A0A087WZ40_HUMAN Loading...

Microtubule associated protein 7

AlphaFold DB , UniProt , Accession A0A087WZ40, Species HUMAN (Homo sapiens, Human), Gene MAP7, Length 779 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	38.4	Very low	39.7	Very low	236 Å²	236	151 Å²	151	100%	1.163	87%	0.871	S	S	*	*				0	138	0	-93.3	-66.5	150	0	0	108.2
2	P	52.1	Low	39.4	Very low	126 Å²	126	158.1 Å²	158.1	82%	0.818	87%	0.872	S	S	*	*			cis	-101.4	-173.3	-16.9	39.2	-30	0	0	0	111.5
3	G	39.5	Very low	39.4	Very low	78 Å²	78	156.7 Å²	156.7	80%	0.804	86%	0.862	S	S	*	*			trans	-153.7	161.2	169.2	0	0	0	0	0	110.3
4	S	40.7	Very low	39.4	Very low	127 Å²	127	159.8 Å²	159.8	89%	0.888	86%	0.862	S	S	*	*			trans	-125.5	107.9	-174.5	49.7	0	0	0	0	111.3
5	A	40.5	Very low	39.4	Very low	101 Å²	101	161.7 Å²	161.7	84%	0.835	86%	0.859	S	S	*	*			trans	-109.9	127.2	178.6	0	0	0	0	0	111.2
6	T	37.5	Very low	39.4	Very low	148 Å²	148	160.4 Å²	160.4	91%	0.908	86%	0.86	S	S	*	*			trans	-86.9	108.4	178.6	33.9	0	0	0	0	111.2	L8	T6-L8 PolarHBondContact O-N 3.41Å
7	A	38.9	Very low	39	Very low	98 Å²	98	159.5 Å²	159.5	81%	0.81	86%	0.855	S	S	*	*			trans	-91.1	102.9	-178.1	0	0	0	0	0	112.5	R9	A7-R9 PolarHBondContact O-N 2.74Å
8	L	37.3	Very low	38.7	Very low	160 Å²	160	156.3 Å²	156.3	84%	0.838	85%	0.854	S	S	*	*			trans	-73.9	117.3	174.6	-152.6	81	0	0	0	110.7	T6	T6-L8 PolarHBondContact O-N 3.41Å
9	R	38.3	Very low	38.7	Very low	244 Å²	244	158.6 Å²	158.6	92%	0.921	85%	0.849	S	S	*	*			trans	-89.9	109.3	178	-84.3	-176.6	169.4	160.1	-1.9	111.8	A7	A7-R9 PolarHBondContact O-N 2.74Å
10	H	37	Very low	38.9	Very low	174 Å²	174	156.6 Å²	156.6	81%	0.806	85%	0.845	S	S	*	*			trans	-76.2	121.4	164.8	-95	-83.1	0	0	0	111.6
11	E	36.5	Very low	38.7	Very low	169 Å²	169	156.7 Å²	156.7	79%	0.79	84%	0.843	S	S	*	*			trans	-85.2	120.7	177.3	-167.4	178.5	160.4	0	0	111.6	L13	E11-L13 PolarHBondContact O-N 3.17Å; E11-L13 VanDerWaalsContact O-N 3.15Å
12	R	36.1	Very low	38.8	Very low	236 Å²	236	151 Å²	151	89%	0.891	82%	0.824	S	S	*	*			trans	-85.1	83.5	-178.8	-75.8	-176.2	171.7	174.9	-2.7	112.2	K14	R12-K14 PolarHBondContact O-N 3.32Å
13	L	39.9	Very low	38.3	Very low	140 Å²	140	153 Å²	153	73%	0.733	83%	0.827	S	S	*	*			trans	-62.5	126.8	169.3	-73.9	169.9	0	0	0	111.6	E11 K15	E11-L13 PolarHBondContact O-N 3.17Å; E11-L13 VanDerWaalsContact O-N 3.15Å; L13-K15 PolarHBondContact O-N 2.61Å
14	K	38.3	Very low	37.9	Very low	200 Å²	200	152.6 Å²	152.6	87%	0.87	82%	0.822	S	S	*	*			trans	-85.9	105.2	-177.2	-64.6	172.6	-176.7	169.7	0	110.9	R12	R12-K14 PolarHBondContact O-N 3.32Å
15	K	39.4	Very low	37.7	Very low	188 Å²	188	154.8 Å²	154.8	82%	0.817	82%	0.823	S	S	*	*			trans	-83.2	114.4	172.2	-85.1	179.4	173.3	174.8	0	111.5	L13 N17	L13-K15 PolarHBondContact O-N 2.61Å; K15-N17 PolarHBondContact O-N 2.81Å
16	T	39.8	Very low	37.4	Very low	142 Å²	142	159.2 Å²	159.2	87%	0.871	82%	0.824	S	S	*	*			trans	-85	97.2	170.7	48.7	0	0	0	0	110.7
17	N	32.3	Very low	37.5	Very low	144 Å²	144	158.2 Å²	158.2	77%	0.77	82%	0.818	S	S	*	*			trans	-103.1	105.6	172.3	-75.6	-54.7	0	0	0	110.3	K15	K15-N17 PolarHBondContact O-N 2.81Å
18	A	34.5	Very low	37.5	Very low	102 Å²	102	161.1 Å²	161.1	84%	0.843	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-85.6	126.8	162.7	0	0	0	0	0	108.7
19	R	38.5	Very low	37.3	Very low	200 Å²	200	159.4 Å²	159.4	76%	0.755	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-82.7	140.4	171.3	-80.2	-172.9	168.5	-155.3	-5.3	110.1
20	P	41.7	Very low	37.7	Very low	119 Å²	119	156.9 Å²	156.9	77%	0.773	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-68.8	157.1	156.1	32.3	-33.4	0	0	0	110.2
21	I	35.7	Very low	38	Very low	158 Å²	158	156.9 Å²	156.9	81%	0.81	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-86.5	129.1	178.2	-60.8	166.5	0	0	0	108.4
22	P	40.9	Very low	38.3	Very low	117 Å²	117	156.3 Å²	156.3	76%	0.76	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-73.7	135.2	170.2	30.8	-32.7	0	0	0	110.3
23	L	40.2	Very low	38.7	Very low	169 Å²	169	153.5 Å²	153.5	89%	0.885	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-75.7	130.5	166.1	-69.2	169.3	0	0	0	108.6	L25	L23-L25 PolarHBondContact O-N 3.31Å
24	G	31.8	Very low	38.8	Very low	68 Å²	68	155.1 Å²	155.1	70%	0.701	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-77.4	119.2	177.8	0	0	0	0	0	111.3
25	L	36.8	Very low	38.8	Very low	173 Å²	173	155 Å²	155	91%	0.906	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-76.9	119.3	165.1	-68.2	170	0	0	0	108.5	L23	L23-L25 PolarHBondContact O-N 3.31Å
26	F	33	Very low	38.8	Very low	195 Å²	195	155.2 Å²	155.2	86%	0.855	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-86.9	120.3	165.4	-87.2	-90.6	0	0	0	108.9
27	T	39.9	Very low	38.7	Very low	127 Å²	127	156.2 Å²	156.2	78%	0.779	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-68.9	123.9	162.2	47.2	0	0	0	0	108.9
28	I	40.4	Very low	39.1	Very low	158 Å²	158	152.1 Å²	152.1	81%	0.81	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-95.7	128	168	-62.5	175.2	0	0	0	106.6
29	N	31.3	Very low	39	Very low	125 Å²	125	155.7 Å²	155.7	67%	0.668	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-78.2	140.9	173.7	-70.7	4.4	0	0	0	109.7	E31	N29-E31 VanDerWaalsContact C-N 3.31Å; N29-E31 PolarHBondContact O-N 3.45Å
30	E	47.6	Very low	38.9	Very low	190 Å²	190	151 Å²	151	89%	0.888	81%	0.81	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.3	2.4	-170.9	-150.1	173.2	144.6	0	0	114.2
31	E	43.8	Very low	38.5	Very low	175 Å²	175	157 Å²	157	82%	0.818	82%	0.818	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.1	-13.2	-166.5	-63.3	-174.1	114.9	0	0	115.6	N29	N29-E31 VanDerWaalsContact C-N 3.31Å; N29-E31 PolarHBondContact O-N 3.45Å
32	D	42.4	Very low	38.8	Very low	157 Å²	157	160 Å²	160	84%	0.84	82%	0.819	S	S	*	*	S	Bend	trans	-89	-8.7	-169.3	-108.3	-22.5	0	0	0	115.6
33	E	45	Very low	38.7	Very low	176 Å²	176	160 Å²	160	82%	0.822	82%	0.819	S	S	*	*	S	Bend	trans	-77.5	-24.2	-175.6	-81.2	-131.7	111.7	0	0	114.7	Q35	E33-Q35 PolarHBondContact O-N 2.72Å
34	Q	40.5	Very low	38.3	Very low	175 Å²	175	160.6 Å²	160.6	82%	0.818	81%	0.814	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.3	-15.8	-163.9	-62.2	-167.4	18	0	0	115.4
35	Q	39.2	Very low	38.3	Very low	198 Å²	198	161.6 Å²	161.6	93%	0.925	82%	0.816	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94	7.4	-173.4	-70.1	-159.1	0.8	0	0	116.3	E33	E33-Q35 PolarHBondContact O-N 2.72Å
36	K	38.4	Very low	38.5	Very low	191 Å²	191	159.4 Å²	159.4	83%	0.83	81%	0.812	S	S	*	*			trans	-114.2	2.9	-173.6	-137.2	167.6	-172.1	169.1	0	117.7	G38	K36-G38 PolarHBondContact O-N 3.23Å
37	N	37.9	Very low	38.6	Very low	163 Å²	163	157.8 Å²	157.8	87%	0.872	81%	0.812	S	S	*	*	S	Bend	trans	-88.1	67.4	173	-73.9	-37.6	0	0	0	111.7
38	G	42.3	Very low	38.3	Very low	58 Å²	58	156.7 Å²	156.7	60%	0.598	81%	0.81	S	S	*	*			trans	-171.1	34	-167.9	0	0	0	0	0	121.2	K36	K36-G38 PolarHBondContact O-N 3.23Å
39	N	31	Very low	37.7	Very low	177 Å²	177	158.7 Å²	158.7	95%	0.947	81%	0.809	S	S	*	*			trans	-176.8	154.2	137.8	-103.1	-45.4	0	0	0	115.6
40	S	37.3	Very low	37.9	Very low	102 Å²	102	161.8 Å²	161.8	71%	0.713	82%	0.816	S	S	*	*			trans	-89.3	143.8	-175.4	177.5	0	0	0	0	114.1
41	R	33.8	Very low	37	Very low	246 Å²	246	157.6 Å²	157.6	93%	0.928	80%	0.803	S	S	*	*			trans	-160.4	128.3	137.7	-107	163.1	-149.6	-109.6	2.9	111.8
42	R	40.5	Very low	36.3	Very low	219 Å²	219	158 Å²	158	83%	0.826	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-100.9	133.9	-178.2	179	-171.5	-170	-165.7	8.7	111.2
43	P	39.5	Very low	35.8	Very low	118 Å²	118	157 Å²	157	77%	0.766	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-101.1	160.2	150.3	-6.9	26.9	0	0	0	111.8
44	K	31.4	Very low	35.5	Very low	181 Å²	181	159 Å²	159	79%	0.787	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-93.5	155.4	174.5	-67.9	-178.5	177.1	-179.9	0	111.3
45	A	32	Very low	35.2	Very low	89 Å²	89	160 Å²	160	74%	0.736	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-80.1	153.4	155	0	0	0	0	0	110.6
46	P	41.5	Very low	34.7	Very low	127 Å²	127	158.4 Å²	158.4	83%	0.825	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-95.1	139	171.2	35.2	-30.5	0	0	0	112.6
47	D	34.9	Very low	34.2	Very low	161 Å²	161	153.7 Å²	153.7	86%	0.861	80%	0.802	S	S	*	*			trans	-109.8	176.3	171.9	-80.7	-55.6	0	0	0	111.4
48	S	33.2	Very low	34.2	Very low	104 Å²	104	151.2 Å²	151.2	73%	0.727	80%	0.798	S	S	*	*			trans	97.1	137.2	179.9	-155.3	0	0	0	0	113.2
49	Y	29.1	Very low	33.7	Very low	201 Å²	201	154.2 Å²	154.2	79%	0.788	81%	0.809	S	S	*	*			cis	-146.6	134.4	17	34.3	-92	0	0	0	110.7
50	K	33.7	Very low	34.3	Very low	189 Å²	189	157.4 Å²	157.4	82%	0.822	81%	0.808	S	S	*	*				63	147.8	100.1	-64.6	-159.8	173.9	-170.9	0	117.2
51	V	30.6	Very low	34.7	Very low	103 Å²	103	158.4 Å²	158.4	62%	0.624	81%	0.812	S	S	*	*			cis	-167.5	152.3	-11	127.4	0	0	0	0	109.1	D53	V51-D53 WeakPolarHBondContact CG1-OD2 3.25Å
52	Q	29	Very low	34.8	Very low	182 Å²	182	151.1 Å²	151.1	85%	0.85	81%	0.805	S	S	*	*			trans	166.2	114.9	137.4	-91.9	-175.4	12.8	0	0	108
53	D	31.4	Very low	34.8	Very low	136 Å²	136	146.7 Å²	146.7	73%	0.727	81%	0.807	S	S	*	*				80.6	99.6	59.4	-77.3	-53.1	0	0	0	115.2	V51	V51-D53 WeakPolarHBondContact CG1-OD2 3.25Å
54	K	38.3	Very low	34.8	Very low	218 Å²	218	145.2 Å²	145.2	95%	0.948	81%	0.805	S	S	*	*			trans	-145	151.8	139.8	-138.7	162.3	-172.9	172.2	0	110.1
55	K	34.7	Very low	35.3	Very low	196 Å²	196	144.3 Å²	144.3	85%	0.852	81%	0.807	S	S	*	*			trans	-127.9	142.9	-146.6	173.1	-175.9	178.6	-178	0	111.6
56	N	28.1	Very low	35.4	Very low	166 Å²	166	146 Å²	146	89%	0.888	81%	0.814	S	S	*	*			trans	-157.4	164	152.5	-106.3	-14.4	0	0	0	112.1
57	A	28.6	Very low	35.2	Very low	91 Å²	91	142.9 Å²	142.9	75%	0.752	80%	0.804	S	S	*	*			trans	-60.9	141.6	-170.6	0	0	0	0	0	113.1
58	S	37.8	Very low	35.5	Very low	112 Å²	112	144.5 Å²	144.5	78%	0.783	81%	0.807	S	S	*	*			cis	75.3	95	43.8	-177.6	0	0	0	0	114.9
59	S	31.5	Very low	35.9	Very low	120 Å²	120	146.1 Å²	146.1	84%	0.839	81%	0.807	S	S	*	*				-172.1	152.6	121.1	48.5	0	0	0	0	111.2
60	R	43.4	Very low	36.4	Very low	245 Å²	245	143.9 Å²	143.9	93%	0.925	81%	0.809	S	S	*	*			trans	-151.1	110.5	170.2	-173	-171.1	-167.3	-156.8	5.7	108.3
61	P	45.8	Very low	37.1	Very low	122 Å²	122	141 Å²	141	79%	0.792	80%	0.802	S	S	*	*			trans	-86.6	157.7	169.6	34	-31.8	0	0	0	111
62	A	36.4	Very low	37.7	Very low	94 Å²	94	145.3 Å²	145.3	78%	0.777	82%	0.815	S	S	*	*			trans	-137.1	147.2	164.6	0	0	0	0	0	108.1
63	S	40	Very low	38.6	Very low	125 Å²	125	141.7 Å²	141.7	87%	0.874	81%	0.81	S	S	*	*			trans	159.3	158.3	147.5	-73.8	0	0	0	0	111.4
64	A	38.8	Very low	39.5	Very low	88 Å²	88	138.3 Å²	138.3	73%	0.727	81%	0.808	S	S	*	*			trans	-78.3	-172.2	155.6	0	0	0	0	0	108.8
65	I	41.6	Very low	39.7	Very low	162 Å²	162	135.8 Å²	135.8	83%	0.831	80%	0.804	S	S	*	*			cis	-155.7	163.5	29.9	-56	163.5	0	0	0	107.8
66	S	34.8	Very low	40.2	Very low	125 Å²	125	135.2 Å²	135.2	87%	0.874	80%	0.802	S	S	*	*			trans	77.3	152.4	165.2	-140.2	0	0	0	0	115.9
67	G	38.3	Very low	41.4	Very low	61 Å²	61	133.1 Å²	133.1	63%	0.629	80%	0.797	S	S	*	*			cis	169.2	156.2	-9.2	0	0	0	0	0	112.9
68	Q	41.3	Very low	42.4	Very low	194 Å²	194	135.4 Å²	135.4	91%	0.907	80%	0.797	S	S	*	*			trans	66.9	94.7	172.8	-63.7	-171.7	-30.5	0	0	119.8
69	N	40.2	Very low	43.4	Very low	139 Å²	139	134.7 Å²	134.7	74%	0.743	79%	0.79	S	S	*	*				52.6	112.4	110.8	-166.6	23	0	0	0	120.8
70	N	39.8	Very low	44.8	Very low	154 Å²	154	134.2 Å²	134.2	82%	0.824	78%	0.783	S	S	*	*				-148.3	158.2	128.2	-157.5	-2.2	0	0	0	110.7
71	N	48.2	Very low	45.8	Very low	127 Å²	127	128.1 Å²	128.1	68%	0.679	78%	0.776	S	S	*	*			trans	-87.3	138.3	-171.2	-64.5	-81	0	0	0	113.1
72	H	42.8	Very low	46.4	Very low	195 Å²	195	128.4 Å²	128.4	90%	0.903	78%	0.775	S	S	*	*			trans	-136.8	143.2	148.8	-126.2	58	0	0	0	111.2
73	S	48	Very low	47.8	Very low	106 Å²	106	129 Å²	129	74%	0.741	76%	0.764	S	S	*	*			trans	-87.3	150.5	-164.8	48.1	0	0	0	0	113.3
74	G	51	Low	49.8	Very low	65 Å²	65	132 Å²	132	67%	0.67	76%	0.756	S	S	*	*			trans	50.8	85.7	144.1	0	0	0	0	0	117.8
75	N	43.2	Very low	51.9	Low	164 Å²	164	132.7 Å²	132.7	88%	0.877	75%	0.752	S	S	*	*				-162.7	139.7	107.9	-98.5	-53.2	0	0	0	110.7	P77	N75-P77 WeakPolarHBondContact O-CD 3.22Å
76	K	44.3	Very low	54.1	Low	185 Å²	185	130.1 Å²	130.1	80%	0.804	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-81.1	123.3	165.8	-63.6	173.7	-176.2	172.5	0	106.8	D78	K76-D78 PolarHBondContact O-N 3.34Å
77	P	54.2	Low	56.7	Low	122 Å²	122	127.3 Å²	127.3	79%	0.792	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-64.5	125.3	148.9	29.6	-29.6	0	0	0	106.3	N75	N75-P77 WeakPolarHBondContact O-CD 3.22Å
78	D	49.3	Very low	59.1	Low	138 Å²	138	132.7 Å²	132.7	74%	0.738	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-57.2	141.4	176.6	-78.6	-54.8	0	0	0	110.1	K76	K76-D78 PolarHBondContact O-N 3.34Å
79	P	58.4	Low	61.4	Low	98 Å²	98	128.1 Å²	128.1	64%	0.636	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-58.2	131.3	172	26.4	-33	0	0	0	107.8
80	P	62	Low	63.9	Low	109 Å²	109	130.1 Å²	130.1	71%	0.708	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-54.3	136.8	178.9	23.9	-33.8	0	0	0	108.4	V82	P80-V82 PolarHBondContact O-N 2.96Å
81	P	63	Low	66.4	Low	117 Å²	117	126.8 Å²	126.8	76%	0.76	67%	0.674	S	S	*	*	P	Polyproline II helix	trans	-52.7	120.7	-167.9	20.5	-33.1	0	0	0	108.9	L83	P81-L83 PolarHBondContact O-N 3.38Å
82	V	59.6	Low	68.4	Low	128 Å²	128	122.5 Å²	122.5	78%	0.776	66%	0.656	S	S	*	*			trans	-71.7	84.9	-173.3	-176.8	0	0	0	0	108	P80 R84	P80-V82 PolarHBondContact O-N 2.96Å; V82-R84 PolarHBondContact O-N 3.46Å
83	L	65.3	Low	70.7	Confident	106 Å²	106	120.3 Å²	120.3	56%	0.555	64%	0.639	S	S	*	*			trans	-40.7	130.9	164.9	-77.1	176.1	0	0	0	107.7	P81 D87	P81-L83 PolarHBondContact O-N 3.38Å; L83-D87 HydrophobicContact CB-CB 4.01Å; L83-D87 HydrophobicContact CD2-CB 4.26Å
84	R	80.9	Confident	72.7	Confident	188 Å²	188	120.4 Å²	120.4	71%	0.709	63%	0.628	S	S	*	*			trans	-57.6	154.4	-172.4	-64.3	-70.1	-178.5	153.3	-2.5	108.4	V82 D86 D87 R88	V82-R84 PolarHBondContact O-N 3.46Å; R84-D86 PolarHBondContact O-N 3.21Å; R84-D87 WeakPolarHBondContact CB-OD2 3.18Å; R84-D87 PolarHBondContact N-OD2 2.79Å; R84-D87 WeakPolarHBondContact O-CB 3.28Å; R84-D87 PolarHBondContact O-N 2.84Å; R84-R88 PolarHBondContact O-N 3.34Å
85	V	84.3	Confident	74.8	Confident	104 Å²	104	123.3 Å²	123.3	63%	0.63	62%	0.619	S	S	*	*	H	α-helix	trans	-54.6	-33.2	-176.6	-179.8	0	0	0	0	110.3	Q89	V85-Q89 WeakPolarHBondContact O-CB 3.36Å; V85-Q89 PolarHBondContact O-N 2.96Å
86	D	86.8	Confident	77	Confident	108 Å²	108	123.6 Å²	123.6	58%	0.578	61%	0.608	S	S	*	*	H	α-helix	trans	-63.8	-46.3	172.7	-46.4	-75.2	0	0	0	113.7	R84 Q89 R90	R84-D86 PolarHBondContact O-N 3.21Å; D86-Q89 CarbonylContact O-C 3.3Å; D86-Q89 PolarHBondContact O-N 2.79Å; D86-R90 WeakPolarHBondContact O-CG 3.33Å; D86-R90 PolarHBondContact O-N 2.84Å
87	D	88.8	Confident	79.2	Confident	66 Å²	66	119 Å²	119	35%	0.353	59%	0.589	S	S	.	*	H	α-helix	trans	-62.6	-46.3	176.3	-56.8	-38.4	0	0	0	110.8	L83 R84 Q89 R90 L91	L83-D87 HydrophobicContact CB-CB 4.01Å; L83-D87 HydrophobicContact CD2-CB 4.26Å; R84-D87 WeakPolarHBondContact CB-OD2 3.18Å; R84-D87 PolarHBondContact N-OD2 2.79Å; R84-D87 WeakPolarHBondContact O-CB 3.28Å; R84-D87 PolarHBondContact O-N 2.84Å; D87-Q89 PolarHBondContact O-N 3.27Å; D87-R90 WeakPolarHBondContact O-CB 3.31Å; D87-R90 PolarHBondContact O-N 2.77Å; D87-L91 WeakPolarHBondContact O-CB 3.23Å; D87-L91 PolarHBondContact O-N 3.49Å
88	R	89.1	Confident	80.9	Confident	173 Å²	173	118 Å²	118	65%	0.653	57%	0.574	S	S	*	*	H	α-helix	trans	-64.2	-29.6	175.7	175.6	170.6	159.2	-90.2	3	111.8	R84 A92	R84-R88 PolarHBondContact O-N 3.34Å; R88-A92 WeakPolarHBondContact O-CB 3.25Å; R88-A92 PolarHBondContact O-N 2.88Å
89	Q	90.9	Very high	82.9	Confident	98 Å²	98	119.4 Å²	119.4	46%	0.458	57%	0.569	S	S	.	*	H	α-helix	trans	-78.4	-38.6	173.7	-157.9	-173.2	72.2	0	0	111.9	V85 D86 D87 A92 R93	V85-Q89 WeakPolarHBondContact O-CB 3.36Å; V85-Q89 PolarHBondContact O-N 2.96Å; D86-Q89 CarbonylContact O-C 3.3Å; D86-Q89 PolarHBondContact O-N 2.79Å; D87-Q89 PolarHBondContact O-N 3.27Å; Q89-A92 CarbonylContact O-C 3.57Å; Q89-A92 WeakPolarHBondContact O-CA 3.21Å; Q89-A92 WeakPolarHBondContact O-CB 3.41Å; Q89-A92 PolarHBondContact O-N 3.49Å; Q89-A92 VanDerWaalsContact O-N 3.08Å; Q89-R93 WeakPolarHBondContact O-CG 3.15Å; Q89-R93 PolarHBondContact O-N 3.34Å
90	R	92.7	Very high	84.6	Confident	182 Å²	182	120.2 Å²	120.2	69%	0.687	56%	0.564	S	S	*	*	H	α-helix	trans	-56.4	-53.3	170.6	-77.9	176.4	172.7	-123.5	1.4	110.6	D86 D87 A92 R93 E94	D86-R90 WeakPolarHBondContact O-CG 3.33Å; D86-R90 PolarHBondContact O-N 2.84Å; D87-R90 WeakPolarHBondContact O-CB 3.31Å; D87-R90 PolarHBondContact O-N 2.77Å; R90-A92 PolarHBondContact O-N 3.27Å; R90-R93 WeakPolarHBondContact O-CA 3.36Å; R90-R93 PolarHBondContact O-N 2.77Å; R90-E94 WeakPolarHBondContact O-CB 3.17Å; R90-E94 PolarHBondContact O-N 2.84Å
91	L	91.6	Very high	86.2	Confident	84 Å²	84	121 Å²	121	44%	0.44	56%	0.556	S	S	.	*	H	α-helix	trans	-62.7	-14.1	176.4	-156.2	80.9	0	0	0	113.2	D87 R95	D87-L91 WeakPolarHBondContact O-CB 3.23Å; D87-L91 PolarHBondContact O-N 3.49Å; L91-R95 PolarHBondContact O-NE 3.24Å; L91-R95 PolarHBondContact O-NH2 2.76Å
92	A	90.1	Very high	87.6	Confident	37 Å²	37	120 Å²	120	31%	0.306	54%	0.541	S	S	.	.	H	α-helix	trans	-94.6	-21.3	172.6	0	0	0	0	0	113.7	R88 Q89 R90 R96	R88-A92 WeakPolarHBondContact O-CB 3.25Å; R88-A92 PolarHBondContact O-N 2.88Å; Q89-A92 CarbonylContact O-C 3.57Å; Q89-A92 WeakPolarHBondContact O-CA 3.21Å; Q89-A92 WeakPolarHBondContact O-CB 3.41Å; Q89-A92 PolarHBondContact O-N 3.49Å; Q89-A92 VanDerWaalsContact O-N 3.08Å; R90-A92 PolarHBondContact O-N 3.27Å; A92-R96 WeakPolarHBondContact O-CG 3.27Å
93	R	92.1	Very high	89.3	Confident	148 Å²	148	119.1 Å²	119.1	56%	0.558	53%	0.532	S	S	*	.	H	α-helix	trans	-80.3	-45.6	168.3	-64.4	176	-165.2	-164	5.9	110.4	Q89 R90 R95 R96 E97	Q89-R93 WeakPolarHBondContact O-CG 3.15Å; Q89-R93 PolarHBondContact O-N 3.34Å; R90-R93 WeakPolarHBondContact O-CA 3.36Å; R90-R93 PolarHBondContact O-N 2.77Å; R93-R95 PolarHBondContact O-N 2.78Å; R93-R96 WeakPolarHBondContact O-CA 3.41Å; R93-R96 VanDerWaalsContact O-CB 3.32Å; R93-R96 WeakPolarHBondContact O-CB 3.34Å; R93-R96 PolarHBondContact O-N 3.42Å; R93-E97 PolarHBondContact O-N 2.74Å
94	E	89.8	Confident	90.6	Very high	108 Å²	108	116 Å²	116	51%	0.505	52%	0.522	S	S	.	.	H	α-helix	trans	-54.7	-46.1	177.5	-175.8	172.6	-149.9	0	0	112.3	R90 R96 E97 E98	R90-E94 WeakPolarHBondContact O-CB 3.17Å; R90-E94 PolarHBondContact O-N 2.84Å; E94-R96 PolarHBondContact O-N 3.45Å; E94-E97 PolarHBondContact O-N 2.69Å; E94-E98 VanDerWaalsContact O-CB 3.29Å; E94-E98 WeakPolarHBondContact O-CB 3.33Å; E94-E98 PolarHBondContact O-N 3.44Å
95	R	94.9	Very high	91.3	Very high	126 Å²	126	109.5 Å²	109.5	48%	0.475	51%	0.508	S	S	.	.	H	α-helix	trans	-71.5	-2.6	174.5	-73.3	179.8	-65.1	141.5	4.3	115.2	L91 R93 R99	L91-R95 PolarHBondContact O-NE 3.24Å; L91-R95 PolarHBondContact O-NH2 2.76Å; R93-R95 PolarHBondContact O-N 2.78Å; R95-R99 VanDerWaalsContact O-CD 3.23Å; R95-R99 WeakPolarHBondContact O-CD 3.35Å; R95-R99 WeakPolarHBondContact O-CG 3.23Å; R95-R99 PolarHBondContact O-NE 3.2Å
96	R	88.9	Confident	91.8	Very high	170 Å²	170	112.8 Å²	112.8	64%	0.642	51%	0.509	S	S	*	.	H	α-helix	trans	-93.9	-51.7	165.5	-64.6	174.2	-176.6	-162.1	-1.6	109.3	A92 R93 E94 E98 R99 E100	A92-R96 WeakPolarHBondContact O-CG 3.27Å; R93-R96 WeakPolarHBondContact O-CA 3.41Å; R93-R96 VanDerWaalsContact O-CB 3.32Å; R93-R96 WeakPolarHBondContact O-CB 3.34Å; R93-R96 PolarHBondContact O-N 3.42Å; E94-R96 PolarHBondContact O-N 3.45Å; R96-E98 PolarHBondContact O-N 2.88Å; R96-R99 WeakPolarHBondContact O-CA 3.5Å; R96-R99 WeakPolarHBondContact O-CB 3.18Å; R96-R99 PolarHBondContact O-N 2.75Å; R96-E100 WeakPolarHBondContact O-CG 3.06Å; R96-E100 PolarHBondContact O-N 3.02Å
97	E	90.7	Very high	92	Very high	89 Å²	89	113.5 Å²	113.5	42%	0.416	51%	0.509	S	S	.	.	H	α-helix	trans	-54.6	-37.3	174.1	-68.8	177.9	-144.3	0	0	112.6	R93 E94 R99 E100 K101	R93-E97 PolarHBondContact O-N 2.74Å; E94-E97 PolarHBondContact O-N 2.69Å; E97-R99 VanDerWaalsContact C-N 3.34Å; E97-E100 PolarHBondContact O-N 2.86Å; E97-K101 VanDerWaalsContact O-CB 3.24Å; E97-K101 WeakPolarHBondContact O-CB 3.42Å; E97-K101 VanDerWaalsContact O-CD 3.28Å; E97-K101 WeakPolarHBondContact O-CD 3.16Å; E97-K101 WeakPolarHBondContact O-CG 3.09Å; E97-K101 PolarHBondContact O-N 3.49Å; E97-K101 IonicContact OE2-NZ 2.64Å; E97-K101 PolarHBondContact OE2-NZ 2.82Å
98	E	90.7	Very high	92.2	Very high	100 Å²	100	115.6 Å²	115.6	47%	0.467	52%	0.519	S	S	.	.	H	α-helix	trans	-65	-37.9	176.6	-170.8	-170.1	-169.7	0	0	111.6	E94 R96 Q102	E94-E98 VanDerWaalsContact O-CB 3.29Å; E94-E98 WeakPolarHBondContact O-CB 3.33Å; E94-E98 PolarHBondContact O-N 3.44Å; R96-E98 PolarHBondContact O-N 2.88Å; E98-Q102 WeakPolarHBondContact O-CB 3.48Å; E98-Q102 VanDerWaalsContact O-CG 3.26Å; E98-Q102 WeakPolarHBondContact O-CG 3.21Å; E98-Q102 PolarHBondContact O-N 3.43Å
99	R	91.4	Very high	92.5	Very high	168 Å²	168	111.1 Å²	111.1	63%	0.634	51%	0.511	S	S	*	.	H	α-helix	trans	-72.2	-39	175.4	-64.7	171.9	-178.9	-175.5	-3.1	111.1	R95 R96 E97 Q102 L103	R95-R99 VanDerWaalsContact O-CD 3.23Å; R95-R99 WeakPolarHBondContact O-CD 3.35Å; R95-R99 WeakPolarHBondContact O-CG 3.23Å; R95-R99 PolarHBondContact O-NE 3.2Å; R96-R99 WeakPolarHBondContact O-CA 3.5Å; R96-R99 WeakPolarHBondContact O-CB 3.18Å; R96-R99 PolarHBondContact O-N 2.75Å; E97-R99 VanDerWaalsContact C-N 3.34Å; R99-Q102 PolarHBondContact O-N 2.86Å; R99-L103 WeakPolarHBondContact O-CG 3.42Å; R99-L103 PolarHBondContact O-N 3.14Å
100	E	92.6	Very high	92.7	Very high	116 Å²	116	114.2 Å²	114.2	54%	0.542	52%	0.519	S	S	.	.	H	α-helix	trans	-65	-41.6	174	-71.1	154	-157.9	0	0	110.6	R96 E97 Q102 L103 A104	R96-E100 WeakPolarHBondContact O-CG 3.06Å; R96-E100 PolarHBondContact O-N 3.02Å; E97-E100 PolarHBondContact O-N 2.86Å; E100-Q102 PolarHBondContact O-N 2.93Å; E100-L103 PolarHBondContact O-N 3.48Å; E100-A104 WeakPolarHBondContact O-CB 3.48Å; E100-A104 PolarHBondContact O-N 3.41Å
101	K	95.4	Very high	92.7	Very high	124 Å²	124	109.7 Å²	109.7	54%	0.539	51%	0.507	S	S	.	.	H	α-helix	trans	-61.1	-40.2	170.2	-72.8	158.2	-167.9	159.9	0	111.7	E97 A105	E97-K101 VanDerWaalsContact O-CB 3.24Å; E97-K101 WeakPolarHBondContact O-CB 3.42Å; E97-K101 VanDerWaalsContact O-CD 3.28Å; E97-K101 WeakPolarHBondContact O-CD 3.16Å; E97-K101 WeakPolarHBondContact O-CG 3.09Å; E97-K101 PolarHBondContact O-N 3.49Å; E97-K101 IonicContact OE2-NZ 2.64Å; E97-K101 PolarHBondContact OE2-NZ 2.82Å; K101-A105 VanDerWaalsContact O-CB 3.24Å; K101-A105 WeakPolarHBondContact O-CB 3.43Å; K101-A105 PolarHBondContact O-N 3.2Å
102	Q	94	Very high	92.7	Very high	96 Å²	96	109.7 Å²	109.7	45%	0.449	51%	0.505	S	S	.	.	H	α-helix	trans	-68.6	-31	174.1	-74.6	174.4	27.2	0	0	113.5	E98 R99 E100 R106	E98-Q102 WeakPolarHBondContact O-CB 3.48Å; E98-Q102 VanDerWaalsContact O-CG 3.26Å; E98-Q102 WeakPolarHBondContact O-CG 3.21Å; E98-Q102 PolarHBondContact O-N 3.43Å; R99-Q102 PolarHBondContact O-N 2.86Å; E100-Q102 PolarHBondContact O-N 2.93Å; Q102-R106 WeakPolarHBondContact O-CD 3.3Å; Q102-R106 VanDerWaalsContact O-CG 3.29Å; Q102-R106 WeakPolarHBondContact O-CG 3.37Å; Q102-R106 PolarHBondContact O-N 2.83Å
103	L	93.6	Very high	92.6	Very high	111 Å²	111	116.5 Å²	116.5	58%	0.581	52%	0.523	S	S	*	.	H	α-helix	trans	-73.7	-49	172.9	-71	170.9	0	0	0	110.8	R99 E100 A105 R106 E107	R99-L103 WeakPolarHBondContact O-CG 3.42Å; R99-L103 PolarHBondContact O-N 3.14Å; E100-L103 PolarHBondContact O-N 3.48Å; L103-A105 VanDerWaalsContact C-N 3.31Å; L103-A105 PolarHBondContact O-N 2.76Å; L103-R106 WeakPolarHBondContact O-CA 3.5Å; L103-R106 WeakPolarHBondContact O-CB 3.44Å; L103-R106 PolarHBondContact O-N 2.72Å; L103-E107 PolarHBondContact O-N 3.32Å
104	A	94.4	Very high	92.5	Very high	40 Å²	40	112.3 Å²	112.3	33%	0.331	51%	0.51	S	S	.	.	H	α-helix	trans	-58.1	-40	175.6	0	0	0	0	0	112.1	E100 R106 E107 I108	E100-A104 WeakPolarHBondContact O-CB 3.48Å; E100-A104 PolarHBondContact O-N 3.41Å; A104-R106 VanDerWaalsContact C-N 3.3Å; A104-R106 PolarHBondContact O-N 2.86Å; A104-E107 PolarHBondContact O-N 2.9Å; A104-I108 WeakPolarHBondContact O-CB 3.41Å; A104-I108 WeakPolarHBondContact O-CD1 3.25Å; A104-I108 VanDerWaalsContact O-CG1 3.23Å; A104-I108 WeakPolarHBondContact O-CG1 3.46Å; A104-I108 PolarHBondContact O-N 3.43Å
105	A	95.3	Very high	92.5	Very high	52 Å²	52	112.2 Å²	112.2	43%	0.43	51%	0.509	S	S	.	.	H	α-helix	trans	-62.2	-35.5	174.4	0	0	0	0	0	112.9	K101 L103 V109	K101-A105 VanDerWaalsContact O-CB 3.24Å; K101-A105 WeakPolarHBondContact O-CB 3.43Å; K101-A105 PolarHBondContact O-N 3.2Å; L103-A105 VanDerWaalsContact C-N 3.31Å; L103-A105 PolarHBondContact O-N 2.76Å; A105-V109 WeakPolarHBondContact O-CG2 3.27Å; A105-V109 PolarHBondContact O-N 3.46Å
106	R	94.7	Very high	92.2	Very high	173 Å²	173	112.5 Å²	112.5	65%	0.653	51%	0.51	S	S	*	.	H	α-helix	trans	-73.1	-37.2	174.6	-68.5	167.4	-177	-167.7	1.8	111.8	Q102 L103 A104 V109 W110	Q102-R106 WeakPolarHBondContact O-CD 3.3Å; Q102-R106 VanDerWaalsContact O-CG 3.29Å; Q102-R106 WeakPolarHBondContact O-CG 3.37Å; Q102-R106 PolarHBondContact O-N 2.83Å; L103-R106 WeakPolarHBondContact O-CA 3.5Å; L103-R106 WeakPolarHBondContact O-CB 3.44Å; L103-R106 PolarHBondContact O-N 2.72Å; A104-R106 VanDerWaalsContact C-N 3.3Å; A104-R106 PolarHBondContact O-N 2.86Å; R106-V109 PolarHBondContact O-N 3.09Å; R106-W110 PolarHBondContact O-N 2.97Å
107	E	91.1	Very high	92.4	Very high	122 Å²	122	107.4 Å²	107.4	57%	0.57	51%	0.505	S	S	*	.	H	α-helix	trans	-65.5	-44.2	175.4	-174.7	166.7	-149.7	0	0	111.5	L103 A104 V109 W110 L111	L103-E107 PolarHBondContact O-N 3.32Å; A104-E107 PolarHBondContact O-N 2.9Å; E107-V109 PolarHBondContact O-N 3.13Å; E107-W110 WeakPolarHBondContact O-CA 3.33Å; E107-W110 WeakPolarHBondContact O-CB 3.48Å; E107-W110 PolarHBondContact O-N 3.36Å; E107-W110 VanDerWaalsContact O-N 3.07Å; E107-L111 HydrophobicContact CG-CD1 4.12Å; E107-L111 WeakPolarHBondContact O-CG 3.33Å; E107-L111 PolarHBondContact O-N 3.25Å
108	I	93.1	Very high	92.6	Very high	111 Å²	111	110.3 Å²	110.3	57%	0.569	51%	0.512	S	S	*	.	H	α-helix	trans	-57.4	-47.8	172.6	-70.1	162.5	0	0	0	110.7	A104 W110 L111 E112	A104-I108 WeakPolarHBondContact O-CB 3.41Å; A104-I108 WeakPolarHBondContact O-CD1 3.25Å; A104-I108 VanDerWaalsContact O-CG1 3.23Å; A104-I108 WeakPolarHBondContact O-CG1 3.46Å; A104-I108 PolarHBondContact O-N 3.43Å; I108-W110 PolarHBondContact O-N 2.93Å; I108-L111 PolarHBondContact O-N 2.77Å; I108-E112 WeakPolarHBondContact O-CB 3.38Å; I108-E112 PolarHBondContact O-N 3.44Å
109	V	94.9	Very high	92.7	Very high	79 Å²	79	108.8 Å²	108.8	48%	0.479	51%	0.505	S	S	.	.	H	α-helix	trans	-65.2	-26.7	177	170.5	0	0	0	0	112.7	A105 R106 E107 R113	A105-V109 WeakPolarHBondContact O-CG2 3.27Å; A105-V109 PolarHBondContact O-N 3.46Å; R106-V109 PolarHBondContact O-N 3.09Å; E107-V109 PolarHBondContact O-N 3.13Å; V109-R113 WeakPolarHBondContact O-CB 3.44Å; V109-R113 PolarHBondContact O-N 3.08Å
110	W	93.8	Very high	92.6	Very high	163 Å²	163	107.4 Å²	107.4	62%	0.617	51%	0.505	S	S	*	.	H	α-helix	trans	-75.5	-46.9	173.4	-172.2	93.4	0	0	0	111.6	R106 E107 I108 R113 E114	R106-W110 PolarHBondContact O-N 2.97Å; E107-W110 WeakPolarHBondContact O-CA 3.33Å; E107-W110 WeakPolarHBondContact O-CB 3.48Å; E107-W110 PolarHBondContact O-N 3.36Å; E107-W110 VanDerWaalsContact O-N 3.07Å; I108-W110 PolarHBondContact O-N 2.93Å; W110-R113 WeakPolarHBondContact O-CB 3.15Å; W110-R113 PolarHBondContact O-N 2.93Å; W110-R113 VanDerWaalsContact O-N 3.12Å; W110-E114 HydrophobicContact CH2-CG 4.43Å; W110-E114 HydrophobicContact CZ3-CB 4.36Å; W110-E114 PolarHBondContact O-N 3.4Å
111	L	93.5	Very high	92.5	Very high	86 Å²	86	109.2 Å²	109.2	45%	0.45	51%	0.508	S	S	.	.	H	α-helix	trans	-62.2	-43.6	176.2	-70.4	168.8	0	0	0	111.5	E107 I108 R113 E114 E115	E107-L111 HydrophobicContact CG-CD1 4.12Å; E107-L111 WeakPolarHBondContact O-CG 3.33Å; E107-L111 PolarHBondContact O-N 3.25Å; I108-L111 PolarHBondContact O-N 2.77Å; L111-R113 PolarHBondContact O-N 2.79Å; L111-E114 PolarHBondContact O-N 2.98Å; L111-E114 VanDerWaalsContact O-N 3.09Å; L111-E115 WeakPolarHBondContact O-CB 3.43Å; L111-E115 PolarHBondContact O-N 3.2Å
