A0A096LS94_POEFO Loading...

RUN and FYVE domain containing 2

AlphaFold DB , UniProt , Accession A0A096LS94, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 707 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	36.9	Very low	36.7	Very low	247 Å²	247	137.1 Å²	137.1	100%	1.217	84%	0.839	S	S	*	*				0	145.9	0	-62.9	168.6	173	0	0	107.6
2	A	36.4	Very low	36.3	Very low	90 Å²	90	138.4 Å²	138.4	74%	0.744	84%	0.836	S	S	*	*			cis	-177.5	126.6	-28.2	0	0	0	0	0	107.2
3	S	37.1	Very low	35.7	Very low	129 Å²	129	140.6 Å²	140.6	90%	0.902	84%	0.84	S	S	*	*			trans	62.5	162.6	177.5	-109.7	0	0	0	0	116.4
4	A	39.9	Very low	35.3	Very low	92 Å²	92	142.7 Å²	142.7	76%	0.76	84%	0.837	S	S	*	*			cis	-137.4	163.7	-2.7	0	0	0	0	0	111
5	A	41.1	Very low	35	Very low	90 Å²	90	139.5 Å²	139.5	74%	0.744	83%	0.833	S	S	*	*			trans	-89.6	162.5	173.9	0	0	0	0	0	112.3
6	A	38.6	Very low	34.7	Very low	105 Å²	105	140.9 Å²	140.9	87%	0.868	84%	0.835	S	S	*	*			trans	-149	86.8	164.2	0	0	0	0	0	109.1
7	E	34	Very low	34.4	Very low	188 Å²	188	137.5 Å²	137.5	88%	0.879	82%	0.82	S	S	*	*			trans	-75.9	153.4	165.1	-66.1	168.3	134.1	0	0	109.1
8	H	40.4	Very low	34.2	Very low	176 Å²	176	135.2 Å²	135.2	82%	0.815	81%	0.812	S	S	*	*			trans	-142.4	98.1	168.4	-153	-49.1	0	0	0	110.2
9	D	36.3	Very low	34.1	Very low	151 Å²	151	137.7 Å²	137.7	81%	0.807	81%	0.811	S	S	*	*			trans	-61.9	152.8	164.8	-96.5	-42.1	0	0	0	111
10	L	32.1	Very low	33.9	Very low	162 Å²	162	137.8 Å²	137.8	85%	0.848	80%	0.803	S	S	*	*			trans	-153.1	129.7	142.4	-116.7	169.4	0	0	0	109.7
11	A	31.2	Very low	33.8	Very low	78 Å²	78	140.1 Å²	140.1	65%	0.645	80%	0.804	S	S	*	*			trans	-82.3	149	-161.7	0	0	0	0	0	114.4
12	L	31.6	Very low	33.4	Very low	153 Å²	153	132.4 Å²	132.4	80%	0.801	79%	0.787	S	S	*	*				27.9	142.2	128.1	-58	168.6	0	0	0	119.8
13	N	29.1	Very low	33	Very low	167 Å²	167	137 Å²	137	89%	0.893	79%	0.793	S	S	*	*			trans	-142.3	151.2	136.3	-139	-14.4	0	0	0	110.5
14	E	29.8	Very low	32.5	Very low	170 Å²	170	136.5 Å²	136.5	79%	0.794	78%	0.784	S	S	*	*			trans	-113	152.5	-162.2	-56.8	173.2	117.6	0	0	113.8
15	A	30.1	Very low	31.8	Very low	94 Å²	94	141.7 Å²	141.7	78%	0.777	79%	0.79	S	S	*	*			trans	168.6	115.7	144.5	0	0	0	0	0	108
16	D	30.7	Very low	31	Very low	162 Å²	162	141.1 Å²	141.1	87%	0.866	79%	0.793	S	S	*	*				72.6	129.3	63.8	-155.7	43.1	0	0	0	112.1
17	S	29	Very low	30.4	Very low	83 Å²	83	143.5 Å²	143.5	58%	0.58	79%	0.79	S	S	*	*			cis	-153.7	172.8	14	81.7	0	0	0	0	114.7
18	S	30.9	Very low	30	Very low	96 Å²	96	142.5 Å²	142.5	67%	0.671	79%	0.79	S	S	*	*			trans	67.1	107.2	141.5	-56.3	0	0	0	0	124.2
19	K	33.4	Very low	29.4	Very low	184 Å²	184	144.6 Å²	144.6	80%	0.8	79%	0.79	S	S	*	*				77	128.5	119.6	-72.6	-169.9	176.5	-173.1	0	124.7
20	E	30.2	Very low	28.8	Very low	138 Å²	138	145.7 Å²	145.7	65%	0.645	80%	0.795	S	S	*	*			trans	74.3	108.3	137.8	-66.6	-161.2	101	0	0	123.5
21	K	30.9	Very low	28.6	Very low	188 Å²	188	146.8 Å²	146.8	82%	0.817	80%	0.796	S	S	*	*				42.8	104.6	128.6	-60.7	171.5	-171.8	147.6	0	118.3
22	G	29	Very low	28.4	Very low	85 Å²	85	152 Å²	152	88%	0.876	81%	0.807	S	S	*	*			trans	-144.9	140.7	163.9	0	0	0	0	0	111.8
23	Q	28.1	Very low	28.2	Very low	187 Å²	187	151.7 Å²	151.7	87%	0.874	80%	0.802	S	S	*	*			trans	-99.4	164.9	-169.6	-139.9	179.3	-4.2	0	0	112.2
24	V	25.2	Very low	28.1	Very low	117 Å²	117	151.6 Å²	151.6	71%	0.709	79%	0.793	S	S	*	*			trans	82.6	126.9	153.3	171.7	0	0	0	0	120.4
25	F	25.2	Very low	28	Very low	201 Å²	201	149.6 Å²	149.6	88%	0.882	80%	0.798	S	S	*	*			trans	20.3	128.9	153.1	-76	-106.1	0	0	0	121.7
26	G	25.6	Very low	28	Very low	79 Å²	79	148.6 Å²	148.6	81%	0.814	80%	0.797	S	S	*	*			trans	-156.6	111.3	164.5	0	0	0	0	0	113.2
27	I	26.5	Very low	27.9	Very low	154 Å²	154	146.5 Å²	146.5	79%	0.79	80%	0.802	S	S	*	*			trans	-79.9	133.1	-179.6	-65.3	162.1	0	0	0	111.2
28	L	25.2	Very low	27.9	Very low	167 Å²	167	145.9 Å²	145.9	87%	0.874	81%	0.808	S	S	*	*			trans	-131.3	107.4	153.1	-72.6	172.4	0	0	0	107
29	R	26.4	Very low	27.9	Very low	220 Å²	220	148.7 Å²	148.7	83%	0.83	82%	0.816	S	S	*	*				70.6	89.7	66.4	-162.2	179	-154.3	161.5	7.8	111.6
30	L	25.6	Very low	27.7	Very low	174 Å²	174	149.2 Å²	149.2	91%	0.911	82%	0.818	S	S	*	*			trans	-59.8	153.6	168.7	-71.5	160.9	0	0	0	111.1
31	Q	25.9	Very low	27.7	Very low	185 Å²	185	147 Å²	147	86%	0.864	82%	0.824	S	S	*	*			trans	-128.6	129.3	174.5	-178.7	173.1	-16.4	0	0	108.7
32	E	28.8	Very low	27.6	Very low	189 Å²	189	145 Å²	145	88%	0.883	82%	0.822	S	S	*	*			trans	-97.3	143.3	-173.1	-63	175.2	113.9	0	0	112.9
33	E	26.2	Very low	27.7	Very low	146 Å²	146	145.7 Å²	145.7	68%	0.682	81%	0.814	S	S	*	*			trans	-148.4	149.2	156.5	-74.1	-142.9	160.4	0	0	108.1
34	K	28.1	Very low	27.6	Very low	164 Å²	164	142.5 Å²	142.5	71%	0.713	81%	0.812	S	S	*	*			cis	-167.9	130.5	-13.6	-115	-179.2	-169.6	141.4	0	109.2
