251 A252 S253 I296	A194-V249 HydrophobicContact CB-CG2 4.49Å; L198-V249 HydrophobicContact CD1-CG2 4.04Å; L198-V249 HydrophobicContact CD2-CG2 4.15Å; L198-V249 HydrophobicContact CG-CG2 4.16Å; V245-V249 HydrophobicContact CG1-CG2 3.91Å; V245-V249 VanDerWaalsContact O-CB 3.3Å; V245-V249 WeakPolarHBondContact O-CB 3.47Å; V245-V249 VanDerWaalsContact O-CG2 3.26Å; V245-V249 WeakPolarHBondContact O-CG2 3.48Å; V245-V249 PolarHBondContact O-N 2.87Å; E246-V249 PolarHBondContact O-N 3.15Å; V249-Q251 VanDerWaalsContact C-N 3.33Å; V249-Q251 PolarHBondContact O-N 3.39Å; V249-A252 PolarHBondContact O-N 3.03Å; V249-S253 WeakPolarHBondContact O-CB 3.32Å; V249-S253 PolarHBondContact O-N 2.95Å; V249-S253 PolarHBondContact O-OG 3.46Å; V249-I296 HydrophobicContact CG1-CD1 3.89Å
250	Q	88.5	Confident	88.2	Confident	74 Å²	74	57.5 Å²	57.5	35%	0.346	27%	0.27	S	S	.	.	H	α-helix	trans	-62	-38.7	173.2	-75.4	173.4	10.8	0	0	112.3	E246 S253 Q254	E246-Q250 VanDerWaalsContact CG-NE2 3.27Å; E246-Q250 WeakPolarHBondContact O-CB 3.13Å; E246-Q250 WeakPolarHBondContact O-CG 3.41Å; E246-Q250 PolarHBondContact O-N 3.02Å; E246-Q250 PolarHBondContact OE1-NE2 3.05Å; Q250-S253 PolarHBondContact O-OG 3.46Å; Q250-S253 VanDerWaalsContact O-OG 3.1Å; Q250-Q254 WeakPolarHBondContact O-CB 3.34Å; Q250-Q254 VanDerWaalsContact O-CD 3.24Å; Q250-Q254 WeakPolarHBondContact O-CG 3.39Å; Q250-Q254 PolarHBondContact O-N 3.06Å
251	Q	89.1	Confident	88	Confident	107 Å²	107	53.9 Å²	53.9	50%	0.5	26%	0.259	S	S	.	.	H	α-helix	trans	-66.8	-42.6	174.1	-74.9	171.8	-15.1	0	0	112.2	K247 I248 V249 Q255	K247-Q251 VanDerWaalsContact O-CG 3.31Å; K247-Q251 WeakPolarHBondContact O-CG 3.42Å; K247-Q251 PolarHBondContact O-N 3.37Å; I248-Q251 PolarHBondContact O-N 3.04Å; V249-Q251 VanDerWaalsContact C-N 3.33Å; V249-Q251 PolarHBondContact O-N 3.39Å; Q251-Q255 PolarHBondContact O-N 3.48Å
252	A	88.7	Confident	87.8	Confident	1 Å²	1	53.1 Å²	53.1	1%	0.008	26%	0.255	C	S	.	.	H	α-helix	trans	-68.4	-35.3	177.5	0	0	0	0	0	112.7	V191 A194 I248 V249 L256 L292	V191-A252 HydrophobicContact CG2-CB 4.41Å; A194-A252 HydrophobicContact CB-CB 3.87Å; I248-A252 WeakPolarHBondContact O-CB 3.27Å; I248-A252 PolarHBondContact O-N 3.29Å; V249-A252 PolarHBondContact O-N 3.03Å; A252-L256 WeakPolarHBondContact O-CG 3.39Å; A252-L256 PolarHBondContact O-N 3.08Å; A252-L256 VanDerWaalsContact O-N 3.11Å; A252-L292 HydrophobicContact CB-CD2 4.2Å
253	S	88.9	Confident	87.5	Confident	27 Å²	27	52.7 Å²	52.7	19%	0.189	25%	0.253	C	S	.	.	H	α-helix	trans	-70.1	-44.9	175.4	71.1	0	0	0	0	111.6	V249 Q250 Q255 L256 D257	V249-S253 WeakPolarHBondContact O-CB 3.32Å; V249-S253 PolarHBondContact O-N 2.95Å; V249-S253 PolarHBondContact O-OG 3.46Å; Q250-S253 PolarHBondContact O-OG 3.46Å; Q250-S253 VanDerWaalsContact O-OG 3.1Å; S253-Q255 PolarHBondContact O-N 2.87Å; S253-L256 PolarHBondContact O-N 2.62Å; S253-D257 VanDerWaalsContact O-CG 3.28Å; S253-D257 PolarHBondContact O-N 3.15Å
254	Q	88.6	Confident	87.1	Confident	91 Å²	91	51.7 Å²	51.7	43%	0.425	25%	0.249	S	C	.	.	H	α-helix	trans	-53.2	-43.8	175	-76.4	161.8	16.1	0	0	111.6	Q250 D257 E258	Q250-Q254 WeakPolarHBondContact O-CB 3.34Å; Q250-Q254 VanDerWaalsContact O-CD 3.24Å; Q250-Q254 WeakPolarHBondContact O-CG 3.39Å; Q250-Q254 PolarHBondContact O-N 3.06Å; Q254-D257 PolarHBondContact O-N 2.9Å; Q254-E258 VanDerWaalsContact O-CG 3.31Å; Q254-E258 WeakPolarHBondContact O-CG 3.33Å; Q254-E258 PolarHBondContact O-N 2.86Å
255	Q	85.1	Confident	86.6	Confident	11 Å²	11	51.2 Å²	51.2	5%	0.051	25%	0.247	C	C	.	.	H	α-helix	trans	-70.9	-31.9	177	-76.9	-142.7	-70.1	0	0	115	D186 V187 R190 Q251 S253 D257 L259	D186-Q255 PolarHBondContact OD2-NE2 3.17Å; V187-Q255 HydrophobicContact CG1-CB 4.35Å; V187-Q255 HydrophobicContact CG2-CB 4.08Å; R190-Q255 VanDerWaalsContact CZ-NE2 3.28Å; R190-Q255 VanDerWaalsContact NH1-CD 3.31Å; R190-Q255 VanDerWaalsContact NH2-NE2 3.17Å; Q251-Q255 PolarHBondContact O-N 3.48Å; S253-Q255 PolarHBondContact O-N 2.87Å; Q255-D257 VanDerWaalsContact C-N 3.33Å; Q255-L259 VanDerWaalsContact O-CB 3.29Å; Q255-L259 WeakPolarHBondContact O-CB 3.44Å; Q255-L259 PolarHBondContact O-N 2.9Å
256	L	88.6	Confident	85.8	Confident	8 Å²	8	52 Å²	52	4%	0.042	25%	0.25	C	S	.	.	H	α-helix	trans	-68.5	-36.6	171.7	-76.8	166.5	0	0	0	110.8	V187 V191 A252 S253 H260 Y285 L288 L292	V187-L256 HydrophobicContact CG1-CD2 3.76Å; V187-L256 HydrophobicContact CG1-CG 4.04Å; V191-L256 HydrophobicContact CG2-CD1 4.01Å; V191-L256 HydrophobicContact CG2-CD2 4.4Å; V191-L256 HydrophobicContact CG2-CG 4.2Å; A252-L256 WeakPolarHBondContact O-CG 3.39Å; A252-L256 PolarHBondContact O-N 3.08Å; A252-L256 VanDerWaalsContact O-N 3.11Å; S253-L256 PolarHBondContact O-N 2.62Å; L256-H260 VanDerWaalsContact O-CB 3.26Å; L256-H260 WeakPolarHBondContact O-CB 3.15Å; L256-H260 PolarHBondContact O-N 2.91Å; L256-Y285 HydrophobicContact CB-CE2 4.28Å; L256-Y285 HydrophobicContact CD2-CD2 3.97Å; L256-Y285 HydrophobicContact CD2-CE2 4.14Å; L256-Y285 WeakPolarHBondContact O-CE2 3.16Å; L256-L288 HydrophobicContact CD2-CB 3.87Å; L256-L292 HydrophobicContact CD1-CD2 3.57Å
257	D	85.5	Confident	84.9	Confident	73 Å²	73	51.6 Å²	51.6	39%	0.39	25%	0.245	S	C	.	.	H	α-helix	trans	-68.4	-41.4	174.5	-61.9	-30.8	0	0	0	111.3	S253 Q254 Q255 H260 H261	S253-D257 VanDerWaalsContact O-CG 3.28Å; S253-D257 PolarHBondContact O-N 3.15Å; Q254-D257 PolarHBondContact O-N 2.9Å; Q255-D257 VanDerWaalsContact C-N 3.33Å; D257-H260 PolarHBondContact O-N 2.64Å; D257-H261 WeakPolarHBondContact O-CB 3.49Å; D257-H261 PolarHBondContact O-N 3.47Å
258	E	87.5	Confident	83.7	Confident	96 Å²	96	53.4 Å²	53.4	45%	0.449	26%	0.26	S	S	.	.	H	α-helix	trans	-58.7	-51.3	171.3	-74.8	167.7	179.4	0	0	111.7	Q254 H260 H261 I262	Q254-E258 VanDerWaalsContact O-CG 3.31Å; Q254-E258 WeakPolarHBondContact O-CG 3.33Å; Q254-E258 PolarHBondContact O-N 2.86Å; E258-H260 VanDerWaalsContact C-N 3.33Å; E258-H260 PolarHBondContact O-N 2.68Å; E258-H261 PolarHBondContact O-N 2.7Å; E258-I262 VanDerWaalsContact O-CG1 3.3Å; E258-I262 WeakPolarHBondContact O-CG1 3.24Å; E258-I262 PolarHBondContact O-N 3.32Å
259	L	87.8	Confident	82.5	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-61.6	-40.7	177.5	175.4	60.8	0	0	0	111.7	L180 V183 V184 V187 Q255 I262 I263 Y285	L180-L259 HydrophobicContact CD1-CD1 3.76Å; V183-L259 HydrophobicContact CG1-CD1 4.21Å; V184-L259 HydrophobicContact CG2-CD1 3.88Å; V184-L259 HydrophobicContact CG2-CD2 4.28Å; V187-L259 HydrophobicContact CB-CD2 4.19Å; V187-L259 HydrophobicContact CG1-CD2 4.18Å; V187-L259 HydrophobicContact CG2-CB 4.24Å; V187-L259 HydrophobicContact CG2-CD2 4.17Å; Q255-L259 VanDerWaalsContact O-CB 3.29Å; Q255-L259 WeakPolarHBondContact O-CB 3.44Å; Q255-L259 PolarHBondContact O-N 2.9Å; L259-I262 PolarHBondContact O-N 3.39Å; L259-I263 HydrophobicContact CD1-CD1 4.02Å; L259-I263 HydrophobicContact CD1-CG1 4.3Å; L259-I263 HydrophobicContact CG-CD1 4Å; L259-I263 VanDerWaalsContact O-CG1 3.28Å; L259-I263 WeakPolarHBondContact O-CG1 3.45Å; L259-I263 PolarHBondContact O-N 2.95Å; L259-Y285 HydrophobicContact CD2-CD2 4.3Å; L259-Y285 HydrophobicContact CG-CD2 4.44Å
260	H	85.4	Confident	81.2	Confident	63 Å²	63	59.8 Å²	59.8	29%	0.292	29%	0.292	S	S	.	.	H	α-helix	trans	-60.7	-46.7	175.6	-170.7	60.7	0	0	0	111.1	L256 D257 E258 I262 I263 E264 Y285	L256-H260 VanDerWaalsContact O-CB 3.26Å; L256-H260 WeakPolarHBondContact O-CB 3.15Å; L256-H260 PolarHBondContact O-N 2.91Å; D257-H260 PolarHBondContact O-N 2.64Å; E258-H260 VanDerWaalsContact C-N 3.33Å; E258-H260 PolarHBondContact O-N 2.68Å; H260-I262 PolarHBondContact O-N 2.87Å; H260-I263 WeakPolarHBondContact O-CB 3.36Å; H260-I263 PolarHBondContact O-N 3.4Å; H260-E264 WeakPolarHBondContact O-CG 3.22Å; H260-E264 PolarHBondContact O-N 2.84Å; H260-Y285 HydrophobicContact CB-CE2 3.75Å; H260-Y285 AromaticContact CG-CZ 3.78Å; H260-Y285 AromaticContact ND1-CE1 3.47Å; H260-Y285 WeakPolarHBondContact ND1-CE1 3.24Å; H260-Y285 AromaticContact ND1-CZ 3.46Å; H260-Y285 PolarHBondContact ND1-OH 3.21Å
261	H	84.6	Confident	79.9	Confident	80 Å²	80	62.5 Å²	62.5	37%	0.37	30%	0.304	S	S	.	.	H	α-helix	trans	-65.6	-38.5	179.2	-167.7	90.9	0	0	0	112.6	D257 E258 I263 E264 Q265	D257-H261 WeakPolarHBondContact O-CB 3.49Å; D257-H261 PolarHBondContact O-N 3.47Å; E258-H261 PolarHBondContact O-N 2.7Å; H261-I263 VanDerWaalsContact C-N 3.34Å; H261-I263 PolarHBondContact O-N 3.27Å; H261-E264 PolarHBondContact O-N 3.07Å; H261-Q265 PolarHBondContact CD2-NE2 3.32Å; H261-Q265 PolarHBondContact NE2-NE2 3.14Å; H261-Q265 WeakPolarHBondContact O-CG 3.25Å; H261-Q265 PolarHBondContact O-N 3.09Å
262	I	82.6	Confident	78.5	Confident	14 Å²	14	57.5 Å²	57.5	7%	0.072	28%	0.281	C	S	.	.	H	α-helix	trans	-62.1	-42.4	173.5	-67.4	162.9	0	0	0	110.4	V172 V175 L180 V183 E258 L259 H260 Q265 H266	V172-I262 HydrophobicContact CG1-CG1 4.41Å; V175-I262 HydrophobicContact CG2-CD1 4.06Å; L180-I262 HydrophobicContact CD1-CG2 3.78Å; V183-I262 HydrophobicContact CG1-CD1 4.33Å; E258-I262 VanDerWaalsContact O-CG1 3.3Å; E258-I262 WeakPolarHBondContact O-CG1 3.24Å; E258-I262 PolarHBondContact O-N 3.32Å; L259-I262 PolarHBondContact O-N 3.39Å; H260-I262 PolarHBondContact O-N 2.87Å; I262-Q265 PolarHBondContact O-N 3.05Å; I262-H266 WeakPolarHBondContact CG2-NE2 3.42Å; I262-H266 PolarHBondContact O-CD2 3.25Å; I262-H266 PolarHBondContact O-N 2.82Å
263	I	82.1	Confident	77.1	Confident	12 Å²	12	59.5 Å²	59.5	6%	0.062	29%	0.291	C	S	.	.	H	α-helix	trans	-61.7	-43.5	173.6	-70.2	167.1	0	0	0	111	L259 H260 H261 H266 R267 I282 Y285	L259-I263 HydrophobicContact CD1-CD1 4.02Å; L259-I263 HydrophobicContact CD1-CG1 4.3Å; L259-I263 HydrophobicContact CG-CD1 4Å; L259-I263 VanDerWaalsContact O-CG1 3.28Å; L259-I263 WeakPolarHBondContact O-CG1 3.45Å; L259-I263 PolarHBondContact O-N 2.95Å; H260-I263 WeakPolarHBondContact O-CB 3.36Å; H260-I263 PolarHBondContact O-N 3.4Å; H261-I263 VanDerWaalsContact C-N 3.34Å; H261-I263 PolarHBondContact O-N 3.27Å; I263-H266 PolarHBondContact O-N 3.34Å; I263-R267 WeakPolarHBondContact O-CB 3.39Å; I263-R267 PolarHBondContact O-N 3.49Å; I263-I282 HydrophobicContact CG2-CD1 4.34Å; I263-I282 HydrophobicContact CG2-CG1 3.8Å; I263-Y285 HydrophobicContact CD1-CG 4.42Å
264	E	79.6	Confident	76	Confident	87 Å²	87	63 Å²	63	41%	0.407	31%	0.308	S	S	.	.	H	α-helix	trans	-64.7	-37.5	176.7	-71.6	-148.5	114.1	0	0	113.5	H260 H261 R267 N268	H260-E264 WeakPolarHBondContact O-CG 3.22Å; H260-E264 PolarHBondContact O-N 2.84Å; H261-E264 PolarHBondContact O-N 3.07Å; E264-R267 WeakPolarHBondContact O-CB 3.4Å; E264-N268 PolarHBondContact O-ND2 3.14Å; E264-N268 VanDerWaalsContact O-ND2 3.13Å
265	Q	79.1	Confident	75.1	Confident	84 Å²	84	60 Å²	60	39%	0.393	30%	0.297	S	S	.	.	H	α-helix	trans	-62.6	-52.2	173	-73.6	-173.5	8	0	0	110.8	H261 I262 R267 N268	H261-Q265 PolarHBondContact CD2-NE2 3.32Å; H261-Q265 PolarHBondContact NE2-NE2 3.14Å; H261-Q265 WeakPolarHBondContact O-CG 3.25Å; H261-Q265 PolarHBondContact O-N 3.09Å; I262-Q265 PolarHBondContact O-N 3.05Å; Q265-R267 VanDerWaalsContact C-N 3.28Å; Q265-R267 PolarHBondContact O-N 3.49Å; Q265-N268 PolarHBondContact O-N 3Å
266	H	71.4	Confident	74.7	Confident	25 Å²	25	63.9 Å²	63.9	12%	0.116	32%	0.318	C	S	.	.	H	α-helix	trans	-66.3	-27.5	-179.3	-65.5	-49.5	0	0	0	113.2	V175 F177 I262 I263 N268 S269 A272 I278	V175-H266 PolarHBondContact O-CE1 3.43Å; F177-H266 HydrophobicContact CD2-CB 4.39Å; I262-H266 WeakPolarHBondContact CG2-NE2 3.42Å; I262-H266 PolarHBondContact O-CD2 3.25Å; I262-H266 PolarHBondContact O-N 2.82Å; I263-H266 PolarHBondContact O-N 3.34Å; H266-N268 PolarHBondContact O-N 3.04Å; H266-S269 WeakPolarHBondContact O-CB 3.01Å; H266-S269 PolarHBondContact O-N 3.03Å; H266-A272 WeakPolarHBondContact O-CB 3.46Å; H266-I278 HydrophobicContact CB-CD1 4.15Å
267	R	70	Confident	74.1	Confident	63 Å²	63	65.2 Å²	65.2	24%	0.238	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.1	-29.8	177	-165.8	-177.7	-163.2	154.3	16.1	114.2	I263 E264 Q265 E412	I263-R267 WeakPolarHBondContact O-CB 3.39Å; I263-R267 PolarHBondContact O-N 3.49Å; E264-R267 WeakPolarHBondContact O-CB 3.4Å; Q265-R267 VanDerWaalsContact C-N 3.28Å; Q265-R267 PolarHBondContact O-N 3.49Å; R267-E412 IonicContact CZ-OE1 2.69Å; R267-E412 VanDerWaalsContact CZ-OE1 3.24Å; R267-E412 IonicContact NH1-OE1 2.69Å; R267-E412 PolarHBondContact NH1-OE1 2.99Å; R267-E412 IonicContact NH2-OE1 2.98Å; R267-E412 PolarHBondContact NH2-OE1 3.03Å
268	N	65.8	Low	73.8	Confident	141 Å²	141	61.8 Å²	61.8	75%	0.754	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96	-3.7	-176.5	-62.9	-67.6	0	0	0	114	E264 Q265 H266	E264-N268 PolarHBondContact O-ND2 3.14Å; E264-N268 VanDerWaalsContact O-ND2 3.13Å; Q265-N268 PolarHBondContact O-N 3Å; H266-N268 PolarHBondContact O-N 3.04Å
269	S	64.9	Low	73.5	Confident	42 Å²	42	57.6 Å²	57.6	29%	0.294	29%	0.288	S	S	.	.	S	Bend	trans	-71.8	141.6	173.9	-178.2	0	0	0	0	110.7	H266 Q271 A272	H266-S269 WeakPolarHBondContact O-CB 3.01Å; H266-S269 PolarHBondContact O-N 3.03Å; S269-Q271 PolarHBondContact O-N 3.45Å; S269-Q271 PolarHBondContact OG-N 3.07Å; S269-A272 WeakPolarHBondContact O-CB 3.45Å; S269-A272 PolarHBondContact O-N 3.19Å; S269-A272 VanDerWaalsContact O-N 3.08Å
270	E	61.5	Low	73.3	Confident	156 Å²	156	62.1 Å²	62.1	73%	0.729	31%	0.312	S	S	*	.	G	3₁₀ helix	trans	-67.3	-26.2	177	-170.5	156.8	-142.8	0	0	112.6	A272 R423	E270-A272 PolarHBondContact O-N 3.29Å; E270-R423 PolarHBondContact O-NH2 3.27Å; E270-R423 IonicContact OE1-NH2 3.74Å
271	Q	61	Low	73.1	Confident	131 Å²	131	59.3 Å²	59.3	61%	0.612	30%	0.3	S	S	*	.	G	3₁₀ helix	trans	-71.8	-14.3	174.3	-60	169.6	-8.8	0	0	113	S269 I273	S269-Q271 PolarHBondContact O-N 3.45Å; S269-Q271 PolarHBondContact OG-N 3.07Å; Q271-I273 PolarHBondContact O-N 3.08Å
272	A	58.8	Low	73.1	Confident	2 Å²	2	55.9 Å²	55.9	2%	0.017	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-62.8	-29.9	-179.8	0	0	0	0	0	113.6	H266 S269 E270 I278	H266-A272 WeakPolarHBondContact O-CB 3.46Å; S269-A272 WeakPolarHBondContact O-CB 3.45Å; S269-A272 PolarHBondContact O-N 3.19Å; S269-A272 VanDerWaalsContact O-N 3.08Å; E270-A272 PolarHBondContact O-N 3.29Å; A272-I278 HydrophobicContact CB-CD1 3.35Å
273	I	61.3	Low	73.3	Confident	43 Å²	43	59.5 Å²	59.5	22%	0.221	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-33.8	-164.7	-68.6	164	0	0	0	111.1	Q271 R420	Q271-I273 PolarHBondContact O-N 3.08Å; I273-R420 HydrophobicContact CG2-CG 3.8Å; I273-R420 WeakPolarHBondContact O-CD 3.47Å; I273-R420 WeakPolarHBondContact O-CG 3.37Å
274	D	63.9	Low	73.4	Confident	102 Å²	102	60 Å²	60	55%	0.545	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-13	-174.7	-49.5	-52.3	0	0	0	113.4	R423	D274-R423 IonicContact OD1-CZ 2.64Å; D274-R423 IonicContact OD1-NH1 3.15Å; D274-R423 PolarHBondContact OD1-NH1 3.24Å; D274-R423 IonicContact OD2-CZ 3.09Å; D274-R423 IonicContact OD2-NH1 2.73Å; D274-R423 PolarHBondContact OD2-NH1 3.24Å
275	S	70.3	Confident	73.7	Confident	28 Å²	28	56.9 Å²	56.9	20%	0.196	29%	0.29	C	S	.	.			trans	-100.8	136.2	-176.3	-179.6	0	0	0	0	112.9	I277	S275-I277 PolarHBondContact O-N 2.83Å; S275-I277 WeakPolarHBondContact OG-CB 3.47Å; S275-I277 WeakPolarHBondContact OG-CG1 3.35Å; S275-I277 PolarHBondContact OG-N 3.44Å
276	N	76.3	Confident	74.1	Confident	92 Å²	92	53.4 Å²	53.4	49%	0.492	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-14.9	173.3	-70.3	-25.2	0	0	0	113.5	I278 P279 D280 R420	N276-I278 PolarHBondContact O-N 2.88Å; N276-I278 VanDerWaalsContact O-N 3.07Å; N276-P279 WeakPolarHBondContact O-CD 3.34Å; N276-P279 VanDerWaalsContact O-CG 3.26Å; N276-P279 WeakPolarHBondContact O-CG 3.44Å; N276-D280 WeakPolarHBondContact O-CB 3.43Å; N276-D280 PolarHBondContact O-N 2.93Å; N276-R420 PolarHBondContact OD1-NH1 3.06Å
277	I	75.7	Confident	74.9	Confident	36 Å²	36	57.4 Å²	57.4	19%	0.185	29%	0.294	C	S	.	.	H	α-helix	trans	-55.1	-35.1	-175.9	-64.4	170.9	0	0	0	111.9	F177 Y178 L180 P181 S275 S281	F177-I277 HydrophobicContact CE1-CD1 4.09Å; F177-I277 HydrophobicContact CE2-CG2 4.46Å; F177-I277 HydrophobicContact CZ-CB 4.08Å; F177-I277 HydrophobicContact CZ-CD1 4.48Å; F177-I277 HydrophobicContact CZ-CG2 4.41Å; Y178-I277 HydrophobicContact CD1-CD1 4.4Å; L180-I277 HydrophobicContact CB-CG2 4.37Å; L180-I277 HydrophobicContact CD2-CG2 4.18Å; P181-I277 HydrophobicContact CG-CG2 4.09Å; S275-I277 PolarHBondContact O-N 2.83Å; S275-I277 WeakPolarHBondContact OG-CB 3.47Å; S275-I277 WeakPolarHBondContact OG-CG1 3.35Å; S275-I277 PolarHBondContact OG-N 3.44Å; I277-S281 VanDerWaalsContact O-CB 3.24Å; I277-S281 WeakPolarHBondContact O-CB 3.49Å; I277-S281 PolarHBondContact O-N 2.77Å; I277-S281 PolarHBondContact O-OG 3.19Å
278	I	79.8	Confident	75.8	Confident	1 Å²	1	55.2 Å²	55.2	1%	0.005	29%	0.287	C	S	.	.	H	α-helix	trans	-74.1	-56	179.5	-69.6	177.1	0	0	0	113.4	F177 H266 A272 N276 D280 S281 I282	F177-I278 HydrophobicContact CE2-CD1 3.82Å; F177-I278 HydrophobicContact CE2-CG1 3.74Å; F177-I278 HydrophobicContact CZ-CD1 4.32Å; F177-I278 HydrophobicContact CZ-CG1 4.2Å; H266-I278 HydrophobicContact CB-CD1 4.15Å; A272-I278 HydrophobicContact CB-CD1 3.35Å; N276-I278 PolarHBondContact O-N 2.88Å; N276-I278 VanDerWaalsContact O-N 3.07Å; I278-D280 PolarHBondContact O-N 3.47Å; I278-S281 PolarHBondContact O-N 2.99Å; I278-S281 VanDerWaalsContact O-N 3.11Å; I278-I282 HydrophobicContact CG2-CD1 3.66Å; I278-I282 HydrophobicContact CG2-CG1 4.32Å; I278-I282 WeakPolarHBondContact O-CG1 3.47Å; I278-I282 PolarHBondContact O-N 3.29Å
279	P	82.5	Confident	76.9	Confident	8 Å²	8	50.6 Å²	50.6	5%	0.052	26%	0.261	C	S	.	.	H	α-helix	trans	-58.7	-35.6	176.3	20.2	-31.4	0	0	0	112.3	N276 I282 E283	N276-P279 WeakPolarHBondContact O-CD 3.34Å; N276-P279 VanDerWaalsContact O-CG 3.26Å; N276-P279 WeakPolarHBondContact O-CG 3.44Å; P279-I282 PolarHBondContact O-N 3.2Å; P279-E283 WeakPolarHBondContact O-CB 3.49Å; P279-E283 PolarHBondContact O-N 3.4Å
280	D	82.3	Confident	77.9	Confident	94 Å²	94	52.5 Å²	52.5	50%	0.503	26%	0.262	S	S	.	.	H	α-helix	trans	-63.7	-43.6	174.7	-60.8	-11.2	0	0	0	111.1	N276 I278 E283 S284	N276-D280 WeakPolarHBondContact O-CB 3.43Å; N276-D280 PolarHBondContact O-N 2.93Å; I278-D280 PolarHBondContact O-N 3.47Å; D280-E283 PolarHBondContact O-N 3Å; D280-S284 PolarHBondContact O-N 3.44Å
281	S	82.3	Confident	79.2	Confident	5 Å²	5	48 Å²	48	4%	0.035	24%	0.243	C	C	.	.	H	α-helix	trans	-68.2	-36.5	176.7	-59.8	0	0	0	0	113.1	L180 I277 I278 E283 S284 Y285	L180-S281 WeakPolarHBondContact CD2-OG 3.45Å; I277-S281 VanDerWaalsContact O-CB 3.24Å; I277-S281 WeakPolarHBondContact O-CB 3.49Å; I277-S281 PolarHBondContact O-N 2.77Å; I277-S281 PolarHBondContact O-OG 3.19Å; I278-S281 PolarHBondContact O-N 2.99Å; I278-S281 VanDerWaalsContact O-N 3.11Å; S281-E283 VanDerWaalsContact C-N 3.32Å; S281-S284 PolarHBondContact O-N 2.91Å; S281-Y285 VanDerWaalsContact O-CB 3.28Å; S281-Y285 WeakPolarHBondContact O-CB 3.47Å; S281-Y285 PolarHBondContact O-N 2.89Å
282	I	84.1	Confident	80.5	Confident	8 Å²	8	42.1 Å²	42.1	4%	0.041	22%	0.216	C	C	.	.	H	α-helix	trans	-64.6	-39.1	172.6	-69.3	167.7	0	0	0	110.1	I263 I278 P279 G286 T409 I413	I263-I282 HydrophobicContact CG2-CD1 4.34Å; I263-I282 HydrophobicContact CG2-CG1 3.8Å; I278-I282 HydrophobicContact CG2-CD1 3.66Å; I278-I282 HydrophobicContact CG2-CG1 4.32Å; I278-I282 WeakPolarHBondContact O-CG1 3.47Å; I278-I282 PolarHBondContact O-N 3.29Å; P279-I282 PolarHBondContact O-N 3.2Å; I282-G286 PolarHBondContact O-N 2.93Å; I282-T409 HydrophobicContact CG2-CG2 4.46Å; I282-I413 HydrophobicContact CG2-CD1 4.41Å; I282-I413 HydrophobicContact CG2-CG1 4.07Å
283	E	86.3	Confident	81.9	Confident	89 Å²	89	44 Å²	44	42%	0.416	23%	0.227	S	C	.	.	H	α-helix	trans	-68.4	-42.8	177.4	-156.3	-173.3	122.1	0	0	111.9	P279 D280 S281 G286 K287 I413	P279-E283 WeakPolarHBondContact O-CB 3.49Å; P279-E283 PolarHBondContact O-N 3.4Å; D280-E283 PolarHBondContact O-N 3Å; S281-E283 VanDerWaalsContact C-N 3.32Å; E283-G286 PolarHBondContact O-N 2.82Å; E283-K287 WeakPolarHBondContact O-CD 3.48Å; E283-K287 VanDerWaalsContact O-CG 3.26Å; E283-K287 WeakPolarHBondContact O-CG 3.39Å; E283-K287 PolarHBondContact O-N 2.55Å; E283-K287 WeakPolarHBondContact OE1-CE 3.44Å; E283-K287 IonicContact OE1-NZ 3.87Å; E283-K287 PolarHBondContact OE1-NZ 3.36Å; E283-I413 HydrophobicContact CB-CD1 3.92Å; E283-I413 HydrophobicContact CG-CD1 4.05Å
284	S	83.8	Confident	83.1	Confident	23 Å²	23	42.9 Å²	42.9	16%	0.161	23%	0.226	C	C	.	.	H	α-helix	trans	-63.7	-46.5	172.2	-86.4	0	0	0	0	112.2	E188 D280 S281 G286 K287 L288	E188-S284 PolarHBondContact OE1-OG 3.28Å; D280-S284 PolarHBondContact O-N 3.44Å; S281-S284 PolarHBondContact O-N 2.91Å; S284-G286 VanDerWaalsContact C-N 3.33Å; S284-G286 PolarHBondContact O-N 3.02Å; S284-K287 PolarHBondContact O-N 2.84Å; S284-L288 WeakPolarHBondContact O-CB 3.46Å; S284-L288 VanDerWaalsContact O-CG 3.24Å; S284-L288 WeakPolarHBondContact O-CG 3.15Å; S284-L288 PolarHBondContact O-N 2.96Å
285	Y	87.4	Confident	84.2	Confident	21 Å²	21	39 Å²	39	8%	0.082	21%	0.207	C	C	.	.	H	α-helix	trans	-55.6	-47.1	175	171.3	-102.5	0	0	0	112	L256 L259 H260 I263 S281 K287 L288 Q289	L256-Y285 HydrophobicContact CB-CE2 4.28Å; L256-Y285 HydrophobicContact CD2-CD2 3.97Å; L256-Y285 HydrophobicContact CD2-CE2 4.14Å; L256-Y285 WeakPolarHBondContact O-CE2 3.16Å; L259-Y285 HydrophobicContact CD2-CD2 4.3Å; L259-Y285 HydrophobicContact CG-CD2 4.44Å; H260-Y285 HydrophobicContact CB-CE2 3.75Å; H260-Y285 AromaticContact CG-CZ 3.78Å; H260-Y285 AromaticContact ND1-CE1 3.47Å; H260-Y285 WeakPolarHBondContact ND1-CE1 3.24Å; H260-Y285 AromaticContact ND1-CZ 3.46Å; H260-Y285 PolarHBondContact ND1-OH 3.21Å; I263-Y285 HydrophobicContact CD1-CG 4.42Å; S281-Y285 VanDerWaalsContact O-CB 3.28Å; S281-Y285 WeakPolarHBondContact O-CB 3.47Å; S281-Y285 PolarHBondContact O-N 2.89Å; Y285-K287 PolarHBondContact O-N 3.39Å; Y285-L288 PolarHBondContact O-N 3.04Å; Y285-Q289 WeakPolarHBondContact O-CB 3.4Å; Y285-Q289 PolarHBondContact O-N 3.01Å; Y285-Q289 PolarHBondContact OH-NE2 2.9Å; Y285-Q289 VanDerWaalsContact OH-NE2 3.08Å
286	G	86.6	Confident	85.1	Confident	12 Å²	12	39.4 Å²	39.4	12%	0.124	21%	0.206	C	C	.	.	H	α-helix	trans	-61.9	-40.2	178	0	0	0	0	0	113.6	I282 E283 S284 Y290	I282-G286 PolarHBondContact O-N 2.93Å; E283-G286 PolarHBondContact O-N 2.82Å; S284-G286 VanDerWaalsContact C-N 3.33Å; S284-G286 PolarHBondContact O-N 3.02Å; G286-Y290 VanDerWaalsContact O-CB 3.28Å; G286-Y290 WeakPolarHBondContact O-CB 3.39Å; G286-Y290 PolarHBondContact O-N 2.65Å; G286-Y290 VanDerWaalsContact O-N 3.08Å
287	K	88.4	Confident	85.6	Confident	108 Å²	108	35.1 Å²	35.1	47%	0.47	18%	0.183	S	C	.	.	H	α-helix	trans	-63.7	-48.5	173.7	-72	161.9	-175.2	158.4	0	111.6	E283 S284 Y285 Y290 D291	E283-K287 WeakPolarHBondContact O-CD 3.48Å; E283-K287 VanDerWaalsContact O-CG 3.26Å; E283-K287 WeakPolarHBondContact O-CG 3.39Å; E283-K287 PolarHBondContact O-N 2.55Å; E283-K287 WeakPolarHBondContact OE1-CE 3.44Å; E283-K287 IonicContact OE1-NZ 3.87Å; E283-K287 PolarHBondContact OE1-NZ 3.36Å; S284-K287 PolarHBondContact O-N 2.84Å; Y285-K287 PolarHBondContact O-N 3.39Å; K287-Y290 PolarHBondContact O-N 3.37Å; K287-D291 WeakPolarHBondContact O-CB 3.32Å; K287-D291 PolarHBondContact O-N 2.71Å
288	L	88.6	Confident	86	Confident	17 Å²	17	37.9 Å²	37.9	9%	0.089	19%	0.194	C	C	.	.	H	α-helix	trans	-65.5	-42	-176.7	-67.7	167.4	0	0	0	112.2	V187 E188 V191 L256 S284 Y285 D291 L292	V187-L288 HydrophobicContact CG1-CD1 4.25Å; E188-L288 HydrophobicContact CB-CD2 4.42Å; E188-L288 HydrophobicContact CG-CD1 3.77Å; E188-L288 HydrophobicContact CG-CD2 4Å; E188-L288 HydrophobicContact CG-CG 4.36Å; V191-L288 HydrophobicContact CB-CD2 3.94Å; V191-L288 HydrophobicContact CG1-CB 4.38Å; V191-L288 HydrophobicContact CG1-CD2 3.82Å; V191-L288 HydrophobicContact CG2-CB 4.41Å; V191-L288 HydrophobicContact CG2-CD2 4.36Å; L256-L288 HydrophobicContact CD2-CB 3.87Å; S284-L288 WeakPolarHBondContact O-CB 3.46Å; S284-L288 VanDerWaalsContact O-CG 3.24Å; S284-L288 WeakPolarHBondContact O-CG 3.15Å; S284-L288 PolarHBondContact O-N 2.96Å; Y285-L288 PolarHBondContact O-N 3.04Å; L288-D291 PolarHBondContact O-N 3.48Å; L288-L292 WeakPolarHBondContact O-CB 3.29Å; L288-L292 PolarHBondContact O-N 3.24Å
289	Q	88.1	Confident	86.4	Confident	44 Å²	44	38.2 Å²	38.2	21%	0.206	20%	0.196	C	C	.	.	H	α-helix	trans	-62.3	-45.8	173.3	-172.9	-177.5	73.4	0	0	111.1	Y285 D291 L292 T293 N405	Y285-Q289 WeakPolarHBondContact O-CB 3.4Å; Y285-Q289 PolarHBondContact O-N 3.01Å; Y285-Q289 PolarHBondContact OH-NE2 2.9Å; Y285-Q289 VanDerWaalsContact OH-NE2 3.08Å; Q289-D291 PolarHBondContact O-N 3.47Å; Q289-L292 PolarHBondContact O-N 3.3Å; Q289-T293 WeakPolarHBondContact O-CB 3.35Å; Q289-T293 PolarHBondContact O-N 3.45Å; Q289-T293 PolarHBondContact O-OG1 3.3Å; Q289-N405 PolarHBondContact OE1-ND2 3.42Å
290	Y	87.8	Confident	86.5	Confident	82 Å²	82	39.6 Å²	39.6	32%	0.322	21%	0.205	S	C	.	.	H	α-helix	trans	-60.3	-43.9	178.1	179.4	-89.1	0	0	0	112.5	G286 K287 G294 Q402	G286-Y290 VanDerWaalsContact O-CB 3.28Å; G286-Y290 WeakPolarHBondContact O-CB 3.39Å; G286-Y290 PolarHBondContact O-N 2.65Å; G286-Y290 VanDerWaalsContact O-N 3.08Å; K287-Y290 PolarHBondContact O-N 3.37Å; Y290-G294 WeakPolarHBondContact O-CA 3.5Å; Y290-G294 PolarHBondContact O-N 3.25Å; Y290-Q402 HydrophobicContact CD2-CG 3.78Å; Y290-Q402 HydrophobicContact CE2-CG 3.95Å; Y290-Q402 PolarHBondContact O-NE2 3.43Å
291	D	87.3	Confident	86.6	Confident	61 Å²	61	40.2 Å²	40.2	33%	0.326	20%	0.203	S	C	.	.	H	α-helix	trans	-70.7	-38.2	-179.5	-94.5	30.7	0	0	0	112.8	K195 K287 L288 Q289 S295	K195-D291 HydrophobicContact CD-CB 4.47Å; K195-D291 IonicContact NZ-OD2 3.37Å; K195-D291 PolarHBondContact NZ-OD2 3.35Å; K287-D291 WeakPolarHBondContact O-CB 3.32Å; K287-D291 PolarHBondContact O-N 2.71Å; L288-D291 PolarHBondContact O-N 3.48Å; Q289-D291 PolarHBondContact O-N 3.47Å; D291-S295 WeakPolarHBondContact O-CB 3.45Å; D291-S295 PolarHBondContact O-N 2.68Å; D291-S295 PolarHBondContact O-OG 2.92Å
292	L	88.7	Confident	86.8	Confident	8 Å²	8	41.1 Å²	41.1	4%	0.042	21%	0.207	C	C	.	.	H	α-helix	trans	-68.7	-51.6	175.9	-175.7	62.1	0	0	0	111	V191 A194 L198 A252 L256 L288 Q289 G294 S295 I296	V191-L292 HydrophobicContact CG1-CB 4.36Å; A194-L292 HydrophobicContact CB-CD1 4Å; L198-L292 HydrophobicContact CD1-CD1 3.97Å; A252-L292 HydrophobicContact CB-CD2 4.2Å; L256-L292 HydrophobicContact CD1-CD2 3.57Å; L288-L292 WeakPolarHBondContact O-CB 3.29Å; L288-L292 PolarHBondContact O-N 3.24Å; Q289-L292 PolarHBondContact O-N 3.3Å; L292-G294 VanDerWaalsContact C-N 3.35Å; L292-G294 PolarHBondContact O-N 3.47Å; L292-S295 WeakPolarHBondContact O-CB 3.08Å; L292-S295 PolarHBondContact O-N 2.83Å; L292-S295 VanDerWaalsContact O-N 3.14Å; L292-I296 HydrophobicContact CD1-CD1 4.3Å; L292-I296 HydrophobicContact CG-CD1 4Å; L292-I296 WeakPolarHBondContact O-CG1 3.4Å; L292-I296 PolarHBondContact O-N 3.26Å
293	T	88.1	Confident	86.8	Confident	43 Å²	43	41.6 Å²	41.6	26%	0.264	21%	0.209	S	C	.	.	H	α-helix	trans	-61.3	-42	176.6	-61.5	0	0	0	0	111.6	Q289 S295 I296 N297 Q402	Q289-T293 WeakPolarHBondContact O-CB 3.35Å; Q289-T293 PolarHBondContact O-N 3.45Å; Q289-T293 PolarHBondContact O-OG1 3.3Å; T293-S295 VanDerWaalsContact C-N 3.26Å; T293-S295 PolarHBondContact O-N 2.99Å; T293-I296 PolarHBondContact O-N 2.8Å; T293-N297 WeakPolarHBondContact O-CB 3.28Å; T293-N297 PolarHBondContact O-N 3.22Å; T293-N297 PolarHBondContact O-OD1 3.28Å; T293-Q402 HydrophobicContact CG2-CB 4.39Å; T293-Q402 HydrophobicContact CG2-CG 4.34Å
294	G	87.4	Confident	86.6	Confident	19 Å²	19	39.2 Å²	39.2	20%	0.196	20%	0.199	C	C	.	.	H	α-helix	trans	-61.5	-32.5	175.5	0	0	0	0	0	113.5	Y290 L292 K298	Y290-G294 WeakPolarHBondContact O-CA 3.5Å; Y290-G294 PolarHBondContact O-N 3.25Å; L292-G294 VanDerWaalsContact C-N 3.35Å; L292-G294 PolarHBondContact O-N 3.47Å; G294-K298 WeakPolarHBondContact O-CD 3.31Å; G294-K298 WeakPolarHBondContact O-CG 3.4Å
295	S	86.2	Confident	86.5	Confident	19 Å²	19	41.3 Å²	41.3	13%	0.133	21%	0.209	C	C	.	.	H	α-helix	trans	-75.6	-38.4	174.1	-57.6	0	0	0	0	112.3	D291 L292 T293 V299	D291-S295 WeakPolarHBondContact O-CB 3.45Å; D291-S295 PolarHBondContact O-N 2.68Å; D291-S295 PolarHBondContact O-OG 2.92Å; L292-S295 WeakPolarHBondContact O-CB 3.08Å; L292-S295 PolarHBondContact O-N 2.83Å; L292-S295 VanDerWaalsContact O-N 3.14Å; T293-S295 VanDerWaalsContact C-N 3.26Å; T293-S295 PolarHBondContact O-N 2.99Å; S295-V299 PolarHBondContact O-N 2.99Å
296	I	88.9	Confident	86.3	Confident	37 Å²	37	40.4 Å²	40.4	19%	0.19	21%	0.205	C	C	.	.	H	α-helix	trans	-64.7	-47.1	174.9	-68.4	164.9	0	0	0	110.9	V157 L198 V249 L292 T293 K298 V299 V300	V157-I296 HydrophobicContact CG2-CG2 4.32Å; L198-I296 HydrophobicContact CD1-CG1 4.19Å; V249-I296 HydrophobicContact CG1-CD1 3.89Å; L292-I296 HydrophobicContact CD1-CD1 4.3Å; L292-I296 HydrophobicContact CG-CD1 4Å; L292-I296 WeakPolarHBondContact O-CG1 3.4Å; L292-I296 PolarHBondContact O-N 3.26Å; T293-I296 PolarHBondContact O-N 2.8Å; I296-K298 PolarHBondContact O-N 3.12Å; I296-V299 WeakPolarHBondContact O-CA 3.35Å; I296-V299 PolarHBondContact O-N 3.15Å; I296-V300 HydrophobicContact CG2-CG2 4.03Å; I296-V300 WeakPolarHBondContact O-CG2 3.48Å; I296-V300 PolarHBondContact O-N 2.77Å
297	N	86.3	Confident	86.1	Confident	2 Å²	2	42.7 Å²	42.7	1%	0.011	21%	0.214	C	C	.	.	H	α-helix	trans	-58.2	-34.1	-177.8	-68	-3.6	0	0	0	112.5	T293 K301 Y399 Q402	T293-N297 WeakPolarHBondContact O-CB 3.28Å; T293-N297 PolarHBondContact O-N 3.22Å; T293-N297 PolarHBondContact O-OD1 3.28Å; N297-K301 WeakPolarHBondContact O-CB 3.36Å; N297-K301 PolarHBondContact O-N 3.46Å; N297-Y399 HydrophobicContact CB-CE1 4.31Å; N297-Q402 PolarHBondContact ND2-OE1 3.29Å; N297-Q402 VanDerWaalsContact ND2-OE1 3.08Å
298	K	86	Confident	85.6	Confident	94 Å²	94	38.9 Å²	38.9	41%	0.409	20%	0.199	S	C	.	.	H	α-helix	trans	-64.2	-47.3	171.8	-71.6	160.7	139.3	-121.2	0	112.4	E202 G294 I296 K301 L302	E202-K298 IonicContact OE1-NZ 2.64Å; E202-K298 PolarHBondContact OE1-NZ 2.93Å; E202-K298 IonicContact OE2-NZ 3.93Å; E202-K298 PolarHBondContact OE2-NZ 3.45Å; G294-K298 WeakPolarHBondContact O-CD 3.31Å; G294-K298 WeakPolarHBondContact O-CG 3.4Å; I296-K298 PolarHBondContact O-N 3.12Å; K298-K301 WeakPolarHBondContact O-CB 3.36Å; K298-K301 PolarHBondContact O-N 3.08Å; K298-L302 PolarHBondContact O-N 3.09Å
299	V	86.4	Confident	85.1	Confident	8 Å²	8	40.4 Å²	40.4	5%	0.048	21%	0.207	C	C	.	.	H	α-helix	trans	-65.4	-41.1	179.3	168	0	0	0	0	111	L198 F201 I205 S295 I296 K301 L302 Q303	L198-V299 HydrophobicContact CD2-CB 4.47Å; L198-V299 HydrophobicContact CD2-CG2 3.89Å; F201-V299 HydrophobicContact CD1-CG1 3.56Å; F201-V299 HydrophobicContact CD1-CG2 4.23Å; F201-V299 HydrophobicContact CE1-CG1 3.48Å; F201-V299 VanDerWaalsContact CE1-CG1 3.48Å; I205-V299 HydrophobicContact CD1-CG1 4.29Å; S295-V299 PolarHBondContact O-N 2.99Å; I296-V299 WeakPolarHBondContact O-CA 3.35Å; I296-V299 PolarHBondContact O-N 3.15Å; V299-K301 VanDerWaalsContact C-N 3.34Å; V299-K301 PolarHBondContact O-N 3.48Å; V299-L302 PolarHBondContact O-N 2.76Å; V299-Q303 WeakPolarHBondContact O-CB 3.34Å; V299-Q303 PolarHBondContact O-N 2.9Å
300	V	85.3	Confident	84.7	Confident	38 Å²	38	40.9 Å²	40.9	23%	0.23	21%	0.208	C	C	.	.	H	α-helix	trans	-60.9	-43	174	176.5	0	0	0	0	110.7	I296 Q303 N304 L395	I296-V300 HydrophobicContact CG2-CG2 4.03Å; I296-V300 WeakPolarHBondContact O-CG2 3.48Å; I296-V300 PolarHBondContact O-N 2.77Å; V300-Q303 PolarHBondContact O-N 3.44Å; V300-N304 WeakPolarHBondContact O-CB 3.32Å; V300-N304 VanDerWaalsContact O-CG 3.27Å; V300-N304 PolarHBondContact O-N 3.13Å; V300-N304 PolarHBondContact O-ND2 3.36Å; V300-L395 HydrophobicContact CB-CD2 4.23Å; V300-L395 HydrophobicContact CG1-CD2 3.87Å
301	K	85.4	Confident	84.1	Confident	107 Å²	107	43.4 Å²	43.4	47%	0.465	22%	0.217	S	C	.	.	H	α-helix	trans	-58.2	-52.3	173.7	-172.4	-160.9	168.5	-163.7	0	111.9	N297 K298 V299 Q303 N304 D305 L395	N297-K301 WeakPolarHBondContact O-CB 3.36Å; N297-K301 PolarHBondContact O-N 3.46Å; K298-K301 WeakPolarHBondContact O-CB 3.36Å; K298-K301 PolarHBondContact O-N 3.08Å; V299-K301 VanDerWaalsContact C-N 3.34Å; V299-K301 PolarHBondContact O-N 3.48Å; K301-Q303 VanDerWaalsContact C-N 3.33Å; K301-Q303 PolarHBondContact O-N 3.12Å; K301-N304 WeakPolarHBondContact O-CA 3.26Å; K301-N304 WeakPolarHBondContact O-CB 3.29Å; K301-N304 PolarHBondContact O-N 3.35Å; K301-N304 VanDerWaalsContact O-N 3.07Å; K301-D305 PolarHBondContact O-N 3.37Å; K301-L395 HydrophobicContact CB-CD1 4.18Å; K301-L395 HydrophobicContact CB-CD2 4.48Å; K301-L395 HydrophobicContact CG-CD1 4.24Å
302	L	85.1	Confident	83.4	Confident	23 Å²	23	46.3 Å²	46.3	12%	0.12	22%	0.224	C	C	.	.	H	α-helix	trans	-64.1	-35.6	-179.8	-69.8	177.7	0	0	0	112.9	E202 I205 E206 L209 K298 V299 N304 D305 V306	E202-L302 HydrophobicContact CB-CD1 4.4Å; E202-L302 HydrophobicContact CG-CD1 3.69Å; I205-L302 HydrophobicContact CB-CB 4.35Å; I205-L302 HydrophobicContact CD1-CB 4.38Å; I205-L302 HydrophobicContact CG2-CB 3.71Å; E206-L302 HydrophobicContact CG-CD1 4.22Å; L209-L302 HydrophobicContact CD1-CD2 4.02Å; K298-L302 PolarHBondContact O-N 3.09Å; V299-L302 PolarHBondContact O-N 2.76Å; L302-N304 VanDerWaalsContact C-N 3.32Å; L302-D305 PolarHBondContact O-N 3.12Å; L302-V306 WeakPolarHBondContact O-CG2 3.3Å; L302-V306 PolarHBondContact O-N 2.94Å
303	Q	85.1	Confident	83	Confident	18 Å²	18	50.4 Å²	50.4	8%	0.084	24%	0.239	C	C	.	.	H	α-helix	trans	-68.5	-32.3	173.7	-165.7	83.4	-45.8	0	0	111.3	L154 K238 E242 V299 V300 K301 V306 N307	L154-Q303 HydrophobicContact CD1-CG 3.99Å; K238-Q303 VanDerWaalsContact CE-OE1 3.26Å; E242-Q303 VanDerWaalsContact CD-NE2 3.33Å; E242-Q303 PolarHBondContact OE1-NE2 3.48Å; E242-Q303 PolarHBondContact OE2-NE2 2.81Å; V299-Q303 WeakPolarHBondContact O-CB 3.34Å; V299-Q303 PolarHBondContact O-N 2.9Å; V300-Q303 PolarHBondContact O-N 3.44Å; K301-Q303 VanDerWaalsContact C-N 3.33Å; K301-Q303 PolarHBondContact O-N 3.12Å; Q303-V306 PolarHBondContact O-N 3.03Å; Q303-N307 WeakPolarHBondContact O-CB 3.32Å; Q303-N307 PolarHBondContact O-N 2.98Å; Q303-N307 PolarHBondContact O-ND2 3.49Å
304	N	81.8	Confident	82.5	Confident	40 Å²	40	51.6 Å²	51.6	21%	0.214	24%	0.244	C	C	.	.	H	α-helix	trans	-66.7	-43.2	170.7	-73.6	-22.3	0	0	0	111.7	V300 K301 L302 V306 N307 M308	V300-N304 WeakPolarHBondContact O-CB 3.32Å; V300-N304 VanDerWaalsContact O-CG 3.27Å; V300-N304 PolarHBondContact O-N 3.13Å; V300-N304 PolarHBondContact O-ND2 3.36Å; K301-N304 WeakPolarHBondContact O-CA 3.26Å; K301-N304 WeakPolarHBondContact O-CB 3.29Å; K301-N304 PolarHBondContact O-N 3.35Å; K301-N304 VanDerWaalsContact O-N 3.07Å; L302-N304 VanDerWaalsContact C-N 3.32Å; N304-V306 VanDerWaalsContact C-N 3.34Å; N304-V306 PolarHBondContact O-N 3.26Å; N304-N307 PolarHBondContact O-N 3.24Å; N304-N307 VanDerWaalsContact O-N 3.16Å; N304-M308 WeakPolarHBondContact O-CG 3.3Å; N304-M308 PolarHBondContact O-N 3.23Å
305	D	81.1	Confident	81.9	Confident	67 Å²	67	53.5 Å²	53.5	36%	0.358	25%	0.249	S	C	.	.	H	α-helix	trans	-59.5	-43.1	173.8	-66.1	-37.3	0	0	0	111.1	L209 K301 L302 M308 L309	L209-D305 HydrophobicContact CD1-CB 4.38Å; L209-D305 HydrophobicContact CD2-CB 4.29Å; K301-D305 PolarHBondContact O-N 3.37Å; L302-D305 PolarHBondContact O-N 3.12Å; D305-M308 PolarHBondContact O-N 2.6Å; D305-L309 PolarHBondContact O-N 2.88Å
306	V	83.2	Confident	81.4	Confident	1 Å²	1	54.5 Å²	54.5	1%	0.006	26%	0.259	C	S	.	.	H	α-helix	trans	-59	-48.2	171.6	163.7	0	0	0	0	111.7	I205 Y208 L209 L302 Q303 N304 M308 L309 K310	I205-V306 HydrophobicContact CG2-CG2 3.53Å; Y208-V306 HydrophobicContact CD1-CG1 4.29Å; Y208-V306 HydrophobicContact CD1-CG2 3.93Å; Y208-V306 HydrophobicContact CE1-CG1 3.8Å; Y208-V306 HydrophobicContact CE1-CG2 4.28Å; L209-V306 HydrophobicContact CD2-CB 4.26Å; L209-V306 HydrophobicContact CD2-CG2 3.49Å; L209-V306 VanDerWaalsContact CD2-CG2 3.49Å; L209-V306 HydrophobicContact CG-CG2 3.84Å; L302-V306 WeakPolarHBondContact O-CG2 3.3Å; L302-V306 PolarHBondContact O-N 2.94Å; Q303-V306 PolarHBondContact O-N 3.03Å; N304-V306 VanDerWaalsContact C-N 3.34Å; N304-V306 PolarHBondContact O-N 3.26Å; V306-M308 VanDerWaalsContact C-N 3.27Å; V306-M308 PolarHBondContact O-N 2.77Å; V306-L309 PolarHBondContact O-N 2.65Å; V306-K310 HydrophobicContact CG1-CD 4.22Å; V306-K310 HydrophobicContact CG1-CG 4.38Å; V306-K310 WeakPolarHBondContact O-CG 3.31Å; V306-K310 PolarHBondContact O-N 2.72Å