112	E	91.1	Very high	92.3	Very high	84 Å²	84	108.7 Å²	108.7	39%	0.393	51%	0.507	S	S	.	.	H	α-helix	trans	-64.1	-23.8	175.7	-165.1	-143.7	-161.5	0	0	112.2	I108 R116	I108-E112 WeakPolarHBondContact O-CB 3.38Å; I108-E112 PolarHBondContact O-N 3.44Å; E112-R116 VanDerWaalsContact CD-CZ 3.41Å; E112-R116 VanDerWaalsContact O-CG 3.3Å; E112-R116 WeakPolarHBondContact O-CG 3.36Å; E112-R116 PolarHBondContact O-N 3.29Å; E112-R116 PolarHBondContact O-NH1 3.33Å; E112-R116 VanDerWaalsContact O-NH1 3.12Å; E112-R116 IonicContact OE1-CZ 3.29Å; E112-R116 IonicContact OE1-NH1 3.06Å; E112-R116 PolarHBondContact OE1-NH1 2.85Å; E112-R116 IonicContact OE1-NH2 2.69Å; E112-R116 PolarHBondContact OE1-NH2 3.22Å; E112-R116 IonicContact OE2-CZ 2.7Å; E112-R116 IonicContact OE2-NH1 3.38Å; E112-R116 PolarHBondContact OE2-NH1 2.96Å; E112-R116 IonicContact OE2-NH2 3.66Å; E112-R116 PolarHBondContact OE2-NH2 3.45Å
113	R	88.1	Confident	92.4	Very high	181 Å²	181	109.4 Å²	109.4	68%	0.683	51%	0.509	S	S	*	.	H	α-helix	trans	-82	-39	170.8	-174.8	176.7	-63.2	-157.1	-1.6	111.9	V109 W110 L111 A117	V109-R113 WeakPolarHBondContact O-CB 3.44Å; V109-R113 PolarHBondContact O-N 3.08Å; W110-R113 WeakPolarHBondContact O-CB 3.15Å; W110-R113 PolarHBondContact O-N 2.93Å; W110-R113 VanDerWaalsContact O-N 3.12Å; L111-R113 PolarHBondContact O-N 2.79Å; R113-A117 PolarHBondContact O-N 2.95Å
114	E	89.9	Confident	92.5	Very high	60 Å²	60	108 Å²	108	28%	0.28	50%	0.499	S	S	.	.	H	α-helix	trans	-65	-43.8	175.1	-152.2	-150.2	153.9	0	0	111.1	W110 L111 R116 A117 R118	W110-E114 HydrophobicContact CH2-CG 4.43Å; W110-E114 HydrophobicContact CZ3-CB 4.36Å; W110-E114 PolarHBondContact O-N 3.4Å; L111-E114 PolarHBondContact O-N 2.98Å; L111-E114 VanDerWaalsContact O-N 3.09Å; E114-R116 PolarHBondContact O-N 2.64Å; E114-A117 WeakPolarHBondContact O-CA 3.37Å; E114-A117 WeakPolarHBondContact O-CB 3.23Å; E114-A117 PolarHBondContact O-N 3.3Å; E114-A117 VanDerWaalsContact O-N 3.08Å; E114-R118 WeakPolarHBondContact O-CG 3.39Å; E114-R118 PolarHBondContact O-N 3.42Å; E114-R118 IonicContact OE1-CZ 3.57Å; E114-R118 IonicContact OE1-NE 2.67Å; E114-R118 PolarHBondContact OE1-NE 2.67Å; E114-R118 IonicContact OE1-NH2 3.08Å; E114-R118 PolarHBondContact OE1-NH2 2.74Å; E114-R118 IonicContact OE2-CZ 3.06Å; E114-R118 IonicContact OE2-NE 3.16Å; E114-R118 IonicContact OE2-NH2 2.81Å; E114-R118 PolarHBondContact OE2-NH2 2.86Å
115	E	90.5	Very high	92.4	Very high	105 Å²	105	109 Å²	109	49%	0.491	50%	0.498	S	S	.	.	H	α-helix	trans	-61.8	-45.8	178	-159.5	-153.2	136.4	0	0	111.2	L111 A117 R118 Q119	L111-E115 WeakPolarHBondContact O-CB 3.43Å; L111-E115 PolarHBondContact O-N 3.2Å; E115-A117 PolarHBondContact O-N 3.33Å; E115-R118 CarbonylContact O-C 3.57Å; E115-R118 WeakPolarHBondContact O-CB 3.36Å; E115-R118 PolarHBondContact O-N 3.12Å; E115-R118 VanDerWaalsContact O-N 3.09Å; E115-Q119 WeakPolarHBondContact O-CB 3.27Å; E115-Q119 WeakPolarHBondContact O-CG 3.46Å; E115-Q119 PolarHBondContact O-N 3.34Å; E115-Q119 PolarHBondContact OE1-NE2 2.8Å
116	R	88.3	Confident	92.3	Very high	133 Å²	133	111.1 Å²	111.1	50%	0.502	50%	0.5	S	S	.	.	H	α-helix	trans	-57.6	-35.9	172.8	-76.6	-175.7	-169.3	103	-6.5	112.8	E112 E114 H120	E112-R116 VanDerWaalsContact CD-CZ 3.41Å; E112-R116 VanDerWaalsContact O-CG 3.3Å; E112-R116 WeakPolarHBondContact O-CG 3.36Å; E112-R116 PolarHBondContact O-N 3.29Å; E112-R116 PolarHBondContact O-NH1 3.33Å; E112-R116 VanDerWaalsContact O-NH1 3.12Å; E112-R116 IonicContact OE1-CZ 3.29Å; E112-R116 IonicContact OE1-NH1 3.06Å; E112-R116 PolarHBondContact OE1-NH1 2.85Å; E112-R116 IonicContact OE1-NH2 2.69Å; E112-R116 PolarHBondContact OE1-NH2 3.22Å; E112-R116 IonicContact OE2-CZ 2.7Å; E112-R116 IonicContact OE2-NH1 3.38Å; E112-R116 PolarHBondContact OE2-NH1 2.96Å; E112-R116 IonicContact OE2-NH2 3.66Å; E112-R116 PolarHBondContact OE2-NH2 3.45Å; E114-R116 PolarHBondContact O-N 2.64Å; R116-H120 WeakPolarHBondContact O-CB 3.31Å; R116-H120 PolarHBondContact O-N 3.02Å
117	A	93.4	Very high	92.2	Very high	63 Å²	63	108 Å²	108	52%	0.521	49%	0.493	S	S	.	.	H	α-helix	trans	-69.9	-41.1	175.1	0	0	0	0	0	112.1	R113 E114 E115 H120 Y121	R113-A117 PolarHBondContact O-N 2.95Å; E114-A117 WeakPolarHBondContact O-CA 3.37Å; E114-A117 WeakPolarHBondContact O-CB 3.23Å; E114-A117 PolarHBondContact O-N 3.3Å; E114-A117 VanDerWaalsContact O-N 3.08Å; E115-A117 PolarHBondContact O-N 3.33Å; A117-H120 PolarHBondContact O-N 2.8Å; A117-Y121 PolarHBondContact O-N 2.85Å
118	R	95.4	Very high	92	Very high	150 Å²	150	109 Å²	109	57%	0.566	49%	0.491	S	S	*	.	H	α-helix	trans	-61.2	-50.8	173	-67	174.3	-177.1	-169.5	6.2	111	E114 E115 H120 Y121 E122	E114-R118 WeakPolarHBondContact O-CG 3.39Å; E114-R118 PolarHBondContact O-N 3.42Å; E114-R118 IonicContact OE1-CZ 3.57Å; E114-R118 IonicContact OE1-NE 2.67Å; E114-R118 PolarHBondContact OE1-NE 2.67Å; E114-R118 IonicContact OE1-NH2 3.08Å; E114-R118 PolarHBondContact OE1-NH2 2.74Å; E114-R118 IonicContact OE2-CZ 3.06Å; E114-R118 IonicContact OE2-NE 3.16Å; E114-R118 IonicContact OE2-NH2 2.81Å; E114-R118 PolarHBondContact OE2-NH2 2.86Å; E115-R118 CarbonylContact O-C 3.57Å; E115-R118 WeakPolarHBondContact O-CB 3.36Å; E115-R118 PolarHBondContact O-N 3.12Å; E115-R118 VanDerWaalsContact O-N 3.09Å; R118-H120 VanDerWaalsContact C-N 3.3Å; R118-H120 PolarHBondContact O-N 3.49Å; R118-Y121 WeakPolarHBondContact O-CB 3.15Å; R118-Y121 PolarHBondContact O-N 2.95Å; R118-Y121 VanDerWaalsContact O-N 3.14Å; R118-E122 WeakPolarHBondContact O-CB 3.39Å; R118-E122 PolarHBondContact O-N 3.28Å
119	Q	92.3	Very high	91.7	Very high	68 Å²	68	110 Å²	110	32%	0.318	49%	0.491	S	S	.	.	H	α-helix	trans	-56.4	-40.1	175.4	-70.6	-175.9	18.9	0	0	112.6	E115 K123	E115-Q119 WeakPolarHBondContact O-CB 3.27Å; E115-Q119 WeakPolarHBondContact O-CG 3.46Å; E115-Q119 PolarHBondContact O-N 3.34Å; E115-Q119 PolarHBondContact OE1-NE2 2.8Å; Q119-K123 WeakPolarHBondContact O-CB 3.35Å; Q119-K123 WeakPolarHBondContact O-CD 3.45Å; Q119-K123 VanDerWaalsContact O-CG 3.23Å; Q119-K123 WeakPolarHBondContact O-CG 3.37Å; Q119-K123 PolarHBondContact O-N 2.93Å
120	H	89.9	Confident	91.7	Very high	138 Å²	138	113.7 Å²	113.7	64%	0.639	50%	0.501	S	S	*	.	H	α-helix	trans	-68.2	-40.1	177.7	-176.7	-76.2	0	0	0	112	R116 A117 R118 H124	R116-H120 WeakPolarHBondContact O-CB 3.31Å; R116-H120 PolarHBondContact O-N 3.02Å; A117-H120 PolarHBondContact O-N 2.8Å; R118-H120 VanDerWaalsContact C-N 3.3Å; R118-H120 PolarHBondContact O-N 3.49Å; H120-H124 PolarHBondContact O-N 3.48Å; H120-H124 VanDerWaalsContact O-N 3.11Å
121	Y	89.5	Confident	91.7	Very high	155 Å²	155	113.8 Å²	113.8	61%	0.608	50%	0.501	S	S	*	.	H	α-helix	trans	-64.4	-43.9	174	178.5	-98.6	0	0	0	111.8	A117 R118 H124 L125	A117-Y121 PolarHBondContact O-N 2.85Å; R118-Y121 WeakPolarHBondContact O-CB 3.15Å; R118-Y121 PolarHBondContact O-N 2.95Å; R118-Y121 VanDerWaalsContact O-N 3.14Å; Y121-H124 PolarHBondContact O-N 3.26Å; Y121-L125 HydrophobicContact CD1-CD1 4.15Å; Y121-L125 HydrophobicContact CE1-CD1 3.48Å; Y121-L125 VanDerWaalsContact CE1-CD1 3.48Å; Y121-L125 HydrophobicContact CE1-CG 4.15Å; Y121-L125 PolarHBondContact O-N 3.39Å; Y121-L125 VanDerWaalsContact O-N 3.07Å
122	E	92.2	Very high	91.6	Very high	112 Å²	112	114.5 Å²	114.5	52%	0.523	51%	0.505	S	S	.	.	H	α-helix	trans	-60.7	-53.2	176.6	-177.8	155	-125	0	0	111.7	R118 H124 L125 E126	R118-E122 WeakPolarHBondContact O-CB 3.39Å; R118-E122 PolarHBondContact O-N 3.28Å; E122-H124 PolarHBondContact O-N 2.94Å; E122-L125 CarbonylContact O-C 3.59Å; E122-L125 WeakPolarHBondContact O-CA 3.34Å; E122-L125 WeakPolarHBondContact O-CB 3.23Å; E122-L125 PolarHBondContact O-N 3.46Å; E122-E126 HydrophobicContact CG-CG 4.37Å; E122-E126 WeakPolarHBondContact O-CG 3.24Å; E122-E126 PolarHBondContact O-N 3.32Å
123	K	94.9	Very high	91.5	Very high	111 Å²	111	114.5 Å²	114.5	48%	0.483	51%	0.505	S	S	.	.	H	α-helix	trans	-52.7	-39.6	174	-75.5	164.3	-178.4	162.3	0	112.1	Q119 L125 E126 E127	Q119-K123 WeakPolarHBondContact O-CB 3.35Å; Q119-K123 WeakPolarHBondContact O-CD 3.45Å; Q119-K123 VanDerWaalsContact O-CG 3.23Å; Q119-K123 WeakPolarHBondContact O-CG 3.37Å; Q119-K123 PolarHBondContact O-N 2.93Å; K123-L125 PolarHBondContact O-N 2.81Å; K123-E126 PolarHBondContact O-N 3.25Å; K123-E127 WeakPolarHBondContact O-CG 3.46Å; K123-E127 PolarHBondContact O-N 3.06Å
124	H	95.4	Very high	91.8	Very high	83 Å²	83	111.5 Å²	111.5	38%	0.384	50%	0.499	S	S	.	.	H	α-helix	trans	-67.1	-35.6	175.6	-165.9	-4.6	0	0	0	112.8	H120 Y121 E122 R128	H120-H124 PolarHBondContact O-N 3.48Å; H120-H124 VanDerWaalsContact O-N 3.11Å; Y121-H124 PolarHBondContact O-N 3.26Å; E122-H124 PolarHBondContact O-N 2.94Å; H124-R128 PolarHBondContact CE1-NE 3.49Å; H124-R128 VanDerWaalsContact CE1-NE 3.27Å; H124-R128 PolarHBondContact CE1-NH2 2.83Å; H124-R128 VanDerWaalsContact CE1-NH2 3.29Å; H124-R128 PolarHBondContact ND1-NE 3.07Å; H124-R128 PolarHBondContact NE2-NH2 3.19Å; H124-R128 WeakPolarHBondContact O-CG 3.41Å; H124-R128 PolarHBondContact O-N 2.86Å
125	L	93.5	Very high	91.9	Very high	59 Å²	59	114.9 Å²	114.9	31%	0.309	51%	0.514	S	S	.	.	H	α-helix	trans	-70.3	-38.7	171.7	-67.4	-176.4	0	0	0	112	Y121 E122 K123 R128 K129	Y121-L125 HydrophobicContact CD1-CD1 4.15Å; Y121-L125 HydrophobicContact CE1-CD1 3.48Å; Y121-L125 VanDerWaalsContact CE1-CD1 3.48Å; Y121-L125 HydrophobicContact CE1-CG 4.15Å; Y121-L125 PolarHBondContact O-N 3.39Å; Y121-L125 VanDerWaalsContact O-N 3.07Å; E122-L125 CarbonylContact O-C 3.59Å; E122-L125 WeakPolarHBondContact O-CA 3.34Å; E122-L125 WeakPolarHBondContact O-CB 3.23Å; E122-L125 PolarHBondContact O-N 3.46Å; K123-L125 PolarHBondContact O-N 2.81Å; L125-R128 WeakPolarHBondContact O-CB 3.39Å; L125-R128 PolarHBondContact O-N 2.85Å; L125-K129 WeakPolarHBondContact O-CG 3.44Å; L125-K129 PolarHBondContact O-N 2.94Å
126	E	92.8	Very high	92.1	Very high	98 Å²	98	117.4 Å²	117.4	46%	0.458	52%	0.519	S	S	.	.	H	α-helix	trans	-63.6	-44.3	175.6	-68.2	-174.7	136.2	0	0	112.4	E122 K123 R128 K129 K130	E122-E126 HydrophobicContact CG-CG 4.37Å; E122-E126 WeakPolarHBondContact O-CG 3.24Å; E122-E126 PolarHBondContact O-N 3.32Å; K123-E126 PolarHBondContact O-N 3.25Å; E126-R128 VanDerWaalsContact C-N 3.26Å; E126-R128 PolarHBondContact O-N 2.79Å; E126-K129 WeakPolarHBondContact O-CB 3.47Å; E126-K129 PolarHBondContact O-N 3.43Å; E126-K129 VanDerWaalsContact O-N 3.16Å; E126-K130 VanDerWaalsContact O-CB 3.24Å; E126-K130 WeakPolarHBondContact O-CB 3.43Å; E126-K130 PolarHBondContact O-N 3.44Å
127	E	93.3	Very high	92	Very high	108 Å²	108	115 Å²	115	51%	0.505	51%	0.514	S	S	.	.	H	α-helix	trans	-59.1	-38.8	173.4	-77.3	-172.1	-174.6	0	0	112.2	K123 R131	K123-E127 WeakPolarHBondContact O-CG 3.46Å; K123-E127 PolarHBondContact O-N 3.06Å; E127-R131 WeakPolarHBondContact O-CG 3.35Å; E127-R131 PolarHBondContact O-N 3.25Å
128	R	85.9	Confident	92.1	Very high	143 Å²	143	118 Å²	118	54%	0.54	52%	0.515	S	S	.	.	H	α-helix	trans	-66.2	-42.8	175	-71.2	173.7	-174.1	177.9	6.9	111.6	H124 L125 E126 L132	H124-R128 PolarHBondContact CE1-NE 3.49Å; H124-R128 VanDerWaalsContact CE1-NE 3.27Å; H124-R128 PolarHBondContact CE1-NH2 2.83Å; H124-R128 VanDerWaalsContact CE1-NH2 3.29Å; H124-R128 PolarHBondContact ND1-NE 3.07Å; H124-R128 PolarHBondContact NE2-NH2 3.19Å; H124-R128 WeakPolarHBondContact O-CG 3.41Å; H124-R128 PolarHBondContact O-N 2.86Å; L125-R128 WeakPolarHBondContact O-CB 3.39Å; L125-R128 PolarHBondContact O-N 2.85Å; E126-R128 VanDerWaalsContact C-N 3.26Å; E126-R128 PolarHBondContact O-N 2.79Å; R128-L132 PolarHBondContact O-N 3.01Å
129	K	87.4	Confident	91.9	Very high	130 Å²	130	115.5 Å²	115.5	57%	0.565	51%	0.51	S	S	*	.	H	α-helix	trans	-60.6	-51.7	172.8	-68.5	169.2	-173.3	170.8	0	110.4	L125 E126 R131 L132 E133	L125-K129 WeakPolarHBondContact O-CG 3.44Å; L125-K129 PolarHBondContact O-N 2.94Å; E126-K129 WeakPolarHBondContact O-CB 3.47Å; E126-K129 PolarHBondContact O-N 3.43Å; E126-K129 VanDerWaalsContact O-N 3.16Å; K129-R131 VanDerWaalsContact C-N 3.34Å; K129-R131 PolarHBondContact O-N 3.39Å; K129-L132 CarbonylContact O-C 3.56Å; K129-L132 WeakPolarHBondContact O-CA 3.18Å; K129-L132 WeakPolarHBondContact O-CB 3.39Å; K129-L132 PolarHBondContact O-N 2.88Å; K129-E133 PolarHBondContact O-N 2.83Å
130	K	94.6	Very high	91.8	Very high	157 Å²	157	118.2 Å²	118.2	68%	0.683	52%	0.523	S	S	*	.	H	α-helix	trans	-58.2	-39.6	-177.7	-172.7	173.2	-178.9	174.5	0	112.7	E126 L132 E133 E134	E126-K130 VanDerWaalsContact O-CB 3.24Å; E126-K130 WeakPolarHBondContact O-CB 3.43Å; E126-K130 PolarHBondContact O-N 3.44Å; K130-L132 VanDerWaalsContact C-N 3.33Å; K130-L132 PolarHBondContact O-N 3.37Å; K130-E133 PolarHBondContact O-N 3.39Å; K130-E134 WeakPolarHBondContact O-CB 3.39Å; K130-E134 PolarHBondContact O-N 3.05Å
131	R	94.6	Very high	91.9	Very high	166 Å²	166	119.8 Å²	119.8	63%	0.626	52%	0.523	S	S	*	.	H	α-helix	trans	-65.6	-31.8	173.5	-74.5	-179.4	-174.2	-170.6	5.1	113.4	E127 K129 Q135	E127-R131 WeakPolarHBondContact O-CG 3.35Å; E127-R131 PolarHBondContact O-N 3.25Å; K129-R131 VanDerWaalsContact C-N 3.34Å; K129-R131 PolarHBondContact O-N 3.39Å; R131-Q135 VanDerWaalsContact O-CG 3.31Å; R131-Q135 WeakPolarHBondContact O-CG 3.45Å; R131-Q135 PolarHBondContact O-N 2.78Å
132	L	90	Very high	92.2	Very high	101 Å²	101	121 Å²	121	53%	0.529	53%	0.526	S	S	.	.	H	α-helix	trans	-77.1	-37.2	173.5	-65.1	172	0	0	0	111.5	R128 K129 K130 Q135 R136	R128-L132 PolarHBondContact O-N 3.01Å; K129-L132 CarbonylContact O-C 3.56Å; K129-L132 WeakPolarHBondContact O-CA 3.18Å; K129-L132 WeakPolarHBondContact O-CB 3.39Å; K129-L132 PolarHBondContact O-N 2.88Å; K130-L132 VanDerWaalsContact C-N 3.33Å; K130-L132 PolarHBondContact O-N 3.37Å; L132-Q135 PolarHBondContact O-N 3.37Å; L132-R136 WeakPolarHBondContact O-CG 3.49Å; L132-R136 PolarHBondContact O-N 2.85Å
133	E	89.2	Confident	92.3	Very high	84 Å²	84	122.4 Å²	122.4	39%	0.393	53%	0.527	S	S	.	.	H	α-helix	trans	-64.4	-42	173.7	-139.7	70.9	-94	0	0	111.6	K129 K130 Q135 R136 Q137	K129-E133 PolarHBondContact O-N 2.83Å; K130-E133 PolarHBondContact O-N 3.39Å; E133-Q135 VanDerWaalsContact C-N 3.34Å; E133-Q135 PolarHBondContact O-N 2.88Å; E133-R136 WeakPolarHBondContact O-CB 3.18Å; E133-R136 PolarHBondContact O-N 3.33Å; E133-R136 WeakPolarHBondContact OE1-CD 3.17Å; E133-R136 IonicContact OE1-CZ 2.69Å; E133-R136 IonicContact OE1-NE 2.87Å; E133-R136 IonicContact OE1-NH1 3.75Å; E133-R136 PolarHBondContact OE1-NH1 3.04Å; E133-R136 IonicContact OE2-NH1 3.96Å; E133-Q137 WeakPolarHBondContact O-CG 3.45Å; E133-Q137 PolarHBondContact O-N 3.42Å
134	E	93.7	Very high	92.1	Very high	118 Å²	118	119.4 Å²	119.4	55%	0.551	52%	0.523	S	S	*	.	H	α-helix	trans	-62.4	-40.5	174.5	-169.8	-168.4	160.3	0	0	111.4	K130 Q137 K138	K130-E134 WeakPolarHBondContact O-CB 3.39Å; K130-E134 PolarHBondContact O-N 3.05Å; E134-Q137 PolarHBondContact O-N 3.26Å; E134-K138 WeakPolarHBondContact O-CB 3.29Å; E134-K138 PolarHBondContact O-N 2.85Å
135	Q	92.1	Very high	92	Very high	131 Å²	131	117.7 Å²	117.7	61%	0.612	52%	0.523	S	S	*	.	H	α-helix	trans	-63.4	-42.4	173.7	-75.8	176.6	15.6	0	0	112	R131 L132 E133 K138 E139	R131-Q135 VanDerWaalsContact O-CG 3.31Å; R131-Q135 WeakPolarHBondContact O-CG 3.45Å; R131-Q135 PolarHBondContact O-N 2.78Å; L132-Q135 PolarHBondContact O-N 3.37Å; E133-Q135 VanDerWaalsContact C-N 3.34Å; E133-Q135 PolarHBondContact O-N 2.88Å; Q135-K138 PolarHBondContact O-N 2.67Å; Q135-E139 PolarHBondContact O-N 2.84Å
136	R	95.4	Very high	92.1	Very high	157 Å²	157	119.4 Å²	119.4	59%	0.592	54%	0.535	S	S	*	.	H	α-helix	trans	-61.1	-52.1	173.7	-73.3	165.8	170.9	180	-2.2	111.4	L132 E133 K138 E139 E140	L132-R136 WeakPolarHBondContact O-CG 3.49Å; L132-R136 PolarHBondContact O-N 2.85Å; E133-R136 WeakPolarHBondContact O-CB 3.18Å; E133-R136 PolarHBondContact O-N 3.33Å; E133-R136 WeakPolarHBondContact OE1-CD 3.17Å; E133-R136 IonicContact OE1-CZ 2.69Å; E133-R136 IonicContact OE1-NE 2.87Å; E133-R136 IonicContact OE1-NH1 3.75Å; E133-R136 PolarHBondContact OE1-NH1 3.04Å; E133-R136 IonicContact OE2-NH1 3.96Å; R136-K138 PolarHBondContact O-N 2.87Å; R136-E139 CarbonylContact O-C 3.58Å; R136-E139 WeakPolarHBondContact O-CB 3.42Å; R136-E139 PolarHBondContact O-N 3.22Å; R136-E139 VanDerWaalsContact O-N 3.07Å; R136-E140 WeakPolarHBondContact O-CB 3.47Å; R136-E140 PolarHBondContact O-N 2.85Å
137	Q	86.7	Confident	92.1	Very high	83 Å²	83	121.2 Å²	121.2	39%	0.388	54%	0.544	S	S	.	.	H	α-helix	trans	-59.8	-34.2	177	-72.4	-172.1	17.7	0	0	112.3	E133 E134 E140 R141	E133-Q137 WeakPolarHBondContact O-CG 3.45Å; E133-Q137 PolarHBondContact O-N 3.42Å; E134-Q137 PolarHBondContact O-N 3.26Å; Q137-E140 PolarHBondContact O-N 3.31Å; Q137-R141 WeakPolarHBondContact O-CB 3.36Å; Q137-R141 WeakPolarHBondContact O-CG 3.34Å; Q137-R141 PolarHBondContact O-N 3.5Å
138	K	95.2	Very high	92.1	Very high	126 Å²	126	122.6 Å²	122.6	55%	0.548	55%	0.55	S	S	.	*	H	α-helix	trans	-72.8	-29.7	177	-168.3	169.2	-170.3	165.7	0	112.5	E134 Q135 R136 R142	E134-K138 WeakPolarHBondContact O-CB 3.29Å; E134-K138 PolarHBondContact O-N 2.85Å; Q135-K138 PolarHBondContact O-N 2.67Å; R136-K138 PolarHBondContact O-N 2.87Å; K138-R142 WeakPolarHBondContact O-CD 3.45Å; K138-R142 WeakPolarHBondContact O-CG 3.36Å
139	E	91.6	Very high	92.4	Very high	98 Å²	98	122.7 Å²	122.7	46%	0.458	56%	0.555	S	S	.	*	H	α-helix	trans	-74.4	-43.3	167.9	-160.3	-166.2	168.8	0	0	111.3	Q135 R136 R142 R143	Q135-E139 PolarHBondContact O-N 2.84Å; R136-E139 CarbonylContact O-C 3.58Å; R136-E139 WeakPolarHBondContact O-CB 3.42Å; R136-E139 PolarHBondContact O-N 3.22Å; R136-E139 VanDerWaalsContact O-N 3.07Å; E139-R142 CarbonylContact O-C 3.55Å; E139-R142 WeakPolarHBondContact O-CA 3.45Å; E139-R142 WeakPolarHBondContact O-CB 3.49Å; E139-R142 PolarHBondContact O-N 3.34Å; E139-R143 WeakPolarHBondContact O-CG 3.35Å; E139-R143 PolarHBondContact O-N 3.48Å; E139-R143 IonicContact OE1-CZ 2.6Å; E139-R143 VanDerWaalsContact OE1-CZ 3.25Å; E139-R143 IonicContact OE1-NE 3.17Å; E139-R143 PolarHBondContact OE1-NE 2.93Å; E139-R143 IonicContact OE1-NH2 2.84Å; E139-R143 PolarHBondContact OE1-NH2 3.4Å; E139-R143 IonicContact OE2-CZ 2.71Å; E139-R143 IonicContact OE2-NH2 3.73Å; E139-R143 PolarHBondContact OE2-NH2 2.68Å
140	E	90.3	Very high	92.6	Very high	125 Å²	125	125.5 Å²	125.5	58%	0.584	56%	0.562	S	S	*	*	H	α-helix	trans	-61	-45.8	178.9	-174.5	167.7	-130.6	0	0	111.8	R136 Q137 R142 R143 A144	R136-E140 WeakPolarHBondContact O-CB 3.47Å; R136-E140 PolarHBondContact O-N 2.85Å; Q137-E140 PolarHBondContact O-N 3.31Å; E140-R142 PolarHBondContact O-N 3.17Å; E140-R143 CarbonylContact O-C 3.59Å; E140-R143 PolarHBondContact O-N 3.02Å; E140-R143 VanDerWaalsContact O-N 3.08Å; E140-A144 VanDerWaalsContact O-CB 3.31Å; E140-A144 WeakPolarHBondContact O-CB 3.3Å; E140-A144 PolarHBondContact O-N 2.71Å
141	R	91.6	Very high	92.4	Very high	170 Å²	170	126 Å²	126	64%	0.642	56%	0.56	S	S	*	*	H	α-helix	trans	-58.8	-32.7	171.9	-70.2	169.8	-156.8	-169.1	8.8	112.6	Q137 A145	Q137-R141 WeakPolarHBondContact O-CB 3.36Å; Q137-R141 WeakPolarHBondContact O-CG 3.34Å; Q137-R141 PolarHBondContact O-N 3.5Å; R141-A145 WeakPolarHBondContact O-CB 3.45Å; R141-A145 PolarHBondContact O-N 2.81Å
142	R	95.1	Very high	92.4	Very high	181 Å²	181	123.1 Å²	123.1	68%	0.683	55%	0.553	S	S	*	*	H	α-helix	trans	-73.4	-39.2	173.9	-72.9	169.3	166.8	-170.6	-5.8	112.1	K138 E139 E140 V146	K138-R142 WeakPolarHBondContact O-CD 3.45Å; K138-R142 WeakPolarHBondContact O-CG 3.36Å; E139-R142 CarbonylContact O-C 3.55Å; E139-R142 WeakPolarHBondContact O-CA 3.45Å; E139-R142 WeakPolarHBondContact O-CB 3.49Å; E139-R142 PolarHBondContact O-N 3.34Å; E140-R142 PolarHBondContact O-N 3.17Å; R142-V146 WeakPolarHBondContact O-CG2 3.45Å; R142-V146 PolarHBondContact O-N 3.43Å
143	R	94.4	Very high	92.6	Very high	142 Å²	142	126 Å²	126	54%	0.536	56%	0.557	S	S	.	*	H	α-helix	trans	-65.5	-48.9	174.7	-67.8	174.4	-177.6	-171.2	4	110.4	E139 E140 A145 V146 E147	E139-R143 WeakPolarHBondContact O-CG 3.35Å; E139-R143 PolarHBondContact O-N 3.48Å; E139-R143 IonicContact OE1-CZ 2.6Å; E139-R143 VanDerWaalsContact OE1-CZ 3.25Å; E139-R143 IonicContact OE1-NE 3.17Å; E139-R143 PolarHBondContact OE1-NE 2.93Å; E139-R143 IonicContact OE1-NH2 2.84Å; E139-R143 PolarHBondContact OE1-NH2 3.4Å; E139-R143 IonicContact OE2-CZ 2.71Å; E139-R143 IonicContact OE2-NH2 3.73Å; E139-R143 PolarHBondContact OE2-NH2 2.68Å; E140-R143 CarbonylContact O-C 3.59Å; E140-R143 PolarHBondContact O-N 3.02Å; E140-R143 VanDerWaalsContact O-N 3.08Å; R143-A145 PolarHBondContact O-N 3.47Å; R143-V146 CarbonylContact O-C 3.59Å; R143-V146 WeakPolarHBondContact O-CB 3.29Å; R143-V146 PolarHBondContact O-N 3.44Å; R143-E147 WeakPolarHBondContact O-CB 3.25Å; R143-E147 PolarHBondContact O-N 2.66Å
144	A	90.6	Very high	92.8	Very high	48 Å²	48	128 Å²	128	40%	0.397	57%	0.57	S	S	.	*	H	α-helix	trans	-56	-47.2	175.6	0	0	0	0	0	112	E140 V146 E147 E148	E140-A144 VanDerWaalsContact O-CB 3.31Å; E140-A144 WeakPolarHBondContact O-CB 3.3Å; E140-A144 PolarHBondContact O-N 2.71Å; A144-V146 VanDerWaalsContact C-N 3.26Å; A144-V146 PolarHBondContact O-N 2.85Å; A144-E147 PolarHBondContact O-N 3.14Å; A144-E148 WeakPolarHBondContact O-CB 3.45Å; A144-E148 PolarHBondContact O-N 3.46Å
145	A	94	Very high	92.7	Very high	46 Å²	46	125.2 Å²	125.2	38%	0.38	56%	0.557	S	S	.	*	H	α-helix	trans	-65.7	-24	176.8	0	0	0	0	0	114.2	R141 R143 K149	R141-A145 WeakPolarHBondContact O-CB 3.45Å; R141-A145 PolarHBondContact O-N 2.81Å; R143-A145 PolarHBondContact O-N 3.47Å; A145-K149 WeakPolarHBondContact O-CG 3.28Å; A145-K149 PolarHBondContact O-N 2.95Å
146	V	96.1	Very high	92.7	Very high	95 Å²	95	121.1 Å²	121.1	58%	0.576	54%	0.538	S	S	*	.	H	α-helix	trans	-82.4	-37	172.9	169.2	0	0	0	0	111.3	R142 R143 A144 K149 R150	R142-V146 WeakPolarHBondContact O-CG2 3.45Å; R142-V146 PolarHBondContact O-N 3.43Å; R143-V146 CarbonylContact O-C 3.59Å; R143-V146 WeakPolarHBondContact O-CB 3.29Å; R143-V146 PolarHBondContact O-N 3.44Å; A144-V146 VanDerWaalsContact C-N 3.26Å; A144-V146 PolarHBondContact O-N 2.85Å; V146-K149 PolarHBondContact O-N 3.04Å; V146-R150 PolarHBondContact O-N 2.94Å
147	E	92.9	Very high	92.7	Very high	137 Å²	137	118.9 Å²	118.9	64%	0.64	54%	0.537	S	S	*	.	H	α-helix	trans	-70.1	-41.3	176.4	-174.6	160.3	-152.7	0	0	111.8	R143 A144 R150 R151	R143-E147 WeakPolarHBondContact O-CB 3.25Å; R143-E147 PolarHBondContact O-N 2.66Å; A144-E147 PolarHBondContact O-N 3.14Å; E147-R150 CarbonylContact O-C 3.55Å; E147-R150 WeakPolarHBondContact O-CB 3.3Å; E147-R150 PolarHBondContact O-N 3.16Å; E147-R150 VanDerWaalsContact O-N 3.16Å; E147-R151 WeakPolarHBondContact O-CB 3.42Å; E147-R151 PolarHBondContact O-N 2.98Å
148	E	91.8	Very high	93.2	Very high	136 Å²	136	120.4 Å²	120.4	64%	0.636	54%	0.542	S	S	*	.	H	α-helix	trans	-57.1	-47.5	169	-178.2	-177.5	-159.6	0	0	110.9	A144 R150 R151 Q152	A144-E148 WeakPolarHBondContact O-CB 3.45Å; A144-E148 PolarHBondContact O-N 3.46Å; E148-R150 VanDerWaalsContact C-N 3.33Å; E148-R150 PolarHBondContact O-N 2.86Å; E148-R151 PolarHBondContact O-N 3.33Å; E148-Q152 WeakPolarHBondContact O-CB 3.42Å; E148-Q152 PolarHBondContact O-N 3.47Å
149	K	93.9	Very high	93.1	Very high	145 Å²	145	120 Å²	120	63%	0.63	54%	0.543	S	S	*	.	H	α-helix	trans	-65.2	-32.4	174.5	-79.9	-171.3	174.2	-171.3	0	113.7	A145 V146 R153	A145-K149 WeakPolarHBondContact O-CG 3.28Å; A145-K149 PolarHBondContact O-N 2.95Å; V146-K149 PolarHBondContact O-N 3.04Å; K149-R153 WeakPolarHBondContact O-CG 3.36Å; K149-R153 PolarHBondContact O-N 3.21Å
150	R	91.9	Very high	93.3	Very high	190 Å²	190	123.1 Å²	123.1	72%	0.717	55%	0.55	S	S	*	*	H	α-helix	trans	-66.8	-45.3	170.7	-97.4	-177.4	167.4	178.3	-3.1	111.3	V146 E147 E148 R153 L154	V146-R150 PolarHBondContact O-N 2.94Å; E147-R150 CarbonylContact O-C 3.55Å; E147-R150 WeakPolarHBondContact O-CB 3.3Å; E147-R150 PolarHBondContact O-N 3.16Å; E147-R150 VanDerWaalsContact O-N 3.16Å; E148-R150 VanDerWaalsContact C-N 3.33Å; E148-R150 PolarHBondContact O-N 2.86Å; R150-R153 PolarHBondContact O-N 3.46Å; R150-L154 WeakPolarHBondContact O-CG 3.35Å; R150-L154 PolarHBondContact O-N 2.81Å; R150-L154 VanDerWaalsContact O-N 3.14Å
151	R	90.3	Very high	93.5	Very high	168 Å²	168	123.2 Å²	123.2	63%	0.634	55%	0.551	S	S	*	*	H	α-helix	trans	-62.6	-47.4	177.1	-177.7	178.7	173.5	174.8	-1.1	110.9	E147 E148 R153 L154 E155	E147-R151 WeakPolarHBondContact O-CB 3.42Å; E147-R151 PolarHBondContact O-N 2.98Å; E148-R151 PolarHBondContact O-N 3.33Å; R151-R153 VanDerWaalsContact C-N 3.27Å; R151-R153 PolarHBondContact O-N 2.78Å; R151-L154 CarbonylContact O-C 3.59Å; R151-L154 PolarHBondContact O-N 3.36Å; R151-E155 IonicContact NE-OE2 2.71Å; R151-E155 PolarHBondContact NE-OE2 3.27Å; R151-E155 IonicContact NH2-OE2 2.97Å; R151-E155 WeakPolarHBondContact O-CB 3.22Å; R151-E155 PolarHBondContact O-N 3.48Å
152	Q	93.1	Very high	93.7	Very high	104 Å²	104	118.6 Å²	118.6	49%	0.486	54%	0.536	S	S	.	.	H	α-helix	trans	-54.4	-43.5	175.2	-174.4	-178.7	21.5	0	0	111.2	E148 L154 E155 E156	E148-Q152 WeakPolarHBondContact O-CB 3.42Å; E148-Q152 PolarHBondContact O-N 3.47Å; Q152-L154 VanDerWaalsContact C-N 3.35Å; Q152-L154 PolarHBondContact O-N 3.43Å; Q152-E155 PolarHBondContact O-N 2.81Å; Q152-E156 HydrophobicContact CG-CG 4.34Å; Q152-E156 VanDerWaalsContact O-CB 3.27Å; Q152-E156 WeakPolarHBondContact O-CB 3.44Å; Q152-E156 VanDerWaalsContact O-CG 3.23Å; Q152-E156 WeakPolarHBondContact O-CG 3.42Å; Q152-E156 PolarHBondContact O-N 2.97Å
153	R	93.9	Very high	93.6	Very high	161 Å²	161	111.9 Å²	111.9	61%	0.608	52%	0.52	S	S	*	.	H	α-helix	trans	-65	-33.9	175.9	-77.7	-69.6	-172.7	-108.5	-4.4	113.9	K149 R150 R151 E156 D157	K149-R153 WeakPolarHBondContact O-CG 3.36Å; K149-R153 PolarHBondContact O-N 3.21Å; R150-R153 PolarHBondContact O-N 3.46Å; R151-R153 VanDerWaalsContact C-N 3.27Å; R151-R153 PolarHBondContact O-N 2.78Å; R153-E156 IonicContact CZ-OE2 2.64Å; R153-E156 IonicContact NE-OE2 2.69Å; R153-E156 IonicContact NH1-OE1 3.54Å; R153-E156 PolarHBondContact NH1-OE1 2.84Å; R153-E156 IonicContact NH1-OE2 3.51Å; R153-E156 PolarHBondContact NH1-OE2 3.38Å; R153-D157 WeakPolarHBondContact O-CB 3.11Å; R153-D157 PolarHBondContact O-N 3.06Å
154	L	93.9	Very high	93.7	Very high	127 Å²	127	109.1 Å²	109.1	67%	0.665	52%	0.518	S	S	*	.	H	α-helix	trans	-75.2	-38.5	175.2	-67.1	170.3	0	0	0	111.9	R150 R151 Q152 D157 K158	R150-L154 WeakPolarHBondContact O-CG 3.35Å; R150-L154 PolarHBondContact O-N 2.81Å; R150-L154 VanDerWaalsContact O-N 3.14Å; R151-L154 CarbonylContact O-C 3.59Å; R151-L154 PolarHBondContact O-N 3.36Å; Q152-L154 VanDerWaalsContact C-N 3.35Å; Q152-L154 PolarHBondContact O-N 3.43Å; L154-D157 PolarHBondContact O-N 3.3Å; L154-K158 WeakPolarHBondContact O-CB 3.21Å; L154-K158 PolarHBondContact O-N 2.89Å
155	E	91.5	Very high	94	Very high	60 Å²	60	110.1 Å²	110.1	28%	0.28	52%	0.519	S	S	.	.	H	α-helix	trans	-67.3	-43.9	175.5	-142.6	84.2	-108.3	0	0	110.2	R151 Q152 D157 K158 E159	R151-E155 IonicContact NE-OE2 2.71Å; R151-E155 PolarHBondContact NE-OE2 3.27Å; R151-E155 IonicContact NH2-OE2 2.97Å; R151-E155 WeakPolarHBondContact O-CB 3.22Å; R151-E155 PolarHBondContact O-N 3.48Å; Q152-E155 PolarHBondContact O-N 2.81Å; E155-D157 PolarHBondContact O-N 3.03Å; E155-K158 PolarHBondContact O-N 3.42Å; E155-K158 IonicContact OE1-NZ 3.15Å; E155-K158 PolarHBondContact OE1-NZ 3.07Å; E155-E159 WeakPolarHBondContact O-CB 3.35Å; E155-E159 WeakPolarHBondContact O-CG 3.42Å; E155-E159 PolarHBondContact O-N 3.48Å
156	E	92.9	Very high	93.9	Very high	45 Å²	45	114.7 Å²	114.7	21%	0.21	53%	0.527	C	S	.	.	H	α-helix	trans	-59.4	-40.1	172.8	-79.3	174.7	-167.2	0	0	113	Q152 R153 R160	Q152-E156 HydrophobicContact CG-CG 4.34Å; Q152-E156 VanDerWaalsContact O-CB 3.27Å; Q152-E156 WeakPolarHBondContact O-CB 3.44Å; Q152-E156 VanDerWaalsContact O-CG 3.23Å; Q152-E156 WeakPolarHBondContact O-CG 3.42Å; Q152-E156 PolarHBondContact O-N 2.97Å; R153-E156 IonicContact CZ-OE2 2.64Å; R153-E156 IonicContact NE-OE2 2.69Å; R153-E156 IonicContact NH1-OE1 3.54Å; R153-E156 PolarHBondContact NH1-OE1 2.84Å; R153-E156 IonicContact NH1-OE2 3.51Å; R153-E156 PolarHBondContact NH1-OE2 3.38Å; E156-R160 WeakPolarHBondContact O-CB 3.46Å; E156-R160 WeakPolarHBondContact O-CD 3.25Å; E156-R160 WeakPolarHBondContact O-CG 3.42Å; E156-R160 PolarHBondContact O-N 2.89Å
157	D	94.6	Very high	93.7	Very high	109 Å²	109	118.6 Å²	118.6	58%	0.583	53%	0.531	S	S	*	.	H	α-helix	trans	-75.4	-37.4	-179.4	-160.9	50.7	0	0	0	111.6	R153 L154 E155 R160 H161	R153-D157 WeakPolarHBondContact O-CB 3.11Å; R153-D157 PolarHBondContact O-N 3.06Å; L154-D157 PolarHBondContact O-N 3.3Å; E155-D157 PolarHBondContact O-N 3.03Å; D157-R160 WeakPolarHBondContact O-CB 3.35Å; D157-R160 PolarHBondContact O-N 3.02Å; D157-H161 WeakPolarHBondContact O-CB 3.39Å; D157-H161 PolarHBondContact O-N 3.43Å