35	S	27.8	Very low	27.9	Very low	129 Å²	129	144 Å²	144	90%	0.902	82%	0.821	S	S	*	*			trans	176.5	139.2	151.6	53.2	0	0	0	0	110.7
36	G	28.8	Very low	28.1	Very low	72 Å²	72	137.6 Å²	137.6	74%	0.742	81%	0.813	S	S	*	*			cis	162.3	126.7	-7.1	0	0	0	0	0	111.8
37	A	30	Very low	28.3	Very low	118 Å²	118	146.5 Å²	146.5	98%	0.975	82%	0.822	S	S	*	*			trans	64.8	149.4	-176.5	0	0	0	0	0	116.4
38	G	28.4	Very low	28.4	Very low	70 Å²	70	142.7 Å²	142.7	72%	0.722	82%	0.821	S	S	*	*			cis	-167.6	160.9	-4.3	0	0	0	0	0	112.9
39	D	30.6	Very low	28.5	Very low	155 Å²	155	139 Å²	139	83%	0.829	82%	0.823	S	S	*	*			trans	-77.8	152.5	-163.2	-52.7	-88.3	0	0	0	117.1
40	K	30.3	Very low	28.6	Very low	195 Å²	195	132.6 Å²	132.6	85%	0.848	83%	0.825	S	S	*	*				-175.9	128.9	106.1	-97.2	156.8	-173.5	173.1	0	115.1
41	A	29.6	Very low	28.7	Very low	93 Å²	93	128 Å²	128	77%	0.769	82%	0.82	S	S	*	*				35.7	151.4	128.3	0	0	0	0	0	121.4
42	N	29	Very low	28.8	Very low	144 Å²	144	126.7 Å²	126.7	77%	0.77	82%	0.824	S	S	*	*			cis	-157.2	157.8	22.8	-157.6	13.8	0	0	0	115.1
43	S	30.1	Very low	28.8	Very low	101 Å²	101	120.9 Å²	120.9	71%	0.706	82%	0.815	S	S	*	*			trans	36.4	129.6	148.2	63.2	0	0	0	0	122.3
44	S	26.6	Very low	28.8	Very low	119 Å²	119	122.4 Å²	122.4	83%	0.832	83%	0.828	S	S	*	*			trans	-124	142.1	163.2	60.6	0	0	0	0	113
45	T	31.4	Very low	29.1	Very low	148 Å²	148	117.7 Å²	117.7	91%	0.908	83%	0.826	S	S	*	*			trans	-155.9	138.4	170	52.1	0	0	0	0	108.9
46	G	29.4	Very low	29.1	Very low	68 Å²	68	120.7 Å²	120.7	70%	0.701	82%	0.818	S	S	*	*			cis	160.5	142.8	-7.2	0	0	0	0	0	111.5
47	R	30.5	Very low	28.9	Very low	265 Å²	265	126 Å²	126	100%	1	82%	0.816	S	S	*	*			trans	64	149.4	-179	-65.3	173.1	159.6	176.9	-7.8	116.3
48	G	27.5	Very low	28.9	Very low	75 Å²	75	127.5 Å²	127.5	77%	0.773	80%	0.802	S	S	*	*			cis	159.9	133.7	-12.7	0	0	0	0	0	114.7
49	G	28	Very low	29.2	Very low	89 Å²	89	127.2 Å²	127.2	92%	0.918	79%	0.794	S	S	*	*			trans	81	145	173	0	0	0	0	0	115.2
50	G	28.1	Very low	29.6	Very low	85 Å²	85	124.9 Å²	124.9	88%	0.876	79%	0.787	S	S	*	*			cis	165.1	140.1	-8.2	0	0	0	0	0	111.4
51	G	27.6	Very low	30	Very low	79 Å²	79	122.6 Å²	122.6	81%	0.814	78%	0.782	S	S	*	*			trans	165.4	101.2	-179.9	0	0	0	0	0	115.3
52	V	29.1	Very low	30.3	Very low	156 Å²	156	125.5 Å²	125.5	95%	0.945	78%	0.778	S	S	*	*			trans	-28	142.2	169.4	-175.9	0	0	0	0	116.9
53	G	27.8	Very low	30.6	Very low	67 Å²	67	121.7 Å²	121.7	69%	0.691	77%	0.766	S	S	*	*			trans	154.4	73	149.5	0	0	0	0	0	120.4
54	D	27.4	Very low	30.9	Very low	178 Å²	178	123.7 Å²	123.7	95%	0.952	77%	0.768	S	S	*	*			trans	61.4	164.5	157.1	-145	-8.2	0	0	0	118.8
55	G	33	Very low	31.3	Very low	66 Å²	66	121.6 Å²	121.6	68%	0.68	76%	0.758	S	S	*	*			trans	-106.9	126.6	-166.1	0	0	0	0	0	115.5
56	R	28.1	Very low	31.6	Very low	192 Å²	192	122.2 Å²	122.2	73%	0.725	74%	0.744	S	S	*	*			trans	-159.2	139.2	163.9	-146.7	177.6	172.1	-172	-1.2	113.5
57	W	25.8	Very low	31.8	Very low	183 Å²	183	126 Å²	126	69%	0.693	74%	0.741	S	S	*	*			trans	68.3	156.6	168.5	-43.5	124.2	0	0	0	116.5
58	Q	29.6	Very low	31.9	Very low	149 Å²	149	116.8 Å²	116.8	70%	0.696	72%	0.722	S	S	*	*			cis	-155.7	169.1	-20	-116.1	179.4	39.7	0	0	110.6
59	A	33.8	Very low	32.2	Very low	65 Å²	65	117.6 Å²	117.6	54%	0.537	72%	0.715	S	S	.	*			trans	7.9	129.6	161	0	0	0	0	0	119.5
60	P	38.4	Very low	32.5	Very low	105 Å²	105	119.9 Å²	119.9	68%	0.682	70%	0.702	S	S	*	*	S	Bend		-128.2	-3.7	84.9	37.4	-32.4	0	0	0	116.3	F62 A63	P60-F62 VanDerWaalsContact C-N 3.28Å; P60-F62 PolarHBondContact O-N 3.45Å; P60-A63 WeakPolarHBondContact O-CB 3.31Å; P60-A63 PolarHBondContact O-N 3.23Å; P60-A63 VanDerWaalsContact O-N 3.16Å
61	I	39.6	Very low	32.8	Very low	147 Å²	147	121 Å²	121	75%	0.754	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.1	-29.2	-175	-62.3	177	0	0	0	112.8	A63 L64	I61-A63 PolarHBondContact O-N 2.95Å; I61-L64 PolarHBondContact O-N 3.24Å
62	F	35.7	Very low	33.1	Very low	154 Å²	154	124.1 Å²	124.1	68%	0.675	69%	0.689	S	S	*	*	H	α-helix	trans	-62.7	-9.6	175.6	-81.1	-78.7	0	0	0	115.1	P60	P60-F62 VanDerWaalsContact C-N 3.28Å; P60-F62 PolarHBondContact O-N 3.45Å
63	A	35.9	Very low	33.4	Very low	64 Å²	64	122.1 Å²	122.1	53%	0.529	68%	0.682	S	S	.	*	H	α-helix	trans	-80.7	-30.7	176.9	0	0	0	0	0	113.7	P60 I61	P60-A63 WeakPolarHBondContact O-CB 3.31Å; P60-A63 PolarHBondContact O-N 3.23Å; P60-A63 VanDerWaalsContact O-N 3.16Å; I61-A63 PolarHBondContact O-N 2.95Å
64	L	36.3	Very low	33.4	Very low	144 Å²	144	122.2 Å²	122.2	75%	0.754	68%	0.683	S	S	*	*	H	α-helix	trans	-76.4	-47.7	-180	-107.7	73.7	0	0	0	111.9	I61 R66 K67 A68	I61-L64 PolarHBondContact O-N 3.24Å; L64-R66 VanDerWaalsContact C-N 3.25Å; L64-R66 PolarHBondContact O-N 2.76Å; L64-K67 PolarHBondContact O-N 2.97Å; L64-A68 PolarHBondContact O-N 2.91Å
65	A	34.8	Very low	33.3	Very low	75 Å²	75	120 Å²	120	62%	0.62	68%	0.681	S	S	*	*	H	α-helix	trans	-62.1	-30.3	-175.8	0	0	0	0	0	113.4