307	N	82.8	Confident	80.6	Confident	60 Å²	60	55.1 Å²	55.1	32%	0.321	27%	0.266	S	S	.	.	H	α-helix	trans	-64	-33.4	-178.6	-76.8	-35	0	0	0	111.9	Q303 N304 R311	Q303-N307 WeakPolarHBondContact O-CB 3.32Å; Q303-N307 PolarHBondContact O-N 2.98Å; Q303-N307 PolarHBondContact O-ND2 3.49Å; N304-N307 PolarHBondContact O-N 3.24Å; N304-N307 VanDerWaalsContact O-N 3.16Å; N307-R311 VanDerWaalsContact O-CG 3.26Å; N307-R311 WeakPolarHBondContact O-CG 3.43Å; N307-R311 PolarHBondContact O-N 2.87Å; N307-R311 VanDerWaalsContact O-N 3.14Å
308	M	77.6	Confident	80.2	Confident	28 Å²	28	59.6 Å²	59.6	14%	0.138	29%	0.29	C	S	.	.	H	α-helix	trans	-67.8	-48.8	172.2	-70.6	-62.3	-72.2	0	0	111.4	N304 D305 V306 K310 R311 Y312 Q388	N304-M308 WeakPolarHBondContact O-CG 3.3Å; N304-M308 PolarHBondContact O-N 3.23Å; D305-M308 PolarHBondContact O-N 2.6Å; V306-M308 VanDerWaalsContact C-N 3.27Å; V306-M308 PolarHBondContact O-N 2.77Å; M308-K310 VanDerWaalsContact C-N 3.32Å; M308-K310 PolarHBondContact O-N 3.47Å; M308-R311 PolarHBondContact O-N 3.16Å; M308-R311 VanDerWaalsContact O-N 3.15Å; M308-Y312 HydrophobicContact CB-CE2 4.39Å; M308-Y312 HydrophobicContact CE-CE2 4.04Å; M308-Y312 WeakPolarHBondContact O-CD2 3.45Å; M308-Y312 PolarHBondContact O-N 2.63Å; M308-Q388 HydrophobicContact CE-CB 3.93Å; M308-Q388 HydrophobicContact CE-CG 4.25Å; M308-Q388 HydrophobicContact SD-CB 4.34Å
309	L	78.9	Confident	79.2	Confident	49 Å²	49	57.5 Å²	57.5	26%	0.257	29%	0.287	S	S	.	.	H	α-helix	trans	-60.5	-39.1	176.4	-70.1	-171.1	0	0	0	112.7	L209 L213 D305 V306 Y312 R313	L209-L309 HydrophobicContact CD2-CD1 3.66Å; L209-L309 HydrophobicContact CD2-CG 4.4Å; L213-L309 HydrophobicContact CD2-CD1 3.88Å; L213-L309 HydrophobicContact CD2-CD2 4.02Å; L213-L309 HydrophobicContact CG-CD1 3.91Å; D305-L309 PolarHBondContact O-N 2.88Å; V306-L309 PolarHBondContact O-N 2.65Å; L309-Y312 PolarHBondContact O-N 2.89Å; L309-R313 VanDerWaalsContact O-CB 3.29Å; L309-R313 WeakPolarHBondContact O-CB 3.34Å; L309-R313 PolarHBondContact O-N 3.17Å
310	K	79.3	Confident	78.7	Confident	55 Å²	55	63.5 Å²	63.5	24%	0.239	31%	0.314	C	S	.	.	H	α-helix	trans	-60.2	-44.9	173.5	-74.7	-170.7	174.7	-162.7	0	111.9	Y208 E235 V306 M308 R313 D314	Y208-K310 WeakPolarHBondContact OH-CE 3.48Å; Y208-K310 PolarHBondContact OH-NZ 3.47Å; E235-K310 IonicContact OE1-NZ 2.74Å; E235-K310 PolarHBondContact OE1-NZ 3.24Å; V306-K310 HydrophobicContact CG1-CD 4.22Å; V306-K310 HydrophobicContact CG1-CG 4.38Å; V306-K310 WeakPolarHBondContact O-CG 3.31Å; V306-K310 PolarHBondContact O-N 2.72Å; M308-K310 VanDerWaalsContact C-N 3.32Å; M308-K310 PolarHBondContact O-N 3.47Å; K310-R313 WeakPolarHBondContact O-CB 3.21Å; K310-R313 PolarHBondContact O-N 3.13Å; K310-D314 WeakPolarHBondContact O-CB 3.33Å; K310-D314 PolarHBondContact O-N 3.27Å
311	R	74.9	Confident	78.4	Confident	135 Å²	135	65 Å²	65	51%	0.509	32%	0.324	S	S	.	.	H	α-helix	trans	-61.6	-43.8	175.7	-70.6	170.1	-168.6	-169.2	7.3	112.4	N307 M308 D314 L315	N307-R311 VanDerWaalsContact O-CG 3.26Å; N307-R311 WeakPolarHBondContact O-CG 3.43Å; N307-R311 PolarHBondContact O-N 2.87Å; N307-R311 VanDerWaalsContact O-N 3.14Å; M308-R311 PolarHBondContact O-N 3.16Å; M308-R311 VanDerWaalsContact O-N 3.15Å; R311-D314 PolarHBondContact O-N 2.99Å; R311-L315 VanDerWaalsContact O-CB 3.31Å; R311-L315 WeakPolarHBondContact O-CB 3.5Å; R311-L315 PolarHBondContact O-N 2.92Å
312	Y	73.8	Confident	77.9	Confident	121 Å²	121	64.4 Å²	64.4	48%	0.475	33%	0.325	S	S	.	.	H	α-helix	trans	-64.1	-42.5	176.2	-73.2	-61.2	0	0	0	112.3	M308 L309 L315 A316	M308-Y312 HydrophobicContact CB-CE2 4.39Å; M308-Y312 HydrophobicContact CE-CE2 4.04Å; M308-Y312 WeakPolarHBondContact O-CD2 3.45Å; M308-Y312 PolarHBondContact O-N 2.63Å; L309-Y312 PolarHBondContact O-N 2.89Å; Y312-L315 PolarHBondContact O-N 3.39Å; Y312-A316 WeakPolarHBondContact O-CB 3.48Å; Y312-A316 PolarHBondContact O-N 3.5Å
313	R	80.1	Confident	77.4	Confident	95 Å²	95	68.1 Å²	68.1	36%	0.358	35%	0.345	S	S	.	.	H	α-helix	trans	-60.1	-45.7	175.7	-172.2	-147	85.9	107.2	3.5	111.7	V216 W228 L309 K310 A316 S317	V216-R313 HydrophobicContact CG2-CG 4.22Å; W228-R313 HydrophobicContact CH2-CG 4.17Å; L309-R313 VanDerWaalsContact O-CB 3.29Å; L309-R313 WeakPolarHBondContact O-CB 3.34Å; L309-R313 PolarHBondContact O-N 3.17Å; K310-R313 WeakPolarHBondContact O-CB 3.21Å; K310-R313 PolarHBondContact O-N 3.13Å; R313-A316 PolarHBondContact O-N 3.35Å; R313-S317 PolarHBondContact O-N 3.49Å
314	D	77.6	Confident	77.1	Confident	68 Å²	68	72.8 Å²	72.8	36%	0.364	37%	0.367	S	S	.	.	H	α-helix	trans	-69.3	-42.3	-179	-67.3	-10.3	0	0	0	110.9	K310 R311 A316 S317 L318	K310-D314 WeakPolarHBondContact O-CB 3.33Å; K310-D314 PolarHBondContact O-N 3.27Å; R311-D314 PolarHBondContact O-N 2.99Å; D314-A316 PolarHBondContact O-N 2.96Å; D314-S317 PolarHBondContact O-N 3.31Å; D314-S317 PolarHBondContact O-OG 3.23Å; D314-L318 WeakPolarHBondContact O-CG 3.41Å; D314-L318 PolarHBondContact O-N 3.03Å
315	L	74.7	Confident	77	Confident	59 Å²	59	75.6 Å²	75.6	31%	0.309	38%	0.382	S	S	.	.	H	α-helix	trans	-58	-46.4	172.4	179	63.6	0	0	0	112.3	R311 Y312 S317 L318 S319	R311-L315 VanDerWaalsContact O-CB 3.31Å; R311-L315 WeakPolarHBondContact O-CB 3.5Å; R311-L315 PolarHBondContact O-N 2.92Å; Y312-L315 PolarHBondContact O-N 3.39Å; L315-S317 VanDerWaalsContact C-N 3.33Å; L315-S317 PolarHBondContact O-N 2.94Å; L315-L318 PolarHBondContact O-N 3.28Å; L315-S319 PolarHBondContact O-N 2.87Å
316	A	75	Confident	76.4	Confident	40 Å²	40	74.7 Å²	74.7	33%	0.331	38%	0.377	S	S	.	.	H	α-helix	trans	-63.7	-37.7	175.6	0	0	0	0	0	112.1	Y312 R313 D314 S319 H320	Y312-A316 WeakPolarHBondContact O-CB 3.48Å; Y312-A316 PolarHBondContact O-N 3.5Å; R313-A316 PolarHBondContact O-N 3.35Å; D314-A316 PolarHBondContact O-N 2.96Å; A316-S319 PolarHBondContact O-N 3.36Å; A316-S319 PolarHBondContact O-OG 2.99Å; A316-H320 PolarHBondContact O-CD2 3.48Å; A316-H320 PolarHBondContact O-N 2.88Å
317	S	72.6	Confident	76	Confident	50 Å²	50	80 Å²	80	35%	0.35	41%	0.405	S	S	.	.	H	α-helix	trans	-64.8	-39.9	175.3	76.2	0	0	0	0	112.3	R313 D314 L315 H320 T321	R313-S317 PolarHBondContact O-N 3.49Å; D314-S317 PolarHBondContact O-N 3.31Å; D314-S317 PolarHBondContact O-OG 3.23Å; L315-S317 VanDerWaalsContact C-N 3.33Å; L315-S317 PolarHBondContact O-N 2.94Å; S317-H320 PolarHBondContact O-N 2.91Å; S317-T321 PolarHBondContact O-N 2.85Å; S317-T321 PolarHBondContact O-OG1 3.46Å
318	L	77.2	Confident	75.7	Confident	95 Å²	95	80.7 Å²	80.7	50%	0.497	41%	0.406	S	S	.	.	H	α-helix	trans	-68.4	-37.6	177	-71.1	167.7	0	0	0	112.5	D314 L315 T321 N322	D314-L318 WeakPolarHBondContact O-CG 3.41Å; D314-L318 PolarHBondContact O-N 3.03Å; L315-L318 PolarHBondContact O-N 3.28Å; L318-T321 PolarHBondContact O-OG1 3.38Å; L318-T321 VanDerWaalsContact O-OG1 3.1Å; L318-N322 VanDerWaalsContact O-CB 3.31Å; L318-N322 WeakPolarHBondContact O-CB 3.35Å; L318-N322 PolarHBondContact O-N 3.49Å; L318-N322 PolarHBondContact O-ND2 3.11Å; L318-N322 VanDerWaalsContact O-ND2 3.13Å; L318-N322 PolarHBondContact O-OD1 2.9Å
319	S	65.9	Low	75.7	Confident	51 Å²	51	82.1 Å²	82.1	36%	0.357	42%	0.422	S	S	.	.	H	α-helix	trans	-67	-39.3	174.5	70.8	0	0	0	0	111.3	L315 A316 L323	L315-S319 PolarHBondContact O-N 2.87Å; A316-S319 PolarHBondContact O-N 3.36Å; A316-S319 PolarHBondContact O-OG 2.99Å; S319-L323 WeakPolarHBondContact O-CB 3.37Å; S319-L323 WeakPolarHBondContact O-CD1 3.26Å; S319-L323 VanDerWaalsContact O-CG 3.23Å; S319-L323 WeakPolarHBondContact O-CG 3.47Å; S319-L323 PolarHBondContact O-N 2.93Å
320	H	74.8	Confident	74.8	Confident	133 Å²	133	82.2 Å²	82.2	62%	0.616	42%	0.423	S	S	*	.	H	α-helix	trans	-64.7	-43.4	173.9	-76.1	-56.8	0	0	0	113.5	A316 S317 L323 Q324	A316-H320 PolarHBondContact O-CD2 3.48Å; A316-H320 PolarHBondContact O-N 2.88Å; S317-H320 PolarHBondContact O-N 2.91Å; H320-L323 PolarHBondContact O-N 3.08Å; H320-Q324 PolarHBondContact O-N 3.47Å
321	T	78.8	Confident	74.3	Confident	71 Å²	71	81.6 Å²	81.6	44%	0.436	43%	0.426	S	S	.	.	H	α-helix	trans	-65.2	-46.1	176.4	54.2	0	0	0	0	111.4	S317 L318 L323 Q324 D325	S317-T321 PolarHBondContact O-N 2.85Å; S317-T321 PolarHBondContact O-OG1 3.46Å; L318-T321 PolarHBondContact O-OG1 3.38Å; L318-T321 VanDerWaalsContact O-OG1 3.1Å; T321-L323 VanDerWaalsContact C-N 3.27Å; T321-L323 PolarHBondContact O-N 3.4Å; T321-Q324 PolarHBondContact O-N 2.94Å; T321-D325 PolarHBondContact O-N 3.03Å
322	N	76.5	Confident	74.2	Confident	93 Å²	93	81 Å²	81	50%	0.497	43%	0.427	S	S	.	.	H	α-helix	trans	-60.1	-37.6	178.5	-67.6	-17.1	0	0	0	112.1	L318 D326	L318-N322 VanDerWaalsContact O-CB 3.31Å; L318-N322 WeakPolarHBondContact O-CB 3.35Å; L318-N322 PolarHBondContact O-N 3.49Å; L318-N322 PolarHBondContact O-ND2 3.11Å; L318-N322 VanDerWaalsContact O-ND2 3.13Å; L318-N322 PolarHBondContact O-OD1 2.9Å; N322-D326 PolarHBondContact O-N 2.68Å; N322-D326 VanDerWaalsContact O-N 3.13Å
323	L	74.1	Confident	73.6	Confident	101 Å²	101	80.4 Å²	80.4	53%	0.529	43%	0.428	S	S	.	.	H	α-helix	trans	-70	-38.4	174.4	-74.8	169.2	0	0	0	112.4	S319 H320 T321 L327	S319-L323 WeakPolarHBondContact O-CB 3.37Å; S319-L323 WeakPolarHBondContact O-CD1 3.26Å; S319-L323 VanDerWaalsContact O-CG 3.23Å; S319-L323 WeakPolarHBondContact O-CG 3.47Å; S319-L323 PolarHBondContact O-N 2.93Å; H320-L323 PolarHBondContact O-N 3.08Å; T321-L323 VanDerWaalsContact C-N 3.27Å; T321-L323 PolarHBondContact O-N 3.4Å; L323-L327 WeakPolarHBondContact O-CB 3.23Å; L323-L327 VanDerWaalsContact O-CG 3.24Å; L323-L327 WeakPolarHBondContact O-CG 3.37Å; L323-L327 PolarHBondContact O-N 3.3Å
324	Q	79.4	Confident	72.8	Confident	116 Å²	116	79.9 Å²	79.9	54%	0.542	43%	0.432	S	S	.	.	H	α-helix	trans	-66	-43.9	175.4	-177.8	172.3	-28.3	0	0	111.4	H320 T321 D326 L327 E328	H320-Q324 PolarHBondContact O-N 3.47Å; T321-Q324 PolarHBondContact O-N 2.94Å; Q324-D326 VanDerWaalsContact C-N 3.35Å; Q324-D326 PolarHBondContact O-N 2.96Å; Q324-L327 PolarHBondContact O-N 3.04Å; Q324-E328 HydrophobicContact CG-CG 4.49Å; Q324-E328 PolarHBondContact NE2-OE1 3.39Å; Q324-E328 WeakPolarHBondContact O-CB 3.49Å; Q324-E328 PolarHBondContact O-N 2.95Å
325	D	77.8	Confident	71.9	Confident	99 Å²	99	82 Å²	82	53%	0.529	44%	0.439	S	S	.	.	H	α-helix	trans	-60.9	-42.4	176.8	-68.8	-28.6	0	0	0	111.5	T321 L327 E328 A329	T321-D325 PolarHBondContact O-N 3.03Å; D325-L327 VanDerWaalsContact C-N 3.34Å; D325-L327 PolarHBondContact O-N 3.1Å; D325-E328 PolarHBondContact O-N 3.24Å; D325-A329 WeakPolarHBondContact O-CB 3.33Å; D325-A329 PolarHBondContact O-N 3.41Å
326	D	70.4	Confident	71.2	Confident	48 Å²	48	82.1 Å²	82.1	26%	0.257	46%	0.455	S	S	.	.	H	α-helix	trans	-70.5	-28.5	177.2	-137.2	65.7	0	0	0	112.7	N322 Q324 L330 R362 K369	N322-D326 PolarHBondContact O-N 2.68Å; N322-D326 VanDerWaalsContact O-N 3.13Å; Q324-D326 VanDerWaalsContact C-N 3.35Å; Q324-D326 PolarHBondContact O-N 2.96Å; D326-L330 WeakPolarHBondContact O-CB 3.41Å; D326-L330 PolarHBondContact O-N 3.17Å; D326-L330 VanDerWaalsContact O-N 3.1Å; D326-R362 IonicContact OD2-CZ 3.76Å; D326-R362 IonicContact OD2-NH1 3.71Å; D326-R362 IonicContact OD2-NH2 2.86Å; D326-R362 PolarHBondContact OD2-NH2 3.39Å; D326-K369 IonicContact OD1-NZ 2.83Å; D326-K369 PolarHBondContact OD1-NZ 3.05Å; D326-K369 IonicContact OD2-NZ 2.8Å; D326-K369 PolarHBondContact OD2-NZ 3.11Å
327	L	72.8	Confident	70.2	Confident	112 Å²	112	86.7 Å²	86.7	59%	0.586	47%	0.467	S	S	*	.	H	α-helix	trans	-73.9	-39.2	172.2	-78.1	170.8	0	0	0	112.4	L323 Q324 D325 L330 S331	L323-L327 WeakPolarHBondContact O-CB 3.23Å; L323-L327 VanDerWaalsContact O-CG 3.24Å; L323-L327 WeakPolarHBondContact O-CG 3.37Å; L323-L327 PolarHBondContact O-N 3.3Å; Q324-L327 PolarHBondContact O-N 3.04Å; D325-L327 VanDerWaalsContact C-N 3.34Å; D325-L327 PolarHBondContact O-N 3.1Å; L327-L330 HydrophobicContact CD2-CD1 4.38Å; L327-L330 VanDerWaalsContact O-CB 3.25Å; L327-L330 WeakPolarHBondContact O-CB 3.37Å; L327-L330 PolarHBondContact O-N 2.89Å; L327-S331 PolarHBondContact O-N 3.06Å
328	E	78.4	Confident	69.2	Low	75 Å²	75	94.2 Å²	94.2	35%	0.35	49%	0.488	S	S	.	.	H	α-helix	trans	-70	-35.3	174.5	-80.9	-163.9	-143.7	0	0	112.3	Q324 D325 L330 S331 K332	Q324-E328 HydrophobicContact CG-CG 4.49Å; Q324-E328 PolarHBondContact NE2-OE1 3.39Å; Q324-E328 WeakPolarHBondContact O-CB 3.49Å; Q324-E328 PolarHBondContact O-N 2.95Å; D325-E328 PolarHBondContact O-N 3.24Å; E328-L330 VanDerWaalsContact C-N 3.29Å; E328-S331 PolarHBondContact O-OG 3.06Å; E328-S331 VanDerWaalsContact O-OG 3.07Å; E328-K332 WeakPolarHBondContact O-CB 3.29Å; E328-K332 WeakPolarHBondContact O-CD 3.15Å; E328-K332 WeakPolarHBondContact O-CG 3.38Å; E328-K332 PolarHBondContact O-N 3.08Å; E328-K332 VanDerWaalsContact O-N 3.14Å; E328-K332 IonicContact OE2-NZ 2.63Å; E328-K332 PolarHBondContact OE2-NZ 3.38Å
329	A	76	Confident	67.9	Low	58 Å²	58	97.8 Å²	97.8	48%	0.479	50%	0.502	S	S	.	.	H	α-helix	trans	-63.9	-37.1	169.1	0	0	0	0	0	111.4	D325 H333	D325-A329 WeakPolarHBondContact O-CB 3.33Å; D325-A329 PolarHBondContact O-N 3.41Å; A329-H333 PolarHBondContact O-N 3.05Å; A329-H333 VanDerWaalsContact O-N 3.09Å
330	L	60.9	Low	66.9	Low	51 Å²	51	98.6 Å²	98.6	27%	0.267	52%	0.518	S	S	.	.	H	α-helix	trans	-64	-50.1	174.3	-107.2	168.1	0	0	0	112.5	D326 L327 E328 K332 H333 I334 R362	D326-L330 WeakPolarHBondContact O-CB 3.41Å; D326-L330 PolarHBondContact O-N 3.17Å; D326-L330 VanDerWaalsContact O-N 3.1Å; L327-L330 HydrophobicContact CD2-CD1 4.38Å; L327-L330 VanDerWaalsContact O-CB 3.25Å; L327-L330 WeakPolarHBondContact O-CB 3.37Å; L327-L330 PolarHBondContact O-N 2.89Å; E328-L330 VanDerWaalsContact C-N 3.29Å; L330-K332 PolarHBondContact O-N 3.23Å; L330-H333 PolarHBondContact O-N 2.63Å; L330-I334 HydrophobicContact CD2-CD1 4.01Å; L330-I334 VanDerWaalsContact O-CG1 3.31Å; L330-I334 WeakPolarHBondContact O-CG1 3.34Å; L330-I334 PolarHBondContact O-N 3.26Å; L330-R362 VanDerWaalsContact CD1-NH2 3.31Å
331	S	69.3	Low	65.2	Low	43 Å²	43	102.2 Å²	102.2	30%	0.301	53%	0.533	S	S	.	.	H	α-helix	trans	-61.2	-46.3	179.9	62.3	0	0	0	0	111	L327 E328 H333 I334 E335	L327-S331 PolarHBondContact O-N 3.06Å; E328-S331 PolarHBondContact O-OG 3.06Å; E328-S331 VanDerWaalsContact O-OG 3.07Å; S331-H333 VanDerWaalsContact C-N 3.28Å; S331-H333 PolarHBondContact O-N 3.2Å; S331-I334 PolarHBondContact O-N 3.35Å; S331-I334 VanDerWaalsContact O-N 3.1Å; S331-E335 WeakPolarHBondContact O-CB 3.49Å; S331-E335 WeakPolarHBondContact O-CG 3.47Å; S331-E335 PolarHBondContact O-N 2.9Å
332	K	71.6	Confident	63.4	Low	123 Å²	123	101.9 Å²	101.9	54%	0.535	54%	0.543	S	S	.	.	H	α-helix	trans	-58.5	-36.7	176.2	-67.5	161.2	-161.5	162.8	0	112.1	E328 L330 G336	E328-K332 WeakPolarHBondContact O-CB 3.29Å; E328-K332 WeakPolarHBondContact O-CD 3.15Å; E328-K332 WeakPolarHBondContact O-CG 3.38Å; E328-K332 PolarHBondContact O-N 3.08Å; E328-K332 VanDerWaalsContact O-N 3.14Å; E328-K332 IonicContact OE2-NZ 2.63Å; E328-K332 PolarHBondContact OE2-NZ 3.38Å; L330-K332 PolarHBondContact O-N 3.23Å; K332-G336 PolarHBondContact O-N 3.05Å
333	H	62.6	Low	61.3	Low	107 Å²	107	104.5 Å²	104.5	50%	0.495	56%	0.563	S	S	.	*	H	α-helix	trans	-72.1	-38.5	174.4	-168.8	89.2	0	0	0	113.5	A329 L330 S331 K337	A329-H333 PolarHBondContact O-N 3.05Å; A329-H333 VanDerWaalsContact O-N 3.09Å; L330-H333 PolarHBondContact O-N 2.63Å; S331-H333 VanDerWaalsContact C-N 3.28Å; S331-H333 PolarHBondContact O-N 3.2Å; H333-K337 WeakPolarHBondContact NE2-CE 3.41Å; H333-K337 PolarHBondContact NE2-NZ 3.15Å; H333-K337 PolarHBondContact O-N 2.97Å
334	I	61.8	Low	59.5	Low	85 Å²	85	104.8 Å²	104.8	44%	0.436	57%	0.573	S	S	.	*	H	α-helix	trans	-70.7	-41.8	179.5	-69	164.6	0	0	0	110.9	L330 S331	L330-I334 HydrophobicContact CD2-CD1 4.01Å; L330-I334 VanDerWaalsContact O-CG1 3.31Å; L330-I334 WeakPolarHBondContact O-CG1 3.34Å; L330-I334 PolarHBondContact O-N 3.26Å; S331-I334 PolarHBondContact O-N 3.35Å; S331-I334 VanDerWaalsContact O-N 3.1Å
335	E	59.9	Low	57.9	Low	112 Å²	112	106.2 Å²	106.2	52%	0.523	59%	0.59	S	S	.	*	H	α-helix	trans	-69.8	-41.7	177.5	-71.1	173	-172.3	0	0	111.7	S331 K337 R338	S331-E335 WeakPolarHBondContact O-CB 3.49Å; S331-E335 WeakPolarHBondContact O-CG 3.47Å; S331-E335 PolarHBondContact O-N 2.9Å; E335-K337 PolarHBondContact O-N 3.46Å; E335-R338 PolarHBondContact O-N 3.35Å
336	G	60.5	Low	56	Low	62 Å²	62	107.2 Å²	107.2	64%	0.639	60%	0.6	S	S	*	*	H	α-helix	trans	-58.7	-28.3	177.1	0	0	0	0	0	114.1	K332	K332-G336 PolarHBondContact O-N 3.05Å
337	K	52.5	Low	54.9	Low	135 Å²	135	110.7 Å²	110.7	59%	0.587	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.1	-12.5	172.8	-75.3	-174.5	173.5	178.8	0	114.6	H333 E335	H333-K337 WeakPolarHBondContact NE2-CE 3.41Å; H333-K337 PolarHBondContact NE2-NZ 3.15Å; H333-K337 PolarHBondContact O-N 2.97Å; E335-K337 PolarHBondContact O-N 3.46Å
338	R	52.5	Low	53.9	Low	208 Å²	208	109.4 Å²	109.4	79%	0.785	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.5	-11	-174.4	-87.1	-178.8	161.7	179.6	-4.5	115.5	E335 G340	E335-R338 PolarHBondContact O-N 3.35Å; R338-G340 VanDerWaalsContact C-N 3.33Å; R338-G340 PolarHBondContact O-N 3.28Å
339	Q	49.4	Very low	53.2	Low	170 Å²	170	111.1 Å²	111.1	79%	0.794	63%	0.625	S	S	*	*			trans	-88.4	10.9	-176.5	-62.6	-166.1	0.3	0	0	114.9	K341	Q339-K341 PolarHBondContact O-N 2.92Å
340	G	45.1	Very low	52.8	Low	68 Å²	68	113.3 Å²	113.3	70%	0.701	63%	0.629	S	S	*	*	S	Bend	trans	-93.7	81.2	-176.3	0	0	0	0	0	115.4	R338	R338-G340 VanDerWaalsContact C-N 3.33Å; R338-G340 PolarHBondContact O-N 3.28Å
341	K	39.7	Very low	52.9	Low	210 Å²	210	116.2 Å²	116.2	91%	0.913	64%	0.641	S	S	*	*			trans	64	152.6	-179.3	-75.3	-179.6	174.3	176.7	0	115.4	Q339	Q339-K341 PolarHBondContact O-N 2.92Å
342	G	39.8	Very low	52.9	Low	64 Å²	64	117.9 Å²	117.9	66%	0.66	65%	0.646	S	S	*	*			trans	-103.1	161.7	-172.7	0	0	0	0	0	115.1
343	T	33.7	Very low	53	Low	148 Å²	148	116.9 Å²	116.9	91%	0.908	65%	0.647	S	S	*	*			trans	55.6	84.6	154.6	60.5	0	0	0	0	118.3
344	S	35.8	Very low	53.6	Low	106 Å²	106	117.1 Å²	117.1	74%	0.741	65%	0.651	S	S	*	*			trans	-141.5	131.8	137.5	63	0	0	0	0	110.5	T346	S344-T346 PolarHBondContact O-N 3.41Å
345	T	44.9	Very low	54.3	Low	147 Å²	147	117.7 Å²	117.7	90%	0.902	66%	0.655	S	S	*	*	S	Bend	trans	-92.1	64.7	-171.1	-49.4	0	0	0	0	111.9
346	T	38.6	Very low	55.1	Low	119 Å²	119	115.8 Å²	115.8	73%	0.73	65%	0.648	S	S	*	*			trans	-164	114.6	162.9	36.2	0	0	0	0	108.3	S344	S344-T346 PolarHBondContact O-N 3.41Å
347	M	47.6	Very low	55.8	Low	121 Å²	121	115.7 Å²	115.7	60%	0.596	64%	0.637	S	S	*	*			trans	-76.7	127	173.8	-166.6	163.4	71.5	0	0	108.9	E351 L352	M347-E351 HydrophobicContact CG-CB 4.07Å; M347-L352 HydrophobicContact CE-CB 4.12Å; M347-L352 HydrophobicContact CE-CD1 3.85Å; M347-L352 HydrophobicContact CE-CG 4.48Å
348	N	52.2	Low	57	Low	85 Å²	85	112.2 Å²	112.2	46%	0.455	63%	0.627	S	S	.	*			trans	-73.6	154.4	-177.1	-174.1	28.7	0	0	0	111	D350 E351 L352	N348-D350 PolarHBondContact ND2-OD2 3.5Å; N348-D350 PolarHBondContact O-N 3.41Å; N348-E351 HydrophobicContact CB-CG 4.2Å; N348-E351 PolarHBondContact N-OE2 2.84Å; N348-E351 PolarHBondContact O-N 3.26Å; N348-E351 VanDerWaalsContact O-N 3.11Å; N348-L352 PolarHBondContact O-N 2.87Å
349	V	63.8	Low	58.1	Low	111 Å²	111	104.5 Å²	104.5	67%	0.673	61%	0.607	S	S	*	*	H	α-helix	trans	-58.7	-37	-179.2	179	0	0	0	0	111	L352 N353	V349-L352 PolarHBondContact O-N 2.96Å; V349-N353 WeakPolarHBondContact O-CB 3.44Å; V349-N353 PolarHBondContact O-N 2.82Å
350	D	67.6	Low	59.5	Low	105 Å²	105	102 Å²	102	56%	0.561	60%	0.596	S	S	*	*	H	α-helix	trans	-66.7	-40.3	177.6	-51.4	-59.3	0	0	0	112.1	N348 N353 D354	N348-D350 PolarHBondContact ND2-OD2 3.5Å; N348-D350 PolarHBondContact O-N 3.41Å; D350-N353 PolarHBondContact O-N 2.68Å; D350-D354 WeakPolarHBondContact O-CB 3.42Å; D350-D354 PolarHBondContact O-N 2.88Å
351	E	62.6	Low	61.1	Low	112 Å²	112	108.4 Å²	108.4	52%	0.523	60%	0.599	S	S	.	*	H	α-helix	trans	-67.4	-36.3	176.5	-62	176.6	135.2	0	0	111.8	M347 N348 L355	M347-E351 HydrophobicContact CG-CB 4.07Å; N348-E351 HydrophobicContact CB-CG 4.2Å; N348-E351 PolarHBondContact N-OE2 2.84Å; N348-E351 PolarHBondContact O-N 3.26Å; N348-E351 VanDerWaalsContact O-N 3.11Å; E351-L355 VanDerWaalsContact O-CB 3.29Å; E351-L355 WeakPolarHBondContact O-CB 3.48Å; E351-L355 PolarHBondContact O-N 2.93Å
352	L	68.9	Low	62.5	Low	77 Å²	77	101.6 Å²	101.6	40%	0.403	57%	0.567	S	S	.	*	H	α-helix	trans	-66.7	-40.4	172	177	59.4	0	0	0	111.2	M347 N348 V349 L355 I356	M347-L352 HydrophobicContact CE-CB 4.12Å; M347-L352 HydrophobicContact CE-CD1 3.85Å; M347-L352 HydrophobicContact CE-CG 4.48Å; N348-L352 PolarHBondContact O-N 2.87Å; V349-L352 PolarHBondContact O-N 2.96Å; L352-L355 PolarHBondContact O-N 3.23Å; L352-I356 HydrophobicContact CD1-CD1 4Å; L352-I356 HydrophobicContact CD1-CG1 4.26Å; L352-I356 HydrophobicContact CG-CD1 3.9Å; L352-I356 WeakPolarHBondContact O-CB 3.14Å; L352-I356 VanDerWaalsContact O-CG1 3.23Å; L352-I356 WeakPolarHBondContact O-CG1 3.39Å; L352-I356 PolarHBondContact O-N 3Å
353	N	73	Confident	64.6	Low	103 Å²	103	102.5 Å²	102.5	55%	0.551	56%	0.556	S	S	*	*	H	α-helix	trans	-69.4	-39.3	178.8	-161.4	28.9	0	0	0	111.6	V349 D350 I356 S357	V349-N353 WeakPolarHBondContact O-CB 3.44Å; V349-N353 PolarHBondContact O-N 2.82Å; D350-N353 PolarHBondContact O-N 2.68Å; N353-I356 PolarHBondContact O-N 2.88Å; N353-S357 WeakPolarHBondContact O-CB 3.31Å; N353-S357 PolarHBondContact O-N 3.05Å
354	D	75.2	Confident	66.8	Low	111 Å²	111	98 Å²	98	59%	0.594	53%	0.531	S	S	*	.	H	α-helix	trans	-60	-45.7	169.5	-90	-6.8	0	0	0	111.2	D350 I356 S357 V358	D350-D354 WeakPolarHBondContact O-CB 3.42Å; D350-D354 PolarHBondContact O-N 2.88Å; D354-I356 VanDerWaalsContact C-N 3.35Å; D354-I356 PolarHBondContact O-N 2.87Å; D354-S357 PolarHBondContact O-N 2.92Å; D354-S357 PolarHBondContact O-OG 3.2Å; D354-V358 WeakPolarHBondContact O-CG2 3.14Å; D354-V358 PolarHBondContact O-N 3.26Å
355	L	77.8	Confident	69	Low	97 Å²	97	95.1 Å²	95.1	51%	0.508	51%	0.51	S	S	.	.	H	α-helix	trans	-61	-41.4	175.4	-179.4	63.2	0	0	0	112.1	E351 L352 V358 A359	E351-L355 VanDerWaalsContact O-CB 3.29Å; E351-L355 WeakPolarHBondContact O-CB 3.48Å; E351-L355 PolarHBondContact O-N 2.93Å; L352-L355 PolarHBondContact O-N 3.23Å; L355-V358 PolarHBondContact O-N 3.21Å; L355-A359 VanDerWaalsContact O-CB 3.29Å; L355-A359 WeakPolarHBondContact O-CB 3.45Å; L355-A359 PolarHBondContact O-N 3.25Å
356	I	75.1	Confident	70.6	Confident	73 Å²	73	91.8 Å²	91.8	37%	0.374	49%	0.486	S	S	.	.	H	α-helix	trans	-65.1	-40.7	174.8	-73.2	166.5	0	0	0	110.8	L352 N353 D354 A359 H360	L352-I356 HydrophobicContact CD1-CD1 4Å; L352-I356 HydrophobicContact CD1-CG1 4.26Å; L352-I356 HydrophobicContact CG-CD1 3.9Å; L352-I356 WeakPolarHBondContact O-CB 3.14Å; L352-I356 VanDerWaalsContact O-CG1 3.23Å; L352-I356 WeakPolarHBondContact O-CG1 3.39Å; L352-I356 PolarHBondContact O-N 3Å; N353-I356 PolarHBondContact O-N 2.88Å; D354-I356 VanDerWaalsContact C-N 3.35Å; D354-I356 PolarHBondContact O-N 2.87Å; I356-A359 PolarHBondContact O-N 2.95Å; I356-H360 PolarHBondContact O-CD2 3.45Å; I356-H360 PolarHBondContact O-N 3.48Å
357	S	77.2	Confident	72.9	Confident	59 Å²	59	91.2 Å²	91.2	41%	0.413	48%	0.476	S	S	.	.	H	α-helix	trans	-65.1	-39.7	176.4	84.9	0	0	0	0	112.1	N353 D354 R361	N353-S357 WeakPolarHBondContact O-CB 3.31Å; N353-S357 PolarHBondContact O-N 3.05Å; D354-S357 PolarHBondContact O-N 2.92Å; D354-S357 PolarHBondContact O-OG 3.2Å; S357-R361 VanDerWaalsContact O-CB 3.24Å; S357-R361 WeakPolarHBondContact O-CB 3.43Å; S357-R361 PolarHBondContact O-N 3.4Å
358	V	75.7	Confident	74.7	Confident	63 Å²	63	90.7 Å²	90.7	38%	0.382	48%	0.475	S	S	.	.	H	α-helix	trans	-67.9	-40	174.5	170.3	0	0	0	0	110.5	D354 L355 R362	D354-V358 WeakPolarHBondContact O-CG2 3.14Å; D354-V358 PolarHBondContact O-N 3.26Å; L355-V358 PolarHBondContact O-N 3.21Å; V358-R362 VanDerWaalsContact O-CB 3.32Å; V358-R362 WeakPolarHBondContact O-CB 3.43Å; V358-R362 PolarHBondContact O-N 2.88Å
359	A	76.5	Confident	76	Confident	45 Å²	45	90.5 Å²	90.5	37%	0.372	47%	0.47	S	S	.	.	H	α-helix	trans	-63.8	-48.9	175.6	0	0	0	0	0	111.7	L355 I356 R362 I363	L355-A359 VanDerWaalsContact O-CB 3.29Å; L355-A359 WeakPolarHBondContact O-CB 3.45Å; L355-A359 PolarHBondContact O-N 3.25Å; I356-A359 PolarHBondContact O-N 2.95Å; A359-R362 CarbonylContact O-C 3.56Å; A359-R362 PolarHBondContact O-N 3.2Å; A359-I363 VanDerWaalsContact O-CG1 3.29Å; A359-I363 WeakPolarHBondContact O-CG1 3.46Å; A359-I363 PolarHBondContact O-N 3.23Å
360	H	78.2	Confident	76.9	Confident	118 Å²	118	89.6 Å²	89.6	55%	0.546	46%	0.461	S	S	.	.	H	α-helix	trans	-63	-44.2	175.7	-83.5	-68.5	0	0	0	112.3	I356 R362 I363 S364	I356-H360 PolarHBondContact O-CD2 3.45Å; I356-H360 PolarHBondContact O-N 3.48Å; H360-R362 VanDerWaalsContact C-N 3.26Å; H360-R362 PolarHBondContact O-N 2.87Å; H360-I363 PolarHBondContact O-N 3.34Å; H360-I363 VanDerWaalsContact O-N 3.12Å; H360-S364 PolarHBondContact O-N 2.98Å; H360-S364 PolarHBondContact O-OG 3.01Å
361	R	79.4	Confident	77.5	Confident	203 Å²	203	88.6 Å²	88.6	77%	0.766	46%	0.456	S	S	*	.	H	α-helix	trans	-61.5	-33.8	174.7	-174.7	179.2	-111.9	159	-4.2	112.1	S357 S365	S357-R361 VanDerWaalsContact O-CB 3.24Å; S357-R361 WeakPolarHBondContact O-CB 3.43Å; S357-R361 PolarHBondContact O-N 3.4Å; R361-S365 WeakPolarHBondContact O-CB 3.27Å; R361-S365 PolarHBondContact O-N 3.11Å
362	R	69.9	Low	78.6	Confident	67 Å²	67	89.8 Å²	89.8	25%	0.253	46%	0.461	S	S	.	.	H	α-helix	trans	-74.5	-35.5	172.9	-176.3	56.9	177.2	177.8	1.4	112.3	D326 L330 V358 A359 H360 S365 L366	D326-R362 IonicContact OD2-CZ 3.76Å; D326-R362 IonicContact OD2-NH1 3.71Å; D326-R362 IonicContact OD2-NH2 2.86Å; D326-R362 PolarHBondContact OD2-NH2 3.39Å; L330-R362 VanDerWaalsContact CD1-NH2 3.31Å; V358-R362 VanDerWaalsContact O-CB 3.32Å; V358-R362 WeakPolarHBondContact O-CB 3.43Å; V358-R362 PolarHBondContact O-N 2.88Å; A359-R362 CarbonylContact O-C 3.56Å; A359-R362 PolarHBondContact O-N 3.2Å; H360-R362 VanDerWaalsContact C-N 3.26Å; H360-R362 PolarHBondContact O-N 2.87Å; R362-S365 PolarHBondContact O-N 3.3Å; R362-L366 HydrophobicContact CG-CD1 3.98Å; R362-L366 HydrophobicContact CG-CG 4.34Å; R362-L366 VanDerWaalsContact O-CB 3.27Å; R362-L366 WeakPolarHBondContact O-CB 3.32Å; R362-L366 WeakPolarHBondContact O-CG 3.21Å; R362-L366 PolarHBondContact O-N 3.32Å
363	I	82.1	Confident	79	Confident	82 Å²	82	90.2 Å²	90.2	42%	0.421	46%	0.463	S	S	.	.	H	α-helix	trans	-62.9	-50.6	173.4	-70.9	162.7	0	0	0	109.7	A359 H360 S365 L366 Q367	A359-I363 VanDerWaalsContact O-CG1 3.29Å; A359-I363 WeakPolarHBondContact O-CG1 3.46Å; A359-I363 PolarHBondContact O-N 3.23Å; H360-I363 PolarHBondContact O-N 3.34Å; H360-I363 VanDerWaalsContact O-N 3.12Å; I363-S365 PolarHBondContact O-N 3.34Å; I363-L366 CarbonylContact O-C 3.53Å; I363-L366 WeakPolarHBondContact O-CA 3.43Å; I363-L366 PolarHBondContact O-N 3.41Å; I363-Q367 HydrophobicContact CG2-CG 4.44Å; I363-Q367 WeakPolarHBondContact O-CG 3.48Å; I363-Q367 PolarHBondContact O-N 3Å
364	S	81.8	Confident	79.3	Confident	55 Å²	55	89 Å²	89	39%	0.385	45%	0.454	S	S	.	.	H	α-helix	trans	-60.1	-46.8	174.8	-57.1	0	0	0	0	111.7	H360 L366 Q367 D368	H360-S364 PolarHBondContact O-N 2.98Å; H360-S364 PolarHBondContact O-OG 3.01Å; S364-L366 PolarHBondContact O-N 3.2Å; S364-L366 VanDerWaalsContact O-N 3.17Å; S364-Q367 CarbonylContact O-C 3.58Å; S364-Q367 WeakPolarHBondContact O-CA 3.24Å; S364-Q367 WeakPolarHBondContact O-CB 3.35Å; S364-Q367 PolarHBondContact O-N 3.05Å; S364-D368 PolarHBondContact O-N 3.43Å
365	S	81	Confident	79.5	Confident	44 Å²	44	88.9 Å²	88.9	31%	0.308	45%	0.45	S	S	.	.	H	α-helix	trans	-61.9	-24.4	174.9	172.4	0	0	0	0	114	R361 R362 I363 K369	R361-S365 WeakPolarHBondContact O-CB 3.27Å; R361-S365 PolarHBondContact O-N 3.11Å; R362-S365 PolarHBondContact O-N 3.3Å; I363-S365 PolarHBondContact O-N 3.34Å; S365-K369 VanDerWaalsContact O-CB 3.29Å; S365-K369 WeakPolarHBondContact O-CB 3.28Å; S365-K369 VanDerWaalsContact O-CG 3.24Å; S365-K369 WeakPolarHBondContact O-CG 3.38Å; S365-K369 PolarHBondContact O-N 3.33Å
366	L	78.8	Confident	79.5	Confident	77 Å²	77	85.1 Å²	85.1	40%	0.403	43%	0.432	S	S	.	.	H	α-helix	trans	-84	-31.2	172.6	-77.1	170.4	0	0	0	112	R362 I363 S364 L370	R362-L366 HydrophobicContact CG-CD1 3.98Å; R362-L366 HydrophobicContact CG-CG 4.34Å; R362-L366 VanDerWaalsContact O-CB 3.27Å; R362-L366 WeakPolarHBondContact O-CB 3.32Å; R362-L366 WeakPolarHBondContact O-CG 3.21Å; R362-L366 PolarHBondContact O-N 3.32Å; I363-L366 CarbonylContact O-C 3.53Å; I363-L366 WeakPolarHBondContact O-CA 3.43Å; I363-L366 PolarHBondContact O-N 3.41Å; S364-L366 PolarHBondContact O-N 3.2Å; S364-L366 VanDerWaalsContact O-N 3.17Å; L366-L370 WeakPolarHBondContact O-CB 3.48Å; L366-L370 PolarHBondContact O-N 3.02Å
367	Q	86.9	Confident	79.1	Confident	108 Å²	108	84.6 Å²	84.6	51%	0.505	43%	0.428	S	S	.	.	H	α-helix	trans	-67.9	-50.8	171.3	-70.7	170.4	-55	0	0	110.4	I363 S364 K369 L370 D371	I363-Q367 HydrophobicContact CG2-CG 4.44Å; I363-Q367 WeakPolarHBondContact O-CG 3.48Å; I363-Q367 PolarHBondContact O-N 3Å; S364-Q367 CarbonylContact O-C 3.58Å; S364-Q367 WeakPolarHBondContact O-CA 3.24Å; S364-Q367 WeakPolarHBondContact O-CB 3.35Å; S364-Q367 PolarHBondContact O-N 3.05Å; Q367-K369 VanDerWaalsContact C-N 3.26Å; Q367-K369 PolarHBondContact O-N 2.92Å; Q367-L370 PolarHBondContact O-N 2.64Å; Q367-D371 PolarHBondContact O-N 3.23Å
368	D	86.1	Confident	79.4	Confident	110 Å²	110	86.8 Å²	86.8	59%	0.588	43%	0.427	S	S	*	.	H	α-helix	trans	-55.6	-42.2	174.3	-59.2	-33.4	0	0	0	111.4	S364 H372	S364-D368 PolarHBondContact O-N 3.43Å; D368-H372 VanDerWaalsContact O-CB 3.28Å; D368-H372 WeakPolarHBondContact O-CB 3.29Å; D368-H372 PolarHBondContact O-N 3.25Å
369	K	78.6	Confident	79.9	Confident	80 Å²	80	90.1 Å²	90.1	35%	0.348	44%	0.439	S	S	.	.	H	α-helix	trans	-67.6	-40.7	174.2	-86.1	-173.3	171.5	-149.6	0	112.6	D326 S365 Q367 H372 L373	D326-K369 IonicContact OD1-NZ 2.83Å; D326-K369 PolarHBondContact OD1-NZ 3.05Å; D326-K369 IonicContact OD2-NZ 2.8Å; D326-K369 PolarHBondContact OD2-NZ 3.11Å; S365-K369 VanDerWaalsContact O-CB 3.29Å; S365-K369 WeakPolarHBondContact O-CB 3.28Å; S365-K369 VanDerWaalsContact O-CG 3.24Å; S365-K369 WeakPolarHBondContact O-CG 3.38Å; S365-K369 PolarHBondContact O-N 3.33Å; Q367-K369 VanDerWaalsContact C-N 3.26Å; Q367-K369 PolarHBondContact O-N 2.92Å; K369-H372 PolarHBondContact O-N 3.15Å; K369-L373 VanDerWaalsContact O-CB 3.25Å; K369-L373 WeakPolarHBondContact O-CB 3.26Å; K369-L373 WeakPolarHBondContact O-CG 3.48Å; K369-L373 PolarHBondContact O-N 2.94Å
370	L	82.1	Confident	79.8	Confident	93 Å²	93	93.8 Å²	93.8	49%	0.487	44%	0.443	S	S	.	.	H	α-helix	trans	-67.3	-46.2	179.8	-176.6	145.9	0	0	0	110.1	L366 Q367 H372 L373 E374	L366-L370 WeakPolarHBondContact O-CB 3.48Å; L366-L370 PolarHBondContact O-N 3.02Å; Q367-L370 PolarHBondContact O-N 2.64Å; L370-H372 PolarHBondContact O-N 3.18Å; L370-L373 PolarHBondContact O-N 2.93Å; L370-E374 HydrophobicContact CD2-CG 4.03Å; L370-E374 WeakPolarHBondContact O-CB 3.44Å; L370-E374 WeakPolarHBondContact O-CG 3.42Å; L370-E374 PolarHBondContact O-N 2.7Å
371	D	80.6	Confident	79.6	Confident	84 Å²	84	93.4 Å²	93.4	45%	0.449	44%	0.443	S	S	.	.	H	α-helix	trans	-59.3	-45.8	174	-73.9	-7.3	0	0	0	110.9	Q367 E374 H375	Q367-D371 PolarHBondContact O-N 3.23Å; D371-E374 PolarHBondContact O-N 3.25Å; D371-H375 PolarHBondContact O-N 2.91Å; D371-H375 PolarHBondContact O-ND1 3.24Å
372	H	86.1	Confident	79.8	Confident	136 Å²	136	89.6 Å²	89.6	63%	0.63	43%	0.432	S	S	*	.	H	α-helix	trans	-63.8	-41.6	176.2	-177.4	60.6	0	0	0	112.5	D368 K369 L370 H375 S376	D368-H372 VanDerWaalsContact O-CB 3.28Å; D368-H372 WeakPolarHBondContact O-CB 3.29Å; D368-H372 PolarHBondContact O-N 3.25Å; K369-H372 PolarHBondContact O-N 3.15Å; L370-H372 PolarHBondContact O-N 3.18Å; H372-H375 PolarHBondContact O-N 2.91Å; H372-S376 WeakPolarHBondContact O-CB 3.31Å; H372-S376 PolarHBondContact O-N 3.5Å
373	L	77.2	Confident	80.5	Confident	86 Å²	86	89.9 Å²	89.9	45%	0.45	44%	0.444	S	S	.	.	H	α-helix	trans	-61.8	-49.8	174.4	-78.3	168.4	0	0	0	110.7	K369 L370 H375 S376 E377	K369-L373 VanDerWaalsContact O-CB 3.25Å; K369-L373 WeakPolarHBondContact O-CB 3.26Å; K369-L373 WeakPolarHBondContact O-CG 3.48Å; K369-L373 PolarHBondContact O-N 2.94Å; L370-L373 PolarHBondContact O-N 2.93Å; L373-H375 VanDerWaalsContact C-N 3.3Å; L373-H375 PolarHBondContact O-N 3.33Å; L373-S376 CarbonylContact O-C 3.56Å; L373-S376 PolarHBondContact O-N 2.96Å; L373-S376 VanDerWaalsContact O-N 3.09Å; L373-S376 PolarHBondContact O-OG 3.2Å; L373-E377 WeakPolarHBondContact O-CB 3.46Å; L373-E377 WeakPolarHBondContact O-CG 3.47Å; L373-E377 PolarHBondContact O-N 3.37Å
374	E	78.9	Confident	80.2	Confident	78 Å²	78	87.4 Å²	87.4	36%	0.364	44%	0.435	S	S	.	.	H	α-helix	trans	-58.1	-40.1	176.8	-71.7	-165.5	153	0	0	112.1	L370 D371 E377 R378	L370-E374 HydrophobicContact CD2-CG 4.03Å; L370-E374 WeakPolarHBondContact O-CB 3.44Å; L370-E374 WeakPolarHBondContact O-CG 3.42Å; L370-E374 PolarHBondContact O-N 2.7Å; D371-E374 PolarHBondContact O-N 3.25Å; E374-E377 PolarHBondContact O-N 3.4Å; E374-R378 VanDerWaalsContact CB-NH1 3.29Å; E374-R378 VanDerWaalsContact CD-NH2 3.35Å; E374-R378 VanDerWaalsContact O-CB 3.32Å; E374-R378 WeakPolarHBondContact O-CB 3.35Å; E374-R378 WeakPolarHBondContact O-CD 3.49Å; E374-R378 WeakPolarHBondContact O-CG 3.24Å; E374-R378 PolarHBondContact O-N 2.82Å; E374-R378 IonicContact OE1-NH2 3.77Å; E374-R378 IonicContact OE2-CZ 3.14Å; E374-R378 IonicContact OE2-NH1 3.42Å; E374-R378 PolarHBondContact OE2-NH1 2.68Å; E374-R378 IonicContact OE2-NH2 2.66Å; E374-R378 PolarHBondContact OE2-NH2 3.42Å
375	H	79.7	Confident	80.2	Confident	109 Å²	109	88 Å²	88	51%	0.505	43%	0.434	S	S	.	.	H	α-helix	trans	-64.8	-44.9	174.3	-76.9	82.3	0	0	0	111.3	D371 H372 L373 E377 R378 E379	D371-H375 PolarHBondContact O-N 2.91Å; D371-H375 PolarHBondContact O-ND1 3.24Å; H372-H375 PolarHBondContact O-N 2.91Å; L373-H375 VanDerWaalsContact C-N 3.3Å; L373-H375 PolarHBondContact O-N 3.33Å; H375-E377 VanDerWaalsContact C-N 3.34Å; H375-E377 PolarHBondContact O-N 2.95Å; H375-R378 PolarHBondContact O-N 3.41Å; H375-E379 PolarHBondContact O-N 3.03Å
376	S	78	Confident	80.5	Confident	17 Å²	17	90.5 Å²	90.5	12%	0.119	44%	0.441	C	S	.	.	H	α-helix	trans	-63.9	-36.9	176.5	79.8	0	0	0	0	112.7	H372 L373 E379 R380	H372-S376 WeakPolarHBondContact O-CB 3.31Å; H372-S376 PolarHBondContact O-N 3.5Å; L373-S376 CarbonylContact O-C 3.56Å; L373-S376 PolarHBondContact O-N 2.96Å; L373-S376 VanDerWaalsContact O-N 3.09Å; L373-S376 PolarHBondContact O-OG 3.2Å; S376-E379 PolarHBondContact O-N 3.13Å; S376-R380 WeakPolarHBondContact O-CB 3.43Å; S376-R380 WeakPolarHBondContact O-CD 3.14Å; S376-R380 WeakPolarHBondContact O-CG 3.19Å; S376-R380 PolarHBondContact O-N 3.18Å; S376-R380 PolarHBondContact OG-NH1 3.12Å
377	E	67	Low	80.7	Confident	62 Å²	62	88.3 Å²	88.3	29%	0.29	43%	0.434	S	S	.	.	H	α-helix	trans	-73.5	-34.8	175.5	-69.8	-51.4	131.8	0	0	111.7	L373 E374 H375 E379 R380 M381	L373-E377 WeakPolarHBondContact O-CB 3.46Å; L373-E377 WeakPolarHBondContact O-CG 3.47Å; L373-E377 PolarHBondContact O-N 3.37Å; E374-E377 PolarHBondContact O-N 3.4Å; H375-E377 VanDerWaalsContact C-N 3.34Å; H375-E377 PolarHBondContact O-N 2.95Å; E377-E379 VanDerWaalsContact C-N 3.32Å; E377-E379 PolarHBondContact O-N 2.95Å; E377-R380 PolarHBondContact O-N 3.11Å; E377-R380 WeakPolarHBondContact OE1-CD 3.22Å; E377-R380 IonicContact OE1-CZ 3.86Å; E377-R380 IonicContact OE1-NE 3.42Å; E377-R380 IonicContact OE1-NH1 2.75Å; E377-R380 PolarHBondContact OE1-NH1 3.48Å; E377-M381 WeakPolarHBondContact O-CA 3.26Å; E377-M381 WeakPolarHBondContact O-CB 3.49Å; E377-M381 PolarHBondContact O-N 2.79Å
378	R	83	Confident	80.4	Confident	105 Å²	105	86.4 Å²	86.4	40%	0.396	43%	0.425	S	S	.	.	H	α-helix	trans	-61.6	-39.4	170.2	-75.6	162	-177.9	130.3	11.9	111.5	E374 H375 K382	E374-R378 VanDerWaalsContact CB-NH1 3.29Å; E374-R378 VanDerWaalsContact CD-NH2 3.35Å; E374-R378 VanDerWaalsContact O-CB 3.32Å; E374-R378 WeakPolarHBondContact O-CB 3.35Å; E374-R378 WeakPolarHBondContact O-CD 3.49Å; E374-R378 WeakPolarHBondContact O-CG 3.24Å; E374-R378 PolarHBondContact O-N 2.82Å; E374-R378 IonicContact OE1-NH2 3.77Å; E374-R378 IonicContact OE2-CZ 3.14Å; E374-R378 IonicContact OE2-NH1 3.42Å; E374-R378 PolarHBondContact OE2-NH1 2.68Å; E374-R378 IonicContact OE2-NH2 2.66Å; E374-R378 PolarHBondContact OE2-NH2 3.42Å; H375-R378 PolarHBondContact O-N 3.41Å; R378-K382 VanDerWaalsContact O-CG 3.24Å; R378-K382 WeakPolarHBondContact O-CG 3.46Å; R378-K382 PolarHBondContact O-N 2.89Å