158	K	97.1	Very high	93.6	Very high	115 Å²	115	116 Å²	116	50%	0.5	53%	0.525	S	S	.	.	H	α-helix	trans	-60	-47.3	168	171.6	-174.9	155.7	-159.8	0	111.5	L154 E155 R160 H161 E162	L154-K158 WeakPolarHBondContact O-CB 3.21Å; L154-K158 PolarHBondContact O-N 2.89Å; E155-K158 PolarHBondContact O-N 3.42Å; E155-K158 IonicContact OE1-NZ 3.15Å; E155-K158 PolarHBondContact OE1-NZ 3.07Å; K158-R160 VanDerWaalsContact C-N 3.34Å; K158-R160 PolarHBondContact O-N 2.64Å; K158-H161 PolarHBondContact O-N 3.15Å; K158-E162 VanDerWaalsContact O-CB 3.3Å; K158-E162 WeakPolarHBondContact O-CB 3.1Å; K158-E162 PolarHBondContact O-N 3.44Å
159	E	94.5	Very high	93.4	Very high	119 Å²	119	114 Å²	114	56%	0.556	52%	0.516	S	S	*	.	H	α-helix	trans	-61.3	-39.4	174.6	-79	176.9	-172.9	0	0	112	E155 E162 A163	E155-E159 WeakPolarHBondContact O-CB 3.35Å; E155-E159 WeakPolarHBondContact O-CG 3.42Å; E155-E159 PolarHBondContact O-N 3.48Å; E159-E162 PolarHBondContact O-N 2.85Å; E159-A163 WeakPolarHBondContact O-CB 3.43Å; E159-A163 PolarHBondContact O-N 2.9Å
160	R	95.4	Very high	93.1	Very high	162 Å²	162	111.7 Å²	111.7	61%	0.611	51%	0.508	S	S	*	.	H	α-helix	trans	-63.2	-45.1	173.9	-74.9	162	-170.1	-78.3	-5.7	111.6	E156 D157 K158 A163 V164	E156-R160 WeakPolarHBondContact O-CB 3.46Å; E156-R160 WeakPolarHBondContact O-CD 3.25Å; E156-R160 WeakPolarHBondContact O-CG 3.42Å; E156-R160 PolarHBondContact O-N 2.89Å; D157-R160 WeakPolarHBondContact O-CB 3.35Å; D157-R160 PolarHBondContact O-N 3.02Å; K158-R160 VanDerWaalsContact C-N 3.34Å; K158-R160 PolarHBondContact O-N 2.64Å; R160-A163 PolarHBondContact O-N 2.86Å; R160-V164 WeakPolarHBondContact O-CG2 3.32Å; R160-V164 PolarHBondContact O-N 3.34Å
161	H	94.5	Very high	92.8	Very high	128 Å²	128	112.8 Å²	112.8	59%	0.593	51%	0.512	S	S	*	.	H	α-helix	trans	-62.4	-47.6	175.5	-180	71.5	0	0	0	111.3	D157 K158 A163 V164 V165	D157-H161 WeakPolarHBondContact O-CB 3.39Å; D157-H161 PolarHBondContact O-N 3.43Å; K158-H161 PolarHBondContact O-N 3.15Å; H161-A163 VanDerWaalsContact C-N 3.32Å; H161-A163 PolarHBondContact O-N 2.95Å; H161-V164 WeakPolarHBondContact O-CA 3.38Å; H161-V164 WeakPolarHBondContact O-CB 3.5Å; H161-V164 PolarHBondContact O-N 3.49Å; H161-V164 VanDerWaalsContact O-N 3.09Å; H161-V165 WeakPolarHBondContact O-CG2 3.25Å; H161-V165 PolarHBondContact O-N 2.84Å
162	E	95.1	Very high	92.4	Very high	72 Å²	72	109.3 Å²	109.3	34%	0.336	51%	0.514	S	S	.	.	H	α-helix	trans	-63.6	-36.1	178	-161.4	-176.2	157	0	0	112	K158 E159 V165 R166	K158-E162 VanDerWaalsContact O-CB 3.3Å; K158-E162 WeakPolarHBondContact O-CB 3.1Å; K158-E162 PolarHBondContact O-N 3.44Å; E159-E162 PolarHBondContact O-N 2.85Å; E162-V165 PolarHBondContact O-N 2.91Å; E162-R166 WeakPolarHBondContact O-CB 3.29Å; E162-R166 WeakPolarHBondContact O-CG 3.33Å; E162-R166 PolarHBondContact O-N 2.97Å; E162-R166 IonicContact OE1-CZ 3.97Å; E162-R166 IonicContact OE1-NH1 3.39Å; E162-R166 PolarHBondContact OE1-NH1 3.32Å; E162-R166 IonicContact OE1-NH2 3Å; E162-R166 PolarHBondContact OE1-NH2 3.49Å
163	A	93.7	Very high	91.7	Very high	41 Å²	41	111 Å²	111	34%	0.339	52%	0.521	S	S	.	.	H	α-helix	trans	-69.2	-33.2	172.4	0	0	0	0	0	112.7	E159 R160 H161 R167	E159-A163 WeakPolarHBondContact O-CB 3.43Å; E159-A163 PolarHBondContact O-N 2.9Å; R160-A163 PolarHBondContact O-N 2.86Å; H161-A163 VanDerWaalsContact C-N 3.32Å; H161-A163 PolarHBondContact O-N 2.95Å; A163-R167 WeakPolarHBondContact O-CB 3.46Å; A163-R167 WeakPolarHBondContact O-CG 3.25Å; A163-R167 PolarHBondContact O-N 3.48Å
164	V	96.8	Very high	90.6	Very high	83 Å²	83	109.2 Å²	109.2	50%	0.503	52%	0.518	S	S	.	.	H	α-helix	trans	-66.6	-45	170	168.7	0	0	0	0	110.5	R160 H161 R167 T168	R160-V164 WeakPolarHBondContact O-CG2 3.32Å; R160-V164 PolarHBondContact O-N 3.34Å; H161-V164 WeakPolarHBondContact O-CA 3.38Å; H161-V164 WeakPolarHBondContact O-CB 3.5Å; H161-V164 PolarHBondContact O-N 3.49Å; H161-V164 VanDerWaalsContact O-N 3.09Å; V164-R167 PolarHBondContact O-N 2.91Å; V164-T168 WeakPolarHBondContact O-CG2 3.5Å; V164-T168 PolarHBondContact O-N 3.49Å; V164-T168 PolarHBondContact O-OG1 3.42Å
165	V	96	Very high	88.9	Confident	69 Å²	69	109 Å²	109	42%	0.418	52%	0.524	S	S	.	.	H	α-helix	trans	-61	-45.5	175.5	173.1	0	0	0	0	111.4	H161 E162 R167 T168 M169	H161-V165 WeakPolarHBondContact O-CG2 3.25Å; H161-V165 PolarHBondContact O-N 2.84Å; E162-V165 PolarHBondContact O-N 2.91Å; V165-R167 PolarHBondContact O-N 3.32Å; V165-T168 WeakPolarHBondContact CA-OG1 3.33Å; V165-T168 PolarHBondContact O-N 3.42Å; V165-T168 PolarHBondContact O-OG1 3.09Å; V165-M169 WeakPolarHBondContact O-CB 3.19Å; V165-M169 PolarHBondContact O-N 2.64Å
166	R	92.8	Very high	87.5	Confident	142 Å²	142	115.9 Å²	115.9	54%	0.536	55%	0.553	S	S	.	*	H	α-helix	trans	-60	-44.7	174	-77.6	-171	175.5	97.3	16.3	111.8	E162 T168 M169 E170	E162-R166 WeakPolarHBondContact O-CB 3.29Å; E162-R166 WeakPolarHBondContact O-CG 3.33Å; E162-R166 PolarHBondContact O-N 2.97Å; E162-R166 IonicContact OE1-CZ 3.97Å; E162-R166 IonicContact OE1-NH1 3.39Å; E162-R166 PolarHBondContact OE1-NH1 3.32Å; E162-R166 IonicContact OE1-NH2 3Å; E162-R166 PolarHBondContact OE1-NH2 3.49Å; R166-T168 PolarHBondContact O-N 3.21Å; R166-M169 PolarHBondContact O-N 3.09Å; R166-E170 VanDerWaalsContact O-CB 3.3Å; R166-E170 WeakPolarHBondContact O-CB 3.46Å; R166-E170 PolarHBondContact O-N 3.01Å
167	R	92.1	Very high	85.9	Confident	177 Å²	177	122.4 Å²	122.4	67%	0.668	58%	0.584	S	S	*	*	H	α-helix	trans	-64.8	-36.7	177	-76.6	171.4	179.5	-178.2	1.4	113.2	A163 V164 V165 R171	A163-R167 WeakPolarHBondContact O-CB 3.46Å; A163-R167 WeakPolarHBondContact O-CG 3.25Å; A163-R167 PolarHBondContact O-N 3.48Å; V164-R167 PolarHBondContact O-N 2.91Å; V165-R167 PolarHBondContact O-N 3.32Å; R167-R171 WeakPolarHBondContact O-CB 3.44Å; R167-R171 PolarHBondContact O-N 2.76Å
168	T	90.9	Very high	84.3	Confident	83 Å²	83	127.3 Å²	127.3	51%	0.509	60%	0.6	S	S	.	*	H	α-helix	trans	-72.3	-37.7	176.3	52.1	0	0	0	0	111.7	V164 V165 R166 R171 S172	V164-T168 WeakPolarHBondContact O-CG2 3.5Å; V164-T168 PolarHBondContact O-N 3.49Å; V164-T168 PolarHBondContact O-OG1 3.42Å; V165-T168 WeakPolarHBondContact CA-OG1 3.33Å; V165-T168 PolarHBondContact O-N 3.42Å; V165-T168 PolarHBondContact O-OG1 3.09Å; R166-T168 PolarHBondContact O-N 3.21Å; T168-R171 PolarHBondContact O-N 2.79Å; T168-S172 PolarHBondContact O-N 3.04Å; T168-S172 PolarHBondContact O-OG 2.67Å
169	M	87.2	Confident	82.3	Confident	94 Å²	94	130.5 Å²	130.5	46%	0.463	62%	0.616	S	S	.	*	H	α-helix	trans	-64.9	-46.1	172.8	-175.7	172.2	68.2	0	0	112.2	V165 R166 R171 S172 Q173	V165-M169 WeakPolarHBondContact O-CB 3.19Å; V165-M169 PolarHBondContact O-N 2.64Å; R166-M169 PolarHBondContact O-N 3.09Å; M169-R171 VanDerWaalsContact C-N 3.31Å; M169-R171 PolarHBondContact O-N 2.71Å; M169-S172 PolarHBondContact O-N 3.47Å; M169-S172 PolarHBondContact O-OG 2.81Å; M169-Q173 HydrophobicContact CG-CG 4.47Å; M169-Q173 WeakPolarHBondContact O-CB 3.41Å; M169-Q173 VanDerWaalsContact O-CG 3.32Å; M169-Q173 WeakPolarHBondContact O-CG 3.44Å; M169-Q173 PolarHBondContact O-N 2.92Å
170	E	86.8	Confident	80.3	Confident	96 Å²	96	132.1 Å²	132.1	45%	0.449	63%	0.628	S	S	.	*	H	α-helix	trans	-61.9	-40	175.2	-169.8	-164.5	161.8	0	0	111.3	R166 S172 Q173 K174	R166-E170 VanDerWaalsContact O-CB 3.3Å; R166-E170 WeakPolarHBondContact O-CB 3.46Å; R166-E170 PolarHBondContact O-N 3.01Å; E170-S172 VanDerWaalsContact C-N 3.34Å; E170-S172 PolarHBondContact O-N 3.4Å; E170-Q173 PolarHBondContact O-N 2.78Å; E170-K174 HydrophobicContact CG-CD 4.5Å; E170-K174 WeakPolarHBondContact O-CG 3.33Å; E170-K174 PolarHBondContact O-N 3.3Å; E170-K174 WeakPolarHBondContact OE1-CE 3.47Å; E170-K174 IonicContact OE1-NZ 3.25Å; E170-K174 PolarHBondContact OE1-NZ 2.82Å
171	R	85.5	Confident	77.8	Confident	214 Å²	214	133.4 Å²	133.4	81%	0.808	63%	0.633	S	S	*	*	H	α-helix	trans	-69.4	-27.4	176.5	-174.1	177.6	-178.1	-164.5	1.2	113.3	R167 T168 M169	R167-R171 WeakPolarHBondContact O-CB 3.44Å; R167-R171 PolarHBondContact O-N 2.76Å; T168-R171 PolarHBondContact O-N 2.79Å; M169-R171 VanDerWaalsContact C-N 3.31Å; M169-R171 PolarHBondContact O-N 2.71Å
172	S	82.9	Confident	75.9	Confident	95 Å²	95	139.5 Å²	139.5	66%	0.664	65%	0.651	S	S	*	*	H	α-helix	trans	-85.4	-29.7	175.3	65.8	0	0	0	0	112.9	T168 M169 E170	T168-S172 PolarHBondContact O-N 3.04Å; T168-S172 PolarHBondContact O-OG 2.67Å; M169-S172 PolarHBondContact O-N 3.47Å; M169-S172 PolarHBondContact O-OG 2.81Å; E170-S172 VanDerWaalsContact C-N 3.34Å; E170-S172 PolarHBondContact O-N 3.4Å
173	Q	77.4	Confident	73.8	Confident	138 Å²	138	139.9 Å²	139.9	65%	0.645	66%	0.662	S	S	*	*	H	α-helix	trans	-79.6	-29	177	-72.2	177.4	-0.1	0	0	113.6	M169 E170 P175	M169-Q173 HydrophobicContact CG-CG 4.47Å; M169-Q173 WeakPolarHBondContact O-CB 3.41Å; M169-Q173 VanDerWaalsContact O-CG 3.32Å; M169-Q173 WeakPolarHBondContact O-CG 3.44Å; M169-Q173 PolarHBondContact O-N 2.92Å; E170-Q173 PolarHBondContact O-N 2.78Å; Q173-P175 WeakPolarHBondContact O-CD 3.5Å
174	K	71.6	Confident	71.5	Confident	124 Å²	124	150.3 Å²	150.3	54%	0.539	69%	0.693	S	S	.	*	S	Bend	trans	-63.2	119.4	173.2	-79.8	176.7	-176.6	174.2	0	110	E170 K176	E170-K174 HydrophobicContact CG-CD 4.5Å; E170-K174 WeakPolarHBondContact O-CG 3.33Å; E170-K174 PolarHBondContact O-N 3.3Å; E170-K174 WeakPolarHBondContact OE1-CE 3.47Å; E170-K174 IonicContact OE1-NZ 3.25Å; E170-K174 PolarHBondContact OE1-NZ 2.82Å; K174-K176 PolarHBondContact O-N 2.82Å
175	P	58.5	Low	69.4	Low	122 Å²	122	150.2 Å²	150.2	79%	0.792	71%	0.708	S	S	*	*			trans	-62	136.3	-177	24.9	-33.6	0	0	0	110.2	Q173 Q177	Q173-P175 WeakPolarHBondContact O-CD 3.5Å; P175-Q177 VanDerWaalsContact C-N 3.3Å; P175-Q177 PolarHBondContact O-N 3.47Å
176	K	60.8	Low	66.9	Low	205 Å²	205	151 Å²	151	89%	0.891	73%	0.73	S	S	*	*			trans	-68.8	83.7	-178.2	-69.3	179.3	-179	172.9	0	110.9	K174 K178	K174-K176 PolarHBondContact O-N 2.82Å; K176-K178 PolarHBondContact O-N 3.36Å
177	Q	59	Low	64.3	Low	183 Å²	183	149.3 Å²	149.3	86%	0.855	74%	0.741	S	S	*	*			trans	-58.7	109.6	170.1	-172.7	173.6	0	0	0	108.7	P175 H179	P175-Q177 VanDerWaalsContact C-N 3.3Å; P175-Q177 PolarHBondContact O-N 3.47Å; Q177-H179 PolarHBondContact O-N 2.8Å; Q177-H179 VanDerWaalsContact O-N 3.09Å
178	K	62.3	Low	62.3	Low	212 Å²	212	148.8 Å²	148.8	92%	0.922	75%	0.75	S	S	*	*			trans	-70.2	104	-176.1	-67.8	180	179.9	176.8	0	110.1	K176	K176-K178 PolarHBondContact O-N 3.36Å
179	H	55.4	Low	60	Low	181 Å²	181	153.7 Å²	153.7	84%	0.838	77%	0.767	S	S	*	*			trans	-121	154.3	152	74.6	54.7	0	0	0	110.5	Q177	Q177-H179 PolarHBondContact O-N 2.8Å; Q177-H179 VanDerWaalsContact O-N 3.09Å
180	N	51.1	Low	57.6	Low	153 Å²	153	152.8 Å²	152.8	82%	0.818	78%	0.782	S	S	*	*			trans	-100.9	170.8	-147.9	-159.8	3.7	0	0	0	114
181	R	42.8	Very low	55.2	Low	190 Å²	190	154 Å²	154	72%	0.717	80%	0.801	S	S	*	*			trans	71.5	99.9	149.8	-157.2	173.8	-163.6	-89.9	7	117.8	S183	R181-S183 VanDerWaalsContact NH1-CB 3.32Å; R181-S183 PolarHBondContact NH1-OG 2.95Å
182	W	55.8	Low	54.2	Low	255 Å²	255	149.1 Å²	149.1	97%	0.966	80%	0.797	S	S	*	*			trans	-57.6	135.5	147.2	-87.7	-49.7	0	0	0	110
183	S	50.4	Low	51.9	Low	81 Å²	81	149.5 Å²	149.5	57%	0.566	80%	0.8	S	S	*	*			trans	-156.7	86.7	157.8	47.7	0	0	0	0	111.5	R181	R181-S183 VanDerWaalsContact NH1-CB 3.32Å; R181-S183 PolarHBondContact NH1-OG 2.95Å
184	W	44.8	Very low	50.3	Low	260 Å²	260	149 Å²	149	99%	0.985	80%	0.8	S	S	*	*			trans	-100.6	105.7	156	-79.6	101.8	0	0	0	107.4
185	G	52.9	Low	48.7	Very low	80 Å²	80	150.6 Å²	150.6	83%	0.825	81%	0.809	S	S	*	*			trans	171.1	122	177.9	0	0	0	0	0	114.1
186	G	43.3	Very low	47.6	Very low	85 Å²	85	150 Å²	150	88%	0.876	81%	0.807	S	S	*	*			trans	94.2	102.8	160.8	0	0	0	0	0	117.2
187	S	39.2	Very low	46.6	Very low	108 Å²	108	145.1 Å²	145.1	76%	0.755	81%	0.806	S	S	*	*				-168.1	147	105.8	-166.1	0	0	0	0	111.1
188	L	49.5	Very low	45.5	Very low	166 Å²	166	143.9 Å²	143.9	87%	0.869	81%	0.805	S	S	*	*			trans	-142	101.2	177.6	-90.6	173	0	0	0	110.9
189	H	43.4	Very low	45	Very low	185 Å²	185	139 Å²	139	86%	0.856	80%	0.795	S	S	*	*			trans	-154.6	152.1	165.2	-65.5	-89.5	0	0	0	106.3
190	G	37	Very low	44.2	Very low	76 Å²	76	135.1 Å²	135.1	78%	0.784	78%	0.78	S	S	*	*			cis	-178.7	149	-6.3	0	0	0	0	0	108.1
191	S	36.3	Very low	44	Very low	121 Å²	121	139.7 Å²	139.7	85%	0.846	79%	0.786	S	S	*	*			trans	-93	177.2	-177.6	-139.3	0	0	0	0	111.5
192	P	63.1	Low	44.2	Very low	111 Å²	111	140.2 Å²	140.2	72%	0.721	79%	0.788	S	S	*	*			cis	-138.7	-146.5	-0.1	42.7	-21.5	0	0	0	113.8
193	S	35.6	Very low	43.8	Very low	104 Å²	104	132.9 Å²	132.9	73%	0.727	78%	0.776	S	S	*	*			trans	80.2	146.2	160.1	-80.1	0	0	0	0	119.9
194	I	43.8	Very low	43.4	Very low	127 Å²	127	135.4 Å²	135.4	65%	0.651	79%	0.787	S	S	*	*			cis	-165.7	157.6	-16.7	-149.9	166	0	0	0	111.9
195	H	36.9	Very low	43.3	Very low	158 Å²	158	127.9 Å²	127.9	73%	0.731	78%	0.775	S	S	*	*			trans	61.2	172.2	165.1	-63.2	-31.7	0	0	0	120.1
196	S	36.5	Very low	42.9	Very low	108 Å²	108	129.9 Å²	129.9	76%	0.755	77%	0.771	S	S	*	*				-178.3	155	-54.5	-95.6	0	0	0	0	110.9
197	A	40.1	Very low	42.7	Very low	104 Å²	104	132.9 Å²	132.9	86%	0.86	76%	0.764	S	S	*	*			trans	67.3	143.6	-179.2	0	0	0	0	0	115.1
198	D	35.3	Very low	42.9	Very low	156 Å²	156	134.5 Å²	134.5	83%	0.834	76%	0.764	S	S	*	*			cis	-149.8	162.1	43.3	-162.5	41.9	0	0	0	112.3
199	P	51.5	Low	42.5	Very low	110 Å²	110	134 Å²	134	71%	0.714	76%	0.762	S	S	*	*			trans	-113.2	164.8	-167.8	40.5	-31.5	0	0	0	118.4
200	D	39	Very low	42.4	Very low	99 Å²	99	131 Å²	131	53%	0.529	76%	0.761	S	S	.	*			trans	39.4	90.1	172	-166.3	13	0	0	0	119.4	R202	D200-R202 WeakPolarHBondContact OD1-CG 3.47Å; D200-R202 PolarHBondContact OD1-N 3.41Å; D200-R202 VanDerWaalsContact OD1-N 3.08Å; D200-R202 IonicContact OD1-NE 3.14Å; D200-R202 PolarHBondContact OD1-NE 2.89Å; D200-R202 VanDerWaalsContact OD1-NE 3.14Å; D200-R202 IonicContact OD2-CZ 3.28Å; D200-R202 VanDerWaalsContact OD2-CZ 3.28Å; D200-R202 IonicContact OD2-NE 2.87Å; D200-R202 PolarHBondContact OD2-NE 3.03Å; D200-R202 IonicContact OD2-NH2 2.79Å; D200-R202 PolarHBondContact OD2-NH2 2.84Å
201	R	47.2	Very low	43.1	Very low	249 Å²	249	136.8 Å²	136.8	94%	0.94	77%	0.765	S	S	*	*				-130.1	97.3	129.1	-75.8	-164.8	173.4	-118.4	-2.9	112.6
202	R	45.9	Very low	42.8	Very low	201 Å²	201	141.6 Å²	141.6	76%	0.758	77%	0.766	S	S	*	*			trans	5.5	133.7	136.2	-71	144.5	-153.6	-108.1	0.8	116.5	D200	D200-R202 WeakPolarHBondContact OD1-CG 3.47Å; D200-R202 PolarHBondContact OD1-N 3.41Å; D200-R202 VanDerWaalsContact OD1-N 3.08Å; D200-R202 IonicContact OD1-NE 3.14Å; D200-R202 PolarHBondContact OD1-NE 2.89Å; D200-R202 VanDerWaalsContact OD1-NE 3.14Å; D200-R202 IonicContact OD2-CZ 3.28Å; D200-R202 VanDerWaalsContact OD2-CZ 3.28Å; D200-R202 IonicContact OD2-NE 2.87Å; D200-R202 PolarHBondContact OD2-NE 3.03Å; D200-R202 IonicContact OD2-NH2 2.79Å; D200-R202 PolarHBondContact OD2-NH2 2.84Å
203	S	48.8	Very low	41.8	Very low	102 Å²	102	142 Å²	142	71%	0.713	77%	0.767	S	S	*	*			cis	-158.5	154.6	23.6	-92.3	0	0	0	0	114.7
204	V	41.5	Very low	41.8	Very low	133 Å²	133	144.2 Å²	144.2	81%	0.806	77%	0.77	S	S	*	*			trans	6.5	125.3	136.2	-144.5	0	0	0	0	114.8
205	S	41.8	Very low	42.2	Very low	103 Å²	103	142.7 Å²	142.7	72%	0.72	77%	0.769	S	S	*	*			cis	-157.9	172.6	41	-145.9	0	0	0	0	109.7
206	T	44.5	Very low	42.3	Very low	122 Å²	122	142.2 Å²	142.2	75%	0.748	78%	0.776	S	S	*	*			cis	-140.8	174.5	19.9	62.5	0	0	0	0	113.2
207	M	38.9	Very low	42.7	Very low	148 Å²	148	144.4 Å²	144.4	73%	0.729	78%	0.778	S	S	*	*			trans	-134.7	161.7	164.1	-71.7	-170.4	71.2	0	0	107.7
208	N	44.1	Very low	42.7	Very low	142 Å²	142	143.9 Å²	143.9	76%	0.759	77%	0.768	S	S	*	*			cis	-150.5	154.2	41.5	-74.5	-90	0	0	0	114
209	L	42.2	Very low	43.2	Very low	156 Å²	156	145.8 Å²	145.8	82%	0.817	77%	0.769	S	S	*	*			trans	-83.5	146.3	160.9	-61.8	83.1	0	0	0	109.4
210	S	40.9	Very low	43.2	Very low	121 Å²	121	151.7 Å²	151.7	85%	0.846	78%	0.777	S	S	*	*			trans	-118.3	92.3	171.2	47.8	0	0	0	0	111.5
211	K	50.4	Low	43.3	Very low	197 Å²	197	155 Å²	155	86%	0.857	79%	0.794	S	S	*	*			trans	-147.7	99.2	168.3	-73.4	-171.9	-179.9	-179.8	0	111.2
212	Y	30.5	Very low	43.2	Very low	223 Å²	223	148.4 Å²	148.4	88%	0.875	79%	0.786	S	S	*	*				-162.5	169.9	118.7	-140.1	-112.2	0	0	0	111.2
213	V	43	Very low	43.5	Very low	120 Å²	120	144.7 Å²	144.7	73%	0.727	79%	0.79	S	S	*	*			trans	-118.4	141	175.3	168.8	0	0	0	0	107.4
214	D	34.1	Very low	43.3	Very low	149 Å²	149	144.5 Å²	144.5	80%	0.797	79%	0.789	S	S	*	*			trans	-150.9	160.7	155.6	-114.7	-4.2	0	0	0	111.2
215	P	53.4	Low	43.5	Very low	96 Å²	96	143.7 Å²	143.7	62%	0.623	79%	0.79	S	S	*	*			trans	-105.6	148.7	-146.6	38.2	-37.3	0	0	0	115.6
216	V	37.8	Very low	43.5	Very low	147 Å²	147	143.3 Å²	143.3	89%	0.891	79%	0.793	S	S	*	*			trans	-127.7	66.4	164.1	-168.6	0	0	0	0	110.4
217	I	46.8	Very low	43.6	Very low	155 Å²	155	143.2 Å²	143.2	80%	0.795	79%	0.792	S	S	*	*			trans	-91.4	98.7	160.2	-58.1	177.6	0	0	0	107.7
218	S	39.1	Very low	43.9	Very low	93 Å²	93	143.4 Å²	143.4	65%	0.65	80%	0.795	S	S	*	*			trans	152.3	112.3	143.2	-75.6	0	0	0	0	114.1
219	K	46.1	Very low	43.8	Very low	195 Å²	195	145 Å²	145	85%	0.848	80%	0.803	S	S	*	*			trans	136.3	73.6	155.6	-77.2	159.8	-175.3	176.6	0	108.2
220	R	51.3	Low	44.1	Very low	234 Å²	234	144.8 Å²	144.8	88%	0.883	80%	0.803	S	S	*	*				60.7	134.5	81.9	-59.6	-174.9	91.2	-171.5	7.3	112.1
221	L	41.4	Very low	43.8	Very low	169 Å²	169	143 Å²	143	89%	0.885	79%	0.79	S	S	*	*			trans	76.4	82.9	173.2	-46.7	-177.1	0	0	0	117.2
222	S	45.6	Very low	43.8	Very low	111 Å²	111	138.9 Å²	138.9	78%	0.776	78%	0.783	S	S	*	*				-161.7	105.8	110.7	-169.8	0	0	0	0	111.3
223	S	51.3	Low	44.5	Very low	122 Å²	122	133.3 Å²	133.3	85%	0.853	77%	0.769	S	S	*	*			trans	-106.3	72	170.7	175.1	0	0	0	0	109.5
224	S	45.5	Very low	44.8	Very low	99 Å²	99	136.1 Å²	136.1	69%	0.692	77%	0.766	S	S	*	*			trans	-169.4	101.3	165.7	-85.5	0	0	0	0	112.6
225	S	45.3	Very low	45.4	Very low	116 Å²	116	133 Å²	133	81%	0.811	76%	0.761	S	S	*	*			trans	-148.3	22.8	166.1	-67.3	0	0	0	0	112.7
226	A	42.4	Very low	45.3	Very low	95 Å²	95	138.3 Å²	138.3	79%	0.785	77%	0.769	S	S	*	*	S	Bend	trans	-90.5	1.9	-174.8	0	0	0	0	0	114.4
227	T	45.4	Very low	45.9	Very low	119 Å²	119	141.3 Å²	141.3	73%	0.73	76%	0.764	S	S	*	*	S	Bend	trans	-126.5	-0.8	-165.2	46.1	0	0	0	0	115.3	L229	T227-L229 PolarHBondContact O-N 2.92Å
228	L	45.8	Very low	46.3	Very low	153 Å²	153	138.8 Å²	138.8	80%	0.801	75%	0.752	S	S	*	*			trans	-97.3	35.9	179.6	-66.8	-178.9	0	0	0	114.2	N230	L228-N230 VanDerWaalsContact C-N 3.25Å; L228-N230 PolarHBondContact O-N 3.23Å
229	L	42.6	Very low	46.9	Very low	174 Å²	174	143.5 Å²	143.5	91%	0.911	76%	0.763	S	S	*	*			trans	-86.7	14.7	170.2	-71.8	177.6	0	0	0	113.6	T227	T227-L229 PolarHBondContact O-N 2.92Å
230	N	46.9	Very low	48.1	Very low	153 Å²	153	138 Å²	138	82%	0.818	74%	0.743	S	S	*	*			trans	-134.2	45	-177.1	-147.1	-4.7	0	0	0	113.1	L228	L228-N230 VanDerWaalsContact C-N 3.25Å; L228-N230 PolarHBondContact O-N 3.23Å
231	S	34.9	Very low	49.4	Very low	82 Å²	82	129.4 Å²	129.4	57%	0.573	72%	0.719	S	S	*	*			trans	-96.8	117	165	-179.2	0	0	0	0	109.4	D233	S231-D233 VanDerWaalsContact C-N 3.25Å; S231-D233 PolarHBondContact O-N 2.76Å
232	P	51.3	Low	51	Low	111 Å²	111	126.8 Å²	126.8	72%	0.721	71%	0.712	S	S	*	*	G	3₁₀ helix	trans	-59	-30.2	-172.8	-28.1	35.8	0	0	0	115.1	R234 A235	P232-R234 VanDerWaalsContact C-N 3.26Å; P232-R234 PolarHBondContact O-N 3.08Å; P232-A235 WeakPolarHBondContact O-CB 3.49Å; P232-A235 PolarHBondContact O-N 3.34Å
233	D	45.4	Very low	51.9	Low	106 Å²	106	130.6 Å²	130.6	57%	0.567	71%	0.709	S	S	*	*	G	3₁₀ helix	trans	-74.1	-12.6	-166.8	-158.6	33.9	0	0	0	114.1	S231 A235 R236	S231-D233 VanDerWaalsContact C-N 3.25Å; S231-D233 PolarHBondContact O-N 2.76Å; D233-A235 VanDerWaalsContact C-N 3.34Å; D233-R236 IonicContact OD1-NH1 3.97Å
234	R	49.1	Very low	53.3	Low	180 Å²	180	128.8 Å²	128.8	68%	0.679	69%	0.687	S	S	*	*	G	3₁₀ helix	trans	-75.9	-21.8	173.4	-152	172.8	-164	-102.1	1.7	113	P232 R236 R237	P232-R234 VanDerWaalsContact C-N 3.26Å; P232-R234 PolarHBondContact O-N 3.08Å; R234-R236 PolarHBondContact O-N 3.17Å; R234-R237 PolarHBondContact O-N 2.97Å
235	A	45.7	Very low	55	Low	84 Å²	84	126.3 Å²	126.3	69%	0.694	67%	0.67	S	S	*	*	G	3₁₀ helix	trans	-65.3	-24	-178.1	0	0	0	0	0	113.4	P232 D233	P232-A235 WeakPolarHBondContact O-CB 3.49Å; P232-A235 PolarHBondContact O-N 3.34Å; D233-A235 VanDerWaalsContact C-N 3.34Å
236	R	50.9	Low	56.5	Low	207 Å²	207	123.6 Å²	123.6	78%	0.781	65%	0.651	S	S	*	*	G	3₁₀ helix	trans	-88.3	-3	179.8	-70.4	177	62.8	-124.8	3.2	114.8	D233 R234	D233-R236 IonicContact OD1-NH1 3.97Å; R234-R236 PolarHBondContact O-N 3.17Å
237	R	51.8	Low	58.2	Low	210 Å²	210	121.8 Å²	121.8	79%	0.792	63%	0.63	S	S	*	*	S	Bend	trans	-114.3	-3.2	-174.8	-76.7	-171.3	175.4	-90.1	4.6	115.7	R234	R234-R237 PolarHBondContact O-N 2.97Å
238	L	55	Low	60	Low	102 Å²	102	118.8 Å²	118.8	53%	0.534	61%	0.612	S	S	.	*			trans	-103.8	102	168.6	-65.6	178.2	0	0	0	109.1	L240	L238-L240 PolarHBondContact O-N 2.99Å
239	Q	52.1	Low	61.4	Low	191 Å²	191	115.9 Å²	115.9	89%	0.893	60%	0.597	S	S	*	*			trans	-70.9	75.6	169.8	-72.7	-74.2	3.7	0	0	109.3
240	L	70.8	Confident	63.1	Low	79 Å²	79	116.8 Å²	116.8	41%	0.414	59%	0.588	S	S	.	*			trans	-62.8	136.3	172.6	-68.2	171.9	0	0	0	109.4	L238 E244 V248	L238-L240 PolarHBondContact O-N 2.99Å; L240-E244 HydrophobicContact CB-CB 4.21Å; L240-E244 HydrophobicContact CD2-CB 4.33Å; L240-V248 HydrophobicContact CD1-CG2 4.31Å
241	S	78.6	Confident	64.4	Low	54 Å²	54	116 Å²	116	38%	0.378	58%	0.583	S	S	.	*			trans	-53.1	146.6	172.4	170.8	0	0	0	0	110.6	W243 E244 S245	S241-W243 PolarHBondContact O-N 3.21Å; S241-W243 PolarHBondContact OG-N 3.25Å; S241-E244 VanDerWaalsContact CB-OE2 3.26Å; S241-E244 WeakPolarHBondContact CB-OE2 3.44Å; S241-E244 PolarHBondContact N-OE2 2.69Å; S241-E244 PolarHBondContact O-N 3.03Å; S241-S245 WeakPolarHBondContact O-CB 3.44Å; S241-S245 PolarHBondContact O-N 2.71Å
242	P	75.3	Confident	66.3	Low	114 Å²	114	118.3 Å²	118.3	74%	0.74	59%	0.588	S	S	*	*	H	α-helix	trans	-51.8	-29.4	175	-28.8	36	0	0	0	113.8	S246	P242-S246 WeakPolarHBondContact O-CB 3.41Å; P242-S246 PolarHBondContact O-N 2.94Å
243	W	64.3	Low	67.1	Low	191 Å²	191	117 Å²	117	72%	0.723	58%	0.578	S	S	*	*	H	α-helix	trans	-73.4	-45.1	173.4	-177.9	79.4	0	0	0	112.9	S241 S245 S246 V247	S241-W243 PolarHBondContact O-N 3.21Å; S241-W243 PolarHBondContact OG-N 3.25Å; W243-S245 VanDerWaalsContact C-N 3.34Å; W243-S245 PolarHBondContact O-N 2.72Å; W243-S246 WeakPolarHBondContact O-CB 3.31Å; W243-S246 PolarHBondContact O-N 3.37Å; W243-S246 VanDerWaalsContact O-N 3.15Å; W243-V247 HydrophobicContact CD2-CG2 4.38Å; W243-V247 HydrophobicContact CZ2-CG2 4.23Å; W243-V247 WeakPolarHBondContact O-CG2 3.44Å; W243-V247 PolarHBondContact O-N 3.19Å
244	E	81	Confident	68	Low	85 Å²	85	116.6 Å²	116.6	40%	0.397	58%	0.581	S	S	.	*	H	α-helix	trans	-62.9	-42.2	175.2	-65.2	172.5	134.5	0	0	110.9	L240 S241 S246 V247 V248	L240-E244 HydrophobicContact CB-CB 4.21Å; L240-E244 HydrophobicContact CD2-CB 4.33Å; S241-E244 VanDerWaalsContact CB-OE2 3.26Å; S241-E244 WeakPolarHBondContact CB-OE2 3.44Å; S241-E244 PolarHBondContact N-OE2 2.69Å; S241-E244 PolarHBondContact O-N 3.03Å; E244-S246 VanDerWaalsContact C-N 3.32Å; E244-S246 PolarHBondContact O-N 2.96Å; E244-V247 PolarHBondContact O-N 3.44Å; E244-V248 WeakPolarHBondContact O-CB 3.49Å; E244-V248 VanDerWaalsContact O-CG2 3.31Å; E244-V248 WeakPolarHBondContact O-CG2 3.43Å; E244-V248 PolarHBondContact O-N 2.97Å
245	S	80.9	Confident	68.9	Low	47 Å²	47	111.7 Å²	111.7	33%	0.329	57%	0.572	S	S	.	*	H	α-helix	trans	-62.3	-36.9	173.1	-171.1	0	0	0	0	111.8	S241 W243 N249	S241-S245 WeakPolarHBondContact O-CB 3.44Å; S241-S245 PolarHBondContact O-N 2.71Å; W243-S245 VanDerWaalsContact C-N 3.34Å; W243-S245 PolarHBondContact O-N 2.72Å; S245-N249 VanDerWaalsContact O-CB 3.31Å; S245-N249 WeakPolarHBondContact O-CB 3.3Å; S245-N249 PolarHBondContact O-N 3.32Å; S245-N249 PolarHBondContact O-ND2 2.89Å; S245-N249 PolarHBondContact OG-ND2 3.49Å
246	S	75.6	Confident	69.3	Low	58 Å²	58	115.3 Å²	115.3	41%	0.406	57%	0.574	S	S	.	*	H	α-helix	trans	-65.5	-39.7	172.2	-171.8	0	0	0	0	112.6	P242 W243 E244 R250	P242-S246 WeakPolarHBondContact O-CB 3.41Å; P242-S246 PolarHBondContact O-N 2.94Å; W243-S246 WeakPolarHBondContact O-CB 3.31Å; W243-S246 PolarHBondContact O-N 3.37Å; W243-S246 VanDerWaalsContact O-N 3.15Å; E244-S246 VanDerWaalsContact C-N 3.32Å; E244-S246 PolarHBondContact O-N 2.96Å; S246-R250 WeakPolarHBondContact O-CB 3.46Å; S246-R250 PolarHBondContact O-N 3.48Å
247	V	79.6	Confident	69.5	Low	58 Å²	58	109 Å²	109	35%	0.352	56%	0.561	S	S	.	*	H	α-helix	trans	-66.2	-47.4	174.9	170.1	0	0	0	0	111.1	W243 E244 R250 L251	W243-V247 HydrophobicContact CD2-CG2 4.38Å; W243-V247 HydrophobicContact CZ2-CG2 4.23Å; W243-V247 WeakPolarHBondContact O-CG2 3.44Å; W243-V247 PolarHBondContact O-N 3.19Å; E244-V247 PolarHBondContact O-N 3.44Å; V247-R250 WeakPolarHBondContact O-CB 3.17Å; V247-R250 PolarHBondContact O-N 2.96Å; V247-L251 HydrophobicContact CG1-CD1 3.83Å; V247-L251 PolarHBondContact O-N 2.82Å
248	V	82.9	Confident	69.8	Low	56 Å²	56	105.9 Å²	105.9	34%	0.339	55%	0.554	S	S	.	*	H	α-helix	trans	-60.6	-46.5	176.7	169.2	0	0	0	0	110.8	L240 E244 R250 L251 L252	L240-V248 HydrophobicContact CD1-CG2 4.31Å; E244-V248 WeakPolarHBondContact O-CB 3.49Å; E244-V248 VanDerWaalsContact O-CG2 3.31Å; E244-V248 WeakPolarHBondContact O-CG2 3.43Å; E244-V248 PolarHBondContact O-N 2.97Å; V248-R250 VanDerWaalsContact C-N 3.31Å; V248-R250 PolarHBondContact O-N 3.26Å; V248-L251 PolarHBondContact O-N 2.8Å; V248-L252 HydrophobicContact CG1-CD1 3.92Å; V248-L252 WeakPolarHBondContact O-CD1 3.26Å; V248-L252 PolarHBondContact O-N 2.6Å
249	N	75.1	Confident	70.1	Confident	91 Å²	91	106.3 Å²	106.3	49%	0.487	56%	0.556	S	S	.	*	H	α-helix	trans	-62.7	-34.8	175.6	-80.7	-68	0	0	0	112.7	S245 L251 T253	S245-N249 VanDerWaalsContact O-CB 3.31Å; S245-N249 WeakPolarHBondContact O-CB 3.3Å; S245-N249 PolarHBondContact O-N 3.32Å; S245-N249 PolarHBondContact O-ND2 2.89Å; S245-N249 PolarHBondContact OG-ND2 3.49Å; N249-L251 VanDerWaalsContact C-N 3.3Å; N249-L251 PolarHBondContact O-N 2.98Å; N249-T253 WeakPolarHBondContact O-CB 3.09Å; N249-T253 WeakPolarHBondContact O-CG2 3.18Å; N249-T253 PolarHBondContact O-N 3.36Å; N249-T253 PolarHBondContact O-OG1 3.26Å
250	R	77.5	Confident	70.1	Confident	193 Å²	193	101 Å²	101	73%	0.728	54%	0.544	S	S	*	.	H	α-helix	trans	-70.4	-21.3	172.2	-87.9	178.1	153	171.1	-5.7	114.4	S246 V247 V248	S246-R250 WeakPolarHBondContact O-CB 3.46Å; S246-R250 PolarHBondContact O-N 3.48Å; V247-R250 WeakPolarHBondContact O-CB 3.17Å; V247-R250 PolarHBondContact O-N 2.96Å; V248-R250 VanDerWaalsContact C-N 3.31Å; V248-R250 PolarHBondContact O-N 3.26Å
251	L	74.8	Confident	69.4	Low	136 Å²	136	107.1 Å²	107.1	71%	0.712	56%	0.562	S	S	*	*	H	α-helix	trans	-88.8	-32.3	174.7	-82.7	153.8	0	0	0	112.5	V247 V248 N249	V247-L251 HydrophobicContact CG1-CD1 3.83Å; V247-L251 PolarHBondContact O-N 2.82Å; V248-L251 PolarHBondContact O-N 2.8Å; N249-L251 VanDerWaalsContact C-N 3.3Å; N249-L251 PolarHBondContact O-N 2.98Å
252	L	73.9	Confident	68	Low	132 Å²	132	107.7 Å²	107.7	69%	0.691	57%	0.566	S	S	*	*	H	α-helix	trans	-85.2	-26.8	177.8	-89.7	70.5	0	0	0	113.5	V248 P254	V248-L252 HydrophobicContact CG1-CD1 3.92Å; V248-L252 WeakPolarHBondContact O-CD1 3.26Å; V248-L252 PolarHBondContact O-N 2.6Å; L252-P254 VanDerWaalsContact O-CD 3.3Å; L252-P254 WeakPolarHBondContact O-CD 3.2Å
253	T	69.4	Low	66.9	Low	82 Å²	82	111.9 Å²	111.9	50%	0.503	57%	0.573	S	S	.	*	S	Bend	trans	-72.7	120.3	173.7	42.3	0	0	0	0	110.5	N249 T255	N249-T253 WeakPolarHBondContact O-CB 3.09Å; N249-T253 WeakPolarHBondContact O-CG2 3.18Å; N249-T253 PolarHBondContact O-N 3.36Å; N249-T253 PolarHBondContact O-OG1 3.26Å; T253-T255 PolarHBondContact O-N 3.05Å
254	P	64.5	Low	66	Low	98 Å²	98	107.8 Å²	107.8	64%	0.636	57%	0.573	S	S	*	*			trans	-65.1	97	179.8	-22	34.9	0	0	0	110.8	L252	L252-P254 VanDerWaalsContact O-CD 3.3Å; L252-P254 WeakPolarHBondContact O-CD 3.2Å
255	T	67.8	Low	64.3	Low	77 Å²	77	109.9 Å²	109.9	47%	0.472	59%	0.592	S	S	.	*			trans	-67.4	155.5	-178.3	-10.7	0	0	0	0	110	T253 S257 F258 L259	T253-T255 PolarHBondContact O-N 3.05Å; T255-S257 PolarHBondContact O-N 2.88Å; T255-F258 WeakPolarHBondContact O-CA 3.28Å; T255-F258 WeakPolarHBondContact O-CB 3.13Å; T255-F258 PolarHBondContact O-N 2.73Å; T255-L259 PolarHBondContact O-N 2.84Å
256	H	52.8	Low	62.4	Low	161 Å²	161	112.7 Å²	112.7	75%	0.745	62%	0.618	S	S	*	*	H	α-helix	trans	-56.3	-24.3	-179	-164.8	-49.6	0	0	0	113.3	A260	H256-A260 WeakPolarHBondContact O-CB 3.47Å; H256-A260 PolarHBondContact O-N 3.48Å