66	R	37.6	Very low	33.4	Very low	160 Å²	160	124.1 Å²	124.1	60%	0.604	69%	0.686	S	S	*	*	H	α-helix	trans	-77.5	-36.5	177.3	-159.1	177.6	-60.3	147.3	3.3	112.6	L64 A68 S69	L64-R66 VanDerWaalsContact C-N 3.25Å; L64-R66 PolarHBondContact O-N 2.76Å; R66-A68 VanDerWaalsContact C-N 3.28Å; R66-A68 PolarHBondContact O-N 2.95Å; R66-S69 PolarHBondContact O-N 3.43Å
67	K	32.9	Very low	33.5	Very low	147 Å²	147	123.1 Å²	123.1	64%	0.639	69%	0.689	S	S	*	*	H	α-helix	trans	-70.3	-22.6	-176.7	-161.6	169.1	-174.5	177.2	0	113.5	L64 T71	L64-K67 PolarHBondContact O-N 2.97Å; K67-T71 PolarHBondContact O-OG1 3.15Å
68	A	32.3	Very low	33.8	Very low	72 Å²	72	120.1 Å²	120.1	60%	0.595	69%	0.691	S	S	*	*	H	α-helix	trans	-63.2	-41.7	171.7	0	0	0	0	0	112.4	L64 R66 E70	L64-A68 PolarHBondContact O-N 2.91Å; R66-A68 VanDerWaalsContact C-N 3.28Å; R66-A68 PolarHBondContact O-N 2.95Å; A68-E70 VanDerWaalsContact C-N 3.34Å; A68-E70 PolarHBondContact O-N 3.2Å
69	S	35	Very low	33.8	Very low	92 Å²	92	120 Å²	120	64%	0.643	69%	0.694	S	S	*	*	H	α-helix	trans	-73.2	-23.2	-179.4	-57.9	0	0	0	0	114	R66	R66-S69 PolarHBondContact O-N 3.43Å
70	E	33.4	Very low	34	Very low	137 Å²	137	123 Å²	123	64%	0.64	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.3	-5.1	-176.5	-69.6	172.4	173.1	0	0	113.5	A68	A68-E70 VanDerWaalsContact C-N 3.34Å; A68-E70 PolarHBondContact O-N 3.2Å
71	T	33.8	Very low	33.5	Very low	110 Å²	110	127 Å²	127	68%	0.675	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.8	15.7	-178.1	-42	0	0	0	0	113.1	K67 S73	K67-T71 PolarHBondContact O-OG1 3.15Å; T71-S73 VanDerWaalsContact C-N 3.28Å; T71-S73 PolarHBondContact O-N 3.13Å
72	I	34.7	Very low	33	Very low	143 Å²	143	126.8 Å²	126.8	73%	0.733	72%	0.72	S	S	*	*	S	Bend	trans	-94.4	24.3	178.5	-43.1	-176.8	0	0	0	111.3
73	S	35.1	Very low	32.7	Very low	115 Å²	115	124.9 Å²	124.9	80%	0.804	73%	0.726	S	S	*	*	S	Bend	trans	-155.7	103.2	171.1	-170.4	0	0	0	0	111.1	T71	T71-S73 VanDerWaalsContact C-N 3.28Å; T71-S73 PolarHBondContact O-N 3.13Å
74	G	27.4	Very low	32.4	Very low	69 Å²	69	130 Å²	130	71%	0.711	74%	0.739	S	S	*	*	S	Bend	trans	143	104.8	170.5	0	0	0	0	0	116.4
75	S	26.8	Very low	32.1	Very low	130 Å²	130	132.5 Å²	132.5	91%	0.909	75%	0.746	S	S	*	*			trans	59.7	117.7	148.5	-55.7	0	0	0	0	120.7
76	I	34	Very low	31.9	Very low	153 Å²	153	140 Å²	140	79%	0.785	76%	0.758	S	S	*	*			trans	-97	147.4	168.7	-66.7	166.2	0	0	0	110
77	H	31	Very low	31.5	Very low	172 Å²	172	138 Å²	138	80%	0.796	77%	0.765	S	S	*	*			trans	162	162.2	142.5	-83.9	-44.2	0	0	0	110.8
78	V	32.6	Very low	31.4	Very low	119 Å²	119	136.2 Å²	136.2	72%	0.721	77%	0.77	S	S	*	*			cis	-146.7	160.9	21	-141.5	0	0	0	0	112.2
79	L	28.9	Very low	31.3	Very low	148 Å²	148	140.7 Å²	140.7	78%	0.775	78%	0.783	S	S	*	*			trans	67.8	164.3	164	-62.2	172	0	0	0	117.9
80	P	38.4	Very low	31.9	Very low	127 Å²	127	142 Å²	142	83%	0.825	79%	0.79	S	S	*	*			cis	-105.1	173.5	-15.5	37.8	-27.8	0	0	0	113.6
81	K	28.2	Very low	31.9	Very low	188 Å²	188	138.5 Å²	138.5	82%	0.817	79%	0.791	S	S	*	*			trans	-87.7	148.9	-166.1	-60	179.3	176.6	-174.4	0	115.5
82	V	28.6	Very low	31.8	Very low	144 Å²	144	138.7 Å²	138.7	87%	0.873	79%	0.788	S	S	*	*			trans	-127.6	169.7	131.1	-177.6	0	0	0	0	107.8
83	S	28.8	Very low	32.1	Very low	113 Å²	113	143 Å²	143	79%	0.79	79%	0.794	S	S	*	*			trans	-68.1	155.6	-156.5	49.2	0	0	0	0	118.7
84	E	29.8	Very low	32.5	Very low	172 Å²	172	143.3 Å²	143.3	80%	0.804	79%	0.792	S	S	*	*			trans	-80.7	155.9	-174.3	-48.2	163.5	137.5	0	0	114.5
85	H	29.4	Very low	33.2	Very low	197 Å²	197	144.7 Å²	144.7	91%	0.912	79%	0.787	S	S	*	*			trans	-144.7	160.9	130.4	-111.1	47.9	0	0	0	111.1
86	R	31.1	Very low	34	Very low	231 Å²	231	146.7 Å²	146.7	87%	0.872	78%	0.781	S	S	*	*			trans	-81.6	166	-167.9	-52.7	175.8	174.3	-178.7	-3.3	111.5
87	T	30.3	Very low	34.5	Very low	120 Å²	120	141.9 Å²	141.9	74%	0.736	76%	0.764	S	S	*	*			cis	-160.9	161.7	23.6	-31.5	0	0	0	0	112.1
88	S	30.2	Very low	35.2	Very low	109 Å²	109	141.9 Å²	141.9	76%	0.762	77%	0.767	S	S	*	*			trans	62.9	123.5	151.6	52.9	0	0	0	0	121.7
89	L	29.3	Very low	36.3	Very low	165 Å²	165	147.4 Å²	147.4	86%	0.864	78%	0.775	S	S	*	*			trans	-131.7	171.1	160.6	-87.6	171.9	0	0	0	107.2
90	P	48.3	Very low	38.4	Very low	120 Å²	120	143.2 Å²	143.2	78%	0.779	75%	0.753	S	S	*	*			cis	-128.9	169.1	-17	36	-20.6	0	0	0	113.9
91	G	33.4	Very low	40.4	Very low	64 Å²	64	141.1 Å²	141.1	66%	0.66	74%	0.74	S	S	*	*			trans	117.7	82.1	147.2	0	0	0	0	0	118.3
92	D	32.4	Very low	43.1	Very low	114 Å²	114	134.4 Å²	134.4	61%	0.61	71%	0.712	S	S	*	*			trans	-170.7	75.5	137.1	-115.7	-8.6	0	0	0	111.5	T94 V95	D92-T94 PolarHBondContact O-N 3.29Å; D92-V95 HydrophobicContact CB-CG2 4.45Å
93	W	39.7	Very low	45.8	Very low	232 Å²	232	128.8 Å²	128.8	88%	0.879	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.5	-10	-178.3	-79	101.9	0	0	0	114.4