379	E	85	Confident	80.3	Confident	134 Å²	134	88.4 Å²	88.4	63%	0.626	42%	0.424	S	S	*	.	H	α-helix	trans	-73.2	-44.3	176.4	-71.1	-177.9	167.8	0	0	112.4	H375 S376 E377 M381 K382 S383	H375-E379 PolarHBondContact O-N 3.03Å; S376-E379 PolarHBondContact O-N 3.13Å; E377-E379 VanDerWaalsContact C-N 3.32Å; E377-E379 PolarHBondContact O-N 2.95Å; E379-M381 VanDerWaalsContact C-N 3.35Å; E379-M381 PolarHBondContact O-N 3.07Å; E379-K382 PolarHBondContact O-N 3.25Å; E379-S383 WeakPolarHBondContact O-CB 3.36Å; E379-S383 PolarHBondContact O-N 3.23Å
380	R	76.1	Confident	80.8	Confident	121 Å²	121	91 Å²	91	46%	0.457	44%	0.437	S	S	.	.	H	α-helix	trans	-60.5	-42.4	173.2	-72.1	163.6	-174.5	163	6.9	111.8	S376 E377 S383 A384	S376-R380 WeakPolarHBondContact O-CB 3.43Å; S376-R380 WeakPolarHBondContact O-CD 3.14Å; S376-R380 WeakPolarHBondContact O-CG 3.19Å; S376-R380 PolarHBondContact O-N 3.18Å; S376-R380 PolarHBondContact OG-NH1 3.12Å; E377-R380 PolarHBondContact O-N 3.11Å; E377-R380 WeakPolarHBondContact OE1-CD 3.22Å; E377-R380 IonicContact OE1-CZ 3.86Å; E377-R380 IonicContact OE1-NE 3.42Å; E377-R380 IonicContact OE1-NH1 2.75Å; E377-R380 PolarHBondContact OE1-NH1 3.48Å; R380-S383 PolarHBondContact O-N 3.22Å; R380-A384 VanDerWaalsContact O-CB 3.3Å; R380-A384 WeakPolarHBondContact O-CB 3.4Å; R380-A384 PolarHBondContact O-N 3.06Å
381	M	72.5	Confident	80.6	Confident	111 Å²	111	87.7 Å²	87.7	55%	0.547	42%	0.423	S	S	.	.	H	α-helix	trans	-65	-42.2	176.2	-176.9	-178.6	66.7	0	0	111.6	E377 E379 A384 L385	E377-M381 WeakPolarHBondContact O-CA 3.26Å; E377-M381 WeakPolarHBondContact O-CB 3.49Å; E377-M381 PolarHBondContact O-N 2.79Å; E379-M381 VanDerWaalsContact C-N 3.35Å; E379-M381 PolarHBondContact O-N 3.07Å; M381-A384 PolarHBondContact O-N 2.81Å; M381-L385 HydrophobicContact CG-CD1 3.96Å; M381-L385 HydrophobicContact CG-CG 4.44Å; M381-L385 WeakPolarHBondContact O-CB 3.34Å; M381-L385 VanDerWaalsContact O-CG 3.22Å; M381-L385 WeakPolarHBondContact O-CG 3.47Å; M381-L385 PolarHBondContact O-N 3.23Å
382	K	85	Confident	80.7	Confident	123 Å²	123	86.8 Å²	86.8	54%	0.535	42%	0.419	S	S	.	.	H	α-helix	trans	-58.6	-49.8	171.5	-76	166.8	-177.9	175.6	0	111.1	R378 E379 A384 L385 E386	R378-K382 VanDerWaalsContact O-CG 3.24Å; R378-K382 WeakPolarHBondContact O-CG 3.46Å; R378-K382 PolarHBondContact O-N 2.89Å; E379-K382 PolarHBondContact O-N 3.25Å; K382-A384 VanDerWaalsContact C-N 3.33Å; K382-A384 PolarHBondContact O-N 2.89Å; K382-L385 PolarHBondContact O-N 3.45Å; K382-E386 WeakPolarHBondContact O-CB 3.28Å; K382-E386 VanDerWaalsContact O-CG 3.31Å; K382-E386 WeakPolarHBondContact O-CG 3.3Å; K382-E386 PolarHBondContact O-N 3.37Å
383	S	83.7	Confident	80.8	Confident	72 Å²	72	83.3 Å²	83.3	50%	0.503	41%	0.405	S	S	.	.	H	α-helix	trans	-61.3	-38.7	178.7	-171.5	0	0	0	0	112.7	E379 R380 E386 A387	E379-S383 WeakPolarHBondContact O-CB 3.36Å; E379-S383 PolarHBondContact O-N 3.23Å; R380-S383 PolarHBondContact O-N 3.22Å; S383-E386 PolarHBondContact O-N 3.25Å; S383-A387 WeakPolarHBondContact O-CB 3.28Å; S383-A387 PolarHBondContact O-N 3.4Å
384	A	76.4	Confident	81.2	Confident	30 Å²	30	81.4 Å²	81.4	25%	0.248	40%	0.398	C	S	.	.	H	α-helix	trans	-67.6	-42.8	174.8	0	0	0	0	0	112.3	R380 M381 K382 E386 A387 Q388	R380-A384 VanDerWaalsContact O-CB 3.3Å; R380-A384 WeakPolarHBondContact O-CB 3.4Å; R380-A384 PolarHBondContact O-N 3.06Å; M381-A384 PolarHBondContact O-N 2.81Å; K382-A384 VanDerWaalsContact C-N 3.33Å; K382-A384 PolarHBondContact O-N 2.89Å; A384-E386 VanDerWaalsContact C-N 3.34Å; A384-A387 PolarHBondContact O-N 2.85Å; A384-Q388 WeakPolarHBondContact O-CB 3.32Å; A384-Q388 PolarHBondContact O-N 2.84Å
385	L	81.8	Confident	81.4	Confident	68 Å²	68	78.2 Å²	78.2	36%	0.356	38%	0.384	S	S	.	.	H	α-helix	trans	-66.8	-33.4	174.4	-72.7	168.4	0	0	0	112.2	M381 K382 R389	M381-L385 HydrophobicContact CG-CD1 3.96Å; M381-L385 HydrophobicContact CG-CG 4.44Å; M381-L385 WeakPolarHBondContact O-CB 3.34Å; M381-L385 VanDerWaalsContact O-CG 3.22Å; M381-L385 WeakPolarHBondContact O-CG 3.47Å; M381-L385 PolarHBondContact O-N 3.23Å; K382-L385 PolarHBondContact O-N 3.45Å; L385-R389 WeakPolarHBondContact O-CB 3.05Å; L385-R389 WeakPolarHBondContact O-CD 3.48Å; L385-R389 WeakPolarHBondContact O-CG 3.36Å; L385-R389 PolarHBondContact O-N 2.84Å
386	E	87.5	Confident	81.6	Confident	97 Å²	97	79 Å²	79	45%	0.453	38%	0.383	S	S	.	.	H	α-helix	trans	-70.8	-43.1	173.9	-76.2	166	-166.4	0	0	111.5	K382 S383 A384 Q388 R389 Q390	K382-E386 WeakPolarHBondContact O-CB 3.28Å; K382-E386 VanDerWaalsContact O-CG 3.31Å; K382-E386 WeakPolarHBondContact O-CG 3.3Å; K382-E386 PolarHBondContact O-N 3.37Å; S383-E386 PolarHBondContact O-N 3.25Å; A384-E386 VanDerWaalsContact C-N 3.34Å; E386-Q388 VanDerWaalsContact C-N 3.32Å; E386-Q388 PolarHBondContact O-N 3.14Å; E386-R389 PolarHBondContact O-N 2.9Å; E386-Q390 VanDerWaalsContact O-CG 3.28Å; E386-Q390 WeakPolarHBondContact O-CG 3.42Å; E386-Q390 PolarHBondContact O-N 3.44Å
387	A	82.7	Confident	82.2	Confident	30 Å²	30	84 Å²	84	25%	0.248	40%	0.402	C	S	.	.	H	α-helix	trans	-65	-35	173	0	0	0	0	0	112.4	S383 A384 A391	S383-A387 WeakPolarHBondContact O-CB 3.28Å; S383-A387 PolarHBondContact O-N 3.4Å; A384-A387 PolarHBondContact O-N 2.85Å; A387-A391 PolarHBondContact O-N 3.08Å
388	Q	80.9	Confident	82.7	Confident	69 Å²	69	81.8 Å²	81.8	32%	0.322	39%	0.392	S	S	.	.	H	α-helix	trans	-65	-50.4	170.9	-177.5	-177.3	-13.2	0	0	110.8	M308 A384 E386 Q390 A391 D392	M308-Q388 HydrophobicContact CE-CB 3.93Å; M308-Q388 HydrophobicContact CE-CG 4.25Å; M308-Q388 HydrophobicContact SD-CB 4.34Å; A384-Q388 WeakPolarHBondContact O-CB 3.32Å; A384-Q388 PolarHBondContact O-N 2.84Å; E386-Q388 VanDerWaalsContact C-N 3.32Å; E386-Q388 PolarHBondContact O-N 3.14Å; Q388-Q390 VanDerWaalsContact C-N 3.25Å; Q388-Q390 PolarHBondContact O-N 3.32Å; Q388-A391 CarbonylContact O-C 3.57Å; Q388-A391 WeakPolarHBondContact O-CA 3.44Å; Q388-A391 WeakPolarHBondContact O-CB 3.32Å; Q388-A391 PolarHBondContact O-N 3.4Å; Q388-D392 PolarHBondContact O-N 3.3Å
389	R	83.9	Confident	82.8	Confident	152 Å²	152	81.9 Å²	81.9	57%	0.574	39%	0.393	S	S	*	.	H	α-helix	trans	-55.2	-40.6	176.7	-77.5	164.5	178	177	-0.9	112.2	L385 E386 D392 D393	L385-R389 WeakPolarHBondContact O-CB 3.05Å; L385-R389 WeakPolarHBondContact O-CD 3.48Å; L385-R389 WeakPolarHBondContact O-CG 3.36Å; L385-R389 PolarHBondContact O-N 2.84Å; E386-R389 PolarHBondContact O-N 2.9Å; R389-D392 CarbonylContact O-C 3.59Å; R389-D392 PolarHBondContact O-N 2.98Å; R389-D393 VanDerWaalsContact O-CB 3.3Å; R389-D393 WeakPolarHBondContact O-CB 3.39Å; R389-D393 PolarHBondContact O-N 3.01Å
390	Q	87.7	Confident	83	Confident	133 Å²	133	81 Å²	81	62%	0.621	39%	0.391	S	S	*	.	H	α-helix	trans	-63.3	-39.1	175.8	-73.2	169.8	9.9	0	0	112.6	E386 Q388 D393 S394	E386-Q390 VanDerWaalsContact O-CG 3.28Å; E386-Q390 WeakPolarHBondContact O-CG 3.42Å; E386-Q390 PolarHBondContact O-N 3.44Å; Q388-Q390 VanDerWaalsContact C-N 3.25Å; Q388-Q390 PolarHBondContact O-N 3.32Å; Q390-D393 PolarHBondContact O-N 3.37Å; Q390-S394 PolarHBondContact O-N 2.95Å; Q390-S394 PolarHBondContact O-OG 3.44Å
391	A	78.7	Confident	83.5	Confident	24 Å²	24	79.3 Å²	79.3	20%	0.198	39%	0.387	C	S	.	.	H	α-helix	trans	-71.1	-37.4	173.9	0	0	0	0	0	112.6	A387 Q388 D393 S394 L395	A387-A391 PolarHBondContact O-N 3.08Å; Q388-A391 CarbonylContact O-C 3.57Å; Q388-A391 WeakPolarHBondContact O-CA 3.44Å; Q388-A391 WeakPolarHBondContact O-CB 3.32Å; Q388-A391 PolarHBondContact O-N 3.4Å; A391-D393 VanDerWaalsContact C-N 3.31Å; A391-S394 WeakPolarHBondContact CA-OG 3.34Å; A391-S394 PolarHBondContact O-N 2.89Å; A391-S394 PolarHBondContact O-OG 3.1Å; A391-L395 WeakPolarHBondContact O-CB 3.28Å; A391-L395 WeakPolarHBondContact O-CG 3.46Å; A391-L395 PolarHBondContact O-N 3.01Å
392	D	82.2	Confident	83.9	Confident	66 Å²	66	74.7 Å²	74.7	35%	0.353	36%	0.364	S	S	.	.	H	α-helix	trans	-68.5	-31.6	172.6	-68.7	-33.3	0	0	0	111.6	Q388 R389 R396	Q388-D392 PolarHBondContact O-N 3.3Å; R389-D392 CarbonylContact O-C 3.59Å; R389-D392 PolarHBondContact O-N 2.98Å; D392-R396 VanDerWaalsContact C-NH2 3.34Å; D392-R396 VanDerWaalsContact O-CB 3.29Å; D392-R396 WeakPolarHBondContact O-CB 3.29Å; D392-R396 VanDerWaalsContact O-CG 3.29Å; D392-R396 WeakPolarHBondContact O-CG 3.37Å; D392-R396 PolarHBondContact O-N 3.41Å; D392-R396 PolarHBondContact O-NE 2.82Å; D392-R396 PolarHBondContact O-NH2 2.64Å
393	D	89.3	Confident	83.8	Confident	63 Å²	63	72.5 Å²	72.5	34%	0.337	36%	0.356	S	S	.	.	H	α-helix	trans	-72.5	-37.8	173.6	-78.3	-37.5	0	0	0	111.1	R389 Q390 A391 R396 K397	R389-D393 VanDerWaalsContact O-CB 3.3Å; R389-D393 WeakPolarHBondContact O-CB 3.39Å; R389-D393 PolarHBondContact O-N 3.01Å; Q390-D393 PolarHBondContact O-N 3.37Å; A391-D393 VanDerWaalsContact C-N 3.31Å; D393-R396 VanDerWaalsContact CG-NH2 3.34Å; D393-R396 IonicContact OD1-CZ 2.67Å; D393-R396 IonicContact OD1-NH1 3.94Å; D393-R396 PolarHBondContact OD1-NH1 3.36Å; D393-R396 IonicContact OD1-NH2 3.67Å; D393-R396 PolarHBondContact OD1-NH2 2.76Å; D393-K397 WeakPolarHBondContact O-CD 3.46Å; D393-K397 WeakPolarHBondContact O-CG 3.32Å; D393-K397 PolarHBondContact O-N 2.69Å
394	S	84.3	Confident	84	Confident	45 Å²	45	73.2 Å²	73.2	32%	0.315	35%	0.354	S	S	.	.	H	α-helix	trans	-68	-46.1	174.4	63.4	0	0	0	0	111.5	Q390 A391 R396 K397 E398	Q390-S394 PolarHBondContact O-N 2.95Å; Q390-S394 PolarHBondContact O-OG 3.44Å; A391-S394 WeakPolarHBondContact CA-OG 3.34Å; A391-S394 PolarHBondContact O-N 2.89Å; A391-S394 PolarHBondContact O-OG 3.1Å; S394-R396 VanDerWaalsContact C-N 3.33Å; S394-R396 PolarHBondContact O-N 3.49Å; S394-K397 WeakPolarHBondContact O-CB 3.41Å; S394-K397 PolarHBondContact O-N 2.83Å; S394-K397 VanDerWaalsContact O-N 3.11Å; S394-E398 WeakPolarHBondContact O-CG 2.95Å; S394-E398 PolarHBondContact O-N 3.47Å
395	L	83.6	Confident	84.3	Confident	12 Å²	12	73.8 Å²	73.8	6%	0.063	35%	0.353	C	S	.	.	H	α-helix	trans	-58.2	-43.5	172.9	-76.3	170.2	0	0	0	111.7	V300 K301 A391 K397 E398 Y399	V300-L395 HydrophobicContact CB-CD2 4.23Å; V300-L395 HydrophobicContact CG1-CD2 3.87Å; K301-L395 HydrophobicContact CB-CD1 4.18Å; K301-L395 HydrophobicContact CB-CD2 4.48Å; K301-L395 HydrophobicContact CG-CD1 4.24Å; A391-L395 WeakPolarHBondContact O-CB 3.28Å; A391-L395 WeakPolarHBondContact O-CG 3.46Å; A391-L395 PolarHBondContact O-N 3.01Å; L395-K397 PolarHBondContact O-N 3.41Å; L395-E398 PolarHBondContact O-N 2.9Å; L395-E398 VanDerWaalsContact O-N 3.15Å; L395-Y399 WeakPolarHBondContact O-CD2 3.4Å; L395-Y399 PolarHBondContact O-N 2.82Å
396	R	83.8	Confident	84.4	Confident	125 Å²	125	75.2 Å²	75.2	47%	0.472	35%	0.353	S	S	.	.	H	α-helix	trans	-62.5	-39.1	174.6	-82.5	176	-79.3	132.9	0.1	112.6	D392 D393 S394 E398 I400	D392-R396 VanDerWaalsContact C-NH2 3.34Å; D392-R396 VanDerWaalsContact O-CB 3.29Å; D392-R396 WeakPolarHBondContact O-CB 3.29Å; D392-R396 VanDerWaalsContact O-CG 3.29Å; D392-R396 WeakPolarHBondContact O-CG 3.37Å; D392-R396 PolarHBondContact O-N 3.41Å; D392-R396 PolarHBondContact O-NE 2.82Å; D392-R396 PolarHBondContact O-NH2 2.64Å; D393-R396 VanDerWaalsContact CG-NH2 3.34Å; D393-R396 IonicContact OD1-CZ 2.67Å; D393-R396 IonicContact OD1-NH1 3.94Å; D393-R396 PolarHBondContact OD1-NH1 3.36Å; D393-R396 IonicContact OD1-NH2 3.67Å; D393-R396 PolarHBondContact OD1-NH2 2.76Å; S394-R396 VanDerWaalsContact C-N 3.33Å; S394-R396 PolarHBondContact O-N 3.49Å; R396-E398 VanDerWaalsContact C-N 3.33Å; R396-I400 WeakPolarHBondContact O-CD1 3.33Å; R396-I400 VanDerWaalsContact O-CG1 3.25Å; R396-I400 WeakPolarHBondContact O-CG1 3.45Å; R396-I400 PolarHBondContact O-N 3.44Å
397	K	90.2	Very high	84.3	Confident	123 Å²	123	73.8 Å²	73.8	54%	0.535	35%	0.347	S	S	.	.	H	α-helix	trans	-63.4	-37.9	172.1	-71	163	-172.3	172.6	0	111.7	D393 S394 L395 I400 K401	D393-K397 WeakPolarHBondContact O-CD 3.46Å; D393-K397 WeakPolarHBondContact O-CG 3.32Å; D393-K397 PolarHBondContact O-N 2.69Å; S394-K397 WeakPolarHBondContact O-CB 3.41Å; S394-K397 PolarHBondContact O-N 2.83Å; S394-K397 VanDerWaalsContact O-N 3.11Å; L395-K397 PolarHBondContact O-N 3.41Å; K397-I400 PolarHBondContact O-N 2.95Å; K397-K401 VanDerWaalsContact O-CG 3.24Å; K397-K401 WeakPolarHBondContact O-CG 3.04Å; K397-K401 PolarHBondContact O-N 2.97Å
398	E	77.6	Confident	84.5	Confident	14 Å²	14	79.2 Å²	79.2	7%	0.065	36%	0.36	C	S	.	.	H	α-helix	trans	-67.5	-43	177.7	-72.8	170.1	160.3	0	0	112.3	V157 S394 L395 R396 I400 K401 Q402	V157-E398 WeakPolarHBondContact CG2-OE1 3.33Å; S394-E398 WeakPolarHBondContact O-CG 2.95Å; S394-E398 PolarHBondContact O-N 3.47Å; L395-E398 PolarHBondContact O-N 2.9Å; L395-E398 VanDerWaalsContact O-N 3.15Å; R396-E398 VanDerWaalsContact C-N 3.33Å; E398-I400 VanDerWaalsContact C-N 3.34Å; E398-I400 PolarHBondContact O-N 3.34Å; E398-K401 PolarHBondContact O-N 3.06Å; E398-Q402 WeakPolarHBondContact O-CB 3.3Å; E398-Q402 PolarHBondContact O-N 2.89Å
399	Y	85.4	Confident	84.5	Confident	108 Å²	108	76.8 Å²	76.8	42%	0.424	35%	0.35	S	S	.	.	H	α-helix	trans	-61.8	-39.4	171	-73.4	-62.6	0	0	0	112.7	N297 L395 Q402 E403	N297-Y399 HydrophobicContact CB-CE1 4.31Å; L395-Y399 WeakPolarHBondContact O-CD2 3.4Å; L395-Y399 PolarHBondContact O-N 2.82Å; Y399-Q402 PolarHBondContact O-N 3.24Å; Y399-E403 PolarHBondContact O-N 2.89Å; Y399-E403 VanDerWaalsContact O-N 3.08Å
400	I	89.6	Confident	84.7	Confident	114 Å²	114	75.2 Å²	75.2	59%	0.585	34%	0.344	S	S	*	.	H	α-helix	trans	-65.7	-42.1	175	-68.6	164.5	0	0	0	111.1	R396 K397 E398 Q402 L404	R396-I400 WeakPolarHBondContact O-CD1 3.33Å; R396-I400 VanDerWaalsContact O-CG1 3.25Å; R396-I400 WeakPolarHBondContact O-CG1 3.45Å; R396-I400 PolarHBondContact O-N 3.44Å; K397-I400 PolarHBondContact O-N 2.95Å; E398-I400 VanDerWaalsContact C-N 3.34Å; E398-I400 PolarHBondContact O-N 3.34Å; I400-Q402 VanDerWaalsContact C-N 3.3Å; I400-Q402 PolarHBondContact O-N 3.41Å; I400-L404 WeakPolarHBondContact O-CB 3.31Å; I400-L404 PolarHBondContact O-N 3.05Å
401	K	87.1	Confident	84.7	Confident	86 Å²	86	74.3 Å²	74.3	37%	0.374	34%	0.34	S	S	.	.	H	α-helix	trans	-59.3	-41	173.1	-71.8	166.4	-174.2	174.6	0	111.2	E158 K397 E398 L404 N405	E158-K401 IonicContact OE1-NZ 3.91Å; E158-K401 PolarHBondContact OE1-NZ 3.3Å; K397-K401 VanDerWaalsContact O-CG 3.24Å; K397-K401 WeakPolarHBondContact O-CG 3.04Å; K397-K401 PolarHBondContact O-N 2.97Å; E398-K401 PolarHBondContact O-N 3.06Å; K401-L404 PolarHBondContact O-N 2.92Å; K401-N405 PolarHBondContact O-N 2.96Å
402	Q	81	Confident	85	Confident	14 Å²	14	75.5 Å²	75.5	7%	0.065	34%	0.341	C	S	.	.	H	α-helix	trans	-64.8	-51.6	-179	-174.9	179.5	-0	0	0	112.5	Y290 T293 N297 E398 Y399 I400 L404 N405 R406	Y290-Q402 HydrophobicContact CD2-CG 3.78Å; Y290-Q402 HydrophobicContact CE2-CG 3.95Å; Y290-Q402 PolarHBondContact O-NE2 3.43Å; T293-Q402 HydrophobicContact CG2-CB 4.39Å; T293-Q402 HydrophobicContact CG2-CG 4.34Å; N297-Q402 PolarHBondContact ND2-OE1 3.29Å; N297-Q402 VanDerWaalsContact ND2-OE1 3.08Å; E398-Q402 WeakPolarHBondContact O-CB 3.3Å; E398-Q402 PolarHBondContact O-N 2.89Å; Y399-Q402 PolarHBondContact O-N 3.24Å; I400-Q402 VanDerWaalsContact C-N 3.3Å; I400-Q402 PolarHBondContact O-N 3.41Å; Q402-L404 VanDerWaalsContact C-N 3.33Å; Q402-L404 PolarHBondContact O-N 3.39Å; Q402-N405 PolarHBondContact O-N 2.89Å; Q402-R406 PolarHBondContact O-N 3.29Å
403	E	81.6	Confident	85.1	Confident	78 Å²	78	73.3 Å²	73.3	36%	0.364	33%	0.33	S	S	.	.	H	α-helix	trans	-69.5	-30.8	177.2	-67.5	-63.8	160.2	0	0	112	Y399 N405 R406 E407	Y399-E403 PolarHBondContact O-N 2.89Å; Y399-E403 VanDerWaalsContact O-N 3.08Å; E403-N405 VanDerWaalsContact C-N 3.33Å; E403-N405 PolarHBondContact O-N 2.89Å; E403-R406 WeakPolarHBondContact O-CB 3.38Å; E403-R406 PolarHBondContact O-N 3.03Å; E403-R406 VanDerWaalsContact O-N 3.14Å; E403-R406 IonicContact OE1-NH1 2.64Å; E403-R406 PolarHBondContact OE1-NH1 2.92Å; E403-R406 WeakPolarHBondContact OE2-CD 3.12Å; E403-R406 IonicContact OE2-CZ 3.7Å; E403-R406 IonicContact OE2-NE 2.71Å; E403-R406 IonicContact OE2-NH1 3.95Å; E403-R406 PolarHBondContact OE2-NH1 3.18Å; E403-E407 PolarHBondContact O-N 3.43Å; E403-E407 VanDerWaalsContact O-N 3.07Å
404	L	89	Confident	85.1	Confident	87 Å²	87	74.7 Å²	74.7	46%	0.455	33%	0.334	S	S	.	.	H	α-helix	trans	-67.1	-32.7	173.9	-168.1	148.4	0	0	0	112.2	I400 K401 Q402 R408	I400-L404 WeakPolarHBondContact O-CB 3.31Å; I400-L404 PolarHBondContact O-N 3.05Å; K401-L404 PolarHBondContact O-N 2.92Å; Q402-L404 VanDerWaalsContact C-N 3.33Å; Q402-L404 PolarHBondContact O-N 3.39Å; L404-R408 HydrophobicContact CD2-CG 4.34Å; L404-R408 VanDerWaalsContact O-CG 3.29Å; L404-R408 WeakPolarHBondContact O-CG 3.35Å; L404-R408 PolarHBondContact O-N 3.32Å; L404-R408 VanDerWaalsContact O-N 3.09Å
405	N	82.1	Confident	85.1	Confident	42 Å²	42	79.3 Å²	79.3	23%	0.225	34%	0.344	C	S	.	.	H	α-helix	trans	-67.4	-35.1	169.4	-79.2	3.6	0	0	0	112.7	Q289 K401 Q402 E403 R408 T409	Q289-N405 PolarHBondContact OE1-ND2 3.42Å; K401-N405 PolarHBondContact O-N 2.96Å; Q402-N405 PolarHBondContact O-N 2.89Å; E403-N405 VanDerWaalsContact C-N 3.33Å; E403-N405 PolarHBondContact O-N 2.89Å; N405-R408 WeakPolarHBondContact O-CB 3.42Å; N405-R408 PolarHBondContact O-N 2.74Å; N405-R408 PolarHBondContact OD1-NH1 3.07Å; N405-T409 PolarHBondContact O-N 3.18Å; N405-T409 VanDerWaalsContact O-N 3.12Å; N405-T409 PolarHBondContact O-OG1 3.36Å
406	R	84.4	Confident	85	Confident	98 Å²	98	79.3 Å²	79.3	37%	0.37	34%	0.344	S	S	.	.	H	α-helix	trans	-65.4	-42.1	176.7	-173.8	-169.3	-165.3	161.4	7.7	112.9	Q402 E403 T409 R410	Q402-R406 PolarHBondContact O-N 3.29Å; E403-R406 WeakPolarHBondContact O-CB 3.38Å; E403-R406 PolarHBondContact O-N 3.03Å; E403-R406 VanDerWaalsContact O-N 3.14Å; E403-R406 IonicContact OE1-NH1 2.64Å; E403-R406 PolarHBondContact OE1-NH1 2.92Å; E403-R406 WeakPolarHBondContact OE2-CD 3.12Å; E403-R406 IonicContact OE2-CZ 3.7Å; E403-R406 IonicContact OE2-NE 2.71Å; E403-R406 IonicContact OE2-NH1 3.95Å; E403-R406 PolarHBondContact OE2-NH1 3.18Å; R406-T409 PolarHBondContact O-OG1 3.42Å; R406-T409 VanDerWaalsContact O-OG1 3.12Å; R406-R410 WeakPolarHBondContact O-CG 3.29Å; R406-R410 PolarHBondContact O-N 3.2Å
407	E	85.9	Confident	85.2	Confident	67 Å²	67	78.4 Å²	78.4	31%	0.313	34%	0.344	S	S	.	.	H	α-helix	trans	-76.2	-26.5	176.1	-58.8	-49.5	129.1	0	0	112.2	E403 R410 H411	E403-E407 PolarHBondContact O-N 3.43Å; E403-E407 VanDerWaalsContact O-N 3.07Å; E407-R410 IonicContact OE1-CZ 3.47Å; E407-R410 IonicContact OE1-NE 3.86Å; E407-R410 IonicContact OE1-NH1 3.83Å; E407-R410 PolarHBondContact OE1-NH1 3.15Å; E407-R410 WeakPolarHBondContact OE2-CD 3.31Å; E407-R410 IonicContact OE2-CZ 3.83Å; E407-R410 IonicContact OE2-NE 2.95Å; E407-R410 IonicContact OE2-NH1 2.7Å; E407-R410 PolarHBondContact OE2-NH1 3.11Å; E407-H411 WeakPolarHBondContact O-CB 3.35Å; E407-H411 PolarHBondContact O-CD2 3.01Å; E407-H411 VanDerWaalsContact O-CD2 3.26Å; E407-H411 PolarHBondContact O-N 2.93Å
408	R	87.2	Confident	85.1	Confident	143 Å²	143	81 Å²	81	54%	0.54	35%	0.35	S	S	.	.	H	α-helix	trans	-57.5	-55	167.6	-79.3	169.1	172.6	160.2	-5.1	111.7	L404 N405 R410 H411 E412	L404-R408 HydrophobicContact CD2-CG 4.34Å; L404-R408 VanDerWaalsContact O-CG 3.29Å; L404-R408 WeakPolarHBondContact O-CG 3.35Å; L404-R408 PolarHBondContact O-N 3.32Å; L404-R408 VanDerWaalsContact O-N 3.09Å; N405-R408 WeakPolarHBondContact O-CB 3.42Å; N405-R408 PolarHBondContact O-N 2.74Å; N405-R408 PolarHBondContact OD1-NH1 3.07Å; R408-R410 VanDerWaalsContact C-N 3.29Å; R408-R410 PolarHBondContact O-N 2.92Å; R408-H411 PolarHBondContact O-N 3.32Å; R408-E412 WeakPolarHBondContact O-CG 3.14Å; R408-E412 PolarHBondContact O-N 3.38Å
409	T	81	Confident	85.5	Confident	18 Å²	18	84.2 Å²	84.2	11%	0.11	37%	0.367	C	S	.	.	H	α-helix	trans	-64.8	-33.9	-176.7	54.9	0	0	0	0	112.3	I282 N405 R406 E412 I413	I282-T409 HydrophobicContact CG2-CG2 4.46Å; N405-T409 PolarHBondContact O-N 3.18Å; N405-T409 VanDerWaalsContact O-N 3.12Å; N405-T409 PolarHBondContact O-OG1 3.36Å; R406-T409 PolarHBondContact O-OG1 3.42Å; R406-T409 VanDerWaalsContact O-OG1 3.12Å; T409-E412 PolarHBondContact O-N 3.27Å; T409-I413 WeakPolarHBondContact O-CG1 3.4Å; T409-I413 PolarHBondContact O-N 3.08Å
410	R	87.3	Confident	85.4	Confident	119 Å²	119	81.4 Å²	81.4	45%	0.449	36%	0.356	S	S	.	.	H	α-helix	trans	-59.1	-53.6	169.2	-76.2	171	160.6	-172.6	2.1	112.6	R406 E407 R408 E412 I413 E414	R406-R410 WeakPolarHBondContact O-CG 3.29Å; R406-R410 PolarHBondContact O-N 3.2Å; E407-R410 IonicContact OE1-CZ 3.47Å; E407-R410 IonicContact OE1-NE 3.86Å; E407-R410 IonicContact OE1-NH1 3.83Å; E407-R410 PolarHBondContact OE1-NH1 3.15Å; E407-R410 WeakPolarHBondContact OE2-CD 3.31Å; E407-R410 IonicContact OE2-CZ 3.83Å; E407-R410 IonicContact OE2-NE 2.95Å; E407-R410 IonicContact OE2-NH1 2.7Å; E407-R410 PolarHBondContact OE2-NH1 3.11Å; R408-R410 VanDerWaalsContact C-N 3.29Å; R408-R410 PolarHBondContact O-N 2.92Å; R410-E412 PolarHBondContact O-N 3.11Å; R410-I413 PolarHBondContact O-N 3.48Å; R410-I413 VanDerWaalsContact O-N 3.13Å; R410-E414 WeakPolarHBondContact O-CG 3.34Å; R410-E414 PolarHBondContact O-N 3.18Å
411	H	88.4	Confident	85.4	Confident	114 Å²	114	81 Å²	81	53%	0.528	35%	0.351	S	S	.	.	H	α-helix	trans	-63.4	-27.5	178.1	-70	-33.4	0	0	0	112.9	E407 R408 E414 R415	E407-H411 WeakPolarHBondContact O-CB 3.35Å; E407-H411 PolarHBondContact O-CD2 3.01Å; E407-H411 VanDerWaalsContact O-CD2 3.26Å; E407-H411 PolarHBondContact O-N 2.93Å; R408-H411 PolarHBondContact O-N 3.32Å; H411-E414 IonicContact CE1-OE2 3.27Å; H411-E414 IonicContact CG-OE2 3.94Å; H411-E414 IonicContact ND1-OE2 2.55Å; H411-E414 PolarHBondContact ND1-OE2 2.85Å; H411-R415 WeakPolarHBondContact O-CB 3.35Å; H411-R415 PolarHBondContact O-N 3.31Å
412	E	84.2	Confident	85.5	Confident	49 Å²	49	79.7 Å²	79.7	23%	0.229	36%	0.357	C	S	.	.	H	α-helix	trans	-70.7	-45	171.4	-70.3	-173.8	129.2	0	0	112	R267 R408 T409 R410 E414 R415 H416	R267-E412 IonicContact CZ-OE1 2.69Å; R267-E412 VanDerWaalsContact CZ-OE1 3.24Å; R267-E412 IonicContact NH1-OE1 2.69Å; R267-E412 PolarHBondContact NH1-OE1 2.99Å; R267-E412 IonicContact NH2-OE1 2.98Å; R267-E412 PolarHBondContact NH2-OE1 3.03Å; R408-E412 WeakPolarHBondContact O-CG 3.14Å; R408-E412 PolarHBondContact O-N 3.38Å; T409-E412 PolarHBondContact O-N 3.27Å; R410-E412 PolarHBondContact O-N 3.11Å; E412-E414 VanDerWaalsContact C-N 3.34Å; E412-E414 PolarHBondContact O-N 2.93Å; E412-R415 PolarHBondContact O-N 2.88Å; E412-H416 PolarHBondContact O-CD2 3.46Å; E412-H416 PolarHBondContact O-N 2.96Å
413	I	84.5	Confident	85.7	Confident	21 Å²	21	81.4 Å²	81.4	11%	0.108	36%	0.363	C	S	.	.	H	α-helix	trans	-61.7	-41.7	174.1	-68	163.3	0	0	0	111	I282 E283 T409 R410 H416 K417	I282-I413 HydrophobicContact CG2-CD1 4.41Å; I282-I413 HydrophobicContact CG2-CG1 4.07Å; E283-I413 HydrophobicContact CB-CD1 3.92Å; E283-I413 HydrophobicContact CG-CD1 4.05Å; T409-I413 WeakPolarHBondContact O-CG1 3.4Å; T409-I413 PolarHBondContact O-N 3.08Å; R410-I413 PolarHBondContact O-N 3.48Å; R410-I413 VanDerWaalsContact O-N 3.13Å; I413-H416 PolarHBondContact O-N 3.42Å; I413-K417 WeakPolarHBondContact O-CG 3.48Å; I413-K417 PolarHBondContact O-N 3.49Å; I413-K417 VanDerWaalsContact O-N 3.15Å
414	E	88.3	Confident	86	Confident	91 Å²	91	82.2 Å²	82.2	43%	0.425	37%	0.37	S	S	.	.	H	α-helix	trans	-61.4	-47.1	172.9	-70.7	172.7	157.5	0	0	111.3	R410 H411 E412 H416 K417 W418	R410-E414 WeakPolarHBondContact O-CG 3.34Å; R410-E414 PolarHBondContact O-N 3.18Å; H411-E414 IonicContact CE1-OE2 3.27Å; H411-E414 IonicContact CG-OE2 3.94Å; H411-E414 IonicContact ND1-OE2 2.55Å; H411-E414 PolarHBondContact ND1-OE2 2.85Å; E412-E414 VanDerWaalsContact C-N 3.34Å; E412-E414 PolarHBondContact O-N 2.93Å; E414-H416 VanDerWaalsContact C-N 3.29Å; E414-H416 PolarHBondContact O-N 3.49Å; E414-K417 WeakPolarHBondContact O-CA 3.43Å; E414-K417 WeakPolarHBondContact O-CB 3.42Å; E414-K417 PolarHBondContact O-N 3.34Å; E414-W418 PolarHBondContact O-N 2.94Å
415	R	84.8	Confident	86.2	Confident	142 Å²	142	80.5 Å²	80.5	54%	0.536	37%	0.368	S	S	.	.	H	α-helix	trans	-59.2	-38.3	175.7	179.8	178.4	175.1	-170.2	-2.5	112.1	H411 E412 K417 L419	H411-R415 WeakPolarHBondContact O-CB 3.35Å; H411-R415 PolarHBondContact O-N 3.31Å; E412-R415 PolarHBondContact O-N 2.88Å; R415-K417 VanDerWaalsContact C-N 3.27Å; R415-K417 PolarHBondContact O-N 3.16Å; R415-L419 HydrophobicContact CG-CD1 3.98Å; R415-L419 HydrophobicContact CG-CG 4.41Å; R415-L419 VanDerWaalsContact O-CB 3.32Å; R415-L419 WeakPolarHBondContact O-CB 3.24Å; R415-L419 WeakPolarHBondContact O-CG 3.21Å; R415-L419 PolarHBondContact O-N 2.7Å
416	H	82.5	Confident	86.5	Confident	13 Å²	13	85.6 Å²	85.6	6%	0.06	39%	0.389	C	S	.	.	H	α-helix	trans	-72.1	-14.3	174.3	-82.8	-81.3	0	0	0	114	E412 I413 E414 R420	E412-H416 PolarHBondContact O-CD2 3.46Å; E412-H416 PolarHBondContact O-N 2.96Å; I413-H416 PolarHBondContact O-N 3.42Å; E414-H416 VanDerWaalsContact C-N 3.29Å; E414-H416 PolarHBondContact O-N 3.49Å; H416-R420 PolarHBondContact O-NE 3.45Å
417	K	86.6	Confident	86.7	Confident	106 Å²	106	84.9 Å²	84.9	46%	0.461	39%	0.389	S	S	.	.	H	α-helix	trans	-85.6	-52	167.7	-67.7	169.2	-175.7	175.8	0	110.6	I413 E414 R415 L419 R420 E421	I413-K417 WeakPolarHBondContact O-CG 3.48Å; I413-K417 PolarHBondContact O-N 3.49Å; I413-K417 VanDerWaalsContact O-N 3.15Å; E414-K417 WeakPolarHBondContact O-CA 3.43Å; E414-K417 WeakPolarHBondContact O-CB 3.42Å; E414-K417 PolarHBondContact O-N 3.34Å; R415-K417 VanDerWaalsContact C-N 3.27Å; R415-K417 PolarHBondContact O-N 3.16Å; K417-L419 VanDerWaalsContact C-N 3.26Å; K417-L419 PolarHBondContact O-N 2.94Å; K417-R420 WeakPolarHBondContact O-CB 3.36Å; K417-R420 PolarHBondContact O-N 3.39Å; K417-E421 PolarHBondContact O-N 3.03Å
418	W	88	Confident	87	Confident	178 Å²	178	87.2 Å²	87.2	67%	0.674	40%	0.4	S	S	*	.	H	α-helix	trans	-55.3	-36.9	176	-73.7	116.4	0	0	0	113.6	E414 A422	E414-W418 PolarHBondContact O-N 2.94Å; W418-A422 WeakPolarHBondContact O-CB 3.34Å; W418-A422 PolarHBondContact O-N 3.32Å
419	L	87.5	Confident	87.3	Confident	80 Å²	80	87 Å²	87	42%	0.419	41%	0.405	S	S	.	.	H	α-helix	trans	-67.8	-32.5	176.3	-76.8	169.6	0	0	0	113.4	R415 K417 R423	R415-L419 HydrophobicContact CG-CD1 3.98Å; R415-L419 HydrophobicContact CG-CG 4.41Å; R415-L419 VanDerWaalsContact O-CB 3.32Å; R415-L419 WeakPolarHBondContact O-CB 3.24Å; R415-L419 WeakPolarHBondContact O-CG 3.21Å; R415-L419 PolarHBondContact O-N 2.7Å; K417-L419 VanDerWaalsContact C-N 3.26Å; K417-L419 PolarHBondContact O-N 2.94Å; L419-R423 WeakPolarHBondContact O-CB 3.47Å; L419-R423 PolarHBondContact O-N 2.92Å
420	R	81.9	Confident	87.8	Confident	50 Å²	50	90.7 Å²	90.7	19%	0.189	42%	0.424	C	S	.	.	H	α-helix	trans	-70.6	-54	172	-83.8	-178.7	-87.5	-168.1	-1.7	110.7	I273 N276 H416 K417 A422 R423 D424	I273-R420 HydrophobicContact CG2-CG 3.8Å; I273-R420 WeakPolarHBondContact O-CD 3.47Å; I273-R420 WeakPolarHBondContact O-CG 3.37Å; N276-R420 PolarHBondContact OD1-NH1 3.06Å; H416-R420 PolarHBondContact O-NE 3.45Å; K417-R420 WeakPolarHBondContact O-CB 3.36Å; K417-R420 PolarHBondContact O-N 3.39Å; R420-A422 PolarHBondContact O-N 2.94Å; R420-R423 CarbonylContact O-C 3.6Å; R420-R423 WeakPolarHBondContact O-CA 3.36Å; R420-R423 WeakPolarHBondContact O-CB 3.46Å; R420-R423 PolarHBondContact O-N 3.43Å; R420-D424 PolarHBondContact O-N 2.88Å
421	E	90	Very high	88.1	Confident	104 Å²	104	90.7 Å²	90.7	49%	0.486	43%	0.427	S	S	.	.	H	α-helix	trans	-56.4	-37.7	-179.7	-67.4	168.3	-155.7	0	0	112	K417 A425	K417-E421 PolarHBondContact O-N 3.03Å; E421-A425 VanDerWaalsContact O-CB 3.22Å; E421-A425 WeakPolarHBondContact O-CB 3.4Å; E421-A425 PolarHBondContact O-N 2.86Å
422	A	88.7	Confident	88.4	Confident	60 Å²	60	88.3 Å²	88.3	50%	0.496	42%	0.418	S	S	.	.	H	α-helix	trans	-71.3	-33	174	0	0	0	0	0	114	W418 R420 K426	W418-A422 WeakPolarHBondContact O-CB 3.34Å; W418-A422 PolarHBondContact O-N 3.32Å; R420-A422 PolarHBondContact O-N 2.94Å; A422-K426 VanDerWaalsContact O-CB 3.29Å; A422-K426 WeakPolarHBondContact O-CB 3.28Å; A422-K426 PolarHBondContact O-N 3.45Å; A422-K426 VanDerWaalsContact O-N 3.14Å
423	R	85.8	Confident	88.8	Confident	49 Å²	49	87.7 Å²	87.7	19%	0.185	42%	0.421	C	S	.	.	H	α-helix	trans	-66.4	-51.1	171.2	174.7	-174.4	-85.3	-174.9	-11.7	109.8	E270 D274 L419 R420 A425 K426 E427	E270-R423 PolarHBondContact O-NH2 3.27Å; E270-R423 IonicContact OE1-NH2 3.74Å; D274-R423 IonicContact OD1-CZ 2.64Å; D274-R423 IonicContact OD1-NH1 3.15Å; D274-R423 PolarHBondContact OD1-NH1 3.24Å; D274-R423 IonicContact OD2-CZ 3.09Å; D274-R423 IonicContact OD2-NH1 2.73Å; D274-R423 PolarHBondContact OD2-NH1 3.24Å; L419-R423 WeakPolarHBondContact O-CB 3.47Å; L419-R423 PolarHBondContact O-N 2.92Å; R420-R423 CarbonylContact O-C 3.6Å; R420-R423 WeakPolarHBondContact O-CA 3.36Å; R420-R423 WeakPolarHBondContact O-CB 3.46Å; R420-R423 PolarHBondContact O-N 3.43Å; R423-A425 PolarHBondContact O-N 3.45Å; R423-K426 PolarHBondContact O-N 2.86Å; R423-E427 WeakPolarHBondContact O-CB 3.24Å; R423-E427 PolarHBondContact O-N 3.14Å
424	D	87.6	Confident	89.2	Confident	96 Å²	96	91.9 Å²	91.9	51%	0.513	44%	0.443	S	S	.	.	H	α-helix	trans	-59.9	-44.5	-179.4	-68.1	-34.8	0	0	0	111.8	R420 E427 H428	R420-D424 PolarHBondContact O-N 2.88Å; D424-E427 PolarHBondContact O-N 3.28Å; D424-H428 VanDerWaalsContact O-CB 3.28Å; D424-H428 WeakPolarHBondContact O-CB 3.37Å; D424-H428 PolarHBondContact O-N 3Å
425	A	94.1	Very high	89.4	Confident	51 Å²	51	89.9 Å²	89.9	42%	0.421	44%	0.442	S	S	.	.	H	α-helix	trans	-61.5	-48.5	175.6	0	0	0	0	0	112	E421 R423 E427 H428 E429	E421-A425 VanDerWaalsContact O-CB 3.22Å; E421-A425 WeakPolarHBondContact O-CB 3.4Å; E421-A425 PolarHBondContact O-N 2.86Å; R423-A425 PolarHBondContact O-N 3.45Å; A425-E427 VanDerWaalsContact C-N 3.34Å; A425-E427 PolarHBondContact O-N 3.31Å; A425-H428 PolarHBondContact O-N 3.34Å; A425-E429 WeakPolarHBondContact O-CG 3.25Å; A425-E429 PolarHBondContact O-N 3.06Å
426	K	87.8	Confident	89.6	Confident	149 Å²	149	90.4 Å²	90.4	65%	0.648	44%	0.444	S	S	*	.	H	α-helix	trans	-61	-42	176.8	179.6	-169.7	171.6	-166.3	0	111.8	A422 R423 L430	A422-K426 VanDerWaalsContact O-CB 3.29Å; A422-K426 WeakPolarHBondContact O-CB 3.28Å; A422-K426 PolarHBondContact O-N 3.45Å; A422-K426 VanDerWaalsContact O-N 3.14Å; R423-K426 PolarHBondContact O-N 2.86Å; K426-L430 WeakPolarHBondContact O-CB 3.19Å; K426-L430 PolarHBondContact O-N 3.39Å
427	E	89.1	Confident	90	Very high	82 Å²	82	95.4 Å²	95.4	38%	0.383	47%	0.467	S	S	.	.	H	α-helix	trans	-65.1	-41	175.9	-83.1	-163.7	-146.9	0	0	112.1	R423 D424 A425 L430 K431	R423-E427 WeakPolarHBondContact O-CB 3.24Å; R423-E427 PolarHBondContact O-N 3.14Å; D424-E427 PolarHBondContact O-N 3.28Å; A425-E427 VanDerWaalsContact C-N 3.34Å; A425-E427 PolarHBondContact O-N 3.31Å; E427-L430 PolarHBondContact O-N 3.11Å; E427-K431 VanDerWaalsContact O-CB 3.31Å; E427-K431 WeakPolarHBondContact O-CB 3.36Å; E427-K431 VanDerWaalsContact O-CD 3.29Å; E427-K431 WeakPolarHBondContact O-CD 3.3Å; E427-K431 WeakPolarHBondContact O-CG 3.39Å; E427-K431 PolarHBondContact O-N 3.44Å; E427-K431 WeakPolarHBondContact OE2-CE 3.44Å; E427-K431 IonicContact OE2-NZ 2.68Å; E427-K431 PolarHBondContact OE2-NZ 3.04Å
428	H	92.1	Very high	90.4	Very high	117 Å²	117	93.9 Å²	93.9	54%	0.542	47%	0.47	S	S	.	.	H	α-helix	trans	-64.8	-43.3	176.3	-179	-106.9	0	0	0	111.7	D424 A425 L430 K431 L432	D424-H428 VanDerWaalsContact O-CB 3.28Å; D424-H428 WeakPolarHBondContact O-CB 3.37Å; D424-H428 PolarHBondContact O-N 3Å; A425-H428 PolarHBondContact O-N 3.34Å; H428-L430 PolarHBondContact O-N 3.49Å; H428-K431 PolarHBondContact O-N 2.89Å; H428-L432 VanDerWaalsContact CE1-CD1 3.45Å; H428-L432 WeakPolarHBondContact CE1-CD1 3.49Å; H428-L432 WeakPolarHBondContact O-CB 3.45Å; H428-L432 WeakPolarHBondContact O-CG 3.39Å; H428-L432 PolarHBondContact O-N 3.23Å
429	E	93.6	Very high	90.7	Very high	139 Å²	139	91.8 Å²	91.8	65%	0.65	47%	0.468	S	S	*	.	H	α-helix	trans	-59.9	-44	172.3	-74.3	-174.6	166.7	0	0	112.2	A425 L432 A433	A425-E429 WeakPolarHBondContact O-CG 3.25Å; A425-E429 PolarHBondContact O-N 3.06Å; E429-L432 PolarHBondContact O-N 3.41Å; E429-A433 WeakPolarHBondContact O-CB 3.49Å; E429-A433 PolarHBondContact O-N 3.3Å
430	L	91.5	Very high	91.1	Very high	95 Å²	95	93.2 Å²	93.2	50%	0.497	47%	0.472	S	S	.	.	H	α-helix	trans	-66.3	-42.9	177.8	-176	149.5	0	0	0	111.8	K426 E427 H428 A433 L434	K426-L430 WeakPolarHBondContact O-CB 3.19Å; K426-L430 PolarHBondContact O-N 3.39Å; E427-L430 PolarHBondContact O-N 3.11Å; H428-L430 PolarHBondContact O-N 3.49Å; L430-A433 PolarHBondContact O-N 3.05Å; L430-L434 HydrophobicContact CD2-CD1 3.63Å; L430-L434 HydrophobicContact CD2-CG 4.21Å; L430-L434 WeakPolarHBondContact O-CG 3.46Å; L430-L434 PolarHBondContact O-N 3.48Å
431	K	93.2	Very high	91.8	Very high	118 Å²	118	95.7 Å²	95.7	51%	0.513	49%	0.488	S	S	.	.	H	α-helix	trans	-61.9	-43	175.2	-71.6	160	-167.7	169.2	0	110.8	E427 H428 A435	E427-K431 VanDerWaalsContact O-CB 3.31Å; E427-K431 WeakPolarHBondContact O-CB 3.36Å; E427-K431 VanDerWaalsContact O-CD 3.29Å; E427-K431 WeakPolarHBondContact O-CD 3.3Å; E427-K431 WeakPolarHBondContact O-CG 3.39Å; E427-K431 PolarHBondContact O-N 3.44Å; E427-K431 WeakPolarHBondContact OE2-CE 3.44Å; E427-K431 IonicContact OE2-NZ 2.68Å; E427-K431 PolarHBondContact OE2-NZ 3.04Å; H428-K431 PolarHBondContact O-N 2.89Å; K431-A435 WeakPolarHBondContact O-CB 3.31Å; K431-A435 PolarHBondContact O-N 2.8Å
432	L	93.5	Very high	92.1	Very high	65 Å²	65	93.3 Å²	93.3	34%	0.34	48%	0.484	S	S	.	.	H	α-helix	trans	-66.1	-37.2	173.3	-75	176.8	0	0	0	113.1	H428 E429 R436	H428-L432 VanDerWaalsContact CE1-CD1 3.45Å; H428-L432 WeakPolarHBondContact CE1-CD1 3.49Å; H428-L432 WeakPolarHBondContact O-CB 3.45Å; H428-L432 WeakPolarHBondContact O-CG 3.39Å; H428-L432 PolarHBondContact O-N 3.23Å; E429-L432 PolarHBondContact O-N 3.41Å; L432-R436 VanDerWaalsContact O-CG 3.3Å; L432-R436 WeakPolarHBondContact O-CG 3.48Å; L432-R436 PolarHBondContact O-N 2.9Å
433	A	92.9	Very high	92.5	Very high	36 Å²	36	95.1 Å²	95.1	30%	0.298	48%	0.481	S	S	.	.	H	α-helix	trans	-65.6	-48.4	175.7	0	0	0	0	0	111	E429 L430 A435 R436 H437	E429-A433 WeakPolarHBondContact O-CB 3.49Å; E429-A433 PolarHBondContact O-N 3.3Å; L430-A433 PolarHBondContact O-N 3.05Å; A433-A435 VanDerWaalsContact C-N 3.34Å; A433-A435 PolarHBondContact O-N 2.93Å; A433-R436 PolarHBondContact O-N 2.85Å; A433-H437 WeakPolarHBondContact O-CB 3.48Å; A433-H437 PolarHBondContact O-CD2 3.47Å; A433-H437 PolarHBondContact O-N 3.3Å
434	L	92.9	Very high	93	Very high	108 Å²	108	96.8 Å²	96.8	57%	0.565	49%	0.492	S	S	*	.	H	α-helix	trans	-60.3	-40.8	175.6	-70.7	179.2	0	0	0	112.3	L430 H437 S438	L430-L434 HydrophobicContact CD2-CD1 3.63Å; L430-L434 HydrophobicContact CD2-CG 4.21Å; L430-L434 WeakPolarHBondContact O-CG 3.46Å; L430-L434 PolarHBondContact O-N 3.48Å; L434-H437 PolarHBondContact O-N 2.82Å; L434-S438 PolarHBondContact O-N 2.99Å; L434-S438 PolarHBondContact O-OG 2.91Å
435	A	93.4	Very high	93.4	Very high	50 Å²	50	98.2 Å²	98.2	41%	0.413	50%	0.499	S	S	.	.	H	α-helix	trans	-62.7	-46.5	175.6	0	0	0	0	0	112.3	K431 A433 H437 S438 E439	K431-A435 WeakPolarHBondContact O-CB 3.31Å; K431-A435 PolarHBondContact O-N 2.8Å; A433-A435 VanDerWaalsContact C-N 3.34Å; A433-A435 PolarHBondContact O-N 2.93Å; A435-H437 VanDerWaalsContact C-N 3.3Å; A435-H437 PolarHBondContact O-N 3Å; A435-S438 PolarHBondContact O-N 2.66Å; A435-S438 PolarHBondContact O-OG 3.17Å; A435-S438 VanDerWaalsContact O-OG 3.06Å; A435-E439 VanDerWaalsContact O-CB 3.31Å; A435-E439 WeakPolarHBondContact O-CB 3.14Å; A435-E439 PolarHBondContact O-N 3.23Å
436	R	89.1	Confident	93.5	Very high	152 Å²	152	100.9 Å²	100.9	57%	0.574	50%	0.503	S	S	*	.	H	α-helix	trans	-63	-36	174.6	-70.3	176.2	-165.5	118.4	-2.4	112.2	L432 A433 H440	L432-R436 VanDerWaalsContact O-CG 3.3Å; L432-R436 WeakPolarHBondContact O-CG 3.48Å; L432-R436 PolarHBondContact O-N 2.9Å; A433-R436 PolarHBondContact O-N 2.85Å; R436-H440 WeakPolarHBondContact O-CB 3.24Å; R436-H440 PolarHBondContact O-N 3.3Å