257	S	55.2	Low	61	Low	73 Å²	73	114 Å²	114	51%	0.51	63%	0.632	S	S	.	*	H	α-helix	trans	-71.6	-25.7	172.4	52.2	0	0	0	0	114.5	T255 R261	T255-S257 PolarHBondContact O-N 2.88Å; S257-R261 WeakPolarHBondContact O-CG 3.47Å
258	F	57.8	Low	59.2	Low	145 Å²	145	119.7 Å²	119.7	64%	0.636	66%	0.66	S	S	*	*	H	α-helix	trans	-76.4	-48.5	173.2	-127.6	-85.4	0	0	0	110.1	T255 A260 R261 S262	T255-F258 WeakPolarHBondContact O-CA 3.28Å; T255-F258 WeakPolarHBondContact O-CB 3.13Å; T255-F258 PolarHBondContact O-N 2.73Å; F258-A260 VanDerWaalsContact C-N 3.31Å; F258-A260 PolarHBondContact O-N 2.64Å; F258-R261 CarbonylContact O-C 3.55Å; F258-R261 WeakPolarHBondContact O-CA 2.93Å; F258-R261 PolarHBondContact O-N 2.82Å; F258-S262 WeakPolarHBondContact O-CB 3.35Å; F258-S262 PolarHBondContact O-N 3.06Å; F258-S262 PolarHBondContact O-OG 3.02Å
259	L	62.1	Low	56.9	Low	112 Å²	112	122.9 Å²	122.9	59%	0.586	69%	0.685	S	S	*	*	H	α-helix	trans	-61.8	-35.8	175.2	-73	168.5	0	0	0	112.8	T255 R261 S262	T255-L259 PolarHBondContact O-N 2.84Å; L259-R261 PolarHBondContact O-N 3.09Å; L259-S262 PolarHBondContact O-OG 2.72Å
260	A	53.1	Low	55	Low	78 Å²	78	121.9 Å²	121.9	65%	0.645	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71	-10.1	173	0	0	0	0	0	114.3	H256 F258	H256-A260 WeakPolarHBondContact O-CB 3.47Å; H256-A260 PolarHBondContact O-N 3.48Å; F258-A260 VanDerWaalsContact C-N 3.31Å; F258-A260 PolarHBondContact O-N 2.64Å
261	R	54.2	Low	53.1	Low	208 Å²	208	120.8 Å²	120.8	79%	0.785	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.4	-23.1	177.6	-77.5	177.7	164.2	-178.6	-5	113.8	S257 F258 L259 K263	S257-R261 WeakPolarHBondContact O-CG 3.47Å; F258-R261 CarbonylContact O-C 3.55Å; F258-R261 WeakPolarHBondContact O-CA 2.93Å; F258-R261 PolarHBondContact O-N 2.82Å; L259-R261 PolarHBondContact O-N 3.09Å; R261-K263 PolarHBondContact O-N 3.18Å
262	S	49.5	Very low	51.2	Low	66 Å²	66	118.4 Å²	118.4	46%	0.462	70%	0.699	S	S	.	*	T	Hydrogen-bonded Turn	trans	-78.4	14.9	-170.8	65.9	0	0	0	0	115.5	F258 L259 S264	F258-S262 WeakPolarHBondContact O-CB 3.35Å; F258-S262 PolarHBondContact O-N 3.06Å; F258-S262 PolarHBondContact O-OG 3.02Å; L259-S262 PolarHBondContact O-OG 2.72Å; S262-S264 VanDerWaalsContact C-N 3.34Å
263	K	52.1	Low	49.6	Very low	202 Å²	202	118.3 Å²	118.3	88%	0.878	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.5	11.2	171.3	-80.8	-159.1	170.8	-169.2	0	114	R261	R261-K263 PolarHBondContact O-N 3.18Å
264	S	46.7	Very low	48.5	Very low	106 Å²	106	122 Å²	122	74%	0.741	72%	0.719	S	S	*	*	S	Bend	trans	-137.4	29.7	-170.6	-53.5	0	0	0	0	115.4	S262	S262-S264 VanDerWaalsContact C-N 3.34Å
265	T	44.6	Very low	47.8	Very low	129 Å²	129	122.7 Å²	122.7	79%	0.791	72%	0.723	S	S	*	*			trans	-141.7	70.1	173.3	55.8	0	0	0	0	111.7
266	A	42	Very low	46.4	Very low	106 Å²	106	126.9 Å²	126.9	88%	0.876	74%	0.741	S	S	*	*			trans	-145.4	41.9	-179.5	0	0	0	0	0	113.1
267	A	45.2	Very low	45.6	Very low	85 Å²	85	125.1 Å²	125.1	70%	0.702	75%	0.745	S	S	*	*			trans	-156.2	149.5	169.3	0	0	0	0	0	109.6
268	L	42.9	Very low	45.7	Very low	177 Å²	177	126.5 Å²	126.5	93%	0.927	75%	0.752	S	S	*	*			trans	66.1	126.7	-172.2	-43.8	177.9	0	0	0	112.9
269	S	34.3	Very low	44.4	Very low	123 Å²	123	131 Å²	131	86%	0.86	77%	0.765	S	S	*	*			cis	-136.4	151.1	2	-167	0	0	0	0	110.5
270	G	34.4	Very low	43.2	Very low	71 Å²	71	131.4 Å²	131.4	73%	0.732	78%	0.777	S	S	*	*			trans	-143.9	118	171.7	0	0	0	0	0	110
271	E	37.4	Very low	42.2	Very low	169 Å²	169	132 Å²	132	79%	0.79	78%	0.783	S	S	*	*			trans	-161.5	105.7	163.5	-176.2	49.8	-111	0	0	108.8
272	A	34.5	Very low	41.3	Very low	86 Å²	86	127 Å²	127	71%	0.711	78%	0.779	S	S	*	*			trans	178.3	89.6	165.1	0	0	0	0	0	110.4
273	V	41.3	Very low	40.5	Very low	130 Å²	130	129.9 Å²	129.9	79%	0.788	80%	0.798	S	S	*	*			trans	10.2	118.3	154.6	-173.2	0	0	0	0	118
274	I	45.8	Very low	40.1	Very low	161 Å²	161	125.5 Å²	125.5	83%	0.826	79%	0.793	S	S	*	*			trans	-115	126.6	157.4	-62.1	177.2	0	0	0	108.4
275	P	49.4	Very low	40.3	Very low	111 Å²	111	126.2 Å²	126.2	72%	0.721	80%	0.795	S	S	*	*			trans	-78.6	159.7	177.9	32	-34.9	0	0	0	113.4
276	I	38.8	Very low	40.2	Very low	166 Å²	166	126.8 Å²	126.8	85%	0.851	79%	0.792	S	S	*	*			trans	-68.9	132.2	-173.8	-63	154.7	0	0	0	112.7
277	C	36.4	Very low	39.8	Very low	123 Å²	123	128.9 Å²	128.9	83%	0.831	79%	0.786	S	S	*	*			trans	-162.6	140.8	134.7	-142.4	0	0	0	0	112.3
278	P	57	Low	39.5	Very low	102 Å²	102	132.7 Å²	132.7	66%	0.662	79%	0.792	S	S	*	*			trans	-112.6	154.6	-174.8	39.6	-32.6	0	0	0	115.4
279	R	31.3	Very low	40.2	Very low	241 Å²	241	129.7 Å²	129.7	91%	0.909	78%	0.783	S	S	*	*			trans	-169.3	145.3	143.6	-110.6	166.7	175.9	101.4	-4.6	113.3
280	S	37.2	Very low	40	Very low	119 Å²	119	133 Å²	133	83%	0.832	78%	0.778	S	S	*	*			trans	5.3	142.5	148.4	-50.8	0	0	0	0	119.3
281	A	32.1	Very low	40.4	Very low	92 Å²	92	137.6 Å²	137.6	76%	0.76	78%	0.778	S	S	*	*			cis	-170.3	-177.6	0.7	0	0	0	0	0	108
282	S	34.1	Very low	40.1	Very low	102 Å²	102	133 Å²	133	71%	0.713	77%	0.769	S	S	*	*			cis	-165.7	163.5	-3.2	19.5	0	0	0	0	110
283	C	32.8	Very low	39.9	Very low	126 Å²	126	133.8 Å²	133.8	85%	0.851	78%	0.775	S	S	*	*			trans	46.7	120	153.1	-61.2	0	0	0	0	121.9
284	S	44.3	Very low	39.5	Very low	110 Å²	110	136.6 Å²	136.6	77%	0.769	78%	0.779	S	S	*	*			trans	-91.8	162.1	152.8	-43.8	0	0	0	0	111.4
285	P	50.7	Low	38.8	Very low	122 Å²	122	133.7 Å²	133.7	79%	0.792	77%	0.773	S	S	*	*			trans	-139.1	171.7	142.7	31.5	-14.7	0	0	0	114
286	I	41.9	Very low	38.1	Very low	140 Å²	140	138.5 Å²	138.5	72%	0.718	78%	0.777	S	S	*	*			cis	-176	147.1	-46.6	-111.9	165.5	0	0	0	108.9
287	I	34.3	Very low	37.7	Very low	150 Å²	150	137.4 Å²	137.4	77%	0.769	77%	0.773	S	S	*	*			trans	64.5	143.4	167.1	-76.8	163	0	0	0	117.2
288	M	38.6	Very low	37.4	Very low	165 Å²	165	136.1 Å²	136.1	81%	0.813	77%	0.765	S	S	*	*			cis	116.3	150.9	8.5	-70.6	-74.9	100.5	0	0	115.2
289	P	57.4	Low	36.1	Very low	114 Å²	114	139 Å²	139	74%	0.74	77%	0.772	S	S	*	*			trans	-111.7	169.2	-151.4	42.2	-36.5	0	0	0	117.1
290	Y	30.6	Very low	36	Very low	192 Å²	192	134 Å²	134	75%	0.753	76%	0.763	S	S	*	*			trans	-158.5	148.3	173.2	-158.9	-145.5	0	0	0	108.5	A292	Y290-A292 HydrophobicContact CD2-CB 3.93Å; Y290-A292 HydrophobicContact CE2-CB 3.65Å
291	K	42.6	Very low	36	Very low	168 Å²	168	139.3 Å²	139.3	73%	0.73	77%	0.765	S	S	*	*			cis	-128.6	161.3	11.3	-33.8	-159	173.9	-176.2	0	109.6
292	A	31.3	Very low	36.5	Very low	74 Å²	74	140 Å²	140	61%	0.612	76%	0.762	S	S	*	*			cis	84.4	97	19.6	0	0	0	0	0	117.1	Y290	Y290-A292 HydrophobicContact CD2-CB 3.93Å; Y290-A292 HydrophobicContact CE2-CB 3.65Å
293	A	29.6	Very low	37.2	Very low	101 Å²	101	144.7 Å²	144.7	84%	0.835	77%	0.769	S	S	*	*			trans	-154.5	144.3	152	0	0	0	0	0	109.3
294	H	33.4	Very low	37.3	Very low	189 Å²	189	146 Å²	146	88%	0.875	77%	0.767	S	S	*	*			trans	-129	179	-177.7	-80.4	60.7	0	0	0	110.4
295	S	31.6	Very low	36.6	Very low	100 Å²	100	149.9 Å²	149.9	70%	0.699	77%	0.77	S	S	*	*			trans	112	127.7	172.6	-178	0	0	0	0	112.4
296	R	33.3	Very low	35.6	Very low	212 Å²	212	150.4 Å²	150.4	80%	0.8	77%	0.771	S	S	*	*			cis	-149.2	143	3.1	-108.1	158.2	-161.5	-132.5	1.3	107.9
297	N	31.7	Very low	35.3	Very low	144 Å²	144	149.6 Å²	149.6	77%	0.77	77%	0.773	S	S	*	*				58.2	141.5	90.5	-58.5	17.4	0	0	0	114.3
298	S	29.2	Very low	35.9	Very low	95 Å²	95	148.1 Å²	148.1	66%	0.664	77%	0.773	S	S	*	*			cis	-176.5	179.2	-8.2	44.9	0	0	0	0	110.3
299	M	30.4	Very low	36.1	Very low	162 Å²	162	146 Å²	146	80%	0.798	77%	0.772	S	S	*	*			trans	77.2	140.3	167.3	-54.3	-178.3	79.8	0	0	116.6
300	D	29.7	Very low	34.8	Very low	138 Å²	138	149.6 Å²	149.6	74%	0.738	78%	0.779	S	S	*	*			cis	-152.2	175.3	-15.1	-131.1	-40.6	0	0	0	114.2
301	R	35.8	Very low	35.1	Very low	229 Å²	229	143.6 Å²	143.6	86%	0.864	78%	0.775	S	S	*	*			trans	-101.3	-180	173.9	-118.5	-172	170.6	-166.7	-1.2	110.4
302	P	43.3	Very low	34.8	Very low	106 Å²	106	141 Å²	141	69%	0.688	78%	0.778	S	S	*	*			cis	-131.3	-174.5	-9.9	38.3	-19.4	0	0	0	115.1
303	K	49.2	Very low	34.9	Very low	202 Å²	202	142.1 Å²	142.1	88%	0.878	78%	0.781	S	S	*	*			trans	-90	138.5	168.4	-68	-177.4	177.5	-176.9	0	112.4
304	L	33.8	Very low	35.1	Very low	152 Å²	152	147.2 Å²	147.2	80%	0.796	78%	0.779	S	S	*	*			trans	-155.4	165.4	161.3	-69.2	179.2	0	0	0	108.7
305	F	31	Very low	35.2	Very low	192 Å²	192	147.7 Å²	147.7	84%	0.842	77%	0.773	S	S	*	*				-162.5	-176.3	-56.3	-130.6	-24.5	0	0	0	109.5
306	V	29.2	Very low	35.7	Very low	133 Å²	133	153.5 Å²	153.5	81%	0.806	78%	0.78	S	S	*	*			trans	73.8	149.5	169.6	-174	0	0	0	0	117.7
307	T	36	Very low	35.8	Very low	124 Å²	124	150.2 Å²	150.2	76%	0.761	78%	0.777	S	S	*	*			trans	-130.7	176.6	-179.8	43.8	0	0	0	0	110.3
308	P	45.4	Very low	36.2	Very low	119 Å²	119	149.5 Å²	149.5	77%	0.773	77%	0.771	S	S	*	*			cis	-105.8	-106	-2.2	23.6	0.5	0	0	0	112.3
309	P	43.4	Very low	36.4	Very low	121 Å²	121	153.6 Å²	153.6	79%	0.786	78%	0.779	S	S	*	*			cis	-100.1	-159	3.1	42.9	-36.7	0	0	0	114.2
310	E	30	Very low	36.7	Very low	189 Å²	189	149.2 Å²	149.2	88%	0.883	78%	0.776	S	S	*	*			trans	-141.2	168.3	-178.9	-177.6	57.2	-118.9	0	0	110.9
311	G	36.3	Very low	37.1	Very low	66 Å²	66	149.2 Å²	149.2	68%	0.68	78%	0.781	S	S	*	*			trans	-59.3	175.7	-166.5	0	0	0	0	0	121.4
312	S	37.8	Very low	36.9	Very low	113 Å²	113	142.9 Å²	142.9	79%	0.79	78%	0.778	S	S	*	*			trans	-94.2	141.3	177.6	-179.4	0	0	0	0	113
313	S	33.9	Very low	36.4	Very low	97 Å²	97	143 Å²	143	68%	0.678	78%	0.781	S	S	*	*			trans	70.3	99.6	153.5	-62.6	0	0	0	0	121.6
314	R	32.6	Very low	35.6	Very low	209 Å²	209	142.7 Å²	142.7	79%	0.789	78%	0.776	S	S	*	*				68.7	109.7	125.9	-68.1	-173	171.8	-141.2	-0.6	122
315	R	36.8	Very low	35.5	Very low	198 Å²	198	144 Å²	144	75%	0.747	78%	0.775	S	S	*	*				85.8	123.8	120.1	-73	-173.6	179	-133.4	-0.9	121.9
316	R	41.8	Very low	35.8	Very low	222 Å²	222	144.1 Å²	144.1	84%	0.838	78%	0.775	S	S	*	*			trans	77.4	147.1	154.9	-61.6	-173.1	-56.5	175.5	4.4	116.2
317	I	33.8	Very low	35.7	Very low	144 Å²	144	145.4 Å²	145.4	74%	0.738	77%	0.773	S	S	*	*			cis	-151.7	163.3	-7	-119	166.9	0	0	0	110.9
318	I	41.8	Very low	35.4	Very low	129 Å²	129	147.7 Å²	147.7	66%	0.662	77%	0.767	S	S	*	*			trans	-59.4	164.1	-179.7	55.4	171.6	0	0	0	114.2
319	H	33	Very low	34.8	Very low	180 Å²	180	147 Å²	147	83%	0.833	75%	0.754	S	S	*	*			cis	-134	-168.8	42.2	-64.6	-101.9	0	0	0	112.6
320	G	35.8	Very low	34.3	Very low	70 Å²	70	147.5 Å²	147.5	72%	0.722	74%	0.74	S	S	*	*			cis	-166.7	-135.4	12.8	0	0	0	0	0	115.6
321	T	37.5	Very low	34.7	Very low	139 Å²	139	139.5 Å²	139.5	85%	0.853	70%	0.702	S	S	*	*			trans	-136.6	146.9	-160.9	49.8	0	0	0	0	116.5
322	A	32.7	Very low	34.6	Very low	95 Å²	95	138.2 Å²	138.2	79%	0.785	68%	0.68	S	S	*	*			trans	56.4	160.9	146	0	0	0	0	0	119.9
323	S	32.8	Very low	34.6	Very low	110 Å²	110	136.7 Å²	136.7	77%	0.769	67%	0.666	S	S	*	*			cis	-150.1	-169.6	2.8	-8.5	0	0	0	0	112
324	Y	31.7	Very low	34.9	Very low	194 Å²	194	138.4 Å²	138.4	76%	0.761	67%	0.667	S	S	*	*			trans	-104.7	178.1	-165.2	52.9	-94	0	0	0	115.9
325	K	31.8	Very low	35	Very low	179 Å²	179	136.4 Å²	136.4	78%	0.778	66%	0.664	S	S	*	*			trans	112.5	118	174.6	-65.8	-62.2	178.4	160.4	0	110.8
326	K	37.5	Very low	34.9	Very low	195 Å²	195	133.6 Å²	133.6	85%	0.848	66%	0.663	S	S	*	*			cis	97.7	83.6	19.7	-162.5	-147.7	171	-179.8	0	116.4
327	E	26.5	Very low	34.4	Very low	161 Å²	161	129.2 Å²	129.2	75%	0.752	66%	0.661	S	S	*	*			trans	-163.1	160.7	137.9	-111.4	-171.1	117.2	0	0	106.7
328	R	31.1	Very low	34.3	Very low	171 Å²	171	127.9 Å²	127.9	65%	0.645	66%	0.664	S	S	*	*			cis	-150.7	164.5	1.5	-147.7	178.7	-162.2	-113.7	-3.5	108.5
329	E	31.7	Very low	33.7	Very low	105 Å²	105	124.8 Å²	124.8	49%	0.491	66%	0.664	S	S	.	*			trans	36.5	121.2	139.8	-102.7	170.6	-165.1	0	0	120.8
330	R	33.3	Very low	33.7	Very low	131 Å²	131	123.6 Å²	123.6	49%	0.494	67%	0.67	S	S	.	*				149.9	111.2	105.7	-86	140.7	172.1	-170	-28.6	119.8	R548 E551	R330-R548 VanDerWaalsContact CB-NH2 3.25Å; R330-R548 PolarHBondContact O-NE 3.27Å; R330-R548 PolarHBondContact O-NH2 3.1Å; R330-E551 WeakPolarHBondContact CD-OE1 3.38Å; R330-E551 WeakPolarHBondContact CD-OE2 3.4Å; R330-E551 VanDerWaalsContact CG-OE2 3.28Å; R330-E551 WeakPolarHBondContact CG-OE2 3.17Å; R330-E551 IonicContact CZ-OE1 2.68Å; R330-E551 IonicContact CZ-OE2 2.71Å; R330-E551 IonicContact NE-OE1 3.31Å; R330-E551 PolarHBondContact NE-OE1 2.81Å; R330-E551 IonicContact NE-OE2 2.66Å; R330-E551 PolarHBondContact NE-OE2 2.87Å; R330-E551 VanDerWaalsContact NE-OE2 3.09Å; R330-E551 IonicContact NH2-OE1 3.16Å; R330-E551 PolarHBondContact NH2-OE1 3.27Å; R330-E551 IonicContact NH2-OE2 2.89Å
331	E	38.5	Very low	33.6	Very low	21 Å²	21	129.5 Å²	129.5	10%	0.098	67%	0.67	C	S	.	*				50.4	144.7	125.6	36.7	-179.5	83.9	0	0	123.9	E544 Q547 R548 E551	E331-E544 CarbonylContact C-O 3.45Å; E331-E544 WeakPolarHBondContact CA-O 3.14Å; E331-E544 HydrophobicContact CB-CG 4.47Å; E331-E544 WeakPolarHBondContact CB-O 3.47Å; E331-Q547 HydrophobicContact CB-CB 4.28Å; E331-Q547 HydrophobicContact CG-CB 4.43Å; E331-Q547 WeakPolarHBondContact OE1-CB 3.3Å; E331-Q547 WeakPolarHBondContact OE1-CG 3.32Å; E331-Q547 PolarHBondContact OE1-NE2 2.85Å; E331-R548 HydrophobicContact CB-CG 3.85Å; E331-R548 HydrophobicContact CG-CG 3.78Å; E331-R548 WeakPolarHBondContact O-CG 3.23Å; E331-R548 PolarHBondContact O-NE 2.94Å; E331-R548 VanDerWaalsContact OE2-CA 3.26Å; E331-R548 WeakPolarHBondContact OE2-CA 3.39Å; E331-R548 PolarHBondContact OE2-N 3.33Å; E331-E551 WeakPolarHBondContact OE2-CG 3.45Å
332	N	33.5	Very low	33.2	Very low	40 Å²	40	133.3 Å²	133.3	21%	0.214	67%	0.669	C	S	.	*			trans	58.8	160.1	165.4	-75.4	61.3	0	0	0	122.1	E544 L545 A546 Q547 R548 V549	N332-E544 PolarHBondContact N-O 3.23Å; N332-E544 PolarHBondContact OD1-O 3.45Å; N332-L545 PolarHBondContact ND2-O 3.01Å; N332-L545 WeakPolarHBondContact OD1-CA 3.42Å; N332-L545 PolarHBondContact OD1-O 3.33Å; N332-A546 PolarHBondContact OD1-N 2.78Å; N332-Q547 PolarHBondContact OD1-N 3.35Å; N332-R548 HydrophobicContact CB-CB 3.53Å; N332-R548 HydrophobicContact CB-CG 3.6Å; N332-R548 PolarHBondContact OD1-N 2.89Å; N332-V549 WeakPolarHBondContact ND2-CG2 3.35Å; N332-V549 PolarHBondContact ND2-N 3.49Å
333	V	38.8	Very low	33	Very low	80 Å²	80	132.7 Å²	132.7	49%	0.485	66%	0.664	S	S	.	*			cis	-160.7	117.7	-24	132.6	0	0	0	0	111	L545	V333-L545 HydrophobicContact CG2-CB 3.6Å; V333-L545 HydrophobicContact CG2-CD1 3.72Å; V333-L545 HydrophobicContact CG2-CD2 4.17Å; V333-L545 HydrophobicContact CG2-CG 3.97Å; V333-L545 WeakPolarHBondContact CG2-O 3.28Å
334	L	39.9	Very low	33	Very low	133 Å²	133	134.3 Å²	134.3	70%	0.696	67%	0.669	S	S	*	*			trans	56.2	-169.1	160	-51.3	178.1	0	0	0	117.6	L545	L334-L545 HydrophobicContact CD2-CD1 3.83Å; L334-L545 HydrophobicContact CG-CD1 4.07Å
335	F	34.8	Very low	33	Very low	168 Å²	168	130.5 Å²	130.5	74%	0.737	67%	0.671	S	S	*	*			cis	-162.1	168.7	1.9	-153	18	0	0	0	114.6
336	L	35.1	Very low	33.7	Very low	138 Å²	138	128.1 Å²	128.1	72%	0.723	67%	0.673	S	S	*	*			trans	68.8	159.5	163	-61.8	175.8	0	0	0	119.6
337	T	30.8	Very low	33.3	Very low	131 Å²	131	124.1 Å²	124.1	80%	0.804	67%	0.67	S	S	*	*			cis	-121.3	-150.5	10.2	51.4	0	0	0	0	111.4
338	S	32.1	Very low	33.7	Very low	115 Å²	115	123.9 Å²	123.9	80%	0.804	67%	0.674	S	S	*	*			cis	-159.6	-176.3	1.5	64.1	0	0	0	0	109.1
339	G	29.7	Very low	34.2	Very low	64 Å²	64	121.8 Å²	121.8	66%	0.66	68%	0.683	S	S	*	*			cis	173.1	-10.4	-3.6	0	0	0	0	0	119.9
340	T	31.6	Very low	34.2	Very low	155 Å²	155	127 Å²	127	95%	0.951	70%	0.703	S	S	*	*			trans	-73.2	154.3	-171.6	-41.2	0	0	0	0	114.8
341	R	33.3	Very low	34.1	Very low	194 Å²	194	125.4 Å²	125.4	73%	0.732	72%	0.718	S	S	*	*			trans	-115.9	153.7	-156	-49.3	-177.9	-170.5	-111	11.7	117.8
342	R	30	Very low	33.6	Very low	220 Å²	220	135.5 Å²	135.5	83%	0.83	76%	0.756	S	S	*	*			trans	71.9	151	144.3	-91.9	-170.7	-68.1	-135.1	8.6	117.8
343	A	29.6	Very low	33.6	Very low	82 Å²	82	141.3 Å²	141.3	68%	0.678	78%	0.782	S	S	*	*			cis	-154.7	-168.5	3.7	0	0	0	0	0	112.8
344	V	32.7	Very low	33.7	Very low	143 Å²	143	143.6 Å²	143.6	87%	0.867	80%	0.798	S	S	*	*			trans	88.9	127.1	164.7	-168.8	0	0	0	0	117.1
345	S	31.4	Very low	33.3	Very low	114 Å²	114	140.8 Å²	140.8	80%	0.797	79%	0.794	S	S	*	*			trans	-108.2	150.2	177.1	-44.4	0	0	0	0	111.4
346	P	45	Very low	33.1	Very low	129 Å²	129	145 Å²	145	84%	0.838	81%	0.805	S	S	*	*			trans	-113.5	158.9	156.1	35.6	-27	0	0	0	113.4
347	S	29.7	Very low	32.7	Very low	111 Å²	111	143.9 Å²	143.9	78%	0.776	81%	0.809	S	S	*	*			trans	-78.5	167.2	-167.2	50.8	0	0	0	0	116.8
348	N	35.5	Very low	33.2	Very low	156 Å²	156	148.4 Å²	148.4	83%	0.834	81%	0.812	S	S	*	*			trans	-49.4	149.3	166.2	-54.2	-64.7	0	0	0	113.8
349	P	41.2	Very low	33.4	Very low	127 Å²	127	149.3 Å²	149.3	83%	0.825	81%	0.807	S	S	*	*			trans	-112	110.4	145.7	33.3	-25	0	0	0	111.1
350	K	31.8	Very low	33.6	Very low	214 Å²	214	157.9 Å²	157.9	93%	0.93	82%	0.819	S	S	*	*			trans	-96.3	95.1	168.1	-172.2	160.3	-176.3	170.8	0	109.4
351	A	31.8	Very low	34.1	Very low	98 Å²	98	156.2 Å²	156.2	81%	0.81	80%	0.804	S	S	*	*			trans	-108.7	157	178.6	0	0	0	0	0	112.1
352	R	28.1	Very low	34.6	Very low	233 Å²	233	152.8 Å²	152.8	88%	0.879	81%	0.807	S	S	*	*			trans	-134.5	99.4	-157.7	177	-171.2	172.2	178.9	-2.1	112.9
353	Q	33.8	Very low	34.8	Very low	163 Å²	163	146.3 Å²	146.3	76%	0.762	80%	0.795	S	S	*	*			trans	63.8	168.2	166.3	-52.1	-63.9	-27.7	0	0	113.2
354	P	39.8	Very low	35.1	Very low	127 Å²	127	151.9 Å²	151.9	83%	0.825	80%	0.804	S	S	*	*			cis	-115.2	171.3	49.5	40.2	-33.6	0	0	0	115
355	A	30.6	Very low	35.1	Very low	75 Å²	75	150.6 Å²	150.6	62%	0.62	80%	0.802	S	S	*	*			trans	-127.3	161	171.5	0	0	0	0	0	111.1
356	R	30.7	Very low	35.3	Very low	255 Å²	255	152.3 Å²	152.3	96%	0.962	80%	0.801	S	S	*	*			trans	75.4	141.6	-176.1	-49	177.8	-179.3	-164.9	-0.7	111.8
357	S	27.4	Very low	35.6	Very low	116 Å²	116	151.7 Å²	151.7	81%	0.811	80%	0.797	S	S	*	*			cis	-126.1	170	37.5	56.4	0	0	0	0	116.3
358	R	41	Very low	35.6	Very low	226 Å²	226	154.2 Å²	154.2	85%	0.853	80%	0.796	S	S	*	*			trans	-113.8	168.9	154.8	-51.5	-177.2	-160.3	-104.4	9.2	107.7
359	L	36.6	Very low	35.7	Very low	134 Å²	134	153.8 Å²	153.8	70%	0.702	79%	0.793	S	S	*	*				150.5	131.5	124.9	-81.1	168.4	0	0	0	110.7	L361	L359-L361 HydrophobicContact CD2-CD1 4.07Å
360	W	34.6	Very low	35.4	Very low	243 Å²	243	153.9 Å²	153.9	92%	0.92	79%	0.794	S	S	*	*				-170.2	167	103.5	-110.2	74.5	0	0	0	111.4
361	L	40.9	Very low	35.3	Very low	120 Å²	120	146.8 Å²	146.8	63%	0.628	78%	0.782	S	S	*	*			trans	-117.6	178.7	-171.1	-66.8	75.1	0	0	0	111	L359	L359-L361 HydrophobicContact CD2-CD1 4.07Å
362	P	44.9	Very low	35.5	Very low	122 Å²	122	149 Å²	149	79%	0.792	79%	0.785	S	S	*	*				-128.2	139	90.1	5.5	17.3	0	0	0	113.1
363	S	33.1	Very low	35.8	Very low	85 Å²	85	144.2 Å²	144.2	59%	0.594	78%	0.784	S	S	*	*				70.9	139.7	76.8	-67.3	0	0	0	0	114.6
364	K	37.3	Very low	35.7	Very low	198 Å²	198	147.9 Å²	147.9	86%	0.861	79%	0.791	S	S	*	*			cis	-158.2	169.8	-6.7	-101	163.2	-171.7	178.9	0	106
365	S	31.5	Very low	35.7	Very low	117 Å²	117	146.5 Å²	146.5	82%	0.818	78%	0.782	S	S	*	*			cis	-151.7	-176.4	33.1	53.5	0	0	0	0	112.8
366	L	36.7	Very low	35.6	Very low	150 Å²	150	149.4 Å²	149.4	79%	0.785	79%	0.793	S	S	*	*			trans	-138.7	147.4	-179.8	-165.1	81	0	0	0	110.4
367	P	50.9	Low	35.6	Very low	115 Å²	115	142.2 Å²	142.2	75%	0.747	78%	0.781	S	S	*	*				-140.1	159.8	119	35.8	-23.3	0	0	0	112.4
368	H	30.2	Very low	35.7	Very low	164 Å²	164	142.1 Å²	142.1	76%	0.759	78%	0.78	S	S	*	*			cis	-157.9	-173.4	-22.3	-154.9	-98.9	0	0	0	108.4
369	L	37.1	Very low	35.6	Very low	148 Å²	148	139.2 Å²	139.2	78%	0.775	78%	0.781	S	S	*	*			trans	-134.3	147.4	165.4	-74	175.4	0	0	0	111.8
370	P	34.2	Very low	36.2	Very low	129 Å²	129	138.3 Å²	138.3	84%	0.838	78%	0.783	S	S	*	*				-132.1	176.9	116.2	38.6	-30	0	0	0	111.1
371	G	29.4	Very low	36.8	Very low	65 Å²	65	132.7 Å²	132.7	67%	0.67	78%	0.778	S	S	*	*			cis	151.1	103.8	-4.9	0	0	0	0	0	112.2
372	T	37.6	Very low	36.2	Very low	143 Å²	143	130.1 Å²	130.1	88%	0.877	78%	0.781	S	S	*	*			trans	36.8	115.3	160.9	54.1	0	0	0	0	121.1
373	P	33.2	Very low	35.6	Very low	134 Å²	134	129.6 Å²	129.6	87%	0.87	78%	0.78	S	S	*	*			trans	-104.3	136.7	172.1	36.6	-30.6	0	0	0	115.4
374	R	31.9	Very low	35.5	Very low	239 Å²	239	132 Å²	132	90%	0.902	79%	0.791	S	S	*	*			trans	-176.4	144.3	161.5	-177.8	-171.7	-81.9	-126.6	4.9	109
375	P	40.5	Very low	35.2	Very low	99 Å²	99	131.8 Å²	131.8	64%	0.643	79%	0.79	S	S	*	*			cis	-126	-170.4	-31.7	37.2	-18.5	0	0	0	112.7
376	T	28.8	Very low	35.2	Very low	136 Å²	136	131 Å²	131	83%	0.834	79%	0.79	S	S	*	*			trans	70.2	153.7	174.9	85.7	0	0	0	0	114.5
377	S	29.4	Very low	35	Very low	104 Å²	104	128.2 Å²	128.2	73%	0.727	79%	0.788	S	S	*	*			cis	-151.5	174.7	-6.7	-156.3	0	0	0	0	111.2
378	S	30	Very low	34.6	Very low	113 Å²	113	128.7 Å²	128.7	79%	0.79	79%	0.792	S	S	*	*			trans	66.4	155.4	164.1	37.8	0	0	0	0	120.2
379	L	38.8	Very low	34.8	Very low	165 Å²	165	125.5 Å²	125.5	86%	0.864	79%	0.794	S	S	*	*			trans	-109.2	-154.5	-177.5	-67.9	160.7	0	0	0	110.1
380	P	49.9	Very low	34.6	Very low	115 Å²	115	126.7 Å²	126.7	75%	0.747	80%	0.795	S	S	*	*				-112.5	-139.2	-98.7	42.4	-24.6	0	0	0	109.1
381	P	46.7	Very low	34.6	Very low	126 Å²	126	125.4 Å²	125.4	82%	0.818	79%	0.785	S	S	*	*			cis	-114.2	-169.1	-31.3	39.8	-23.6	0	0	0	110.6
382	G	28.8	Very low	34.6	Very low	66 Å²	66	133.1 Å²	133.1	68%	0.68	79%	0.794	S	S	*	*			cis	-177.2	-157.9	6.1	0	0	0	0	0	112.3
383	S	31.9	Very low	35.5	Very low	111 Å²	111	131.6 Å²	131.6	78%	0.776	79%	0.786	S	S	*	*			trans	-12.9	143.7	168	55.3	0	0	0	0	119.5
384	V	31.8	Very low	36.7	Very low	135 Å²	135	131 Å²	131	82%	0.818	78%	0.782	S	S	*	*			cis	-154.2	148.8	23.8	-126.4	0	0	0	0	114.2
385	K	30.9	Very low	36.7	Very low	194 Å²	194	124.5 Å²	124.5	84%	0.843	77%	0.774	S	S	*	*			trans	40.8	125.5	137.2	-164.2	169.6	-175.5	176.5	0	121.6
386	A	30.9	Very low	37.1	Very low	99 Å²	99	125.9 Å²	125.9	82%	0.818	78%	0.783	S	S	*	*			trans	79.5	151.4	155.6	0	0	0	0	0	119.3
387	A	32	Very low	37.1	Very low	92 Å²	92	123 Å²	123	76%	0.76	78%	0.779	S	S	*	*			trans	-130.8	-173.4	-177	0	0	0	0	0	108.7
388	P	42.6	Very low	37.2	Very low	126 Å²	126	125.5 Å²	125.5	82%	0.818	79%	0.785	S	S	*	*				-130.8	151.4	-62.9	35.9	-23.1	0	0	0	112.9
389	A	34.1	Very low	37.6	Very low	97 Å²	97	126.1 Å²	126.1	80%	0.802	78%	0.778	S	S	*	*			trans	176.9	129.5	144.6	0	0	0	0	0	112.2
390	Q	33.1	Very low	37.7	Very low	172 Å²	172	129 Å²	129	80%	0.804	78%	0.778	S	S	*	*			trans	-108.8	119.1	163.8	-74	-79.4	-2.3	0	0	106.6
391	V	34.8	Very low	37.2	Very low	103 Å²	103	129.7 Å²	129.7	62%	0.624	78%	0.782	S	S	*	*				79.4	108.9	85.8	158.1	0	0	0	0	111.6
392	R	29.8	Very low	36.6	Very low	227 Å²	227	129.7 Å²	129.7	86%	0.857	78%	0.779	S	S	*	*				88.6	174.8	72.9	-106	-178.6	-175.6	165.2	0.2	111.6
393	P	54.8	Low	36.8	Very low	110 Å²	110	135.2 Å²	135.2	71%	0.714	79%	0.785	S	S	*	*			cis	-122.5	-162.5	-17.2	32.9	-11.1	0	0	0	111.1
394	P	58.6	Low	37	Very low	121 Å²	121	138.5 Å²	138.5	79%	0.786	78%	0.78	S	S	*	*			cis	-114.8	-118.4	-1.5	28.8	-3.3	0	0	0	113.1
395	S	33.3	Very low	37	Very low	104 Å²	104	139.2 Å²	139.2	73%	0.727	77%	0.774	S	S	*	*			cis	-156.4	170.1	6.7	-137.3	0	0	0	0	111
396	P	48.8	Very low	36.8	Very low	128 Å²	128	136.1 Å²	136.1	83%	0.831	77%	0.771	S	S	*	*			trans	-99.9	152.9	-161	37.5	-35	0	0	0	117.2
397	G	29.1	Very low	36.7	Very low	74 Å²	74	140.4 Å²	140.4	76%	0.763	77%	0.771	S	S	*	*			trans	-160.3	-3.5	-173.4	0	0	0	0	0	122.2
398	N	30.5	Very low	36.5	Very low	157 Å²	157	142 Å²	142	84%	0.84	77%	0.771	S	S	*	*			trans	70.4	157.5	159.6	-151.4	4.4	0	0	0	121.6
399	I	39.1	Very low	36	Very low	126 Å²	126	143 Å²	143	65%	0.646	77%	0.765	S	S	*	*			trans	84.9	92.7	161	-45.4	-176.5	0	0	0	121.7
400	R	39.9	Very low	36.3	Very low	227 Å²	227	143.1 Å²	143.1	86%	0.857	76%	0.758	S	S	*	*			trans	52.8	126.1	132.7	-58.7	178.1	-177.5	155.9	0.5	123.9
401	P	40.8	Very low	36.2	Very low	128 Å²	128	140.7 Å²	140.7	83%	0.831	75%	0.746	S	S	*	*			trans	-100	174	158.1	39.6	-33.2	0	0	0	113.7
402	V	33.4	Very low	35.9	Very low	126 Å²	126	142.8 Å²	142.8	76%	0.764	75%	0.747	S	S	*	*			trans	-146.2	126.4	-178.5	-174.6	0	0	0	0	113.1
403	K	32.5	Very low	35.8	Very low	183 Å²	183	140.3 Å²	140.3	80%	0.796	74%	0.743	S	S	*	*			trans	55.3	153	161	-76	-176.3	178.4	-179.3	0	119.3
404	R	36.4	Very low	34.5	Very low	179 Å²	179	142.2 Å²	142.2	68%	0.675	75%	0.747	S	S	*	*			cis	-176.7	133.3	-29.8	-122.8	-169.4	162	150.1	3.9	107.6
405	E	31.4	Very low	34	Very low	151 Å²	151	141.4 Å²	141.4	71%	0.706	74%	0.742	S	S	*	*			trans	56.6	153.6	146.7	-62.5	146.6	-159	0	0	117.8
406	V	27.5	Very low	33.7	Very low	129 Å²	129	143.5 Å²	143.5	78%	0.782	74%	0.74	S	S	*	*			cis	-148.5	139	29.7	171.3	0	0	0	0	110.6
407	K	28.9	Very low	32.7	Very low	188 Å²	188	145.4 Å²	145.4	82%	0.817	74%	0.735	S	S	*	*			trans	17.8	149.6	134.4	-110.8	178.6	174.3	-173.8	0	120.2
408	V	28.1	Very low	32.7	Very low	125 Å²	125	150 Å²	150	76%	0.758	74%	0.737	S	S	*	*			cis	-148.3	158.4	20.4	-161.3	0	0	0	0	112.3
409	E	30.7	Very low	33.6	Very low	147 Å²	147	146.5 Å²	146.5	69%	0.687	72%	0.723	S	S	*	*			trans	-59	-175.9	158.4	-99.8	-109.1	107.8	0	0	115
410	P	42.2	Very low	33.1	Very low	100 Å²	100	147.4 Å²	147.4	65%	0.649	72%	0.724	S	S	*	*			cis	-138.8	165.5	10.6	42	-24.1	0	0	0	119.7
411	E	30	Very low	32.7	Very low	121 Å²	121	144.7 Å²	144.7	57%	0.565	72%	0.719	S	S	*	*			trans	44.1	167.4	135.6	-62	-168.2	103.8	0	0	123.3
412	K	29.5	Very low	32.1	Very low	148 Å²	148	144.5 Å²	144.5	64%	0.643	72%	0.715	S	S	*	*			cis	-158.1	138.4	11.7	-139	149.1	-174.9	140.1	0	114.4
413	K	27.2	Very low	31.9	Very low	174 Å²	174	142.3 Å²	142.3	76%	0.757	71%	0.71	S	S	*	*			trans	30.1	134.1	145.4	-61.4	-176.8	176.3	-178.4	0	125.5
414	D	26.7	Very low	31.5	Very low	150 Å²	150	141.3 Å²	141.3	80%	0.802	71%	0.713	S	S	*	*				-4.2	165.6	119.4	-56.9	-82.6	0	0	0	119.9
415	P	47.5	Very low	31.2	Very low	105 Å²	105	140.2 Å²	140.2	68%	0.682	72%	0.716	S	S	*	*			cis	-153.6	-176.6	32.9	45.7	-23.7	0	0	0	120.5
416	E	27.4	Very low	31.9	Very low	147 Å²	147	138.4 Å²	138.4	69%	0.687	72%	0.717	S	S	*	*			trans	17.1	161.4	137.9	-54.8	-173.2	124.6	0	0	122.6
417	K	29.2	Very low	31.9	Very low	168 Å²	168	136.5 Å²	136.5	73%	0.73	71%	0.709	S	S	*	*			cis	-163.1	176.8	20.1	-139.1	151	-165	151.1	0	115.6
418	E	29.2	Very low	32.3	Very low	170 Å²	170	134.7 Å²	134.7	79%	0.794	71%	0.708	S	S	*	*			trans	-72.6	-170.8	167.9	-128.2	-170	-159.7	0	0	113
419	P	47.4	Very low	32.2	Very low	84 Å²	84	138.6 Å²	138.6	55%	0.545	72%	0.715	S	S	.	*			cis	-147.3	179.9	-7.8	40.9	-20.2	0	0	0	120.1
420	Q	30	Very low	32.1	Very low	145 Å²	145	135 Å²	135	68%	0.678	72%	0.717	S	S	*	*			trans	70.2	175.9	149.3	-79.2	161.3	68.7	0	0	117.4
421	K	30.7	Very low	31.4	Very low	171 Å²	171	142.4 Å²	142.4	74%	0.743	73%	0.732	S	S	*	*			cis	-165.7	176.9	3.3	-128.9	165	-178.3	149.2	0	108.9
422	V	29.1	Very low	31	Very low	124 Å²	124	140.6 Å²	140.6	75%	0.752	74%	0.737	S	S	*	*			cis	-153.5	170.1	-6.2	-145	0	0	0	0	109.7
423	A	28.5	Very low	31.6	Very low	80 Å²	80	139 Å²	139	66%	0.661	74%	0.743	S	S	*	*			trans	72	149.9	145.1	0	0	0	0	0	121.2
424	N	24.9	Very low	31.6	Very low	162 Å²	162	138 Å²	138	87%	0.866	74%	0.744	S	S	*	*			cis	-148.3	156.6	5	-120.2	-20.6	0	0	0	113.2
425	E	29	Very low	31.5	Very low	155 Å²	155	136 Å²	136	72%	0.724	74%	0.738	S	S	*	*			trans	-104.6	-178.3	161.1	-155.5	-157.3	-114	0	0	108.8	S427	E425-S427 PolarHBondContact OE2-N 2.87Å
426	P	45.6	Very low	30.5	Very low	114 Å²	114	140.3 Å²	140.3	74%	0.74	75%	0.746	S	S	*	*				-161.8	146.1	83.3	42.2	-20.2	0	0	0	119.9
427	S	28.7	Very low	30.4	Very low	88 Å²	88	137.8 Å²	137.8	62%	0.615	74%	0.74	S	S	*	*				65.1	166.3	120.4	-168.9	0	0	0	0	122.9	E425	E425-S427 PolarHBondContact OE2-N 2.87Å
428	L	36.1	Very low	30.3	Very low	150 Å²	150	137.8 Å²	137.8	79%	0.785	74%	0.743	S	S	*	*			cis	-172.2	162.5	-40.4	-86.6	-178.5	0	0	0	108.3
429	K	26.7	Very low	30.2	Very low	207 Å²	207	138.1 Å²	138.1	90%	0.9	74%	0.744	S	S	*	*			trans	146.6	149.4	143.2	-81.8	157.9	-175.4	170	0	112.3
430	G	28.4	Very low	29.2	Very low	71 Å²	71	137.9 Å²	137.9	73%	0.732	75%	0.75	S	S	*	*			cis	120.8	111.7	-14.2	0	0	0	0	0	116.7
431	R	27	Very low	28.8	Very low	257 Å²	257	137 Å²	137	97%	0.97	76%	0.755	S	S	*	*			trans	-167.5	162.6	158.1	-127.7	179.2	177.5	-176.4	-1.9	115
432	A	23.2	Very low	28.4	Very low	82 Å²	82	134.2 Å²	134.2	68%	0.678	75%	0.751	S	S	*	*			trans	-154.9	-160.4	176	0	0	0	0	0	108
433	P	41.3	Very low	28.3	Very low	116 Å²	116	135.1 Å²	135.1	75%	0.753	75%	0.747	S	S	*	*			cis	-112.1	-119.9	-24.6	16.6	9.6	0	0	0	111.5