94	T	43.2	Very low	48.6	Very low	123 Å²	123	127.5 Å²	127.5	76%	0.755	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.9	-14.6	-171.5	41.9	0	0	0	0	114.6	D92	D92-T94 PolarHBondContact O-N 3.29Å
95	V	43.3	Very low	51.4	Low	98 Å²	98	124.5 Å²	124.5	59%	0.594	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.6	-29.1	-173	-173.5	0	0	0	0	112.7	D92	D92-V95 HydrophobicContact CB-CG2 4.45Å
96	Q	42.9	Very low	54.4	Low	172 Å²	172	116.2 Å²	116.2	80%	0.804	61%	0.609	S	S	*	*	G	3₁₀ helix	trans	-84.1	-10	-174.1	-163.3	155.7	-15.2	0	0	114.5	M98	Q96-M98 PolarHBondContact O-N 2.79Å
97	A	45.2	Very low	57.2	Low	51 Å²	51	107 Å²	107	42%	0.421	58%	0.583	S	S	.	*	G	3₁₀ helix	trans	-64.6	-17.9	-178.9	0	0	0	0	0	114.7	R99 M104	A97-R99 PolarHBondContact O-N 3.27Å; A97-M104 WeakPolarHBondContact O-CG 3.24Å
98	M	44.8	Very low	60.1	Low	173 Å²	173	105.8 Å²	105.8	85%	0.852	57%	0.572	S	S	*	*	G	3₁₀ helix	trans	-78.6	11.3	-177	-70	-166.3	71.9	0	0	115.5	Q96	Q96-M98 PolarHBondContact O-N 2.79Å
99	R	57.1	Low	63.1	Low	235 Å²	235	101.7 Å²	101.7	89%	0.887	54%	0.541	S	S	*	.	G	3₁₀ helix	trans	-135.5	3.9	-174	-76.3	-167.9	173.7	177	-0.7	117.9	A97	A97-R99 PolarHBondContact O-N 3.27Å
100	D	72.6	Confident	66.2	Low	60 Å²	60	94.7 Å²	94.7	32%	0.321	50%	0.504	S	S	.	.			trans	-132.5	115.4	166.3	174.8	26.3	0	0	0	110.7	M102 A103 M104	D100-M102 VanDerWaalsContact C-N 3.3Å; D100-M102 PolarHBondContact O-N 2.74Å; D100-M102 PolarHBondContact OD1-N 3.01Å; D100-A103 HydrophobicContact CB-CB 3.93Å; D100-A103 PolarHBondContact O-N 2.94Å; D100-A103 WeakPolarHBondContact OD2-CB 3.35Å; D100-A103 PolarHBondContact OD2-N 2.88Å; D100-M104 PolarHBondContact O-N 3.09Å
101	P	80.4	Confident	68.2	Low	83 Å²	83	92.8 Å²	92.8	54%	0.539	49%	0.488	S	S	.	.	H	α-helix	trans	-55.9	-39.5	171.5	-25.6	35.7	0	0	0	113.6	M104 E105	P101-M104 PolarHBondContact O-N 3.39Å; P101-E105 WeakPolarHBondContact O-CG 3.45Å; P101-E105 PolarHBondContact O-N 3.3Å
102	M	84.5	Confident	71	Confident	47 Å²	47	91.5 Å²	91.5	23%	0.232	47%	0.465	C	S	.	.	H	α-helix	trans	-66.8	-41.9	-179.5	-78.4	-137.6	-139	0	0	111.9	D100 M104 E105 R106 E232 S234	D100-M102 VanDerWaalsContact C-N 3.3Å; D100-M102 PolarHBondContact O-N 2.74Å; D100-M102 PolarHBondContact OD1-N 3.01Å; M102-M104 VanDerWaalsContact C-N 3.29Å; M102-M104 PolarHBondContact O-N 3.41Å; M102-E105 PolarHBondContact O-N 3.41Å; M102-E105 VanDerWaalsContact O-N 3.15Å; M102-R106 WeakPolarHBondContact O-CG 3.39Å; M102-R106 PolarHBondContact O-N 3.15Å; M102-E232 WeakPolarHBondContact CE-OE2 3.39Å; M102-S234 WeakPolarHBondContact CE-OG 3.43Å; M102-S234 PolarHBondContact SD-OG 3.29Å
103	A	86	Confident	73.9	Confident	26 Å²	26	86.1 Å²	86.1	22%	0.215	44%	0.437	C	S	.	.	H	α-helix	trans	-58.9	-38.8	174.2	0	0	0	0	0	112.6	D100 A107	D100-A103 HydrophobicContact CB-CB 3.93Å; D100-A103 PolarHBondContact O-N 2.94Å; D100-A103 WeakPolarHBondContact OD2-CB 3.35Å; D100-A103 PolarHBondContact OD2-N 2.88Å; A103-A107 VanDerWaalsContact O-CB 3.31Å; A103-A107 WeakPolarHBondContact O-CB 3.49Å; A103-A107 PolarHBondContact O-N 3.44Å
104	M	85.9	Confident	76.4	Confident	86 Å²	86	79 Å²	79	42%	0.424	41%	0.412	S	S	.	.	H	α-helix	trans	-66.9	-41.8	173.4	-66.3	-168.6	-65.6	0	0	112	A97 D100 P101 M102 A107 N108	A97-M104 WeakPolarHBondContact O-CG 3.24Å; D100-M104 PolarHBondContact O-N 3.09Å; P101-M104 PolarHBondContact O-N 3.39Å; M102-M104 VanDerWaalsContact C-N 3.29Å; M102-M104 PolarHBondContact O-N 3.41Å; M104-A107 PolarHBondContact O-N 3.09Å; M104-N108 WeakPolarHBondContact O-CB 3.48Å; M104-N108 PolarHBondContact O-N 3.07Å; M104-N108 PolarHBondContact O-ND2 3.41Å; M104-N108 VanDerWaalsContact O-ND2 3.15Å
105	E	88.7	Confident	78.7	Confident	109 Å²	109	77.2 Å²	77.2	51%	0.509	40%	0.397	S	S	.	.	H	α-helix	trans	-64.2	-44	176.9	-73.8	178.7	-152.1	0	0	112.3	P101 M102 N108 L109	P101-E105 WeakPolarHBondContact O-CG 3.45Å; P101-E105 PolarHBondContact O-N 3.3Å; M102-E105 PolarHBondContact O-N 3.41Å; M102-E105 VanDerWaalsContact O-N 3.15Å; E105-N108 PolarHBondContact O-N 2.86Å; E105-L109 WeakPolarHBondContact O-CB 3.07Å; E105-L109 WeakPolarHBondContact O-CG 3.46Å; E105-L109 PolarHBondContact O-N 2.87Å
106	R	93.3	Very high	81.1	Confident	22 Å²	22	72.7 Å²	72.7	8%	0.083	37%	0.37	C	S	.	.	H	α-helix	trans	-59.4	-47.1	172.4	-68.2	-163.1	-53.3	-84.8	-2.1	112.1	M102 N108 L109 L110 H151 S234 L236 E241	M102-R106 WeakPolarHBondContact O-CG 3.39Å; M102-R106 PolarHBondContact O-N 3.15Å; R106-N108 VanDerWaalsContact C-N 3.34Å; R106-N108 PolarHBondContact O-N 2.75Å; R106-L109 PolarHBondContact O-N 3.21Å; R106-L110 VanDerWaalsContact O-CB 3.3Å; R106-L110 WeakPolarHBondContact O-CB 3.13Å; R106-L110 PolarHBondContact O-N 2.98Å; R106-H151 VanDerWaalsContact CG-CE1 3.46Å; R106-H151 WeakPolarHBondContact CG-CE1 3.49Å; R106-S234 WeakPolarHBondContact CD-O 3.39Å; R106-S234 PolarHBondContact NH1-O 2.89Å; R106-L236 HydrophobicContact CG-CB 4.14Å; R106-E241 HydrophobicContact CB-CG 4.13Å; R106-E241 WeakPolarHBondContact CB-OE1 3.37Å; R106-E241 WeakPolarHBondContact CD-OE2 3.46Å; R106-E241 IonicContact CZ-OE1 2.73Å; R106-E241 VanDerWaalsContact NE-CD 3.27Å; R106-E241 IonicContact NE-OE1 3.61Å; R106-E241 PolarHBondContact NE-OE1 2.62Å; R106-E241 IonicContact NE-OE2 3.62Å; R106-E241 PolarHBondContact NE-OE2 3.47Å; R106-E241 VanDerWaalsContact NE-OE2 3.13Å; R106-E241 IonicContact NH2-OE1 2.6Å