437	H	90.5	Very high	94	Very high	118 Å²	118	98.4 Å²	98.4	55%	0.546	50%	0.496	S	S	.	.	H	α-helix	trans	-70.5	-39.2	176.7	-74.2	-55	0	0	0	112.5	A433 L434 A435 H440 L441	A433-H437 WeakPolarHBondContact O-CB 3.48Å; A433-H437 PolarHBondContact O-CD2 3.47Å; A433-H437 PolarHBondContact O-N 3.3Å; L434-H437 PolarHBondContact O-N 2.82Å; A435-H437 VanDerWaalsContact C-N 3.3Å; A435-H437 PolarHBondContact O-N 3Å; H437-H440 PolarHBondContact O-N 3.45Å; H437-L441 WeakPolarHBondContact O-CB 3.31Å; H437-L441 VanDerWaalsContact O-CG 3.24Å; H437-L441 WeakPolarHBondContact O-CG 3.28Å; H437-L441 PolarHBondContact O-N 3.31Å
438	S	94.6	Very high	94.2	Very high	74 Å²	74	99.5 Å²	99.5	52%	0.517	50%	0.501	S	S	.	.	H	α-helix	trans	-72	-37.2	176.8	64.5	0	0	0	0	112.5	L434 A435 L441 S442	L434-S438 PolarHBondContact O-N 2.99Å; L434-S438 PolarHBondContact O-OG 2.91Å; A435-S438 PolarHBondContact O-N 2.66Å; A435-S438 PolarHBondContact O-OG 3.17Å; A435-S438 VanDerWaalsContact O-OG 3.06Å; S438-L441 PolarHBondContact O-N 3.35Å; S438-S442 WeakPolarHBondContact O-CB 3.45Å; S438-S442 PolarHBondContact O-N 3.44Å; S438-S442 PolarHBondContact O-OG 3.26Å
439	E	95	Very high	94.4	Very high	134 Å²	134	99.4 Å²	99.4	63%	0.626	50%	0.5	S	S	*	.	H	α-helix	trans	-63.8	-43.9	170.3	-175.6	178.2	-158.4	0	0	111.8	A435 S442 H443	A435-E439 VanDerWaalsContact O-CB 3.31Å; A435-E439 WeakPolarHBondContact O-CB 3.14Å; A435-E439 PolarHBondContact O-N 3.23Å; E439-S442 PolarHBondContact O-N 3.44Å; E439-S442 PolarHBondContact O-OG 3.44Å; E439-H443 WeakPolarHBondContact O-CB 3.26Å; E439-H443 PolarHBondContact O-N 2.82Å
440	H	96.6	Very high	94.6	Very high	110 Å²	110	96.1 Å²	96.1	51%	0.509	49%	0.486	S	S	.	.	H	α-helix	trans	-63.5	-42.8	175.9	-174.9	58.1	0	0	0	112	R436 H437 M444	R436-H440 WeakPolarHBondContact O-CB 3.24Å; R436-H440 PolarHBondContact O-N 3.3Å; H437-H440 PolarHBondContact O-N 3.45Å; H440-M444 PolarHBondContact NE2-SD 3.27Å; H440-M444 VanDerWaalsContact NE2-SD 3.43Å; H440-M444 WeakPolarHBondContact O-CB 3.25Å; H440-M444 VanDerWaalsContact O-CG 3.28Å; H440-M444 WeakPolarHBondContact O-CG 3.33Å; H440-M444 PolarHBondContact O-N 2.82Å
441	L	95.9	Very high	94.9	Very high	102 Å²	102	97 Å²	97	53%	0.534	49%	0.486	S	S	.	.	H	α-helix	trans	-66	-41.3	176.9	-75.1	170.1	0	0	0	112.3	H437 S438 M444 L445	H437-L441 WeakPolarHBondContact O-CB 3.31Å; H437-L441 VanDerWaalsContact O-CG 3.24Å; H437-L441 WeakPolarHBondContact O-CG 3.28Å; H437-L441 PolarHBondContact O-N 3.31Å; S438-L441 PolarHBondContact O-N 3.35Å; L441-M444 PolarHBondContact O-N 3.33Å; L441-L445 WeakPolarHBondContact O-CB 3.28Å; L441-L445 VanDerWaalsContact O-CG 3.28Å; L441-L445 WeakPolarHBondContact O-CG 3.32Å; L441-L445 PolarHBondContact O-N 3.42Å
442	S	96.2	Very high	94.9	Very high	55 Å²	55	95.2 Å²	95.2	39%	0.385	48%	0.481	S	S	.	.	H	α-helix	trans	-66.5	-42	177.6	69.7	0	0	0	0	111.6	S438 E439 L445 Q446	S438-S442 WeakPolarHBondContact O-CB 3.45Å; S438-S442 PolarHBondContact O-N 3.44Å; S438-S442 PolarHBondContact O-OG 3.26Å; E439-S442 PolarHBondContact O-N 3.44Å; E439-S442 PolarHBondContact O-OG 3.44Å; S442-L445 PolarHBondContact O-N 3.11Å; S442-Q446 VanDerWaalsContact O-CG 3.31Å; S442-Q446 WeakPolarHBondContact O-CG 3.33Å; S442-Q446 PolarHBondContact O-N 2.96Å
443	H	97.7	Very high	95	Very high	97 Å²	97	97.1 Å²	97.1	45%	0.449	49%	0.488	S	S	.	.	H	α-helix	trans	-65.4	-38.7	173.5	-177.9	-109.5	0	0	0	112.6	E439 Q446 L447	E439-H443 WeakPolarHBondContact O-CB 3.26Å; E439-H443 PolarHBondContact O-N 2.82Å; H443-Q446 PolarHBondContact O-N 3.39Å; H443-L447 VanDerWaalsContact CE1-CD1 3.47Å; H443-L447 WeakPolarHBondContact CE1-CD1 3.33Å; H443-L447 WeakPolarHBondContact O-CB 3.49Å; H443-L447 WeakPolarHBondContact O-CG 3.29Å; H443-L447 PolarHBondContact O-N 3.34Å
444	M	96.1	Very high	95.1	Very high	84 Å²	84	102.1 Å²	102.1	41%	0.414	51%	0.505	S	S	.	.	H	α-helix	trans	-62.7	-41.6	172.6	-80.2	-175.6	71.4	0	0	112.2	H440 L441 L447 Q448	H440-M444 PolarHBondContact NE2-SD 3.27Å; H440-M444 VanDerWaalsContact NE2-SD 3.43Å; H440-M444 WeakPolarHBondContact O-CB 3.25Å; H440-M444 VanDerWaalsContact O-CG 3.28Å; H440-M444 WeakPolarHBondContact O-CG 3.33Å; H440-M444 PolarHBondContact O-N 2.82Å; L441-M444 PolarHBondContact O-N 3.33Å; M444-L447 PolarHBondContact O-N 3.47Å; M444-Q448 VanDerWaalsContact O-CG 3.31Å; M444-Q448 WeakPolarHBondContact O-CG 3.41Å; M444-Q448 PolarHBondContact O-N 3.1Å
445	L	95.3	Very high	95.2	Very high	126 Å²	126	101.3 Å²	101.3	66%	0.66	50%	0.498	S	S	*	.	H	α-helix	trans	-67.9	-38.5	177.3	-72.4	169.3	0	0	0	111.7	L441 S442 Q448 K449	L441-L445 WeakPolarHBondContact O-CB 3.28Å; L441-L445 VanDerWaalsContact O-CG 3.28Å; L441-L445 WeakPolarHBondContact O-CG 3.32Å; L441-L445 PolarHBondContact O-N 3.42Å; S442-L445 PolarHBondContact O-N 3.11Å; L445-Q448 PolarHBondContact O-N 3.46Å; L445-K449 WeakPolarHBondContact O-CB 3.3Å; L445-K449 PolarHBondContact O-N 3.14Å
446	Q	96.8	Very high	95.2	Very high	108 Å²	108	104.9 Å²	104.9	51%	0.505	50%	0.504	S	S	.	.	H	α-helix	trans	-60.5	-53.2	170.9	-73.8	168.2	-7.6	0	0	111	S442 H443 Q448 K449 D450	S442-Q446 VanDerWaalsContact O-CG 3.31Å; S442-Q446 WeakPolarHBondContact O-CG 3.33Å; S442-Q446 PolarHBondContact O-N 2.96Å; H443-Q446 PolarHBondContact O-N 3.39Å; Q446-Q448 VanDerWaalsContact C-N 3.28Å; Q446-Q448 PolarHBondContact O-N 3.47Å; Q446-K449 CarbonylContact O-C 3.59Å; Q446-K449 WeakPolarHBondContact O-CA 3.34Å; Q446-K449 WeakPolarHBondContact O-CB 3.32Å; Q446-K449 PolarHBondContact O-N 3.05Å; Q446-D450 WeakPolarHBondContact O-CB 3.49Å; Q446-D450 PolarHBondContact O-N 2.97Å
447	L	97.3	Very high	95.6	Very high	96 Å²	96	99.2 Å²	99.2	50%	0.503	49%	0.49	S	S	.	.	H	α-helix	trans	-58.4	-36	178.1	-74.7	177.5	0	0	0	113.6	H443 M444 K451	H443-L447 VanDerWaalsContact CE1-CD1 3.47Å; H443-L447 WeakPolarHBondContact CE1-CD1 3.33Å; H443-L447 WeakPolarHBondContact O-CB 3.49Å; H443-L447 WeakPolarHBondContact O-CG 3.29Å; H443-L447 PolarHBondContact O-N 3.34Å; M444-L447 PolarHBondContact O-N 3.47Å; L447-K451 WeakPolarHBondContact O-CB 3.42Å; L447-K451 PolarHBondContact O-N 2.84Å
448	Q	94.7	Very high	95.8	Very high	105 Å²	105	98.8 Å²	98.8	49%	0.491	49%	0.488	S	S	.	.	H	α-helix	trans	-70.9	-42	174.1	-69.1	-72.3	10.5	0	0	111.7	M444 L445 Q446 K451 M452	M444-Q448 VanDerWaalsContact O-CG 3.31Å; M444-Q448 WeakPolarHBondContact O-CG 3.41Å; M444-Q448 PolarHBondContact O-N 3.1Å; L445-Q448 PolarHBondContact O-N 3.46Å; Q446-Q448 VanDerWaalsContact C-N 3.28Å; Q446-Q448 PolarHBondContact O-N 3.47Å; Q448-K451 PolarHBondContact O-N 3.06Å; Q448-M452 VanDerWaalsContact O-CG 3.29Å; Q448-M452 WeakPolarHBondContact O-CG 3.38Å; Q448-M452 PolarHBondContact O-N 3.15Å
449	K	96.5	Very high	95.9	Very high	116 Å²	116	100.2 Å²	100.2	50%	0.504	49%	0.487	S	S	.	.	H	α-helix	trans	-58.4	-54.4	174.3	-177.4	-158.6	162.3	-160.2	0	110.6	L445 Q446 K451 M452 E453	L445-K449 WeakPolarHBondContact O-CB 3.3Å; L445-K449 PolarHBondContact O-N 3.14Å; Q446-K449 CarbonylContact O-C 3.59Å; Q446-K449 WeakPolarHBondContact O-CA 3.34Å; Q446-K449 WeakPolarHBondContact O-CB 3.32Å; Q446-K449 PolarHBondContact O-N 3.05Å; K449-K451 VanDerWaalsContact C-N 3.29Å; K449-K451 PolarHBondContact O-N 3.33Å; K449-M452 WeakPolarHBondContact O-CB 3.31Å; K449-M452 PolarHBondContact O-N 2.95Å; K449-E453 WeakPolarHBondContact CE-OE1 3.15Å; K449-E453 IonicContact NZ-OE1 2.97Å; K449-E453 PolarHBondContact NZ-OE1 3.07Å; K449-E453 IonicContact NZ-OE2 3.2Å; K449-E453 PolarHBondContact O-N 3.35Å
450	D	97.2	Very high	95.9	Very high	69 Å²	69	99.2 Å²	99.2	37%	0.369	49%	0.485	S	S	.	.	H	α-helix	trans	-60.2	-40.8	-178	-60.7	-11.5	0	0	0	110.8	Q446 E453 H454	Q446-D450 WeakPolarHBondContact O-CB 3.49Å; Q446-D450 PolarHBondContact O-N 2.97Å; D450-E453 PolarHBondContact O-N 3.03Å; D450-H454 WeakPolarHBondContact O-CB 3.3Å; D450-H454 PolarHBondContact O-CD2 2.72Å; D450-H454 PolarHBondContact O-N 2.89Å
451	K	97	Very high	96	Very high	113 Å²	113	101.9 Å²	101.9	49%	0.491	49%	0.491	S	S	.	.	H	α-helix	trans	-61.8	-42.6	173.7	-179.3	-176	175	-169.4	0	112.5	L447 Q448 K449 Q455	L447-K451 WeakPolarHBondContact O-CB 3.42Å; L447-K451 PolarHBondContact O-N 2.84Å; Q448-K451 PolarHBondContact O-N 3.06Å; K449-K451 VanDerWaalsContact C-N 3.29Å; K449-K451 PolarHBondContact O-N 3.33Å; K451-Q455 WeakPolarHBondContact O-CB 3.43Å; K451-Q455 WeakPolarHBondContact O-CG 3.39Å; K451-Q455 PolarHBondContact O-N 3.2Å
452	M	92.8	Very high	96	Very high	82 Å²	82	101.2 Å²	101.2	40%	0.404	49%	0.485	S	S	.	.	H	α-helix	trans	-66.8	-44.1	175.8	-70.7	-60.9	-59.3	0	0	111.3	Q448 K449 H454 Q455 F456	Q448-M452 VanDerWaalsContact O-CG 3.29Å; Q448-M452 WeakPolarHBondContact O-CG 3.38Å; Q448-M452 PolarHBondContact O-N 3.15Å; K449-M452 WeakPolarHBondContact O-CB 3.31Å; K449-M452 PolarHBondContact O-N 2.95Å; M452-H454 PolarHBondContact O-N 3.4Å; M452-Q455 PolarHBondContact O-N 2.91Å; M452-Q455 VanDerWaalsContact O-N 3.14Å; M452-F456 HydrophobicContact CB-CD2 4.45Å; M452-F456 HydrophobicContact CB-CE2 4.25Å; M452-F456 HydrophobicContact CE-CE2 3.68Å; M452-F456 HydrophobicContact CE-CZ 3.72Å; M452-F456 WeakPolarHBondContact O-CD2 3.46Å; M452-F456 PolarHBondContact O-N 3.07Å
453	E	96.7	Very high	95.9	Very high	104 Å²	104	103.1 Å²	103.1	49%	0.486	49%	0.488	S	S	.	.	H	α-helix	trans	-61.6	-41.4	175.6	-72.1	-174.6	171.1	0	0	111.6	K449 D450 A457	K449-E453 WeakPolarHBondContact CE-OE1 3.15Å; K449-E453 IonicContact NZ-OE1 2.97Å; K449-E453 PolarHBondContact NZ-OE1 3.07Å; K449-E453 IonicContact NZ-OE2 3.2Å; K449-E453 PolarHBondContact O-N 3.35Å; D450-E453 PolarHBondContact O-N 3.03Å; E453-A457 WeakPolarHBondContact O-CB 3.48Å; E453-A457 PolarHBondContact O-N 2.78Å
454	H	95.6	Very high	95.8	Very high	141 Å²	141	103 Å²	103	65%	0.653	49%	0.49	S	S	*	.	H	α-helix	trans	-61.6	-40.8	171.5	-83.7	-63.5	0	0	0	112.6	D450 M452 H458	D450-H454 WeakPolarHBondContact O-CB 3.3Å; D450-H454 PolarHBondContact O-CD2 2.72Å; D450-H454 PolarHBondContact O-N 2.89Å; M452-H454 PolarHBondContact O-N 3.4Å; H454-H458 WeakPolarHBondContact O-CB 3.45Å; H454-H458 PolarHBondContact O-N 2.99Å
455	Q	95.2	Very high	95.8	Very high	91 Å²	91	101.3 Å²	101.3	43%	0.425	49%	0.489	S	S	.	.	H	α-helix	trans	-67.1	-47.4	177.2	-77.1	-179.4	-15.1	0	0	112.3	K451 M452 A457 H458 Q459	K451-Q455 WeakPolarHBondContact O-CB 3.43Å; K451-Q455 WeakPolarHBondContact O-CG 3.39Å; K451-Q455 PolarHBondContact O-N 3.2Å; M452-Q455 PolarHBondContact O-N 2.91Å; M452-Q455 VanDerWaalsContact O-N 3.14Å; Q455-A457 PolarHBondContact O-N 3.42Å; Q455-H458 WeakPolarHBondContact O-CB 3.32Å; Q455-H458 PolarHBondContact O-N 2.74Å; Q455-Q459 WeakPolarHBondContact O-CG 2.82Å; Q455-Q459 PolarHBondContact O-N 3.47Å
456	F	92.5	Very high	95.7	Very high	125 Å²	125	100.8 Å²	100.8	55%	0.548	48%	0.482	S	S	.	.	H	α-helix	trans	-61.8	-42.6	175.3	-70.8	-56.1	0	0	0	111.8	M452 H458 Q459 L460	M452-F456 HydrophobicContact CB-CD2 4.45Å; M452-F456 HydrophobicContact CB-CE2 4.25Å; M452-F456 HydrophobicContact CE-CE2 3.68Å; M452-F456 HydrophobicContact CE-CZ 3.72Å; M452-F456 WeakPolarHBondContact O-CD2 3.46Å; M452-F456 PolarHBondContact O-N 3.07Å; F456-H458 VanDerWaalsContact C-N 3.29Å; F456-H458 PolarHBondContact O-N 2.9Å; F456-Q459 PolarHBondContact O-N 2.88Å; F456-L460 WeakPolarHBondContact O-CB 3.48Å; F456-L460 PolarHBondContact O-N 2.87Å
457	A	97.3	Very high	95.6	Very high	33 Å²	33	100.7 Å²	100.7	27%	0.273	48%	0.481	S	S	.	.	H	α-helix	trans	-71.6	-22.1	177.3	0	0	0	0	0	112.9	E453 Q455 R461	E453-A457 WeakPolarHBondContact O-CB 3.48Å; E453-A457 PolarHBondContact O-N 2.78Å; Q455-A457 PolarHBondContact O-N 3.42Å; A457-R461 VanDerWaalsContact CB-NH1 3.34Å; A457-R461 VanDerWaalsContact O-CG 3.23Å; A457-R461 WeakPolarHBondContact O-CG 3.45Å; A457-R461 PolarHBondContact O-N 3.42Å; A457-R461 PolarHBondContact O-NH1 3.25Å
458	H	95.4	Very high	95.5	Very high	110 Å²	110	103.7 Å²	103.7	51%	0.509	49%	0.486	S	S	.	.	H	α-helix	trans	-71.3	-54.6	169.4	-169.4	-80.1	0	0	0	110	H454 Q455 F456 L460 R461 E462	H454-H458 WeakPolarHBondContact O-CB 3.45Å; H454-H458 PolarHBondContact O-N 2.99Å; Q455-H458 WeakPolarHBondContact O-CB 3.32Å; Q455-H458 PolarHBondContact O-N 2.74Å; F456-H458 VanDerWaalsContact C-N 3.29Å; F456-H458 PolarHBondContact O-N 2.9Å; H458-L460 VanDerWaalsContact C-N 3.34Å; H458-L460 PolarHBondContact O-N 3.01Å; H458-R461 WeakPolarHBondContact O-CA 3.4Å; H458-R461 WeakPolarHBondContact O-CB 3.1Å; H458-R461 PolarHBondContact O-N 3.33Å; H458-E462 IonicContact CE1-OE1 2.83Å; H458-E462 PolarHBondContact CE1-OE1 2.89Å; H458-E462 IonicContact CE1-OE2 3.73Å; H458-E462 PolarHBondContact CE1-OE2 3.43Å; H458-E462 IonicContact CG-OE2 3.64Å; H458-E462 IonicContact ND1-OE1 2.63Å; H458-E462 IonicContact ND1-OE2 2.6Å; H458-E462 PolarHBondContact ND1-OE2 3.19Å; H458-E462 PolarHBondContact O-N 3.4Å
459	Q	96.1	Very high	95.5	Very high	103 Å²	103	103.2 Å²	103.2	48%	0.481	49%	0.49	S	S	.	.	H	α-helix	trans	-55.7	-45.9	178.7	-70.2	170.4	-6.6	0	0	112	Q455 F456 R461 E462 E463	Q455-Q459 WeakPolarHBondContact O-CG 2.82Å; Q455-Q459 PolarHBondContact O-N 3.47Å; F456-Q459 PolarHBondContact O-N 2.88Å; Q459-R461 VanDerWaalsContact C-N 3.3Å; Q459-R461 PolarHBondContact O-N 3.26Å; Q459-E462 WeakPolarHBondContact O-CB 3.19Å; Q459-E462 PolarHBondContact O-N 3.11Å; Q459-E462 VanDerWaalsContact O-N 3.11Å; Q459-E463 WeakPolarHBondContact O-CG 3.28Å; Q459-E463 PolarHBondContact O-N 3.35Å
460	L	95.8	Very high	95.5	Very high	113 Å²	113	100.4 Å²	100.4	59%	0.592	49%	0.488	S	S	*	.	H	α-helix	trans	-61.8	-36	177.1	-177.2	61.5	0	0	0	112.6	F456 H458 L464	F456-L460 WeakPolarHBondContact O-CB 3.48Å; F456-L460 PolarHBondContact O-N 2.87Å; H458-L460 VanDerWaalsContact C-N 3.34Å; H458-L460 PolarHBondContact O-N 3.01Å; L460-L464 HydrophobicContact CD1-CD1 4.26Å; L460-L464 HydrophobicContact CD1-CG 4.41Å; L460-L464 HydrophobicContact CG-CD1 4.08Å; L460-L464 VanDerWaalsContact O-CB 3.28Å; L460-L464 WeakPolarHBondContact O-CB 3.23Å; L460-L464 WeakPolarHBondContact O-CD1 3.22Å; L460-L464 WeakPolarHBondContact O-CG 3.36Å; L460-L464 PolarHBondContact O-N 2.89Å
461	R	97.4	Very high	95.2	Very high	166 Å²	166	103.5 Å²	103.5	63%	0.626	50%	0.498	S	S	*	.	H	α-helix	trans	-70.9	-36.5	173.5	-73.1	176.8	-168.8	103.1	-7.8	112	A457 H458 Q459 A465	A457-R461 VanDerWaalsContact CB-NH1 3.34Å; A457-R461 VanDerWaalsContact O-CG 3.23Å; A457-R461 WeakPolarHBondContact O-CG 3.45Å; A457-R461 PolarHBondContact O-N 3.42Å; A457-R461 PolarHBondContact O-NH1 3.25Å; H458-R461 WeakPolarHBondContact O-CA 3.4Å; H458-R461 WeakPolarHBondContact O-CB 3.1Å; H458-R461 PolarHBondContact O-N 3.33Å; Q459-R461 VanDerWaalsContact C-N 3.3Å; Q459-R461 PolarHBondContact O-N 3.26Å; R461-A465 VanDerWaalsContact O-CB 3.22Å; R461-A465 WeakPolarHBondContact O-CB 3.34Å; R461-A465 PolarHBondContact O-N 3.06Å
462	E	95.9	Very high	95.2	Very high	88 Å²	88	103.2 Å²	103.2	41%	0.411	50%	0.499	S	S	.	.	H	α-helix	trans	-64.3	-47.6	175.7	-71.2	175.6	113	0	0	111.7	H458 Q459 A465 K466	H458-E462 IonicContact CE1-OE1 2.83Å; H458-E462 PolarHBondContact CE1-OE1 2.89Å; H458-E462 IonicContact CE1-OE2 3.73Å; H458-E462 PolarHBondContact CE1-OE2 3.43Å; H458-E462 IonicContact CG-OE2 3.64Å; H458-E462 IonicContact ND1-OE1 2.63Å; H458-E462 IonicContact ND1-OE2 2.6Å; H458-E462 PolarHBondContact ND1-OE2 3.19Å; H458-E462 PolarHBondContact O-N 3.4Å; Q459-E462 WeakPolarHBondContact O-CB 3.19Å; Q459-E462 PolarHBondContact O-N 3.11Å; Q459-E462 VanDerWaalsContact O-N 3.11Å; E462-A465 PolarHBondContact O-N 2.9Å; E462-K466 WeakPolarHBondContact O-CG 3.43Å; E462-K466 PolarHBondContact O-N 3Å
463	E	94.7	Very high	95.3	Very high	96 Å²	96	102.3 Å²	102.3	45%	0.449	50%	0.504	S	S	.	.	H	α-helix	trans	-65	-44.5	176.4	-56.5	-44.9	140.7	0	0	111.6	Q459 A465 K466 E467	Q459-E463 WeakPolarHBondContact O-CG 3.28Å; Q459-E463 PolarHBondContact O-N 3.35Å; E463-A465 PolarHBondContact O-N 2.71Å; E463-K466 PolarHBondContact O-N 3.18Å; E463-K466 IonicContact OE1-NZ 2.72Å; E463-K466 PolarHBondContact OE1-NZ 2.93Å; E463-K466 WeakPolarHBondContact OE2-CD 3.37Å; E463-K466 WeakPolarHBondContact OE2-CE 3.5Å; E463-K466 IonicContact OE2-NZ 2.65Å; E463-K466 PolarHBondContact OE2-NZ 2.94Å; E463-E467 PolarHBondContact O-N 2.97Å
464	L	95.6	Very high	95.2	Very high	93 Å²	93	99.3 Å²	99.3	49%	0.487	50%	0.497	S	S	.	.	H	α-helix	trans	-61.3	-29.9	174.5	-74.7	171.8	0	0	0	113.1	L460 R468	L460-L464 HydrophobicContact CD1-CD1 4.26Å; L460-L464 HydrophobicContact CD1-CG 4.41Å; L460-L464 HydrophobicContact CG-CD1 4.08Å; L460-L464 VanDerWaalsContact O-CB 3.28Å; L460-L464 WeakPolarHBondContact O-CB 3.23Å; L460-L464 WeakPolarHBondContact O-CD1 3.22Å; L460-L464 WeakPolarHBondContact O-CG 3.36Å; L460-L464 PolarHBondContact O-N 2.89Å; L464-R468 WeakPolarHBondContact O-CB 3.41Å; L464-R468 WeakPolarHBondContact O-CD 3.41Å; L464-R468 WeakPolarHBondContact O-CG 3.23Å; L464-R468 PolarHBondContact O-N 3.34Å; L464-R468 VanDerWaalsContact O-N 3.12Å
465	A	95	Very high	95.2	Very high	49 Å²	49	97.3 Å²	97.3	41%	0.405	49%	0.491	S	S	.	.	H	α-helix	trans	-73.9	-41.1	174.8	0	0	0	0	0	112	R461 E462 E463 R468 V469	R461-A465 VanDerWaalsContact O-CB 3.22Å; R461-A465 WeakPolarHBondContact O-CB 3.34Å; R461-A465 PolarHBondContact O-N 3.06Å; E462-A465 PolarHBondContact O-N 2.9Å; E463-A465 PolarHBondContact O-N 2.71Å; A465-R468 PolarHBondContact O-N 2.64Å; A465-V469 WeakPolarHBondContact O-CG2 3.49Å; A465-V469 PolarHBondContact O-N 3.37Å
466	K	95	Very high	95.3	Very high	115 Å²	115	97.6 Å²	97.6	50%	0.5	49%	0.494	S	S	.	.	H	α-helix	trans	-59.9	-48	174.6	-67.6	172.2	-144.6	169	0	111.3	E462 E463 V469 A470	E462-K466 WeakPolarHBondContact O-CG 3.43Å; E462-K466 PolarHBondContact O-N 3Å; E463-K466 PolarHBondContact O-N 3.18Å; E463-K466 IonicContact OE1-NZ 2.72Å; E463-K466 PolarHBondContact OE1-NZ 2.93Å; E463-K466 WeakPolarHBondContact OE2-CD 3.37Å; E463-K466 WeakPolarHBondContact OE2-CE 3.5Å; E463-K466 IonicContact OE2-NZ 2.65Å; E463-K466 PolarHBondContact OE2-NZ 2.94Å; K466-V469 PolarHBondContact O-N 3.12Å; K466-A470 WeakPolarHBondContact O-CB 3.38Å; K466-A470 PolarHBondContact O-N 3.31Å
467	E	92.7	Very high	95.4	Very high	107 Å²	107	93.1 Å²	93.1	50%	0.5	48%	0.483	S	S	.	.	H	α-helix	trans	-60.3	-46.4	176.9	-71.3	-60.7	146.4	0	0	111.4	E463 V469 A470 F471	E463-E467 PolarHBondContact O-N 2.97Å; E467-V469 PolarHBondContact O-N 2.95Å; E467-A470 WeakPolarHBondContact O-CB 3.32Å; E467-A470 PolarHBondContact O-N 3.43Å; E467-A470 VanDerWaalsContact O-N 3.15Å; E467-F471 HydrophobicContact CB-CD2 4.45Å; E467-F471 HydrophobicContact CB-CE2 4.2Å; E467-F471 WeakPolarHBondContact O-CD2 3.38Å; E467-F471 PolarHBondContact O-N 3.18Å
468	R	95.2	Very high	95.2	Very high	159 Å²	159	99 Å²	99	60%	0.6	50%	0.499	S	S	*	.	H	α-helix	trans	-56.8	-48.2	175.4	-78.3	169.1	-179.7	-79.6	-3.2	112.7	L464 A465 A470 F471 E472	L464-R468 WeakPolarHBondContact O-CB 3.41Å; L464-R468 WeakPolarHBondContact O-CD 3.41Å; L464-R468 WeakPolarHBondContact O-CG 3.23Å; L464-R468 PolarHBondContact O-N 3.34Å; L464-R468 VanDerWaalsContact O-N 3.12Å; A465-R468 PolarHBondContact O-N 2.64Å; R468-A470 VanDerWaalsContact C-N 3.29Å; R468-A470 PolarHBondContact O-N 3.23Å; R468-F471 PolarHBondContact O-N 3.39Å; R468-E472 WeakPolarHBondContact O-CB 3.5Å; R468-E472 WeakPolarHBondContact O-CG 3.5Å; R468-E472 PolarHBondContact O-N 2.84Å
469	V	95.8	Very high	95.2	Very high	95 Å²	95	98 Å²	98	58%	0.576	50%	0.501	S	S	*	.	H	α-helix	trans	-62.8	-35.9	177.6	171.5	0	0	0	0	111.5	A465 K466 E467 A473	A465-V469 WeakPolarHBondContact O-CG2 3.49Å; A465-V469 PolarHBondContact O-N 3.37Å; K466-V469 PolarHBondContact O-N 3.12Å; E467-V469 PolarHBondContact O-N 2.95Å; V469-A473 VanDerWaalsContact O-CB 3.23Å; V469-A473 WeakPolarHBondContact O-CB 3.18Å; V469-A473 PolarHBondContact O-N 3.01Å
470	A	95.6	Very high	95.1	Very high	56 Å²	56	99.4 Å²	99.4	46%	0.463	51%	0.505	S	S	.	.	H	α-helix	trans	-66.4	-43.8	174.3	0	0	0	0	0	112.4	K466 E467 R468 A474	K466-A470 WeakPolarHBondContact O-CB 3.38Å; K466-A470 PolarHBondContact O-N 3.31Å; E467-A470 WeakPolarHBondContact O-CB 3.32Å; E467-A470 PolarHBondContact O-N 3.43Å; E467-A470 VanDerWaalsContact O-N 3.15Å; R468-A470 VanDerWaalsContact C-N 3.29Å; R468-A470 PolarHBondContact O-N 3.23Å; A470-A474 WeakPolarHBondContact O-CB 3.41Å; A470-A474 PolarHBondContact O-N 3.39Å
471	F	92	Very high	95.1	Very high	134 Å²	134	101 Å²	101	59%	0.588	50%	0.503	S	S	*	.	H	α-helix	trans	-66.4	-41.7	175.3	-71.5	-60.9	0	0	0	112.5	E467 R468 A474 L475	E467-F471 HydrophobicContact CB-CD2 4.45Å; E467-F471 HydrophobicContact CB-CE2 4.2Å; E467-F471 WeakPolarHBondContact O-CD2 3.38Å; E467-F471 PolarHBondContact O-N 3.18Å; R468-F471 PolarHBondContact O-N 3.39Å; F471-A474 PolarHBondContact O-N 2.97Å; F471-L475 WeakPolarHBondContact O-CB 3.46Å; F471-L475 WeakPolarHBondContact O-CG 3.3Å; F471-L475 PolarHBondContact O-N 3Å
472	E	96.2	Very high	94.9	Very high	108 Å²	108	98.7 Å²	98.7	51%	0.505	50%	0.501	S	S	.	.	H	α-helix	trans	-64	-42.8	176.1	-73.5	167.3	-157.8	0	0	111.5	R468 A474 L475 I476	R468-E472 WeakPolarHBondContact O-CB 3.5Å; R468-E472 WeakPolarHBondContact O-CG 3.5Å; R468-E472 PolarHBondContact O-N 2.84Å; E472-A474 VanDerWaalsContact C-N 3.35Å; E472-A474 PolarHBondContact O-N 3.44Å; E472-L475 PolarHBondContact O-N 2.93Å; E472-I476 VanDerWaalsContact O-CG1 3.3Å; E472-I476 WeakPolarHBondContact O-CG1 3.38Å; E472-I476 PolarHBondContact O-N 3.34Å
473	A	95	Very high	94.9	Very high	62 Å²	62	99.7 Å²	99.7	51%	0.512	51%	0.506	S	S	.	.	H	α-helix	trans	-63.7	-38.5	173.6	0	0	0	0	0	112.5	V469 G477	V469-A473 VanDerWaalsContact O-CB 3.23Å; V469-A473 WeakPolarHBondContact O-CB 3.18Å; V469-A473 PolarHBondContact O-N 3.01Å; A473-G477 PolarHBondContact O-N 2.89Å
474	A	95.6	Very high	94.8	Very high	41 Å²	41	97.5 Å²	97.5	34%	0.339	50%	0.504	S	S	.	.	H	α-helix	trans	-64	-46.4	174.2	0	0	0	0	0	111.5	A470 F471 E472 G477 W478	A470-A474 WeakPolarHBondContact O-CB 3.41Å; A470-A474 PolarHBondContact O-N 3.39Å; F471-A474 PolarHBondContact O-N 2.97Å; E472-A474 VanDerWaalsContact C-N 3.35Å; E472-A474 PolarHBondContact O-N 3.44Å; A474-G477 CarbonylContact O-C 3.53Å; A474-G477 WeakPolarHBondContact O-CA 3.35Å; A474-G477 PolarHBondContact O-N 3.15Å; A474-W478 PolarHBondContact O-N 3.23Å
475	L	96	Very high	94.7	Very high	100 Å²	100	97.8 Å²	97.8	52%	0.524	51%	0.505	S	S	.	.	H	α-helix	trans	-59.6	-49.1	176.4	-74.1	171.3	0	0	0	111.7	F471 E472 G477 W478 T479	F471-L475 WeakPolarHBondContact O-CB 3.46Å; F471-L475 WeakPolarHBondContact O-CG 3.3Å; F471-L475 PolarHBondContact O-N 3Å; E472-L475 PolarHBondContact O-N 2.93Å; L475-G477 VanDerWaalsContact C-N 3.26Å; L475-G477 PolarHBondContact O-N 2.94Å; L475-W478 HydrophobicContact CD2-CE3 4.48Å; L475-W478 CarbonylContact O-C 3.58Å; L475-W478 WeakPolarHBondContact O-CA 3.4Å; L475-W478 WeakPolarHBondContact O-CB 3.26Å; L475-W478 PolarHBondContact O-N 3.06Å; L475-T479 PolarHBondContact O-N 3.45Å; L475-T479 PolarHBondContact O-OG1 2.83Å; L475-T479 VanDerWaalsContact O-OG1 3.08Å
476	I	95.5	Very high	94.6	Very high	96 Å²	96	101 Å²	101	49%	0.492	51%	0.512	S	S	.	.	H	α-helix	trans	-59.4	-39	175.8	-66.6	163.6	0	0	0	110.9	E472 W478 T479 K480	E472-I476 VanDerWaalsContact O-CG1 3.3Å; E472-I476 WeakPolarHBondContact O-CG1 3.38Å; E472-I476 PolarHBondContact O-N 3.34Å; I476-W478 PolarHBondContact O-N 2.87Å; I476-T479 PolarHBondContact O-N 3.49Å; I476-K480 HydrophobicContact CG2-CD 4.31Å; I476-K480 WeakPolarHBondContact O-CB 3.04Å; I476-K480 WeakPolarHBondContact O-CG 3.42Å; I476-K480 PolarHBondContact O-N 3.28Å
477	G	94.6	Very high	94.5	Very high	31 Å²	31	101 Å²	101	32%	0.32	52%	0.517	S	S	.	.	H	α-helix	trans	-68.6	-17.9	173.8	0	0	0	0	0	114.6	A473 A474 L475 R481	A473-G477 PolarHBondContact O-N 2.89Å; A474-G477 CarbonylContact O-C 3.53Å; A474-G477 WeakPolarHBondContact O-CA 3.35Å; A474-G477 PolarHBondContact O-N 3.15Å; L475-G477 VanDerWaalsContact C-N 3.26Å; L475-G477 PolarHBondContact O-N 2.94Å; G477-R481 PolarHBondContact O-NE 3.08Å
478	W	94.2	Very high	94.4	Very high	157 Å²	157	100.8 Å²	100.8	60%	0.595	52%	0.523	S	S	*	.	H	α-helix	trans	-88.2	-44.2	171.8	-65.6	13.1	0	0	0	110.3	A474 L475 I476 K480 R481 M482	A474-W478 PolarHBondContact O-N 3.23Å; L475-W478 HydrophobicContact CD2-CE3 4.48Å; L475-W478 CarbonylContact O-C 3.58Å; L475-W478 WeakPolarHBondContact O-CA 3.4Å; L475-W478 WeakPolarHBondContact O-CB 3.26Å; L475-W478 PolarHBondContact O-N 3.06Å; I476-W478 PolarHBondContact O-N 2.87Å; W478-K480 PolarHBondContact O-N 2.92Å; W478-R481 CarbonylContact O-C 3.58Å; W478-R481 WeakPolarHBondContact O-CA 3.38Å; W478-R481 PolarHBondContact O-N 2.94Å; W478-M482 PolarHBondContact O-N 3.11Å
479	T	96.1	Very high	94.3	Very high	90 Å²	90	97.2 Å²	97.2	55%	0.552	52%	0.519	S	S	*	.	H	α-helix	trans	-56.7	-48.6	175.4	-49.8	0	0	0	0	111.3	L475 I476 R481 M482 E483	L475-T479 PolarHBondContact O-N 3.45Å; L475-T479 PolarHBondContact O-OG1 2.83Å; L475-T479 VanDerWaalsContact O-OG1 3.08Å; I476-T479 PolarHBondContact O-N 3.49Å; T479-R481 PolarHBondContact O-N 3.26Å; T479-M482 WeakPolarHBondContact O-CA 3.46Å; T479-M482 WeakPolarHBondContact O-CB 3.5Å; T479-M482 PolarHBondContact O-N 2.85Å; T479-E483 WeakPolarHBondContact O-CB 3.42Å; T479-E483 PolarHBondContact O-N 2.98Å
480	K	93.4	Very high	94.2	Very high	132 Å²	132	97.7 Å²	97.7	57%	0.574	52%	0.518	S	S	*	.	H	α-helix	trans	-63.7	-25.2	176.8	-71.8	-175.9	176.5	-170.7	0	114.2	I476 W478 A484	I476-K480 HydrophobicContact CG2-CD 4.31Å; I476-K480 WeakPolarHBondContact O-CB 3.04Å; I476-K480 WeakPolarHBondContact O-CG 3.42Å; I476-K480 PolarHBondContact O-N 3.28Å; W478-K480 PolarHBondContact O-N 2.92Å; K480-A484 VanDerWaalsContact O-CB 3.26Å; K480-A484 WeakPolarHBondContact O-CB 3.41Å; K480-A484 PolarHBondContact O-N 2.92Å; K480-A484 VanDerWaalsContact O-N 3.11Å
481	R	94.7	Very high	93.9	Very high	145 Å²	145	96.7 Å²	96.7	55%	0.547	51%	0.514	S	S	.	.	H	α-helix	trans	-80	-28.8	171.8	-81.8	-167.1	-78.5	97.8	-12	112.4	G477 W478 T479 I485	G477-R481 PolarHBondContact O-NE 3.08Å; W478-R481 CarbonylContact O-C 3.58Å; W478-R481 WeakPolarHBondContact O-CA 3.38Å; W478-R481 PolarHBondContact O-N 2.94Å; T479-R481 PolarHBondContact O-N 3.26Å; R481-I485 WeakPolarHBondContact O-CB 3.48Å; R481-I485 VanDerWaalsContact O-CD1 3.26Å; R481-I485 WeakPolarHBondContact O-CD1 3.46Å; R481-I485 WeakPolarHBondContact O-CG1 3.44Å; R481-I485 PolarHBondContact O-N 3.21Å
482	M	94.6	Very high	93.8	Very high	118 Å²	118	97 Å²	97	58%	0.581	51%	0.511	S	S	*	.	H	α-helix	trans	-70.6	-49.5	171.5	-169.1	68.9	-164.8	0	0	110.4	W478 T479 A484 I485 E486	W478-M482 PolarHBondContact O-N 3.11Å; T479-M482 WeakPolarHBondContact O-CA 3.46Å; T479-M482 WeakPolarHBondContact O-CB 3.5Å; T479-M482 PolarHBondContact O-N 2.85Å; M482-A484 PolarHBondContact O-N 3.32Å; M482-I485 CarbonylContact O-C 3.6Å; M482-I485 WeakPolarHBondContact O-CA 3.48Å; M482-I485 WeakPolarHBondContact O-CB 3.42Å; M482-I485 PolarHBondContact O-N 2.95Å; M482-E486 WeakPolarHBondContact O-CB 3.26Å; M482-E486 PolarHBondContact O-N 3.06Å
483	E	94.6	Very high	93.5	Very high	109 Å²	109	94.3 Å²	94.3	51%	0.509	51%	0.507	S	S	.	.	H	α-helix	trans	-52.1	-50.2	173.6	-176.2	179.1	-152.1	0	0	111.3	T479 I485 E486 D487	T479-E483 WeakPolarHBondContact O-CB 3.42Å; T479-E483 PolarHBondContact O-N 2.98Å; E483-I485 VanDerWaalsContact C-N 3.26Å; E483-I485 PolarHBondContact O-N 2.88Å; E483-E486 WeakPolarHBondContact O-CB 3.15Å; E483-E486 PolarHBondContact O-N 2.86Å; E483-E486 VanDerWaalsContact O-N 3.15Å; E483-D487 PolarHBondContact O-N 3.26Å
484	A	92.6	Very high	93.3	Very high	51 Å²	51	95.2 Å²	95.2	42%	0.421	50%	0.504	S	S	.	.	H	α-helix	trans	-70	-14.9	176	0	0	0	0	0	114.9	K480 M482 V488	K480-A484 VanDerWaalsContact O-CB 3.26Å; K480-A484 WeakPolarHBondContact O-CB 3.41Å; K480-A484 PolarHBondContact O-N 2.92Å; K480-A484 VanDerWaalsContact O-N 3.11Å; M482-A484 PolarHBondContact O-N 3.32Å; A484-V488 WeakPolarHBondContact O-CG2 3.47Å
485	I	94.5	Very high	92.9	Very high	99 Å²	99	94.9 Å²	94.9	51%	0.508	50%	0.496	S	S	.	.	H	α-helix	trans	-85	-38.6	169.4	-74.4	165.6	0	0	0	109.8	R481 M482 E483 V488 V489	R481-I485 WeakPolarHBondContact O-CB 3.48Å; R481-I485 VanDerWaalsContact O-CD1 3.26Å; R481-I485 WeakPolarHBondContact O-CD1 3.46Å; R481-I485 WeakPolarHBondContact O-CG1 3.44Å; R481-I485 PolarHBondContact O-N 3.21Å; M482-I485 CarbonylContact O-C 3.6Å; M482-I485 WeakPolarHBondContact O-CA 3.48Å; M482-I485 WeakPolarHBondContact O-CB 3.42Å; M482-I485 PolarHBondContact O-N 2.95Å; E483-I485 VanDerWaalsContact C-N 3.26Å; E483-I485 PolarHBondContact O-N 2.88Å; I485-V488 PolarHBondContact O-N 3.21Å; I485-V489 HydrophobicContact CG2-CG2 4.3Å; I485-V489 WeakPolarHBondContact O-CB 3.29Å; I485-V489 VanDerWaalsContact O-CG2 3.25Å; I485-V489 WeakPolarHBondContact O-CG2 3.2Å; I485-V489 PolarHBondContact O-N 3.07Å
486	E	93.1	Very high	92.6	Very high	116 Å²	116	92.3 Å²	92.3	54%	0.542	48%	0.482	S	S	.	.	H	α-helix	trans	-62.2	-52.1	176.3	-164.6	165.3	-175	0	0	110.6	M482 E483 V488 V489 D490	M482-E486 WeakPolarHBondContact O-CB 3.26Å; M482-E486 PolarHBondContact O-N 3.06Å; E483-E486 WeakPolarHBondContact O-CB 3.15Å; E483-E486 PolarHBondContact O-N 2.86Å; E483-E486 VanDerWaalsContact O-N 3.15Å; E486-V488 VanDerWaalsContact C-N 3.25Å; E486-V488 PolarHBondContact O-N 3.41Å; E486-V489 PolarHBondContact O-N 3.15Å; E486-D490 PolarHBondContact O-N 2.82Å
487	D	92.5	Very high	92.3	Very high	115 Å²	115	93.9 Å²	93.9	62%	0.615	48%	0.482	S	S	*	.	H	α-helix	trans	-51.2	-42.2	172.1	-81.4	-23.2	0	0	0	112.7	E483 G491	E483-D487 PolarHBondContact O-N 3.26Å; D487-G491 PolarHBondContact O-N 2.94Å
488	V	91.6	Very high	91.9	Very high	102 Å²	102	94.2 Å²	94.2	62%	0.618	48%	0.476	S	S	*	.	H	α-helix	trans	-76.4	-32.2	-178.6	167.5	0	0	0	0	111.8	A484 I485 E486 R492	A484-V488 WeakPolarHBondContact O-CG2 3.47Å; I485-V488 PolarHBondContact O-N 3.21Å; E486-V488 VanDerWaalsContact C-N 3.25Å; E486-V488 PolarHBondContact O-N 3.41Å; V488-R492 WeakPolarHBondContact O-CB 3.18Å; V488-R492 PolarHBondContact O-N 2.96Å
489	V	93	Very high	91.6	Very high	84 Å²	84	86.7 Å²	86.7	51%	0.509	45%	0.448	S	S	.	.	H	α-helix	trans	-71.9	-44.4	174.8	165.1	0	0	0	0	110.8	I485 E486 R492 A493	I485-V489 HydrophobicContact CG2-CG2 4.3Å; I485-V489 WeakPolarHBondContact O-CB 3.29Å; I485-V489 VanDerWaalsContact O-CG2 3.25Å; I485-V489 WeakPolarHBondContact O-CG2 3.2Å; I485-V489 PolarHBondContact O-N 3.07Å; E486-V489 PolarHBondContact O-N 3.15Å; V489-R492 CarbonylContact O-C 3.58Å; V489-R492 WeakPolarHBondContact O-CB 3.46Å; V489-R492 PolarHBondContact O-N 3.06Å; V489-A493 WeakPolarHBondContact O-CB 3.39Å; V489-A493 PolarHBondContact O-N 3.11Å
490	D	92.4	Very high	91.2	Very high	105 Å²	105	89.2 Å²	89.2	56%	0.561	45%	0.451	S	S	*	.	H	α-helix	trans	-68.2	-44.6	177.5	-81.7	0.3	0	0	0	111.5	E486 R492 A493 D494	E486-D490 PolarHBondContact O-N 2.82Å; D490-R492 PolarHBondContact O-N 2.69Å; D490-A493 WeakPolarHBondContact O-CB 3.25Å; D490-A493 PolarHBondContact O-N 2.98Å; D490-D494 PolarHBondContact O-N 3.2Å
491	G	89.4	Confident	90.9	Very high	36 Å²	36	84.1 Å²	84.1	37%	0.371	43%	0.43	S	S	.	.	H	α-helix	trans	-58.3	-35.1	172.1	0	0	0	0	0	112.8	D487 L495	D487-G491 PolarHBondContact O-N 2.94Å; G491-L495 VanDerWaalsContact O-CG 3.29Å; G491-L495 WeakPolarHBondContact O-CG 3.2Å; G491-L495 PolarHBondContact O-N 3.46Å
492	R	90.4	Very high	90.5	Very high	139 Å²	139	77.2 Å²	77.2	53%	0.525	40%	0.404	S	S	.	.	H	α-helix	trans	-71.4	-40.1	172.5	-172.2	-178.4	-170.8	96.7	3.8	112.3	V488 V489 D490 D494 L495 D496	V488-R492 WeakPolarHBondContact O-CB 3.18Å; V488-R492 PolarHBondContact O-N 2.96Å; V489-R492 CarbonylContact O-C 3.58Å; V489-R492 WeakPolarHBondContact O-CB 3.46Å; V489-R492 PolarHBondContact O-N 3.06Å; D490-R492 PolarHBondContact O-N 2.69Å; R492-D494 VanDerWaalsContact C-N 3.32Å; R492-D494 PolarHBondContact O-N 3.26Å; R492-L495 PolarHBondContact O-N 2.83Å; R492-D496 WeakPolarHBondContact O-CB 3.27Å; R492-D496 PolarHBondContact O-N 2.85Å
493	A	90.5	Very high	90.2	Very high	53 Å²	53	75.7 Å²	75.7	44%	0.438	40%	0.395	S	S	.	.	H	α-helix	trans	-62.1	-39.8	177.8	0	0	0	0	0	111.7	V489 D490 D496 R497	V489-A493 WeakPolarHBondContact O-CB 3.39Å; V489-A493 PolarHBondContact O-N 3.11Å; D490-A493 WeakPolarHBondContact O-CB 3.25Å; D490-A493 PolarHBondContact O-N 2.98Å; A493-D496 PolarHBondContact O-N 3.28Å; A493-R497 WeakPolarHBondContact O-CB 3.35Å; A493-R497 PolarHBondContact O-N 2.99Å
494	D	89.4	Confident	90	Very high	81 Å²	81	72.8 Å²	72.8	43%	0.433	39%	0.387	S	S	.	.	H	α-helix	trans	-69.6	-38.6	175.7	-116	-6.8	0	0	0	112.5	D490 R492 R497 L498	D490-D494 PolarHBondContact O-N 3.2Å; R492-D494 VanDerWaalsContact C-N 3.32Å; R492-D494 PolarHBondContact O-N 3.26Å; D494-R497 WeakPolarHBondContact O-CB 3.47Å; D494-R497 PolarHBondContact O-N 3.08Å; D494-R497 IonicContact OD1-CZ 3.24Å; D494-R497 VanDerWaalsContact OD1-CZ 3.26Å; D494-R497 IonicContact OD1-NE 2.66Å; D494-R497 PolarHBondContact OD1-NE 3.05Å; D494-R497 IonicContact OD1-NH2 2.96Å; D494-R497 PolarHBondContact OD1-NH2 3.44Å; D494-R497 IonicContact OD2-NH2 2.68Å; D494-L498 WeakPolarHBondContact O-CG 3.48Å; D494-L498 PolarHBondContact O-N 3.2Å
495	L	88.7	Confident	89.9	Confident	33 Å²	33	70.4 Å²	70.4	17%	0.173	37%	0.367	C	S	.	.	H	α-helix	trans	-65.2	-37.8	171.7	-72.3	170	0	0	0	112.4	G491 R492 R497 L498 A499 K744 R745	G491-L495 VanDerWaalsContact O-CG 3.29Å; G491-L495 WeakPolarHBondContact O-CG 3.2Å; G491-L495 PolarHBondContact O-N 3.46Å; R492-L495 PolarHBondContact O-N 2.83Å; L495-R497 VanDerWaalsContact C-N 3.34Å; L495-L498 PolarHBondContact O-N 2.85Å; L495-A499 VanDerWaalsContact O-CB 3.32Å; L495-A499 WeakPolarHBondContact O-CB 3.37Å; L495-A499 PolarHBondContact O-N 3.33Å; L495-K744 HydrophobicContact CD1-CB 4.15Å; L495-K744 WeakPolarHBondContact CD1-O 3.34Å; L495-K744 HydrophobicContact CD2-CB 3.62Å; L495-K744 HydrophobicContact CD2-CD 4.04Å; L495-R745 HydrophobicContact CB-CG 3.98Å; L495-R745 HydrophobicContact CD1-CG 4.17Å
496	D	88.7	Confident	89.7	Confident	46 Å²	46	70.6 Å²	70.6	25%	0.246	36%	0.361	C	S	.	.	H	α-helix	trans	-71.2	-28.4	175.7	-75.5	-10.1	0	0	0	112.2	R492 A493 K500 R745	R492-D496 WeakPolarHBondContact O-CB 3.27Å; R492-D496 PolarHBondContact O-N 2.85Å; A493-D496 PolarHBondContact O-N 3.28Å; D496-K500 WeakPolarHBondContact O-CD 3.32Å; D496-K500 VanDerWaalsContact O-CG 3.25Å; D496-K500 WeakPolarHBondContact O-CG 3.43Å; D496-K500 PolarHBondContact O-N 2.81Å; D496-K500 VanDerWaalsContact O-N 3.13Å; D496-R745 IonicContact OD1-CZ 2.72Å; D496-R745 IonicContact OD1-NE 2.65Å; D496-R745 PolarHBondContact OD1-NE 3.27Å; D496-R745 IonicContact OD1-NH2 3.08Å; D496-R745 PolarHBondContact OD1-NH2 3.08Å
497	R	88.9	Confident	89.6	Confident	129 Å²	129	70 Å²	70	49%	0.487	36%	0.362	S	S	.	.	H	α-helix	trans	-68	-52	168.4	179.6	170	67.3	108.8	-12.8	111.5	A493 D494 L495 A499 K500 E501	A493-R497 WeakPolarHBondContact O-CB 3.35Å; A493-R497 PolarHBondContact O-N 2.99Å; D494-R497 WeakPolarHBondContact O-CB 3.47Å; D494-R497 PolarHBondContact O-N 3.08Å; D494-R497 IonicContact OD1-CZ 3.24Å; D494-R497 VanDerWaalsContact OD1-CZ 3.26Å; D494-R497 IonicContact OD1-NE 2.66Å; D494-R497 PolarHBondContact OD1-NE 3.05Å; D494-R497 IonicContact OD1-NH2 2.96Å; D494-R497 PolarHBondContact OD1-NH2 3.44Å; D494-R497 IonicContact OD2-NH2 2.68Å; L495-R497 VanDerWaalsContact C-N 3.34Å; R497-A499 PolarHBondContact O-N 3.22Å; R497-K500 WeakPolarHBondContact O-CB 3.49Å; R497-K500 PolarHBondContact O-N 3.19Å; R497-E501 IonicContact NH1-OE1 3.86Å; R497-E501 PolarHBondContact O-N 3.48Å
498	L	87.1	Confident	89.5	Confident	38 Å²	38	65.5 Å²	65.5	20%	0.199	34%	0.339	C	S	.	.	H	α-helix	trans	-60.6	-33.2	178.4	-71.6	172.6	0	0	0	112.9	D494 L495 A502 T741	D494-L498 WeakPolarHBondContact O-CG 3.48Å; D494-L498 PolarHBondContact O-N 3.2Å; L495-L498 PolarHBondContact O-N 2.85Å; L498-A502 WeakPolarHBondContact O-CB 3.49Å; L498-A502 PolarHBondContact O-N 3.21Å; L498-T741 HydrophobicContact CB-CG2 4.47Å