434	L	26.3	Very low	28	Very low	151 Å²	151	137.3 Å²	137.3	79%	0.791	74%	0.744	S	S	*	*			cis	-171.4	178.9	-0.1	-167.9	56.6	0	0	0	111.1
435	V	25	Very low	28	Very low	110 Å²	110	139.7 Å²	139.7	67%	0.667	74%	0.741	S	S	*	*			trans	93.9	102	152.6	-176.7	0	0	0	0	121.6
436	K	26.7	Very low	28	Very low	194 Å²	194	138.5 Å²	138.5	84%	0.843	74%	0.744	S	S	*	*				57	158.3	124.3	-65.3	-164.2	168.9	-168.6	0	122.3
437	V	26.4	Very low	27.4	Very low	95 Å²	95	138.6 Å²	138.6	58%	0.576	75%	0.745	S	S	*	*			cis	-168.5	163.9	-5.1	124.4	0	0	0	0	113
438	E	26.9	Very low	27.1	Very low	167 Å²	167	138.6 Å²	138.6	78%	0.78	75%	0.75	S	S	*	*			trans	61.4	153.4	161.2	-93.1	124.2	-125.9	0	0	120.2
439	E	26.1	Very low	26.7	Very low	177 Å²	177	138.9 Å²	138.9	83%	0.827	75%	0.748	S	S	*	*			cis	-145.6	174.2	-8.4	-149.3	-178.3	147.6	0	0	111.5
440	A	26.3	Very low	27.4	Very low	80 Å²	80	134.7 Å²	134.7	66%	0.661	74%	0.742	S	S	*	*			trans	-82.4	-174	171.1	0	0	0	0	0	111.4
441	T	21.4	Very low	27.2	Very low	127 Å²	127	137.9 Å²	137.9	78%	0.779	74%	0.737	S	S	*	*			cis	-142.9	-154.9	22.3	46.6	0	0	0	0	108.9
442	V	23.1	Very low	27.2	Very low	111 Å²	111	131.6 Å²	131.6	67%	0.673	73%	0.728	S	S	*	*			cis	-160.5	160.2	4.5	80.8	0	0	0	0	109.8
443	E	26.5	Very low	27.3	Very low	144 Å²	144	130.3 Å²	130.3	67%	0.673	72%	0.722	S	S	*	*			trans	53.3	143.9	167.7	-57.4	-48.7	83.9	0	0	120.2
444	E	22	Very low	27.6	Very low	126 Å²	126	130.7 Å²	130.7	59%	0.589	73%	0.725	S	S	*	*			cis	98.1	140.5	29.3	-145.5	-159.1	78.5	0	0	115.2
445	R	24.4	Very low	27.6	Very low	211 Å²	211	128.1 Å²	128.1	80%	0.796	73%	0.725	S	S	*	*			trans	72.5	120.5	159.4	-94	174	179.3	126	-5.9	122
446	T	29.2	Very low	27.7	Very low	130 Å²	130	127.4 Å²	127.4	80%	0.798	73%	0.731	S	S	*	*			trans	-54.3	151.3	141.8	-12.9	0	0	0	0	111.1
447	P	33.4	Very low	28.5	Very low	116 Å²	116	123.9 Å²	123.9	75%	0.753	73%	0.727	S	S	*	*				-151.8	170	98.4	40	-23.3	0	0	0	117.3
448	A	23.2	Very low	28.7	Very low	89 Å²	89	123.3 Å²	123.3	74%	0.736	73%	0.733	S	S	*	*			trans	50	122	144.7	0	0	0	0	0	123.5
449	E	26.4	Very low	28.9	Very low	156 Å²	156	124.4 Å²	124.4	73%	0.729	74%	0.74	S	S	*	*				9.5	154	116.4	-110.4	-158.9	121.3	0	0	121.7	E451	E449-E451 PolarHBondContact OE1-N 2.77Å; E449-E451 VanDerWaalsContact OE1-N 3.09Å
450	P	41.3	Very low	29.1	Very low	119 Å²	119	120 Å²	120	77%	0.773	73%	0.734	S	S	*	*				-143	149.4	68	38.1	-20.4	0	0	0	119.6
451	E	24.2	Very low	30.1	Very low	137 Å²	137	122.5 Å²	122.5	64%	0.64	74%	0.743	S	S	*	*				26.7	135	124.3	-116	-72.6	101.6	0	0	122.1	E449	E449-E451 PolarHBondContact OE1-N 2.77Å; E449-E451 VanDerWaalsContact OE1-N 3.09Å
452	V	27.7	Very low	30.4	Very low	126 Å²	126	120.6 Å²	120.6	76%	0.764	74%	0.741	S	S	*	*				172	133.2	118.1	156.7	0	0	0	0	110.5
453	G	26.2	Very low	31.5	Very low	54 Å²	54	121 Å²	121	56%	0.557	75%	0.746	S	S	*	*			trans	-84.8	-141	178.2	0	0	0	0	0	115.5
454	P	46.5	Very low	31.7	Very low	125 Å²	125	118.3 Å²	118.3	81%	0.812	75%	0.748	S	S	*	*			cis	-143.8	-177.8	19.7	44.5	-25.6	0	0	0	118.2
455	A	26.1	Very low	32.3	Very low	97 Å²	97	118.5 Å²	118.5	80%	0.802	76%	0.763	S	S	*	*			trans	81.4	143.9	144.5	0	0	0	0	0	122.9
456	A	26.7	Very low	32.7	Very low	95 Å²	95	112.9 Å²	112.9	79%	0.785	76%	0.762	S	S	*	*			trans	-119.6	-147.7	166.3	0	0	0	0	0	107.6
457	P	44.4	Very low	33.5	Very low	119 Å²	119	113.1 Å²	113.1	77%	0.773	77%	0.766	S	S	*	*			cis	-147.8	-175.8	13.3	45.9	-24.7	0	0	0	118.7
458	A	30.8	Very low	33.4	Very low	83 Å²	83	112 Å²	112	69%	0.686	77%	0.766	S	S	*	*			trans	84.5	134.1	134.6	0	0	0	0	0	125.6
459	M	31	Very low	34.5	Very low	190 Å²	190	113.6 Å²	113.6	94%	0.936	77%	0.769	S	S	*	*			trans	90.2	153.1	138.9	-78	170.7	71.8	0	0	123.5
460	A	30.6	Very low	34.7	Very low	84 Å²	84	110.4 Å²	110.4	69%	0.694	77%	0.77	S	S	*	*			trans	-135.9	172.4	-178.2	0	0	0	0	0	109.6
461	P	46.4	Very low	34.4	Very low	133 Å²	133	110.8 Å²	110.8	86%	0.864	78%	0.775	S	S	*	*				-154.4	-164.2	98.7	40.7	-20.8	0	0	0	115.6
462	A	29.2	Very low	34.8	Very low	88 Å²	88	108.8 Å²	108.8	73%	0.727	78%	0.782	S	S	*	*			trans	-98	-161.7	171.6	0	0	0	0	0	110.8
463	P	45.9	Very low	35.6	Very low	119 Å²	119	109 Å²	109	77%	0.773	79%	0.786	S	S	*	*			cis	-147.4	178	20.1	45.3	-23.8	0	0	0	119.9
464	A	30.7	Very low	36	Very low	88 Å²	88	110.8 Å²	110.8	73%	0.727	80%	0.795	S	S	*	*			trans	25.7	141.6	145.2	0	0	0	0	0	125.3
465	S	32.9	Very low	36.1	Very low	129 Å²	129	111.2 Å²	111.2	90%	0.902	80%	0.798	S	S	*	*				169	165	116.7	-74.8	0	0	0	0	114.5
466	A	33.1	Very low	36.5	Very low	94 Å²	94	110.9 Å²	110.9	78%	0.777	80%	0.795	S	S	*	*			trans	-129	164.1	172.6	0	0	0	0	0	111
467	P	46.8	Very low	37.8	Very low	135 Å²	135	111.4 Å²	111.4	88%	0.877	79%	0.79	S	S	*	*				-154.2	-172.3	113.6	40.4	-22.2	0	0	0	115.6
468	A	30.5	Very low	37.5	Very low	91 Å²	91	112.1 Å²	112.1	75%	0.752	79%	0.792	S	S	*	*			trans	-123.1	164.8	163.3	0	0	0	0	0	109.7
469	P	48	Very low	38.4	Very low	123 Å²	123	113.9 Å²	113.9	80%	0.799	80%	0.797	S	S	*	*				-158.8	157.5	105.1	40.2	-21.2	0	0	0	119.2
470	A	30.7	Very low	38.6	Very low	90 Å²	90	111 Å²	111	74%	0.744	79%	0.79	S	S	*	*			trans	48.4	151.9	133	0	0	0	0	0	126.8
471	S	33.5	Very low	39.3	Very low	126 Å²	126	113.2 Å²	113.2	88%	0.881	80%	0.798	S	S	*	*			trans	104.8	140.8	144.2	-60.6	0	0	0	0	121.1
472	A	32.8	Very low	38.8	Very low	95 Å²	95	111.2 Å²	111.2	79%	0.785	79%	0.792	S	S	*	*			trans	-123.4	170.3	170.4	0	0	0	0	0	109.3
473	P	45.5	Very low	39	Very low	132 Å²	132	115.9 Å²	115.9	86%	0.857	80%	0.801	S	S	*	*				-151.7	-165.1	87.8	40.7	-21.2	0	0	0	114.4
474	A	33.8	Very low	38.5	Very low	91 Å²	91	116.8 Å²	116.8	75%	0.752	80%	0.804	S	S	*	*			trans	-125.9	163.5	174.7	0	0	0	0	0	112.2
475	P	49.2	Very low	38.9	Very low	134 Å²	134	118.1 Å²	118.1	87%	0.87	81%	0.808	S	S	*	*			trans	-140.2	175.1	138	36.6	-21.6	0	0	0	114.9
476	A	34.9	Very low	39.1	Very low	89 Å²	89	116.5 Å²	116.5	74%	0.736	80%	0.803	S	S	*	*			trans	-103	-157.9	177.4	0	0	0	0	0	110.3
477	P	52.5	Low	39.9	Very low	106 Å²	106	117.9 Å²	117.9	69%	0.688	80%	0.804	S	S	*	*			cis	-145.9	171.7	0	38.7	-16.2	0	0	0	119.3
478	V	38.1	Very low	39.3	Very low	134 Å²	134	116.6 Å²	116.6	81%	0.812	80%	0.798	S	S	*	*			trans	53.9	168.2	152.4	-66	0	0	0	0	122.5
479	P	51	Low	39.7	Very low	120 Å²	120	117.8 Å²	117.8	78%	0.779	80%	0.801	S	S	*	*			cis	-129	-160.8	-28.4	27.9	-4.4	0	0	0	114.6
480	T	34.3	Very low	39.1	Very low	129 Å²	129	117.7 Å²	117.7	79%	0.791	80%	0.798	S	S	*	*			trans	-81.8	169.4	-174	48.7	0	0	0	0	117.1
481	P	46.3	Very low	39.6	Very low	132 Å²	132	119.3 Å²	119.3	86%	0.857	80%	0.798	S	S	*	*				-132.4	-168.9	114.6	39.7	-31.6	0	0	0	114.2
482	A	36	Very low	39.6	Very low	91 Å²	91	120.3 Å²	120.3	75%	0.752	79%	0.794	S	S	*	*			trans	-147.1	-179.1	-163.4	0	0	0	0	0	116.3
483	M	32.8	Very low	39.7	Very low	185 Å²	185	119.6 Å²	119.6	91%	0.911	79%	0.788	S	S	*	*			trans	75.2	159.3	176.6	-47.3	-170.6	172.2	0	0	115.3
484	V	34.5	Very low	39.2	Very low	139 Å²	139	119.2 Å²	119.2	84%	0.842	79%	0.788	S	S	*	*			cis	-136.6	-177.4	12.6	-74	0	0	0	0	112.1
485	S	38.7	Very low	39.7	Very low	116 Å²	116	119.6 Å²	119.6	81%	0.811	79%	0.792	S	S	*	*			trans	-133.3	149.8	-171	-57.9	0	0	0	0	116.4
486	A	37.7	Very low	39.3	Very low	95 Å²	95	118.2 Å²	118.2	79%	0.785	79%	0.785	S	S	*	*			trans	70.5	168.1	154.8	0	0	0	0	0	116.7
487	P	50.9	Low	39.6	Very low	123 Å²	123	120.1 Å²	120.1	80%	0.799	79%	0.788	S	S	*	*			cis	-145.9	-177.9	21.5	45.4	-25.5	0	0	0	120
488	S	33.9	Very low	39.2	Very low	107 Å²	107	124.1 Å²	124.1	75%	0.748	79%	0.794	S	S	*	*			trans	81.9	119.7	143.8	-161	0	0	0	0	123
489	S	38	Very low	39.7	Very low	116 Å²	116	123.4 Å²	123.4	81%	0.811	79%	0.79	S	S	*	*				-150.7	147.2	123	65.1	0	0	0	0	110.2
490	T	36.8	Very low	39.9	Very low	122 Å²	122	123 Å²	123	75%	0.748	79%	0.791	S	S	*	*			trans	-174.3	141.4	-157.6	-90.9	0	0	0	0	111.3
491	V	39.5	Very low	40.4	Very low	123 Å²	123	120.6 Å²	120.6	75%	0.745	78%	0.783	S	S	*	*			cis	-118.8	-97.1	-12.7	-104.9	0	0	0	0	112.5
492	N	34.5	Very low	40.7	Very low	147 Å²	147	117.2 Å²	117.2	79%	0.786	77%	0.772	S	S	*	*			cis	-164.8	160	-10.7	-159.5	49.5	0	0	0	110
493	A	34.9	Very low	41.3	Very low	81 Å²	81	117.2 Å²	117.2	67%	0.669	76%	0.763	S	S	*	*				-158.7	140.8	-65.3	0	0	0	0	0	111.1
494	S	35.4	Very low	42.6	Very low	123 Å²	123	115.4 Å²	115.4	86%	0.86	76%	0.763	S	S	*	*			trans	-161.1	164.7	157.3	56.6	0	0	0	0	110.7
495	A	43.9	Very low	43.8	Very low	100 Å²	100	112.5 Å²	112.5	83%	0.826	74%	0.743	S	S	*	*			trans	-56.6	153.8	-171.3	0	0	0	0	0	114.1
496	S	40.8	Very low	45.4	Very low	105 Å²	105	111.7 Å²	111.7	73%	0.734	73%	0.734	S	S	*	*			cis	-146.5	144.6	31.6	58.1	0	0	0	0	116.2
497	V	41.4	Very low	47.2	Very low	129 Å²	129	114.1 Å²	114.1	78%	0.782	73%	0.729	S	S	*	*			trans	49.1	116.5	155.7	-175	0	0	0	0	118.3	T499	V497-T499 HydrophobicContact CG1-CG2 4.3Å
498	K	44.8	Very low	48.6	Very low	189 Å²	189	111.2 Å²	111.2	82%	0.822	71%	0.705	S	S	*	*			trans	-85.6	133	156.7	-63.4	172.4	-177	172.5	0	109.5	S500	K498-S500 PolarHBondContact O-OG 3.4Å
499	T	46.9	Very low	50.7	Low	120 Å²	120	108.6 Å²	108.6	74%	0.736	69%	0.69	S	S	*	*			trans	-124.7	116.1	148	49.1	0	0	0	0	105.5	V497	V497-T499 HydrophobicContact CG1-CG2 4.3Å
500	S	56.7	Low	52.9	Low	112 Å²	112	107.3 Å²	107.3	78%	0.783	68%	0.678	S	S	*	*			cis	62.4	29.8	13.2	89.9	0	0	0	0	115.8	K498	K498-S500 PolarHBondContact O-OG 3.4Å
501	A	44	Very low	55.5	Low	77 Å²	77	108 Å²	108	64%	0.636	67%	0.666	S	S	*	*			trans	-142	146.6	147.1	0	0	0	0	0	107.4
502	G	52.6	Low	57.8	Low	61 Å²	61	106 Å²	106	63%	0.629	65%	0.651	S	S	*	*			trans	-72.8	130.4	156.7	0	0	0	0	0	107.3	T504	G502-T504 VanDerWaalsContact C-N 3.29Å; G502-T504 PolarHBondContact O-N 2.7Å
503	T	49.2	Very low	60.4	Low	91 Å²	91	103.5 Å²	103.5	56%	0.558	64%	0.637	S	S	*	*			trans	-69.3	90.7	173.8	48.9	0	0	0	0	108.5	D505	T503-D505 PolarHBondContact O-N 3.38Å
504	T	59.3	Low	63.2	Low	147 Å²	147	102.2 Å²	102.2	90%	0.902	63%	0.626	S	S	*	*			trans	-75.6	48.1	178.2	47.2	0	0	0	0	111.5	G502	G502-T504 VanDerWaalsContact C-N 3.29Å; G502-T504 PolarHBondContact O-N 2.7Å
505	D	59.3	Low	65.9	Low	79 Å²	79	101.4 Å²	101.4	42%	0.422	61%	0.609	S	S	.	*			trans	-136.8	113.9	-178.3	-167.4	-30.9	0	0	0	108.6	T503 E507 E508	T503-D505 PolarHBondContact O-N 3.38Å; D505-E507 PolarHBondContact O-N 3.46Å; D505-E507 PolarHBondContact OD1-N 2.81Å; D505-E508 HydrophobicContact CB-CG 4.37Å; D505-E508 PolarHBondContact O-N 2.79Å
506	P	72.4	Confident	68.3	Low	98 Å²	98	103.4 Å²	103.4	64%	0.636	60%	0.599	S	S	*	*	H	α-helix	trans	-67.8	-20.3	-173.7	28.3	-35.4	0	0	0	113.5	T510	P506-T510 WeakPolarHBondContact O-CG2 3.29Å; P506-T510 PolarHBondContact O-N 2.89Å; P506-T510 VanDerWaalsContact O-N 3.14Å; P506-T510 PolarHBondContact O-OG1 3.36Å
507	E	75.4	Confident	70.9	Confident	146 Å²	146	106 Å²	106	68%	0.682	59%	0.593	S	S	*	*	H	α-helix	trans	-71.9	-35.2	-179.1	-59.5	-158.8	170.6	0	0	111.6	D505 T510 R511	D505-E507 PolarHBondContact O-N 3.46Å; D505-E507 PolarHBondContact OD1-N 2.81Å; E507-T510 WeakPolarHBondContact CA-OG1 3.49Å; E507-T510 PolarHBondContact O-OG1 3.09Å; E507-R511 VanDerWaalsContact O-CB 3.24Å; E507-R511 WeakPolarHBondContact O-CB 3.43Å; E507-R511 PolarHBondContact O-N 3.41Å
508	E	79.9	Confident	73.5	Confident	63 Å²	63	108 Å²	108	29%	0.294	59%	0.586	S	S	.	*	H	α-helix	trans	-70.8	-39.9	177.9	-56.2	-137.2	121.9	0	0	112.1	D505 R511 L512	D505-E508 HydrophobicContact CB-CG 4.37Å; D505-E508 PolarHBondContact O-N 2.79Å; E508-R511 VanDerWaalsContact CD-NH2 3.29Å; E508-R511 PolarHBondContact O-N 2.79Å; E508-R511 IonicContact OE1-CZ 3.34Å; E508-R511 IonicContact OE1-NH1 3.12Å; E508-R511 PolarHBondContact OE1-NH1 3.25Å; E508-R511 VanDerWaalsContact OE1-NH1 3.12Å; E508-R511 IonicContact OE1-NH2 2.66Å; E508-R511 PolarHBondContact OE1-NH2 3.37Å; E508-R511 IonicContact OE2-NH2 3.96Å; E508-L512 WeakPolarHBondContact O-CG 3.21Å; E508-L512 PolarHBondContact O-N 3.45Å
509	A	80	Confident	75.9	Confident	51 Å²	51	103.3 Å²	103.3	42%	0.421	57%	0.57	S	S	.	*	H	α-helix	trans	-65	-39.4	176.5	0	0	0	0	0	112.2	L513	A509-L513 WeakPolarHBondContact O-CG 3.5Å; A509-L513 PolarHBondContact O-N 2.8Å; A509-L513 VanDerWaalsContact O-N 3.15Å
510	T	83.4	Confident	78	Confident	90 Å²	90	100.2 Å²	100.2	55%	0.552	56%	0.557	S	S	*	*	H	α-helix	trans	-71.9	-37	175.6	51.6	0	0	0	0	112.1	P506 E507 L513 A514	P506-T510 WeakPolarHBondContact O-CG2 3.29Å; P506-T510 PolarHBondContact O-N 2.89Å; P506-T510 VanDerWaalsContact O-N 3.14Å; P506-T510 PolarHBondContact O-OG1 3.36Å; E507-T510 WeakPolarHBondContact CA-OG1 3.49Å; E507-T510 PolarHBondContact O-OG1 3.09Å; T510-L513 PolarHBondContact O-N 2.77Å; T510-A514 WeakPolarHBondContact O-CB 3.5Å; T510-A514 PolarHBondContact O-N 3.11Å
511	R	90.2	Very high	79.7	Confident	137 Å²	137	103.9 Å²	103.9	52%	0.517	55%	0.553	S	S	.	*	H	α-helix	trans	-58.2	-48.1	171.4	-170.4	174.5	72.5	-142.7	0.4	111.8	E507 E508 L513 A514 E515	E507-R511 VanDerWaalsContact O-CB 3.24Å; E507-R511 WeakPolarHBondContact O-CB 3.43Å; E507-R511 PolarHBondContact O-N 3.41Å; E508-R511 VanDerWaalsContact CD-NH2 3.29Å; E508-R511 PolarHBondContact O-N 2.79Å; E508-R511 IonicContact OE1-CZ 3.34Å; E508-R511 IonicContact OE1-NH1 3.12Å; E508-R511 PolarHBondContact OE1-NH1 3.25Å; E508-R511 VanDerWaalsContact OE1-NH1 3.12Å; E508-R511 IonicContact OE1-NH2 2.66Å; E508-R511 PolarHBondContact OE1-NH2 3.37Å; E508-R511 IonicContact OE2-NH2 3.96Å; R511-L513 VanDerWaalsContact C-N 3.33Å; R511-L513 PolarHBondContact O-N 3.33Å; R511-A514 WeakPolarHBondContact O-CB 3.2Å; R511-A514 PolarHBondContact O-N 2.95Å; R511-E515 WeakPolarHBondContact O-CB 3.46Å; R511-E515 PolarHBondContact O-N 2.76Å
512	L	88.6	Confident	82.2	Confident	81 Å²	81	103.3 Å²	103.3	42%	0.424	54%	0.537	S	S	.	.	H	α-helix	trans	-63.6	-33.6	176.5	-72.8	170.3	0	0	0	113.3	E508 K516	E508-L512 WeakPolarHBondContact O-CG 3.21Å; E508-L512 PolarHBondContact O-N 3.45Å; L512-K516 WeakPolarHBondContact O-CB 3.47Å; L512-K516 VanDerWaalsContact O-CG 3.3Å; L512-K516 WeakPolarHBondContact O-CG 3.02Å; L512-K516 PolarHBondContact O-N 3.4Å
513	L	88.5	Confident	83.9	Confident	93 Å²	93	107.2 Å²	107.2	49%	0.487	54%	0.539	S	S	.	.	H	α-helix	trans	-73.2	-36.6	173.1	-75.2	172.9	0	0	0	112.4	A509 T510 R511 R517	A509-L513 WeakPolarHBondContact O-CG 3.5Å; A509-L513 PolarHBondContact O-N 2.8Å; A509-L513 VanDerWaalsContact O-N 3.15Å; T510-L513 PolarHBondContact O-N 2.77Å; R511-L513 VanDerWaalsContact C-N 3.33Å; R511-L513 PolarHBondContact O-N 3.33Å; L513-R517 WeakPolarHBondContact O-CB 3.3Å; L513-R517 WeakPolarHBondContact O-CD 3.32Å; L513-R517 WeakPolarHBondContact O-CG 3.17Å; L513-R517 PolarHBondContact O-N 2.92Å
514	A	93.4	Very high	86	Confident	54 Å²	54	111 Å²	111	45%	0.446	54%	0.543	S	S	.	.	H	α-helix	trans	-64.8	-41.6	173.3	0	0	0	0	0	111.5	T510 R511 R517 R518	T510-A514 WeakPolarHBondContact O-CB 3.5Å; T510-A514 PolarHBondContact O-N 3.11Å; R511-A514 WeakPolarHBondContact O-CB 3.2Å; R511-A514 PolarHBondContact O-N 2.95Å; A514-R517 WeakPolarHBondContact O-CB 3.33Å; A514-R517 PolarHBondContact O-N 3.33Å; A514-R518 PolarHBondContact O-N 3.41Å
515	E	92.6	Very high	87.6	Confident	107 Å²	107	108.6 Å²	108.6	50%	0.5	52%	0.522	S	S	.	.	H	α-helix	trans	-64.8	-46.5	175.5	-175.2	168.5	-143.2	0	0	112.2	R511 R517 R518 L519	R511-E515 WeakPolarHBondContact O-CB 3.46Å; R511-E515 PolarHBondContact O-N 2.76Å; E515-R517 VanDerWaalsContact C-N 3.28Å; E515-R517 PolarHBondContact O-N 2.75Å; E515-R518 WeakPolarHBondContact O-CA 3.25Å; E515-R518 WeakPolarHBondContact O-CB 2.99Å; E515-R518 PolarHBondContact O-N 3.25Å; E515-L519 HydrophobicContact CG-CD1 4.45Å; E515-L519 WeakPolarHBondContact O-CG 3.12Å; E515-L519 PolarHBondContact O-N 2.72Å
516	K	94.1	Very high	89.4	Confident	141 Å²	141	110.5 Å²	110.5	61%	0.613	53%	0.526	S	S	*	.	H	α-helix	trans	-60.3	-36.9	173.4	-74.2	172	-178.5	176.9	0	112.5	L512 A520	L512-K516 WeakPolarHBondContact O-CB 3.47Å; L512-K516 VanDerWaalsContact O-CG 3.3Å; L512-K516 WeakPolarHBondContact O-CG 3.02Å; L512-K516 PolarHBondContact O-N 3.4Å; K516-A520 WeakPolarHBondContact O-CB 3.19Å; K516-A520 PolarHBondContact O-N 3.5Å
517	R	96.6	Very high	90.3	Very high	161 Å²	161	112.5 Å²	112.5	61%	0.608	53%	0.527	S	S	*	.	H	α-helix	trans	-67.2	-35.3	172.3	-72.6	164.7	179.9	170.7	-0.1	112.5	L513 A514 E515 R521	L513-R517 WeakPolarHBondContact O-CB 3.3Å; L513-R517 WeakPolarHBondContact O-CD 3.32Å; L513-R517 WeakPolarHBondContact O-CG 3.17Å; L513-R517 PolarHBondContact O-N 2.92Å; A514-R517 WeakPolarHBondContact O-CB 3.33Å; A514-R517 PolarHBondContact O-N 3.33Å; E515-R517 VanDerWaalsContact C-N 3.28Å; E515-R517 PolarHBondContact O-N 2.75Å; R517-R521 VanDerWaalsContact O-CG 3.3Å; R517-R521 WeakPolarHBondContact O-CG 3.09Å; R517-R521 PolarHBondContact O-N 2.89Å
518	R	95.5	Very high	91.2	Very high	171 Å²	171	109.3 Å²	109.3	65%	0.645	51%	0.512	S	S	*	.	H	α-helix	trans	-65.2	-50.1	172.8	177.6	-177.7	171	175.4	-0.6	110.7	A514 E515 A520 R521 E522	A514-R518 PolarHBondContact O-N 3.41Å; E515-R518 WeakPolarHBondContact O-CA 3.25Å; E515-R518 WeakPolarHBondContact O-CB 2.99Å; E515-R518 PolarHBondContact O-N 3.25Å; R518-A520 VanDerWaalsContact C-N 3.34Å; R518-A520 PolarHBondContact O-N 2.75Å; R518-R521 WeakPolarHBondContact O-CB 3.45Å; R518-R521 PolarHBondContact O-N 2.95Å; R518-R521 VanDerWaalsContact O-N 3.12Å; R518-E522 WeakPolarHBondContact O-CB 3.42Å; R518-E522 PolarHBondContact O-N 2.93Å
519	L	94.7	Very high	91.8	Very high	89 Å²	89	112.9 Å²	112.9	47%	0.466	52%	0.523	S	S	.	.	H	α-helix	trans	-60.2	-41	178.4	-68.6	172.7	0	0	0	112.2	E515 R521 E522 Q523	E515-L519 HydrophobicContact CG-CD1 4.45Å; E515-L519 WeakPolarHBondContact O-CG 3.12Å; E515-L519 PolarHBondContact O-N 2.72Å; L519-R521 VanDerWaalsContact C-N 3.34Å; L519-R521 PolarHBondContact O-N 3.21Å; L519-E522 PolarHBondContact O-N 2.85Å; L519-Q523 WeakPolarHBondContact O-CB 3.23Å; L519-Q523 WeakPolarHBondContact O-CG 3.22Å; L519-Q523 PolarHBondContact O-N 2.74Å
520	A	91.7	Very high	92.4	Very high	56 Å²	56	115.9 Å²	115.9	46%	0.463	53%	0.528	S	S	.	.	H	α-helix	trans	-64.4	-35.1	175.3	0	0	0	0	0	113.2	K516 R518 R524	K516-A520 WeakPolarHBondContact O-CB 3.19Å; K516-A520 PolarHBondContact O-N 3.5Å; R518-A520 VanDerWaalsContact C-N 3.34Å; R518-A520 PolarHBondContact O-N 2.75Å; A520-R524 WeakPolarHBondContact O-CB 3.01Å; A520-R524 PolarHBondContact O-N 3.21Å
521	R	92.9	Very high	92.8	Very high	188 Å²	188	119.4 Å²	119.4	71%	0.709	53%	0.531	S	S	*	.	H	α-helix	trans	-68.9	-44	172	-71.4	168.3	-178.2	176.3	-0.3	111.3	R517 R518 L519 R524 E525	R517-R521 VanDerWaalsContact O-CG 3.3Å; R517-R521 WeakPolarHBondContact O-CG 3.09Å; R517-R521 PolarHBondContact O-N 2.89Å; R518-R521 WeakPolarHBondContact O-CB 3.45Å; R518-R521 PolarHBondContact O-N 2.95Å; R518-R521 VanDerWaalsContact O-N 3.12Å; L519-R521 VanDerWaalsContact C-N 3.34Å; L519-R521 PolarHBondContact O-N 3.21Å; R521-R524 PolarHBondContact O-N 2.88Å; R521-E525 WeakPolarHBondContact O-CB 3Å; R521-E525 PolarHBondContact O-N 3.38Å
522	E	94.8	Very high	92.9	Very high	65 Å²	65	119.8 Å²	119.8	30%	0.304	53%	0.533	S	S	.	.	H	α-helix	trans	-68	-34.9	-178.9	-164.1	-176.9	133.9	0	0	112.4	R518 L519 E525 K526	R518-E522 WeakPolarHBondContact O-CB 3.42Å; R518-E522 PolarHBondContact O-N 2.93Å; L519-E522 PolarHBondContact O-N 2.85Å; E522-E525 PolarHBondContact O-N 2.94Å; E522-K526 WeakPolarHBondContact O-CB 3.46Å; E522-K526 VanDerWaalsContact O-CG 3.28Å; E522-K526 WeakPolarHBondContact O-CG 3.23Å; E522-K526 PolarHBondContact O-N 3.19Å; E522-K526 WeakPolarHBondContact OE1-CE 3.37Å; E522-K526 IonicContact OE1-NZ 2.74Å; E522-K526 PolarHBondContact OE1-NZ 2.96Å
523	Q	89.1	Confident	93.2	Very high	143 Å²	143	121.9 Å²	121.9	67%	0.668	54%	0.54	S	S	*	.	H	α-helix	trans	-64.2	-49.9	170.2	-78.4	-178.7	-31.6	0	0	111.4	L519 E525 K526 E527	L519-Q523 WeakPolarHBondContact O-CB 3.23Å; L519-Q523 WeakPolarHBondContact O-CG 3.22Å; L519-Q523 PolarHBondContact O-N 2.74Å; Q523-E525 VanDerWaalsContact C-N 3.27Å; Q523-E525 PolarHBondContact O-N 3.3Å; Q523-K526 PolarHBondContact O-N 3.48Å; Q523-E527 PolarHBondContact O-N 3.39Å
524	R	92.7	Very high	93.2	Very high	171 Å²	171	122.9 Å²	122.9	65%	0.645	54%	0.542	S	S	*	.	H	α-helix	trans	-60.5	-36.6	175.8	178.8	176.5	168.6	175.5	-1.7	112.2	A520 R521 E528	A520-R524 WeakPolarHBondContact O-CB 3.01Å; A520-R524 PolarHBondContact O-N 3.21Å; R521-R524 PolarHBondContact O-N 2.88Å; R524-E528 VanDerWaalsContact O-CB 3.27Å; R524-E528 WeakPolarHBondContact O-CB 3.26Å; R524-E528 PolarHBondContact O-N 3.18Å
525	E	94.1	Very high	93.1	Very high	97 Å²	97	125.8 Å²	125.8	45%	0.453	55%	0.547	S	S	.	.	H	α-helix	trans	-69.5	-38.3	176.9	-167	-175.6	166.2	0	0	111.9	R521 E522 Q523 E528 R529	R521-E525 WeakPolarHBondContact O-CB 3Å; R521-E525 PolarHBondContact O-N 3.38Å; E522-E525 PolarHBondContact O-N 2.94Å; Q523-E525 VanDerWaalsContact C-N 3.27Å; Q523-E525 PolarHBondContact O-N 3.3Å; E525-E528 PolarHBondContact O-N 2.87Å; E525-R529 WeakPolarHBondContact O-CB 3.48Å; E525-R529 WeakPolarHBondContact O-CG 3.4Å; E525-R529 PolarHBondContact O-N 2.8Å; E525-R529 IonicContact OE1-CZ 2.64Å; E525-R529 IonicContact OE1-NE 2.71Å; E525-R529 PolarHBondContact OE1-NE 3.01Å; E525-R529 IonicContact OE1-NH2 3.09Å; E525-R529 PolarHBondContact OE1-NH2 3.3Å
526	K	95.9	Very high	93.1	Very high	119 Å²	119	126.2 Å²	126.2	52%	0.517	55%	0.549	S	S	.	.	H	α-helix	trans	-65.5	-44.8	173.3	-74.3	167.9	-173.9	169.3	0	111.7	E522 Q523 E528 R529 E530	E522-K526 WeakPolarHBondContact O-CB 3.46Å; E522-K526 VanDerWaalsContact O-CG 3.28Å; E522-K526 WeakPolarHBondContact O-CG 3.23Å; E522-K526 PolarHBondContact O-N 3.19Å; E522-K526 WeakPolarHBondContact OE1-CE 3.37Å; E522-K526 IonicContact OE1-NZ 2.74Å; E522-K526 PolarHBondContact OE1-NZ 2.96Å; Q523-K526 PolarHBondContact O-N 3.48Å; K526-E528 VanDerWaalsContact C-N 3.33Å; K526-E528 PolarHBondContact O-N 2.9Å; K526-R529 PolarHBondContact O-N 3.26Å; K526-E530 PolarHBondContact O-N 2.74Å
527	E	92.6	Very high	93.1	Very high	139 Å²	139	123.7 Å²	123.7	65%	0.65	54%	0.542	S	S	*	.	H	α-helix	trans	-59.9	-41.9	173	-172.8	-170.6	167.4	0	0	111.6	Q523 R531	Q523-E527 PolarHBondContact O-N 3.39Å; E527-R531 VanDerWaalsContact O-CB 3.22Å; E527-R531 WeakPolarHBondContact O-CB 3.34Å; E527-R531 PolarHBondContact O-N 3.46Å
528	E	93.3	Very high	92.9	Very high	79 Å²	79	122 Å²	122	37%	0.369	54%	0.541	S	S	.	.	H	α-helix	trans	-70.3	-33.3	178.3	-164.3	177.3	141.4	0	0	112.5	R524 E525 K526 R532	R524-E528 VanDerWaalsContact O-CB 3.27Å; R524-E528 WeakPolarHBondContact O-CB 3.26Å; R524-E528 PolarHBondContact O-N 3.18Å; E525-E528 PolarHBondContact O-N 2.87Å; K526-E528 VanDerWaalsContact C-N 3.33Å; K526-E528 PolarHBondContact O-N 2.9Å; E528-R532 WeakPolarHBondContact O-CD 3.1Å; E528-R532 WeakPolarHBondContact O-CG 3.24Å; E528-R532 PolarHBondContact O-N 3.43Å; E528-R532 IonicContact OE1-CZ 2.75Å; E528-R532 IonicContact OE1-NE 3.19Å; E528-R532 IonicContact OE1-NH2 3.82Å; E528-R532 PolarHBondContact OE1-NH2 2.8Å
529	R	92.4	Very high	92.7	Very high	139 Å²	139	120.9 Å²	120.9	53%	0.525	54%	0.537	S	S	.	.	H	α-helix	trans	-66.8	-51.5	171.5	-72.3	167.8	-174.1	-152.4	6.7	111.3	E525 K526 R531 R532 E533	E525-R529 WeakPolarHBondContact O-CB 3.48Å; E525-R529 WeakPolarHBondContact O-CG 3.4Å; E525-R529 PolarHBondContact O-N 2.8Å; E525-R529 IonicContact OE1-CZ 2.64Å; E525-R529 IonicContact OE1-NE 2.71Å; E525-R529 PolarHBondContact OE1-NE 3.01Å; E525-R529 IonicContact OE1-NH2 3.09Å; E525-R529 PolarHBondContact OE1-NH2 3.3Å; K526-R529 PolarHBondContact O-N 3.26Å; R529-R531 VanDerWaalsContact C-N 3.28Å; R529-R531 PolarHBondContact O-N 2.81Å; R529-R532 WeakPolarHBondContact O-CB 3.26Å; R529-R532 PolarHBondContact O-N 3.38Å; R529-E533 PolarHBondContact O-N 2.82Å
530	E	92.4	Very high	92.7	Very high	113 Å²	113	122.2 Å²	122.2	53%	0.528	54%	0.54	S	S	.	.	H	α-helix	trans	-58.5	-42.6	177.8	-168.2	-170	152.3	0	0	111	K526 R532 E533 Q534	K526-E530 PolarHBondContact O-N 2.74Å; E530-R532 VanDerWaalsContact C-N 3.35Å; E530-R532 PolarHBondContact O-N 2.89Å; E530-E533 PolarHBondContact O-N 3.18Å; E530-Q534 WeakPolarHBondContact O-CG 3.41Å; E530-Q534 PolarHBondContact O-N 2.97Å; E530-Q534 PolarHBondContact OE1-NE2 2.77Å
531	R	93.6	Very high	92.8	Very high	164 Å²	164	125.8 Å²	125.8	62%	0.619	55%	0.545	S	S	*	.	H	α-helix	trans	-61.9	-39.3	174.9	-179.9	179.3	162.7	-169.1	-8.3	112.6	E527 R529 Q534 E535	E527-R531 VanDerWaalsContact O-CB 3.22Å; E527-R531 WeakPolarHBondContact O-CB 3.34Å; E527-R531 PolarHBondContact O-N 3.46Å; R529-R531 VanDerWaalsContact C-N 3.28Å; R529-R531 PolarHBondContact O-N 2.81Å; R531-Q534 PolarHBondContact O-N 3.06Å; R531-E535 WeakPolarHBondContact O-CB 3.24Å; R531-E535 PolarHBondContact O-N 3.27Å
532	R	90.4	Very high	92.7	Very high	146 Å²	146	125.2 Å²	125.2	55%	0.551	54%	0.543	S	S	*	.	H	α-helix	trans	-65.6	-42	175.3	-73.1	165	-173.2	-155.3	7.5	111.1	E528 R529 E530 Q534 E535 E536	E528-R532 WeakPolarHBondContact O-CD 3.1Å; E528-R532 WeakPolarHBondContact O-CG 3.24Å; E528-R532 PolarHBondContact O-N 3.43Å; E528-R532 IonicContact OE1-CZ 2.75Å; E528-R532 IonicContact OE1-NE 3.19Å; E528-R532 IonicContact OE1-NH2 3.82Å; E528-R532 PolarHBondContact OE1-NH2 2.8Å; R529-R532 WeakPolarHBondContact O-CB 3.26Å; R529-R532 PolarHBondContact O-N 3.38Å; E530-R532 VanDerWaalsContact C-N 3.35Å; E530-R532 PolarHBondContact O-N 2.89Å; R532-Q534 VanDerWaalsContact C-N 3.35Å; R532-Q534 PolarHBondContact O-N 3.32Å; R532-E535 PolarHBondContact O-N 2.94Å; R532-E536 WeakPolarHBondContact O-CB 3.48Å; R532-E536 WeakPolarHBondContact O-CG 3.47Å; R532-E536 PolarHBondContact O-N 3.43Å
533	E	95	Very high	92.5	Very high	124 Å²	124	126.8 Å²	126.8	58%	0.579	55%	0.551	S	S	*	*	H	α-helix	trans	-62.3	-41.4	174.9	-69.5	169.8	-157.2	0	0	111.5	R529 E530 E536 L537	R529-E533 PolarHBondContact O-N 2.82Å; E530-E533 PolarHBondContact O-N 3.18Å; E533-E536 PolarHBondContact O-N 3.18Å; E533-L537 WeakPolarHBondContact O-CB 3.39Å; E533-L537 VanDerWaalsContact O-CG 3.27Å; E533-L537 WeakPolarHBondContact O-CG 3.45Å; E533-L537 PolarHBondContact O-N 3.26Å
534	Q	89.8	Confident	92.7	Very high	114 Å²	114	125 Å²	125	53%	0.533	54%	0.542	S	S	.	.	H	α-helix	trans	-64.4	-42.7	173.1	-69.4	177.9	20	0	0	112.4	E530 R531 R532 L537 E538	E530-Q534 WeakPolarHBondContact O-CG 3.41Å; E530-Q534 PolarHBondContact O-N 2.97Å; E530-Q534 PolarHBondContact OE1-NE2 2.77Å; R531-Q534 PolarHBondContact O-N 3.06Å; R532-Q534 VanDerWaalsContact C-N 3.35Å; R532-Q534 PolarHBondContact O-N 3.32Å; Q534-L537 PolarHBondContact O-N 2.85Å; Q534-E538 PolarHBondContact O-N 3.33Å
535	E	91.9	Very high	92.2	Very high	116 Å²	116	119.5 Å²	119.5	54%	0.542	53%	0.525	S	S	.	.	H	α-helix	trans	-68	-35.1	177.2	-169.7	170.3	155.4	0	0	111.7	R531 R532 R539	R531-E535 WeakPolarHBondContact O-CB 3.24Å; R531-E535 PolarHBondContact O-N 3.27Å; R532-E535 PolarHBondContact O-N 2.94Å; E535-R539 WeakPolarHBondContact O-CB 3.14Å; E535-R539 PolarHBondContact O-N 3.1Å
536	E	92	Very high	92.2	Very high	115 Å²	115	117.7 Å²	117.7	54%	0.537	53%	0.527	S	S	.	.	H	α-helix	trans	-70	-38.1	172.3	-76.6	-173.8	-169.8	0	0	112.4	R532 E533 R539 Q540	R532-E536 WeakPolarHBondContact O-CB 3.48Å; R532-E536 WeakPolarHBondContact O-CG 3.47Å; R532-E536 PolarHBondContact O-N 3.43Å; E533-E536 PolarHBondContact O-N 3.18Å; E536-R539 PolarHBondContact O-N 2.76Å; E536-Q540 WeakPolarHBondContact O-CB 3.48Å; E536-Q540 VanDerWaalsContact O-CG 3.28Å; E536-Q540 WeakPolarHBondContact O-CG 3.27Å; E536-Q540 PolarHBondContact O-N 3.45Å
537	L	94.4	Very high	92.1	Very high	88 Å²	88	117.4 Å²	117.4	46%	0.461	53%	0.528	S	S	.	.	H	α-helix	trans	-70.2	-36.3	173.6	-72.5	170.8	0	0	0	112.5	E533 Q534 K541	E533-L537 WeakPolarHBondContact O-CB 3.39Å; E533-L537 VanDerWaalsContact O-CG 3.27Å; E533-L537 WeakPolarHBondContact O-CG 3.45Å; E533-L537 PolarHBondContact O-N 3.26Å; Q534-L537 PolarHBondContact O-N 2.85Å; L537-K541 WeakPolarHBondContact O-CB 3.49Å; L537-K541 WeakPolarHBondContact O-CD 3.28Å; L537-K541 VanDerWaalsContact O-CG 3.28Å; L537-K541 WeakPolarHBondContact O-CG 3.49Å; L537-K541 PolarHBondContact O-N 2.77Å
538	E	91.1	Very high	92.1	Very high	127 Å²	127	115.1 Å²	115.1	59%	0.593	51%	0.513	S	S	*	.	H	α-helix	trans	-65.1	-42.4	169.3	-166.9	-167.8	137.1	0	0	110.3	Q534 K541 R542	Q534-E538 PolarHBondContact O-N 3.33Å; E538-K541 PolarHBondContact O-N 3.19Å; E538-R542 WeakPolarHBondContact O-CB 3.39Å; E538-R542 PolarHBondContact O-N 2.77Å