107	A	90.3	Very high	83.5	Confident	38 Å²	38	64.7 Å²	64.7	31%	0.314	33%	0.332	S	S	.	.	H	α-helix	trans	-63	-39.4	179.4	0	0	0	0	0	112.4	A103 M104 N111	A103-A107 VanDerWaalsContact O-CB 3.31Å; A103-A107 WeakPolarHBondContact O-CB 3.49Å; A103-A107 PolarHBondContact O-N 3.44Å; M104-A107 PolarHBondContact O-N 3.09Å; A107-N111 VanDerWaalsContact O-CG 3.29Å; A107-N111 PolarHBondContact O-N 3.17Å; A107-N111 VanDerWaalsContact O-N 3.09Å; A107-N111 PolarHBondContact O-ND2 3.42Å
108	N	91.1	Very high	85.7	Confident	95 Å²	95	68 Å²	68	51%	0.508	34%	0.337	S	S	.	.	H	α-helix	trans	-65.6	-48.8	175.1	-73.3	-28.6	0	0	0	111.6	M104 E105 R106 L110 N111 M112	M104-N108 WeakPolarHBondContact O-CB 3.48Å; M104-N108 PolarHBondContact O-N 3.07Å; M104-N108 PolarHBondContact O-ND2 3.41Å; M104-N108 VanDerWaalsContact O-ND2 3.15Å; E105-N108 PolarHBondContact O-N 2.86Å; R106-N108 VanDerWaalsContact C-N 3.34Å; R106-N108 PolarHBondContact O-N 2.75Å; N108-L110 VanDerWaalsContact C-N 3.32Å; N108-L110 PolarHBondContact O-N 3.33Å; N108-N111 PolarHBondContact O-N 3.25Å; N108-N111 VanDerWaalsContact O-N 3.14Å; N108-M112 VanDerWaalsContact O-CG 3.28Å; N108-M112 WeakPolarHBondContact O-CG 3.27Å; N108-M112 PolarHBondContact O-N 3.04Å
109	L	92.6	Very high	87.8	Confident	22 Å²	22	60.6 Å²	60.6	12%	0.115	31%	0.305	C	S	.	.	H	α-helix	trans	-61.5	-38.4	176.5	-72.6	173.5	0	0	0	112.4	E105 R106 N111 M112 A113 H147 H151 L236	E105-L109 WeakPolarHBondContact O-CB 3.07Å; E105-L109 WeakPolarHBondContact O-CG 3.46Å; E105-L109 PolarHBondContact O-N 2.87Å; R106-L109 PolarHBondContact O-N 3.21Å; L109-N111 VanDerWaalsContact C-N 3.34Å; L109-N111 PolarHBondContact O-N 2.99Å; L109-M112 PolarHBondContact O-N 2.75Å; L109-A113 VanDerWaalsContact O-CB 3.28Å; L109-A113 WeakPolarHBondContact O-CB 3.14Å; L109-A113 PolarHBondContact O-N 3.28Å; L109-H147 HydrophobicContact CD2-CB 3.88Å; L109-H151 HydrophobicContact CD1-CB 3.68Å; L109-L236 HydrophobicContact CB-CD1 3.55Å; L109-L236 HydrophobicContact CD1-CD1 3.94Å; L109-L236 HydrophobicContact CG-CD1 4.41Å
110	L	93.6	Very high	89.4	Confident	18 Å²	18	49.4 Å²	49.4	9%	0.094	26%	0.263	C	S	.	.	H	α-helix	trans	-59.3	-43.6	172.9	176.5	61	0	0	0	112.1	R106 N108 K114 E241 V244 I245	R106-L110 VanDerWaalsContact O-CB 3.3Å; R106-L110 WeakPolarHBondContact O-CB 3.13Å; R106-L110 PolarHBondContact O-N 2.98Å; N108-L110 VanDerWaalsContact C-N 3.32Å; N108-L110 PolarHBondContact O-N 3.33Å; L110-K114 HydrophobicContact CD1-CD 4.38Å; L110-K114 HydrophobicContact CD1-CG 4.47Å; L110-K114 HydrophobicContact CG-CD 4.21Å; L110-K114 WeakPolarHBondContact O-CB 3.4Å; L110-K114 WeakPolarHBondContact O-CD 3.49Å; L110-K114 VanDerWaalsContact O-CG 3.23Å; L110-K114 WeakPolarHBondContact O-CG 3.31Å; L110-K114 PolarHBondContact O-N 2.91Å; L110-E241 HydrophobicContact CB-CB 4.16Å; L110-E241 HydrophobicContact CB-CG 4.31Å; L110-E241 HydrophobicContact CD1-CB 4.4Å; L110-E241 HydrophobicContact CD2-CB 4.04Å; L110-E241 HydrophobicContact CD2-CG 3.79Å; L110-E241 HydrophobicContact CG-CB 4.42Å; L110-V244 HydrophobicContact CD1-CB 4.04Å; L110-V244 HydrophobicContact CD1-CG1 3.86Å; L110-I245 HydrophobicContact CD1-CD1 4.17Å; L110-I245 HydrophobicContact CD1-CG1 3.68Å
111	N	91.9	Very high	90.3	Very high	80 Å²	80	48.1 Å²	48.1	43%	0.428	26%	0.256	S	S	.	.	H	α-helix	trans	-70.9	-37.2	178.8	-69.2	-27.1	0	0	0	111.9	A107 N108 L109 K114 L115	A107-N111 VanDerWaalsContact O-CG 3.29Å; A107-N111 PolarHBondContact O-N 3.17Å; A107-N111 VanDerWaalsContact O-N 3.09Å; A107-N111 PolarHBondContact O-ND2 3.42Å; N108-N111 PolarHBondContact O-N 3.25Å; N108-N111 VanDerWaalsContact O-N 3.14Å; L109-N111 VanDerWaalsContact C-N 3.34Å; L109-N111 PolarHBondContact O-N 2.99Å; N111-K114 PolarHBondContact O-N 3.45Å; N111-L115 WeakPolarHBondContact O-CG 3.39Å; N111-L115 PolarHBondContact O-N 3.47Å
112	M	91.1	Very high	90.7	Very high	38 Å²	38	49.5 Å²	49.5	19%	0.187	26%	0.255	C	S	.	.	H	α-helix	trans	-65.5	-42.1	173.3	-67.5	166.9	61.5	0	0	111.9	N108 L109 L115 S116 V144 I273 F275	N108-M112 VanDerWaalsContact O-CG 3.28Å; N108-M112 WeakPolarHBondContact O-CG 3.27Å; N108-M112 PolarHBondContact O-N 3.04Å; L109-M112 PolarHBondContact O-N 2.75Å; M112-L115 PolarHBondContact O-N 2.83Å; M112-S116 VanDerWaalsContact O-CB 3.23Å; M112-S116 WeakPolarHBondContact O-CB 3.42Å; M112-S116 PolarHBondContact O-N 3.4Å; M112-V144 HydrophobicContact CB-CG1 4.22Å; M112-I273 HydrophobicContact CE-CD1 3.44Å; M112-I273 VanDerWaalsContact CE-CD1 3.44Å; M112-I273 HydrophobicContact CE-CG2 3.92Å; M112-F275 HydrophobicContact CE-CE1 4.49Å; M112-F275 HydrophobicContact CE-CZ 3.92Å; M112-F275 HydrophobicContact CG-CE1 4.34Å; M112-F275 HydrophobicContact SD-CZ 4.3Å