499	A	86.9	Confident	89.3	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-73.3	-34.5	173.7	0	0	0	0	0	113	L495 R497 A502 Q503 R745	L495-A499 VanDerWaalsContact O-CB 3.32Å; L495-A499 WeakPolarHBondContact O-CB 3.37Å; L495-A499 PolarHBondContact O-N 3.33Å; R497-A499 PolarHBondContact O-N 3.22Å; A499-A502 PolarHBondContact O-N 2.74Å; A499-Q503 WeakPolarHBondContact O-CB 3.42Å; A499-Q503 VanDerWaalsContact O-CG 3.23Å; A499-Q503 WeakPolarHBondContact O-CG 3.37Å; A499-Q503 PolarHBondContact O-N 3.05Å; A499-R745 VanDerWaalsContact CB-NH2 3.29Å
500	K	88.2	Confident	89.1	Confident	142 Å²	142	59.6 Å²	59.6	62%	0.617	30%	0.299	S	S	*	.	H	α-helix	trans	-64.9	-42.1	171.7	-75.9	165.1	-177.2	171.5	0	111.5	D496 R497 Q503 S504	D496-K500 WeakPolarHBondContact O-CD 3.32Å; D496-K500 VanDerWaalsContact O-CG 3.25Å; D496-K500 WeakPolarHBondContact O-CG 3.43Å; D496-K500 PolarHBondContact O-N 2.81Å; D496-K500 VanDerWaalsContact O-N 3.13Å; R497-K500 WeakPolarHBondContact O-CB 3.49Å; R497-K500 PolarHBondContact O-N 3.19Å; K500-Q503 PolarHBondContact O-N 3.37Å; K500-S504 PolarHBondContact O-N 3.11Å; K500-S504 PolarHBondContact O-OG 3.28Å
501	E	86.6	Confident	88.9	Confident	26 Å²	26	56.5 Å²	56.5	12%	0.121	29%	0.288	C	S	.	.	H	α-helix	trans	-61.1	-42.7	173.8	-68.7	175.7	-154.4	0	0	111.8	R497 S504 L505 N557 Y558	R497-E501 IonicContact NH1-OE1 3.86Å; R497-E501 PolarHBondContact O-N 3.48Å; E501-S504 PolarHBondContact O-OG 2.89Å; E501-S504 VanDerWaalsContact O-OG 3.09Å; E501-L505 VanDerWaalsContact O-CB 3.26Å; E501-L505 WeakPolarHBondContact O-CB 3.38Å; E501-L505 PolarHBondContact O-N 3.16Å; E501-L505 VanDerWaalsContact O-N 3.12Å; E501-N557 PolarHBondContact OE2-ND2 3.28Å; E501-Y558 HydrophobicContact CB-CE2 4.39Å
502	A	86.8	Confident	88.8	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-66	-40.5	174.8	0	0	0	0	0	112.1	L498 A499 L505 W506 V734 R737 D738	L498-A502 WeakPolarHBondContact O-CB 3.49Å; L498-A502 PolarHBondContact O-N 3.21Å; A499-A502 PolarHBondContact O-N 2.74Å; A502-L505 WeakPolarHBondContact O-CB 3.41Å; A502-L505 PolarHBondContact O-N 3.32Å; A502-W506 WeakPolarHBondContact O-CB 3.46Å; A502-W506 PolarHBondContact O-N 2.98Å; A502-V734 VanDerWaalsContact O-CG1 3.23Å; A502-V734 WeakPolarHBondContact O-CG1 3.36Å; A502-R737 HydrophobicContact CB-CG 4.08Å; A502-D738 VanDerWaalsContact CB-OD1 3.23Å; A502-D738 WeakPolarHBondContact CB-OD1 3.42Å
503	Q	88.9	Confident	88.5	Confident	85 Å²	85	48.5 Å²	48.5	40%	0.397	25%	0.248	S	C	.	.	H	α-helix	trans	-68.4	-39.4	177.3	-75.7	175.3	-14.6	0	0	113.6	A499 K500 L505 W506 L507	A499-Q503 WeakPolarHBondContact O-CB 3.42Å; A499-Q503 VanDerWaalsContact O-CG 3.23Å; A499-Q503 WeakPolarHBondContact O-CG 3.37Å; A499-Q503 PolarHBondContact O-N 3.05Å; K500-Q503 PolarHBondContact O-N 3.37Å; Q503-L505 VanDerWaalsContact C-N 3.31Å; Q503-W506 PolarHBondContact O-N 3.38Å; Q503-L507 WeakPolarHBondContact O-CG 3.32Å; Q503-L507 PolarHBondContact O-N 3.17Å
504	S	90.5	Very high	88.2	Confident	49 Å²	49	49 Å²	49	34%	0.343	25%	0.248	S	C	.	.	H	α-helix	trans	-67.4	-35.9	174.6	57.9	0	0	0	0	111.8	K500 E501 S508	K500-S504 PolarHBondContact O-N 3.11Å; K500-S504 PolarHBondContact O-OG 3.28Å; E501-S504 PolarHBondContact O-OG 2.89Å; E501-S504 VanDerWaalsContact O-OG 3.09Å; S504-S508 WeakPolarHBondContact O-CB 3.47Å; S504-S508 PolarHBondContact O-N 3.47Å; S504-S508 VanDerWaalsContact O-N 3.1Å; S504-S508 PolarHBondContact O-OG 2.69Å
505	L	89.9	Confident	87.8	Confident	1 Å²	1	49.7 Å²	49.7	1%	0.005	24%	0.244	C	C	.	.	H	α-helix	trans	-66.5	-41.6	171.7	-176.2	63.3	0	0	0	111.4	E501 A502 Q503 S508 C509 I549 C552 T553 Y558 V561 V734	E501-L505 VanDerWaalsContact O-CB 3.26Å; E501-L505 WeakPolarHBondContact O-CB 3.38Å; E501-L505 PolarHBondContact O-N 3.16Å; E501-L505 VanDerWaalsContact O-N 3.12Å; A502-L505 WeakPolarHBondContact O-CB 3.41Å; A502-L505 PolarHBondContact O-N 3.32Å; Q503-L505 VanDerWaalsContact C-N 3.31Å; L505-S508 PolarHBondContact O-N 2.94Å; L505-C509 PolarHBondContact O-N 2.84Å; L505-C509 PolarHBondContact O-SG 3.3Å; L505-I549 HydrophobicContact CD1-CG2 3.79Å; L505-C552 HydrophobicContact CB-CB 4.35Å; L505-C552 HydrophobicContact CD1-CB 4.03Å; L505-T553 HydrophobicContact CD1-CG2 3.71Å; L505-T553 HydrophobicContact CD2-CG2 4.35Å; L505-Y558 HydrophobicContact CD2-CD1 4.16Å; L505-Y558 HydrophobicContact CD2-CD2 3.76Å; L505-Y558 HydrophobicContact CD2-CE1 4.38Å; L505-Y558 HydrophobicContact CD2-CE2 4.02Å; L505-Y558 HydrophobicContact CD2-CG 3.84Å; L505-V561 HydrophobicContact CD2-CG2 4.31Å; L505-V734 HydrophobicContact CD2-CG2 3.76Å; L505-V734 HydrophobicContact CG-CG2 3.74Å
506	W	91.1	Very high	87.4	Confident	102 Å²	102	48.2 Å²	48.2	39%	0.386	24%	0.236	S	C	.	.	H	α-helix	trans	-60.6	-50.3	175.9	-178.7	71.3	0	0	0	111.1	A502 Q503 S508 C509 E510 V734	A502-W506 WeakPolarHBondContact O-CB 3.46Å; A502-W506 PolarHBondContact O-N 2.98Å; Q503-W506 PolarHBondContact O-N 3.38Å; W506-S508 PolarHBondContact O-N 3.03Å; W506-C509 PolarHBondContact O-N 2.83Å; W506-E510 HydrophobicContact CH2-CG 4.42Å; W506-E510 HydrophobicContact CZ2-CB 4.47Å; W506-E510 HydrophobicContact CZ2-CG 4.25Å; W506-E510 VanDerWaalsContact O-CB 3.27Å; W506-E510 WeakPolarHBondContact O-CB 3.41Å; W506-E510 PolarHBondContact O-N 3.11Å; W506-V734 HydrophobicContact CB-CG1 3.64Å; W506-V734 HydrophobicContact CG-CG1 4.44Å
507	L	91	Very high	86.7	Confident	105 Å²	105	49.4 Å²	49.4	55%	0.55	24%	0.24	S	C	.	.	H	α-helix	trans	-59.4	-34.3	177.2	-71.7	169.4	0	0	0	112.5	Q503 A511	Q503-L507 WeakPolarHBondContact O-CG 3.32Å; Q503-L507 PolarHBondContact O-N 3.17Å; L507-A511 VanDerWaalsContact O-CB 3.24Å; L507-A511 WeakPolarHBondContact O-CB 3.48Å; L507-A511 PolarHBondContact O-N 2.65Å
508	S	89	Confident	85.4	Confident	20 Å²	20	45.5 Å²	45.5	14%	0.14	23%	0.233	C	C	.	.	H	α-helix	trans	-73.3	-41.4	177.4	-57.9	0	0	0	0	112.2	S504 L505 W506 A511 L512	S504-S508 WeakPolarHBondContact O-CB 3.47Å; S504-S508 PolarHBondContact O-N 3.47Å; S504-S508 VanDerWaalsContact O-N 3.1Å; S504-S508 PolarHBondContact O-OG 2.69Å; L505-S508 PolarHBondContact O-N 2.94Å; W506-S508 PolarHBondContact O-N 3.03Å; S508-A511 PolarHBondContact O-N 3.47Å; S508-L512 PolarHBondContact O-N 2.94Å; S508-L512 VanDerWaalsContact O-N 3.11Å
509	C	88.6	Confident	83.7	Confident	1 Å²	1	47.8 Å²	47.8	1%	0.007	25%	0.245	C	C	.	.	H	α-helix	trans	-67.7	-38.3	173.6	-66	0	0	0	0	112.1	L505 W506 L512 A513 L730 L731	L505-C509 PolarHBondContact O-N 2.84Å; L505-C509 PolarHBondContact O-SG 3.3Å; W506-C509 PolarHBondContact O-N 2.83Å; C509-L512 PolarHBondContact O-N 3.46Å; C509-A513 WeakPolarHBondContact O-CB 3.28Å; C509-A513 PolarHBondContact O-N 3.48Å; C509-L730 HydrophobicContact CB-CB 4.35Å; C509-L731 HydrophobicContact CB-CD2 4.19Å; C509-L731 HydrophobicContact CB-CG 4.23Å
510	E	88.4	Confident	81.5	Confident	60 Å²	60	51.9 Å²	51.9	28%	0.28	27%	0.274	S	S	.	.	H	α-helix	trans	-69.2	-38.5	175.4	-173.4	53.6	-133.4	0	0	111.1	W506 L512 A513 C514 L731	W506-E510 HydrophobicContact CH2-CG 4.42Å; W506-E510 HydrophobicContact CZ2-CB 4.47Å; W506-E510 HydrophobicContact CZ2-CG 4.25Å; W506-E510 VanDerWaalsContact O-CB 3.27Å; W506-E510 WeakPolarHBondContact O-CB 3.41Å; W506-E510 PolarHBondContact O-N 3.11Å; E510-L512 VanDerWaalsContact C-N 3.32Å; E510-L512 PolarHBondContact O-N 3.06Å; E510-A513 PolarHBondContact O-N 2.82Å; E510-C514 WeakPolarHBondContact O-CB 3.47Å; E510-C514 PolarHBondContact O-N 2.88Å; E510-C514 PolarHBondContact O-SG 3Å; E510-C514 PolarHBondContact OE1-SG 3.46Å; E510-L731 HydrophobicContact CB-CD2 4.13Å; E510-L731 WeakPolarHBondContact OE2-CD2 3.43Å
511	A	87.4	Confident	79.1	Confident	41 Å²	41	50 Å²	50	34%	0.339	28%	0.276	S	S	.	.	H	α-helix	trans	-61.2	-40	171.9	0	0	0	0	0	112.1	L507 S508 R515 F545	L507-A511 VanDerWaalsContact O-CB 3.24Å; L507-A511 WeakPolarHBondContact O-CB 3.48Å; L507-A511 PolarHBondContact O-N 2.65Å; S508-A511 PolarHBondContact O-N 3.47Å; A511-R515 VanDerWaalsContact O-CB 3.32Å; A511-R515 WeakPolarHBondContact O-CB 3.43Å; A511-R515 PolarHBondContact O-N 3.14Å; A511-F545 HydrophobicContact CB-CD1 4.13Å; A511-F545 HydrophobicContact CB-CE1 4.13Å
512	L	86.8	Confident	76.6	Confident	2 Å²	2	53.2 Å²	53.2	1%	0.01	30%	0.302	C	S	.	.	H	α-helix	trans	-67.1	-43	173.7	-176.6	149.8	0	0	0	111.8	S508 C509 E510 R515 L516 L542 F545 V546 I549 A727	S508-L512 PolarHBondContact O-N 2.94Å; S508-L512 VanDerWaalsContact O-N 3.11Å; C509-L512 PolarHBondContact O-N 3.46Å; E510-L512 VanDerWaalsContact C-N 3.32Å; E510-L512 PolarHBondContact O-N 3.06Å; L512-R515 WeakPolarHBondContact O-CB 3.47Å; L512-R515 PolarHBondContact O-N 3.02Å; L512-L516 HydrophobicContact CD2-CD1 3.89Å; L512-L516 WeakPolarHBondContact O-CG 3.38Å; L512-L516 PolarHBondContact O-N 2.91Å; L512-L542 HydrophobicContact CD1-CD2 4.01Å; L512-L542 HydrophobicContact CD1-CG 4.2Å; L512-L542 HydrophobicContact CG-CD2 4.32Å; L512-L542 HydrophobicContact CG-CG 4.46Å; L512-F545 HydrophobicContact CB-CB 4.18Å; L512-F545 HydrophobicContact CD1-CB 4.04Å; L512-F545 HydrophobicContact CG-CB 4.4Å; L512-V546 HydrophobicContact CD1-CG2 4.43Å; L512-I549 HydrophobicContact CB-CD1 4.3Å; L512-I549 HydrophobicContact CD1-CD1 3.76Å; L512-A727 HydrophobicContact CD2-CB 3.57Å
513	A	85.9	Confident	74	Confident	5 Å²	5	61.8 Å²	61.8	4%	0.041	34%	0.344	C	S	.	.	H	α-helix	trans	-63.8	-48.8	176.1	0	0	0	0	0	111.8	C509 E510 R515 L516 H517 A727 L731	C509-A513 WeakPolarHBondContact O-CB 3.28Å; C509-A513 PolarHBondContact O-N 3.48Å; E510-A513 PolarHBondContact O-N 2.82Å; A513-R515 VanDerWaalsContact C-N 3.27Å; A513-R515 PolarHBondContact O-N 3.31Å; A513-L516 PolarHBondContact O-N 2.88Å; A513-L516 VanDerWaalsContact O-N 3.07Å; A513-H517 PolarHBondContact O-N 2.8Å; A513-H517 PolarHBondContact O-ND1 3.36Å; A513-A727 HydrophobicContact CB-CB 4.11Å; A513-L731 HydrophobicContact CB-CD1 3.55Å
514	C	83	Confident	71.4	Confident	63 Å²	63	66.5 Å²	66.5	43%	0.426	36%	0.363	S	S	.	.	H	α-helix	trans	-52.4	-45.1	170.5	-82.8	0	0	0	0	111	E510 L516 H517 S518	E510-C514 WeakPolarHBondContact O-CB 3.47Å; E510-C514 PolarHBondContact O-N 2.88Å; E510-C514 PolarHBondContact O-SG 3Å; E510-C514 PolarHBondContact OE1-SG 3.46Å; C514-L516 PolarHBondContact O-N 3.48Å; C514-H517 PolarHBondContact O-N 3.15Å; C514-H517 VanDerWaalsContact O-N 3.17Å; C514-S518 WeakPolarHBondContact O-CA 3.3Å; C514-S518 WeakPolarHBondContact O-CB 3.4Å; C514-S518 PolarHBondContact O-N 3.12Å; C514-S518 PolarHBondContact O-OG 2.89Å; C514-S518 VanDerWaalsContact O-OG 3.1Å
515	R	81.3	Confident	68.7	Low	96 Å²	96	68.7 Å²	68.7	36%	0.362	38%	0.379	S	S	.	.	H	α-helix	trans	-61.4	-30.2	178.8	-174.5	55.9	166	168.4	-5.8	113.5	A511 L512 A513 T539 L542 F545	A511-R515 VanDerWaalsContact O-CB 3.32Å; A511-R515 WeakPolarHBondContact O-CB 3.43Å; A511-R515 PolarHBondContact O-N 3.14Å; L512-R515 WeakPolarHBondContact O-CB 3.47Å; L512-R515 PolarHBondContact O-N 3.02Å; A513-R515 VanDerWaalsContact C-N 3.27Å; A513-R515 PolarHBondContact O-N 3.31Å; R515-T539 HydrophobicContact CG-CG2 4.45Å; R515-T539 WeakPolarHBondContact O-CG2 3.49Å; R515-L542 HydrophobicContact CG-CD1 4.4Å; R515-F545 HydrophobicContact CB-CE1 4.47Å; R515-F545 HydrophobicContact CB-CE2 4.33Å; R515-F545 HydrophobicContact CB-CZ 4.14Å; R515-F545 HydrophobicContact CG-CD2 4.46Å; R515-F545 HydrophobicContact CG-CE2 3.8Å; R515-F545 HydrophobicContact CG-CZ 3.97Å
516	L	80.5	Confident	66	Low	1 Å²	1	77 Å²	77	1%	0.005	42%	0.417	C	S	.	.	H	α-helix	trans	-82.1	-29.9	176.1	-66.6	168.2	0	0	0	113.4	L512 A513 C514 V577 A723 A727	L512-L516 HydrophobicContact CD2-CD1 3.89Å; L512-L516 WeakPolarHBondContact O-CG 3.38Å; L512-L516 PolarHBondContact O-N 2.91Å; A513-L516 PolarHBondContact O-N 2.88Å; A513-L516 VanDerWaalsContact O-N 3.07Å; C514-L516 PolarHBondContact O-N 3.48Å; L516-V577 HydrophobicContact CD2-CB 4.19Å; L516-V577 HydrophobicContact CD2-CG1 4.34Å; L516-V577 HydrophobicContact CD2-CG2 4.33Å; L516-A723 HydrophobicContact CD1-CB 3.95Å; L516-A723 WeakPolarHBondContact CD1-O 3.15Å; L516-A723 HydrophobicContact CD2-CB 3.92Å; L516-A727 HydrophobicContact CD1-CB 3.94Å
517	H	74.1	Confident	63.6	Low	72 Å²	72	80.9 Å²	80.9	33%	0.333	44%	0.439	S	S	.	.	H	α-helix	trans	-92.7	-18.2	179.4	-65	80.5	0	0	0	113.5	A513 C514 D519 K724	A513-H517 PolarHBondContact O-N 2.8Å; A513-H517 PolarHBondContact O-ND1 3.36Å; C514-H517 PolarHBondContact O-N 3.15Å; C514-H517 VanDerWaalsContact O-N 3.17Å; H517-D519 PolarHBondContact O-N 2.96Å; H517-K724 WeakPolarHBondContact NE2-CE 3.47Å
518	S	62.5	Low	60.7	Low	47 Å²	47	84.5 Å²	84.5	33%	0.329	45%	0.453	S	S	.	.			trans	-75.6	83.7	-168.7	64	0	0	0	0	113.7	C514 S520	C514-S518 WeakPolarHBondContact O-CA 3.3Å; C514-S518 WeakPolarHBondContact O-CB 3.4Å; C514-S518 PolarHBondContact O-N 3.12Å; C514-S518 PolarHBondContact O-OG 2.89Å; C514-S518 VanDerWaalsContact O-OG 3.1Å; S518-S520 PolarHBondContact O-N 3.06Å
519	D	50	Low	58.2	Low	86 Å²	86	88.3 Å²	88.3	46%	0.46	48%	0.475	S	S	.	.			trans	-65.1	65.8	146.9	-87.4	-0.3	0	0	0	110.1	H517 T579 N581	H517-D519 PolarHBondContact O-N 2.96Å; D519-T579 PolarHBondContact OD1-OG1 3.11Å; D519-N581 VanDerWaalsContact CG-CB 3.48Å; D519-N581 WeakPolarHBondContact OD1-CB 3.24Å; D519-N581 WeakPolarHBondContact OD2-CB 3.49Å; D519-N581 VanDerWaalsContact OD2-CG 3.26Å; D519-N581 PolarHBondContact OD2-ND2 2.97Å
520	S	42	Very low	56.1	Low	86 Å²	86	98.2 Å²	98.2	60%	0.601	52%	0.518	S	S	*	.			trans	-117.9	124.4	179.9	-163	0	0	0	0	109.8	S518	S518-S520 PolarHBondContact O-N 3.06Å
521	P	37.5	Very low	53.8	Low	102 Å²	102	98.7 Å²	98.7	66%	0.662	53%	0.528	S	S	*	.	P	Polyproline II helix	trans	-61.3	148.4	171.3	29.2	-34.4	0	0	0	108.8	M523	P521-M523 PolarHBondContact O-N 3.02Å; P521-M523 VanDerWaalsContact O-N 3.16Å
522	S	34.2	Very low	51.4	Low	94 Å²	94	100.7 Å²	100.7	66%	0.657	53%	0.533	S	S	*	.	P	Polyproline II helix	trans	-51.3	127.4	171.5	43.8	0	0	0	0	109.8	K524	S522-K524 PolarHBondContact O-N 3.17Å; S522-K524 VanDerWaalsContact O-N 3.1Å
523	M	30.6	Very low	49.5	Very low	180 Å²	180	104.1 Å²	104.1	89%	0.887	56%	0.558	S	S	*	*	P	Polyproline II helix	trans	-51.3	123.4	163.4	-176.4	179	80.3	0	0	106.1	P521 S525	P521-M523 PolarHBondContact O-N 3.02Å; P521-M523 VanDerWaalsContact O-N 3.16Å; M523-S525 PolarHBondContact O-N 3.45Å
524	K	34.3	Very low	47.7	Very low	183 Å²	183	110.5 Å²	110.5	80%	0.796	59%	0.59	S	S	*	*			trans	-69.2	75.5	-163.2	-65	179.6	-177.8	175.2	0	112.4	S522 H526	S522-K524 PolarHBondContact O-N 3.17Å; S522-K524 VanDerWaalsContact O-N 3.1Å; K524-H526 PolarHBondContact O-CD2 3.33Å; K524-H526 PolarHBondContact O-N 2.77Å
525	S	34.6	Very low	46.4	Very low	96 Å²	96	112.2 Å²	112.2	67%	0.671	60%	0.598	S	S	*	*			trans	-56.5	118.9	152.6	43.5	0	0	0	0	107	M523 H527	M523-S525 PolarHBondContact O-N 3.45Å; S525-H527 PolarHBondContact O-N 3.26Å
526	H	33.3	Very low	45.2	Very low	176 Å²	176	112.8 Å²	112.8	82%	0.815	61%	0.608	S	S	*	*	S	Bend	trans	-73.4	76	-179.9	-84.6	-112	0	0	0	110.2	K524	K524-H526 PolarHBondContact O-CD2 3.33Å; K524-H526 PolarHBondContact O-N 2.77Å
527	H	41.2	Very low	44.5	Very low	183 Å²	183	114.2 Å²	114.2	85%	0.847	62%	0.615	S	S	*	*			trans	-142.6	122.5	157.3	-115.6	-76.4	0	0	0	111	S525	S525-H527 PolarHBondContact O-N 3.26Å
528	E	30.3	Very low	44.3	Very low	181 Å²	181	114.5 Å²	114.5	85%	0.846	62%	0.617	S	S	*	*			trans	-89.1	132.8	-172.1	-53.5	170.6	113	0	0	111.1
529	T	35.8	Very low	44.4	Very low	99 Å²	99	112.4 Å²	112.4	61%	0.607	60%	0.602	S	S	*	*			trans	-143.6	141.5	134.6	44	0	0	0	0	109.1	S531	T529-S531 WeakPolarHBondContact CB-OG 3.26Å; T529-S531 PolarHBondContact O-N 3.32Å; T529-S531 PolarHBondContact OG1-OG 3.42Å
530	K	43.6	Very low	45.5	Very low	209 Å²	209	110 Å²	110	91%	0.909	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.5	3.3	-178.5	-73	178.8	177.7	171.4	0	113.7
531	S	40	Very low	47.1	Very low	70 Å²	70	108.5 Å²	108.5	49%	0.49	59%	0.587	S	S	.	*	T	Hydrogen-bonded Turn	trans	-67.6	-36.2	178.8	34.4	0	0	0	0	113.2	T529 S533	T529-S531 WeakPolarHBondContact CB-OG 3.26Å; T529-S531 PolarHBondContact O-N 3.32Å; T529-S531 PolarHBondContact OG1-OG 3.42Å; S531-S533 PolarHBondContact O-N 3.28Å; S531-S533 PolarHBondContact O-OG 3.09Å
532	D	37.5	Very low	49.2	Very low	83 Å²	83	103.7 Å²	103.7	44%	0.444	56%	0.556	S	S	.	*	T	Hydrogen-bonded Turn	trans	-80	12.5	-154.6	-64.8	18.4	0	0	0	114.6	I534 V535 L536	D532-I534 PolarHBondContact O-N 3.38Å; D532-I534 VanDerWaalsContact O-N 3.09Å; D532-V535 HydrophobicContact CB-CB 4.4Å; D532-V535 HydrophobicContact CB-CG2 4.01Å; D532-V535 WeakPolarHBondContact O-CB 3.25Å; D532-V535 PolarHBondContact O-N 2.93Å; D532-L536 PolarHBondContact O-N 3.09Å
533	S	47.2	Very low	51.6	Low	75 Å²	75	103.6 Å²	103.6	52%	0.524	54%	0.543	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.5	-24.2	167.2	65.3	0	0	0	0	114.4	S531 N537	S531-S533 PolarHBondContact O-N 3.28Å; S531-S533 PolarHBondContact O-OG 3.09Å; S533-N537 PolarHBondContact O-ND2 2.89Å
534	I	49.3	Very low	54.2	Low	139 Å²	139	99.9 Å²	99.9	71%	0.713	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-40.4	175.2	-58.4	176.1	0	0	0	110.7	D532 L536	D532-I534 PolarHBondContact O-N 3.38Å; D532-I534 VanDerWaalsContact O-N 3.09Å; I534-L536 PolarHBondContact O-N 3.22Å
535	V	54	Low	56.7	Low	99 Å²	99	93.9 Å²	93.9	60%	0.6	50%	0.501	S	S	*	.	G	3₁₀ helix	trans	-69.3	-18.5	-176.4	-165.5	0	0	0	0	112.2	D532 N537	D532-V535 HydrophobicContact CB-CB 4.4Å; D532-V535 HydrophobicContact CB-CG2 4.01Å; D532-V535 WeakPolarHBondContact O-CB 3.25Å; D532-V535 PolarHBondContact O-N 2.93Å; V535-N537 PolarHBondContact O-N 3.12Å; V535-N537 VanDerWaalsContact O-N 3.16Å
536	L	57.7	Low	59.2	Low	108 Å²	108	89.8 Å²	89.8	57%	0.565	47%	0.472	S	S	*	.	G	3₁₀ helix	trans	-73.8	5.8	-177.4	-92.7	159.1	0	0	0	116.3	D532 I534	D532-L536 PolarHBondContact O-N 3.09Å; I534-L536 PolarHBondContact O-N 3.22Å
537	N	64.9	Low	61.8	Low	30 Å²	30	84.4 Å²	84.4	16%	0.16	45%	0.45	C	S	.	.	G	3₁₀ helix	trans	-134.8	-3.1	-172.3	-56.3	-76.2	0	0	0	114.7	S533 V535 W578 T579 K585	S533-N537 PolarHBondContact O-ND2 2.89Å; V535-N537 PolarHBondContact O-N 3.12Å; V535-N537 VanDerWaalsContact O-N 3.16Å; N537-W578 HydrophobicContact CB-CE3 4.27Å; N537-W578 HydrophobicContact CB-CZ3 4.06Å; N537-T579 PolarHBondContact O-N 3.15Å; N537-T579 VanDerWaalsContact O-N 3.1Å; N537-K585 WeakPolarHBondContact OD1-CD 3.44Å; N537-K585 PolarHBondContact OD1-NZ 2.9Å
538	Q	69.7	Low	63.9	Low	78 Å²	78	78.1 Å²	78.1	36%	0.364	43%	0.426	S	S	.	.	B	Isolated β-bridge	trans	-133.4	135.1	-179.6	-177.7	175.4	-7.2	0	0	108.4	N575	Q538-N575 PolarHBondContact NE2-O 3.05Å
539	T	65.5	Low	66.7	Low	4 Å²	4	69.5 Å²	69.5	3%	0.025	39%	0.386	C	S	.	.			trans	-69.6	134.2	174.2	63	0	0	0	0	109.2	R515 G576 V577 T579	R515-T539 HydrophobicContact CG-CG2 4.45Å; R515-T539 WeakPolarHBondContact O-CG2 3.49Å; T539-G576 WeakPolarHBondContact O-CA 3.29Å; T539-V577 PolarHBondContact N-O 3.3Å; T539-V577 PolarHBondContact OG1-N 3.33Å; T539-V577 PolarHBondContact OG1-O 2.67Å; T539-T579 HydrophobicContact CG2-CG2 3.92Å
540	G	72.2	Confident	69.1	Low	36 Å²	36	70.3 Å²	70.3	37%	0.371	38%	0.378	S	S	.	.			trans	-62.5	155.7	168.1	0	0	0	0	0	111	L542	G540-L542 PolarHBondContact O-N 2.86Å
541	S	75.3	Confident	71.2	Confident	54 Å²	54	67 Å²	67	38%	0.378	37%	0.366	S	S	.	.			trans	-32.5	119.3	-173.8	51.8	0	0	0	0	114.4	K543	S541-K543 PolarHBondContact O-N 3.13Å
542	L	82.8	Confident	73.2	Confident	1 Å²	1	65 Å²	65	1%	0.005	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-13.6	-175.7	-144.5	72	0	0	0	113	L512 R515 G540 D544 F545 V546 L568 I572 V573	L512-L542 HydrophobicContact CD1-CD2 4.01Å; L512-L542 HydrophobicContact CD1-CG 4.2Å; L512-L542 HydrophobicContact CG-CD2 4.32Å; L512-L542 HydrophobicContact CG-CG 4.46Å; R515-L542 HydrophobicContact CG-CD1 4.4Å; G540-L542 PolarHBondContact O-N 2.86Å; L542-D544 VanDerWaalsContact C-N 3.26Å; L542-D544 PolarHBondContact O-N 2.94Å; L542-D544 VanDerWaalsContact O-N 3.15Å; L542-F545 HydrophobicContact CD1-CD2 4.45Å; L542-F545 PolarHBondContact O-N 2.78Å; L542-F545 VanDerWaalsContact O-N 3.07Å; L542-V546 PolarHBondContact O-N 3.41Å; L542-L568 HydrophobicContact CD2-CD2 4.26Å; L542-I572 HydrophobicContact CD2-CG2 4.24Å; L542-V573 PolarHBondContact N-O 3.16Å; L542-V573 VanDerWaalsContact N-O 3.16Å
543	K	84.3	Confident	75.3	Confident	91 Å²	91	61.2 Å²	61.2	40%	0.396	33%	0.331	S	S	.	.	H	α-helix	trans	-41.6	-43.8	177.9	-164	163.4	-168.9	159	0	114.7	S541 V546 N547 V573 E574	S541-K543 PolarHBondContact O-N 3.13Å; K543-V546 PolarHBondContact O-N 3.02Å; K543-N547 WeakPolarHBondContact O-CB 3.3Å; K543-N547 PolarHBondContact O-N 3.01Å; K543-N547 PolarHBondContact O-ND2 2.9Å; K543-V573 HydrophobicContact CB-CG1 4.03Å; K543-V573 HydrophobicContact CG-CG1 4.3Å; K543-V573 PolarHBondContact N-O 3.15Å; K543-E574 IonicContact NZ-OE1 2.67Å; K543-E574 PolarHBondContact NZ-OE1 3.39Å
544	D	85.5	Confident	76.6	Confident	102 Å²	102	61.6 Å²	61.6	55%	0.545	34%	0.339	S	S	.	.	H	α-helix	trans	-66.7	-43.8	-177.8	-61.6	-20.4	0	0	0	111.7	L542 N547 S548	L542-D544 VanDerWaalsContact C-N 3.26Å; L542-D544 PolarHBondContact O-N 2.94Å; L542-D544 VanDerWaalsContact O-N 3.15Å; D544-N547 WeakPolarHBondContact O-CB 3.33Å; D544-N547 PolarHBondContact O-N 3.37Å; D544-S548 PolarHBondContact O-N 3.37Å; D544-S548 PolarHBondContact O-OG 3.18Å
545	F	86.1	Confident	77.6	Confident	57 Å²	57	58.5 Å²	58.5	25%	0.25	33%	0.33	C	S	.	.	H	α-helix	trans	-67.3	-40.3	176	-59.5	-87	0	0	0	111.7	A511 L512 R515 L542 N547 S548 I549	A511-F545 HydrophobicContact CB-CD1 4.13Å; A511-F545 HydrophobicContact CB-CE1 4.13Å; L512-F545 HydrophobicContact CB-CB 4.18Å; L512-F545 HydrophobicContact CD1-CB 4.04Å; L512-F545 HydrophobicContact CG-CB 4.4Å; R515-F545 HydrophobicContact CB-CE1 4.47Å; R515-F545 HydrophobicContact CB-CE2 4.33Å; R515-F545 HydrophobicContact CB-CZ 4.14Å; R515-F545 HydrophobicContact CG-CD2 4.46Å; R515-F545 HydrophobicContact CG-CE2 3.8Å; R515-F545 HydrophobicContact CG-CZ 3.97Å; L542-F545 HydrophobicContact CD1-CD2 4.45Å; L542-F545 PolarHBondContact O-N 2.78Å; L542-F545 VanDerWaalsContact O-N 3.07Å; F545-N547 VanDerWaalsContact C-N 3.29Å; F545-N547 PolarHBondContact O-N 2.91Å; F545-S548 PolarHBondContact O-N 3.4Å; F545-I549 VanDerWaalsContact O-CG1 3.29Å; F545-I549 WeakPolarHBondContact O-CG1 3.49Å; F545-I549 PolarHBondContact O-N 3.43Å
546	V	86.9	Confident	78.5	Confident	10 Å²	10	56.5 Å²	56.5	6%	0.061	33%	0.329	C	S	.	.	H	α-helix	trans	-61.7	-39	174.5	173	0	0	0	0	110.9	L512 L542 K543 R550 L565	L512-V546 HydrophobicContact CD1-CG2 4.43Å; L542-V546 PolarHBondContact O-N 3.41Å; K543-V546 PolarHBondContact O-N 3.02Å; V546-R550 VanDerWaalsContact O-CB 3.3Å; V546-R550 WeakPolarHBondContact O-CB 3.43Å; V546-R550 PolarHBondContact O-N 3.36Å; V546-L565 HydrophobicContact CG1-CD1 4.5Å; V546-L565 HydrophobicContact CG1-CD2 4.33Å; V546-L565 HydrophobicContact CG2-CD2 4.49Å
547	N	87	Confident	79.3	Confident	64 Å²	64	54.2 Å²	54.2	34%	0.342	32%	0.317	S	S	.	.	H	α-helix	trans	-65.5	-47.4	173.6	-70.1	-23.9	0	0	0	111.5	K543 D544 F545 I549 R550 E551	K543-N547 WeakPolarHBondContact O-CB 3.3Å; K543-N547 PolarHBondContact O-N 3.01Å; K543-N547 PolarHBondContact O-ND2 2.9Å; D544-N547 WeakPolarHBondContact O-CB 3.33Å; D544-N547 PolarHBondContact O-N 3.37Å; F545-N547 VanDerWaalsContact C-N 3.29Å; F545-N547 PolarHBondContact O-N 2.91Å; N547-I549 VanDerWaalsContact C-N 3.3Å; N547-I549 PolarHBondContact O-N 3.07Å; N547-R550 CarbonylContact O-C 3.55Å; N547-R550 PolarHBondContact O-N 3.19Å; N547-E551 WeakPolarHBondContact O-CB 3.23Å; N547-E551 WeakPolarHBondContact O-CG 3.23Å; N547-E551 PolarHBondContact O-N 3.24Å
548	S	87.1	Confident	80.2	Confident	51 Å²	51	52.9 Å²	52.9	36%	0.357	31%	0.31	S	S	.	.	H	α-helix	trans	-60.2	-37.3	177	-58.2	0	0	0	0	113.1	D544 F545 C552	D544-S548 PolarHBondContact O-N 3.37Å; D544-S548 PolarHBondContact O-OG 3.18Å; F545-S548 PolarHBondContact O-N 3.4Å; S548-C552 PolarHBondContact O-N 3.33Å; S548-C552 PolarHBondContact O-SG 2.79Å
549	I	88.6	Confident	80.9	Confident	0 Å²	0	53 Å²	53	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-66.9	-44.2	173.2	-63.1	165.8	0	0	0	110.1	L505 L512 F545 N547 E551 C552 T553 V561 L565 L730	L505-I549 HydrophobicContact CD1-CG2 3.79Å; L512-I549 HydrophobicContact CB-CD1 4.3Å; L512-I549 HydrophobicContact CD1-CD1 3.76Å; F545-I549 VanDerWaalsContact O-CG1 3.29Å; F545-I549 WeakPolarHBondContact O-CG1 3.49Å; F545-I549 PolarHBondContact O-N 3.43Å; N547-I549 VanDerWaalsContact C-N 3.3Å; N547-I549 PolarHBondContact O-N 3.07Å; I549-E551 VanDerWaalsContact C-N 3.33Å; I549-E551 PolarHBondContact O-N 2.93Å; I549-C552 CarbonylContact O-C 3.55Å; I549-C552 WeakPolarHBondContact O-CB 3.23Å; I549-C552 PolarHBondContact O-N 3.3Å; I549-T553 WeakPolarHBondContact O-CG2 3.33Å; I549-T553 PolarHBondContact O-N 3.45Å; I549-T553 PolarHBondContact O-OG1 2.87Å; I549-V561 HydrophobicContact CG2-CG1 3.67Å; I549-L565 HydrophobicContact CB-CD1 4.26Å; I549-L565 HydrophobicContact CG2-CD1 3.8Å; I549-L565 HydrophobicContact CG2-CD2 4.47Å; I549-L730 HydrophobicContact CD1-CD1 4.48Å
550	R	86.9	Confident	81.9	Confident	115 Å²	115	57.5 Å²	57.5	43%	0.434	34%	0.337	S	S	.	.	H	α-helix	trans	-66.5	-30.6	178.4	-174.5	174.7	-83.3	172.6	-7.6	113.2	V546 N547 T553 A554 D566	V546-R550 VanDerWaalsContact O-CB 3.3Å; V546-R550 WeakPolarHBondContact O-CB 3.43Å; V546-R550 PolarHBondContact O-N 3.36Å; N547-R550 CarbonylContact O-C 3.55Å; N547-R550 PolarHBondContact O-N 3.19Å; R550-T553 PolarHBondContact O-OG1 2.98Å; R550-A554 PolarHBondContact O-N 3.21Å; R550-D566 IonicContact NH2-OD1 2.63Å; R550-D566 PolarHBondContact NH2-OD1 3.04Å
551	E	86.5	Confident	82.8	Confident	140 Å²	140	55.8 Å²	55.8	65%	0.654	32%	0.319	S	S	*	.	H	α-helix	trans	-67.6	-45.6	169.3	-74	166.5	-167.8	0	0	110.8	N547 I549 T553 A554	N547-E551 WeakPolarHBondContact O-CB 3.23Å; N547-E551 WeakPolarHBondContact O-CG 3.23Å; N547-E551 PolarHBondContact O-N 3.24Å; I549-E551 VanDerWaalsContact C-N 3.33Å; I549-E551 PolarHBondContact O-N 2.93Å; E551-T553 VanDerWaalsContact C-N 3.27Å; E551-T553 PolarHBondContact O-N 3.29Å; E551-A554 VanDerWaalsContact O-CB 3.27Å; E551-A554 WeakPolarHBondContact O-CB 3.36Å; E551-A554 PolarHBondContact O-N 3.2Å
552	C	82.8	Confident	83.3	Confident	29 Å²	29	55.7 Å²	55.7	20%	0.196	31%	0.314	C	S	.	.	H	α-helix	trans	-63.2	-28.9	174.4	-68.4	0	0	0	0	113.3	L505 S548 I549	L505-C552 HydrophobicContact CB-CB 4.35Å; L505-C552 HydrophobicContact CD1-CB 4.03Å; S548-C552 PolarHBondContact O-N 3.33Å; S548-C552 PolarHBondContact O-SG 2.79Å; I549-C552 CarbonylContact O-C 3.55Å; I549-C552 WeakPolarHBondContact O-CB 3.23Å; I549-C552 PolarHBondContact O-N 3.3Å
553	T	80.2	Confident	83.6	Confident	3 Å²	3	61 Å²	61	2%	0.018	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.3	-1	177	63.1	0	0	0	0	114.8	L505 I549 R550 E551 S555 G556 Y558 V561 N562	L505-T553 HydrophobicContact CD1-CG2 3.71Å; L505-T553 HydrophobicContact CD2-CG2 4.35Å; I549-T553 WeakPolarHBondContact O-CG2 3.33Å; I549-T553 PolarHBondContact O-N 3.45Å; I549-T553 PolarHBondContact O-OG1 2.87Å; R550-T553 PolarHBondContact O-OG1 2.98Å; E551-T553 VanDerWaalsContact C-N 3.27Å; E551-T553 PolarHBondContact O-N 3.29Å; T553-S555 PolarHBondContact O-N 3.4Å; T553-S555 VanDerWaalsContact O-N 3.08Å; T553-G556 PolarHBondContact O-N 3.07Å; T553-Y558 HydrophobicContact CG2-CD2 4.23Å; T553-Y558 HydrophobicContact CG2-CG 4.41Å; T553-V561 HydrophobicContact CG2-CB 3.92Å; T553-V561 HydrophobicContact CG2-CG1 3.64Å; T553-V561 HydrophobicContact CG2-CG2 4.44Å; T553-N562 PolarHBondContact OG1-OD1 2.77Å
554	A	74.8	Confident	83.8	Confident	83 Å²	83	57.4 Å²	57.4	69%	0.686	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-24.8	179.6	0	0	0	0	0	113.8	R550 E551 G556	R550-A554 PolarHBondContact O-N 3.21Å; E551-A554 VanDerWaalsContact O-CB 3.27Å; E551-A554 WeakPolarHBondContact O-CB 3.36Å; E551-A554 PolarHBondContact O-N 3.2Å; A554-G556 PolarHBondContact O-N 2.96Å; A554-G556 VanDerWaalsContact O-N 3.08Å
555	S	70.9	Confident	83.8	Confident	74 Å²	74	53 Å²	53	52%	0.517	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-2.9	172.8	-56	0	0	0	0	114.8	T553 N557	T553-S555 PolarHBondContact O-N 3.4Å; T553-S555 VanDerWaalsContact O-N 3.08Å; S555-N557 PolarHBondContact O-N 3.26Å
556	G	72.5	Confident	83.8	Confident	56 Å²	56	55.4 Å²	55.4	58%	0.577	32%	0.319	S	S	*	.	S	Bend	trans	75.1	-8.3	175.3	0	0	0	0	0	115.7	T553 A554 Y558	T553-G556 PolarHBondContact O-N 3.07Å; A554-G556 PolarHBondContact O-N 2.96Å; A554-G556 VanDerWaalsContact O-N 3.08Å; G556-Y558 PolarHBondContact O-N 2.79Å; G556-Y558 VanDerWaalsContact O-N 3.11Å
557	N	74.2	Confident	83.7	Confident	61 Å²	61	59.1 Å²	59.1	33%	0.326	35%	0.345	S	S	.	.	S	Bend	trans	-64.6	-12.7	-177.9	-81.9	-34.5	0	0	0	115	E501 S555	E501-N557 PolarHBondContact OE2-ND2 3.28Å; S555-N557 PolarHBondContact O-N 3.26Å
558	Y	83.8	Confident	83.5	Confident	1 Å²	1	56.8 Å²	56.8	0%	0.004	33%	0.332	C	S	.	.			trans	-133.3	56.8	-165.3	-55.9	-61.4	0	0	0	114.3	E501 L505 T553 G556 F560 V561 Y733 R737	E501-Y558 HydrophobicContact CB-CE2 4.39Å; L505-Y558 HydrophobicContact CD2-CD1 4.16Å; L505-Y558 HydrophobicContact CD2-CD2 3.76Å; L505-Y558 HydrophobicContact CD2-CE1 4.38Å; L505-Y558 HydrophobicContact CD2-CE2 4.02Å; L505-Y558 HydrophobicContact CD2-CG 3.84Å; T553-Y558 HydrophobicContact CG2-CD2 4.23Å; T553-Y558 HydrophobicContact CG2-CG 4.41Å; G556-Y558 PolarHBondContact O-N 2.79Å; G556-Y558 VanDerWaalsContact O-N 3.11Å; Y558-F560 PolarHBondContact O-N 3.26Å; Y558-F560 VanDerWaalsContact O-N 3.16Å; Y558-V561 PolarHBondContact O-N 3.1Å; Y558-V561 VanDerWaalsContact O-N 3.11Å; Y558-Y733 AromaticContact CD1-CE1 3.9Å; Y558-Y733 HydrophobicContact CD1-CE1 3.9Å; Y558-R737 HydrophobicContact CE1-CG 3.85Å
559	P	84.8	Confident	83.1	Confident	81 Å²	81	56 Å²	56	53%	0.526	33%	0.327	S	S	.	.	H	α-helix	trans	-60.3	-29.7	-177.1	25.5	-35.2	0	0	0	113.6	V561 N562 I563	P559-V561 VanDerWaalsContact C-N 3.34Å; P559-V561 PolarHBondContact O-N 3.39Å; P559-N562 PolarHBondContact O-N 2.74Å; P559-I563 WeakPolarHBondContact O-CG1 3.49Å; P559-I563 PolarHBondContact O-N 3.3Å
560	F	87.9	Confident	82.7	Confident	99 Å²	99	62 Å²	62	43%	0.434	36%	0.359	S	S	.	.	H	α-helix	trans	-65.2	-34.2	177.7	-176.6	-110.6	0	0	0	113.2	Y558 I563 I564 Y733	Y558-F560 PolarHBondContact O-N 3.26Å; Y558-F560 VanDerWaalsContact O-N 3.16Å; F560-I563 PolarHBondContact O-N 2.93Å; F560-I564 HydrophobicContact CD1-CD1 3.77Å; F560-I564 HydrophobicContact CE1-CD1 3.34Å; F560-I564 HydrophobicContact CE1-CG1 4.43Å; F560-I564 HydrophobicContact CE2-CD1 4.34Å; F560-I564 HydrophobicContact CG-CD1 4.46Å; F560-I564 HydrophobicContact CZ-CD1 3.67Å; F560-I564 HydrophobicContact CZ-CG1 4.43Å; F560-I564 PolarHBondContact O-N 3.4Å; F560-I564 VanDerWaalsContact O-N 3.11Å; F560-Y733 HydrophobicContact CB-CE2 4.02Å; F560-Y733 HydrophobicContact CD1-CD1 4.2Å; F560-Y733 AromaticContact CD1-CD2 3.32Å; F560-Y733 HydrophobicContact CD1-CD2 3.32Å; F560-Y733 HydrophobicContact CD1-CE1 4.47Å; F560-Y733 AromaticContact CD1-CE2 3.65Å; F560-Y733 HydrophobicContact CD1-CE2 3.65Å; F560-Y733 AromaticContact CD1-CG 3.62Å; F560-Y733 HydrophobicContact CD1-CG 3.62Å; F560-Y733 AromaticContact CE1-CD2 3.77Å; F560-Y733 HydrophobicContact CE1-CD2 3.77Å; F560-Y733 HydrophobicContact CE1-CE2 4.47Å; F560-Y733 HydrophobicContact CE1-CG 4.02Å; F560-Y733 HydrophobicContact CG-CD2 4.24Å; F560-Y733 HydrophobicContact CG-CE2 4.14Å
561	V	89.5	Confident	82.4	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-66.5	-42.6	176.9	171.2	0	0	0	0	110.5	L505 I549 T553 Y558 P559 I563 I564 L565 L730 Y733	L505-V561 HydrophobicContact CD2-CG2 4.31Å; I549-V561 HydrophobicContact CG2-CG1 3.67Å; T553-V561 HydrophobicContact CG2-CB 3.92Å; T553-V561 HydrophobicContact CG2-CG1 3.64Å; T553-V561 HydrophobicContact CG2-CG2 4.44Å; Y558-V561 PolarHBondContact O-N 3.1Å; Y558-V561 VanDerWaalsContact O-N 3.11Å; P559-V561 VanDerWaalsContact C-N 3.34Å; P559-V561 PolarHBondContact O-N 3.39Å; V561-I563 PolarHBondContact O-N 2.89Å; V561-I564 PolarHBondContact O-N 2.87Å; V561-I564 VanDerWaalsContact O-N 3.17Å; V561-L565 HydrophobicContact CG1-CD1 4.18Å; V561-L565 HydrophobicContact CG1-CG 4.32Å; V561-L565 WeakPolarHBondContact O-CG 3.15Å; V561-L565 PolarHBondContact O-N 3.37Å; V561-L730 HydrophobicContact CB-CD2 4.05Å; V561-L730 HydrophobicContact CG1-CD2 3.73Å; V561-L730 HydrophobicContact CG2-CD2 3.9Å; V561-Y733 HydrophobicContact CG2-CD1 3.7Å; V561-Y733 HydrophobicContact CG2-CE1 3.65Å
562	N	86.7	Confident	82.2	Confident	51 Å²	51	54.5 Å²	54.5	27%	0.273	33%	0.332	S	S	.	.	H	α-helix	trans	-63.2	-42.8	178.1	-63.9	-3.4	0	0	0	110.9	T553 P559 I564 L565 D566	T553-N562 PolarHBondContact OG1-OD1 2.77Å; P559-N562 PolarHBondContact O-N 2.74Å; N562-I564 VanDerWaalsContact C-N 3.28Å; N562-I564 PolarHBondContact O-N 3.24Å; N562-L565 PolarHBondContact O-N 3.22Å; N562-D566 WeakPolarHBondContact O-CB 3.34Å; N562-D566 PolarHBondContact O-N 2.94Å
563	I	88.5	Confident	82.2	Confident	114 Å²	114	54 Å²	54	59%	0.585	33%	0.328	S	S	*	.	H	α-helix	trans	-58.8	-38.3	174.6	-65.5	165.2	0	0	0	111.8	P559 F560 V561 S567	P559-I563 WeakPolarHBondContact O-CG1 3.49Å; P559-I563 PolarHBondContact O-N 3.3Å; F560-I563 PolarHBondContact O-N 2.93Å; V561-I563 PolarHBondContact O-N 2.89Å; I563-S567 PolarHBondContact O-N 3.03Å
564	I	89.3	Confident	82.4	Confident	15 Å²	15	59.5 Å²	59.5	8%	0.077	35%	0.353	C	S	.	.	H	α-helix	trans	-69.4	-46.7	175.5	-73	168.2	0	0	0	111.2	F560 V561 N562 D566 S567 T726 L730	F560-I564 HydrophobicContact CD1-CD1 3.77Å; F560-I564 HydrophobicContact CE1-CD1 3.34Å; F560-I564 HydrophobicContact CE1-CG1 4.43Å; F560-I564 HydrophobicContact CE2-CD1 4.34Å; F560-I564 HydrophobicContact CG-CD1 4.46Å; F560-I564 HydrophobicContact CZ-CD1 3.67Å; F560-I564 HydrophobicContact CZ-CG1 4.43Å; F560-I564 PolarHBondContact O-N 3.4Å; F560-I564 VanDerWaalsContact O-N 3.11Å; V561-I564 PolarHBondContact O-N 2.87Å; V561-I564 VanDerWaalsContact O-N 3.17Å; N562-I564 VanDerWaalsContact C-N 3.28Å; N562-I564 PolarHBondContact O-N 3.24Å; I564-D566 VanDerWaalsContact C-N 3.32Å; I564-D566 PolarHBondContact O-N 3.34Å; I564-S567 WeakPolarHBondContact O-CB 3.48Å; I564-S567 PolarHBondContact O-N 2.81Å; I564-S567 VanDerWaalsContact O-N 3.09Å; I564-S567 PolarHBondContact O-OG 3.41Å; I564-T726 HydrophobicContact CG2-CG2 3.71Å; I564-L730 HydrophobicContact CB-CD2 3.97Å; I564-L730 HydrophobicContact CD1-CD2 3.97Å; I564-L730 HydrophobicContact CG2-CD1 4.26Å; I564-L730 HydrophobicContact CG2-CD2 3.77Å; I564-L730 HydrophobicContact CG2-CG 3.83Å
565	L	85.2	Confident	82.5	Confident	9 Å²	9	60.5 Å²	60.5	5%	0.047	35%	0.348	C	S	.	.	H	α-helix	trans	-61.5	-39.8	178	-68.9	179.3	0	0	0	112.4	V546 I549 V561 N562 S567 L568 L730	V546-L565 HydrophobicContact CG1-CD1 4.5Å; V546-L565 HydrophobicContact CG1-CD2 4.33Å; V546-L565 HydrophobicContact CG2-CD2 4.49Å; I549-L565 HydrophobicContact CB-CD1 4.26Å; I549-L565 HydrophobicContact CG2-CD1 3.8Å; I549-L565 HydrophobicContact CG2-CD2 4.47Å; V561-L565 HydrophobicContact CG1-CD1 4.18Å; V561-L565 HydrophobicContact CG1-CG 4.32Å; V561-L565 WeakPolarHBondContact O-CG 3.15Å; V561-L565 PolarHBondContact O-N 3.37Å; N562-L565 PolarHBondContact O-N 3.22Å; L565-S567 PolarHBondContact O-N 2.88Å; L565-L568 WeakPolarHBondContact O-CB 3.29Å; L565-L568 PolarHBondContact O-N 2.93Å; L565-L730 HydrophobicContact CD2-CD1 4.12Å
566	D	85.2	Confident	82.9	Confident	108 Å²	108	57.5 Å²	57.5	58%	0.578	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-8.1	178.6	-60.5	-20.3	0	0	0	112.4	R550 N562 I564	R550-D566 IonicContact NH2-OD1 2.63Å; R550-D566 PolarHBondContact NH2-OD1 3.04Å; N562-D566 WeakPolarHBondContact O-CB 3.34Å; N562-D566 PolarHBondContact O-N 2.94Å; I564-D566 VanDerWaalsContact C-N 3.32Å; I564-D566 PolarHBondContact O-N 3.34Å
567	S	85.2	Confident	83.4	Confident	87 Å²	87	54.9 Å²	54.9	61%	0.608	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.2	-10.6	172	76.9	0	0	0	0	114.1	I563 I564 L565	I563-S567 PolarHBondContact O-N 3.03Å; I564-S567 WeakPolarHBondContact O-CB 3.48Å; I564-S567 PolarHBondContact O-N 2.81Å; I564-S567 VanDerWaalsContact O-N 3.09Å; I564-S567 PolarHBondContact O-OG 3.41Å; L565-S567 PolarHBondContact O-N 2.88Å