539	R	92.4	Very high	92.1	Very high	147 Å²	147	113.7 Å²	113.7	56%	0.555	51%	0.51	S	S	*	.	H	α-helix	trans	-63.8	-45.1	177.3	179.9	178.9	166.5	-126.9	-24.5	112.2	E535 E536 R542 E543	E535-R539 WeakPolarHBondContact O-CB 3.14Å; E535-R539 PolarHBondContact O-N 3.1Å; E536-R539 PolarHBondContact O-N 2.76Å; R539-R542 CarbonylContact O-C 3.59Å; R539-R542 PolarHBondContact O-N 2.75Å; R539-R542 VanDerWaalsContact O-N 3.1Å; R539-E543 HydrophobicContact CG-CG 4.36Å; R539-E543 IonicContact CZ-OE1 2.78Å; R539-E543 IonicContact CZ-OE2 3.27Å; R539-E543 IonicContact NE-OE1 3.42Å; R539-E543 PolarHBondContact NE-OE1 3.47Å; R539-E543 IonicContact NE-OE2 3.75Å; R539-E543 IonicContact NH2-OE1 3.86Å; R539-E543 PolarHBondContact NH2-OE1 2.81Å; R539-E543 IonicContact NH2-OE2 2.68Å; R539-E543 PolarHBondContact NH2-OE2 3.07Å; R539-E543 WeakPolarHBondContact O-CB 3.38Å; R539-E543 WeakPolarHBondContact O-CG 3.34Å; R539-E543 PolarHBondContact O-N 2.69Å
540	Q	95.1	Very high	92	Very high	117 Å²	117	109.2 Å²	109.2	55%	0.547	50%	0.502	S	S	.	.	H	α-helix	trans	-59.2	-51.5	175.5	-77.1	174.3	21.2	0	0	110.3	E536 R542 E543 E544	E536-Q540 WeakPolarHBondContact O-CB 3.48Å; E536-Q540 VanDerWaalsContact O-CG 3.28Å; E536-Q540 WeakPolarHBondContact O-CG 3.27Å; E536-Q540 PolarHBondContact O-N 3.45Å; Q540-R542 PolarHBondContact O-N 2.91Å; Q540-E543 PolarHBondContact O-N 3.43Å; Q540-E544 VanDerWaalsContact O-CB 3.25Å; Q540-E544 WeakPolarHBondContact O-CB 3.41Å; Q540-E544 PolarHBondContact O-N 3.43Å
541	K	93.4	Very high	91.8	Very high	130 Å²	130	105 Å²	105	57%	0.565	48%	0.483	S	S	*	.	H	α-helix	trans	-56.3	-39.2	173.1	-73.7	168.9	-175.8	170.4	0	111.2	L537 E538 E544 L545	L537-K541 WeakPolarHBondContact O-CB 3.49Å; L537-K541 WeakPolarHBondContact O-CD 3.28Å; L537-K541 VanDerWaalsContact O-CG 3.28Å; L537-K541 WeakPolarHBondContact O-CG 3.49Å; L537-K541 PolarHBondContact O-N 2.77Å; E538-K541 PolarHBondContact O-N 3.19Å; K541-E544 CarbonylContact O-C 3.52Å; K541-E544 WeakPolarHBondContact O-CB 3.44Å; K541-L545 WeakPolarHBondContact O-CA 3.41Å; K541-L545 VanDerWaalsContact O-CB 3.22Å; K541-L545 WeakPolarHBondContact O-CB 3.38Å; K541-L545 WeakPolarHBondContact O-CD2 3.22Å; K541-L545 WeakPolarHBondContact O-CG 2.99Å; K541-L545 PolarHBondContact O-N 3.23Å
542	R	91	Very high	91.6	Very high	176 Å²	176	102.7 Å²	102.7	66%	0.664	48%	0.479	S	S	*	.	H	α-helix	trans	-75.3	-30.8	-178.6	-177	174	175.3	178.2	-1	114.1	E538 R539 Q540 L545 A546	E538-R542 WeakPolarHBondContact O-CB 3.39Å; E538-R542 PolarHBondContact O-N 2.77Å; R539-R542 CarbonylContact O-C 3.59Å; R539-R542 PolarHBondContact O-N 2.75Å; R539-R542 VanDerWaalsContact O-N 3.1Å; Q540-R542 PolarHBondContact O-N 2.91Å; R542-L545 CarbonylContact O-C 3.59Å; R542-L545 PolarHBondContact O-N 2.91Å; R542-A546 WeakPolarHBondContact O-CB 3.5Å; R542-A546 PolarHBondContact O-N 3.44Å
543	E	90.8	Very high	91.4	Very high	99 Å²	99	101.1 Å²	101.1	46%	0.463	47%	0.473	S	S	.	.	H	α-helix	trans	-73.9	-42.6	172.4	-74	176.4	177.2	0	0	109.6	R539 Q540 L545 A546	R539-E543 HydrophobicContact CG-CG 4.36Å; R539-E543 IonicContact CZ-OE1 2.78Å; R539-E543 IonicContact CZ-OE2 3.27Å; R539-E543 IonicContact NE-OE1 3.42Å; R539-E543 PolarHBondContact NE-OE1 3.47Å; R539-E543 IonicContact NE-OE2 3.75Å; R539-E543 IonicContact NH2-OE1 3.86Å; R539-E543 PolarHBondContact NH2-OE1 2.81Å; R539-E543 IonicContact NH2-OE2 2.68Å; R539-E543 PolarHBondContact NH2-OE2 3.07Å; R539-E543 WeakPolarHBondContact O-CB 3.38Å; R539-E543 WeakPolarHBondContact O-CG 3.34Å; R539-E543 PolarHBondContact O-N 2.69Å; Q540-E543 PolarHBondContact O-N 3.43Å; E543-L545 VanDerWaalsContact C-N 3.32Å; E543-L545 PolarHBondContact O-N 3.38Å; E543-A546 WeakPolarHBondContact O-CB 3.28Å; E543-A546 PolarHBondContact O-N 2.87Å; E543-A546 VanDerWaalsContact O-N 3.11Å
544	E	92.3	Very high	91	Very high	104 Å²	104	97.7 Å²	97.7	49%	0.486	46%	0.46	S	S	.	.	H	α-helix	trans	-55.1	-44.5	164.4	-172.8	-179.5	-145.5	0	0	111.1	E331 N332 Q540 K541 A546	E331-E544 CarbonylContact C-O 3.45Å; E331-E544 WeakPolarHBondContact CA-O 3.14Å; E331-E544 HydrophobicContact CB-CG 4.47Å; E331-E544 WeakPolarHBondContact CB-O 3.47Å; N332-E544 PolarHBondContact N-O 3.23Å; N332-E544 PolarHBondContact OD1-O 3.45Å; Q540-E544 VanDerWaalsContact O-CB 3.25Å; Q540-E544 WeakPolarHBondContact O-CB 3.41Å; Q540-E544 PolarHBondContact O-N 3.43Å; K541-E544 CarbonylContact O-C 3.52Å; K541-E544 WeakPolarHBondContact O-CB 3.44Å; E544-A546 VanDerWaalsContact C-N 3.29Å; E544-A546 PolarHBondContact O-N 2.83Å
545	L	82.6	Confident	91.1	Very high	56 Å²	56	95.9 Å²	95.9	29%	0.293	46%	0.457	S	S	.	.	H	α-helix	trans	-79.2	-3.7	178.4	-62	-142.4	0	0	0	113.7	N332 V333 L334 K541 R542 E543	N332-L545 PolarHBondContact ND2-O 3.01Å; N332-L545 WeakPolarHBondContact OD1-CA 3.42Å; N332-L545 PolarHBondContact OD1-O 3.33Å; V333-L545 HydrophobicContact CG2-CB 3.6Å; V333-L545 HydrophobicContact CG2-CD1 3.72Å; V333-L545 HydrophobicContact CG2-CD2 4.17Å; V333-L545 HydrophobicContact CG2-CG 3.97Å; V333-L545 WeakPolarHBondContact CG2-O 3.28Å; L334-L545 HydrophobicContact CD2-CD1 3.83Å; L334-L545 HydrophobicContact CG-CD1 4.07Å; K541-L545 WeakPolarHBondContact O-CA 3.41Å; K541-L545 VanDerWaalsContact O-CB 3.22Å; K541-L545 WeakPolarHBondContact O-CB 3.38Å; K541-L545 WeakPolarHBondContact O-CD2 3.22Å; K541-L545 WeakPolarHBondContact O-CG 2.99Å; K541-L545 PolarHBondContact O-N 3.23Å; R542-L545 CarbonylContact O-C 3.59Å; R542-L545 PolarHBondContact O-N 2.91Å; E543-L545 VanDerWaalsContact C-N 3.32Å; E543-L545 PolarHBondContact O-N 3.38Å
546	A	93.1	Very high	91	Very high	60 Å²	60	97.3 Å²	97.3	50%	0.496	46%	0.458	S	S	.	.	H	α-helix	trans	-87.1	-32.2	176.6	0	0	0	0	0	111.9	N332 R542 E543 E544	N332-A546 PolarHBondContact OD1-N 2.78Å; R542-A546 WeakPolarHBondContact O-CB 3.5Å; R542-A546 PolarHBondContact O-N 3.44Å; E543-A546 WeakPolarHBondContact O-CB 3.28Å; E543-A546 PolarHBondContact O-N 2.87Å; E543-A546 VanDerWaalsContact O-N 3.11Å; E544-A546 VanDerWaalsContact C-N 3.29Å; E544-A546 PolarHBondContact O-N 2.83Å
547	Q	94.3	Very high	90.9	Very high	113 Å²	113	99.9 Å²	99.9	53%	0.528	46%	0.463	S	S	.	.	H	α-helix	trans	-102.9	-22.2	-150.2	-159.9	169.7	-100.5	0	0	116.2	E331 N332 V549 A550 E551	E331-Q547 HydrophobicContact CB-CB 4.28Å; E331-Q547 HydrophobicContact CG-CB 4.43Å; E331-Q547 WeakPolarHBondContact OE1-CB 3.3Å; E331-Q547 WeakPolarHBondContact OE1-CG 3.32Å; E331-Q547 PolarHBondContact OE1-NE2 2.85Å; N332-Q547 PolarHBondContact OD1-N 3.35Å; Q547-V549 PolarHBondContact O-N 2.73Å; Q547-A550 HydrophobicContact CG-CB 4.25Å; Q547-A550 CarbonylContact O-C 3.53Å; Q547-A550 VanDerWaalsContact O-C 3.29Å; Q547-A550 WeakPolarHBondContact O-CA 3.37Å; Q547-A550 WeakPolarHBondContact O-CB 3.42Å; Q547-A550 PolarHBondContact O-N 3.25Å; Q547-E551 PolarHBondContact O-N 2.69Å
548	R	92.8	Very high	90.7	Very high	91 Å²	91	100.9 Å²	100.9	34%	0.343	47%	0.465	S	S	.	.	H	α-helix	trans	-69	-30.3	160.9	-60.1	-71.5	-164.5	172.5	9.9	110	R330 E331 N332 A550 E551 E552	R330-R548 VanDerWaalsContact CB-NH2 3.25Å; R330-R548 PolarHBondContact O-NE 3.27Å; R330-R548 PolarHBondContact O-NH2 3.1Å; E331-R548 HydrophobicContact CB-CG 3.85Å; E331-R548 HydrophobicContact CG-CG 3.78Å; E331-R548 WeakPolarHBondContact O-CG 3.23Å; E331-R548 PolarHBondContact O-NE 2.94Å; E331-R548 VanDerWaalsContact OE2-CA 3.26Å; E331-R548 WeakPolarHBondContact OE2-CA 3.39Å; E331-R548 PolarHBondContact OE2-N 3.33Å; N332-R548 HydrophobicContact CB-CB 3.53Å; N332-R548 HydrophobicContact CB-CG 3.6Å; N332-R548 PolarHBondContact OD1-N 2.89Å; R548-A550 CarbonylContact O-C 3.58Å; R548-A550 VanDerWaalsContact O-C 3.3Å; R548-A550 PolarHBondContact O-N 2.82Å; R548-E551 IonicContact CZ-OE2 2.67Å; R548-E551 IonicContact NE-OE2 3.8Å; R548-E551 IonicContact NH1-OE2 3.31Å; R548-E551 PolarHBondContact NH1-OE2 3.19Å; R548-E551 CarbonylContact O-C 3.29Å; R548-E551 PolarHBondContact O-N 3.46Å; R548-E552 WeakPolarHBondContact O-CA 3.23Å; R548-E552 WeakPolarHBondContact O-CB 3.46Å; R548-E552 PolarHBondContact O-N 3.18Å
549	V	93.1	Very high	90.7	Very high	49 Å²	49	99.3 Å²	99.3	30%	0.297	46%	0.457	S	S	.	.	H	α-helix	trans	-62.9	-4.4	167.3	163.6	0	0	0	0	111.2	N332 Q547 R553	N332-V549 WeakPolarHBondContact ND2-CG2 3.35Å; N332-V549 PolarHBondContact ND2-N 3.49Å; Q547-V549 PolarHBondContact O-N 2.73Å; V549-R553 WeakPolarHBondContact O-CD 3.21Å; V549-R553 VanDerWaalsContact O-CG 3.26Å; V549-R553 WeakPolarHBondContact O-CG 3.32Å; V549-R553 PolarHBondContact O-NE 2.77Å; V549-R553 PolarHBondContact O-NH1 3.09Å
550	A	90.5	Very high	90.5	Very high	45 Å²	45	96.3 Å²	96.3	37%	0.372	45%	0.45	S	S	.	.	H	α-helix	trans	-97	-47.1	150.5	0	0	0	0	0	114.8	Q547 R548 R553 T554	Q547-A550 HydrophobicContact CG-CB 4.25Å; Q547-A550 CarbonylContact O-C 3.53Å; Q547-A550 VanDerWaalsContact O-C 3.29Å; Q547-A550 WeakPolarHBondContact O-CA 3.37Å; Q547-A550 WeakPolarHBondContact O-CB 3.42Å; Q547-A550 PolarHBondContact O-N 3.25Å; R548-A550 CarbonylContact O-C 3.58Å; R548-A550 VanDerWaalsContact O-C 3.3Å; R548-A550 PolarHBondContact O-N 2.82Å; A550-R553 CarbonylContact O-C 3.6Å; A550-R553 VanDerWaalsContact O-C 3.25Å; A550-R553 VanDerWaalsContact O-CA 3.22Å; A550-R553 WeakPolarHBondContact O-CA 3.49Å; A550-R553 VanDerWaalsContact O-CB 3.23Å; A550-R553 WeakPolarHBondContact O-CB 3.44Å; A550-R553 PolarHBondContact O-N 3.31Å; A550-T554 PolarHBondContact O-N 3.19Å
551	E	89.3	Confident	90.3	Very high	24 Å²	24	93.9 Å²	93.9	11%	0.112	45%	0.446	C	S	.	.	H	α-helix	trans	-69.4	-43.2	-179.1	-69.5	-176.6	171.9	0	0	115.7	R330 E331 Q547 R548 R553 T554 T555	R330-E551 WeakPolarHBondContact CD-OE1 3.38Å; R330-E551 WeakPolarHBondContact CD-OE2 3.4Å; R330-E551 VanDerWaalsContact CG-OE2 3.28Å; R330-E551 WeakPolarHBondContact CG-OE2 3.17Å; R330-E551 IonicContact CZ-OE1 2.68Å; R330-E551 IonicContact CZ-OE2 2.71Å; R330-E551 IonicContact NE-OE1 3.31Å; R330-E551 PolarHBondContact NE-OE1 2.81Å; R330-E551 IonicContact NE-OE2 2.66Å; R330-E551 PolarHBondContact NE-OE2 2.87Å; R330-E551 VanDerWaalsContact NE-OE2 3.09Å; R330-E551 IonicContact NH2-OE1 3.16Å; R330-E551 PolarHBondContact NH2-OE1 3.27Å; R330-E551 IonicContact NH2-OE2 2.89Å; E331-E551 WeakPolarHBondContact OE2-CG 3.45Å; Q547-E551 PolarHBondContact O-N 2.69Å; R548-E551 IonicContact CZ-OE2 2.67Å; R548-E551 IonicContact NE-OE2 3.8Å; R548-E551 IonicContact NH1-OE2 3.31Å; R548-E551 PolarHBondContact NH1-OE2 3.19Å; R548-E551 CarbonylContact O-C 3.29Å; R548-E551 PolarHBondContact O-N 3.46Å; E551-R553 PolarHBondContact O-N 2.74Å; E551-T554 CarbonylContact O-C 3.54Å; E551-T554 WeakPolarHBondContact O-CA 3.48Å; E551-T554 PolarHBondContact O-N 2.77Å; E551-T554 PolarHBondContact O-OG1 3.14Å; E551-T554 VanDerWaalsContact O-OG1 3.09Å; E551-T555 WeakPolarHBondContact O-CG2 3.42Å; E551-T555 PolarHBondContact O-N 3.16Å; E551-T555 PolarHBondContact O-OG1 3.27Å
552	E	88.9	Confident	90.4	Very high	115 Å²	115	96.4 Å²	96.4	54%	0.537	45%	0.452	S	S	.	.	H	α-helix	trans	-50.5	-26.4	162.1	-167.8	-151.3	128.3	0	0	111.2	R548 T555 R556	R548-E552 WeakPolarHBondContact O-CA 3.23Å; R548-E552 WeakPolarHBondContact O-CB 3.46Å; R548-E552 PolarHBondContact O-N 3.18Å; E552-T555 WeakPolarHBondContact CA-OG1 3.29Å; E552-R556 WeakPolarHBondContact O-CB 3.4Å; E552-R556 PolarHBondContact O-N 3.21Å
553	R	85.6	Confident	90.6	Very high	113 Å²	113	95.6 Å²	95.6	43%	0.426	45%	0.449	S	S	.	.	H	α-helix	trans	-91.5	-12.1	171.8	-57.2	-178.2	-169	149.2	2.7	114.5	V549 A550 E551 R557	V549-R553 WeakPolarHBondContact O-CD 3.21Å; V549-R553 VanDerWaalsContact O-CG 3.26Å; V549-R553 WeakPolarHBondContact O-CG 3.32Å; V549-R553 PolarHBondContact O-NE 2.77Å; V549-R553 PolarHBondContact O-NH1 3.09Å; A550-R553 CarbonylContact O-C 3.6Å; A550-R553 VanDerWaalsContact O-C 3.25Å; A550-R553 VanDerWaalsContact O-CA 3.22Å; A550-R553 WeakPolarHBondContact O-CA 3.49Å; A550-R553 VanDerWaalsContact O-CB 3.23Å; A550-R553 WeakPolarHBondContact O-CB 3.44Å; A550-R553 PolarHBondContact O-N 3.31Å; E551-R553 PolarHBondContact O-N 2.74Å; R553-R557 WeakPolarHBondContact O-CD 3.49Å; R553-R557 WeakPolarHBondContact O-CG 3.38Å
554	T	87.5	Confident	90.8	Very high	52 Å²	52	95.8 Å²	95.8	32%	0.319	45%	0.452	S	S	.	.	H	α-helix	trans	-89.1	-52.2	167.7	67.3	0	0	0	0	109.2	A550 E551 R556 R557 E558	A550-T554 PolarHBondContact O-N 3.19Å; E551-T554 CarbonylContact O-C 3.54Å; E551-T554 WeakPolarHBondContact O-CA 3.48Å; E551-T554 PolarHBondContact O-N 2.77Å; E551-T554 PolarHBondContact O-OG1 3.14Å; E551-T554 VanDerWaalsContact O-OG1 3.09Å; T554-R556 VanDerWaalsContact C-N 3.3Å; T554-R556 PolarHBondContact O-N 3.42Å; T554-R557 CarbonylContact O-C 3.59Å; T554-R557 WeakPolarHBondContact O-CA 3.18Å; T554-R557 WeakPolarHBondContact O-CB 3.35Å; T554-R557 PolarHBondContact O-N 3.37Å; T554-E558 VanDerWaalsContact CB-OE1 3.25Å; T554-E558 WeakPolarHBondContact CB-OE1 3.31Å; T554-E558 WeakPolarHBondContact O-CB 3.39Å; T554-E558 VanDerWaalsContact O-CD 3.32Å; T554-E558 VanDerWaalsContact O-CG 3.29Å; T554-E558 WeakPolarHBondContact O-CG 3.18Å; T554-E558 PolarHBondContact O-N 2.67Å; T554-E558 PolarHBondContact OG1-OE1 3.45Å
555	T	90.2	Very high	90.8	Very high	76 Å²	76	97.3 Å²	97.3	47%	0.466	46%	0.459	S	S	.	.	H	α-helix	trans	-56.4	-40	174	63.6	0	0	0	0	112.2	E551 E552 R557 E558 E559	E551-T555 WeakPolarHBondContact O-CG2 3.42Å; E551-T555 PolarHBondContact O-N 3.16Å; E551-T555 PolarHBondContact O-OG1 3.27Å; E552-T555 WeakPolarHBondContact CA-OG1 3.29Å; T555-R557 PolarHBondContact O-N 3.31Å; T555-E558 PolarHBondContact O-N 3.18Å; T555-E559 VanDerWaalsContact O-CB 3.25Å; T555-E559 WeakPolarHBondContact O-CB 3.41Å; T555-E559 PolarHBondContact O-N 2.76Å
556	R	91.6	Very high	91.3	Very high	147 Å²	147	96.9 Å²	96.9	56%	0.555	46%	0.464	S	S	*	.	H	α-helix	trans	-64.2	-36.5	171.8	176.7	179.2	164.3	141.8	12.2	113.1	E552 T554 E560	E552-R556 WeakPolarHBondContact O-CB 3.4Å; E552-R556 PolarHBondContact O-N 3.21Å; T554-R556 VanDerWaalsContact C-N 3.3Å; T554-R556 PolarHBondContact O-N 3.42Å; R556-E560 HydrophobicContact CG-CG 4.4Å; R556-E560 IonicContact CZ-OE1 3.71Å; R556-E560 IonicContact NE-OE1 3.25Å; R556-E560 PolarHBondContact NE-OE1 3.04Å; R556-E560 IonicContact NH2-OE1 3.9Å; R556-E560 PolarHBondContact NH2-OE1 3.34Å; R556-E560 VanDerWaalsContact O-CB 3.3Å; R556-E560 WeakPolarHBondContact O-CB 3.27Å; R556-E560 VanDerWaalsContact O-CG 3.23Å; R556-E560 WeakPolarHBondContact O-CG 3.42Å; R556-E560 PolarHBondContact O-N 3.5Å
557	R	88.4	Confident	91.3	Very high	168 Å²	168	100.2 Å²	100.2	63%	0.634	47%	0.469	S	S	*	.	H	α-helix	trans	-71.9	-39.2	176.3	-75.2	170.3	-178.5	165.9	-3.6	111.6	R553 T554 T555 E559 E560 S561	R553-R557 WeakPolarHBondContact O-CD 3.49Å; R553-R557 WeakPolarHBondContact O-CG 3.38Å; T554-R557 CarbonylContact O-C 3.59Å; T554-R557 WeakPolarHBondContact O-CA 3.18Å; T554-R557 WeakPolarHBondContact O-CB 3.35Å; T554-R557 PolarHBondContact O-N 3.37Å; T555-R557 PolarHBondContact O-N 3.31Å; R557-E559 VanDerWaalsContact C-N 3.31Å; R557-E560 PolarHBondContact O-N 3.43Å; R557-S561 PolarHBondContact O-N 2.69Å; R557-S561 PolarHBondContact O-OG 3Å; R557-S561 VanDerWaalsContact O-OG 3.1Å
558	E	90.6	Very high	91.3	Very high	110 Å²	110	99.8 Å²	99.8	51%	0.514	47%	0.467	S	S	.	.	H	α-helix	trans	-65	-36.7	174.5	-69.2	151.4	-151	0	0	110.5	T554 T555 S561 R562	T554-E558 VanDerWaalsContact CB-OE1 3.25Å; T554-E558 WeakPolarHBondContact CB-OE1 3.31Å; T554-E558 WeakPolarHBondContact O-CB 3.39Å; T554-E558 VanDerWaalsContact O-CD 3.32Å; T554-E558 VanDerWaalsContact O-CG 3.29Å; T554-E558 WeakPolarHBondContact O-CG 3.18Å; T554-E558 PolarHBondContact O-N 2.67Å; T554-E558 PolarHBondContact OG1-OE1 3.45Å; T555-E558 PolarHBondContact O-N 3.18Å; E558-S561 WeakPolarHBondContact CA-OG 3.43Å; E558-S561 PolarHBondContact O-OG 3.31Å; E558-R562 WeakPolarHBondContact O-CB 3.4Å; E558-R562 PolarHBondContact O-N 2.9Å
559	E	91.3	Very high	91.4	Very high	93 Å²	93	98 Å²	98	44%	0.435	47%	0.472	S	S	.	.	H	α-helix	trans	-71.8	-42.6	171.9	-161.2	-160.8	148.8	0	0	111.8	T555 R557 S561 R562 R563	T555-E559 VanDerWaalsContact O-CB 3.25Å; T555-E559 WeakPolarHBondContact O-CB 3.41Å; T555-E559 PolarHBondContact O-N 2.76Å; R557-E559 VanDerWaalsContact C-N 3.31Å; E559-S561 VanDerWaalsContact C-N 3.33Å; E559-S561 PolarHBondContact O-N 3.26Å; E559-R562 PolarHBondContact O-N 2.87Å; E559-R563 WeakPolarHBondContact O-CB 3.45Å; E559-R563 WeakPolarHBondContact O-CD 3.23Å; E559-R563 WeakPolarHBondContact O-CG 3.36Å; E559-R563 PolarHBondContact O-N 2.94Å; E559-R563 IonicContact OE1-CZ 3.46Å; E559-R563 IonicContact OE1-NE 2.69Å; E559-R563 PolarHBondContact OE1-NE 2.8Å; E559-R563 IonicContact OE1-NH2 3.67Å; E559-R563 PolarHBondContact OE1-NH2 3.27Å
560	E	88.9	Confident	91.5	Very high	85 Å²	85	104.6 Å²	104.6	40%	0.397	49%	0.492	S	S	.	.	H	α-helix	trans	-60.9	-39.9	173.2	-77.7	169.3	175.8	0	0	111.1	R556 R557 L564	R556-E560 HydrophobicContact CG-CG 4.4Å; R556-E560 IonicContact CZ-OE1 3.71Å; R556-E560 IonicContact NE-OE1 3.25Å; R556-E560 PolarHBondContact NE-OE1 3.04Å; R556-E560 IonicContact NH2-OE1 3.9Å; R556-E560 PolarHBondContact NH2-OE1 3.34Å; R556-E560 VanDerWaalsContact O-CB 3.3Å; R556-E560 WeakPolarHBondContact O-CB 3.27Å; R556-E560 VanDerWaalsContact O-CG 3.23Å; R556-E560 WeakPolarHBondContact O-CG 3.42Å; R556-E560 PolarHBondContact O-N 3.5Å; R557-E560 PolarHBondContact O-N 3.43Å; E560-L564 WeakPolarHBondContact O-CG 3.33Å; E560-L564 PolarHBondContact O-N 2.87Å
561	S	91	Very high	91.7	Very high	65 Å²	65	107.8 Å²	107.8	46%	0.455	50%	0.499	S	S	.	.	H	α-helix	trans	-71.1	-40.4	172.4	56.7	0	0	0	0	113	R557 E558 E559 R563 L564 E565	R557-S561 PolarHBondContact O-N 2.69Å; R557-S561 PolarHBondContact O-OG 3Å; R557-S561 VanDerWaalsContact O-OG 3.1Å; E558-S561 WeakPolarHBondContact CA-OG 3.43Å; E558-S561 PolarHBondContact O-OG 3.31Å; E559-S561 VanDerWaalsContact C-N 3.33Å; E559-S561 PolarHBondContact O-N 3.26Å; S561-R563 VanDerWaalsContact C-N 3.28Å; S561-R563 PolarHBondContact O-N 3.43Å; S561-L564 PolarHBondContact O-N 3.37Å; S561-E565 WeakPolarHBondContact O-CB 3.15Å; S561-E565 PolarHBondContact O-N 3.45Å
562	R	94.2	Very high	92	Very high	184 Å²	184	112.1 Å²	112.1	69%	0.694	52%	0.517	S	S	*	.	H	α-helix	trans	-66.5	-30.4	177.3	-175.6	179.9	178.5	-156.3	-0.9	112.1	E558 E559 A566	E558-R562 WeakPolarHBondContact O-CB 3.4Å; E558-R562 PolarHBondContact O-N 2.9Å; E559-R562 PolarHBondContact O-N 2.87Å; R562-A566 WeakPolarHBondContact O-CB 3.41Å; R562-A566 PolarHBondContact O-N 2.86Å
563	R	95.4	Very high	92.2	Very high	159 Å²	159	111.9 Å²	111.9	60%	0.6	52%	0.516	S	S	*	.	H	α-helix	trans	-65.5	-47.9	170.9	-76.8	165.4	177.6	-118.5	6.6	110.8	E559 S561 E565 A566 E567	E559-R563 WeakPolarHBondContact O-CB 3.45Å; E559-R563 WeakPolarHBondContact O-CD 3.23Å; E559-R563 WeakPolarHBondContact O-CG 3.36Å; E559-R563 PolarHBondContact O-N 2.94Å; E559-R563 IonicContact OE1-CZ 3.46Å; E559-R563 IonicContact OE1-NE 2.69Å; E559-R563 PolarHBondContact OE1-NE 2.8Å; E559-R563 IonicContact OE1-NH2 3.67Å; E559-R563 PolarHBondContact OE1-NH2 3.27Å; S561-R563 VanDerWaalsContact C-N 3.28Å; S561-R563 PolarHBondContact O-N 3.43Å; R563-E565 VanDerWaalsContact C-N 3.35Å; R563-E565 PolarHBondContact O-N 2.84Å; R563-A566 PolarHBondContact O-N 3.43Å; R563-E567 VanDerWaalsContact O-CB 3.31Å; R563-E567 WeakPolarHBondContact O-CB 3.45Å; R563-E567 PolarHBondContact O-N 2.89Å
564	L	95	Very high	92.6	Very high	102 Å²	102	111 Å²	111	53%	0.534	52%	0.517	S	S	.	.	H	α-helix	trans	-63.4	-38.6	175.5	-68.4	169.2	0	0	0	112.5	E560 S561 E567 Q568	E560-L564 WeakPolarHBondContact O-CG 3.33Å; E560-L564 PolarHBondContact O-N 2.87Å; S561-L564 PolarHBondContact O-N 3.37Å; L564-E567 PolarHBondContact O-N 2.97Å; L564-Q568 WeakPolarHBondContact O-CG 3.18Å; L564-Q568 PolarHBondContact O-N 3.12Å
565	E	93.7	Very high	93	Very high	136 Å²	136	113 Å²	113	64%	0.636	52%	0.523	S	S	*	.	H	α-helix	trans	-65.3	-44.3	174.6	-175.2	178.9	-163.3	0	0	111.5	S561 R563 E567 Q568 A569	S561-E565 WeakPolarHBondContact O-CB 3.15Å; S561-E565 PolarHBondContact O-N 3.45Å; R563-E565 VanDerWaalsContact C-N 3.35Å; R563-E565 PolarHBondContact O-N 2.84Å; E565-E567 VanDerWaalsContact C-N 3.34Å; E565-E567 PolarHBondContact O-N 2.71Å; E565-Q568 PolarHBondContact O-N 2.9Å; E565-A569 VanDerWaalsContact O-CB 3.28Å; E565-A569 WeakPolarHBondContact O-CB 3.37Å; E565-A569 PolarHBondContact O-N 3.45Å
566	A	92.4	Very high	93.3	Very high	48 Å²	48	114.8 Å²	114.8	40%	0.397	53%	0.528	S	S	.	.	H	α-helix	trans	-67.6	-31.6	175.7	0	0	0	0	0	113	R562 R563 R570	R562-A566 WeakPolarHBondContact O-CB 3.41Å; R562-A566 PolarHBondContact O-N 2.86Å; R563-A566 PolarHBondContact O-N 3.43Å; A566-R570 WeakPolarHBondContact O-CB 3.42Å; A566-R570 VanDerWaalsContact O-CG 3.3Å; A566-R570 WeakPolarHBondContact O-CG 3.42Å; A566-R570 PolarHBondContact O-N 2.81Å
567	E	92.3	Very high	93.4	Very high	129 Å²	129	113 Å²	113	60%	0.603	53%	0.527	S	S	*	.	H	α-helix	trans	-68.6	-47.2	173.7	-171.9	168.1	-157.8	0	0	110.8	R563 L564 E565 A569 R570 E571	R563-E567 VanDerWaalsContact O-CB 3.31Å; R563-E567 WeakPolarHBondContact O-CB 3.45Å; R563-E567 PolarHBondContact O-N 2.89Å; L564-E567 PolarHBondContact O-N 2.97Å; E565-E567 VanDerWaalsContact C-N 3.34Å; E565-E567 PolarHBondContact O-N 2.71Å; E567-A569 VanDerWaalsContact C-N 3.32Å; E567-A569 PolarHBondContact O-N 3.42Å; E567-R570 PolarHBondContact O-N 3.18Å; E567-E571 PolarHBondContact O-N 3.3Å
568	Q	93.8	Very high	93.8	Very high	105 Å²	105	112.3 Å²	112.3	49%	0.491	52%	0.524	S	S	.	.	H	α-helix	trans	-64.8	-33	171.9	-72	-175.5	20.8	0	0	113.3	L564 E565 K572	L564-Q568 WeakPolarHBondContact O-CG 3.18Å; L564-Q568 PolarHBondContact O-N 3.12Å; E565-Q568 PolarHBondContact O-N 2.9Å; Q568-K572 WeakPolarHBondContact O-CB 3.4Å; Q568-K572 WeakPolarHBondContact O-CD 3.39Å; Q568-K572 WeakPolarHBondContact O-CG 3.47Å; Q568-K572 PolarHBondContact O-N 3.01Å
569	A	95.2	Very high	93.9	Very high	53 Å²	53	111 Å²	111	44%	0.438	52%	0.518	S	S	.	.	H	α-helix	trans	-65.9	-43.8	174.7	0	0	0	0	0	110.7	E565 E567 K572 E573	E565-A569 VanDerWaalsContact O-CB 3.28Å; E565-A569 WeakPolarHBondContact O-CB 3.37Å; E565-A569 PolarHBondContact O-N 3.45Å; E567-A569 VanDerWaalsContact C-N 3.32Å; E567-A569 PolarHBondContact O-N 3.42Å; A569-K572 PolarHBondContact O-N 3.15Å; A569-E573 WeakPolarHBondContact O-CB 3.36Å; A569-E573 PolarHBondContact O-N 2.88Å
570	R	95.6	Very high	94.1	Very high	188 Å²	188	109.2 Å²	109.2	71%	0.709	52%	0.519	S	S	*	.	H	α-helix	trans	-63.2	-42	173.5	-77	173.3	173.2	-156.6	-4.3	112.7	A566 E567 K572 E573 E574	A566-R570 WeakPolarHBondContact O-CB 3.42Å; A566-R570 VanDerWaalsContact O-CG 3.3Å; A566-R570 WeakPolarHBondContact O-CG 3.42Å; A566-R570 PolarHBondContact O-N 2.81Å; E567-R570 PolarHBondContact O-N 3.18Å; R570-K572 VanDerWaalsContact C-N 3.34Å; R570-K572 PolarHBondContact O-N 2.86Å; R570-E573 PolarHBondContact O-N 2.78Å; R570-E574 WeakPolarHBondContact O-CB 3.39Å; R570-E574 PolarHBondContact O-N 3.31Å
571	E	95.5	Very high	94.3	Very high	111 Å²	111	111.3 Å²	111.3	52%	0.519	53%	0.529	S	S	.	.	H	α-helix	trans	-62	-43.5	176.5	-164.5	-165.6	164.2	0	0	111.2	E567 E574 Q575	E567-E571 PolarHBondContact O-N 3.3Å; E571-E574 PolarHBondContact O-N 3.14Å; E571-Q575 WeakPolarHBondContact O-CB 3.42Å; E571-Q575 VanDerWaalsContact O-CG 3.25Å; E571-Q575 WeakPolarHBondContact O-CG 3.49Å; E571-Q575 PolarHBondContact O-N 3.09Å; E571-Q575 PolarHBondContact OE1-NE2 3.08Å
572	K	95.3	Very high	94.5	Very high	115 Å²	115	112.8 Å²	112.8	50%	0.5	53%	0.528	S	S	.	.	H	α-helix	trans	-65.6	-40.5	175.3	-70.6	163.6	-170.2	165.3	0	112.1	Q568 A569 R570 Q575 L576	Q568-K572 WeakPolarHBondContact O-CB 3.4Å; Q568-K572 WeakPolarHBondContact O-CD 3.39Å; Q568-K572 WeakPolarHBondContact O-CG 3.47Å; Q568-K572 PolarHBondContact O-N 3.01Å; A569-K572 PolarHBondContact O-N 3.15Å; R570-K572 VanDerWaalsContact C-N 3.34Å; R570-K572 PolarHBondContact O-N 2.86Å; K572-Q575 PolarHBondContact O-N 2.88Å; K572-L576 WeakPolarHBondContact O-CB 3.48Å; K572-L576 VanDerWaalsContact O-CG 3.29Å; K572-L576 WeakPolarHBondContact O-CG 3.3Å; K572-L576 PolarHBondContact O-N 3.03Å
573	E	92.4	Very high	94.5	Very high	110 Å²	110	111.5 Å²	111.5	51%	0.514	52%	0.524	S	S	.	.	H	α-helix	trans	-63.3	-45.3	175.4	-165.3	-172.3	158.3	0	0	110.9	A569 R570 L576 Q577	A569-E573 WeakPolarHBondContact O-CB 3.36Å; A569-E573 PolarHBondContact O-N 2.88Å; R570-E573 PolarHBondContact O-N 2.78Å; E573-L576 CarbonylContact O-C 3.25Å; E573-L576 PolarHBondContact O-N 3.2Å; E573-Q577 WeakPolarHBondContact O-CB 3.45Å; E573-Q577 VanDerWaalsContact O-CG 3.3Å; E573-Q577 WeakPolarHBondContact O-CG 3.12Å; E573-Q577 PolarHBondContact O-N 3.12Å; E573-Q577 PolarHBondContact OE1-NE2 3.25Å
574	E	94.8	Very high	94.5	Very high	94 Å²	94	105.6 Å²	105.6	44%	0.439	51%	0.509	S	S	.	.	H	α-helix	trans	-65	-40.3	176.9	-167.2	-175.6	163.6	0	0	111.8	R570 E571 L576 Q577 R578	R570-E574 WeakPolarHBondContact O-CB 3.39Å; R570-E574 PolarHBondContact O-N 3.31Å; E571-E574 PolarHBondContact O-N 3.14Å; E574-L576 VanDerWaalsContact C-N 3.33Å; E574-L576 PolarHBondContact O-N 3.5Å; E574-Q577 PolarHBondContact O-N 3.34Å; E574-R578 WeakPolarHBondContact O-CB 3.48Å; E574-R578 VanDerWaalsContact O-CG 3.25Å; E574-R578 WeakPolarHBondContact O-CG 3.38Å; E574-R578 PolarHBondContact O-N 2.68Å; E574-R578 IonicContact OE1-CZ 2.78Å; E574-R578 VanDerWaalsContact OE1-CZ 3.25Å; E574-R578 IonicContact OE1-NE 3.12Å; E574-R578 PolarHBondContact OE1-NE 2.78Å; E574-R578 VanDerWaalsContact OE1-NE 3.15Å; E574-R578 IonicContact OE1-NH2 2.67Å; E574-R578 PolarHBondContact OE1-NH2 3.33Å
575	Q	94.6	Very high	94.5	Very high	95 Å²	95	105.3 Å²	105.3	44%	0.444	51%	0.507	S	S	.	.	H	α-helix	trans	-62	-39.8	172.9	-73.6	176.2	23.5	0	0	111.9	E571 K572 Q579	E571-Q575 WeakPolarHBondContact O-CB 3.42Å; E571-Q575 VanDerWaalsContact O-CG 3.25Å; E571-Q575 WeakPolarHBondContact O-CG 3.49Å; E571-Q575 PolarHBondContact O-N 3.09Å; E571-Q575 PolarHBondContact OE1-NE2 3.08Å; K572-Q575 PolarHBondContact O-N 2.88Å; Q575-Q579 WeakPolarHBondContact O-CG 3.39Å; Q575-Q579 PolarHBondContact O-N 2.86Å
576	L	96.4	Very high	94.6	Very high	113 Å²	113	105.6 Å²	105.6	59%	0.592	50%	0.502	S	S	*	.	H	α-helix	trans	-70	-39.3	174.8	-72.7	170.3	0	0	0	112.2	K572 E573 E574 Q579 A580	K572-L576 WeakPolarHBondContact O-CB 3.48Å; K572-L576 VanDerWaalsContact O-CG 3.29Å; K572-L576 WeakPolarHBondContact O-CG 3.3Å; K572-L576 PolarHBondContact O-N 3.03Å; E573-L576 CarbonylContact O-C 3.25Å; E573-L576 PolarHBondContact O-N 3.2Å; E574-L576 VanDerWaalsContact C-N 3.33Å; E574-L576 PolarHBondContact O-N 3.5Å; L576-Q579 PolarHBondContact O-N 3.41Å; L576-A580 WeakPolarHBondContact O-CB 3.45Å; L576-A580 PolarHBondContact O-N 2.75Å
577	Q	94.5	Very high	94.7	Very high	110 Å²	110	110 Å²	110	51%	0.514	52%	0.515	S	S	.	.	H	α-helix	trans	-63.1	-45.1	174.7	-74.1	178.5	17.6	0	0	111	E573 E574 Q579 A580 E581	E573-Q577 WeakPolarHBondContact O-CB 3.45Å; E573-Q577 VanDerWaalsContact O-CG 3.3Å; E573-Q577 WeakPolarHBondContact O-CG 3.12Å; E573-Q577 PolarHBondContact O-N 3.12Å; E573-Q577 PolarHBondContact OE1-NE2 3.25Å; E574-Q577 PolarHBondContact O-N 3.34Å; Q577-Q579 PolarHBondContact O-N 3.27Å; Q577-A580 PolarHBondContact O-N 3.32Å; Q577-A580 VanDerWaalsContact O-N 3.14Å; Q577-E581 WeakPolarHBondContact O-CB 3.42Å; Q577-E581 PolarHBondContact O-N 3.16Å
578	R	96.1	Very high	94.7	Very high	154 Å²	154	112.4 Å²	112.4	58%	0.581	52%	0.518	S	S	*	.	H	α-helix	trans	-60.6	-42.1	174.4	-71.1	171	-177.7	-158.8	3.9	112	E574 E581 E582	E574-R578 WeakPolarHBondContact O-CB 3.48Å; E574-R578 VanDerWaalsContact O-CG 3.25Å; E574-R578 WeakPolarHBondContact O-CG 3.38Å; E574-R578 PolarHBondContact O-N 2.68Å; E574-R578 IonicContact OE1-CZ 2.78Å; E574-R578 VanDerWaalsContact OE1-CZ 3.25Å; E574-R578 IonicContact OE1-NE 3.12Å; E574-R578 PolarHBondContact OE1-NE 2.78Å; E574-R578 VanDerWaalsContact OE1-NE 3.15Å; E574-R578 IonicContact OE1-NH2 2.67Å; E574-R578 PolarHBondContact OE1-NH2 3.33Å; R578-E581 PolarHBondContact O-N 3.34Å; R578-E582 WeakPolarHBondContact O-CB 3.45Å; R578-E582 PolarHBondContact O-N 2.9Å
579	Q	94.1	Very high	94.7	Very high	83 Å²	83	112 Å²	112	39%	0.388	52%	0.517	S	S	.	.	H	α-helix	trans	-66.1	-35.8	173.5	-76	-172.9	38.7	0	0	112.9	Q575 L576 Q577 R583	Q575-Q579 WeakPolarHBondContact O-CG 3.39Å; Q575-Q579 PolarHBondContact O-N 2.86Å; L576-Q579 PolarHBondContact O-N 3.41Å; Q577-Q579 PolarHBondContact O-N 3.27Å; Q579-R583 WeakPolarHBondContact O-CB 3.24Å; Q579-R583 WeakPolarHBondContact O-CD 3.23Å; Q579-R583 WeakPolarHBondContact O-CG 3.43Å; Q579-R583 PolarHBondContact O-N 3.29Å