113	A	93.4	Very high	90.9	Very high	1 Å²	1	49.2 Å²	49.2	1%	0.008	26%	0.258	C	S	.	.	H	α-helix	trans	-64.2	-43.9	174.3	0	0	0	0	0	111.8	L109 S116 I117 V144 I245	L109-A113 VanDerWaalsContact O-CB 3.28Å; L109-A113 WeakPolarHBondContact O-CB 3.14Å; L109-A113 PolarHBondContact O-N 3.28Å; A113-S116 PolarHBondContact O-N 3Å; A113-I117 HydrophobicContact CB-CD1 4.49Å; A113-I117 VanDerWaalsContact O-CB 3.3Å; A113-I117 WeakPolarHBondContact O-CB 3.44Å; A113-I117 WeakPolarHBondContact O-CD1 3.43Å; A113-I117 VanDerWaalsContact O-CG1 3.23Å; A113-I117 WeakPolarHBondContact O-CG1 3.2Å; A113-I117 PolarHBondContact O-N 2.87Å; A113-V144 HydrophobicContact CB-CG1 4.16Å; A113-I245 HydrophobicContact CB-CD1 3.97Å; A113-I245 HydrophobicContact CB-CG1 3.8Å; A113-I245 HydrophobicContact CB-CG2 4.38Å
114	K	92.4	Very high	90.9	Very high	81 Å²	81	48.5 Å²	48.5	35%	0.352	25%	0.252	S	S	.	.	H	α-helix	trans	-56	-50.9	173	-78.4	164.9	-178.4	168.4	0	111.9	L110 N111 K118 L248	L110-K114 HydrophobicContact CD1-CD 4.38Å; L110-K114 HydrophobicContact CD1-CG 4.47Å; L110-K114 HydrophobicContact CG-CD 4.21Å; L110-K114 WeakPolarHBondContact O-CB 3.4Å; L110-K114 WeakPolarHBondContact O-CD 3.49Å; L110-K114 VanDerWaalsContact O-CG 3.23Å; L110-K114 WeakPolarHBondContact O-CG 3.31Å; L110-K114 PolarHBondContact O-N 2.91Å; N111-K114 PolarHBondContact O-N 3.45Å; K114-K118 WeakPolarHBondContact O-CB 3.17Å; K114-K118 PolarHBondContact O-N 3.48Å; K114-L248 HydrophobicContact CB-CD1 4.49Å; K114-L248 HydrophobicContact CG-CD1 3.53Å
115	L	91.6	Very high	90.9	Very high	87 Å²	87	49.9 Å²	49.9	46%	0.455	26%	0.26	S	S	.	.	H	α-helix	trans	-62.4	-44.9	178.6	-73.5	170.3	0	0	0	111.6	N111 M112 G119 Y278	N111-L115 WeakPolarHBondContact O-CG 3.39Å; N111-L115 PolarHBondContact O-N 3.47Å; M112-L115 PolarHBondContact O-N 2.83Å; L115-G119 PolarHBondContact O-N 2.87Å; L115-Y278 HydrophobicContact CB-CD1 4.11Å; L115-Y278 HydrophobicContact CB-CE1 4.26Å; L115-Y278 VanDerWaalsContact O-CE1 3.31Å; L115-Y278 WeakPolarHBondContact O-CE1 3.23Å
116	S	93.6	Very high	90.6	Very high	2 Å²	2	49.3 Å²	49.3	1%	0.014	27%	0.269	C	S	.	.	H	α-helix	trans	-68.3	-48.6	-177.4	-172.8	0	0	0	0	112.8	M112 A113 G119 L120 F141	M112-S116 VanDerWaalsContact O-CB 3.23Å; M112-S116 WeakPolarHBondContact O-CB 3.42Å; M112-S116 PolarHBondContact O-N 3.4Å; A113-S116 PolarHBondContact O-N 3Å; S116-G119 PolarHBondContact O-N 2.96Å; S116-L120 VanDerWaalsContact O-CB 3.25Å; S116-L120 WeakPolarHBondContact O-CB 3.37Å; S116-L120 PolarHBondContact O-N 3.05Å; S116-F141 VanDerWaalsContact OG-CA 3.25Å; S116-F141 WeakPolarHBondContact OG-CA 3.4Å; S116-F141 PolarHBondContact OG-N 3.21Å
117	I	93.9	Very high	90.1	Very high	4 Å²	4	52.7 Å²	52.7	2%	0.021	28%	0.284	C	S	.	.	H	α-helix	trans	-61.4	-47.1	176.4	-66.6	165	0	0	0	110.4	A113 L120 I121 F141 I245 L248 L249 L252	A113-I117 HydrophobicContact CB-CD1 4.49Å; A113-I117 VanDerWaalsContact O-CB 3.3Å; A113-I117 WeakPolarHBondContact O-CB 3.44Å; A113-I117 WeakPolarHBondContact O-CD1 3.43Å; A113-I117 VanDerWaalsContact O-CG1 3.23Å; A113-I117 WeakPolarHBondContact O-CG1 3.2Å; A113-I117 PolarHBondContact O-N 2.87Å; I117-L120 PolarHBondContact O-N 2.91Å; I117-I121 HydrophobicContact CG2-CD1 3.75Å; I117-I121 VanDerWaalsContact O-CG1 3.28Å; I117-I121 WeakPolarHBondContact O-CG1 3.09Å; I117-I121 PolarHBondContact O-N 3.07Å; I117-F141 HydrophobicContact CG1-CD2 4.11Å; I117-F141 HydrophobicContact CG1-CE2 3.89Å; I117-I245 HydrophobicContact CD1-CG2 4.43Å; I117-L248 HydrophobicContact CD1-CB 3.94Å; I117-L248 HydrophobicContact CG2-CB 4.28Å; I117-L249 HydrophobicContact CD1-CD2 3.62Å; I117-L249 HydrophobicContact CD1-CG 4.13Å; I117-L249 HydrophobicContact CG1-CD2 4.04Å; I117-L252 HydrophobicContact CG2-CD2 4.2Å; I117-L252 HydrophobicContact CG2-CG 4.4Å
118	K	91.2	Very high	89.3	Confident	120 Å²	120	54.1 Å²	54.1	52%	0.522	30%	0.303	S	S	.	.	H	α-helix	trans	-60.6	-51.4	178	-178.4	-177.1	171.7	-174.1	0	111.4	K114 L120 I121 E122	K114-K118 WeakPolarHBondContact O-CB 3.17Å; K114-K118 PolarHBondContact O-N 3.48Å; K118-L120 VanDerWaalsContact C-N 3.33Å; K118-L120 PolarHBondContact O-N 3.27Å; K118-I121 PolarHBondContact O-N 3.09Å; K118-E122 WeakPolarHBondContact CE-OE1 3.41Å; K118-E122 WeakPolarHBondContact CE-OE2 3.38Å; K118-E122 HydrophobicContact CG-CG 4.33Å; K118-E122 IonicContact NZ-OE1 3.9Å; K118-E122 WeakPolarHBondContact O-CB 3.45Å; K118-E122 WeakPolarHBondContact O-CG 3.32Å; K118-E122 PolarHBondContact O-N 2.97Å
119	G	88.4	Confident	88.9	Confident	18 Å²	18	58.8 Å²	58.8	19%	0.186	31%	0.313	C	S	.	.	H	α-helix	trans	-63.4	-37	-178.8	0	0	0	0	0	113	L115 S116 S123	L115-G119 PolarHBondContact O-N 2.87Å; S116-G119 PolarHBondContact O-N 2.96Å; G119-S123 WeakPolarHBondContact O-CB 3.14Å; G119-S123 PolarHBondContact O-N 3.01Å