568	L	83.3	Confident	83.9	Confident	15 Å²	15	54.8 Å²	54.8	8%	0.079	30%	0.296	C	S	.	.	S	Bend	trans	-77.3	135.3	177	-165.2	63.5	0	0	0	109.9	L542 L565 I572 V573 T726	L542-L568 HydrophobicContact CD2-CD2 4.26Å; L565-L568 WeakPolarHBondContact O-CB 3.29Å; L565-L568 PolarHBondContact O-N 2.93Å; L568-I572 HydrophobicContact CD1-CB 4.41Å; L568-I572 HydrophobicContact CD1-CD1 3.83Å; L568-I572 HydrophobicContact CD1-CG2 3.87Å; L568-I572 HydrophobicContact CD2-CG2 3.9Å; L568-I572 HydrophobicContact CG-CB 4.27Å; L568-I572 HydrophobicContact CG-CD1 4.48Å; L568-I572 HydrophobicContact CG-CG2 3.83Å; L568-V573 HydrophobicContact CD2-CG2 3.95Å; L568-V573 HydrophobicContact CG-CG2 4.27Å; L568-T726 HydrophobicContact CD1-CG2 4.29Å
569	S	79	Confident	83.8	Confident	36 Å²	36	55.2 Å²	55.2	25%	0.252	30%	0.299	S	S	.	.			trans	-66	141.4	-178.5	74.3	0	0	0	0	111.5	D571 I572 V573	S569-D571 PolarHBondContact O-N 3.02Å; S569-I572 WeakPolarHBondContact O-CB 3.49Å; S569-I572 PolarHBondContact O-N 2.66Å; S569-I572 VanDerWaalsContact O-N 3.07Å; S569-I572 WeakPolarHBondContact OG-CD1 3.31Å; S569-I572 VanDerWaalsContact OG-CG1 3.31Å; S569-I572 WeakPolarHBondContact OG-CG1 3.4Å; S569-I572 PolarHBondContact OG-N 2.93Å; S569-V573 PolarHBondContact O-N 2.86Å
570	N	80.7	Confident	83.5	Confident	125 Å²	125	52.8 Å²	52.8	67%	0.668	28%	0.28	S	S	*	.	H	α-helix	trans	-58.3	-33.1	176.8	-68.1	-41.8	0	0	0	111.3	I572 V573 E574	N570-I572 VanDerWaalsContact C-N 3.3Å; N570-I572 PolarHBondContact O-N 3.36Å; N570-V573 PolarHBondContact O-N 3.07Å; N570-V573 VanDerWaalsContact O-N 3.07Å; N570-E574 PolarHBondContact O-N 2.93Å
571	D	80.2	Confident	83	Confident	97 Å²	97	50.8 Å²	50.8	52%	0.519	27%	0.274	S	S	.	.	H	α-helix	trans	-58.1	-40.5	176.8	-59.7	-9.3	0	0	0	112	S569 N575	S569-D571 PolarHBondContact O-N 3.02Å; D571-N575 VanDerWaalsContact O-CB 3.27Å; D571-N575 WeakPolarHBondContact O-CB 3.42Å; D571-N575 PolarHBondContact O-N 3.23Å; D571-N575 PolarHBondContact O-ND2 3.07Å
572	I	82.4	Confident	82.7	Confident	1 Å²	1	50.8 Å²	50.8	1%	0.005	28%	0.275	C	S	.	.	H	α-helix	trans	-66.3	-42.6	173.4	-74.4	165.1	0	0	0	111.4	L542 L568 S569 N570 G576 V577 H719 E722 A723	L542-I572 HydrophobicContact CD2-CG2 4.24Å; L568-I572 HydrophobicContact CD1-CB 4.41Å; L568-I572 HydrophobicContact CD1-CD1 3.83Å; L568-I572 HydrophobicContact CD1-CG2 3.87Å; L568-I572 HydrophobicContact CD2-CG2 3.9Å; L568-I572 HydrophobicContact CG-CB 4.27Å; L568-I572 HydrophobicContact CG-CD1 4.48Å; L568-I572 HydrophobicContact CG-CG2 3.83Å; S569-I572 WeakPolarHBondContact O-CB 3.49Å; S569-I572 PolarHBondContact O-N 2.66Å; S569-I572 VanDerWaalsContact O-N 3.07Å; S569-I572 WeakPolarHBondContact OG-CD1 3.31Å; S569-I572 VanDerWaalsContact OG-CG1 3.31Å; S569-I572 WeakPolarHBondContact OG-CG1 3.4Å; S569-I572 PolarHBondContact OG-N 2.93Å; N570-I572 VanDerWaalsContact C-N 3.3Å; N570-I572 PolarHBondContact O-N 3.36Å; I572-G576 VanDerWaalsContact O-CA 3.3Å; I572-G576 WeakPolarHBondContact O-CA 3.34Å; I572-G576 PolarHBondContact O-N 3.18Å; I572-G576 VanDerWaalsContact O-N 3.15Å; I572-V577 HydrophobicContact CB-CG2 4.37Å; I572-V577 HydrophobicContact CG1-CG2 4.36Å; I572-V577 HydrophobicContact CG2-CG2 3.64Å; I572-H719 HydrophobicContact CD1-CB 3.98Å; I572-H719 HydrophobicContact CG1-CB 3.79Å; I572-E722 HydrophobicContact CD1-CB 4.25Å; I572-A723 HydrophobicContact CG2-CB 4.33Å
573	V	82.9	Confident	82.7	Confident	19 Å²	19	48.4 Å²	48.4	12%	0.115	26%	0.262	C	S	.	.	H	α-helix	trans	-68.3	-40.8	-175.5	178.7	0	0	0	0	111.6	L542 K543 L568 S569 N570	L542-V573 PolarHBondContact N-O 3.16Å; L542-V573 VanDerWaalsContact N-O 3.16Å; K543-V573 HydrophobicContact CB-CG1 4.03Å; K543-V573 HydrophobicContact CG-CG1 4.3Å; K543-V573 PolarHBondContact N-O 3.15Å; L568-V573 HydrophobicContact CD2-CG2 3.95Å; L568-V573 HydrophobicContact CG-CG2 4.27Å; S569-V573 PolarHBondContact O-N 2.86Å; N570-V573 PolarHBondContact O-N 3.07Å; N570-V573 VanDerWaalsContact O-N 3.07Å
574	E	83.7	Confident	82.5	Confident	117 Å²	117	44.9 Å²	44.9	55%	0.547	24%	0.242	S	C	.	.	H	α-helix	trans	-89.7	-47.6	-175.3	-57.1	-149.3	130.5	0	0	113.2	K543 N570	K543-E574 IonicContact NZ-OE1 2.67Å; K543-E574 PolarHBondContact NZ-OE1 3.39Å; N570-E574 PolarHBondContact O-N 2.93Å
575	N	76.3	Confident	82.3	Confident	105 Å²	105	48 Å²	48	56%	0.561	26%	0.255	S	S	*	.	H	α-helix	trans	-84.6	-14.2	-177.5	-53.3	-77.4	0	0	0	113.3	Q538 D571	Q538-N575 PolarHBondContact NE2-O 3.05Å; D571-N575 VanDerWaalsContact O-CB 3.27Å; D571-N575 WeakPolarHBondContact O-CB 3.42Å; D571-N575 PolarHBondContact O-N 3.23Å; D571-N575 PolarHBondContact O-ND2 3.07Å
576	G	80.6	Confident	82.3	Confident	10 Å²	10	50.1 Å²	50.1	10%	0.103	26%	0.262	C	S	.	.			trans	71.5	-168.5	-170.6	0	0	0	0	0	112.8	T539 I572	T539-G576 WeakPolarHBondContact O-CA 3.29Å; I572-G576 VanDerWaalsContact O-CA 3.3Å; I572-G576 WeakPolarHBondContact O-CA 3.34Å; I572-G576 PolarHBondContact O-N 3.18Å; I572-G576 VanDerWaalsContact O-N 3.15Å
577	V	82.8	Confident	82.5	Confident	2 Å²	2	45.1 Å²	45.1	1%	0.012	24%	0.236	C	C	.	.			trans	-137	141.6	-164.1	-173.8	0	0	0	0	110.1	L516 T539 I572 T579 Y720 A723	L516-V577 HydrophobicContact CD2-CB 4.19Å; L516-V577 HydrophobicContact CD2-CG1 4.34Å; L516-V577 HydrophobicContact CD2-CG2 4.33Å; T539-V577 PolarHBondContact N-O 3.3Å; T539-V577 PolarHBondContact OG1-N 3.33Å; T539-V577 PolarHBondContact OG1-O 2.67Å; I572-V577 HydrophobicContact CB-CG2 4.37Å; I572-V577 HydrophobicContact CG1-CG2 4.36Å; I572-V577 HydrophobicContact CG2-CG2 3.64Å; V577-T579 PolarHBondContact O-N 3.19Å; V577-Y720 VanDerWaalsContact CG1-CA 3.48Å; V577-Y720 HydrophobicContact CG1-CD2 3.89Å; V577-Y720 HydrophobicContact CG1-CG 4.37Å; V577-A723 HydrophobicContact CG2-CB 4.13Å
578	W	83.8	Confident	82.5	Confident	58 Å²	58	45.8 Å²	45.8	22%	0.22	23%	0.229	C	C	.	.	B	Isolated β-bridge	trans	-62.7	134	172.1	-67.9	83.8	0	0	0	111	N537 L583 R586 D716 Y720	N537-W578 HydrophobicContact CB-CE3 4.27Å; N537-W578 HydrophobicContact CB-CZ3 4.06Å; W578-L583 HydrophobicContact CB-CB 4.35Å; W578-L583 HydrophobicContact CB-CD1 4.41Å; W578-R586 VanDerWaalsContact CZ2-NH1 3.28Å; W578-R586 VanDerWaalsContact NE1-NH1 3.14Å; W578-D716 VanDerWaalsContact CD1-CG 3.45Å; W578-D716 HydrophobicContact CG-CB 4.42Å; W578-D716 PolarHBondContact NE1-OD1 3.35Å; W578-Y720 WeakPolarHBondContact O-CD2 3.45Å
579	T	81.9	Confident	82.7	Confident	11 Å²	11	52.4 Å²	52.4	7%	0.067	26%	0.257	C	S	.	.			trans	-68.7	156.6	170.4	71.1	0	0	0	0	109.5	D519 N537 T539 V577 N581 G582 L583	D519-T579 PolarHBondContact OD1-OG1 3.11Å; N537-T579 PolarHBondContact O-N 3.15Å; N537-T579 VanDerWaalsContact O-N 3.1Å; T539-T579 HydrophobicContact CG2-CG2 3.92Å; V577-T579 PolarHBondContact O-N 3.19Å; T579-N581 PolarHBondContact O-N 3.11Å; T579-G582 CarbonylContact O-C 3.56Å; T579-G582 WeakPolarHBondContact O-CA 3.33Å; T579-G582 PolarHBondContact O-N 3.48Å; T579-G582 PolarHBondContact OG1-N 3.32Å; T579-G582 VanDerWaalsContact OG1-N 3.15Å; T579-L583 WeakPolarHBondContact O-CB 3.32Å; T579-L583 PolarHBondContact O-N 3.05Å
580	E	79.5	Confident	83.1	Confident	29 Å²	29	51.6 Å²	51.6	14%	0.136	25%	0.251	C	S	.	.	H	α-helix	trans	-53.5	-42.6	-177.9	-165.1	-173.4	116.8	0	0	112.2	L583 K584 Y720 K724	E580-L583 CarbonylContact O-C 3.38Å; E580-L583 WeakPolarHBondContact O-CB 3.21Å; E580-L583 PolarHBondContact O-N 3.26Å; E580-K584 WeakPolarHBondContact O-CG 3.47Å; E580-K584 PolarHBondContact O-N 3.4Å; E580-K584 WeakPolarHBondContact OE1-CE 3.44Å; E580-K584 IonicContact OE1-NZ 2.76Å; E580-K584 PolarHBondContact OE1-NZ 3.39Å; E580-Y720 HydrophobicContact CB-CE1 4.2Å; E580-Y720 HydrophobicContact CG-CE1 4.29Å; E580-K724 IonicContact OE2-NZ 3.99Å; E580-K724 PolarHBondContact OE2-NZ 3.45Å; E580-K724 VanDerWaalsContact OE2-NZ 3.09Å
581	N	77.3	Confident	83.4	Confident	57 Å²	57	45.9 Å²	45.9	31%	0.305	22%	0.22	S	C	.	.	H	α-helix	trans	-79.4	-28.6	179.4	-163.2	-11	0	0	0	112.5	D519 T579 L583 K584 K585	D519-N581 VanDerWaalsContact CG-CB 3.48Å; D519-N581 WeakPolarHBondContact OD1-CB 3.24Å; D519-N581 WeakPolarHBondContact OD2-CB 3.49Å; D519-N581 VanDerWaalsContact OD2-CG 3.26Å; D519-N581 PolarHBondContact OD2-ND2 2.97Å; T579-N581 PolarHBondContact O-N 3.11Å; N581-L583 VanDerWaalsContact C-N 3.25Å; N581-L583 PolarHBondContact O-N 3.48Å; N581-K584 PolarHBondContact O-N 2.89Å; N581-K585 WeakPolarHBondContact O-CB 3.27Å; N581-K585 VanDerWaalsContact O-CD 3.27Å; N581-K585 WeakPolarHBondContact O-CD 3.37Å; N581-K585 WeakPolarHBondContact O-CG 3.38Å; N581-K585 PolarHBondContact O-N 3.26Å; N581-K585 VanDerWaalsContact OD1-CE 3.26Å; N581-K585 WeakPolarHBondContact OD1-CE 3.27Å
582	G	82.1	Confident	83.7	Confident	1 Å²	1	45 Å²	45	1%	0.01	22%	0.216	C	C	.	.	H	α-helix	trans	-57.6	-41.9	163.8	0	0	0	0	0	111.8	T579 R586	T579-G582 CarbonylContact O-C 3.56Å; T579-G582 WeakPolarHBondContact O-CA 3.33Å; T579-G582 PolarHBondContact O-N 3.48Å; T579-G582 PolarHBondContact OG1-N 3.32Å; T579-G582 VanDerWaalsContact OG1-N 3.15Å; G582-R586 WeakPolarHBondContact O-CB 3.3Å; G582-R586 PolarHBondContact O-N 3.26Å
583	L	86.7	Confident	83.9	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-72.5	-36.1	177.4	-167.6	69.6	0	0	0	112.4	W578 T579 E580 N581 R586 F587 L692 W713 D716 A717	W578-L583 HydrophobicContact CB-CB 4.35Å; W578-L583 HydrophobicContact CB-CD1 4.41Å; T579-L583 WeakPolarHBondContact O-CB 3.32Å; T579-L583 PolarHBondContact O-N 3.05Å; E580-L583 CarbonylContact O-C 3.38Å; E580-L583 WeakPolarHBondContact O-CB 3.21Å; E580-L583 PolarHBondContact O-N 3.26Å; N581-L583 VanDerWaalsContact C-N 3.25Å; N581-L583 PolarHBondContact O-N 3.48Å; L583-R586 PolarHBondContact O-N 3.49Å; L583-F587 VanDerWaalsContact O-CB 3.28Å; L583-F587 WeakPolarHBondContact O-CB 3.38Å; L583-F587 PolarHBondContact O-N 3.03Å; L583-L692 HydrophobicContact CD2-CD1 3.71Å; L583-L692 HydrophobicContact CD2-CD2 3.8Å; L583-L692 HydrophobicContact CD2-CG 4.38Å; L583-W713 HydrophobicContact CD1-CD2 4.34Å; L583-W713 HydrophobicContact CD1-CG 4.34Å; L583-W713 HydrophobicContact CD1-CZ2 4.24Å; L583-W713 VanDerWaalsContact CD1-NE1 3.33Å; L583-W713 HydrophobicContact CD2-CZ2 4.17Å; L583-W713 HydrophobicContact CG-CZ2 3.82Å; L583-W713 PolarHBondContact O-NE1 2.96Å; L583-D716 HydrophobicContact CD1-CB 4.28Å; L583-A717 HydrophobicContact CD1-CB 4.22Å; L583-A717 HydrophobicContact CD2-CB 3.77Å; L583-A717 HydrophobicContact CG-CB 4.49Å
584	K	84.8	Confident	84	Confident	40 Å²	40	47.5 Å²	47.5	17%	0.174	23%	0.231	C	C	.	.	H	α-helix	trans	-61.3	-51.3	168.2	-72.7	178.1	177.8	-179.7	0	111.3	E580 N581 R586 F587 E588 M673 D676	E580-K584 WeakPolarHBondContact O-CG 3.47Å; E580-K584 PolarHBondContact O-N 3.4Å; E580-K584 WeakPolarHBondContact OE1-CE 3.44Å; E580-K584 IonicContact OE1-NZ 2.76Å; E580-K584 PolarHBondContact OE1-NZ 3.39Å; N581-K584 PolarHBondContact O-N 2.89Å; K584-R586 VanDerWaalsContact C-N 3.3Å; K584-R586 PolarHBondContact O-N 3.18Å; K584-F587 WeakPolarHBondContact O-CB 3.48Å; K584-F587 PolarHBondContact O-N 3.37Å; K584-F587 VanDerWaalsContact O-N 3.1Å; K584-E588 PolarHBondContact O-N 3.43Å; K584-M673 HydrophobicContact CB-CE 4.37Å; K584-M673 HydrophobicContact CG-CE 3.84Å; K584-D676 IonicContact NZ-OD1 2.69Å; K584-D676 PolarHBondContact NZ-OD1 2.87Å; K584-D676 IonicContact NZ-OD2 3.85Å
585	K	83.9	Confident	84.1	Confident	82 Å²	82	44.4 Å²	44.4	36%	0.357	21%	0.214	S	C	.	.	H	α-helix	trans	-61.8	-34.9	176.8	-65.4	157	-166.9	151	0	112.9	N537 N581	N537-K585 WeakPolarHBondContact OD1-CD 3.44Å; N537-K585 PolarHBondContact OD1-NZ 2.9Å; N581-K585 WeakPolarHBondContact O-CB 3.27Å; N581-K585 VanDerWaalsContact O-CD 3.27Å; N581-K585 WeakPolarHBondContact O-CD 3.37Å; N581-K585 WeakPolarHBondContact O-CG 3.38Å; N581-K585 PolarHBondContact O-N 3.26Å; N581-K585 VanDerWaalsContact OD1-CE 3.26Å; N581-K585 WeakPolarHBondContact OD1-CE 3.27Å
586	R	86.3	Confident	84.4	Confident	52 Å²	52	41.8 Å²	41.8	20%	0.196	20%	0.2	C	C	.	.	H	α-helix	trans	-73.8	-37.1	173.7	-172.5	172.1	164.2	-165.7	-16.2	111.3	W578 G582 L583 K584 E588 K589 V590 D716	W578-R586 VanDerWaalsContact CZ2-NH1 3.28Å; W578-R586 VanDerWaalsContact NE1-NH1 3.14Å; G582-R586 WeakPolarHBondContact O-CB 3.3Å; G582-R586 PolarHBondContact O-N 3.26Å; L583-R586 PolarHBondContact O-N 3.49Å; K584-R586 VanDerWaalsContact C-N 3.3Å; K584-R586 PolarHBondContact O-N 3.18Å; R586-E588 PolarHBondContact O-N 2.88Å; R586-K589 PolarHBondContact O-N 3.46Å; R586-V590 HydrophobicContact CG-CG2 4.32Å; R586-V590 WeakPolarHBondContact O-CG2 3.49Å; R586-V590 PolarHBondContact O-N 2.79Å; R586-D716 IonicContact CZ-OD2 3.78Å; R586-D716 VanDerWaalsContact NH1-CG 3.31Å; R586-D716 IonicContact NH1-OD1 3.73Å; R586-D716 IonicContact NH1-OD2 3.38Å; R586-D716 PolarHBondContact NH1-OD2 2.88Å; R586-D716 IonicContact NH2-OD2 3.54Å; R586-D716 PolarHBondContact NH2-OD2 3.24Å
587	F	88.2	Confident	84.6	Confident	3 Å²	3	42.2 Å²	42.2	1%	0.013	20%	0.2	C	C	.	.	H	α-helix	trans	-58.1	-44.3	173.5	173	-99.7	0	0	0	111.5	L583 K584 K589 V590 F591 A669 K670 M673 L699 W713	L583-F587 VanDerWaalsContact O-CB 3.28Å; L583-F587 WeakPolarHBondContact O-CB 3.38Å; L583-F587 PolarHBondContact O-N 3.03Å; K584-F587 WeakPolarHBondContact O-CB 3.48Å; K584-F587 PolarHBondContact O-N 3.37Å; K584-F587 VanDerWaalsContact O-N 3.1Å; F587-K589 VanDerWaalsContact C-N 3.25Å; F587-K589 PolarHBondContact O-N 2.75Å; F587-V590 CarbonylContact O-C 3.47Å; F587-V590 PolarHBondContact O-N 3.05Å; F587-V590 VanDerWaalsContact O-N 3.13Å; F587-F591 HydrophobicContact CD1-CB 4.42Å; F587-F591 HydrophobicContact CE1-CB 3.97Å; F587-F591 HydrophobicContact CE1-CD2 4.37Å; F587-F591 HydrophobicContact CE1-CG 4.36Å; F587-F591 HydrophobicContact CE2-CB 4.18Å; F587-F591 HydrophobicContact CZ-CB 3.85Å; F587-F591 AromaticContact CZ-CD2 3.92Å; F587-F591 HydrophobicContact CZ-CD2 3.92Å; F587-F591 HydrophobicContact CZ-CG 4.23Å; F587-F591 VanDerWaalsContact O-CB 3.22Å; F587-F591 WeakPolarHBondContact O-CB 3.3Å; F587-F591 PolarHBondContact O-N 2.86Å; F587-A669 HydrophobicContact CE2-CB 4.5Å; F587-A669 HydrophobicContact CZ-CB 4.37Å; F587-K670 HydrophobicContact CE1-CB 3.85Å; F587-K670 HydrophobicContact CE1-CG 4.14Å; F587-K670 HydrophobicContact CZ-CB 3.94Å; F587-M673 HydrophobicContact CB-CE 3.75Å; F587-M673 HydrophobicContact CB-SD 3.8Å; F587-M673 HydrophobicContact CD1-CB 4.31Å; F587-M673 HydrophobicContact CD1-CE 4.26Å; F587-M673 HydrophobicContact CD1-CG 4.49Å; F587-M673 HydrophobicContact CD1-SD 3.54Å; F587-M673 VanDerWaalsContact CD1-SD 3.54Å; F587-M673 HydrophobicContact CD2-SD 3.53Å; F587-M673 VanDerWaalsContact CD2-SD 3.53Å; F587-M673 HydrophobicContact CE1-CB 4.33Å; F587-M673 HydrophobicContact CE1-SD 3.97Å; F587-M673 HydrophobicContact CE2-SD 3.97Å; F587-M673 HydrophobicContact CG-CE 3.94Å; F587-M673 HydrophobicContact CG-SD 3.3Å; F587-M673 WeakPolarHBondContact CG-SD 3.24Å; F587-M673 HydrophobicContact CZ-SD 4.16Å; F587-L699 HydrophobicContact CD2-CD1 3.96Å; F587-L699 HydrophobicContact CE2-CD1 3.7Å; F587-L699 HydrophobicContact CE2-CD2 4.2Å; F587-L699 HydrophobicContact CE2-CG 4.39Å; F587-W713 HydrophobicContact CB-CZ2 4.08Å; F587-W713 HydrophobicContact CD2-CZ2 4.17Å; F587-W713 HydrophobicContact CG-CZ2 4.45Å
588	E	86.4	Confident	84.4	Confident	102 Å²	102	42.3 Å²	42.3	48%	0.477	20%	0.201	S	C	.	.	H	α-helix	trans	-56.3	-40.3	178	-67.7	-161.7	122.5	0	0	112.8	K584 R586 N592	K584-E588 PolarHBondContact O-N 3.43Å; R586-E588 PolarHBondContact O-N 2.88Å; E588-N592 WeakPolarHBondContact O-CB 3.43Å; E588-N592 VanDerWaalsContact O-CG 3.24Å; E588-N592 PolarHBondContact O-N 3.4Å; E588-N592 VanDerWaalsContact O-N 3.15Å; E588-N592 PolarHBondContact O-ND2 2.97Å
589	K	86.5	Confident	84	Confident	153 Å²	153	43.3 Å²	43.3	67%	0.665	21%	0.211	S	C	*	.	H	α-helix	trans	-67.1	-48.4	176	-62.2	176.4	-176.7	177.4	0	111.1	R586 F587 N592 V593	R586-K589 PolarHBondContact O-N 3.46Å; F587-K589 VanDerWaalsContact C-N 3.25Å; F587-K589 PolarHBondContact O-N 2.75Å; K589-N592 PolarHBondContact O-N 3.13Å; K589-V593 PolarHBondContact O-N 2.73Å
590	V	88.3	Confident	83.7	Confident	19 Å²	19	43.1 Å²	43.1	12%	0.115	21%	0.209	C	C	.	.	H	α-helix	trans	-63.1	-47.6	-180	170.8	0	0	0	0	110.9	R586 F587 N592 V593 C594 W713	R586-V590 HydrophobicContact CG-CG2 4.32Å; R586-V590 WeakPolarHBondContact O-CG2 3.49Å; R586-V590 PolarHBondContact O-N 2.79Å; F587-V590 CarbonylContact O-C 3.47Å; F587-V590 PolarHBondContact O-N 3.05Å; F587-V590 VanDerWaalsContact O-N 3.13Å; V590-N592 VanDerWaalsContact C-N 3.32Å; V590-N592 PolarHBondContact O-N 3.03Å; V590-V593 PolarHBondContact O-N 3.3Å; V590-V593 VanDerWaalsContact O-N 3.12Å; V590-C594 WeakPolarHBondContact O-CB 3.49Å; V590-C594 PolarHBondContact O-N 3.38Å; V590-C594 PolarHBondContact O-SG 3.23Å; V590-W713 HydrophobicContact CG1-CB 4.22Å; V590-W713 HydrophobicContact CG2-CB 4.19Å
591	F	87.4	Confident	83.4	Confident	5 Å²	5	45.7 Å²	45.7	2%	0.022	22%	0.224	C	C	.	.	H	α-helix	trans	-51.7	-47.9	172.9	170.7	-89.5	0	0	0	111.7	F587 V593 C594 R595 L666 K670	F587-F591 HydrophobicContact CD1-CB 4.42Å; F587-F591 HydrophobicContact CE1-CB 3.97Å; F587-F591 HydrophobicContact CE1-CD2 4.37Å; F587-F591 HydrophobicContact CE1-CG 4.36Å; F587-F591 HydrophobicContact CE2-CB 4.18Å; F587-F591 HydrophobicContact CZ-CB 3.85Å; F587-F591 AromaticContact CZ-CD2 3.92Å; F587-F591 HydrophobicContact CZ-CD2 3.92Å; F587-F591 HydrophobicContact CZ-CG 4.23Å; F587-F591 VanDerWaalsContact O-CB 3.22Å; F587-F591 WeakPolarHBondContact O-CB 3.3Å; F587-F591 PolarHBondContact O-N 2.86Å; F591-V593 VanDerWaalsContact C-N 3.33Å; F591-V593 PolarHBondContact O-N 2.64Å; F591-C594 PolarHBondContact O-N 3.48Å; F591-R595 HydrophobicContact CE1-CB 4.46Å; F591-R595 HydrophobicContact CZ-CB 4.49Å; F591-R595 HydrophobicContact CZ-CG 4.39Å; F591-R595 WeakPolarHBondContact O-CB 3.2Å; F591-R595 PolarHBondContact O-N 2.97Å; F591-L666 HydrophobicContact CD2-CB 4.25Å; F591-L666 HydrophobicContact CD2-CD2 4.39Å; F591-L666 HydrophobicContact CE2-CB 3.98Å; F591-L666 WeakPolarHBondContact CE2-O 3.35Å; F591-K670 HydrophobicContact CD1-CD 3.85Å; F591-K670 HydrophobicContact CD2-CB 3.8Å; F591-K670 HydrophobicContact CD2-CD 3.96Å; F591-K670 HydrophobicContact CD2-CG 4.42Å; F591-K670 HydrophobicContact CE1-CD 3.51Å; F591-K670 HydrophobicContact CE2-CB 3.63Å; F591-K670 HydrophobicContact CE2-CD 3.61Å; F591-K670 HydrophobicContact CE2-CG 4.25Å; F591-K670 HydrophobicContact CG-CD 4.08Å; F591-K670 HydrophobicContact CZ-CB 4.27Å; F591-K670 HydrophobicContact CZ-CD 3.37Å; F591-K670 HydrophobicContact CZ-CG 4.45Å
592	N	85.3	Confident	83.1	Confident	80 Å²	80	49.5 Å²	49.5	43%	0.428	24%	0.24	S	C	.	.	H	α-helix	trans	-63.1	-38	-179.8	-75.2	-31.1	0	0	0	112.2	E588 K589 V590 N596	E588-N592 WeakPolarHBondContact O-CB 3.43Å; E588-N592 VanDerWaalsContact O-CG 3.24Å; E588-N592 PolarHBondContact O-N 3.4Å; E588-N592 VanDerWaalsContact O-N 3.15Å; E588-N592 PolarHBondContact O-ND2 2.97Å; K589-N592 PolarHBondContact O-N 3.13Å; V590-N592 VanDerWaalsContact C-N 3.32Å; V590-N592 PolarHBondContact O-N 3.03Å; N592-N596 PolarHBondContact O-N 2.89Å; N592-N596 PolarHBondContact O-ND2 2.66Å; N592-N596 PolarHBondContact O-OD1 2.97Å
593	V	87.3	Confident	82.4	Confident	71 Å²	71	54.9 Å²	54.9	43%	0.43	27%	0.273	S	S	.	.	H	α-helix	trans	-71.6	-49.7	174.7	-176.8	0	0	0	0	111	K589 V590 F591 R595 N596 V597 V709	K589-V593 PolarHBondContact O-N 2.73Å; V590-V593 PolarHBondContact O-N 3.3Å; V590-V593 VanDerWaalsContact O-N 3.12Å; F591-V593 VanDerWaalsContact C-N 3.33Å; F591-V593 PolarHBondContact O-N 2.64Å; V593-R595 VanDerWaalsContact C-N 3.29Å; V593-R595 PolarHBondContact O-N 3.15Å; V593-N596 WeakPolarHBondContact O-CB 3.43Å; V593-N596 PolarHBondContact O-N 2.91Å; V593-N596 VanDerWaalsContact O-N 3.12Å; V593-V597 WeakPolarHBondContact O-CB 3.48Å; V593-V597 WeakPolarHBondContact O-CG2 3.35Å; V593-V597 PolarHBondContact O-N 3.06Å; V593-V709 HydrophobicContact CB-CG1 3.99Å; V593-V709 HydrophobicContact CG1-CG1 3.73Å; V593-V709 HydrophobicContact CG1-CG2 4.3Å
594	C	85.9	Confident	81.3	Confident	1 Å²	1	60.7 Å²	60.7	1%	0.007	31%	0.313	C	S	.	.	H	α-helix	trans	-57.5	-40.4	178.2	-66.3	0	0	0	0	112.1	V590 F591 N596 V597 A598 L666 S706 V709	V590-C594 WeakPolarHBondContact O-CB 3.49Å; V590-C594 PolarHBondContact O-N 3.38Å; V590-C594 PolarHBondContact O-SG 3.23Å; F591-C594 PolarHBondContact O-N 3.48Å; C594-N596 PolarHBondContact O-N 2.98Å; C594-V597 CarbonylContact O-C 3.54Å; C594-V597 PolarHBondContact O-N 3.2Å; C594-A598 WeakPolarHBondContact O-CA 3.27Å; C594-A598 WeakPolarHBondContact O-CB 3.43Å; C594-A598 PolarHBondContact O-N 2.95Å; C594-L666 HydrophobicContact CB-CD1 3.91Å; C594-L666 HydrophobicContact CB-CD2 3.67Å; C594-L666 HydrophobicContact CB-CG 4.47Å; C594-S706 PolarHBondContact SG-O 2.89Å; C594-S706 VanDerWaalsContact SG-O 3.4Å; C594-V709 VanDerWaalsContact SG-CG1 3.56Å
595	R	84	Confident	80.3	Confident	52 Å²	52	59.5 Å²	59.5	20%	0.196	31%	0.312	C	S	.	.	H	α-helix	trans	-66.3	-35.2	178.3	-165.6	-170.6	69	128.1	14.8	112.2	F591 V593 V597 S617 F663 L666	F591-R595 HydrophobicContact CE1-CB 4.46Å; F591-R595 HydrophobicContact CZ-CB 4.49Å; F591-R595 HydrophobicContact CZ-CG 4.39Å; F591-R595 WeakPolarHBondContact O-CB 3.2Å; F591-R595 PolarHBondContact O-N 2.97Å; V593-R595 VanDerWaalsContact C-N 3.29Å; V593-R595 PolarHBondContact O-N 3.15Å; R595-V597 PolarHBondContact O-N 3.18Å; R595-S617 PolarHBondContact NH1-O 3.39Å; R595-S617 PolarHBondContact NH2-O 3.2Å; R595-S617 PolarHBondContact NH2-OG 3.15Å; R595-S617 VanDerWaalsContact O-CB 3.24Å; R595-S617 WeakPolarHBondContact O-CB 3.47Å; R595-F663 HydrophobicContact CG-CD1 4.33Å; R595-F663 HydrophobicContact CG-CE1 4.48Å; R595-F663 WeakPolarHBondContact O-CE1 3.22Å; R595-L666 HydrophobicContact CB-CD1 4.33Å
596	N	83.1	Confident	79.8	Confident	49 Å²	49	58.1 Å²	58.1	26%	0.262	31%	0.313	S	S	.	.	H	α-helix	trans	-68.5	-20.7	172.5	-66.2	-14.4	0	0	0	112.6	N592 V593 C594 S613 W614 S617	N592-N596 PolarHBondContact O-N 2.89Å; N592-N596 PolarHBondContact O-ND2 2.66Å; N592-N596 PolarHBondContact O-OD1 2.97Å; V593-N596 WeakPolarHBondContact O-CB 3.43Å; V593-N596 PolarHBondContact O-N 2.91Å; V593-N596 VanDerWaalsContact O-N 3.12Å; C594-N596 PolarHBondContact O-N 2.98Å; N596-S613 CarbonylContact O-C 3.57Å; N596-S613 WeakPolarHBondContact O-CB 3.42Å; N596-S613 PolarHBondContact O-OG 3.24Å; N596-W614 PolarHBondContact O-N 3.1Å; N596-S617 PolarHBondContact OD1-OG 3.48Å
597	V	84.2	Confident	79.3	Confident	19 Å²	19	63 Å²	63	12%	0.115	34%	0.342	C	S	.	.	H	α-helix	trans	-111.8	-0.2	-170.7	174.3	0	0	0	0	112.3	V593 C594 R595 L599 I600 Q705	V593-V597 WeakPolarHBondContact O-CB 3.48Å; V593-V597 WeakPolarHBondContact O-CG2 3.35Å; V593-V597 PolarHBondContact O-N 3.06Å; C594-V597 CarbonylContact O-C 3.54Å; C594-V597 PolarHBondContact O-N 3.2Å; R595-V597 PolarHBondContact O-N 3.18Å; V597-L599 VanDerWaalsContact C-N 3.3Å; V597-L599 PolarHBondContact O-N 2.84Å; V597-I600 HydrophobicContact CB-CD1 4.37Å; V597-I600 HydrophobicContact CG1-CD1 4.07Å; V597-I600 PolarHBondContact O-N 3.45Å; V597-I600 VanDerWaalsContact O-N 3.15Å; V597-Q705 HydrophobicContact CG1-CB 3.52Å; V597-Q705 HydrophobicContact CG1-CG 3.53Å
598	A	78.8	Confident	78.7	Confident	4 Å²	4	72.4 Å²	72.4	3%	0.033	38%	0.378	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-19.9	-166.6	0	0	0	0	0	115.7	C594 S613 S662 F663 L666	C594-A598 WeakPolarHBondContact O-CA 3.27Å; C594-A598 WeakPolarHBondContact O-CB 3.43Å; C594-A598 PolarHBondContact O-N 2.95Å; A598-S613 PolarHBondContact N-OG 2.92Å; A598-S662 WeakPolarHBondContact O-CB 3.44Å; A598-S662 PolarHBondContact O-OG 3.03Å; A598-F663 HydrophobicContact CB-CD1 3.96Å; A598-F663 HydrophobicContact CB-CD2 4.02Å; A598-F663 HydrophobicContact CB-CE1 3.77Å; A598-F663 HydrophobicContact CB-CE2 3.83Å; A598-F663 HydrophobicContact CB-CG 4.09Å; A598-F663 HydrophobicContact CB-CZ 3.71Å; A598-L666 HydrophobicContact CB-CD1 3.84Å
599	L	75.2	Confident	78.3	Confident	79 Å²	79	71.6 Å²	71.6	41%	0.414	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85	-15.7	177.4	-165.4	68.7	0	0	0	113.1	V597 D601 L612 S613 F663	V597-L599 VanDerWaalsContact C-N 3.3Å; V597-L599 PolarHBondContact O-N 2.84Å; L599-D601 PolarHBondContact O-N 2.72Å; L599-L612 HydrophobicContact CD2-CB 4.43Å; L599-S613 PolarHBondContact N-OG 2.95Å; L599-F663 HydrophobicContact CB-CE2 4.16Å; L599-F663 HydrophobicContact CB-CZ 4.35Å; L599-F663 HydrophobicContact CD1-CE2 4.36Å
600	I	76.7	Confident	78	Confident	7 Å²	7	69 Å²	69	4%	0.036	36%	0.36	C	S	.	.			trans	-82.5	101.5	-176.3	-62.3	126.2	0	0	0	109.8	V597 Y610 G704 Q705	V597-I600 HydrophobicContact CB-CD1 4.37Å; V597-I600 HydrophobicContact CG1-CD1 4.07Å; V597-I600 PolarHBondContact O-N 3.45Å; V597-I600 VanDerWaalsContact O-N 3.15Å; I600-Y610 HydrophobicContact CD1-CD1 3.5Å; I600-Y610 HydrophobicContact CD1-CD2 4.24Å; I600-Y610 HydrophobicContact CD1-CE1 3.58Å; I600-Y610 HydrophobicContact CD1-CE2 4.3Å; I600-Y610 HydrophobicContact CD1-CG 3.86Å; I600-Y610 HydrophobicContact CG1-CD1 4.4Å; I600-Y610 HydrophobicContact CG1-CD2 4.31Å; I600-Y610 HydrophobicContact CG1-CE1 4.35Å; I600-Y610 HydrophobicContact CG1-CE2 4.25Å; I600-Y610 HydrophobicContact CG1-CG 4.38Å; I600-Y610 HydrophobicContact CG2-CE2 4.38Å; I600-G704 WeakPolarHBondContact O-CA 3.46Å; I600-Q705 HydrophobicContact CB-CB 4.44Å; I600-Q705 HydrophobicContact CG2-CB 4.14Å; I600-Q705 PolarHBondContact O-N 2.89Å; I600-Q705 VanDerWaalsContact O-N 3.13Å
601	D	72.8	Confident	77.7	Confident	84 Å²	84	70 Å²	70	45%	0.449	37%	0.371	S	S	.	.			trans	-66.8	177.8	172.8	-132.6	-12.2	0	0	0	111.2	L599 T603 R659	L599-D601 PolarHBondContact O-N 2.72Å; D601-T603 PolarHBondContact O-N 3.12Å; D601-T603 VanDerWaalsContact O-N 3.11Å; D601-R659 IonicContact OD1-NH2 2.65Å; D601-R659 IonicContact OD2-NH2 2.74Å
602	E	71.6	Confident	77.2	Confident	137 Å²	137	74.6 Å²	74.6	64%	0.64	40%	0.395	S	S	*	.	S	Bend	trans	-69.3	-11.3	-168.2	-65.1	170.2	-171.5	0	0	114.7	G704	E602-G704 VanDerWaalsContact CG-CA 3.49Å; E602-G704 PolarHBondContact OE1-N 2.65Å
603	T	66.1	Low	76.8	Confident	114 Å²	114	70.8 Å²	70.8	70%	0.699	38%	0.375	S	S	*	.	S	Bend	trans	-90.5	130.8	170.5	50.7	0	0	0	0	111	D601 G605	D601-T603 PolarHBondContact O-N 3.12Å; D601-T603 VanDerWaalsContact O-N 3.11Å; T603-G605 PolarHBondContact O-N 3.44Å
604	S	64.2	Low	76.6	Confident	122 Å²	122	74.2 Å²	74.2	85%	0.853	38%	0.38	S	S	*	.			trans	-50.5	98.3	-175.8	57	0	0	0	0	114
605	G	63.8	Low	76.4	Confident	14 Å²	14	78.4 Å²	78.4	14%	0.144	40%	0.402	C	S	.	.			trans	-69	151.5	-178.3	0	0	0	0	0	113.4	T603 E609	T603-G605 PolarHBondContact O-N 3.44Å; G605-E609 WeakPolarHBondContact CA-OE2 3.45Å
606	S	73.4	Confident	76	Confident	54 Å²	54	79 Å²	79	38%	0.378	41%	0.407	S	S	.	.			trans	-65.3	159.7	177.4	71.5	0	0	0	0	112.3	W608 E609 Y610	S606-W608 PolarHBondContact O-N 3.41Å; S606-W608 PolarHBondContact OG-N 2.99Å; S606-E609 WeakPolarHBondContact CB-OE1 3.24Å; S606-E609 PolarHBondContact N-OE1 3.25Å; S606-E609 PolarHBondContact N-OE2 3.35Å; S606-E609 WeakPolarHBondContact O-CA 3.49Å; S606-E609 WeakPolarHBondContact O-CB 3.31Å; S606-E609 PolarHBondContact O-N 3.3Å; S606-E609 PolarHBondContact OG-N 3.45Å; S606-E609 PolarHBondContact OG-OE1 2.92Å; S606-Y610 WeakPolarHBondContact O-CD2 3.09Å; S606-Y610 PolarHBondContact O-N 3.35Å; S606-Y610 VanDerWaalsContact O-N 3.09Å
607	L	77.2	Confident	75.6	Confident	153 Å²	153	76.6 Å²	76.6	80%	0.801	39%	0.394	S	S	*	.	H	α-helix	trans	-55.6	-26.9	174.5	-66	174.7	0	0	0	112.8	A611	L607-A611 PolarHBondContact O-N 3.07Å
608	W	75	Confident	75.3	Confident	202 Å²	202	79.8 Å²	79.8	77%	0.765	41%	0.409	S	S	*	.	H	α-helix	trans	-75.5	-31.1	173.9	-71.9	113.8	0	0	0	113.2	S606 A611 L612	S606-W608 PolarHBondContact O-N 3.41Å; S606-W608 PolarHBondContact OG-N 2.99Å; W608-A611 HydrophobicContact CE3-CB 4.28Å; W608-A611 PolarHBondContact O-N 3.1Å; W608-L612 VanDerWaalsContact O-CB 3.32Å; W608-L612 WeakPolarHBondContact O-CB 3.45Å; W608-L612 WeakPolarHBondContact O-CG 3.43Å; W608-L612 PolarHBondContact O-N 3.24Å
609	E	77.3	Confident	74.8	Confident	85 Å²	85	85.9 Å²	85.9	40%	0.397	44%	0.441	S	S	.	.	H	α-helix	trans	-68.9	-36.5	169.6	-71.6	146.4	-107.4	0	0	111.7	G605 S606 L612 S613	G605-E609 WeakPolarHBondContact CA-OE2 3.45Å; S606-E609 WeakPolarHBondContact CB-OE1 3.24Å; S606-E609 PolarHBondContact N-OE1 3.25Å; S606-E609 PolarHBondContact N-OE2 3.35Å; S606-E609 WeakPolarHBondContact O-CA 3.49Å; S606-E609 WeakPolarHBondContact O-CB 3.31Å; S606-E609 PolarHBondContact O-N 3.3Å; S606-E609 PolarHBondContact OG-N 3.45Å; S606-E609 PolarHBondContact OG-OE1 2.92Å; E609-L612 PolarHBondContact O-N 3.5Å; E609-S613 WeakPolarHBondContact O-CB 3.45Å; E609-S613 PolarHBondContact O-N 3.23Å
610	Y	80.7	Confident	74.3	Confident	97 Å²	97	84.8 Å²	84.8	38%	0.38	44%	0.438	S	S	.	.	H	α-helix	trans	-62	-43	169.7	-81.1	-95.4	0	0	0	111.8	I600 S606 W614	I600-Y610 HydrophobicContact CD1-CD1 3.5Å; I600-Y610 HydrophobicContact CD1-CD2 4.24Å; I600-Y610 HydrophobicContact CD1-CE1 3.58Å; I600-Y610 HydrophobicContact CD1-CE2 4.3Å; I600-Y610 HydrophobicContact CD1-CG 3.86Å; I600-Y610 HydrophobicContact CG1-CD1 4.4Å; I600-Y610 HydrophobicContact CG1-CD2 4.31Å; I600-Y610 HydrophobicContact CG1-CE1 4.35Å; I600-Y610 HydrophobicContact CG1-CE2 4.25Å; I600-Y610 HydrophobicContact CG1-CG 4.38Å; I600-Y610 HydrophobicContact CG2-CE2 4.38Å; S606-Y610 WeakPolarHBondContact O-CD2 3.09Å; S606-Y610 PolarHBondContact O-N 3.35Å; S606-Y610 VanDerWaalsContact O-N 3.09Å; Y610-W614 WeakPolarHBondContact O-CB 3.47Å; Y610-W614 PolarHBondContact O-N 3.5Å
611	A	81.5	Confident	73.3	Confident	40 Å²	40	89.1 Å²	89.1	33%	0.331	46%	0.464	S	S	.	.	H	α-helix	trans	-66.1	-39.9	175.9	0	0	0	0	0	112.7	L607 W608 W614 L615	L607-A611 PolarHBondContact O-N 3.07Å; W608-A611 HydrophobicContact CE3-CB 4.28Å; W608-A611 PolarHBondContact O-N 3.1Å; A611-W614 PolarHBondContact O-N 2.78Å; A611-L615 VanDerWaalsContact O-CB 3.27Å; A611-L615 WeakPolarHBondContact O-CB 3.46Å; A611-L615 PolarHBondContact O-N 3.17Å
612	L	78.1	Confident	72.6	Confident	103 Å²	103	87.9 Å²	87.9	54%	0.539	46%	0.457	S	S	.	.	H	α-helix	trans	-67.3	-42.7	175	-84	160.7	0	0	0	112	L599 W608 E609 W614 L615 Q616	L599-L612 HydrophobicContact CD2-CB 4.43Å; W608-L612 VanDerWaalsContact O-CB 3.32Å; W608-L612 WeakPolarHBondContact O-CB 3.45Å; W608-L612 WeakPolarHBondContact O-CG 3.43Å; W608-L612 PolarHBondContact O-N 3.24Å; E609-L612 PolarHBondContact O-N 3.5Å; L612-W614 VanDerWaalsContact C-N 3.32Å; L612-W614 PolarHBondContact O-N 2.91Å; L612-L615 PolarHBondContact O-N 3.25Å; L612-Q616 WeakPolarHBondContact O-CB 3.49Å; L612-Q616 PolarHBondContact O-N 2.79Å
613	S	76.3	Confident	71.9	Confident	0 Å²	0	86.3 Å²	86.3	0%	0	46%	0.457	C	S	.	.	H	α-helix	trans	-57.9	-45.1	174.2	-174.8	0	0	0	0	111.2	N596 A598 L599 E609 S617	N596-S613 CarbonylContact O-C 3.57Å; N596-S613 WeakPolarHBondContact O-CB 3.42Å; N596-S613 PolarHBondContact O-OG 3.24Å; A598-S613 PolarHBondContact N-OG 2.92Å; L599-S613 PolarHBondContact N-OG 2.95Å; E609-S613 WeakPolarHBondContact O-CB 3.45Å; E609-S613 PolarHBondContact O-N 3.23Å; S613-S617 WeakPolarHBondContact O-CB 3.42Å; S613-S617 PolarHBondContact O-N 2.79Å
614	W	81.8	Confident	71.4	Confident	142 Å²	142	88.4 Å²	88.4	54%	0.538	46%	0.456	S	S	.	.	H	α-helix	trans	-67.1	-43.1	176	177.8	84.5	0	0	0	112.8	N596 Y610 A611 L612 S617 I618	N596-W614 PolarHBondContact O-N 3.1Å; Y610-W614 WeakPolarHBondContact O-CB 3.47Å; Y610-W614 PolarHBondContact O-N 3.5Å; A611-W614 PolarHBondContact O-N 2.78Å; L612-W614 VanDerWaalsContact C-N 3.32Å; L612-W614 PolarHBondContact O-N 2.91Å; W614-S617 WeakPolarHBondContact O-CB 3.42Å; W614-S617 PolarHBondContact O-N 3.49Å; W614-S617 PolarHBondContact O-OG 3.38Å; W614-I618 HydrophobicContact CD2-CD1 3.84Å; W614-I618 HydrophobicContact CE3-CD1 3.99Å; W614-I618 HydrophobicContact CH2-CD1 3.6Å; W614-I618 HydrophobicContact CZ2-CD1 3.42Å; W614-I618 VanDerWaalsContact CZ2-CD1 3.42Å; W614-I618 HydrophobicContact CZ3-CD1 3.88Å; W614-I618 PolarHBondContact O-N 2.83Å; W614-I618 VanDerWaalsContact O-N 3.11Å
615	L	81.8	Confident	71.3	Confident	89 Å²	89	85.2 Å²	85.2	47%	0.466	43%	0.426	S	S	.	.	H	α-helix	trans	-68.4	-37.6	178.6	-166.6	153.5	0	0	0	111.5	A611 L612 I618 L619	A611-L615 VanDerWaalsContact O-CB 3.27Å; A611-L615 WeakPolarHBondContact O-CB 3.46Å; A611-L615 PolarHBondContact O-N 3.17Å; L612-L615 PolarHBondContact O-N 3.25Å; L615-I618 PolarHBondContact O-N 2.94Å; L615-L619 HydrophobicContact CD2-CD1 3.68Å; L615-L619 HydrophobicContact CD2-CG 4.33Å; L615-L619 PolarHBondContact O-N 3.03Å
616	Q	76.6	Confident	71.2	Confident	64 Å²	64	92 Å²	92	30%	0.299	45%	0.451	S	S	.	.	H	α-helix	trans	-64.3	-40.7	169.8	-178	171.4	-12	0	0	111.2	L612 I618 L619 V620 F663	L612-Q616 WeakPolarHBondContact O-CB 3.49Å; L612-Q616 PolarHBondContact O-N 2.79Å; Q616-I618 PolarHBondContact O-N 3.11Å; Q616-L619 PolarHBondContact O-N 3.16Å; Q616-V620 HydrophobicContact CG-CG2 3.93Å; Q616-V620 WeakPolarHBondContact O-CB 3.27Å; Q616-V620 VanDerWaalsContact O-CG2 3.25Å; Q616-V620 WeakPolarHBondContact O-CG2 3.5Å; Q616-V620 PolarHBondContact O-N 3.1Å; Q616-F663 HydrophobicContact CB-CZ 4.31Å; Q616-F663 HydrophobicContact CG-CE1 4.3Å; Q616-F663 HydrophobicContact CG-CE2 4.2Å; Q616-F663 HydrophobicContact CG-CZ 3.84Å; Q616-F663 VanDerWaalsContact NE2-CE2 3.35Å
617	S	73.7	Confident	70.5	Confident	0 Å²	0	92.6 Å²	92.6	0%	0	46%	0.455	C	S	.	.	H	α-helix	trans	-58.1	-32.1	173.3	116.7	0	0	0	0	112.4	R595 N596 S613 W614	R595-S617 PolarHBondContact NH1-O 3.39Å; R595-S617 PolarHBondContact NH2-O 3.2Å; R595-S617 PolarHBondContact NH2-OG 3.15Å; R595-S617 VanDerWaalsContact O-CB 3.24Å; R595-S617 WeakPolarHBondContact O-CB 3.47Å; N596-S617 PolarHBondContact OD1-OG 3.48Å; S613-S617 WeakPolarHBondContact O-CB 3.42Å; S613-S617 PolarHBondContact O-N 2.79Å; W614-S617 WeakPolarHBondContact O-CB 3.42Å; W614-S617 PolarHBondContact O-N 3.49Å; W614-S617 PolarHBondContact O-OG 3.38Å
618	I	78.4	Confident	69.6	Low	85 Å²	85	88.3 Å²	88.3	44%	0.436	43%	0.433	S	S	.	.	H	α-helix	trans	-79.8	-41.3	177.1	-69	169.1	0	0	0	112	W614 L615 Q616	W614-I618 HydrophobicContact CD2-CD1 3.84Å; W614-I618 HydrophobicContact CE3-CD1 3.99Å; W614-I618 HydrophobicContact CH2-CD1 3.6Å; W614-I618 HydrophobicContact CZ2-CD1 3.42Å; W614-I618 VanDerWaalsContact CZ2-CD1 3.42Å; W614-I618 HydrophobicContact CZ3-CD1 3.88Å; W614-I618 PolarHBondContact O-N 2.83Å; W614-I618 VanDerWaalsContact O-N 3.11Å; L615-I618 PolarHBondContact O-N 2.94Å; Q616-I618 PolarHBondContact O-N 3.11Å
619	L	68.2	Low	69	Low	133 Å²	133	81.6 Å²	81.6	70%	0.696	41%	0.41	S	S	*	.	H	α-helix	trans	-74.7	-26.2	178.4	-82	175.9	0	0	0	114	L615 Q616 V621	L615-L619 HydrophobicContact CD2-CD1 3.68Å; L615-L619 HydrophobicContact CD2-CG 4.33Å; L615-L619 PolarHBondContact O-N 3.03Å; Q616-L619 PolarHBondContact O-N 3.16Å; L619-V621 PolarHBondContact O-N 2.91Å
620	V	64.5	Low	68.3	Low	56 Å²	56	79.7 Å²	79.7	34%	0.339	41%	0.408	S	S	.	.			trans	-75	78.5	170.4	178.9	0	0	0	0	108.8	Q616	Q616-V620 HydrophobicContact CG-CG2 3.93Å; Q616-V620 WeakPolarHBondContact O-CB 3.27Å; Q616-V620 VanDerWaalsContact O-CG2 3.25Å; Q616-V620 WeakPolarHBondContact O-CG2 3.5Å; Q616-V620 PolarHBondContact O-N 3.1Å
621	V	55.8	Low	67.3	Low	98 Å²	98	78.2 Å²	78.2	59%	0.594	41%	0.406	S	S	*	.			trans	-87.4	131.4	168.1	-177.9	0	0	0	0	108.3	L619 V623	L619-V621 PolarHBondContact O-N 2.91Å; V621-V623 HydrophobicContact CB-CG2 4.05Å; V621-V623 HydrophobicContact CG1-CG2 3.75Å; V621-V623 PolarHBondContact O-N 3.27Å
622	D	59.7	Low	66.3	Low	58 Å²	58	77.2 Å²	77.2	31%	0.31	40%	0.397	S	S	.	.			trans	-71.6	42.4	-175.3	-63.5	-62.3	0	0	0	114.8	K624 Y625 K626	D622-K624 VanDerWaalsContact C-N 3.32Å; D622-K624 PolarHBondContact O-N 3.45Å; D622-Y625 HydrophobicContact CB-CD2 4.16Å; D622-Y625 PolarHBondContact O-N 2.67Å; D622-K626 WeakPolarHBondContact O-CB 3.32Å; D622-K626 PolarHBondContact O-N 3.25Å
623	V	56.6	Low	65.5	Low	103 Å²	103	80.1 Å²	80.1	62%	0.624	40%	0.401	S	S	*	.	H	α-helix	trans	-57.8	-40.6	-173.7	-176.8	0	0	0	0	112.1	V621 C627	V621-V623 HydrophobicContact CB-CG2 4.05Å; V621-V623 HydrophobicContact CG1-CG2 3.75Å; V621-V623 PolarHBondContact O-N 3.27Å; V623-C627 VanDerWaalsContact O-CB 3.28Å; V623-C627 WeakPolarHBondContact O-CB 3.49Å; V623-C627 PolarHBondContact O-N 2.86Å; V623-C627 VanDerWaalsContact O-N 3.13Å
624	K	54.9	Low	64.9	Low	159 Å²	159	86.4 Å²	86.4	69%	0.691	43%	0.433	S	S	*	.	H	α-helix	trans	-60.4	-51.3	177.3	-78.8	-173.9	174.4	-178.8	0	111.9	D622 C627 L628	D622-K624 VanDerWaalsContact C-N 3.32Å; D622-K624 PolarHBondContact O-N 3.45Å; K624-C627 WeakPolarHBondContact O-CB 3.11Å; K624-C627 PolarHBondContact O-N 3.07Å; K624-L628 PolarHBondContact O-N 2.66Å