580	A	94.2	Very high	94.7	Very high	55 Å²	55	115.8 Å²	115.8	46%	0.455	53%	0.525	S	S	.	.	H	α-helix	trans	-70.3	-39.5	176.7	0	0	0	0	0	111.6	L576 Q577 R583 A584	L576-A580 WeakPolarHBondContact O-CB 3.45Å; L576-A580 PolarHBondContact O-N 2.75Å; Q577-A580 PolarHBondContact O-N 3.32Å; Q577-A580 VanDerWaalsContact O-N 3.14Å; A580-R583 PolarHBondContact O-N 2.96Å; A580-A584 VanDerWaalsContact O-CB 3.29Å; A580-A584 WeakPolarHBondContact O-CB 3.32Å; A580-A584 PolarHBondContact O-N 3.43Å
581	E	94.8	Very high	94.6	Very high	129 Å²	129	109.1 Å²	109.1	60%	0.603	51%	0.51	S	S	*	.	H	α-helix	trans	-64.1	-44.9	173.4	-175.5	172.2	-157	0	0	111.3	Q577 R578 R583 A584 L585	Q577-E581 WeakPolarHBondContact O-CB 3.42Å; Q577-E581 PolarHBondContact O-N 3.16Å; R578-E581 PolarHBondContact O-N 3.34Å; E581-R583 PolarHBondContact O-N 3.31Å; E581-A584 PolarHBondContact O-N 2.77Å; E581-L585 HydrophobicContact CG-CD1 4.31Å; E581-L585 WeakPolarHBondContact O-CG 3.34Å; E581-L585 PolarHBondContact O-N 3.04Å
582	E	93.4	Very high	94.6	Very high	95 Å²	95	108.2 Å²	108.2	44%	0.444	51%	0.506	S	S	.	.	H	α-helix	trans	-60.7	-43.7	175.3	-164.6	-164.2	153.7	0	0	111.9	R578 L585 R586	R578-E582 WeakPolarHBondContact O-CB 3.45Å; R578-E582 PolarHBondContact O-N 2.9Å; E582-L585 PolarHBondContact O-N 2.86Å; E582-R586 WeakPolarHBondContact O-CG 3.48Å; E582-R586 PolarHBondContact O-N 3.27Å; E582-R586 IonicContact OE1-CZ 2.67Å; E582-R586 VanDerWaalsContact OE1-CZ 3.31Å; E582-R586 IonicContact OE1-NE 3.15Å; E582-R586 PolarHBondContact OE1-NE 2.81Å; E582-R586 VanDerWaalsContact OE1-NE 3.16Å; E582-R586 IonicContact OE1-NH2 2.74Å; E582-R586 PolarHBondContact OE1-NH2 3.46Å
583	R	95.4	Very high	94.5	Very high	158 Å²	158	109.2 Å²	109.2	60%	0.596	51%	0.506	S	S	*	.	H	α-helix	trans	-63.4	-42	174.8	-70	170.4	-154.5	-160.2	9	111.7	Q579 A580 E581 L585 R586 E587	Q579-R583 WeakPolarHBondContact O-CB 3.24Å; Q579-R583 WeakPolarHBondContact O-CD 3.23Å; Q579-R583 WeakPolarHBondContact O-CG 3.43Å; Q579-R583 PolarHBondContact O-N 3.29Å; A580-R583 PolarHBondContact O-N 2.96Å; E581-R583 PolarHBondContact O-N 3.31Å; R583-L585 VanDerWaalsContact C-N 3.33Å; R583-L585 PolarHBondContact O-N 3.48Å; R583-R586 PolarHBondContact O-N 2.69Å; R583-E587 WeakPolarHBondContact O-CB 3.43Å; R583-E587 PolarHBondContact O-N 3.06Å
584	A	95	Very high	94.5	Very high	35 Å²	35	105.6 Å²	105.6	29%	0.289	50%	0.495	S	S	.	.	H	α-helix	trans	-68.5	-29.5	177.6	0	0	0	0	0	113	A580 E581 R588	A580-A584 VanDerWaalsContact O-CB 3.29Å; A580-A584 WeakPolarHBondContact O-CB 3.32Å; A580-A584 PolarHBondContact O-N 3.43Å; E581-A584 PolarHBondContact O-N 2.77Å; A584-R588 WeakPolarHBondContact O-CB 3.5Å; A584-R588 WeakPolarHBondContact O-CD 3.5Å; A584-R588 WeakPolarHBondContact O-CG 3.33Å; A584-R588 PolarHBondContact O-N 2.82Å
585	L	96.1	Very high	94.3	Very high	95 Å²	95	107.6 Å²	107.6	50%	0.497	51%	0.505	S	S	.	.	H	α-helix	trans	-69.5	-45.7	170.8	-72.3	169.3	0	0	0	111.2	E581 E582 R583 E587 R588 E589	E581-L585 HydrophobicContact CG-CD1 4.31Å; E581-L585 WeakPolarHBondContact O-CG 3.34Å; E581-L585 PolarHBondContact O-N 3.04Å; E582-L585 PolarHBondContact O-N 2.86Å; R583-L585 VanDerWaalsContact C-N 3.33Å; R583-L585 PolarHBondContact O-N 3.48Å; L585-E587 PolarHBondContact O-N 3.22Å; L585-R588 PolarHBondContact O-N 2.96Å; L585-E589 WeakPolarHBondContact O-CB 3.43Å; L585-E589 PolarHBondContact O-N 2.82Å
586	R	95	Very high	94.2	Very high	142 Å²	142	110 Å²	110	54%	0.536	51%	0.51	S	S	.	.	H	α-helix	trans	-59.3	-45.8	173.7	-67.1	169.6	-178.2	-133.1	8.1	111.6	E582 R583 R588 E589 E590	E582-R586 WeakPolarHBondContact O-CG 3.48Å; E582-R586 PolarHBondContact O-N 3.27Å; E582-R586 IonicContact OE1-CZ 2.67Å; E582-R586 VanDerWaalsContact OE1-CZ 3.31Å; E582-R586 IonicContact OE1-NE 3.15Å; E582-R586 PolarHBondContact OE1-NE 2.81Å; E582-R586 VanDerWaalsContact OE1-NE 3.16Å; E582-R586 IonicContact OE1-NH2 2.74Å; E582-R586 PolarHBondContact OE1-NH2 3.46Å; R583-R586 PolarHBondContact O-N 2.69Å; R586-R588 VanDerWaalsContact C-N 3.34Å; R586-R588 PolarHBondContact O-N 3.46Å; R586-E589 WeakPolarHBondContact O-CB 3.32Å; R586-E589 PolarHBondContact O-N 3.07Å; R586-E589 VanDerWaalsContact O-N 3.17Å; R586-E590 WeakPolarHBondContact O-CG 3.44Å; R586-E590 PolarHBondContact O-N 3.05Å
587	E	94.4	Very high	94.1	Very high	140 Å²	140	111.1 Å²	111.1	65%	0.654	51%	0.512	S	S	*	.	H	α-helix	trans	-60.2	-40.9	176.4	-174	-176	175.1	0	0	111.9	R583 L585 A591	R583-E587 WeakPolarHBondContact O-CB 3.43Å; R583-E587 PolarHBondContact O-N 3.06Å; L585-E587 PolarHBondContact O-N 3.22Å; E587-A591 WeakPolarHBondContact O-CB 3.34Å; E587-A591 PolarHBondContact O-N 3.25Å
588	R	92.4	Very high	94.1	Very high	181 Å²	181	112.7 Å²	112.7	68%	0.683	52%	0.517	S	S	*	.	H	α-helix	trans	-65.1	-40.9	173.8	-75.6	169.1	-177.1	-173	3.4	112.5	A584 L585 R586 A591 E592	A584-R588 WeakPolarHBondContact O-CB 3.5Å; A584-R588 WeakPolarHBondContact O-CD 3.5Å; A584-R588 WeakPolarHBondContact O-CG 3.33Å; A584-R588 PolarHBondContact O-N 2.82Å; L585-R588 PolarHBondContact O-N 2.96Å; R586-R588 VanDerWaalsContact C-N 3.34Å; R586-R588 PolarHBondContact O-N 3.46Å; R588-A591 PolarHBondContact O-N 3.43Å; R588-E592 WeakPolarHBondContact O-CB 3.36Å; R588-E592 PolarHBondContact O-N 3.06Å
589	E	94.3	Very high	93.8	Very high	97 Å²	97	112 Å²	112	45%	0.453	52%	0.521	S	S	.	.	H	α-helix	trans	-66.6	-40.2	178.6	-158.7	-170.3	130.7	0	0	111.6	L585 R586 R593	L585-E589 WeakPolarHBondContact O-CB 3.43Å; L585-E589 PolarHBondContact O-N 2.82Å; R586-E589 WeakPolarHBondContact O-CB 3.32Å; R586-E589 PolarHBondContact O-N 3.07Å; R586-E589 VanDerWaalsContact O-N 3.17Å; E589-R593 WeakPolarHBondContact O-CG 3.35Å; E589-R593 PolarHBondContact O-N 3.08Å; E589-R593 IonicContact OE1-CZ 2.64Å; E589-R593 IonicContact OE1-NH1 3.11Å; E589-R593 PolarHBondContact OE1-NH1 2.91Å; E589-R593 IonicContact OE1-NH2 3.02Å; E589-R593 PolarHBondContact OE1-NH2 3.29Å
590	E	94.1	Very high	93.6	Very high	131 Å²	131	114.3 Å²	114.3	61%	0.612	53%	0.531	S	S	*	.	H	α-helix	trans	-68.7	-40.5	172.6	-72.3	176.5	-165.9	0	0	112.1	R586 R593 A594	R586-E590 WeakPolarHBondContact O-CG 3.44Å; R586-E590 PolarHBondContact O-N 3.05Å; E590-R593 PolarHBondContact O-N 3.25Å; E590-A594 WeakPolarHBondContact O-CB 3.43Å; E590-A594 PolarHBondContact O-N 3.47Å
591	A	93.9	Very high	93.4	Very high	48 Å²	48	116.5 Å²	116.5	40%	0.397	53%	0.532	S	S	.	.	H	α-helix	trans	-64.4	-38.2	174.3	0	0	0	0	0	112.2	E587 R588 A594 Q595	E587-A591 WeakPolarHBondContact O-CB 3.34Å; E587-A591 PolarHBondContact O-N 3.25Å; R588-A591 PolarHBondContact O-N 3.43Å; A591-A594 PolarHBondContact O-N 2.9Å; A591-Q595 WeakPolarHBondContact O-CB 3.38Å; A591-Q595 WeakPolarHBondContact O-CG 3.36Å; A591-Q595 PolarHBondContact O-N 2.96Å
592	E	94.7	Very high	93.3	Very high	93 Å²	93	112.9 Å²	112.9	44%	0.435	53%	0.525	S	S	.	.	H	α-helix	trans	-66.4	-43	174	-163.2	-164.6	132.3	0	0	111.2	R588 A594 Q595 R596	R588-E592 WeakPolarHBondContact O-CB 3.36Å; R588-E592 PolarHBondContact O-N 3.06Å; E592-A594 VanDerWaalsContact C-N 3.33Å; E592-A594 PolarHBondContact O-N 3.19Å; E592-Q595 PolarHBondContact O-N 2.89Å; E592-R596 WeakPolarHBondContact O-CG 3.21Å; E592-R596 PolarHBondContact O-N 2.89Å; E592-R596 IonicContact OE1-CZ 2.72Å; E592-R596 IonicContact OE1-NE 3.18Å; E592-R596 PolarHBondContact OE1-NE 2.91Å; E592-R596 IonicContact OE1-NH2 2.69Å; E592-R596 PolarHBondContact OE1-NH2 2.75Å
593	R	94.2	Very high	93.3	Very high	135 Å²	135	116.3 Å²	116.3	51%	0.509	53%	0.533	S	S	.	.	H	α-helix	trans	-58.5	-44.6	172.3	-74.9	-179.6	179.3	106.2	9.2	111.8	E589 E590 Q595 R596 Q597	E589-R593 WeakPolarHBondContact O-CG 3.35Å; E589-R593 PolarHBondContact O-N 3.08Å; E589-R593 IonicContact OE1-CZ 2.64Å; E589-R593 IonicContact OE1-NH1 3.11Å; E589-R593 PolarHBondContact OE1-NH1 2.91Å; E589-R593 IonicContact OE1-NH2 3.02Å; E589-R593 PolarHBondContact OE1-NH2 3.29Å; E590-R593 PolarHBondContact O-N 3.25Å; R593-Q595 VanDerWaalsContact C-N 3.33Å; R593-Q595 PolarHBondContact O-N 3.4Å; R593-R596 PolarHBondContact O-N 2.84Å; R593-Q597 WeakPolarHBondContact O-CG 3.17Å; R593-Q597 PolarHBondContact O-N 2.64Å
594	A	92.1	Very high	93.2	Very high	34 Å²	34	113.5 Å²	113.5	28%	0.281	53%	0.533	S	S	.	.	H	α-helix	trans	-68.4	-29.5	177.3	0	0	0	0	0	112.9	E590 A591 E592 K598	E590-A594 WeakPolarHBondContact O-CB 3.43Å; E590-A594 PolarHBondContact O-N 3.47Å; A591-A594 PolarHBondContact O-N 2.9Å; E592-A594 VanDerWaalsContact C-N 3.33Å; E592-A594 PolarHBondContact O-N 3.19Å; A594-K598 WeakPolarHBondContact O-CD 3.22Å; A594-K598 VanDerWaalsContact O-CG 3.23Å; A594-K598 WeakPolarHBondContact O-CG 3.45Å; A594-K598 PolarHBondContact O-N 2.69Å
595	Q	91.4	Very high	93	Very high	137 Å²	137	119.6 Å²	119.6	64%	0.64	55%	0.549	S	S	*	.	H	α-helix	trans	-70.3	-47.9	170.7	-80	-177.8	-5.9	0	0	111.3	A591 E592 R593 Q597 K598 E599	A591-Q595 WeakPolarHBondContact O-CB 3.38Å; A591-Q595 WeakPolarHBondContact O-CG 3.36Å; A591-Q595 PolarHBondContact O-N 2.96Å; E592-Q595 PolarHBondContact O-N 2.89Å; R593-Q595 VanDerWaalsContact C-N 3.33Å; R593-Q595 PolarHBondContact O-N 3.4Å; Q595-Q597 VanDerWaalsContact C-N 3.33Å; Q595-Q597 PolarHBondContact O-N 3.05Å; Q595-K598 CarbonylContact O-C 3.44Å; Q595-K598 PolarHBondContact O-N 3.4Å; Q595-E599 WeakPolarHBondContact O-CB 3.18Å; Q595-E599 PolarHBondContact O-N 2.92Å
596	R	92.8	Very high	92.8	Very high	145 Å²	145	119.6 Å²	119.6	55%	0.547	55%	0.547	S	S	.	.	H	α-helix	trans	-55.8	-45.4	176.2	-71.8	167.9	177.4	-109.7	6.9	111.8	E592 R593 K598 E599 E600	E592-R596 WeakPolarHBondContact O-CG 3.21Å; E592-R596 PolarHBondContact O-N 2.89Å; E592-R596 IonicContact OE1-CZ 2.72Å; E592-R596 IonicContact OE1-NE 3.18Å; E592-R596 PolarHBondContact OE1-NE 2.91Å; E592-R596 IonicContact OE1-NH2 2.69Å; E592-R596 PolarHBondContact OE1-NH2 2.75Å; R593-R596 PolarHBondContact O-N 2.84Å; R596-K598 VanDerWaalsContact C-N 3.35Å; R596-K598 PolarHBondContact O-N 3.44Å; R596-E599 PolarHBondContact O-N 3.28Å; R596-E600 WeakPolarHBondContact O-CB 3.28Å; R596-E600 WeakPolarHBondContact O-CG 3.46Å; R596-E600 PolarHBondContact O-N 3.5Å
597	Q	92.6	Very high	92.6	Very high	136 Å²	136	118 Å²	118	64%	0.636	55%	0.545	S	S	*	.	H	α-helix	trans	-60.6	-41.2	175	-74.2	177.4	-12.3	0	0	112.7	R593 Q595 E601	R593-Q597 WeakPolarHBondContact O-CG 3.17Å; R593-Q597 PolarHBondContact O-N 2.64Å; Q595-Q597 VanDerWaalsContact C-N 3.33Å; Q595-Q597 PolarHBondContact O-N 3.05Å; Q597-E601 WeakPolarHBondContact O-CB 3.36Å; Q597-E601 PolarHBondContact O-N 3.07Å
598	K	94.2	Very high	92.5	Very high	143 Å²	143	113.8 Å²	113.8	62%	0.622	53%	0.534	S	S	*	.	H	α-helix	trans	-71.2	-32.3	176.7	-72.3	168	-173.9	172.1	0	112.7	A594 Q595 R596 A602	A594-K598 WeakPolarHBondContact O-CD 3.22Å; A594-K598 VanDerWaalsContact O-CG 3.23Å; A594-K598 WeakPolarHBondContact O-CG 3.45Å; A594-K598 PolarHBondContact O-N 2.69Å; Q595-K598 CarbonylContact O-C 3.44Å; Q595-K598 PolarHBondContact O-N 3.4Å; R596-K598 VanDerWaalsContact C-N 3.35Å; R596-K598 PolarHBondContact O-N 3.44Å; K598-A602 WeakPolarHBondContact O-CB 3.49Å; K598-A602 PolarHBondContact O-N 3.27Å
599	E	90.9	Very high	92.4	Very high	141 Å²	141	110.3 Å²	110.3	66%	0.659	53%	0.526	S	S	*	.	H	α-helix	trans	-70.7	-43.9	174.7	-172.6	-179.1	168.6	0	0	111.1	Q595 R596 A602 R603	Q595-E599 WeakPolarHBondContact O-CB 3.18Å; Q595-E599 PolarHBondContact O-N 2.92Å; R596-E599 PolarHBondContact O-N 3.28Å; E599-A602 PolarHBondContact O-N 3.05Å; E599-R603 VanDerWaalsContact O-CB 3.24Å; E599-R603 WeakPolarHBondContact O-CB 3.33Å; E599-R603 PolarHBondContact O-N 3.39Å
600	E	90.1	Very high	92.4	Very high	131 Å²	131	113.2 Å²	113.2	61%	0.612	53%	0.533	S	S	*	.	H	α-helix	trans	-62.2	-44	172.6	-73.3	178.2	169.8	0	0	111.3	R596 R603 V604	R596-E600 WeakPolarHBondContact O-CB 3.28Å; R596-E600 WeakPolarHBondContact O-CG 3.46Å; R596-E600 PolarHBondContact O-N 3.5Å; E600-R603 PolarHBondContact O-N 3.34Å; E600-V604 WeakPolarHBondContact O-CG2 3.43Å; E600-V604 PolarHBondContact O-N 3.47Å
601	E	90.1	Very high	92.4	Very high	100 Å²	100	109.7 Å²	109.7	47%	0.467	52%	0.52	S	S	.	.	H	α-helix	trans	-63.6	-44.1	174.5	-161.6	-161.3	164.6	0	0	111.9	Q597 R603 V604 R605	Q597-E601 WeakPolarHBondContact O-CB 3.36Å; Q597-E601 PolarHBondContact O-N 3.07Å; E601-R603 VanDerWaalsContact C-N 3.34Å; E601-R603 PolarHBondContact O-N 2.97Å; E601-V604 PolarHBondContact O-N 3.42Å; E601-R605 VanDerWaalsContact O-CG 3.27Å; E601-R605 WeakPolarHBondContact O-CG 3.17Å; E601-R605 PolarHBondContact O-N 2.99Å; E601-R605 IonicContact OE1-CZ 3.31Å; E601-R605 IonicContact OE1-NE 3.12Å; E601-R605 PolarHBondContact OE1-NE 2.85Å; E601-R605 IonicContact OE1-NH2 2.83Å; E601-R605 PolarHBondContact OE1-NH2 3.24Å
602	A	92.4	Very high	92.3	Very high	54 Å²	54	116.4 Å²	116.4	45%	0.446	54%	0.535	S	S	.	.	H	α-helix	trans	-63	-40	176.9	0	0	0	0	0	112	K598 E599 R605 E606	K598-A602 WeakPolarHBondContact O-CB 3.49Å; K598-A602 PolarHBondContact O-N 3.27Å; E599-A602 PolarHBondContact O-N 3.05Å; A602-R605 WeakPolarHBondContact O-CB 3.47Å; A602-R605 PolarHBondContact O-N 2.86Å; A602-E606 PolarHBondContact O-N 2.86Å
603	R	92.9	Very high	92.2	Very high	167 Å²	167	115.3 Å²	115.3	63%	0.63	53%	0.53	S	S	*	.	H	α-helix	trans	-65.1	-42.4	175.2	179.2	-178.2	159	-153.2	-11.7	111.7	E599 E600 E601 R605 E606 E607	E599-R603 VanDerWaalsContact O-CB 3.24Å; E599-R603 WeakPolarHBondContact O-CB 3.33Å; E599-R603 PolarHBondContact O-N 3.39Å; E600-R603 PolarHBondContact O-N 3.34Å; E601-R603 VanDerWaalsContact C-N 3.34Å; E601-R603 PolarHBondContact O-N 2.97Å; R603-R605 VanDerWaalsContact C-N 3.3Å; R603-R605 PolarHBondContact O-N 3.11Å; R603-E606 PolarHBondContact O-N 3.45Å; R603-E607 WeakPolarHBondContact O-CB 3.31Å; R603-E607 PolarHBondContact O-N 3.12Å
604	V	94.2	Very high	92.2	Very high	98 Å²	98	115.1 Å²	115.1	59%	0.594	53%	0.534	S	S	*	.	H	α-helix	trans	-62.9	-37.8	173.9	168.6	0	0	0	0	111.1	E600 E601 A608	E600-V604 WeakPolarHBondContact O-CG2 3.43Å; E600-V604 PolarHBondContact O-N 3.47Å; E601-V604 PolarHBondContact O-N 3.42Å; V604-A608 VanDerWaalsContact O-CB 3.31Å; V604-A608 WeakPolarHBondContact O-CB 3.37Å; V604-A608 PolarHBondContact O-N 3.32Å
605	R	90.3	Very high	92.1	Very high	163 Å²	163	122.1 Å²	122.1	62%	0.615	55%	0.554	S	S	*	*	H	α-helix	trans	-65.6	-42.2	173.2	-68.9	168	176.4	-148.5	3.3	112	E601 A602 R603 A608 E609	E601-R605 VanDerWaalsContact O-CG 3.27Å; E601-R605 WeakPolarHBondContact O-CG 3.17Å; E601-R605 PolarHBondContact O-N 2.99Å; E601-R605 IonicContact OE1-CZ 3.31Å; E601-R605 IonicContact OE1-NE 3.12Å; E601-R605 PolarHBondContact OE1-NE 2.85Å; E601-R605 IonicContact OE1-NH2 2.83Å; E601-R605 PolarHBondContact OE1-NH2 3.24Å; A602-R605 WeakPolarHBondContact O-CB 3.47Å; A602-R605 PolarHBondContact O-N 2.86Å; R603-R605 VanDerWaalsContact C-N 3.3Å; R603-R605 PolarHBondContact O-N 3.11Å; R605-A608 PolarHBondContact O-N 2.99Å; R605-E609 PolarHBondContact O-N 3.35Å
606	E	90.9	Very high	92.2	Very high	96 Å²	96	121 Å²	121	45%	0.449	55%	0.548	S	S	.	.	H	α-helix	trans	-64.8	-43.1	175.4	-161.8	-154.4	143.2	0	0	111.5	A602 R603 A608 E609 R610	A602-E606 PolarHBondContact O-N 2.86Å; R603-E606 PolarHBondContact O-N 3.45Å; E606-A608 PolarHBondContact O-N 3.49Å; E606-E609 CarbonylContact O-C 3.53Å; E606-E609 PolarHBondContact O-N 2.82Å; E606-E609 VanDerWaalsContact O-N 3.12Å; E606-R610 WeakPolarHBondContact O-CG 3.33Å; E606-R610 PolarHBondContact O-N 3.2Å; E606-R610 IonicContact OE1-CZ 3.63Å; E606-R610 IonicContact OE1-NE 3.41Å; E606-R610 PolarHBondContact OE1-NE 2.83Å; E606-R610 IonicContact OE1-NH2 3.19Å; E606-R610 PolarHBondContact OE1-NH2 3.26Å
607	E	92.2	Very high	92.2	Very high	109 Å²	109	118.6 Å²	118.6	51%	0.509	54%	0.542	S	S	.	.	H	α-helix	trans	-63.7	-41.7	177.5	-166.5	169.8	151.2	0	0	111.2	R603 E609 R610 V611	R603-E607 WeakPolarHBondContact O-CB 3.31Å; R603-E607 PolarHBondContact O-N 3.12Å; E607-E609 VanDerWaalsContact C-N 3.31Å; E607-E609 PolarHBondContact O-N 3.32Å; E607-R610 PolarHBondContact O-N 3.08Å; E607-V611 WeakPolarHBondContact O-CG2 3.44Å; E607-V611 PolarHBondContact O-N 2.87Å
608	A	91.7	Very high	92.2	Very high	51 Å²	51	117.8 Å²	117.8	42%	0.421	54%	0.538	S	S	.	.	H	α-helix	trans	-63.1	-33.9	171.8	0	0	0	0	0	112.9	V604 R605 E606 R612	V604-A608 VanDerWaalsContact O-CB 3.31Å; V604-A608 WeakPolarHBondContact O-CB 3.37Å; V604-A608 PolarHBondContact O-N 3.32Å; R605-A608 PolarHBondContact O-N 2.99Å; E606-A608 PolarHBondContact O-N 3.49Å; A608-R612 WeakPolarHBondContact O-CG 3.44Å; A608-R612 PolarHBondContact O-N 3.29Å
609	E	90.6	Very high	92.1	Very high	108 Å²	108	116.9 Å²	116.9	51%	0.505	53%	0.534	S	S	.	.	H	α-helix	trans	-71.4	-44.2	172.9	-158.2	-161.4	122.2	0	0	111.7	R605 E606 E607 V611 R612 Q613	R605-E609 PolarHBondContact O-N 3.35Å; E606-E609 CarbonylContact O-C 3.53Å; E606-E609 PolarHBondContact O-N 2.82Å; E606-E609 VanDerWaalsContact O-N 3.12Å; E607-E609 VanDerWaalsContact C-N 3.31Å; E607-E609 PolarHBondContact O-N 3.32Å; E609-V611 VanDerWaalsContact C-N 3.28Å; E609-V611 PolarHBondContact O-N 3.35Å; E609-R612 CarbonylContact O-C 3.58Å; E609-R612 WeakPolarHBondContact O-CA 3.36Å; E609-R612 WeakPolarHBondContact O-CB 3.41Å; E609-R612 PolarHBondContact O-N 3.27Å; E609-Q613 WeakPolarHBondContact O-CG 3.47Å; E609-Q613 PolarHBondContact O-N 2.87Å; E609-Q613 PolarHBondContact OE1-NE2 3.12Å
610	R	94.1	Very high	92.2	Very high	158 Å²	158	114.4 Å²	114.4	60%	0.596	52%	0.523	S	S	*	.	H	α-helix	trans	-56.4	-42.8	174.4	-73.2	-178	-177.9	-145.2	7.1	111.4	E606 E607 R612 Q613 E614	E606-R610 WeakPolarHBondContact O-CG 3.33Å; E606-R610 PolarHBondContact O-N 3.2Å; E606-R610 IonicContact OE1-CZ 3.63Å; E606-R610 IonicContact OE1-NE 3.41Å; E606-R610 PolarHBondContact OE1-NE 2.83Å; E606-R610 IonicContact OE1-NH2 3.19Å; E606-R610 PolarHBondContact OE1-NH2 3.26Å; E607-R610 PolarHBondContact O-N 3.08Å; R610-R612 VanDerWaalsContact C-N 3.32Å; R610-R612 PolarHBondContact O-N 3.46Å; R610-Q613 PolarHBondContact O-N 2.66Å; R610-E614 WeakPolarHBondContact O-CB 3.24Å; R610-E614 PolarHBondContact O-N 2.88Å
611	V	93.6	Very high	92.3	Very high	57 Å²	57	116.1 Å²	116.1	35%	0.345	52%	0.523	S	S	.	.	H	α-helix	trans	-64.2	-34	174.9	170.1	0	0	0	0	112.1	E607 E609 R615	E607-V611 WeakPolarHBondContact O-CG2 3.44Å; E607-V611 PolarHBondContact O-N 2.87Å; E609-V611 VanDerWaalsContact C-N 3.28Å; E609-V611 PolarHBondContact O-N 3.35Å; V611-R615 VanDerWaalsContact O-CG 3.23Å; V611-R615 WeakPolarHBondContact O-CG 3.49Å; V611-R615 PolarHBondContact O-N 3.32Å; V611-R615 VanDerWaalsContact O-N 3.08Å
612	R	92.7	Very high	92.3	Very high	188 Å²	188	114.6 Å²	114.6	71%	0.709	52%	0.517	S	S	*	.	H	α-helix	trans	-67.3	-49.4	171.4	-71	172.1	-178.9	-149.6	0.5	111.3	A608 E609 R610 E614 R615 E616	A608-R612 WeakPolarHBondContact O-CG 3.44Å; A608-R612 PolarHBondContact O-N 3.29Å; E609-R612 CarbonylContact O-C 3.58Å; E609-R612 WeakPolarHBondContact O-CA 3.36Å; E609-R612 WeakPolarHBondContact O-CB 3.41Å; E609-R612 PolarHBondContact O-N 3.27Å; R610-R612 VanDerWaalsContact C-N 3.32Å; R610-R612 PolarHBondContact O-N 3.46Å; R612-E614 VanDerWaalsContact C-N 3.25Å; R612-E614 PolarHBondContact O-N 2.89Å; R612-R615 PolarHBondContact O-N 3.19Å; R612-E616 PolarHBondContact O-N 3.01Å
613	Q	92.5	Very high	92.2	Very high	70 Å²	70	117.5 Å²	117.5	33%	0.327	52%	0.521	S	S	.	.	H	α-helix	trans	-61.2	-33.9	177.3	-65.2	-173.4	21.7	0	0	112.2	E609 R610 K617	E609-Q613 WeakPolarHBondContact O-CG 3.47Å; E609-Q613 PolarHBondContact O-N 2.87Å; E609-Q613 PolarHBondContact OE1-NE2 3.12Å; R610-Q613 PolarHBondContact O-N 2.66Å; Q613-K617 WeakPolarHBondContact O-CB 3.48Å; Q613-K617 VanDerWaalsContact O-CD 3.27Å; Q613-K617 WeakPolarHBondContact O-CD 3.27Å; Q613-K617 WeakPolarHBondContact O-CG 3.45Å; Q613-K617 PolarHBondContact O-N 3.18Å
614	E	93.1	Very high	92.1	Very high	131 Å²	131	115.3 Å²	115.3	61%	0.612	52%	0.518	S	S	*	.	H	α-helix	trans	-70.4	-42.4	175.9	-177.5	167.3	-143.5	0	0	111.8	R610 R612 E616 K617 H618	R610-E614 WeakPolarHBondContact O-CB 3.24Å; R610-E614 PolarHBondContact O-N 2.88Å; R612-E614 VanDerWaalsContact C-N 3.25Å; R612-E614 PolarHBondContact O-N 2.89Å; E614-E616 VanDerWaalsContact C-N 3.31Å; E614-E616 PolarHBondContact O-N 2.99Å; E614-K617 PolarHBondContact O-N 3.24Å; E614-H618 WeakPolarHBondContact O-CB 3.5Å; E614-H618 PolarHBondContact O-N 3.28Å
615	R	91.3	Very high	92.1	Very high	181 Å²	181	114.6 Å²	114.6	68%	0.683	51%	0.508	S	S	*	.	H	α-helix	trans	-61.4	-39.8	172.4	-71.1	169	-171.9	-157.7	3.1	111.9	V611 R612 H618 F619	V611-R615 VanDerWaalsContact O-CG 3.23Å; V611-R615 WeakPolarHBondContact O-CG 3.49Å; V611-R615 PolarHBondContact O-N 3.32Å; V611-R615 VanDerWaalsContact O-N 3.08Å; R612-R615 PolarHBondContact O-N 3.19Å; R615-H618 WeakPolarHBondContact O-CB 3.3Å; R615-H618 PolarHBondContact O-N 3.39Å; R615-F619 PolarHBondContact O-N 3.33Å
616	E	92.1	Very high	92.2	Very high	114 Å²	114	114 Å²	114	53%	0.533	51%	0.505	S	S	.	.	H	α-helix	trans	-65.1	-47.6	174.6	-166.2	-169.2	158.6	0	0	111.5	R612 E614 H618 F619 Q620	R612-E616 PolarHBondContact O-N 3.01Å; E614-E616 VanDerWaalsContact C-N 3.31Å; E614-E616 PolarHBondContact O-N 2.99Å; E616-H618 VanDerWaalsContact C-N 3.28Å; E616-H618 PolarHBondContact O-N 3.04Å; E616-F619 PolarHBondContact O-N 3.4Å; E616-F619 VanDerWaalsContact O-N 3.13Å; E616-Q620 WeakPolarHBondContact O-CG 3.46Å; E616-Q620 PolarHBondContact O-N 3.44Å; E616-Q620 PolarHBondContact OE1-NE2 3.02Å; E616-Q620 VanDerWaalsContact OE1-NE2 3.09Å
617	K	94.4	Very high	92.2	Very high	95 Å²	95	114.8 Å²	114.8	41%	0.413	51%	0.513	S	S	.	.	H	α-helix	trans	-62.5	-33.5	175.2	-71.8	160.2	-166.6	162.1	0	111.9	Q613 E614 R621	Q613-K617 WeakPolarHBondContact O-CB 3.48Å; Q613-K617 VanDerWaalsContact O-CD 3.27Å; Q613-K617 WeakPolarHBondContact O-CD 3.27Å; Q613-K617 WeakPolarHBondContact O-CG 3.45Å; Q613-K617 PolarHBondContact O-N 3.18Å; E614-K617 PolarHBondContact O-N 3.24Å; K617-R621 WeakPolarHBondContact O-CB 3.45Å; K617-R621 VanDerWaalsContact O-CG 3.25Å; K617-R621 WeakPolarHBondContact O-CG 3.49Å; K617-R621 PolarHBondContact O-N 3.19Å
618	H	91.7	Very high	92.2	Very high	118 Å²	118	115.9 Å²	115.9	55%	0.546	52%	0.518	S	S	.	.	H	α-helix	trans	-65.4	-46.4	171.9	-178.1	-69.5	0	0	0	111.1	E614 R615 E616 R621 E622	E614-H618 WeakPolarHBondContact O-CB 3.5Å; E614-H618 PolarHBondContact O-N 3.28Å; R615-H618 WeakPolarHBondContact O-CB 3.3Å; R615-H618 PolarHBondContact O-N 3.39Å; E616-H618 VanDerWaalsContact C-N 3.28Å; E616-H618 PolarHBondContact O-N 3.04Å; H618-R621 PolarHBondContact O-N 3.15Å; H618-E622 PolarHBondContact O-N 2.87Å
619	F	92.6	Very high	92.2	Very high	125 Å²	125	120 Å²	120	55%	0.548	52%	0.522	S	S	.	.	H	α-helix	trans	-62.4	-43.6	176.6	-171.8	-95.4	0	0	0	112	R615 E616 R621 E622 E623	R615-F619 PolarHBondContact O-N 3.33Å; E616-F619 PolarHBondContact O-N 3.4Å; E616-F619 VanDerWaalsContact O-N 3.13Å; F619-R621 VanDerWaalsContact C-N 3.34Å; F619-R621 PolarHBondContact O-N 3.02Å; F619-E622 PolarHBondContact O-N 3.37Å; F619-E622 VanDerWaalsContact O-N 3.14Å; F619-E623 HydrophobicContact CD1-CG 4.3Å; F619-E623 HydrophobicContact CE1-CG 3.86Å; F619-E623 HydrophobicContact CZ-CG 4.24Å; F619-E623 PolarHBondContact O-N 2.95Å
620	Q	92.4	Very high	92.3	Very high	88 Å²	88	121.4 Å²	121.4	41%	0.411	53%	0.527	S	S	.	.	H	α-helix	trans	-61.3	-39.3	173.9	-69.1	175.8	14.8	0	0	112.3	E616 E623 Q624	E616-Q620 WeakPolarHBondContact O-CG 3.46Å; E616-Q620 PolarHBondContact O-N 3.44Å; E616-Q620 PolarHBondContact OE1-NE2 3.02Å; E616-Q620 VanDerWaalsContact OE1-NE2 3.09Å; Q620-E623 PolarHBondContact O-N 2.92Å; Q620-Q624 WeakPolarHBondContact O-CB 3.3Å; Q620-Q624 VanDerWaalsContact O-CG 3.3Å; Q620-Q624 WeakPolarHBondContact O-CG 3.46Å; Q620-Q624 PolarHBondContact O-N 2.87Å
621	R	91.9	Very high	92.3	Very high	167 Å²	167	120.9 Å²	120.9	63%	0.63	53%	0.529	S	S	*	.	H	α-helix	trans	-65.6	-39.9	172.1	-74.4	175.7	-158.4	166.8	7.6	112	K617 H618 F619 Q624 E625	K617-R621 WeakPolarHBondContact O-CB 3.45Å; K617-R621 VanDerWaalsContact O-CG 3.25Å; K617-R621 WeakPolarHBondContact O-CG 3.49Å; K617-R621 PolarHBondContact O-N 3.19Å; H618-R621 PolarHBondContact O-N 3.15Å; F619-R621 VanDerWaalsContact C-N 3.34Å; F619-R621 PolarHBondContact O-N 3.02Å; R621-Q624 PolarHBondContact O-N 2.96Å; R621-E625 WeakPolarHBondContact O-CB 3.4Å; R621-E625 PolarHBondContact O-N 2.86Å
622	E	91.8	Very high	92.2	Very high	69 Å²	69	126.4 Å²	126.4	32%	0.322	54%	0.543	S	S	.	.	H	α-helix	trans	-65.7	-42.7	175.7	-161.9	-167.5	150.4	0	0	110.9	H618 F619 Q624 E625 R626	H618-E622 PolarHBondContact O-N 2.87Å; F619-E622 PolarHBondContact O-N 3.37Å; F619-E622 VanDerWaalsContact O-N 3.14Å; E622-Q624 PolarHBondContact O-N 2.98Å; E622-E625 CarbonylContact O-C 3.59Å; E622-E625 PolarHBondContact O-N 2.88Å; E622-R626 HydrophobicContact CG-CG 4.36Å; E622-R626 WeakPolarHBondContact O-CB 3.38Å; E622-R626 WeakPolarHBondContact O-CG 3.47Å; E622-R626 PolarHBondContact O-N 3.41Å; E622-R626 IonicContact OE1-CZ 3.28Å; E622-R626 VanDerWaalsContact OE1-CZ 3.28Å; E622-R626 IonicContact OE1-NE 3.02Å; E622-R626 PolarHBondContact OE1-NE 3.5Å; E622-R626 IonicContact OE1-NH2 2.69Å; E622-R626 PolarHBondContact OE1-NH2 3.32Å
623	E	89.6	Confident	92.1	Very high	115 Å²	115	122.4 Å²	122.4	54%	0.537	54%	0.536	S	S	.	.	H	α-helix	trans	-62.4	-41.8	174.2	-75.8	-143.1	117.9	0	0	112.5	F619 Q620 R626 L627	F619-E623 HydrophobicContact CD1-CG 4.3Å; F619-E623 HydrophobicContact CE1-CG 3.86Å; F619-E623 HydrophobicContact CZ-CG 4.24Å; F619-E623 PolarHBondContact O-N 2.95Å; Q620-E623 PolarHBondContact O-N 2.92Å; E623-R626 WeakPolarHBondContact O-CB 3.46Å; E623-R626 PolarHBondContact O-N 3.27Å; E623-L627 WeakPolarHBondContact O-CB 3.45Å; E623-L627 WeakPolarHBondContact O-CG 3.18Å; E623-L627 PolarHBondContact O-N 3.07Å
624	Q	91.3	Very high	91.9	Very high	121 Å²	121	123.2 Å²	123.2	57%	0.565	54%	0.539	S	S	*	.	H	α-helix	trans	-60.7	-44.2	172.2	-74.3	174.5	9.1	0	0	111.1	Q620 R621 E622 R626 L627 E628	Q620-Q624 WeakPolarHBondContact O-CB 3.3Å; Q620-Q624 VanDerWaalsContact O-CG 3.3Å; Q620-Q624 WeakPolarHBondContact O-CG 3.46Å; Q620-Q624 PolarHBondContact O-N 2.87Å; R621-Q624 PolarHBondContact O-N 2.96Å; E622-Q624 PolarHBondContact O-N 2.98Å; Q624-R626 VanDerWaalsContact C-N 3.33Å; Q624-R626 PolarHBondContact O-N 3.38Å; Q624-L627 CarbonylContact O-C 3.54Å; Q624-L627 PolarHBondContact O-N 3.32Å; Q624-E628 WeakPolarHBondContact O-CB 3.42Å; Q624-E628 WeakPolarHBondContact O-CG 3.36Å; Q624-E628 PolarHBondContact O-N 2.98Å
625	E	92.7	Very high	91.7	Very high	83 Å²	83	122.8 Å²	122.8	39%	0.388	54%	0.537	S	S	.	.	H	α-helix	trans	-66.9	-33.1	176.2	-151.1	-153	161.1	0	0	112	R621 E622 E628 R629	R621-E625 WeakPolarHBondContact O-CB 3.4Å; R621-E625 PolarHBondContact O-N 2.86Å; E622-E625 CarbonylContact O-C 3.59Å; E622-E625 PolarHBondContact O-N 2.88Å; E625-E628 PolarHBondContact O-N 2.83Å; E625-R629 VanDerWaalsContact CD-CZ 3.41Å; E625-R629 HydrophobicContact CG-CG 4.43Å; E625-R629 WeakPolarHBondContact O-CB 3.49Å; E625-R629 WeakPolarHBondContact O-CD 3.43Å; E625-R629 WeakPolarHBondContact O-CG 3.2Å; E625-R629 PolarHBondContact O-N 2.67Å; E625-R629 IonicContact OE1-CZ 2.77Å; E625-R629 IonicContact OE1-NE 2.76Å; E625-R629 PolarHBondContact OE1-NE 2.95Å; E625-R629 IonicContact OE1-NH2 2.75Å; E625-R629 PolarHBondContact OE1-NH2 2.96Å; E625-R629 IonicContact OE2-CZ 3.8Å; E625-R629 VanDerWaalsContact OE2-CZ 3.31Å; E625-R629 IonicContact OE2-NE 3.51Å; E625-R629 IonicContact OE2-NH2 3.19Å; E625-R629 PolarHBondContact OE2-NH2 3.14Å
626	R	92.9	Very high	91.4	Very high	149 Å²	149	117.1 Å²	117.1	56%	0.562	52%	0.52	S	S	*	.	H	α-helix	trans	-65.5	-41.1	172.9	-66.9	-90.2	-177.4	162.7	5.8	110.5	E622 E623 Q624 K630	E622-R626 HydrophobicContact CG-CG 4.36Å; E622-R626 WeakPolarHBondContact O-CB 3.38Å; E622-R626 WeakPolarHBondContact O-CG 3.47Å; E622-R626 PolarHBondContact O-N 3.41Å; E622-R626 IonicContact OE1-CZ 3.28Å; E622-R626 VanDerWaalsContact OE1-CZ 3.28Å; E622-R626 IonicContact OE1-NE 3.02Å; E622-R626 PolarHBondContact OE1-NE 3.5Å; E622-R626 IonicContact OE1-NH2 2.69Å; E622-R626 PolarHBondContact OE1-NH2 3.32Å; E623-R626 WeakPolarHBondContact O-CB 3.46Å; E623-R626 PolarHBondContact O-N 3.27Å; Q624-R626 VanDerWaalsContact C-N 3.33Å; Q624-R626 PolarHBondContact O-N 3.38Å; R626-K630 WeakPolarHBondContact O-CB 3.41Å; R626-K630 PolarHBondContact O-N 3.48Å
627	L	91.1	Very high	91	Very high	114 Å²	114	115.6 Å²	115.6	60%	0.597	51%	0.514	S	S	*	.	H	α-helix	trans	-69.5	-37.7	174.5	-70.2	173.8	0	0	0	112.3	E623 Q624 K630 K631	E623-L627 WeakPolarHBondContact O-CB 3.45Å; E623-L627 WeakPolarHBondContact O-CG 3.18Å; E623-L627 PolarHBondContact O-N 3.07Å; Q624-L627 CarbonylContact O-C 3.54Å; Q624-L627 PolarHBondContact O-N 3.32Å; L627-K630 PolarHBondContact O-N 2.8Å; L627-K631 WeakPolarHBondContact O-CB 3.38Å; L627-K631 PolarHBondContact O-N 3.04Å