120	L	91.8	Very high	88.6	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-64.6	-46	173.2	173.9	57.8	0	0	0	111.5	S116 I117 K118 A124 L131 Y135 P137 L138 F141 L252 I255	S116-L120 VanDerWaalsContact O-CB 3.25Å; S116-L120 WeakPolarHBondContact O-CB 3.37Å; S116-L120 PolarHBondContact O-N 3.05Å; I117-L120 PolarHBondContact O-N 2.91Å; K118-L120 VanDerWaalsContact C-N 3.33Å; K118-L120 PolarHBondContact O-N 3.27Å; L120-A124 WeakPolarHBondContact O-CB 3.34Å; L120-A124 PolarHBondContact O-N 2.88Å; L120-L131 HydrophobicContact CD1-CD1 3.91Å; L120-Y135 HydrophobicContact CD1-CD1 4.4Å; L120-Y135 HydrophobicContact CD1-CE1 3.99Å; L120-P137 HydrophobicContact CD1-CB 4.1Å; L120-L138 HydrophobicContact CD1-CB 4.01Å; L120-L138 HydrophobicContact CD1-CD1 4.39Å; L120-L138 HydrophobicContact CD2-CD1 3.86Å; L120-F141 HydrophobicContact CD2-CB 3.61Å; L120-F141 HydrophobicContact CD2-CD1 3.9Å; L120-F141 HydrophobicContact CD2-CD2 4.09Å; L120-F141 HydrophobicContact CD2-CG 3.57Å; L120-L252 HydrophobicContact CD2-CD2 3.81Å; L120-L252 HydrophobicContact CG-CD2 4.23Å; L120-I255 HydrophobicContact CD1-CD1 4.21Å; L120-I255 HydrophobicContact CD2-CD1 4.14Å; L120-I255 HydrophobicContact CG-CD1 3.7Å
121	I	90.3	Very high	88.4	Confident	33 Å²	33	60.1 Å²	60.1	17%	0.169	32%	0.323	C	S	.	.	H	α-helix	trans	-63.7	-50	177.7	-66.7	165.6	0	0	0	111	I117 K118 S123 A124 L125 L252 I255	I117-I121 HydrophobicContact CG2-CD1 3.75Å; I117-I121 VanDerWaalsContact O-CG1 3.28Å; I117-I121 WeakPolarHBondContact O-CG1 3.09Å; I117-I121 PolarHBondContact O-N 3.07Å; K118-I121 PolarHBondContact O-N 3.09Å; I121-S123 PolarHBondContact O-N 3.48Å; I121-A124 PolarHBondContact O-N 2.69Å; I121-L125 HydrophobicContact CG2-CD1 3.72Å; I121-L125 HydrophobicContact CG2-CG 4.38Å; I121-L125 VanDerWaalsContact O-CB 3.32Å; I121-L125 WeakPolarHBondContact O-CB 3.42Å; I121-L125 VanDerWaalsContact O-CG 3.23Å; I121-L125 WeakPolarHBondContact O-CG 3.5Å; I121-L125 PolarHBondContact O-N 2.66Å; I121-L252 HydrophobicContact CD1-CD2 4.17Å; I121-L252 HydrophobicContact CG1-CD2 3.8Å; I121-I255 HydrophobicContact CG1-CD1 4.23Å
122	E	89	Confident	88.3	Confident	112 Å²	112	60 Å²	60	52%	0.523	32%	0.323	S	S	.	.	H	α-helix	trans	-62.8	-42.8	-179.4	-71.7	179.3	157.2	0	0	111.6	K118 S126	K118-E122 WeakPolarHBondContact CE-OE1 3.41Å; K118-E122 WeakPolarHBondContact CE-OE2 3.38Å; K118-E122 HydrophobicContact CG-CG 4.33Å; K118-E122 IonicContact NZ-OE1 3.9Å; K118-E122 WeakPolarHBondContact O-CB 3.45Å; K118-E122 WeakPolarHBondContact O-CG 3.32Å; K118-E122 PolarHBondContact O-N 2.97Å; E122-S126 WeakPolarHBondContact O-CB 3.36Å; E122-S126 PolarHBondContact O-N 2.73Å; E122-S126 VanDerWaalsContact O-N 3.13Å
123	S	88.1	Confident	88	Confident	42 Å²	42	59.1 Å²	59.1	29%	0.294	32%	0.32	S	S	.	.	H	α-helix	trans	-71.4	-43	179	-159.1	0	0	0	0	112	G119 I121 L125 S126 F127 Y135	G119-S123 WeakPolarHBondContact O-CB 3.14Å; G119-S123 PolarHBondContact O-N 3.01Å; I121-S123 PolarHBondContact O-N 3.48Å; S123-L125 PolarHBondContact O-N 2.86Å; S123-S126 CarbonylContact O-C 3.54Å; S123-S126 PolarHBondContact O-N 2.6Å; S123-S126 VanDerWaalsContact O-N 3.11Å; S123-S126 PolarHBondContact O-OG 2.72Å; S123-F127 WeakPolarHBondContact O-CB 3.3Å; S123-F127 PolarHBondContact O-N 3.36Å; S123-Y135 VanDerWaalsContact CB-OH 3.26Å; S123-Y135 WeakPolarHBondContact CB-OH 3.47Å; S123-Y135 PolarHBondContact O-OH 3.04Å; S123-Y135 PolarHBondContact OG-OH 3.04Å
124	A	86.8	Confident	87.6	Confident	10 Å²	10	65 Å²	65	8%	0.083	35%	0.352	C	S	.	.	H	α-helix	trans	-64.1	-41.8	178.5	0	0	0	0	0	112.3	L120 I121 S126 F127 G128 L131 Y135 I255	L120-A124 WeakPolarHBondContact O-CB 3.34Å; L120-A124 PolarHBondContact O-N 2.88Å; I121-A124 PolarHBondContact O-N 2.69Å; A124-S126 VanDerWaalsContact C-N 3.26Å; A124-S126 PolarHBondContact O-N 2.9Å; A124-F127 PolarHBondContact O-N 3.5Å; A124-F127 VanDerWaalsContact O-N 3.15Å; A124-G128 PolarHBondContact O-N 2.87Å; A124-L131 HydrophobicContact CB-CD1 3.97Å; A124-L131 HydrophobicContact CB-CD2 4.26Å; A124-L131 HydrophobicContact CB-CG 4.5Å; A124-Y135 PolarHBondContact N-OH 3.43Å; A124-I255 HydrophobicContact CB-CD1 4.14Å; A124-I255 HydrophobicContact CB-CG1 4.18Å; A124-I255 HydrophobicContact CB-CG2 4.39Å
125	L	85.3	Confident	87.4	Confident	115 Å²	115	62.2 Å²	62.2	60%	0.602	34%	0.339	S	S	*	.	H	α-helix	trans	-64.8	-29.9	174	-70.5	174.2	0	0	0	112.4	I121 S123 V254	I121-L125 HydrophobicContact CG2-CD1 3.72Å; I121-L125 HydrophobicContact CG2-CG 4.38Å; I121-L125 VanDerWaalsContact O-CB 3.32Å; I121-L125 WeakPolarHBondContact O-CB 3.42Å; I121-L125 VanDerWaalsContact O-CG 3.23Å; I121-L125 WeakPolarHBondContact O-CG 3.5Å; I121-L125 PolarHBondContact O-N 2.66Å; S123-L125 PolarHBondContact O-N 2.86Å; L125-V254 HydrophobicContact CD2-CG2 4.06Å; L125-V254 HydrophobicContact CG-CG2 4.44Å