625	Y	62.5	Low	63.7	Low	54 Å²	54	85 Å²	85	21%	0.212	43%	0.43	C	S	.	.	H	α-helix	trans	-74.1	-38.2	-172.4	-49	-63.4	0	0	0	111.7	D622 C627 L628 E629 Y646 H664	D622-Y625 HydrophobicContact CB-CD2 4.16Å; D622-Y625 PolarHBondContact O-N 2.67Å; Y625-C627 PolarHBondContact O-N 3.06Å; Y625-L628 HydrophobicContact CD1-CD1 4.46Å; Y625-L628 PolarHBondContact O-N 3.09Å; Y625-E629 WeakPolarHBondContact O-CB 3.2Å; Y625-E629 PolarHBondContact O-N 2.86Å; Y625-Y646 AromaticContact CD1-CD2 3.82Å; Y625-Y646 HydrophobicContact CD1-CD2 3.82Å; Y625-Y646 AromaticContact CD1-CE2 3.9Å; Y625-Y646 HydrophobicContact CD1-CE2 3.9Å; Y625-Y646 AromaticContact CE1-CD2 3.57Å; Y625-Y646 HydrophobicContact CE1-CD2 3.57Å; Y625-Y646 AromaticContact CE1-CE2 3.4Å; Y625-Y646 HydrophobicContact CE1-CE2 3.4Å; Y625-Y646 HydrophobicContact CE2-CE2 4.43Å; Y625-Y646 AromaticContact CZ-CE2 3.72Å; Y625-H664 PolarHBondContact OH-NE2 3.02Å
626	K	61.4	Low	62.7	Low	157 Å²	157	85 Å²	85	68%	0.683	44%	0.436	S	S	*	.	H	α-helix	trans	-64.5	-29	173.5	-154.3	171.6	-168.2	174.4	0	112.5	D622 A630	D622-K626 WeakPolarHBondContact O-CB 3.32Å; D622-K626 PolarHBondContact O-N 3.25Å; K626-A630 WeakPolarHBondContact O-CB 3.08Å; K626-A630 PolarHBondContact O-N 3.44Å; K626-A630 VanDerWaalsContact O-N 3.16Å
627	C	59	Low	61.9	Low	67 Å²	67	89.5 Å²	89.5	45%	0.453	46%	0.462	S	S	.	.	H	α-helix	trans	-72.7	-46.4	170.7	-169	0	0	0	0	111.8	V623 K624 Y625 E629 A630 I631	V623-C627 VanDerWaalsContact O-CB 3.28Å; V623-C627 WeakPolarHBondContact O-CB 3.49Å; V623-C627 PolarHBondContact O-N 2.86Å; V623-C627 VanDerWaalsContact O-N 3.13Å; K624-C627 WeakPolarHBondContact O-CB 3.11Å; K624-C627 PolarHBondContact O-N 3.07Å; Y625-C627 PolarHBondContact O-N 3.06Å; C627-E629 VanDerWaalsContact C-N 3.31Å; C627-E629 PolarHBondContact O-N 2.84Å; C627-A630 WeakPolarHBondContact O-CB 3.46Å; C627-A630 PolarHBondContact O-N 3.42Å; C627-I631 VanDerWaalsContact O-CG1 3.24Å; C627-I631 WeakPolarHBondContact O-CG1 3.4Å; C627-I631 PolarHBondContact O-N 3.23Å
628	L	57.9	Low	61.1	Low	63 Å²	63	95.5 Å²	95.5	33%	0.33	49%	0.493	S	S	.	.	H	α-helix	trans	-59.4	-40.4	175.6	-74.7	169.5	0	0	0	112.4	K624 Y625 I631 S632	K624-L628 PolarHBondContact O-N 2.66Å; Y625-L628 HydrophobicContact CD1-CD1 4.46Å; Y625-L628 PolarHBondContact O-N 3.09Å; L628-I631 PolarHBondContact O-N 3.41Å; L628-S632 PolarHBondContact O-N 2.98Å; L628-S632 PolarHBondContact O-OG 2.92Å
629	E	62.9	Low	59.7	Low	61 Å²	61	93.9 Å²	93.9	29%	0.285	49%	0.485	S	S	.	.	H	α-helix	trans	-64.8	-41.3	174.9	-163.8	-159.6	158.3	0	0	112.1	Y625 C627 I631 S632 R633	Y625-E629 WeakPolarHBondContact O-CB 3.2Å; Y625-E629 PolarHBondContact O-N 2.86Å; C627-E629 VanDerWaalsContact C-N 3.31Å; C627-E629 PolarHBondContact O-N 2.84Å; E629-I631 VanDerWaalsContact C-N 3.32Å; E629-I631 PolarHBondContact O-N 3.23Å; E629-S632 PolarHBondContact O-OG 3.13Å; E629-S632 VanDerWaalsContact O-OG 3.07Å; E629-R633 WeakPolarHBondContact O-CD 3.33Å; E629-R633 WeakPolarHBondContact O-CG 3.17Å; E629-R633 PolarHBondContact O-N 3.36Å; E629-R633 VanDerWaalsContact O-N 3.09Å; E629-R633 IonicContact OE1-CZ 3.36Å; E629-R633 IonicContact OE1-NE 3.28Å; E629-R633 PolarHBondContact OE1-NE 3.48Å; E629-R633 IonicContact OE1-NH2 3.33Å; E629-R633 PolarHBondContact OE1-NH2 2.96Å
630	A	63.2	Low	59.1	Low	45 Å²	45	90 Å²	90	37%	0.372	48%	0.476	S	S	.	.	H	α-helix	trans	-63.6	-38.2	172.8	0	0	0	0	0	111.9	K626 C627 I634	K626-A630 WeakPolarHBondContact O-CB 3.08Å; K626-A630 PolarHBondContact O-N 3.44Å; K626-A630 VanDerWaalsContact O-N 3.16Å; C627-A630 WeakPolarHBondContact O-CB 3.46Å; C627-A630 PolarHBondContact O-N 3.42Å; A630-I634 WeakPolarHBondContact O-CD1 3.08Å; A630-I634 VanDerWaalsContact O-CG1 3.27Å; A630-I634 WeakPolarHBondContact O-CG1 3.27Å; A630-I634 PolarHBondContact O-N 2.86Å
631	I	59.1	Low	58.8	Low	66 Å²	66	90.2 Å²	90.2	34%	0.338	48%	0.48	S	S	.	.	H	α-helix	trans	-72.9	-39.4	178.7	-63.1	162.2	0	0	0	111.3	C627 L628 E629 R633 I634 K635 I639	C627-I631 VanDerWaalsContact O-CG1 3.24Å; C627-I631 WeakPolarHBondContact O-CG1 3.4Å; C627-I631 PolarHBondContact O-N 3.23Å; L628-I631 PolarHBondContact O-N 3.41Å; E629-I631 VanDerWaalsContact C-N 3.32Å; E629-I631 PolarHBondContact O-N 3.23Å; I631-R633 VanDerWaalsContact C-N 3.32Å; I631-R633 PolarHBondContact O-N 3.38Å; I631-I634 CarbonylContact O-C 3.6Å; I631-I634 WeakPolarHBondContact O-CA 3.48Å; I631-I634 PolarHBondContact O-N 2.9Å; I631-K635 PolarHBondContact O-N 3.05Å; I631-I639 HydrophobicContact CG2-CD1 3.39Å
632	S	61	Low	58.9	Low	18 Å²	18	86.8 Å²	86.8	13%	0.126	46%	0.46	C	S	.	.	H	α-helix	trans	-66.6	-34.2	176.9	65.9	0	0	0	0	112	L628 E629 I634 K635 P636 P642	L628-S632 PolarHBondContact O-N 2.98Å; L628-S632 PolarHBondContact O-OG 2.92Å; E629-S632 PolarHBondContact O-OG 3.13Å; E629-S632 VanDerWaalsContact O-OG 3.07Å; S632-I634 PolarHBondContact O-N 3.03Å; S632-K635 CarbonylContact O-C 3.54Å; S632-K635 PolarHBondContact O-N 3.05Å; S632-P636 WeakPolarHBondContact O-CA 3.47Å; S632-P636 WeakPolarHBondContact O-CD 3.42Å; S632-P642 WeakPolarHBondContact OG-CG 3.37Å
633	R	61	Low	58.9	Low	165 Å²	165	85.9 Å²	85.9	62%	0.623	45%	0.452	S	S	*	.	H	α-helix	trans	-61.7	-27	168.9	-70.1	163.7	-178.2	-121.8	3.8	113	E629 I631	E629-R633 WeakPolarHBondContact O-CD 3.33Å; E629-R633 WeakPolarHBondContact O-CG 3.17Å; E629-R633 PolarHBondContact O-N 3.36Å; E629-R633 VanDerWaalsContact O-N 3.09Å; E629-R633 IonicContact OE1-CZ 3.36Å; E629-R633 IonicContact OE1-NE 3.28Å; E629-R633 PolarHBondContact OE1-NE 3.48Å; E629-R633 IonicContact OE1-NH2 3.33Å; E629-R633 PolarHBondContact OE1-NH2 2.96Å; I631-R633 VanDerWaalsContact C-N 3.32Å; I631-R633 PolarHBondContact O-N 3.38Å
634	I	63.3	Low	59.1	Low	131 Å²	131	84.8 Å²	84.8	67%	0.672	45%	0.446	S	S	*	.	H	α-helix	trans	-91.9	-30.8	179.9	-64.6	164.3	0	0	0	112.2	A630 I631 S632	A630-I634 WeakPolarHBondContact O-CD1 3.08Å; A630-I634 VanDerWaalsContact O-CG1 3.27Å; A630-I634 WeakPolarHBondContact O-CG1 3.27Å; A630-I634 PolarHBondContact O-N 2.86Å; I631-I634 CarbonylContact O-C 3.6Å; I631-I634 WeakPolarHBondContact O-CA 3.48Å; I631-I634 PolarHBondContact O-N 2.9Å; S632-I634 PolarHBondContact O-N 3.03Å
635	K	56.9	Low	59.4	Low	113 Å²	113	81.1 Å²	81.1	49%	0.491	43%	0.431	S	S	.	.			trans	-139.7	66	-176.6	-80.7	-179.4	169.8	-176.6	0	113.2	I631 S632 N637 I638 I639	I631-K635 PolarHBondContact O-N 3.05Å; S632-K635 CarbonylContact O-C 3.54Å; S632-K635 PolarHBondContact O-N 3.05Å; K635-N637 PolarHBondContact O-N 2.71Å; K635-I638 HydrophobicContact CB-CB 4.36Å; K635-I638 HydrophobicContact CD-CD1 3.91Å; K635-I638 HydrophobicContact CG-CD1 4.27Å; K635-I638 PolarHBondContact O-N 2.8Å; K635-I639 PolarHBondContact O-N 3.34Å
636	P	60	Low	59.3	Low	89 Å²	89	79.1 Å²	79.1	58%	0.578	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-25.3	-177.6	25.2	-35.2	0	0	0	114.1	S632	S632-P636 WeakPolarHBondContact O-CA 3.47Å; S632-P636 WeakPolarHBondContact O-CD 3.42Å
637	N	59.6	Low	59.3	Low	159 Å²	159	74.5 Å²	74.5	85%	0.85	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.8	-5.6	-177.8	-66.2	9.1	0	0	0	114.4	K635	K635-N637 PolarHBondContact O-N 2.71Å
638	I	57.1	Low	59.5	Low	125 Å²	125	77.3 Å²	77.3	64%	0.641	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.8	-30.9	-173.8	-65.5	166.5	0	0	0	111.4	K635	K635-I638 HydrophobicContact CB-CB 4.36Å; K635-I638 HydrophobicContact CD-CD1 3.91Å; K635-I638 HydrophobicContact CG-CD1 4.27Å; K635-I638 PolarHBondContact O-N 2.8Å
639	I	48.8	Very low	59.6	Low	52 Å²	52	77.7 Å²	77.7	27%	0.267	41%	0.412	S	S	.	.	S	Bend	trans	-116.4	111.2	173.8	-70.7	154.3	0	0	0	106	I631 K635	I631-I639 HydrophobicContact CG2-CD1 3.39Å; K635-I639 PolarHBondContact O-N 3.34Å
640	G	56.9	Low	59.5	Low	50 Å²	50	75.5 Å²	75.5	52%	0.515	40%	0.402	S	S	.	.			trans	-60.1	168.2	174	0	0	0	0	0	111.3
641	S	57.9	Low	59.3	Low	61 Å²	61	76.9 Å²	76.9	43%	0.427	40%	0.403	S	S	.	.			trans	-37.9	125.5	-176.5	172.6	0	0	0	0	111.5	Y643 V644 Q645	S641-Y643 PolarHBondContact O-N 3.23Å; S641-Y643 PolarHBondContact OG-N 3.47Å; S641-V644 PolarHBondContact O-N 2.79Å; S641-Q645 PolarHBondContact O-N 2.75Å; S641-Q645 VanDerWaalsContact O-N 3.08Å
642	P	57.7	Low	59.3	Low	26 Å²	26	77.6 Å²	77.6	17%	0.169	41%	0.41	C	S	.	.	H	α-helix	trans	-54.8	-25.5	-179.9	-26.6	34.1	0	0	0	112.4	S632 Y646 F671	S632-P642 WeakPolarHBondContact OG-CG 3.37Å; P642-Y646 WeakPolarHBondContact O-CB 3.5Å; P642-Y646 PolarHBondContact O-N 2.77Å; P642-F671 HydrophobicContact CB-CE2 4.23Å; P642-F671 HydrophobicContact CB-CZ 3.82Å
643	Y	58.9	Low	58.9	Low	39 Å²	39	80 Å²	80	15%	0.153	43%	0.425	C	S	.	.	H	α-helix	trans	-64.2	-45.8	171.1	-164.8	-132.4	0	0	0	113.4	S641 Y646 I647 F671 A672 T694	S641-Y643 PolarHBondContact O-N 3.23Å; S641-Y643 PolarHBondContact OG-N 3.47Å; Y643-Y646 PolarHBondContact O-N 3.37Å; Y643-I647 HydrophobicContact CD1-CD1 3.81Å; Y643-I647 HydrophobicContact CD2-CD1 4.29Å; Y643-I647 HydrophobicContact CE1-CD1 3.5Å; Y643-I647 HydrophobicContact CE2-CD1 4.03Å; Y643-I647 HydrophobicContact CE2-CG1 4.37Å; Y643-I647 HydrophobicContact CG-CD1 4.19Å; Y643-I647 WeakPolarHBondContact O-CB 3.39Å; Y643-I647 WeakPolarHBondContact O-CG1 3.39Å; Y643-I647 PolarHBondContact O-N 3.14Å; Y643-F671 AromaticContact CD2-CD1 3.59Å; Y643-F671 HydrophobicContact CD2-CD1 3.59Å; Y643-F671 HydrophobicContact CD2-CE1 4.08Å; Y643-F671 HydrophobicContact CE2-CD1 4.43Å; Y643-F671 HydrophobicContact CG-CD1 4.23Å; Y643-F671 HydrophobicContact CG-CE1 4.28Å; Y643-A672 HydrophobicContact CE2-CB 3.76Å; Y643-T694 WeakPolarHBondContact OH-CB 3.36Å; Y643-T694 WeakPolarHBondContact OH-CG2 3.46Å; Y643-T694 PolarHBondContact OH-OG1 3.12Å
644	V	62.2	Low	58.6	Low	81 Å²	81	77.4 Å²	77.4	49%	0.491	42%	0.418	S	S	.	.	H	α-helix	trans	-71.5	-34.8	-179	176.8	0	0	0	0	111	S641 K648	S641-V644 PolarHBondContact O-N 2.79Å; V644-K648 PolarHBondContact O-N 3.15Å
645	Q	60.8	Low	58.2	Low	82 Å²	82	79.3 Å²	79.3	38%	0.383	42%	0.424	S	S	.	.	H	α-helix	trans	-68.8	-44	170.3	-171.1	58.1	45.6	0	0	111	S641 I647 K648 D649	S641-Q645 PolarHBondContact O-N 2.75Å; S641-Q645 VanDerWaalsContact O-N 3.08Å; Q645-I647 VanDerWaalsContact C-N 3.32Å; Q645-I647 PolarHBondContact O-N 3.07Å; Q645-K648 CarbonylContact O-C 3.6Å; Q645-K648 WeakPolarHBondContact O-CB 3.19Å; Q645-K648 PolarHBondContact O-N 3.47Å; Q645-K648 VanDerWaalsContact O-N 3.14Å; Q645-D649 PolarHBondContact NE2-OD1 2.89Å; Q645-D649 WeakPolarHBondContact O-CB 3.43Å; Q645-D649 PolarHBondContact O-N 3.1Å
646	Y	59.4	Low	57.7	Low	12 Å²	12	77.6 Å²	77.6	5%	0.047	42%	0.423	C	S	.	.	H	α-helix	trans	-59	-40.7	174.9	-172.1	-67.3	0	0	0	111.9	Y625 P642 Y643 D649 Y650 H664 S667 S668	Y625-Y646 AromaticContact CD1-CD2 3.82Å; Y625-Y646 HydrophobicContact CD1-CD2 3.82Å; Y625-Y646 AromaticContact CD1-CE2 3.9Å; Y625-Y646 HydrophobicContact CD1-CE2 3.9Å; Y625-Y646 AromaticContact CE1-CD2 3.57Å; Y625-Y646 HydrophobicContact CE1-CD2 3.57Å; Y625-Y646 AromaticContact CE1-CE2 3.4Å; Y625-Y646 HydrophobicContact CE1-CE2 3.4Å; Y625-Y646 HydrophobicContact CE2-CE2 4.43Å; Y625-Y646 AromaticContact CZ-CE2 3.72Å; P642-Y646 WeakPolarHBondContact O-CB 3.5Å; P642-Y646 PolarHBondContact O-N 2.77Å; Y643-Y646 PolarHBondContact O-N 3.37Å; Y646-D649 CarbonylContact O-C 3.48Å; Y646-D649 PolarHBondContact O-N 3.03Å; Y646-Y650 WeakPolarHBondContact O-CB 3.26Å; Y646-Y650 PolarHBondContact O-N 2.88Å; Y646-H664 AromaticContact CZ-CE1 3.6Å; Y646-H664 AromaticContact CZ-ND1 3.62Å; Y646-H664 PolarHBondContact OH-CE1 2.7Å; Y646-H664 VanDerWaalsContact OH-CE1 3.28Å; Y646-H664 PolarHBondContact OH-ND1 3.23Å; Y646-H664 PolarHBondContact OH-O 3.19Å; Y646-S667 PolarHBondContact OH-OG 2.91Å; Y646-S667 VanDerWaalsContact OH-OG 3.05Å; Y646-S668 WeakPolarHBondContact OH-CB 3.33Å; Y646-S668 PolarHBondContact OH-N 2.83Å
647	I	61.9	Low	57.2	Low	60 Å²	60	81.8 Å²	81.8	31%	0.308	44%	0.44	S	S	.	.	H	α-helix	trans	-65.6	-40.9	175.8	-73.5	167.9	0	0	0	110.8	Y643 Q645 D649 Y650 D651	Y643-I647 HydrophobicContact CD1-CD1 3.81Å; Y643-I647 HydrophobicContact CD2-CD1 4.29Å; Y643-I647 HydrophobicContact CE1-CD1 3.5Å; Y643-I647 HydrophobicContact CE2-CD1 4.03Å; Y643-I647 HydrophobicContact CE2-CG1 4.37Å; Y643-I647 HydrophobicContact CG-CD1 4.19Å; Y643-I647 WeakPolarHBondContact O-CB 3.39Å; Y643-I647 WeakPolarHBondContact O-CG1 3.39Å; Y643-I647 PolarHBondContact O-N 3.14Å; Q645-I647 VanDerWaalsContact C-N 3.32Å; Q645-I647 PolarHBondContact O-N 3.07Å; I647-D649 VanDerWaalsContact C-N 3.32Å; I647-D649 PolarHBondContact O-N 2.77Å; I647-Y650 PolarHBondContact O-N 3.19Å; I647-D651 WeakPolarHBondContact O-CB 3.48Å; I647-D651 PolarHBondContact O-N 3.08Å
648	K	63.2	Low	57.1	Low	126 Å²	126	78.5 Å²	78.5	55%	0.548	43%	0.43	S	S	.	.	H	α-helix	trans	-61.8	-40.2	171.2	-78.9	-179.1	174.3	-180	0	112.3	V644 Q645 Y650 T652	V644-K648 PolarHBondContact O-N 3.15Å; Q645-K648 CarbonylContact O-C 3.6Å; Q645-K648 WeakPolarHBondContact O-CB 3.19Å; Q645-K648 PolarHBondContact O-N 3.47Å; Q645-K648 VanDerWaalsContact O-N 3.14Å; K648-Y650 VanDerWaalsContact C-N 3.3Å; K648-T652 WeakPolarHBondContact O-CB 3.16Å; K648-T652 VanDerWaalsContact O-CG2 3.31Å; K648-T652 WeakPolarHBondContact O-CG2 3.37Å; K648-T652 PolarHBondContact O-N 3.26Å; K648-T652 PolarHBondContact O-OG1 3.4Å
649	D	60.3	Low	57.3	Low	70 Å²	70	79.6 Å²	79.6	37%	0.374	43%	0.426	S	S	.	.	H	α-helix	trans	-69.2	-31	177.2	-61.8	-11.6	0	0	0	111	Q645 Y646 I647 T652 T653	Q645-D649 PolarHBondContact NE2-OD1 2.89Å; Q645-D649 WeakPolarHBondContact O-CB 3.43Å; Q645-D649 PolarHBondContact O-N 3.1Å; Y646-D649 CarbonylContact O-C 3.48Å; Y646-D649 PolarHBondContact O-N 3.03Å; I647-D649 VanDerWaalsContact C-N 3.32Å; I647-D649 PolarHBondContact O-N 2.77Å; D649-T652 WeakPolarHBondContact CA-OG1 3.18Å; D649-T652 PolarHBondContact O-OG1 2.98Å; D649-T653 WeakPolarHBondContact O-CB 3.47Å; D649-T653 WeakPolarHBondContact O-CG2 3.35Å; D649-T653 PolarHBondContact O-N 3.4Å; D649-T653 PolarHBondContact O-OG1 2.8Å
650	Y	59.8	Low	58	Low	16 Å²	16	80 Å²	80	6%	0.063	43%	0.432	C	S	.	.	H	α-helix	trans	-73.9	-44.5	173.8	-176.6	-127.1	0	0	0	112.5	Y646 I647 K648 T653 K654 P660 L665 L698 Q701	Y646-Y650 WeakPolarHBondContact O-CB 3.26Å; Y646-Y650 PolarHBondContact O-N 2.88Å; I647-Y650 PolarHBondContact O-N 3.19Å; K648-Y650 VanDerWaalsContact C-N 3.3Å; Y650-T653 WeakPolarHBondContact CA-OG1 3.36Å; Y650-T653 PolarHBondContact O-N 3.41Å; Y650-T653 PolarHBondContact O-OG1 3.5Å; Y650-K654 WeakPolarHBondContact O-CG 3.5Å; Y650-K654 PolarHBondContact O-N 2.79Å; Y650-P660 HydrophobicContact CE2-CB 3.92Å; Y650-L665 HydrophobicContact CE2-CD2 4.42Å; Y650-L665 WeakPolarHBondContact OH-CD2 3.36Å; Y650-L698 HydrophobicContact CE1-CD2 4.17Å; Y650-Q701 PolarHBondContact OH-OE1 3.5Å
651	D	60.2	Low	58.8	Low	73 Å²	73	81.7 Å²	81.7	39%	0.39	43%	0.429	S	S	.	.	H	α-helix	trans	-74.6	-25.6	178.7	-74.2	-27.5	0	0	0	112.7	I647 K654	I647-D651 WeakPolarHBondContact O-CB 3.48Å; I647-D651 PolarHBondContact O-N 3.08Å; D651-K654 WeakPolarHBondContact OD1-CD 3.47Å; D651-K654 WeakPolarHBondContact OD1-CE 3.33Å; D651-K654 IonicContact OD1-NZ 3.96Å; D651-K654 PolarHBondContact OD1-NZ 3.47Å
652	T	58.8	Low	59.9	Low	82 Å²	82	79.9 Å²	79.9	50%	0.503	42%	0.417	S	S	.	.	H	α-helix	trans	-77.3	-34	168	50.8	0	0	0	0	112.4	K648 D649 Q655	K648-T652 WeakPolarHBondContact O-CB 3.16Å; K648-T652 VanDerWaalsContact O-CG2 3.31Å; K648-T652 WeakPolarHBondContact O-CG2 3.37Å; K648-T652 PolarHBondContact O-N 3.26Å; K648-T652 PolarHBondContact O-OG1 3.4Å; D649-T652 WeakPolarHBondContact CA-OG1 3.18Å; D649-T652 PolarHBondContact O-OG1 2.98Å; T652-Q655 WeakPolarHBondContact O-CB 3.32Å; T652-Q655 PolarHBondContact O-N 3.26Å
653	T	53.1	Low	61	Low	69 Å²	69	79.4 Å²	79.4	42%	0.423	41%	0.412	S	S	.	.	H	α-helix	trans	-70.3	-30.9	171.4	44.8	0	0	0	0	112.8	D649 Y650 Q655 T656	D649-T653 WeakPolarHBondContact O-CB 3.47Å; D649-T653 WeakPolarHBondContact O-CG2 3.35Å; D649-T653 PolarHBondContact O-N 3.4Å; D649-T653 PolarHBondContact O-OG1 2.8Å; Y650-T653 WeakPolarHBondContact CA-OG1 3.36Å; Y650-T653 PolarHBondContact O-N 3.41Å; Y650-T653 PolarHBondContact O-OG1 3.5Å; T653-Q655 PolarHBondContact O-N 2.81Å; T653-T656 PolarHBondContact O-N 3.18Å; T653-T656 PolarHBondContact O-OG1 3.01Å
654	K	54	Low	61.9	Low	110 Å²	110	80.5 Å²	80.5	48%	0.478	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59	-20.7	167	-78.6	-179.9	-167.1	157.4	0	114.8	Y650 D651 T656	Y650-K654 WeakPolarHBondContact O-CG 3.5Å; Y650-K654 PolarHBondContact O-N 2.79Å; D651-K654 WeakPolarHBondContact OD1-CD 3.47Å; D651-K654 WeakPolarHBondContact OD1-CE 3.33Å; D651-K654 IonicContact OD1-NZ 3.96Å; D651-K654 PolarHBondContact OD1-NZ 3.47Å; K654-T656 VanDerWaalsContact C-N 3.25Å
655	Q	53.9	Low	62.9	Low	171 Å²	171	76.8 Å²	76.8	80%	0.799	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.9	-6.3	173.8	-70.5	-171.1	-22.5	0	0	113	T652 T653	T652-Q655 WeakPolarHBondContact O-CB 3.32Å; T652-Q655 PolarHBondContact O-N 3.26Å; T653-Q655 PolarHBondContact O-N 2.81Å
656	T	48	Very low	64	Low	77 Å²	77	73 Å²	73	47%	0.472	38%	0.378	S	S	.	.	S	Bend	trans	-94.2	143.5	162.7	72.7	0	0	0	0	108.8	T653 K654 S658	T653-T656 PolarHBondContact O-N 3.18Å; T653-T656 PolarHBondContact O-OG1 3.01Å; K654-T656 VanDerWaalsContact C-N 3.25Å; T656-S658 PolarHBondContact O-N 3.2Å
657	D	48.9	Very low	65	Low	177 Å²	177	73.2 Å²	73.2	95%	0.947	38%	0.381	S	S	*	.	S	Bend	trans	-65.4	6.1	177.4	-65	-62.3	0	0	0	114.1	R659	D657-R659 PolarHBondContact O-N 2.86Å
658	S	57.5	Low	65.9	Low	89 Å²	89	70.5 Å²	70.5	62%	0.622	37%	0.368	S	S	*	.			trans	-71	92.6	173.6	-172.5	0	0	0	0	110.9	T656	T656-S658 PolarHBondContact O-N 3.2Å
659	R	61.5	Low	66.8	Low	148 Å²	148	64.5 Å²	64.5	56%	0.558	34%	0.342	S	S	*	.			trans	-32.9	123.8	164.5	176	170.8	164.6	178.5	-12.6	110.8	D601 D657 D661	D601-R659 IonicContact OD1-NH2 2.65Å; D601-R659 IonicContact OD2-NH2 2.74Å; D657-R659 PolarHBondContact O-N 2.86Å; R659-D661 PolarHBondContact O-N 3.13Å
660	P	62.8	Low	68	Low	62 Å²	62	64 Å²	64	40%	0.403	34%	0.336	S	S	.	.			trans	-65.2	131.2	-170.4	25.8	-34.9	0	0	0	111.1	Y650 L665	Y650-P660 HydrophobicContact CE2-CB 3.92Å; P660-L665 HydrophobicContact CB-CG 4.49Å
661	D	73.3	Confident	68.8	Low	84 Å²	84	65.3 Å²	65.3	45%	0.449	34%	0.342	S	S	.	.			trans	-71.1	138.1	-173.8	-168.9	3.7	0	0	0	111.3	R659 F663 H664 L665	R659-D661 PolarHBondContact O-N 3.13Å; D661-F663 PolarHBondContact O-N 2.74Å; D661-H664 HydrophobicContact CB-CB 4.3Å; D661-H664 WeakPolarHBondContact O-CA 3.32Å; D661-H664 WeakPolarHBondContact O-CB 3.41Å; D661-H664 PolarHBondContact O-N 3.33Å; D661-L665 PolarHBondContact O-N 3.15Å
662	S	81.5	Confident	69.6	Low	24 Å²	24	61.9 Å²	61.9	17%	0.168	32%	0.324	C	S	.	.	H	α-helix	trans	-57.4	-35.3	-176.8	-63	0	0	0	0	112	A598 H664 L666	A598-S662 WeakPolarHBondContact O-CB 3.44Å; A598-S662 PolarHBondContact O-OG 3.03Å; S662-H664 VanDerWaalsContact C-N 3.34Å; S662-L666 WeakPolarHBondContact O-CB 3.46Å; S662-L666 WeakPolarHBondContact O-CG 3.47Å; S662-L666 PolarHBondContact O-N 3.38Å
663	F	80.4	Confident	70.4	Confident	16 Å²	16	58.3 Å²	58.3	7%	0.07	30%	0.302	C	S	.	.	H	α-helix	trans	-65.6	-34.7	174.3	-68	-86.3	0	0	0	112.7	R595 A598 L599 Q616 D661 S667	R595-F663 HydrophobicContact CG-CD1 4.33Å; R595-F663 HydrophobicContact CG-CE1 4.48Å; R595-F663 WeakPolarHBondContact O-CE1 3.22Å; A598-F663 HydrophobicContact CB-CD1 3.96Å; A598-F663 HydrophobicContact CB-CD2 4.02Å; A598-F663 HydrophobicContact CB-CE1 3.77Å; A598-F663 HydrophobicContact CB-CE2 3.83Å; A598-F663 HydrophobicContact CB-CG 4.09Å; A598-F663 HydrophobicContact CB-CZ 3.71Å; L599-F663 HydrophobicContact CB-CE2 4.16Å; L599-F663 HydrophobicContact CB-CZ 4.35Å; L599-F663 HydrophobicContact CD1-CE2 4.36Å; Q616-F663 HydrophobicContact CB-CZ 4.31Å; Q616-F663 HydrophobicContact CG-CE1 4.3Å; Q616-F663 HydrophobicContact CG-CE2 4.2Å; Q616-F663 HydrophobicContact CG-CZ 3.84Å; Q616-F663 VanDerWaalsContact NE2-CE2 3.35Å; D661-F663 PolarHBondContact O-N 2.74Å; F663-S667 WeakPolarHBondContact O-CB 3.45Å; F663-S667 PolarHBondContact O-N 3.04Å; F663-S667 PolarHBondContact O-OG 3.4Å
664	H	78.1	Confident	71.4	Confident	62 Å²	62	59.2 Å²	59.2	29%	0.287	30%	0.304	S	S	.	.	H	α-helix	trans	-75.6	-39	178.5	-141	-72.8	0	0	0	110.9	Y625 Y646 D661 S662 S667 S668	Y625-H664 PolarHBondContact OH-NE2 3.02Å; Y646-H664 AromaticContact CZ-CE1 3.6Å; Y646-H664 AromaticContact CZ-ND1 3.62Å; Y646-H664 PolarHBondContact OH-CE1 2.7Å; Y646-H664 VanDerWaalsContact OH-CE1 3.28Å; Y646-H664 PolarHBondContact OH-ND1 3.23Å; Y646-H664 PolarHBondContact OH-O 3.19Å; D661-H664 HydrophobicContact CB-CB 4.3Å; D661-H664 WeakPolarHBondContact O-CA 3.32Å; D661-H664 WeakPolarHBondContact O-CB 3.41Å; D661-H664 PolarHBondContact O-N 3.33Å; S662-H664 VanDerWaalsContact C-N 3.34Å; H664-S667 PolarHBondContact O-N 3.42Å; H664-S667 PolarHBondContact O-OG 2.97Å; H664-S668 WeakPolarHBondContact O-CB 3.38Å; H664-S668 PolarHBondContact O-N 2.73Å; H664-S668 PolarHBondContact O-OG 3.42Å
665	L	83.5	Confident	71.8	Confident	3 Å²	3	55.8 Å²	55.8	2%	0.016	29%	0.294	C	S	.	.	H	α-helix	trans	-60.9	-46.3	170.1	-73	174.5	0	0	0	111.6	Y650 P660 D661 S668 A669 L698 Q701 L702	Y650-L665 HydrophobicContact CE2-CD2 4.42Å; Y650-L665 WeakPolarHBondContact OH-CD2 3.36Å; P660-L665 HydrophobicContact CB-CG 4.49Å; D661-L665 PolarHBondContact O-N 3.15Å; L665-S668 PolarHBondContact O-N 3.48Å; L665-S668 PolarHBondContact O-OG 2.99Å; L665-A669 PolarHBondContact O-N 3.41Å; L665-L698 HydrophobicContact CD2-CD2 4.26Å; L665-Q701 HydrophobicContact CD1-CB 3.95Å; L665-Q701 HydrophobicContact CD2-CB 4.1Å; L665-L702 HydrophobicContact CB-CD2 3.66Å; L665-L702 HydrophobicContact CD1-CD2 4.06Å
666	L	84.9	Confident	71.7	Confident	1 Å²	1	52.8 Å²	52.8	1%	0.005	28%	0.283	C	S	.	.	H	α-helix	trans	-63.7	-44	176.8	-75.3	167.9	0	0	0	112.7	F591 C594 R595 A598 S662 A669 K670 L699 L702	F591-L666 HydrophobicContact CD2-CB 4.25Å; F591-L666 HydrophobicContact CD2-CD2 4.39Å; F591-L666 HydrophobicContact CE2-CB 3.98Å; F591-L666 WeakPolarHBondContact CE2-O 3.35Å; C594-L666 HydrophobicContact CB-CD1 3.91Å; C594-L666 HydrophobicContact CB-CD2 3.67Å; C594-L666 HydrophobicContact CB-CG 4.47Å; R595-L666 HydrophobicContact CB-CD1 4.33Å; A598-L666 HydrophobicContact CB-CD1 3.84Å; S662-L666 WeakPolarHBondContact O-CB 3.46Å; S662-L666 WeakPolarHBondContact O-CG 3.47Å; S662-L666 PolarHBondContact O-N 3.38Å; L666-A669 PolarHBondContact O-N 3.42Å; L666-K670 WeakPolarHBondContact O-CB 3.31Å; L666-K670 PolarHBondContact O-N 2.98Å; L666-L699 HydrophobicContact CD2-CD2 3.82Å; L666-L702 HydrophobicContact CD2-CD1 3.86Å; L666-L702 HydrophobicContact CD2-CD2 4.48Å; L666-L702 HydrophobicContact CG-CD1 4.34Å; L666-L702 HydrophobicContact CG-CD2 4.07Å
667	S	79.9	Confident	71.9	Confident	18 Å²	18	55 Å²	55	13%	0.126	29%	0.288	C	S	.	.	H	α-helix	trans	-66.9	-36.6	178.6	69.7	0	0	0	0	112.1	Y646 F663 H664 K670 F671	Y646-S667 PolarHBondContact OH-OG 2.91Å; Y646-S667 VanDerWaalsContact OH-OG 3.05Å; F663-S667 WeakPolarHBondContact O-CB 3.45Å; F663-S667 PolarHBondContact O-N 3.04Å; F663-S667 PolarHBondContact O-OG 3.4Å; H664-S667 PolarHBondContact O-N 3.42Å; H664-S667 PolarHBondContact O-OG 2.97Å; S667-K670 PolarHBondContact O-N 2.98Å; S667-F671 WeakPolarHBondContact O-CB 3.39Å; S667-F671 PolarHBondContact O-N 3.25Å
668	S	79.8	Confident	71.7	Confident	3 Å²	3	52.1 Å²	52.1	2%	0.021	27%	0.272	C	S	.	.	H	α-helix	trans	-63.8	-45	173.3	70.1	0	0	0	0	113.1	Y646 H664 L665 F671 A672 L698	Y646-S668 WeakPolarHBondContact OH-CB 3.33Å; Y646-S668 PolarHBondContact OH-N 2.83Å; H664-S668 WeakPolarHBondContact O-CB 3.38Å; H664-S668 PolarHBondContact O-N 2.73Å; H664-S668 PolarHBondContact O-OG 3.42Å; L665-S668 PolarHBondContact O-N 3.48Å; L665-S668 PolarHBondContact O-OG 2.99Å; S668-F671 PolarHBondContact O-N 2.94Å; S668-A672 PolarHBondContact O-N 3.47Å; S668-L698 WeakPolarHBondContact OG-CD1 3.5Å
669	A	83.6	Confident	70.9	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-64.3	-41.1	177.8	0	0	0	0	0	111.3	F587 L665 L666 A672 M673 L698 L699	F587-A669 HydrophobicContact CE2-CB 4.5Å; F587-A669 HydrophobicContact CZ-CB 4.37Å; L665-A669 PolarHBondContact O-N 3.41Å; L666-A669 PolarHBondContact O-N 3.42Å; A669-A672 PolarHBondContact O-N 3.21Å; A669-M673 WeakPolarHBondContact O-CG 3.4Å; A669-M673 PolarHBondContact O-N 2.87Å; A669-L698 HydrophobicContact CB-CB 4.04Å; A669-L699 HydrophobicContact CB-CD2 3.67Å; A669-L699 HydrophobicContact CB-CG 3.93Å
670	K	84.5	Confident	69.9	Low	58 Å²	58	57.4 Å²	57.4	25%	0.252	29%	0.294	S	S	.	.	H	α-helix	trans	-65.6	-41.1	173.4	179.6	171.3	179.4	178.7	0	112.5	F587 F591 L666 S667 A672 M673 N674	F587-K670 HydrophobicContact CE1-CB 3.85Å; F587-K670 HydrophobicContact CE1-CG 4.14Å; F587-K670 HydrophobicContact CZ-CB 3.94Å; F591-K670 HydrophobicContact CD1-CD 3.85Å; F591-K670 HydrophobicContact CD2-CB 3.8Å; F591-K670 HydrophobicContact CD2-CD 3.96Å; F591-K670 HydrophobicContact CD2-CG 4.42Å; F591-K670 HydrophobicContact CE1-CD 3.51Å; F591-K670 HydrophobicContact CE2-CB 3.63Å; F591-K670 HydrophobicContact CE2-CD 3.61Å; F591-K670 HydrophobicContact CE2-CG 4.25Å; F591-K670 HydrophobicContact CG-CD 4.08Å; F591-K670 HydrophobicContact CZ-CB 4.27Å; F591-K670 HydrophobicContact CZ-CD 3.37Å; F591-K670 HydrophobicContact CZ-CG 4.45Å; L666-K670 WeakPolarHBondContact O-CB 3.31Å; L666-K670 PolarHBondContact O-N 2.98Å; S667-K670 PolarHBondContact O-N 2.98Å; K670-A672 VanDerWaalsContact C-N 3.33Å; K670-A672 PolarHBondContact O-N 3.19Å; K670-M673 PolarHBondContact O-N 2.9Å; K670-N674 VanDerWaalsContact O-CB 3.26Å; K670-N674 WeakPolarHBondContact O-CB 3.45Å; K670-N674 PolarHBondContact O-N 2.95Å; K670-N674 PolarHBondContact O-OD1 3.2Å
671	F	76.1	Confident	68.9	Low	45 Å²	45	57.2 Å²	57.2	20%	0.197	30%	0.295	C	S	.	.	H	α-helix	trans	-59.6	-47	175.5	-170.4	-72.9	0	0	0	110.4	P642 Y643 S667 S668 M673 N674 S675	P642-F671 HydrophobicContact CB-CE2 4.23Å; P642-F671 HydrophobicContact CB-CZ 3.82Å; Y643-F671 AromaticContact CD2-CD1 3.59Å; Y643-F671 HydrophobicContact CD2-CD1 3.59Å; Y643-F671 HydrophobicContact CD2-CE1 4.08Å; Y643-F671 HydrophobicContact CE2-CD1 4.43Å; Y643-F671 HydrophobicContact CG-CD1 4.23Å; Y643-F671 HydrophobicContact CG-CE1 4.28Å; S667-F671 WeakPolarHBondContact O-CB 3.39Å; S667-F671 PolarHBondContact O-N 3.25Å; S668-F671 PolarHBondContact O-N 2.94Å; F671-M673 PolarHBondContact O-N 3.28Å; F671-N674 PolarHBondContact O-N 2.91Å; F671-S675 WeakPolarHBondContact O-CB 3.05Å; F671-S675 PolarHBondContact O-N 3.24Å
672	A	76.7	Confident	67.4	Low	1 Å²	1	57 Å²	57	1%	0.008	31%	0.312	C	S	.	.	H	α-helix	trans	-55.8	-52.1	177.2	0	0	0	0	0	111.5	Y643 S668 A669 K670 N674 S675 A691	Y643-A672 HydrophobicContact CE2-CB 3.76Å; S668-A672 PolarHBondContact O-N 3.47Å; A669-A672 PolarHBondContact O-N 3.21Å; K670-A672 VanDerWaalsContact C-N 3.33Å; K670-A672 PolarHBondContact O-N 3.19Å; A672-N674 PolarHBondContact O-N 3.05Å; A672-S675 WeakPolarHBondContact O-CB 3.28Å; A672-S675 PolarHBondContact O-N 3.28Å; A672-A691 WeakPolarHBondContact O-CB 3.38Å
673	M	77.2	Confident	65.6	Low	7 Å²	7	61.4 Å²	61.4	3%	0.034	33%	0.334	C	S	.	.	H	α-helix	trans	-69.8	-26.7	-178.3	-67.5	-168.1	73.3	0	0	114.9	K584 F587 A669 K670 F671 S675 L692 A695 W713	K584-M673 HydrophobicContact CB-CE 4.37Å; K584-M673 HydrophobicContact CG-CE 3.84Å; F587-M673 HydrophobicContact CB-CE 3.75Å; F587-M673 HydrophobicContact CB-SD 3.8Å; F587-M673 HydrophobicContact CD1-CB 4.31Å; F587-M673 HydrophobicContact CD1-CE 4.26Å; F587-M673 HydrophobicContact CD1-CG 4.49Å; F587-M673 HydrophobicContact CD1-SD 3.54Å; F587-M673 VanDerWaalsContact CD1-SD 3.54Å; F587-M673 HydrophobicContact CD2-SD 3.53Å; F587-M673 VanDerWaalsContact CD2-SD 3.53Å; F587-M673 HydrophobicContact CE1-CB 4.33Å; F587-M673 HydrophobicContact CE1-SD 3.97Å; F587-M673 HydrophobicContact CE2-SD 3.97Å; F587-M673 HydrophobicContact CG-CE 3.94Å; F587-M673 HydrophobicContact CG-SD 3.3Å; F587-M673 WeakPolarHBondContact CG-SD 3.24Å; F587-M673 HydrophobicContact CZ-SD 4.16Å; A669-M673 WeakPolarHBondContact O-CG 3.4Å; A669-M673 PolarHBondContact O-N 2.87Å; K670-M673 PolarHBondContact O-N 2.9Å; F671-M673 PolarHBondContact O-N 3.28Å; M673-S675 VanDerWaalsContact C-N 3.32Å; M673-L692 HydrophobicContact CE-CD1 3.96Å; M673-A695 HydrophobicContact CG-CB 3.42Å; M673-A695 VanDerWaalsContact CG-CB 3.42Å; M673-A695 HydrophobicContact SD-CB 3.7Å; M673-W713 HydrophobicContact CE-CH2 4.32Å; M673-W713 HydrophobicContact CE-CZ2 3.64Å; M673-W713 HydrophobicContact SD-CH2 3.93Å; M673-W713 HydrophobicContact SD-CZ2 3.68Å
674	N	73.1	Confident	64.1	Low	87 Å²	87	68.4 Å²	68.4	47%	0.465	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	0.7	175.8	-77.3	53.6	0	0	0	113	K670 F671 A672 D676	K670-N674 VanDerWaalsContact O-CB 3.26Å; K670-N674 WeakPolarHBondContact O-CB 3.45Å; K670-N674 PolarHBondContact O-N 2.95Å; K670-N674 PolarHBondContact O-OD1 3.2Å; F671-N674 PolarHBondContact O-N 2.91Å; A672-N674 PolarHBondContact O-N 3.05Å; N674-D676 PolarHBondContact O-N 3.31Å
675	S	62.3	Low	62.9	Low	38 Å²	38	70.7 Å²	70.7	27%	0.266	38%	0.381	S	S	.	.			trans	-80.5	45	-176.3	-169.6	0	0	0	0	113.5	F671 A672 M673 H677	F671-S675 WeakPolarHBondContact O-CB 3.05Å; F671-S675 PolarHBondContact O-N 3.24Å; A672-S675 WeakPolarHBondContact O-CB 3.28Å; A672-S675 PolarHBondContact O-N 3.28Å; M673-S675 VanDerWaalsContact C-N 3.32Å; S675-H677 PolarHBondContact O-N 2.83Å
676	D	53	Low	61.5	Low	108 Å²	108	74 Å²	74	58%	0.578	40%	0.402	S	S	*	.			trans	-70.9	37.2	173.7	-69.4	-21.5	0	0	0	112	K584 N674	K584-D676 IonicContact NZ-OD1 2.69Å; K584-D676 PolarHBondContact NZ-OD1 2.87Å; K584-D676 IonicContact NZ-OD2 3.85Å; N674-D676 PolarHBondContact O-N 3.31Å
677	H	50.6	Low	60.1	Low	125 Å²	125	77 Å²	77	58%	0.579	42%	0.423	S	S	*	.			trans	-138.3	78.6	-169.5	-84.9	6.8	0	0	0	112.8	S675	S675-H677 PolarHBondContact O-N 2.83Å
678	N	44.7	Very low	59.2	Low	115 Å²	115	77.5 Å²	77.5	62%	0.615	43%	0.426	S	S	*	.				-151	109.3	123.5	-149.4	1.1	0	0	0	112.7	F680	N678-F680 PolarHBondContact O-N 2.98Å
679	I	42.2	Very low	58.6	Low	157 Å²	157	77.9 Å²	77.9	81%	0.805	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	42.7	179.7	-52	171.5	0	0	0	109.4
680	F	39.6	Very low	58.2	Low	191 Å²	191	83.9 Å²	83.9	84%	0.838	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-153.4	2.6	-170.5	-135.9	-94.8	0	0	0	115.5	N678	N678-F680 PolarHBondContact O-N 2.98Å
681	S	41.7	Very low	57.8	Low	58 Å²	58	82 Å²	82	41%	0.406	45%	0.451	S	S	.	.			trans	-109.8	115.6	166.5	45.5	0	0	0	0	108.4	D683	S681-D683 PolarHBondContact O-N 3.38Å
682	G	41.9	Very low	58.2	Low	80 Å²	80	80.1 Å²	80.1	83%	0.825	44%	0.444	S	S	*	.	S	Bend	trans	-68.3	4.4	-170.5	0	0	0	0	0	116.7
683	D	44.7	Very low	58.5	Low	116 Å²	116	83.7 Å²	83.7	62%	0.62	46%	0.46	S	S	*	.			trans	-99.8	62.6	176.5	-65.2	-44	0	0	0	110.4	S681 N685 T686	S681-D683 PolarHBondContact O-N 3.38Å; D683-N685 PolarHBondContact O-N 2.84Å; D683-T686 PolarHBondContact O-N 2.77Å
684	E	48.5	Very low	58.8	Low	164 Å²	164	84.7 Å²	84.7	77%	0.766	47%	0.467	S	S	*	.	H	α-helix	trans	-53.5	-31.3	-174.8	-64.5	-170.8	141.7	0	0	113.2
685	N	52.1	Low	59.4	Low	110 Å²	110	80.6 Å²	80.6	59%	0.588	45%	0.445	S	S	*	.	H	α-helix	trans	-87.7	-4.3	-176.7	-63.3	-38.2	0	0	0	115.2	D683 R728	D683-N685 PolarHBondContact O-N 2.84Å; N685-R728 PolarHBondContact O-NH2 3.29Å
686	T	53.6	Low	60.6	Low	72 Å²	72	79.7 Å²	79.7	44%	0.442	44%	0.437	S	S	.	.	H	α-helix	trans	-98.8	-40.2	-178.3	-51.5	0	0	0	0	111	D683 S688 D689 E690	D683-T686 PolarHBondContact O-N 2.77Å; T686-S688 PolarHBondContact O-N 3.08Å; T686-D689 PolarHBondContact O-N 3.16Å; T686-E690 PolarHBondContact O-N 2.96Å
687	S	56.3	Low	62.2	Low	64 Å²	64	81.3 Å²	81.3	45%	0.448	44%	0.436	S	S	.	.	H	α-helix	trans	-67.9	-31.1	-175.6	-170.3	0	0	0	0	114	D689 A691	S687-D689 PolarHBondContact O-N 3.25Å; S687-A691 PolarHBondContact O-N 3.16Å
688	S	61.6	Low	63.9	Low	28 Å²	28	76.2 Å²	76.2	20%	0.196	41%	0.412	C	S	.	.	H	α-helix	trans	-61.9	-33.2	175	47.1	0	0	0	0	112.8	T686 A691 L692	T686-S688 PolarHBondContact O-N 3.08Å; S688-A691 WeakPolarHBondContact O-CB 3.38Å; S688-L692 PolarHBondContact O-N 2.88Å; S688-L692 VanDerWaalsContact O-N 3.13Å
689	D	66.8	Low	65.9	Low	11 Å²	11	70.9 Å²	70.9	6%	0.059	38%	0.384	C	S	.	.	H	α-helix	trans	-89.9	-40.2	-164.1	-69.9	22.1	0	0	0	111	T686 S687 A691 L692 E693 K724 R728	T686-D689 PolarHBondContact O-N 3.16Å; S687-D689 PolarHBondContact O-N 3.25Å; D689-A691 PolarHBondContact O-N 2.89Å; D689-L692 PolarHBondContact O-N 3.05Å; D689-E693 WeakPolarHBondContact O-CB 3.39Å; D689-E693 WeakPolarHBondContact O-CG 3.22Å; D689-E693 PolarHBondContact O-N 3.12Å; D689-K724 VanDerWaalsContact CG-NZ 3.25Å; D689-K724 IonicContact OD1-NZ 2.64Å; D689-K724 PolarHBondContact OD1-NZ 2.7Å; D689-K724 WeakPolarHBondContact OD2-CD 3.26Å; D689-K724 WeakPolarHBondContact OD2-CE 3.3Å; D689-K724 IonicContact OD2-NZ 3.09Å; D689-K724 PolarHBondContact OD2-NZ 3.45Å; D689-K724 VanDerWaalsContact OD2-NZ 3.15Å; D689-R728 IonicContact OD2-CZ 3.25Å; D689-R728 IonicContact OD2-NH1 3.38Å; D689-R728 PolarHBondContact OD2-NH1 2.78Å; D689-R728 IonicContact OD2-NH2 2.91Å; D689-R728 PolarHBondContact OD2-NH2 2.97Å
690	E	74.3	Confident	68	Low	126 Å²	126	64.9 Å²	64.9	59%	0.589	36%	0.361	S	S	*	.	H	α-helix	trans	-57.6	-37.9	166.7	-65.3	-172.9	-174.8	0	0	110.9	T686 T694	T686-E690 PolarHBondContact O-N 2.96Å; E690-T694 VanDerWaalsContact O-CB 3.26Å; E690-T694 WeakPolarHBondContact O-CB 3.47Å; E690-T694 WeakPolarHBondContact O-CG2 3.46Å; E690-T694 PolarHBondContact O-N 3.31Å; E690-T694 PolarHBondContact O-OG1 3.19Å
691	A	77.5	Confident	70.2	Confident	19 Å²	19	59.8 Å²	59.8	16%	0.157	34%	0.34	C	S	.	.	H	α-helix	trans	-64.6	-42.8	175.5	0	0	0	0	0	113	A672 S687 S688 D689 T694 A695	A672-A691 WeakPolarHBondContact O-CB 3.38Å; S687-A691 PolarHBondContact O-N 3.16Å; S688-A691 WeakPolarHBondContact O-CB 3.38Å; D689-A691 PolarHBondContact O-N 2.89Å; A691-T694 PolarHBondContact O-OG1 3.41Å; A691-T694 VanDerWaalsContact O-OG1 3.06Å; A691-A695 WeakPolarHBondContact O-CB 3.36Å; A691-A695 PolarHBondContact O-N 3.34Å; A691-A695 VanDerWaalsContact O-N 3.07Å
692	L	82.9	Confident	72.3	Confident	6 Å²	6	57 Å²	57	3%	0.031	32%	0.32	C	S	.	.	H	α-helix	trans	-72.8	-43.5	176.8	-175	64.6	0	0	0	112.4	L583 M673 S688 D689 T694 A695 V696 W713 Y720 L721	L583-L692 HydrophobicContact CD2-CD1 3.71Å; L583-L692 HydrophobicContact CD2-CD2 3.8Å; L583-L692 HydrophobicContact CD2-CG 4.38Å; M673-L692 HydrophobicContact CE-CD1 3.96Å; S688-L692 PolarHBondContact O-N 2.88Å; S688-L692 VanDerWaalsContact O-N 3.13Å; D689-L692 PolarHBondContact O-N 3.05Å; L692-T694 VanDerWaalsContact C-N 3.34Å; L692-T694 PolarHBondContact O-N 3.09Å; L692-A695 PolarHBondContact O-N 3.21Å; L692-V696 WeakPolarHBondContact O-CG2 3.42Å; L692-V696 PolarHBondContact O-N 2.79Å; L692-W713 HydrophobicContact CD1-CH2 3.79Å; L692-W713 HydrophobicContact CD1-CZ2 3.9Å; L692-Y720 HydrophobicContact CD2-CD1 3.43Å; L692-Y720 VanDerWaalsContact CD2-CD1 3.43Å; L692-Y720 HydrophobicContact CD2-CE1 3.67Å; L692-L721 HydrophobicContact CD2-CD2 4.13Å; L692-L721 HydrophobicContact CD2-CG 4.37Å
693	E	84.5	Confident	74.2	Confident	75 Å²	75	59.3 Å²	59.3	35%	0.35	30%	0.304	S	S	.	.	H	α-helix	trans	-60.6	-42.9	176.5	-76.8	-170	-172.7	0	0	111.9	D689 V696 R697 L721	D689-E693 WeakPolarHBondContact O-CB 3.39Å; D689-E693 WeakPolarHBondContact O-CG 3.22Å; D689-E693 PolarHBondContact O-N 3.12Å; E693-V696 PolarHBondContact O-N 3.3Å; E693-R697 WeakPolarHBondContact O-CB 3.35Å; E693-R697 VanDerWaalsContact O-CG 3.24Å; E693-R697 WeakPolarHBondContact O-CG 3.36Å; E693-R697 PolarHBondContact O-N 3.23Å; E693-R697 IonicContact OE2-CZ 2.68Å; E693-R697 IonicContact OE2-NH1 3.52Å; E693-R697 PolarHBondContact OE2-NH1 3.03Å; E693-R697 IonicContact OE2-NH2 3.5Å; E693-R697 PolarHBondContact OE2-NH2 3.1Å; E693-L721 HydrophobicContact CG-CD1 4.25Å; E693-L721 HydrophobicContact CG-CD2 4.04Å