628	E	91.9	Very high	90.6	Very high	132 Å²	132	116.6 Å²	116.6	62%	0.617	52%	0.518	S	S	*	.	H	α-helix	trans	-71	-43.1	174.7	-74.6	-170.9	169	0	0	112.2	Q624 E625 K630 K631 R632	Q624-E628 WeakPolarHBondContact O-CB 3.42Å; Q624-E628 WeakPolarHBondContact O-CG 3.36Å; Q624-E628 PolarHBondContact O-N 2.98Å; E625-E628 PolarHBondContact O-N 2.83Å; E628-K630 VanDerWaalsContact C-N 3.31Å; E628-K630 PolarHBondContact O-N 2.87Å; E628-K631 PolarHBondContact O-N 3Å; E628-R632 WeakPolarHBondContact O-CB 3.33Å; E628-R632 PolarHBondContact O-N 3.19Å
629	R	91.2	Very high	90.1	Very high	136 Å²	136	119.4 Å²	119.4	51%	0.513	52%	0.524	S	S	.	.	H	α-helix	trans	-58.6	-43.2	170.1	-73.3	167.5	-180	-170.9	7.5	110.4	E625 L633	E625-R629 VanDerWaalsContact CD-CZ 3.41Å; E625-R629 HydrophobicContact CG-CG 4.43Å; E625-R629 WeakPolarHBondContact O-CB 3.49Å; E625-R629 WeakPolarHBondContact O-CD 3.43Å; E625-R629 WeakPolarHBondContact O-CG 3.2Å; E625-R629 PolarHBondContact O-N 2.67Å; E625-R629 IonicContact OE1-CZ 2.77Å; E625-R629 IonicContact OE1-NE 2.76Å; E625-R629 PolarHBondContact OE1-NE 2.95Å; E625-R629 IonicContact OE1-NH2 2.75Å; E625-R629 PolarHBondContact OE1-NH2 2.96Å; E625-R629 IonicContact OE2-CZ 3.8Å; E625-R629 VanDerWaalsContact OE2-CZ 3.31Å; E625-R629 IonicContact OE2-NE 3.51Å; E625-R629 IonicContact OE2-NH2 3.19Å; E625-R629 PolarHBondContact OE2-NH2 3.14Å; R629-L633 VanDerWaalsContact O-CB 3.23Å; R629-L633 WeakPolarHBondContact O-CB 3.37Å; R629-L633 PolarHBondContact O-N 3.03Å
630	K	93.8	Very high	89.2	Confident	138 Å²	138	117.8 Å²	117.8	60%	0.6	52%	0.524	S	S	*	.	H	α-helix	trans	-64.2	-44.9	174.6	-178	-179.3	177.6	-177.2	0	112	R626 L627 E628 L633 E634	R626-K630 WeakPolarHBondContact O-CB 3.41Å; R626-K630 PolarHBondContact O-N 3.48Å; L627-K630 PolarHBondContact O-N 2.8Å; E628-K630 VanDerWaalsContact C-N 3.31Å; E628-K630 PolarHBondContact O-N 2.87Å; K630-L633 PolarHBondContact O-N 2.8Å; K630-E634 WeakPolarHBondContact O-CB 3.41Å; K630-E634 PolarHBondContact O-N 2.93Å
631	K	94.1	Very high	88.2	Confident	147 Å²	147	122.3 Å²	122.3	64%	0.639	54%	0.538	S	S	*	.	H	α-helix	trans	-64.9	-41.7	177.5	-179.4	-175.5	174.7	-171.3	0	111.7	L627 E628 E634 E635	L627-K631 WeakPolarHBondContact O-CB 3.38Å; L627-K631 PolarHBondContact O-N 3.04Å; E628-K631 PolarHBondContact O-N 3Å; K631-E634 CarbonylContact O-C 3.5Å; K631-E634 PolarHBondContact O-N 3.49Å; K631-E635 VanDerWaalsContact O-CB 3.27Å; K631-E635 WeakPolarHBondContact O-CB 3.46Å; K631-E635 PolarHBondContact O-N 3.36Å
632	R	91.5	Very high	86.5	Confident	174 Å²	174	123.3 Å²	123.3	66%	0.657	54%	0.541	S	S	*	.	H	α-helix	trans	-67.9	-37.3	174.9	-172.3	179.4	-179.1	-175.4	0.6	111.3	E628 E635 I636	E628-R632 WeakPolarHBondContact O-CB 3.33Å; E628-R632 PolarHBondContact O-N 3.19Å; R632-E635 PolarHBondContact O-N 3.45Å; R632-I636 HydrophobicContact CG-CD1 4.14Å; R632-I636 WeakPolarHBondContact O-CB 3.41Å; R632-I636 WeakPolarHBondContact O-CD1 3.39Å; R632-I636 WeakPolarHBondContact O-CG1 3.3Å; R632-I636 PolarHBondContact O-N 3.47Å
633	L	90	Very high	84.7	Confident	104 Å²	104	125.6 Å²	125.6	55%	0.545	56%	0.56	S	S	.	*	H	α-helix	trans	-66.1	-43.6	171.5	-169.3	74.9	0	0	0	110.8	R629 K630 E635 I636 M637	R629-L633 VanDerWaalsContact O-CB 3.23Å; R629-L633 WeakPolarHBondContact O-CB 3.37Å; R629-L633 PolarHBondContact O-N 3.03Å; K630-L633 PolarHBondContact O-N 2.8Å; L633-E635 VanDerWaalsContact C-N 3.34Å; L633-E635 PolarHBondContact O-N 3.18Å; L633-I636 CarbonylContact O-C 3.55Å; L633-I636 PolarHBondContact O-N 2.93Å; L633-M637 HydrophobicContact CG-SD 4.31Å; L633-M637 WeakPolarHBondContact O-CB 3.44Å; L633-M637 VanDerWaalsContact O-CG 3.25Å; L633-M637 WeakPolarHBondContact O-CG 3.49Å; L633-M637 PolarHBondContact O-N 2.88Å
634	E	88	Confident	82.7	Confident	87 Å²	87	128 Å²	128	41%	0.407	57%	0.572	S	S	.	*	H	α-helix	trans	-64.4	-37.1	175.4	-166.5	-167.1	142	0	0	111.8	K630 K631 M637 K638	K630-E634 WeakPolarHBondContact O-CB 3.41Å; K630-E634 PolarHBondContact O-N 2.93Å; K631-E634 CarbonylContact O-C 3.5Å; K631-E634 PolarHBondContact O-N 3.49Å; E634-M637 CarbonylContact O-C 3.51Å; E634-M637 PolarHBondContact O-N 3.45Å; E634-K638 HydrophobicContact CG-CD 4.28Å; E634-K638 VanDerWaalsContact O-CB 3.23Å; E634-K638 WeakPolarHBondContact O-CB 3.44Å; E634-K638 VanDerWaalsContact O-CG 3.28Å; E634-K638 WeakPolarHBondContact O-CG 3.31Å; E634-K638 PolarHBondContact O-N 3Å; E634-K638 WeakPolarHBondContact OE1-CE 3.44Å; E634-K638 IonicContact OE1-NZ 2.61Å; E634-K638 PolarHBondContact OE1-NZ 2.87Å
635	E	89.3	Confident	80.7	Confident	122 Å²	122	125.1 Å²	125.1	57%	0.57	57%	0.569	S	S	*	*	H	α-helix	trans	-67	-43.1	172.4	-178.2	178.7	-164.6	0	0	111.4	K631 R632 L633 M637 K638 R639	K631-E635 VanDerWaalsContact O-CB 3.27Å; K631-E635 WeakPolarHBondContact O-CB 3.46Å; K631-E635 PolarHBondContact O-N 3.36Å; R632-E635 PolarHBondContact O-N 3.45Å; L633-E635 VanDerWaalsContact C-N 3.34Å; L633-E635 PolarHBondContact O-N 3.18Å; E635-M637 VanDerWaalsContact C-N 3.31Å; E635-M637 PolarHBondContact O-N 3.15Å; E635-K638 PolarHBondContact O-N 3.45Å; E635-R639 WeakPolarHBondContact O-CG 3.31Å; E635-R639 PolarHBondContact O-N 3.14Å
636	I	85.7	Confident	78.3	Confident	61 Å²	61	127.2 Å²	127.2	31%	0.313	59%	0.587	S	S	.	*	H	α-helix	trans	-61.3	-39.8	172.1	-72.9	161.3	0	0	0	110.8	R632 L633 R639 T640	R632-I636 HydrophobicContact CG-CD1 4.14Å; R632-I636 WeakPolarHBondContact O-CB 3.41Å; R632-I636 WeakPolarHBondContact O-CD1 3.39Å; R632-I636 WeakPolarHBondContact O-CG1 3.3Å; R632-I636 PolarHBondContact O-N 3.47Å; L633-I636 CarbonylContact O-C 3.55Å; L633-I636 PolarHBondContact O-N 2.93Å; I636-R639 VanDerWaalsContact O-CG 3.31Å; I636-R639 WeakPolarHBondContact O-CG 3.36Å; I636-T640 WeakPolarHBondContact O-CG2 3.37Å; I636-T640 PolarHBondContact O-N 3.45Å; I636-T640 PolarHBondContact O-OG1 2.8Å
637	M	84	Confident	76.1	Confident	82 Å²	82	127.1 Å²	127.1	40%	0.404	60%	0.598	S	S	.	*	H	α-helix	trans	-73.4	-31.4	175	-70.9	174.1	70.3	0	0	112.7	L633 E634 E635 T640 R641	L633-M637 HydrophobicContact CG-SD 4.31Å; L633-M637 WeakPolarHBondContact O-CB 3.44Å; L633-M637 VanDerWaalsContact O-CG 3.25Å; L633-M637 WeakPolarHBondContact O-CG 3.49Å; L633-M637 PolarHBondContact O-N 2.88Å; E634-M637 CarbonylContact O-C 3.51Å; E634-M637 PolarHBondContact O-N 3.45Å; E635-M637 VanDerWaalsContact C-N 3.31Å; E635-M637 PolarHBondContact O-N 3.15Å; M637-T640 PolarHBondContact O-OG1 3Å; M637-R641 WeakPolarHBondContact O-CB 3.49Å; M637-R641 VanDerWaalsContact O-CG 3.25Å; M637-R641 WeakPolarHBondContact O-CG 3.26Å; M637-R641 PolarHBondContact O-N 2.81Å
638	K	84.8	Confident	74	Confident	116 Å²	116	131.3 Å²	131.3	50%	0.504	61%	0.611	S	S	.	*	H	α-helix	trans	-72.6	-44.1	176.2	-85.7	171	167.5	170.1	0	110.9	E634 E635 T640 R641 R642	E634-K638 HydrophobicContact CG-CD 4.28Å; E634-K638 VanDerWaalsContact O-CB 3.23Å; E634-K638 WeakPolarHBondContact O-CB 3.44Å; E634-K638 VanDerWaalsContact O-CG 3.28Å; E634-K638 WeakPolarHBondContact O-CG 3.31Å; E634-K638 PolarHBondContact O-N 3Å; E634-K638 WeakPolarHBondContact OE1-CE 3.44Å; E634-K638 IonicContact OE1-NZ 2.61Å; E634-K638 PolarHBondContact OE1-NZ 2.87Å; E635-K638 PolarHBondContact O-N 3.45Å; K638-T640 VanDerWaalsContact C-N 3.32Å; K638-T640 PolarHBondContact O-N 2.8Å; K638-R641 PolarHBondContact O-N 2.79Å; K638-R642 WeakPolarHBondContact O-CB 3.41Å; K638-R642 WeakPolarHBondContact O-CG 3.39Å; K638-R642 PolarHBondContact O-N 3.2Å
639	R	80.7	Confident	71.7	Confident	177 Å²	177	133.9 Å²	133.9	67%	0.668	62%	0.62	S	S	*	*	H	α-helix	trans	-67.7	-28.9	176.1	75.5	-173	-173.1	168.7	6.5	112.9	E635 I636	E635-R639 WeakPolarHBondContact O-CG 3.31Å; E635-R639 PolarHBondContact O-N 3.14Å; I636-R639 VanDerWaalsContact O-CG 3.31Å; I636-R639 WeakPolarHBondContact O-CG 3.36Å
640	T	74.7	Confident	69.3	Low	91 Å²	91	133.6 Å²	133.6	56%	0.558	63%	0.634	S	S	*	*	H	α-helix	trans	-86.6	-17.6	173.9	57.6	0	0	0	0	114.1	I636 M637 K638 T643	I636-T640 WeakPolarHBondContact O-CG2 3.37Å; I636-T640 PolarHBondContact O-N 3.45Å; I636-T640 PolarHBondContact O-OG1 2.8Å; M637-T640 PolarHBondContact O-OG1 3Å; K638-T640 VanDerWaalsContact C-N 3.32Å; K638-T640 PolarHBondContact O-N 2.8Å; T640-T643 PolarHBondContact O-OG1 3.08Å
641	R	71.3	Confident	66.5	Low	184 Å²	184	132.3 Å²	132.3	69%	0.694	64%	0.642	S	S	*	*	H	α-helix	trans	-90.6	-27.2	170.2	-75.1	179.5	171.8	-177.9	-2.8	113.9	M637 K638 T643 E644	M637-R641 WeakPolarHBondContact O-CB 3.49Å; M637-R641 VanDerWaalsContact O-CG 3.25Å; M637-R641 WeakPolarHBondContact O-CG 3.26Å; M637-R641 PolarHBondContact O-N 2.81Å; K638-R641 PolarHBondContact O-N 2.79Å; R641-T643 PolarHBondContact O-N 3.17Å; R641-E644 PolarHBondContact O-N 3.18Å
642	R	55.8	Low	63.8	Low	187 Å²	187	131.2 Å²	131.2	71%	0.706	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.6	6.7	-178.8	-78.8	-65.1	-167.8	-169.8	2.6	115.3	K638 A645	K638-R642 WeakPolarHBondContact O-CB 3.41Å; K638-R642 WeakPolarHBondContact O-CG 3.39Å; K638-R642 PolarHBondContact O-N 3.2Å; R642-A645 PolarHBondContact NH1-O 3.27Å
643	T	53.8	Low	61.3	Low	118 Å²	118	128.9 Å²	128.9	72%	0.724	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.1	-13	163.2	14.7	0	0	0	0	113.3	T640 R641	T640-T643 PolarHBondContact O-OG1 3.08Å; R641-T643 PolarHBondContact O-N 3.17Å
644	E	49.3	Very low	58.8	Low	165 Å²	165	133.3 Å²	133.3	77%	0.771	65%	0.649	S	S	*	*	S	Bend	trans	-134.6	162.6	168.5	-64.8	-168.9	155.7	0	0	111.4	R641	R641-E644 PolarHBondContact O-N 3.18Å
645	A	47.8	Very low	56.5	Low	61 Å²	61	136 Å²	136	50%	0.504	67%	0.667	S	S	.	*			trans	55.9	87.6	-173.2	0	0	0	0	0	113.8	R642	R642-A645 PolarHBondContact NH1-O 3.27Å
646	T	42.2	Very low	54.2	Low	127 Å²	127	133.3 Å²	133.3	78%	0.779	67%	0.671	S	S	*	*				64	129.8	63.7	-41.5	0	0	0	0	113.8
647	D	48	Very low	51.9	Low	146 Å²	146	137.6 Å²	137.6	78%	0.781	70%	0.695	S	S	*	*			trans	-66.6	138.6	176.2	-61.4	-84.5	0	0	0	114
648	K	45.4	Very low	49.7	Very low	203 Å²	203	140.7 Å²	140.7	88%	0.883	71%	0.712	S	S	*	*			trans	-171.8	120.5	139.6	-99.9	142.3	-166.7	173.2	0	114.1
649	K	45.3	Very low	47.4	Very low	186 Å²	186	138.7 Å²	138.7	81%	0.809	72%	0.717	S	S	*	*			trans	5.2	155.5	143.8	-102.4	-179.2	174.3	178.1	0	122.7
650	T	39.7	Very low	45.3	Very low	129 Å²	129	140.6 Å²	140.6	79%	0.791	73%	0.73	S	S	*	*			trans	81.4	159.6	143.2	44.7	0	0	0	0	121.6
651	S	36	Very low	43.3	Very low	112 Å²	112	140.1 Å²	140.1	78%	0.783	74%	0.743	S	S	*	*			trans	65.1	111.4	-172.7	-110	0	0	0	0	115.1
652	D	36.3	Very low	41.5	Very low	123 Å²	123	136.3 Å²	136.3	66%	0.658	75%	0.751	S	S	*	*			cis	62.9	125.2	19.9	-165.9	19	0	0	0	114.9
653	Q	38.8	Very low	40.5	Very low	125 Å²	125	135 Å²	135	58%	0.584	76%	0.757	S	S	*	*			trans	51.4	136.3	173.4	-77.5	158.8	75.8	0	0	117.5
654	R	39.1	Very low	39.5	Very low	197 Å²	197	135.5 Å²	135.5	74%	0.743	76%	0.76	S	S	*	*			cis	-164.6	-179.8	32.5	-138.1	167.6	-112.3	179.8	-3.6	111.6
655	N	39.8	Very low	38.8	Very low	144 Å²	144	131.4 Å²	131.4	77%	0.77	76%	0.762	S	S	*	*			trans	-13.8	144.9	154.1	-45.8	-5.2	0	0	0	115.3
656	G	39.4	Very low	38	Very low	65 Å²	65	131.6 Å²	131.6	67%	0.67	77%	0.77	S	S	*	*			cis	123.4	-170	27.1	0	0	0	0	0	108.9
657	D	37.3	Very low	37.4	Very low	151 Å²	151	131.5 Å²	131.5	81%	0.807	77%	0.769	S	S	*	*			trans	64.9	149.8	177.1	-65.2	-33.2	0	0	0	115.8
658	I	39	Very low	36.6	Very low	147 Å²	147	132.7 Å²	132.7	75%	0.754	77%	0.771	S	S	*	*			cis	-146.7	159.6	0.6	-133.9	162.8	0	0	0	113.2
659	A	36.2	Very low	36.3	Very low	74 Å²	74	128 Å²	128	61%	0.612	76%	0.759	S	S	*	*			trans	22.2	116.8	156.6	0	0	0	0	0	120.5
660	K	37.1	Very low	36.2	Very low	218 Å²	218	124.6 Å²	124.6	95%	0.948	76%	0.758	S	S	*	*				78.1	127.5	92	-71.6	-175.5	177.7	-174.5	0	116.1
661	G	31.5	Very low	36.2	Very low	81 Å²	81	122.3 Å²	122.3	84%	0.835	75%	0.752	S	S	*	*			trans	139.5	112.3	177.5	0	0	0	0	0	109.2
662	A	34.6	Very low	36.4	Very low	103 Å²	103	123.9 Å²	123.9	85%	0.851	75%	0.751	S	S	*	*			cis	-141.2	163.3	0.6	0	0	0	0	0	111.4
663	L	35	Very low	37.1	Very low	159 Å²	159	123.6 Å²	123.6	83%	0.832	76%	0.756	S	S	*	*			trans	-151.3	157.3	167.7	-114.3	173.8	0	0	0	109.9
664	T	32.1	Very low	36.5	Very low	129 Å²	129	123.4 Å²	123.4	79%	0.791	77%	0.767	S	S	*	*			trans	55.2	73.2	168.4	60.1	0	0	0	0	118
665	G	35.2	Very low	36.2	Very low	80 Å²	80	119.5 Å²	119.5	83%	0.825	77%	0.765	S	S	*	*				-100.7	144.2	106.7	0	0	0	0	0	107.2
666	G	30.8	Very low	35.8	Very low	65 Å²	65	117.8 Å²	117.8	67%	0.67	76%	0.76	S	S	*	*			cis	106.9	74.8	30.4	0	0	0	0	0	107.2
667	T	29.9	Very low	35.2	Very low	124 Å²	124	122.2 Å²	122.2	76%	0.761	77%	0.769	S	S	*	*				55.6	112.2	92.1	-30.9	0	0	0	0	109.6	V669	T667-V669 HydrophobicContact CG2-CG2 4.42Å
668	E	29.7	Very low	35.1	Very low	172 Å²	172	119.3 Å²	119.3	80%	0.804	77%	0.765	S	S	*	*				-157.8	138.2	75.3	-94.1	-175.6	-174.7	0	0	111.8
669	V	40.6	Very low	35.5	Very low	105 Å²	105	118.4 Å²	118.4	64%	0.636	77%	0.769	S	S	*	*				76.2	132.3	77.6	164.8	0	0	0	0	111.4	T667	T667-V669 HydrophobicContact CG2-CG2 4.42Å
670	S	42.6	Very low	35.2	Very low	113 Å²	113	118.5 Å²	118.5	79%	0.79	78%	0.777	S	S	*	*	S	Bend	cis	-129.1	161.5	31.8	-82.6	0	0	0	0	114.3
671	A	39.4	Very low	34.8	Very low	81 Å²	81	116.6 Å²	116.6	67%	0.669	78%	0.777	S	S	*	*			cis	-174	159.4	-10.1	0	0	0	0	0	109.2
672	L	39.3	Very low	34.7	Very low	146 Å²	146	116.1 Å²	116.1	76%	0.764	77%	0.773	S	S	*	*			cis	-148.6	-61.7	-15.3	-117.2	170.2	0	0	0	113.4
673	P	52.1	Low	34.9	Very low	116 Å²	116	120.7 Å²	120.7	75%	0.753	77%	0.774	S	S	*	*			trans	-123.4	150.8	-154.8	35.9	-19.2	0	0	0	116.1
674	C	26.5	Very low	35.9	Very low	122 Å²	122	118 Å²	118	82%	0.824	77%	0.765	S	S	*	*			cis	-159.5	162.7	-10.9	-134.6	0	0	0	0	110.8
675	T	32.9	Very low	35.9	Very low	115 Å²	115	119 Å²	119	71%	0.706	77%	0.771	S	S	*	*			trans	-120	160.5	171.4	61.3	0	0	0	0	111.9
676	T	29.8	Very low	35.7	Very low	108 Å²	108	119 Å²	119	66%	0.663	77%	0.771	S	S	*	*			trans	50.4	126.5	146.7	52.1	0	0	0	0	120.3
677	N	26.7	Very low	35.8	Very low	158 Å²	158	121.5 Å²	121.5	85%	0.845	78%	0.778	S	S	*	*				179.6	165.5	97.2	-95.5	-53.3	0	0	0	114.1
678	A	36.3	Very low	37	Very low	89 Å²	89	120.5 Å²	120.5	74%	0.736	77%	0.774	S	S	*	*			trans	-99.1	175.9	160.6	0	0	0	0	0	108.9
679	P	46.7	Very low	36.8	Very low	129 Å²	129	120.3 Å²	120.3	84%	0.838	77%	0.772	S	S	*	*			cis	-124.9	170.3	45.3	38.5	-24.2	0	0	0	114.1
680	G	29.8	Very low	36.3	Very low	76 Å²	76	120.4 Å²	120.4	78%	0.784	77%	0.773	S	S	*	*			trans	-105.2	176.6	178.5	0	0	0	0	0	114.2
681	N	28.8	Very low	35.7	Very low	177 Å²	177	120.8 Å²	120.8	95%	0.947	77%	0.77	S	S	*	*			trans	-151.9	156.2	157	-151	-10.2	0	0	0	109.2
682	G	31	Very low	35.2	Very low	72 Å²	72	122.6 Å²	122.6	74%	0.742	77%	0.773	S	S	*	*			trans	103	92.8	175.5	0	0	0	0	0	116.6
683	K	37.7	Very low	34.9	Very low	199 Å²	199	120.4 Å²	120.4	87%	0.865	77%	0.77	S	S	*	*			trans	-89.6	174.4	157.2	-99.6	-174	178.7	-179.8	0	109.2
684	P	56.9	Low	34	Very low	102 Å²	102	122.4 Å²	122.4	66%	0.662	77%	0.769	S	S	*	*			cis	-143.2	-176.6	-28.3	38.9	-20.6	0	0	0	114.9
685	V	31.9	Very low	34.3	Very low	150 Å²	150	124.7 Å²	124.7	91%	0.909	77%	0.768	S	S	*	*			trans	63.6	130.3	144.9	162.2	0	0	0	0	120.2
686	G	31.2	Very low	34.4	Very low	79 Å²	79	124.2 Å²	124.2	81%	0.814	77%	0.769	S	S	*	*			trans	160.7	96.3	162.1	0	0	0	0	0	115.7
687	S	31.6	Very low	34.6	Very low	119 Å²	119	128 Å²	128	83%	0.832	78%	0.776	S	S	*	*			trans	-101.5	158.5	161.5	-167.7	0	0	0	0	107.6
688	P	55.8	Low	35	Very low	102 Å²	102	125.7 Å²	125.7	66%	0.662	77%	0.768	S	S	*	*			cis	-142.2	-157	19.4	44.3	-24.2	0	0	0	115.1
689	H	25	Very low	34.5	Very low	168 Å²	168	127.8 Å²	127.8	78%	0.778	77%	0.772	S	S	*	*			trans	77.1	155.5	156.5	-98.8	43.1	0	0	0	118.7
690	V	30.4	Very low	33.9	Very low	107 Å²	107	126.3 Å²	126.3	65%	0.648	76%	0.76	S	S	*	*			cis	172	161.6	-40.7	136.5	0	0	0	0	108
691	V	30.2	Very low	33.9	Very low	121 Å²	121	130.3 Å²	130.3	73%	0.733	76%	0.758	S	S	*	*			trans	77.5	102.7	165.7	144.8	0	0	0	0	118
692	T	29.6	Very low	34	Very low	120 Å²	120	127 Å²	127	74%	0.736	75%	0.749	S	S	*	*			trans	18.6	146.4	131.9	62.5	0	0	0	0	121
693	S	31.4	Very low	34.1	Very low	99 Å²	99	130 Å²	130	69%	0.692	75%	0.753	S	S	*	*				163.2	128.2	97.8	-164.8	0	0	0	0	115.7
694	H	33	Very low	34.7	Very low	158 Å²	158	126.2 Å²	126.2	73%	0.731	75%	0.749	S	S	*	*			trans	36.3	114.6	141.9	-67.6	-102.1	0	0	0	123.9
695	Q	34	Very low	33.2	Very low	170 Å²	170	129 Å²	129	79%	0.794	76%	0.758	S	S	*	*				84.8	141.2	110.7	-163.4	-177.8	75.4	0	0	122.5
696	S	35.6	Very low	33.4	Very low	106 Å²	106	128 Å²	128	74%	0.741	75%	0.747	S	S	*	*			trans	79.2	159.5	165.7	83.3	0	0	0	0	117
697	K	34.2	Very low	33.6	Very low	186 Å²	186	133.6 Å²	133.6	81%	0.809	75%	0.752	S	S	*	*			cis	-158.8	140.3	12.3	-156.8	175.4	177	-176.4	0	114.4
698	V	33.9	Very low	34	Very low	111 Å²	111	135.6 Å²	135.6	67%	0.673	75%	0.746	S	S	*	*			trans	19.1	136.5	147.9	-175.4	0	0	0	0	122.1	V700	V698-V700 HydrophobicContact CG1-CG2 3.8Å
699	T	26.6	Very low	33	Very low	132 Å²	132	137.8 Å²	137.8	81%	0.81	75%	0.747	S	S	*	*			trans	177	121.4	135.5	-72.8	0	0	0	0	107.3
700	V	34	Very low	34.1	Very low	98 Å²	98	134.9 Å²	134.9	59%	0.594	74%	0.743	S	S	*	*			cis	86.8	115.5	42.7	174.6	0	0	0	0	112.2	V698	V698-V700 HydrophobicContact CG1-CG2 3.8Å
701	E	29.1	Very low	34.1	Very low	160 Å²	160	134.8 Å²	134.8	75%	0.748	74%	0.739	S	S	*	*			cis	-125.9	-122.4	-0.4	-148.9	78.2	-73.6	0	0	112.9
702	S	30.9	Very low	34.5	Very low	107 Å²	107	136.6 Å²	136.6	75%	0.748	74%	0.74	S	S	*	*			cis	-161.2	166.9	10.3	-55.6	0	0	0	0	112.2
703	T	32.7	Very low	34.8	Very low	137 Å²	137	138.6 Å²	138.6	84%	0.84	75%	0.746	S	S	*	*			trans	-141.7	164.1	172.6	46.8	0	0	0	0	109
704	P	51.3	Low	35.1	Very low	119 Å²	119	137.7 Å²	137.7	77%	0.773	75%	0.752	S	S	*	*				-131	-161.4	50.1	37.4	-13.9	0	0	0	112.4
705	D	25.6	Very low	35	Very low	159 Å²	159	137.4 Å²	137.4	85%	0.85	76%	0.761	S	S	*	*			cis	-155.2	176.5	20.4	-157.5	5.4	0	0	0	114.3
706	L	35.8	Very low	35.3	Very low	131 Å²	131	134.1 Å²	134.1	69%	0.686	76%	0.757	S	S	*	*			trans	-137.3	105.6	-169	179.6	85.3	0	0	0	112.8
707	E	34.3	Very low	35.6	Very low	196 Å²	196	135.2 Å²	135.2	92%	0.916	76%	0.759	S	S	*	*			trans	-94.7	162.7	165.8	-163.5	163.1	-145.1	0	0	112
708	K	39.9	Very low	35.6	Very low	160 Å²	160	133.9 Å²	133.9	70%	0.696	76%	0.755	S	S	*	*			trans	-137.3	147.2	-162.2	-81.1	-176.1	176.9	178.2	0	114.2
709	Q	34.6	Very low	35.5	Very low	148 Å²	148	134.7 Å²	134.7	69%	0.692	76%	0.756	S	S	*	*			trans	73.4	161.7	150.5	-68	-92	-65.2	0	0	116.4	N711	Q709-N711 PolarHBondContact OE1-OD1 2.87Å; Q709-N711 VanDerWaalsContact OE1-OD1 3.07Å
710	P	49.5	Very low	36.4	Very low	108 Å²	108	136.3 Å²	136.3	70%	0.701	75%	0.754	S	S	*	*			cis	-123.7	152.1	6.2	40.3	-26.5	0	0	0	116.9
711	N	29.2	Very low	36.4	Very low	105 Å²	105	138.3 Å²	138.3	56%	0.561	76%	0.762	S	S	*	*			trans	45	153.8	133	-56.2	-13.4	0	0	0	125.2	Q709	Q709-N711 PolarHBondContact OE1-OD1 2.87Å; Q709-N711 VanDerWaalsContact OE1-OD1 3.07Å
712	E	38.8	Very low	36.7	Very low	159 Å²	159	140.1 Å²	140.1	74%	0.743	77%	0.767	S	S	*	*			trans	84.9	120.6	150.8	-76.7	151	-111.6	0	0	120.5
713	N	37.1	Very low	37.3	Very low	162 Å²	162	144.4 Å²	144.4	87%	0.866	78%	0.776	S	S	*	*			trans	71	90.6	158.2	-55.4	-33.3	0	0	0	119.1
714	G	36.5	Very low	37.7	Very low	79 Å²	79	145.5 Å²	145.5	81%	0.814	77%	0.771	S	S	*	*			trans	161.3	90.9	160.5	0	0	0	0	0	113.9
715	V	32.3	Very low	37.5	Very low	152 Å²	152	146.5 Å²	146.5	92%	0.921	77%	0.769	S	S	*	*			trans	-124.4	120.2	169.3	179.6	0	0	0	0	109.3
716	S	39.9	Very low	38.3	Very low	102 Å²	102	145.5 Å²	145.5	71%	0.713	76%	0.762	S	S	*	*			trans	-155.1	124.3	171.4	58.2	0	0	0	0	110.1
717	V	41.3	Very low	38.2	Very low	128 Å²	128	146.3 Å²	146.3	78%	0.776	77%	0.767	S	S	*	*			trans	71.6	128.2	157.8	179.3	0	0	0	0	113.4
718	Q	34.3	Very low	38.4	Very low	158 Å²	158	144.2 Å²	144.2	74%	0.738	76%	0.761	S	S	*	*			cis	-157.2	-178	20.2	-142.9	157.4	-3.5	0	0	113.3
719	N	32.2	Very low	38.8	Very low	128 Å²	128	142.4 Å²	142.4	68%	0.684	77%	0.766	S	S	*	*			trans	79.8	75.4	159.3	-59.4	-6.4	0	0	0	119.6
720	E	44.3	Very low	38.8	Very low	166 Å²	166	143.6 Å²	143.6	78%	0.776	78%	0.775	S	S	*	*				44.8	144.8	105.9	-60.3	176.3	-172.4	0	0	122.3
721	N	34.7	Very low	38.2	Very low	140 Å²	140	141.9 Å²	141.9	75%	0.749	78%	0.777	S	S	*	*			trans	64.3	121.5	175.2	-66	-26	0	0	0	116
722	F	35.7	Very low	38.4	Very low	198 Å²	198	142.9 Å²	142.9	87%	0.868	79%	0.792	S	S	*	*			cis	-133.5	155.2	23.9	-84.8	-96.4	0	0	0	113.2	E724	F722-E724 PolarHBondContact O-N 3.26Å
723	E	43.6	Very low	38.7	Very low	198 Å²	198	145.1 Å²	145.1	93%	0.925	80%	0.799	S	S	*	*			trans	-78.2	112.9	-179.5	-66	-173.5	130.2	0	0	113.6
724	E	41.5	Very low	39.5	Very low	160 Å²	160	143.5 Å²	143.5	75%	0.748	80%	0.797	S	S	*	*			trans	-82.7	135.5	148.9	172.5	-177.9	-153.2	0	0	108.8	F722	F722-E724 PolarHBondContact O-N 3.26Å
725	I	45.7	Very low	39.2	Very low	140 Å²	140	145.4 Å²	145.4	72%	0.718	80%	0.798	S	S	*	*			trans	-160.5	135	148.5	-105.5	148.4	0	0	0	111.5
726	I	43	Very low	39.2	Very low	137 Å²	137	148.1 Å²	148.1	70%	0.703	79%	0.792	S	S	*	*			trans	-92.4	117.3	178.9	-62.5	165.2	0	0	0	109
727	N	33.8	Very low	39	Very low	148 Å²	148	148.7 Å²	148.7	79%	0.791	79%	0.787	S	S	*	*			trans	-93.7	111	177	-82	-58.5	0	0	0	112.2
728	L	38.3	Very low	38.7	Very low	152 Å²	152	148.8 Å²	148.8	80%	0.796	78%	0.783	S	S	*	*			trans	-84	143	170.8	-71.7	170.6	0	0	0	111.2	I730	L728-I730 PolarHBondContact O-N 3.09Å
729	P	48.5	Very low	38.6	Very low	123 Å²	123	146.8 Å²	146.8	80%	0.799	78%	0.781	S	S	*	*			trans	-87.9	112.5	-173.5	32.9	-34	0	0	0	113.5
730	I	35.1	Very low	38.9	Very low	173 Å²	173	147.2 Å²	147.2	89%	0.887	79%	0.788	S	S	*	*			trans	-129.7	119.1	158	-57.8	-179.2	0	0	0	107.6	L728	L728-I730 PolarHBondContact O-N 3.09Å
731	G	35.8	Very low	38.3	Very low	71 Å²	71	145.7 Å²	145.7	73%	0.732	79%	0.785	S	S	*	*			trans	-99.3	155.6	-168.2	0	0	0	0	0	115.9
732	S	35	Very low	38.2	Very low	127 Å²	127	144 Å²	144	89%	0.888	79%	0.785	S	S	*	*			trans	-147.3	162	157.6	-82.3	0	0	0	0	109.3
733	K	44.9	Very low	38.3	Very low	206 Å²	206	142.4 Å²	142.4	90%	0.896	78%	0.78	S	S	*	*			trans	-111.9	-169.2	-169.1	-40.1	-176.1	178.3	178.2	0	112.5
734	P	52.5	Low	38	Very low	127 Å²	127	137.9 Å²	137.9	83%	0.825	77%	0.771	S	S	*	*				-125.9	162.8	-123.6	32.5	-9.7	0	0	0	116
735	S	30.8	Very low	38.9	Very low	119 Å²	119	136 Å²	136	83%	0.832	77%	0.772	S	S	*	*			trans	-173.1	159.1	171.1	-176.1	0	0	0	0	110
736	R	33	Very low	38.8	Very low	210 Å²	210	138.2 Å²	138.2	79%	0.792	78%	0.779	S	S	*	*			cis	-176.5	127.7	-37.7	172.8	178.1	165.4	173.6	-5.4	107.5
737	L	35	Very low	39	Very low	114 Å²	114	138.3 Å²	138.3	60%	0.597	78%	0.78	S	S	*	*			trans	62.8	132	159.9	-69	-179.6	0	0	0	121.5
738	D	34.4	Very low	39.6	Very low	129 Å²	129	137.2 Å²	137.2	69%	0.69	78%	0.781	S	S	*	*				87.4	132.7	121.1	-66.5	-3.5	0	0	0	127
739	V	32.9	Very low	39.7	Very low	116 Å²	116	136.5 Å²	136.5	70%	0.703	78%	0.777	S	S	*	*			trans	79.3	119.9	137.5	168.2	0	0	0	0	120.9
740	T	37.4	Very low	39	Very low	137 Å²	137	138 Å²	138	84%	0.84	78%	0.778	S	S	*	*			trans	-139.4	109.2	148.9	53.3	0	0	0	0	110.5
741	N	32.8	Very low	39.6	Very low	134 Å²	134	134.4 Å²	134.4	72%	0.717	77%	0.767	S	S	*	*			trans	-86	176	151.4	-59.5	-56.3	0	0	0	107.5
742	S	33	Very low	39.7	Very low	106 Å²	106	138.9 Å²	138.9	74%	0.741	77%	0.772	S	S	*	*			cis	-166.8	172.4	3.6	9.4	0	0	0	0	108.1
743	E	37.4	Very low	39.9	Very low	163 Å²	163	140 Å²	140	76%	0.762	77%	0.767	S	S	*	*			cis	177.1	136.7	-25.6	175.6	-179.4	153.5	0	0	109.7
744	S	37.9	Very low	39.4	Very low	104 Å²	104	133.5 Å²	133.5	73%	0.727	75%	0.752	S	S	*	*			trans	64.2	173.5	161.3	-71	0	0	0	0	118.2
745	P	58.7	Low	38.7	Very low	119 Å²	119	136.4 Å²	136.4	77%	0.773	75%	0.752	S	S	*	*			cis	-105.9	-174	1.4	42.8	-31.3	0	0	0	113.3
746	E	43.7	Very low	39	Very low	187 Å²	187	138.7 Å²	138.7	87%	0.874	76%	0.755	S	S	*	*			cis	-148	173.5	23.1	-160.7	164.6	-142.4	0	0	112.5
747	I	47.3	Very low	39.4	Very low	139 Å²	139	135.7 Å²	135.7	71%	0.713	76%	0.755	S	S	*	*			trans	-127.3	159	-156.1	-24.1	179	0	0	0	112.8
748	P	46.2	Very low	39.7	Very low	126 Å²	126	139.2 Å²	139.2	82%	0.818	77%	0.768	S	S	*	*				-146.2	119.4	105.8	34.9	-17.6	0	0	0	117.1
749	L	40.4	Very low	39.8	Very low	136 Å²	136	136.1 Å²	136.1	71%	0.712	77%	0.766	S	S	*	*			trans	9.1	129.8	142.4	-66.4	154.7	0	0	0	120.7
750	N	34.8	Very low	40	Very low	154 Å²	154	137.2 Å²	137.2	82%	0.824	77%	0.774	S	S	*	*				-168.5	155.9	91.3	-96.9	-49	0	0	0	113.9
751	P	46.7	Very low	40.2	Very low	99 Å²	99	139.1 Å²	139.1	64%	0.643	78%	0.778	S	S	*	*			trans	-107.7	173.4	-170.9	41.5	-35.2	0	0	0	114.6
752	I	39.3	Very low	40.4	Very low	165 Å²	165	136.2 Å²	136.2	85%	0.846	78%	0.779	S	S	*	*			trans	-132.1	120.7	169.1	-64.9	-178.9	0	0	0	110.4
753	L	39.4	Very low	41	Very low	149 Å²	149	137.5 Å²	137.5	78%	0.78	79%	0.785	S	S	*	*			trans	-76.5	136.5	159.7	-87.3	59.7	0	0	0	107.6
754	A	34.8	Very low	41	Very low	71 Å²	71	136.9 Å²	136.9	59%	0.587	79%	0.786	S	S	*	*				81.8	125.8	53.1	0	0	0	0	0	113.6
755	F	35.8	Very low	41.7	Very low	187 Å²	187	137.3 Å²	137.3	82%	0.82	79%	0.786	S	S	*	*			trans	70.9	127.9	178.2	-55.1	-79.6	0	0	0	118.4
756	D	37.2	Very low	40.4	Very low	168 Å²	168	139.4 Å²	139.4	90%	0.898	79%	0.786	S	S	*	*				-137.2	141.8	124.7	-95.2	-39.3	0	0	0	106.8
757	D	42.3	Very low	40.1	Very low	147 Å²	147	135.8 Å²	135.8	79%	0.786	78%	0.776	S	S	*	*			trans	-111	-153	177	-131.4	-44.4	0	0	0	108.4
758	E	41.9	Very low	39.5	Very low	188 Å²	188	136.7 Å²	136.7	88%	0.879	78%	0.782	S	S	*	*			trans	78.9	140.6	-179.3	-56.5	-72.9	177.6	0	0	115.5
759	G	36.9	Very low	39	Very low	63 Å²	63	133.7 Å²	133.7	65%	0.649	77%	0.774	S	S	*	*			cis	-168.2	159	-2.8	0	0	0	0	0	111.3
760	T	36.3	Very low	38.7	Very low	140 Å²	140	134.4 Å²	134.4	86%	0.859	78%	0.784	S	S	*	*			trans	-119	130.1	-171.3	-66	0	0	0	0	112.6
761	L	40.6	Very low	38.6	Very low	177 Å²	177	134.8 Å²	134.8	93%	0.927	78%	0.781	S	S	*	*			trans	-145.9	149.8	162.1	-75.5	-177.4	0	0	0	112.8
762	G	38.3	Very low	38	Very low	72 Å²	72	136 Å²	136	74%	0.742	79%	0.787	S	S	*	*			trans	-94.9	-149.9	-179.5	0	0	0	0	0	114.4
763	P	46.2	Very low	37.8	Very low	133 Å²	133	136.4 Å²	136.4	86%	0.864	79%	0.785	S	S	*	*			cis	-140.7	-179.7	45.8	40.5	-21.5	0	0	0	117.8
764	L	36.3	Very low	37.7	Very low	151 Å²	151	138.3 Å²	138.3	79%	0.791	79%	0.79	S	S	*	*			trans	-71.3	164.1	170.6	-95.4	165	0	0	0	112.6
765	P	52.6	Low	37.9	Very low	112 Å²	112	141 Å²	141	73%	0.727	80%	0.799	S	S	*	*				-132.2	-167.1	50.4	44.4	-27.4	0	0	0	113.6
766	Q	31.2	Very low	38.2	Very low	163 Å²	163	136 Å²	136	76%	0.762	79%	0.793	S	S	*	*			cis	-143.1	-128.2	8.8	-158.1	-177.3	-83.6	0	0	113.1
767	V	38.4	Very low	38.3	Very low	111 Å²	111	136.5 Å²	136.5	67%	0.673	79%	0.79	S	S	*	*			trans	-153.2	137.7	-160.1	178.2	0	0	0	0	109.5
768	D	34.5	Very low	38.2	Very low	158 Å²	158	135.3 Å²	135.3	85%	0.845	79%	0.787	S	S	*	*				176.3	145.8	128.6	-102.2	-31.9	0	0	0	115.7
769	G	34.4	Very low	38.4	Very low	63 Å²	63	137.4 Å²	137.4	65%	0.649	80%	0.802	S	S	*	*				107.2	82.4	123.8	0	0	0	0	0	122.7
770	V	33.9	Very low	38.4	Very low	152 Å²	152	141.1 Å²	141.1	92%	0.921	81%	0.81	S	S	*	*			trans	62.9	116.7	133.1	-170.1	0	0	0	0	122.3
771	Q	33.4	Very low	38.5	Very low	162 Å²	162	141.2 Å²	141.2	76%	0.757	81%	0.807	S	S	*	*			trans	-66.3	169.7	168.8	163	-178.7	0.7	0	0	117.9
772	T	34.6	Very low	38.4	Very low	123 Å²	123	139.2 Å²	139.2	76%	0.755	80%	0.8	S	S	*	*			trans	72.6	154.5	167.5	37	0	0	0	0	118.1
773	Q	34.8	Very low	38.4	Very low	174 Å²	174	143.1 Å²	143.1	81%	0.813	80%	0.804	S	S	*	*			cis	-131.3	172	24.9	-65.4	177.7	-4	0	0	115.7
774	Q	38.3	Very low	38	Very low	190 Å²	190	143.8 Å²	143.8	89%	0.888	80%	0.8	S	S	*	*			trans	-119.7	138.7	161.6	-71.6	-179.2	-31.1	0	0	110.2
775	T	37.7	Very low	38.1	Very low	126 Å²	126	143.3 Å²	143.3	77%	0.773	80%	0.801	S	S	*	*			trans	-158.2	127.3	157.9	19.6	0	0	0	0	106.4
776	A	43.5	Very low	37	Very low	83 Å²	83	145.5 Å²	145.5	69%	0.686	81%	0.806	S	S	*	*				74.5	146.4	77.7	0	0	0	0	0	111.9
777	E	38.9	Very low	37.5	Very low	179 Å²	179	144.2 Å²	144.2	84%	0.836	81%	0.809	S	S	*	*			cis	-160.5	-157.4	19.5	-152.1	164.9	-120.8	0	0	111.4
778	V	38.5	Very low	37.4	Very low	122 Å²	122	146.9 Å²	146.9	74%	0.739	82%	0.821	S	S	*	*			trans	86.5	117.7	162.6	-171	0	0	0	0	117
779	I	46.3	Very low	37.7	Very low	231 Å²	231	145.9 Å²	145.9	100%	1.185	82%	0.818	S	S	*	*			cis	-143.1	0	-12.9	-113.3	168.1	0	0	0	107.3

Retrieved 779 of 779 residues in 2349 ms (Link to these results)

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