694	T	82.9	Confident	76	Confident	29 Å²	29	54.1 Å²	54.1	18%	0.178	28%	0.278	C	S	.	.	H	α-helix	trans	-66.9	-39.3	176.5	52.9	0	0	0	0	111.6	Y643 E690 A691 L692 V696 R697 L698	Y643-T694 WeakPolarHBondContact OH-CB 3.36Å; Y643-T694 WeakPolarHBondContact OH-CG2 3.46Å; Y643-T694 PolarHBondContact OH-OG1 3.12Å; E690-T694 VanDerWaalsContact O-CB 3.26Å; E690-T694 WeakPolarHBondContact O-CB 3.47Å; E690-T694 WeakPolarHBondContact O-CG2 3.46Å; E690-T694 PolarHBondContact O-N 3.31Å; E690-T694 PolarHBondContact O-OG1 3.19Å; A691-T694 PolarHBondContact O-OG1 3.41Å; A691-T694 VanDerWaalsContact O-OG1 3.06Å; L692-T694 VanDerWaalsContact C-N 3.34Å; L692-T694 PolarHBondContact O-N 3.09Å; T694-V696 PolarHBondContact O-N 2.99Å; T694-R697 PolarHBondContact O-N 3.23Å; T694-L698 WeakPolarHBondContact O-CB 3.46Å; T694-L698 WeakPolarHBondContact O-CD1 3.33Å; T694-L698 WeakPolarHBondContact O-CG 3.11Å; T694-L698 PolarHBondContact O-N 3.34Å
695	A	84.9	Confident	77.8	Confident	0 Å²	0	50 Å²	50	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-59.9	-44.6	172.3	0	0	0	0	0	112.2	M673 A691 L692 R697 L698 L699 W713	M673-A695 HydrophobicContact CG-CB 3.42Å; M673-A695 VanDerWaalsContact CG-CB 3.42Å; M673-A695 HydrophobicContact SD-CB 3.7Å; A691-A695 WeakPolarHBondContact O-CB 3.36Å; A691-A695 PolarHBondContact O-N 3.34Å; A691-A695 VanDerWaalsContact O-N 3.07Å; L692-A695 PolarHBondContact O-N 3.21Å; A695-R697 PolarHBondContact O-N 3.46Å; A695-L698 PolarHBondContact O-N 2.93Å; A695-L699 WeakPolarHBondContact O-CB 3.47Å; A695-L699 WeakPolarHBondContact O-CG 3.36Å; A695-L699 PolarHBondContact O-N 2.89Å; A695-W713 HydrophobicContact CB-CH2 4.38Å
696	V	89.1	Confident	79.3	Confident	19 Å²	19	44.7 Å²	44.7	12%	0.115	23%	0.23	C	C	.	.	H	α-helix	trans	-61.9	-41.3	174.2	171	0	0	0	0	111.6	L692 E693 T694 G700 W713 L714 A717 L721	L692-V696 WeakPolarHBondContact O-CG2 3.42Å; L692-V696 PolarHBondContact O-N 2.79Å; E693-V696 PolarHBondContact O-N 3.3Å; T694-V696 PolarHBondContact O-N 2.99Å; V696-G700 PolarHBondContact O-N 3.13Å; V696-W713 HydrophobicContact CG2-CH2 3.97Å; V696-W713 HydrophobicContact CG2-CZ3 3.79Å; V696-L714 HydrophobicContact CB-CD2 4.37Å; V696-L714 HydrophobicContact CG1-CD2 3.95Å; V696-A717 HydrophobicContact CG2-CB 3.58Å; V696-L721 HydrophobicContact CG2-CD1 4.12Å
697	R	86.4	Confident	81	Confident	143 Å²	143	47.1 Å²	47.1	54%	0.54	23%	0.231	S	C	.	.	H	α-helix	trans	-64.3	-36.3	175.1	-72.7	167.6	-177.8	131.6	12	112.8	E693 T694 A695 Q701	E693-R697 WeakPolarHBondContact O-CB 3.35Å; E693-R697 VanDerWaalsContact O-CG 3.24Å; E693-R697 WeakPolarHBondContact O-CG 3.36Å; E693-R697 PolarHBondContact O-N 3.23Å; E693-R697 IonicContact OE2-CZ 2.68Å; E693-R697 IonicContact OE2-NH1 3.52Å; E693-R697 PolarHBondContact OE2-NH1 3.03Å; E693-R697 IonicContact OE2-NH2 3.5Å; E693-R697 PolarHBondContact OE2-NH2 3.1Å; T694-R697 PolarHBondContact O-N 3.23Å; A695-R697 PolarHBondContact O-N 3.46Å; R697-Q701 WeakPolarHBondContact O-CG 3.17Å; R697-Q701 PolarHBondContact O-NE2 3.3Å
698	L	85.1	Confident	82.5	Confident	17 Å²	17	48 Å²	48	9%	0.089	23%	0.234	C	C	.	.	H	α-helix	trans	-79.4	-46.2	-178.4	-70.8	163.9	0	0	0	112	Y650 L665 S668 A669 T694 A695 G700 Q701	Y650-L698 HydrophobicContact CE1-CD2 4.17Å; L665-L698 HydrophobicContact CD2-CD2 4.26Å; S668-L698 WeakPolarHBondContact OG-CD1 3.5Å; A669-L698 HydrophobicContact CB-CB 4.04Å; T694-L698 WeakPolarHBondContact O-CB 3.46Å; T694-L698 WeakPolarHBondContact O-CD1 3.33Å; T694-L698 WeakPolarHBondContact O-CG 3.11Å; T694-L698 PolarHBondContact O-N 3.34Å; A695-L698 PolarHBondContact O-N 2.93Å; L698-G700 VanDerWaalsContact C-N 3.25Å; L698-G700 PolarHBondContact O-N 2.56Å; L698-Q701 WeakPolarHBondContact O-CB 3.4Å; L698-Q701 PolarHBondContact O-N 2.88Å
699	L	86.8	Confident	83.8	Confident	3 Å²	3	48.7 Å²	48.7	2%	0.016	24%	0.237	C	C	.	.	H	α-helix	trans	-65.2	-31.1	173.6	-63.2	-176.7	0	0	0	111.9	F587 L666 A669 A695 Q701 L702 W713 L714	F587-L699 HydrophobicContact CD2-CD1 3.96Å; F587-L699 HydrophobicContact CE2-CD1 3.7Å; F587-L699 HydrophobicContact CE2-CD2 4.2Å; F587-L699 HydrophobicContact CE2-CG 4.39Å; L666-L699 HydrophobicContact CD2-CD2 3.82Å; A669-L699 HydrophobicContact CB-CD2 3.67Å; A669-L699 HydrophobicContact CB-CG 3.93Å; A695-L699 WeakPolarHBondContact O-CB 3.47Å; A695-L699 WeakPolarHBondContact O-CG 3.36Å; A695-L699 PolarHBondContact O-N 2.89Å; L699-Q701 PolarHBondContact O-N 2.72Å; L699-L702 HydrophobicContact CB-CD1 4.29Å; L699-L702 HydrophobicContact CD2-CD1 3.71Å; L699-L702 WeakPolarHBondContact O-CB 3.41Å; L699-L702 WeakPolarHBondContact O-CG 3.46Å; L699-L702 PolarHBondContact O-N 3.41Å; L699-L702 VanDerWaalsContact O-N 3.15Å; L699-W713 HydrophobicContact CD1-CD2 4.3Å; L699-W713 HydrophobicContact CD1-CE3 3.52Å; L699-W713 HydrophobicContact CD1-CH2 4.14Å; L699-W713 HydrophobicContact CD1-CZ3 3.44Å; L699-W713 VanDerWaalsContact CD1-CZ3 3.44Å; L699-L714 HydrophobicContact CB-CD1 4.36Å; L699-L714 HydrophobicContact CB-CD2 4Å; L699-L714 HydrophobicContact CB-CG 4.33Å
700	G	87.9	Confident	84.9	Confident	32 Å²	32	48.2 Å²	48.2	33%	0.33	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-14	171.9	0	0	0	0	0	115	V696 L698	V696-G700 PolarHBondContact O-N 3.13Å; L698-G700 VanDerWaalsContact C-N 3.25Å; L698-G700 PolarHBondContact O-N 2.56Å
701	Q	85.9	Confident	85.7	Confident	83 Å²	83	45.8 Å²	45.8	39%	0.388	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.5	-9	175.2	-69.9	163.9	46.4	0	0	113.4	Y650 L665 R697 L698 L699	Y650-Q701 PolarHBondContact OH-OE1 3.5Å; L665-Q701 HydrophobicContact CD1-CB 3.95Å; L665-Q701 HydrophobicContact CD2-CB 4.1Å; R697-Q701 WeakPolarHBondContact O-CG 3.17Å; R697-Q701 PolarHBondContact O-NE2 3.3Å; L698-Q701 WeakPolarHBondContact O-CB 3.4Å; L698-Q701 PolarHBondContact O-N 2.88Å; L699-Q701 PolarHBondContact O-N 2.72Å
702	L	84.6	Confident	86.4	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	24%	0.243	C	C	.	.			trans	-62.2	156.7	178.5	-67.2	173.9	0	0	0	112.5	L665 L666 L699 R707 A710	L665-L702 HydrophobicContact CB-CD2 3.66Å; L665-L702 HydrophobicContact CD1-CD2 4.06Å; L666-L702 HydrophobicContact CD2-CD1 3.86Å; L666-L702 HydrophobicContact CD2-CD2 4.48Å; L666-L702 HydrophobicContact CG-CD1 4.34Å; L666-L702 HydrophobicContact CG-CD2 4.07Å; L699-L702 HydrophobicContact CB-CD1 4.29Å; L699-L702 HydrophobicContact CD2-CD1 3.71Å; L699-L702 WeakPolarHBondContact O-CB 3.41Å; L699-L702 WeakPolarHBondContact O-CG 3.46Å; L699-L702 PolarHBondContact O-N 3.41Å; L699-L702 VanDerWaalsContact O-N 3.15Å; L702-R707 HydrophobicContact CB-CB 4.1Å; L702-R707 HydrophobicContact CB-CG 4.5Å; L702-R707 VanDerWaalsContact O-CD 3.31Å; L702-R707 WeakPolarHBondContact O-CD 3.42Å; L702-R707 WeakPolarHBondContact O-CG 3.49Å; L702-A710 HydrophobicContact CD1-CB 4.1Å
703	R	81.1	Confident	86.8	Confident	129 Å²	129	49.4 Å²	49.4	49%	0.487	24%	0.242	S	C	.	.			trans	-134.8	174.8	177.1	-63.2	-168.2	-174.2	-165	0.1	111	S706	R703-S706 PolarHBondContact O-OG 3.46Å
704	G	83.6	Confident	87.1	Confident	6 Å²	6	46.1 Å²	46.1	6%	0.062	23%	0.227	C	C	.	.	H	α-helix	trans	63.1	-161	-178.7	0	0	0	0	0	112.9	I600 E602 S706 R707	I600-G704 WeakPolarHBondContact O-CA 3.46Å; E602-G704 VanDerWaalsContact CG-CA 3.49Å; E602-G704 PolarHBondContact OE1-N 2.65Å; G704-S706 PolarHBondContact O-N 2.7Å; G704-S706 VanDerWaalsContact O-N 3.16Å; G704-R707 WeakPolarHBondContact O-CB 3.33Å; G704-R707 PolarHBondContact O-N 3.31Å; G704-R707 VanDerWaalsContact O-N 3.1Å
705	Q	85	Confident	87.5	Confident	77 Å²	77	47.4 Å²	47.4	36%	0.36	23%	0.234	S	C	.	.	H	α-helix	trans	-65	-22	-176.5	-171	65	11.4	0	0	112.5	V597 I600 R707 V708 V709	V597-Q705 HydrophobicContact CG1-CB 3.52Å; V597-Q705 HydrophobicContact CG1-CG 3.53Å; I600-Q705 HydrophobicContact CB-CB 4.44Å; I600-Q705 HydrophobicContact CG2-CB 4.14Å; I600-Q705 PolarHBondContact O-N 2.89Å; I600-Q705 VanDerWaalsContact O-N 3.13Å; Q705-R707 VanDerWaalsContact C-N 3.3Å; Q705-R707 PolarHBondContact O-N 3.18Å; Q705-V708 PolarHBondContact O-N 3.49Å; Q705-V709 PolarHBondContact O-N 3.4Å
706	S	85.3	Confident	87.7	Confident	0 Å²	0	49 Å²	49	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-61.8	-36	174.2	79.5	0	0	0	0	112.9	C594 R703 G704 A710	C594-S706 PolarHBondContact SG-O 2.89Å; C594-S706 VanDerWaalsContact SG-O 3.4Å; R703-S706 PolarHBondContact O-OG 3.46Å; G704-S706 PolarHBondContact O-N 2.7Å; G704-S706 VanDerWaalsContact O-N 3.16Å; S706-A710 WeakPolarHBondContact O-CB 3.43Å; S706-A710 PolarHBondContact O-N 3.15Å; S706-A710 VanDerWaalsContact O-N 3.08Å
707	R	88.4	Confident	87.7	Confident	123 Å²	123	48.1 Å²	48.1	46%	0.464	24%	0.238	S	C	.	.	H	α-helix	trans	-68.8	-39.3	175.4	-170.7	-167.5	176.5	160.7	-2.3	111.6	L702 G704 Q705 A710 N711	L702-R707 HydrophobicContact CB-CB 4.1Å; L702-R707 HydrophobicContact CB-CG 4.5Å; L702-R707 VanDerWaalsContact O-CD 3.31Å; L702-R707 WeakPolarHBondContact O-CD 3.42Å; L702-R707 WeakPolarHBondContact O-CG 3.49Å; G704-R707 WeakPolarHBondContact O-CB 3.33Å; G704-R707 PolarHBondContact O-N 3.31Å; G704-R707 VanDerWaalsContact O-N 3.1Å; Q705-R707 VanDerWaalsContact C-N 3.3Å; Q705-R707 PolarHBondContact O-N 3.18Å; R707-A710 CarbonylContact O-C 3.58Å; R707-A710 PolarHBondContact O-N 3.37Å; R707-N711 WeakPolarHBondContact O-CB 3.47Å; R707-N711 PolarHBondContact O-N 3.04Å
708	V	88.1	Confident	87.8	Confident	83 Å²	83	47.6 Å²	47.6	50%	0.503	24%	0.236	S	C	.	.	H	α-helix	trans	-61.4	-46.2	179.7	-176.7	0	0	0	0	110.2	Q705 A710 N711	Q705-V708 PolarHBondContact O-N 3.49Å; V708-A710 PolarHBondContact O-N 3.33Å; V708-N711 WeakPolarHBondContact O-CB 3.36Å; V708-N711 PolarHBondContact O-N 2.81Å
709	V	88.4	Confident	88	Confident	42 Å²	42	48.7 Å²	48.7	26%	0.255	24%	0.24	S	C	.	.	H	α-helix	trans	-67.1	-35	176.2	178.7	0	0	0	0	112.3	V593 C594 Q705 N711	V593-V709 HydrophobicContact CB-CG1 3.99Å; V593-V709 HydrophobicContact CG1-CG1 3.73Å; V593-V709 HydrophobicContact CG1-CG2 4.3Å; C594-V709 VanDerWaalsContact SG-CG1 3.56Å; Q705-V709 PolarHBondContact O-N 3.4Å; V709-N711 VanDerWaalsContact C-N 3.3Å; V709-N711 PolarHBondContact O-N 2.95Å
710	A	90.8	Very high	88.1	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-73.9	-18.1	175.7	0	0	0	0	0	113.8	L702 S706 R707 V708 D712 W713 L714	L702-A710 HydrophobicContact CD1-CB 4.1Å; S706-A710 WeakPolarHBondContact O-CB 3.43Å; S706-A710 PolarHBondContact O-N 3.15Å; S706-A710 VanDerWaalsContact O-N 3.08Å; R707-A710 CarbonylContact O-C 3.58Å; R707-A710 PolarHBondContact O-N 3.37Å; V708-A710 PolarHBondContact O-N 3.33Å; A710-D712 PolarHBondContact O-N 3.27Å; A710-W713 PolarHBondContact O-N 2.91Å; A710-L714 HydrophobicContact CB-CD1 4.41Å; A710-L714 WeakPolarHBondContact O-CG 3.16Å; A710-L714 PolarHBondContact O-N 2.72Å
711	N	91.3	Very high	88.1	Confident	75 Å²	75	48.6 Å²	48.6	40%	0.401	23%	0.232	S	C	.	.	H	α-helix	trans	-62.9	-44	-170.6	-173.5	80.9	0	0	0	112.8	R707 V708 V709 W713 L714 V715	R707-N711 WeakPolarHBondContact O-CB 3.47Å; R707-N711 PolarHBondContact O-N 3.04Å; V708-N711 WeakPolarHBondContact O-CB 3.36Å; V708-N711 PolarHBondContact O-N 2.81Å; V709-N711 VanDerWaalsContact C-N 3.3Å; V709-N711 PolarHBondContact O-N 2.95Å; N711-W713 VanDerWaalsContact C-N 3.31Å; N711-W713 PolarHBondContact O-N 3.35Å; N711-L714 WeakPolarHBondContact O-CB 3.35Å; N711-L714 PolarHBondContact O-N 3.48Å; N711-L714 VanDerWaalsContact O-N 3.1Å; N711-V715 WeakPolarHBondContact O-CG2 2.87Å; N711-V715 PolarHBondContact O-N 2.84Å
712	D	90.5	Very high	88.3	Confident	101 Å²	101	48.7 Å²	48.7	54%	0.54	23%	0.232	S	C	.	.	H	α-helix	trans	-62	-42.6	179.9	-58.3	-7.6	0	0	0	110.8	A710 V715 D716	A710-D712 PolarHBondContact O-N 3.27Å; D712-V715 PolarHBondContact O-N 3.17Å; D712-D716 PolarHBondContact O-N 3.17Å; D712-D716 VanDerWaalsContact O-N 3.12Å; D712-D716 VanDerWaalsContact O-OD2 3.05Å
713	W	91.4	Very high	88.4	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-66	-37.1	174.6	-176.1	94.3	0	0	0	112.1	L583 F587 V590 M673 L692 A695 V696 L699 A710 N711 V715 D716 A717	L583-W713 HydrophobicContact CD1-CD2 4.34Å; L583-W713 HydrophobicContact CD1-CG 4.34Å; L583-W713 HydrophobicContact CD1-CZ2 4.24Å; L583-W713 VanDerWaalsContact CD1-NE1 3.33Å; L583-W713 HydrophobicContact CD2-CZ2 4.17Å; L583-W713 HydrophobicContact CG-CZ2 3.82Å; L583-W713 PolarHBondContact O-NE1 2.96Å; F587-W713 HydrophobicContact CB-CZ2 4.08Å; F587-W713 HydrophobicContact CD2-CZ2 4.17Å; F587-W713 HydrophobicContact CG-CZ2 4.45Å; V590-W713 HydrophobicContact CG1-CB 4.22Å; V590-W713 HydrophobicContact CG2-CB 4.19Å; M673-W713 HydrophobicContact CE-CH2 4.32Å; M673-W713 HydrophobicContact CE-CZ2 3.64Å; M673-W713 HydrophobicContact SD-CH2 3.93Å; M673-W713 HydrophobicContact SD-CZ2 3.68Å; L692-W713 HydrophobicContact CD1-CH2 3.79Å; L692-W713 HydrophobicContact CD1-CZ2 3.9Å; A695-W713 HydrophobicContact CB-CH2 4.38Å; V696-W713 HydrophobicContact CG2-CH2 3.97Å; V696-W713 HydrophobicContact CG2-CZ3 3.79Å; L699-W713 HydrophobicContact CD1-CD2 4.3Å; L699-W713 HydrophobicContact CD1-CE3 3.52Å; L699-W713 HydrophobicContact CD1-CH2 4.14Å; L699-W713 HydrophobicContact CD1-CZ3 3.44Å; L699-W713 VanDerWaalsContact CD1-CZ3 3.44Å; A710-W713 PolarHBondContact O-N 2.91Å; N711-W713 VanDerWaalsContact C-N 3.31Å; N711-W713 PolarHBondContact O-N 3.35Å; W713-V715 VanDerWaalsContact C-N 3.33Å; W713-V715 PolarHBondContact O-N 3.29Å; W713-D716 PolarHBondContact O-N 3.21Å; W713-A717 HydrophobicContact CD2-CB 4.38Å; W713-A717 HydrophobicContact CE3-CB 4.02Å; W713-A717 HydrophobicContact CH2-CB 3.97Å; W713-A717 HydrophobicContact CZ2-CB 4.31Å; W713-A717 HydrophobicContact CZ3-CB 3.79Å; W713-A717 WeakPolarHBondContact O-CB 3.27Å; W713-A717 PolarHBondContact O-N 3.48Å
714	L	91.7	Very high	88.7	Confident	6 Å²	6	42.8 Å²	42.8	3%	0.031	21%	0.21	C	C	.	.	H	α-helix	trans	-65.7	-33	176.1	-79.8	168.2	0	0	0	112.8	V696 L699 A710 N711 R718	V696-L714 HydrophobicContact CB-CD2 4.37Å; V696-L714 HydrophobicContact CG1-CD2 3.95Å; L699-L714 HydrophobicContact CB-CD1 4.36Å; L699-L714 HydrophobicContact CB-CD2 4Å; L699-L714 HydrophobicContact CB-CG 4.33Å; A710-L714 HydrophobicContact CB-CD1 4.41Å; A710-L714 WeakPolarHBondContact O-CG 3.16Å; A710-L714 PolarHBondContact O-N 2.72Å; N711-L714 WeakPolarHBondContact O-CB 3.35Å; N711-L714 PolarHBondContact O-N 3.48Å; N711-L714 VanDerWaalsContact O-N 3.1Å; L714-R718 WeakPolarHBondContact O-CD 3.32Å; L714-R718 VanDerWaalsContact O-CG 3.22Å; L714-R718 WeakPolarHBondContact O-CG 3.11Å; L714-R718 PolarHBondContact O-N 3.17Å; L714-R718 VanDerWaalsContact O-N 3.13Å
715	V	90.9	Very high	89	Confident	56 Å²	56	48.7 Å²	48.7	34%	0.339	24%	0.236	S	C	.	.	H	α-helix	trans	-68.4	-52.3	173.1	171.3	0	0	0	0	110.1	N711 D712 W713 A717 R718 H719	N711-V715 WeakPolarHBondContact O-CG2 2.87Å; N711-V715 PolarHBondContact O-N 2.84Å; D712-V715 PolarHBondContact O-N 3.17Å; W713-V715 VanDerWaalsContact C-N 3.33Å; W713-V715 PolarHBondContact O-N 3.29Å; V715-A717 VanDerWaalsContact C-N 3.29Å; V715-A717 PolarHBondContact O-N 2.8Å; V715-R718 WeakPolarHBondContact O-CB 3.26Å; V715-R718 PolarHBondContact O-N 3.35Å; V715-R718 VanDerWaalsContact O-N 3.11Å; V715-H719 PolarHBondContact O-N 3.22Å
716	D	88.8	Confident	89.2	Confident	35 Å²	35	45.7 Å²	45.7	19%	0.187	22%	0.223	C	C	.	.	H	α-helix	trans	-61.1	-36.1	178.4	-75.3	-65.5	0	0	0	113	W578 L583 R586 D712 W713 H719 Y720	W578-D716 VanDerWaalsContact CD1-CG 3.45Å; W578-D716 HydrophobicContact CG-CB 4.42Å; W578-D716 PolarHBondContact NE1-OD1 3.35Å; L583-D716 HydrophobicContact CD1-CB 4.28Å; R586-D716 IonicContact CZ-OD2 3.78Å; R586-D716 VanDerWaalsContact NH1-CG 3.31Å; R586-D716 IonicContact NH1-OD1 3.73Å; R586-D716 IonicContact NH1-OD2 3.38Å; R586-D716 PolarHBondContact NH1-OD2 2.88Å; R586-D716 IonicContact NH2-OD2 3.54Å; R586-D716 PolarHBondContact NH2-OD2 3.24Å; D712-D716 PolarHBondContact O-N 3.17Å; D712-D716 VanDerWaalsContact O-N 3.12Å; D712-D716 VanDerWaalsContact O-OD2 3.05Å; W713-D716 PolarHBondContact O-N 3.21Å; D716-H719 PolarHBondContact O-N 3.23Å; D716-Y720 PolarHBondContact O-N 3.1Å
717	A	89.3	Confident	89.3	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-68.3	-35.7	175	0	0	0	0	0	112.8	L583 V696 W713 V715 Y720 L721	L583-A717 HydrophobicContact CD1-CB 4.22Å; L583-A717 HydrophobicContact CD2-CB 3.77Å; L583-A717 HydrophobicContact CG-CB 4.49Å; V696-A717 HydrophobicContact CG2-CB 3.58Å; W713-A717 HydrophobicContact CD2-CB 4.38Å; W713-A717 HydrophobicContact CE3-CB 4.02Å; W713-A717 HydrophobicContact CH2-CB 3.97Å; W713-A717 HydrophobicContact CZ2-CB 4.31Å; W713-A717 HydrophobicContact CZ3-CB 3.79Å; W713-A717 WeakPolarHBondContact O-CB 3.27Å; W713-A717 PolarHBondContact O-N 3.48Å; V715-A717 VanDerWaalsContact C-N 3.29Å; V715-A717 PolarHBondContact O-N 2.8Å; A717-Y720 PolarHBondContact O-N 3.06Å; A717-L721 WeakPolarHBondContact O-CG 3.34Å; A717-L721 PolarHBondContact O-N 2.69Å
718	R	89.7	Confident	89.4	Confident	131 Å²	131	44.7 Å²	44.7	49%	0.494	22%	0.22	S	C	.	.	H	α-helix	trans	-67.2	-46.5	172.8	-76	169.1	-173	-179	3.1	111.3	L714 V715 Y720 L721 E722	L714-R718 WeakPolarHBondContact O-CD 3.32Å; L714-R718 VanDerWaalsContact O-CG 3.22Å; L714-R718 WeakPolarHBondContact O-CG 3.11Å; L714-R718 PolarHBondContact O-N 3.17Å; L714-R718 VanDerWaalsContact O-N 3.13Å; V715-R718 WeakPolarHBondContact O-CB 3.26Å; V715-R718 PolarHBondContact O-N 3.35Å; V715-R718 VanDerWaalsContact O-N 3.11Å; R718-Y720 PolarHBondContact O-N 3.27Å; R718-L721 PolarHBondContact O-N 3.4Å; R718-E722 WeakPolarHBondContact O-CB 3.24Å; R718-E722 WeakPolarHBondContact O-CG 3.38Å; R718-E722 PolarHBondContact O-N 3.09Å
719	H	89.2	Confident	89.5	Confident	41 Å²	41	43.4 Å²	43.4	19%	0.19	21%	0.213	C	C	.	.	H	α-helix	trans	-57.2	-37.1	175.6	-68.4	162.7	0	0	0	112.3	I572 V715 D716 E722 A723	I572-H719 HydrophobicContact CD1-CB 3.98Å; I572-H719 HydrophobicContact CG1-CB 3.79Å; V715-H719 PolarHBondContact O-N 3.22Å; D716-H719 PolarHBondContact O-N 3.23Å; H719-E722 IonicContact CD2-OE2 3.89Å; H719-A723 VanDerWaalsContact O-CB 3.3Å; H719-A723 WeakPolarHBondContact O-CB 3.42Å; H719-A723 PolarHBondContact O-N 2.81Å
720	Y	88.8	Confident	89.6	Confident	1 Å²	1	41.5 Å²	41.5	0%	0.004	20%	0.201	C	C	.	.	H	α-helix	trans	-65.3	-47.7	171.4	178.7	-101.2	0	0	0	113.3	V577 W578 E580 L692 D716 A717 R718 A723 K724	V577-Y720 VanDerWaalsContact CG1-CA 3.48Å; V577-Y720 HydrophobicContact CG1-CD2 3.89Å; V577-Y720 HydrophobicContact CG1-CG 4.37Å; W578-Y720 WeakPolarHBondContact O-CD2 3.45Å; E580-Y720 HydrophobicContact CB-CE1 4.2Å; E580-Y720 HydrophobicContact CG-CE1 4.29Å; L692-Y720 HydrophobicContact CD2-CD1 3.43Å; L692-Y720 VanDerWaalsContact CD2-CD1 3.43Å; L692-Y720 HydrophobicContact CD2-CE1 3.67Å; D716-Y720 PolarHBondContact O-N 3.1Å; A717-Y720 PolarHBondContact O-N 3.06Å; R718-Y720 PolarHBondContact O-N 3.27Å; Y720-A723 PolarHBondContact O-N 2.9Å; Y720-K724 HydrophobicContact CE1-CD 3.71Å; Y720-K724 VanDerWaalsContact O-CB 3.27Å; Y720-K724 WeakPolarHBondContact O-CB 3.19Å; Y720-K724 PolarHBondContact O-N 3.04Å; Y720-K724 VanDerWaalsContact OH-CE 3.27Å; Y720-K724 WeakPolarHBondContact OH-CE 3.46Å; Y720-K724 PolarHBondContact OH-NZ 2.78Å
721	L	88.2	Confident	89.7	Confident	32 Å²	32	42.9 Å²	42.9	17%	0.168	21%	0.208	C	C	.	.	H	α-helix	trans	-65.1	-39.1	178.8	-69.8	170.2	0	0	0	112.2	L692 E693 V696 A717 R718 K724 Q725	L692-L721 HydrophobicContact CD2-CD2 4.13Å; L692-L721 HydrophobicContact CD2-CG 4.37Å; E693-L721 HydrophobicContact CG-CD1 4.25Å; E693-L721 HydrophobicContact CG-CD2 4.04Å; V696-L721 HydrophobicContact CG2-CD1 4.12Å; A717-L721 WeakPolarHBondContact O-CG 3.34Å; A717-L721 PolarHBondContact O-N 2.69Å; R718-L721 PolarHBondContact O-N 3.4Å; L721-K724 PolarHBondContact O-N 3.49Å; L721-Q725 WeakPolarHBondContact O-CB 3.44Å; L721-Q725 PolarHBondContact O-N 3.23Å
722	E	88.5	Confident	89.7	Confident	84 Å²	84	42.3 Å²	42.3	39%	0.393	21%	0.214	S	C	.	.	H	α-helix	trans	-63	-45.8	174.7	-73.7	165.3	-167.2	0	0	111.5	I572 R718 H719 T726	I572-E722 HydrophobicContact CD1-CB 4.25Å; R718-E722 WeakPolarHBondContact O-CB 3.24Å; R718-E722 WeakPolarHBondContact O-CG 3.38Å; R718-E722 PolarHBondContact O-N 3.09Å; H719-E722 IonicContact CD2-OE2 3.89Å; E722-T726 VanDerWaalsContact O-CB 3.24Å; E722-T726 WeakPolarHBondContact O-CB 3.41Å; E722-T726 PolarHBondContact O-N 3.4Å; E722-T726 PolarHBondContact O-OG1 3.18Å
723	A	87.7	Confident	89.7	Confident	2 Å²	2	40.3 Å²	40.3	2%	0.017	20%	0.199	C	C	.	.	H	α-helix	trans	-65.3	-41.1	174.7	0	0	0	0	0	112.3	L516 I572 V577 H719 Y720 T726 A727	L516-A723 HydrophobicContact CD1-CB 3.95Å; L516-A723 WeakPolarHBondContact CD1-O 3.15Å; L516-A723 HydrophobicContact CD2-CB 3.92Å; I572-A723 HydrophobicContact CG2-CB 4.33Å; V577-A723 HydrophobicContact CG2-CB 4.13Å; H719-A723 VanDerWaalsContact O-CB 3.3Å; H719-A723 WeakPolarHBondContact O-CB 3.42Å; H719-A723 PolarHBondContact O-N 2.81Å; Y720-A723 PolarHBondContact O-N 2.9Å; A723-T726 WeakPolarHBondContact O-CB 3.35Å; A723-T726 PolarHBondContact O-N 3.49Å; A723-A727 WeakPolarHBondContact O-CB 3.22Å; A723-A727 PolarHBondContact O-N 3.36Å
724	K	87.8	Confident	89.7	Confident	3 Å²	3	40.4 Å²	40.4	1%	0.013	20%	0.2	C	C	.	.	H	α-helix	trans	-67	-40.1	177.9	-163	174.3	-156.7	171	0	111.7	H517 E580 D689 Y720 L721 R728	H517-K724 WeakPolarHBondContact NE2-CE 3.47Å; E580-K724 IonicContact OE2-NZ 3.99Å; E580-K724 PolarHBondContact OE2-NZ 3.45Å; E580-K724 VanDerWaalsContact OE2-NZ 3.09Å; D689-K724 VanDerWaalsContact CG-NZ 3.25Å; D689-K724 IonicContact OD1-NZ 2.64Å; D689-K724 PolarHBondContact OD1-NZ 2.7Å; D689-K724 WeakPolarHBondContact OD2-CD 3.26Å; D689-K724 WeakPolarHBondContact OD2-CE 3.3Å; D689-K724 IonicContact OD2-NZ 3.09Å; D689-K724 PolarHBondContact OD2-NZ 3.45Å; D689-K724 VanDerWaalsContact OD2-NZ 3.15Å; Y720-K724 HydrophobicContact CE1-CD 3.71Å; Y720-K724 VanDerWaalsContact O-CB 3.27Å; Y720-K724 WeakPolarHBondContact O-CB 3.19Å; Y720-K724 PolarHBondContact O-N 3.04Å; Y720-K724 VanDerWaalsContact OH-CE 3.27Å; Y720-K724 WeakPolarHBondContact OH-CE 3.46Å; Y720-K724 PolarHBondContact OH-NZ 2.78Å; L721-K724 PolarHBondContact O-N 3.49Å; K724-R728 WeakPolarHBondContact O-CB 3.39Å; K724-R728 WeakPolarHBondContact O-CG 3.47Å; K724-R728 PolarHBondContact O-N 3.4Å
725	Q	88.9	Confident	89.7	Confident	130 Å²	130	42.5 Å²	42.5	61%	0.607	22%	0.218	S	C	*	.	H	α-helix	trans	-66.6	-42.4	173.6	-176.9	177.1	-6.7	0	0	111.5	L721 R728 T729	L721-Q725 WeakPolarHBondContact O-CB 3.44Å; L721-Q725 PolarHBondContact O-N 3.23Å; Q725-R728 PolarHBondContact O-N 3.05Å; Q725-T729 HydrophobicContact CG-CG2 4.4Å; Q725-T729 WeakPolarHBondContact O-CB 3.38Å; Q725-T729 WeakPolarHBondContact O-CG2 3.27Å; Q725-T729 PolarHBondContact O-N 2.78Å; Q725-T729 PolarHBondContact O-OG1 3.22Å
726	T	89.2	Confident	89.6	Confident	14 Å²	14	42.6 Å²	42.6	9%	0.086	23%	0.225	C	C	.	.	H	α-helix	trans	-57.8	-50.8	173.3	-64.9	0	0	0	0	110.8	I564 L568 E722 A723 R728 T729 L730	I564-T726 HydrophobicContact CG2-CG2 3.71Å; L568-T726 HydrophobicContact CD1-CG2 4.29Å; E722-T726 VanDerWaalsContact O-CB 3.24Å; E722-T726 WeakPolarHBondContact O-CB 3.41Å; E722-T726 PolarHBondContact O-N 3.4Å; E722-T726 PolarHBondContact O-OG1 3.18Å; A723-T726 WeakPolarHBondContact O-CB 3.35Å; A723-T726 PolarHBondContact O-N 3.49Å; T726-R728 VanDerWaalsContact C-N 3.35Å; T726-R728 PolarHBondContact O-N 2.89Å; T726-T729 PolarHBondContact O-N 3.24Å; T726-T729 PolarHBondContact O-OG1 2.82Å; T726-L730 HydrophobicContact CG2-CD1 4.26Å; T726-L730 WeakPolarHBondContact O-CB 3.4Å; T726-L730 VanDerWaalsContact O-CG 3.3Å; T726-L730 WeakPolarHBondContact O-CG 3.32Å; T726-L730 PolarHBondContact O-N 2.76Å; T726-L730 VanDerWaalsContact O-N 3.07Å
727	A	88	Confident	89.6	Confident	1 Å²	1	43.8 Å²	43.8	1%	0.008	23%	0.227	C	C	.	.	H	α-helix	trans	-57.7	-44.4	176.8	0	0	0	0	0	112.7	L512 A513 L516 A723 L731	L512-A727 HydrophobicContact CD2-CB 3.57Å; A513-A727 HydrophobicContact CB-CB 4.11Å; L516-A727 HydrophobicContact CD1-CB 3.94Å; A723-A727 WeakPolarHBondContact O-CB 3.22Å; A723-A727 PolarHBondContact O-N 3.36Å; A727-L731 WeakPolarHBondContact O-CB 3.42Å; A727-L731 WeakPolarHBondContact O-CG 3.21Å; A727-L731 PolarHBondContact O-N 3.29Å
728	R	89.5	Confident	89.5	Confident	101 Å²	101	44.7 Å²	44.7	38%	0.381	23%	0.231	S	C	.	.	H	α-helix	trans	-70.5	-39.5	180	-77.9	-177.2	173.7	151.9	3.8	114	N685 D689 K724 Q725 T726 L730 L731 A732	N685-R728 PolarHBondContact O-NH2 3.29Å; D689-R728 IonicContact OD2-CZ 3.25Å; D689-R728 IonicContact OD2-NH1 3.38Å; D689-R728 PolarHBondContact OD2-NH1 2.78Å; D689-R728 IonicContact OD2-NH2 2.91Å; D689-R728 PolarHBondContact OD2-NH2 2.97Å; K724-R728 WeakPolarHBondContact O-CB 3.39Å; K724-R728 WeakPolarHBondContact O-CG 3.47Å; K724-R728 PolarHBondContact O-N 3.4Å; Q725-R728 PolarHBondContact O-N 3.05Å; T726-R728 VanDerWaalsContact C-N 3.35Å; T726-R728 PolarHBondContact O-N 2.89Å; R728-L730 VanDerWaalsContact C-N 3.33Å; R728-L731 PolarHBondContact O-N 3.33Å; R728-A732 VanDerWaalsContact O-CB 3.27Å; R728-A732 WeakPolarHBondContact O-CB 3.46Å; R728-A732 PolarHBondContact O-N 3.13Å
729	T	91.2	Very high	89.5	Confident	57 Å²	57	44.1 Å²	44.1	35%	0.35	24%	0.237	S	C	.	.	H	α-helix	trans	-66.8	-37.1	176.9	50.8	0	0	0	0	111.4	Q725 T726 Y733	Q725-T729 HydrophobicContact CG-CG2 4.4Å; Q725-T729 WeakPolarHBondContact O-CB 3.38Å; Q725-T729 WeakPolarHBondContact O-CG2 3.27Å; Q725-T729 PolarHBondContact O-N 2.78Å; Q725-T729 PolarHBondContact O-OG1 3.22Å; T726-T729 PolarHBondContact O-N 3.24Å; T726-T729 PolarHBondContact O-OG1 2.82Å; T729-Y733 VanDerWaalsContact O-CB 3.29Å; T729-Y733 WeakPolarHBondContact O-CB 3.25Å; T729-Y733 PolarHBondContact O-N 3.3Å
730	L	91.3	Very high	89.4	Confident	1 Å²	1	44 Å²	44	1%	0.005	24%	0.241	C	C	.	.	H	α-helix	trans	-63.8	-52.2	170	-68.3	177.4	0	0	0	112	C509 I549 V561 I564 L565 T726 R728 A732 Y733 V734	C509-L730 HydrophobicContact CB-CB 4.35Å; I549-L730 HydrophobicContact CD1-CD1 4.48Å; V561-L730 HydrophobicContact CB-CD2 4.05Å; V561-L730 HydrophobicContact CG1-CD2 3.73Å; V561-L730 HydrophobicContact CG2-CD2 3.9Å; I564-L730 HydrophobicContact CB-CD2 3.97Å; I564-L730 HydrophobicContact CD1-CD2 3.97Å; I564-L730 HydrophobicContact CG2-CD1 4.26Å; I564-L730 HydrophobicContact CG2-CD2 3.77Å; I564-L730 HydrophobicContact CG2-CG 3.83Å; L565-L730 HydrophobicContact CD2-CD1 4.12Å; T726-L730 HydrophobicContact CG2-CD1 4.26Å; T726-L730 WeakPolarHBondContact O-CB 3.4Å; T726-L730 VanDerWaalsContact O-CG 3.3Å; T726-L730 WeakPolarHBondContact O-CG 3.32Å; T726-L730 PolarHBondContact O-N 2.76Å; T726-L730 VanDerWaalsContact O-N 3.07Å; R728-L730 VanDerWaalsContact C-N 3.33Å; L730-A732 VanDerWaalsContact C-N 3.34Å; L730-A732 PolarHBondContact O-N 2.65Å; L730-Y733 PolarHBondContact O-N 3.02Å; L730-V734 WeakPolarHBondContact O-CG2 3.4Å; L730-V734 PolarHBondContact O-N 3.28Å
731	L	91.4	Very high	89.3	Confident	29 Å²	29	44.2 Å²	44.2	15%	0.152	24%	0.242	C	C	.	.	H	α-helix	trans	-57	-44.8	178.1	-84.2	167.4	0	0	0	112.6	C509 E510 A513 A727 R728 V734 A735	C509-L731 HydrophobicContact CB-CD2 4.19Å; C509-L731 HydrophobicContact CB-CG 4.23Å; E510-L731 HydrophobicContact CB-CD2 4.13Å; E510-L731 WeakPolarHBondContact OE2-CD2 3.43Å; A513-L731 HydrophobicContact CB-CD1 3.55Å; A727-L731 WeakPolarHBondContact O-CB 3.42Å; A727-L731 WeakPolarHBondContact O-CG 3.21Å; A727-L731 PolarHBondContact O-N 3.29Å; R728-L731 PolarHBondContact O-N 3.33Å; L731-V734 PolarHBondContact O-N 2.87Å; L731-A735 WeakPolarHBondContact O-CB 3.5Å; L731-A735 PolarHBondContact O-N 3.16Å
732	A	91.2	Very high	89.2	Confident	64 Å²	64	47.2 Å²	47.2	53%	0.529	25%	0.254	S	S	.	.	H	α-helix	trans	-64.6	-40.4	177.1	0	0	0	0	0	112.4	R728 L730 A736	R728-A732 VanDerWaalsContact O-CB 3.27Å; R728-A732 WeakPolarHBondContact O-CB 3.46Å; R728-A732 PolarHBondContact O-N 3.13Å; L730-A732 VanDerWaalsContact C-N 3.34Å; L730-A732 PolarHBondContact O-N 2.65Å; A732-A736 VanDerWaalsContact O-CB 3.28Å; A732-A736 WeakPolarHBondContact O-CB 3.46Å; A732-A736 PolarHBondContact O-N 3.17Å
733	Y	91.9	Very high	89.2	Confident	59 Å²	59	50.2 Å²	50.2	23%	0.231	27%	0.268	C	S	.	.	H	α-helix	trans	-63.5	-43.4	174.9	173.9	-100.8	0	0	0	112.2	Y558 F560 V561 T729 L730 A736 R737	Y558-Y733 AromaticContact CD1-CE1 3.9Å; Y558-Y733 HydrophobicContact CD1-CE1 3.9Å; F560-Y733 HydrophobicContact CB-CE2 4.02Å; F560-Y733 HydrophobicContact CD1-CD1 4.2Å; F560-Y733 AromaticContact CD1-CD2 3.32Å; F560-Y733 HydrophobicContact CD1-CD2 3.32Å; F560-Y733 HydrophobicContact CD1-CE1 4.47Å; F560-Y733 AromaticContact CD1-CE2 3.65Å; F560-Y733 HydrophobicContact CD1-CE2 3.65Å; F560-Y733 AromaticContact CD1-CG 3.62Å; F560-Y733 HydrophobicContact CD1-CG 3.62Å; F560-Y733 AromaticContact CE1-CD2 3.77Å; F560-Y733 HydrophobicContact CE1-CD2 3.77Å; F560-Y733 HydrophobicContact CE1-CE2 4.47Å; F560-Y733 HydrophobicContact CE1-CG 4.02Å; F560-Y733 HydrophobicContact CG-CD2 4.24Å; F560-Y733 HydrophobicContact CG-CE2 4.14Å; V561-Y733 HydrophobicContact CG2-CD1 3.7Å; V561-Y733 HydrophobicContact CG2-CE1 3.65Å; T729-Y733 VanDerWaalsContact O-CB 3.29Å; T729-Y733 WeakPolarHBondContact O-CB 3.25Å; T729-Y733 PolarHBondContact O-N 3.3Å; L730-Y733 PolarHBondContact O-N 3.02Å; Y733-A736 PolarHBondContact O-N 3.18Å; Y733-R737 PolarHBondContact O-N 3.39Å
734	V	90.7	Very high	89.1	Confident	1 Å²	1	56.8 Å²	56.8	1%	0.006	30%	0.296	C	S	.	.	H	α-helix	trans	-70.6	-41.9	179.8	-174.9	0	0	0	0	111.1	A502 L505 W506 L730 L731 A736 R737 D738	A502-V734 VanDerWaalsContact O-CG1 3.23Å; A502-V734 WeakPolarHBondContact O-CG1 3.36Å; L505-V734 HydrophobicContact CD2-CG2 3.76Å; L505-V734 HydrophobicContact CG-CG2 3.74Å; W506-V734 HydrophobicContact CB-CG1 3.64Å; W506-V734 HydrophobicContact CG-CG1 4.44Å; L730-V734 WeakPolarHBondContact O-CG2 3.4Å; L730-V734 PolarHBondContact O-N 3.28Å; L731-V734 PolarHBondContact O-N 2.87Å; V734-A736 VanDerWaalsContact C-N 3.3Å; V734-A736 PolarHBondContact O-N 3.24Å; V734-R737 CarbonylContact O-C 3.52Å; V734-R737 WeakPolarHBondContact O-CA 3.36Å; V734-R737 WeakPolarHBondContact O-CB 3.44Å; V734-R737 PolarHBondContact O-N 3.09Å; V734-D738 PolarHBondContact O-N 3.26Å
735	A	90.7	Very high	88.7	Confident	51 Å²	51	59.5 Å²	59.5	42%	0.421	31%	0.306	S	S	.	.	H	α-helix	trans	-59.9	-39.5	173.3	0	0	0	0	0	112.3	L731 R737 D738 I739	L731-A735 WeakPolarHBondContact O-CB 3.5Å; L731-A735 PolarHBondContact O-N 3.16Å; A735-R737 VanDerWaalsContact C-N 3.33Å; A735-D738 PolarHBondContact O-N 2.89Å; A735-I739 PolarHBondContact O-N 2.83Å
736	A	90.7	Very high	88.1	Confident	58 Å²	58	63.1 Å²	63.1	48%	0.479	33%	0.329	S	S	.	.	H	α-helix	trans	-67.2	-31.9	172.8	0	0	0	0	0	112.7	A732 Y733 V734 I739 S740	A732-A736 VanDerWaalsContact O-CB 3.28Å; A732-A736 WeakPolarHBondContact O-CB 3.46Å; A732-A736 PolarHBondContact O-N 3.17Å; Y733-A736 PolarHBondContact O-N 3.18Å; V734-A736 VanDerWaalsContact C-N 3.3Å; V734-A736 PolarHBondContact O-N 3.24Å; A736-I739 WeakPolarHBondContact O-CG2 3.19Å; A736-S740 WeakPolarHBondContact O-CB 3.49Å; A736-S740 PolarHBondContact O-N 3.35Å
737	R	88.9	Confident	88.1	Confident	59 Å²	59	65.6 Å²	65.6	22%	0.223	34%	0.341	C	S	.	.	H	α-helix	trans	-68.3	-50.1	170.9	178.4	63.4	167.2	-161.1	-10.2	111.1	A502 Y558 Y733 V734 A735 I739 S740 T741	A502-R737 HydrophobicContact CB-CG 4.08Å; Y558-R737 HydrophobicContact CE1-CG 3.85Å; Y733-R737 PolarHBondContact O-N 3.39Å; V734-R737 CarbonylContact O-C 3.52Å; V734-R737 WeakPolarHBondContact O-CA 3.36Å; V734-R737 WeakPolarHBondContact O-CB 3.44Å; V734-R737 PolarHBondContact O-N 3.09Å; A735-R737 VanDerWaalsContact C-N 3.33Å; R737-I739 PolarHBondContact O-N 3.07Å; R737-S740 CarbonylContact O-C 3.59Å; R737-S740 WeakPolarHBondContact O-CA 3.24Å; R737-S740 WeakPolarHBondContact O-CB 3.5Å; R737-S740 PolarHBondContact O-N 3.49Å; R737-S740 PolarHBondContact O-OG 3.36Å; R737-T741 PolarHBondContact O-N 2.98Å
738	D	86.9	Confident	88.1	Confident	19 Å²	19	68.9 Å²	68.9	10%	0.102	36%	0.358	C	S	.	.	H	α-helix	trans	-55.2	-53	-179.5	-86.6	-44.8	0	0	0	110.6	A502 V734 A735 S740 T741 F742	A502-D738 VanDerWaalsContact CB-OD1 3.23Å; A502-D738 WeakPolarHBondContact CB-OD1 3.42Å; V734-D738 PolarHBondContact O-N 3.26Å; A735-D738 PolarHBondContact O-N 2.89Å; D738-S740 PolarHBondContact O-N 3.38Å; D738-T741 WeakPolarHBondContact O-CA 3.4Å; D738-T741 PolarHBondContact O-N 3.46Å; D738-T741 PolarHBondContact O-OG1 2.83Å; D738-F742 HydrophobicContact CB-CD2 4.39Å; D738-F742 HydrophobicContact CB-CE2 4.22Å; D738-F742 WeakPolarHBondContact O-CD2 3.41Å; D738-F742 PolarHBondContact O-N 3.37Å
739	I	89.4	Confident	88	Confident	120 Å²	120	67.2 Å²	67.2	62%	0.615	36%	0.357	S	S	*	.	H	α-helix	trans	-60.9	-30.7	179.1	-154.2	168.4	0	0	0	112.3	A735 A736 R737 F742 Q743	A735-I739 PolarHBondContact O-N 2.83Å; A736-I739 WeakPolarHBondContact O-CG2 3.19Å; R737-I739 PolarHBondContact O-N 3.07Å; I739-F742 PolarHBondContact O-N 3.21Å; I739-Q743 WeakPolarHBondContact O-CB 3.42Å; I739-Q743 PolarHBondContact O-N 3.11Å
740	S	87.4	Confident	87.8	Confident	39 Å²	39	67.8 Å²	67.8	27%	0.273	36%	0.358	S	S	.	.	H	α-helix	trans	-71.8	-26.4	172.4	83.8	0	0	0	0	114.1	A736 R737 D738 K744	A736-S740 WeakPolarHBondContact O-CB 3.49Å; A736-S740 PolarHBondContact O-N 3.35Å; R737-S740 CarbonylContact O-C 3.59Å; R737-S740 WeakPolarHBondContact O-CA 3.24Å; R737-S740 WeakPolarHBondContact O-CB 3.5Å; R737-S740 PolarHBondContact O-N 3.49Å; R737-S740 PolarHBondContact O-OG 3.36Å; D738-S740 PolarHBondContact O-N 3.38Å; S740-K744 WeakPolarHBondContact O-CG 3.27Å; S740-K744 PolarHBondContact O-N 3.01Å
741	T	86.2	Confident	87.6	Confident	4 Å²	4	71.9 Å²	71.9	3%	0.025	38%	0.38	C	S	.	.	H	α-helix	trans	-79.4	-38.6	171.1	71	0	0	0	0	111.3	L498 R737 D738 K744 R745	L498-T741 HydrophobicContact CB-CG2 4.47Å; R737-T741 PolarHBondContact O-N 2.98Å; D738-T741 WeakPolarHBondContact O-CA 3.4Å; D738-T741 PolarHBondContact O-N 3.46Å; D738-T741 PolarHBondContact O-OG1 2.83Å; T741-K744 PolarHBondContact O-N 3.47Å; T741-K744 VanDerWaalsContact O-N 3.15Å; T741-R745 WeakPolarHBondContact O-CG 3.28Å; T741-R745 PolarHBondContact O-N 2.87Å; T741-R745 VanDerWaalsContact O-N 3.12Å
742	F	86.7	Confident	87.4	Confident	96 Å²	96	74.8 Å²	74.8	42%	0.421	40%	0.395	S	S	.	.	H	α-helix	trans	-61.2	-42.5	172	-73	-66.8	0	0	0	111.8	D738 I739 K744 R745 L746	D738-F742 HydrophobicContact CB-CD2 4.39Å; D738-F742 HydrophobicContact CB-CE2 4.22Å; D738-F742 WeakPolarHBondContact O-CD2 3.41Å; D738-F742 PolarHBondContact O-N 3.37Å; I739-F742 PolarHBondContact O-N 3.21Å; F742-K744 PolarHBondContact O-N 2.95Å; F742-R745 PolarHBondContact O-N 3.22Å; F742-R745 VanDerWaalsContact O-N 3.14Å; F742-L746 PolarHBondContact O-N 2.87Å
743	Q	88	Confident	87.1	Confident	147 Å²	147	75.6 Å²	75.6	69%	0.687	39%	0.385	S	S	*	.	H	α-helix	trans	-63.4	-25.7	175.1	-173	178.4	-1	0	0	113.3	I739	I739-Q743 WeakPolarHBondContact O-CB 3.42Å; I739-Q743 PolarHBondContact O-N 3.11Å
744	K	84.6	Confident	86.7	Confident	140 Å²	140	76.8 Å²	76.8	61%	0.609	40%	0.397	S	S	*	.	H	α-helix	trans	-86.2	-15.7	175.6	-73.4	178.4	178	-172.5	0	114.2	L495 S740 T741 F742 L746	L495-K744 HydrophobicContact CD1-CB 4.15Å; L495-K744 WeakPolarHBondContact CD1-O 3.34Å; L495-K744 HydrophobicContact CD2-CB 3.62Å; L495-K744 HydrophobicContact CD2-CD 4.04Å; S740-K744 WeakPolarHBondContact O-CG 3.27Å; S740-K744 PolarHBondContact O-N 3.01Å; T741-K744 PolarHBondContact O-N 3.47Å; T741-K744 VanDerWaalsContact O-N 3.15Å; F742-K744 PolarHBondContact O-N 2.95Å; K744-L746 VanDerWaalsContact C-N 3.34Å
745	R	79.2	Confident	86.4	Confident	59 Å²	59	83.2 Å²	83.2	22%	0.223	43%	0.43	C	S	.	.			trans	-85.1	-9.5	175	-75	159.9	148.2	167.4	-13.3	113	L495 D496 A499 T741 F742	L495-R745 HydrophobicContact CB-CG 3.98Å; L495-R745 HydrophobicContact CD1-CG 4.17Å; D496-R745 IonicContact OD1-CZ 2.72Å; D496-R745 IonicContact OD1-NE 2.65Å; D496-R745 PolarHBondContact OD1-NE 3.27Å; D496-R745 IonicContact OD1-NH2 3.08Å; D496-R745 PolarHBondContact OD1-NH2 3.08Å; A499-R745 VanDerWaalsContact CB-NH2 3.29Å; T741-R745 WeakPolarHBondContact O-CG 3.28Å; T741-R745 PolarHBondContact O-N 2.87Å; T741-R745 VanDerWaalsContact O-N 3.12Å; F742-R745 PolarHBondContact O-N 3.22Å; F742-R745 VanDerWaalsContact O-N 3.14Å
746	L	78.1	Confident	86	Confident	206 Å²	206	86.1 Å²	86.1	100%	1.079	43%	0.43	S	S	*	.			trans	-100.4	0	178	-69.8	171.4	0	0	0	110.5	F742 K744	F742-L746 PolarHBondContact O-N 2.87Å; K744-L746 VanDerWaalsContact C-N 3.34Å

Retrieved 746 of 746 residues in 586.5 ms (Link to these results)

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