126	S	83	Confident	87.2	Confident	98 Å²	98	61.4 Å²	61.4	69%	0.685	34%	0.339	S	S	*	.	H	α-helix	trans	-77.2	-27.6	172	78.9	0	0	0	0	113.8	E122 S123 A124	E122-S126 WeakPolarHBondContact O-CB 3.36Å; E122-S126 PolarHBondContact O-N 2.73Å; E122-S126 VanDerWaalsContact O-N 3.13Å; S123-S126 CarbonylContact O-C 3.54Å; S123-S126 PolarHBondContact O-N 2.6Å; S123-S126 VanDerWaalsContact O-N 3.11Å; S123-S126 PolarHBondContact O-OG 2.72Å; A124-S126 VanDerWaalsContact C-N 3.26Å; A124-S126 PolarHBondContact O-N 2.9Å
127	F	82.1	Confident	87.1	Confident	92 Å²	92	61.8 Å²	61.8	40%	0.404	34%	0.341	S	S	.	.	H	α-helix	trans	-79.2	-32.3	-178.2	-169.7	-113.9	0	0	0	112.4	S123 A124 R129 L131 Y135	S123-F127 WeakPolarHBondContact O-CB 3.3Å; S123-F127 PolarHBondContact O-N 3.36Å; A124-F127 PolarHBondContact O-N 3.5Å; A124-F127 VanDerWaalsContact O-N 3.15Å; F127-R129 HydrophobicContact CD1-CB 4Å; F127-R129 HydrophobicContact CE1-CB 3.99Å; F127-R129 PolarHBondContact O-N 3.31Å; F127-L131 HydrophobicContact CD1-CD2 3.78Å; F127-L131 HydrophobicContact CE1-CD2 4.27Å; F127-Y135 HydrophobicContact CD1-CE2 4.27Å; F127-Y135 HydrophobicContact CD2-CE2 4.23Å; F127-Y135 HydrophobicContact CE2-CE2 4.47Å; F127-Y135 HydrophobicContact CG-CE2 4.12Å
128	G	73.9	Confident	86.9	Confident	69 Å²	69	61.7 Å²	61.7	71%	0.711	34%	0.341	S	S	*	.			trans	65.9	20.9	166.9	0	0	0	0	0	115.4	A124	A124-G128 PolarHBondContact O-N 2.87Å
129	R	83.1	Confident	86.8	Confident	192 Å²	192	59.3 Å²	59.3	73%	0.725	33%	0.332	S	S	*	.	S	Bend	trans	-139	157.6	179.6	-62.8	-179.9	-178.3	-175.6	0.8	109.9	F127 L131	F127-R129 HydrophobicContact CD1-CB 4Å; F127-R129 HydrophobicContact CE1-CB 3.99Å; F127-R129 PolarHBondContact O-N 3.31Å; R129-L131 PolarHBondContact O-N 2.97Å
130	T	86.4	Confident	86.9	Confident	66 Å²	66	59 Å²	59	41%	0.405	33%	0.325	S	S	.	.			trans	-55	131.2	169.7	-50.5	0	0	0	0	110.2	D256 N258	T130-D256 CarbonylContact C-O 3.36Å; T130-D256 WeakPolarHBondContact CA-O 3.23Å; T130-D256 WeakPolarHBondContact CB-OD2 3.18Å; T130-D256 HydrophobicContact CG2-CB 4.49Å; T130-D256 VanDerWaalsContact CG2-OD2 3.29Å; T130-D256 WeakPolarHBondContact CG2-OD2 3.33Å; T130-D256 PolarHBondContact OG1-OD2 3.48Å; T130-N258 HydrophobicContact CG2-CB 3.75Å
131	L	89.8	Confident	87	Confident	2 Å²	2	59 Å²	59	1%	0.01	33%	0.325	C	S	.	.	B	Isolated β-bridge	trans	-80.4	142.2	179.4	-53.1	-175.9	0	0	0	111.5	L120 A124 F127 R129 Y135 L138 I255 D256 A257 N258	L120-L131 HydrophobicContact CD1-CD1 3.91Å; A124-L131 HydrophobicContact CB-CD1 3.97Å; A124-L131 HydrophobicContact CB-CD2 4.26Å; A124-L131 HydrophobicContact CB-CG 4.5Å; F127-L131 HydrophobicContact CD1-CD2 3.78Å; F127-L131 HydrophobicContact CE1-CD2 4.27Å; R129-L131 PolarHBondContact O-N 2.97Å; L131-Y135 HydrophobicContact CB-CD1 4.45Å; L131-Y135 HydrophobicContact CD1-CD1 3.76Å; L131-Y135 HydrophobicContact CD1-CE1 3.79Å; L131-Y135 HydrophobicContact CD2-CD1 3.73Å; L131-Y135 HydrophobicContact CD2-CD2 4.3Å; L131-Y135 HydrophobicContact CD2-CE1 3.63Å; L131-Y135 HydrophobicContact CD2-CE2 4.24Å; L131-Y135 HydrophobicContact CD2-CG 4.05Å; L131-Y135 HydrophobicContact CG-CD1 4.18Å; L131-Y135 HydrophobicContact CG-CE1 4.32Å; L131-L138 HydrophobicContact CB-CD2 4.04Å; L131-L138 HydrophobicContact CD1-CB 4.49Å; L131-L138 HydrophobicContact CD1-CD2 4.18Å; L131-I255 HydrophobicContact CD1-CG2 3.51Å; L131-I255 HydrophobicContact CG-CG2 4.07Å; L131-D256 PolarHBondContact N-O 3.24Å; L131-A257 HydrophobicContact CB-CB 4.27Å; L131-A257 CarbonylContact O-C 3.58Å; L131-A257 WeakPolarHBondContact O-CA 3.31Å; L131-N258 PolarHBondContact O-N 3.1Å
132	D	88.6	Confident	87.2	Confident	78 Å²	78	58.4 Å²	58.4	42%	0.417	32%	0.321	S	S	.	.			trans	-101.5	179.8	171	55.9	46.2	0	0	0	111.4	D134 Y135 L259	D132-D134 VanDerWaalsContact C-N 3.27Å; D132-D134 PolarHBondContact O-N 3.45Å; D132-D134 PolarHBondContact OD1-N 2.89Å; D132-Y135 PolarHBondContact OD1-N 3.17Å; D132-L259 VanDerWaalsContact C-CD2 3.49Å
133	S	84.6	Confident	87.3	Confident	19 Å²	19	53.8 Å²	53.8	13%	0.133	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-17.1	178.7	-58.3	0	0	0	0	114.2	Q139 C260 E264	S133-Q139 WeakPolarHBondContact O-CG 3.49Å; S133-Q139 PolarHBondContact O-NE2 2.9Å; S133-C260 PolarHBondContact OG-N 3.39Å; S133-C260 VanDerWaalsContact OG-N 3.13Å; S133-E264 WeakPolarHBondContact CB-OE1 3.13Å; S133-E264 PolarHBondContact OG-OE1 3.44Å
134	D	84.9	Confident	87.5	Confident	126 Å²	126	51.9 Å²	51.9	67%	0.674	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.4	-14.6	-175.7	-70.8	-38	0	0	0	112.6	D132 P136	D132-D134 VanDerWaalsContact C-N 3.27Å; D132-D134 PolarHBondContact O-N 3.45Å; D132-D134 PolarHBondContact OD1-N 2.89Å; D134-P136 WeakPolarHBondContact O-CD 3.47Å
135	Y	89.4	Confident	87.8	Confident	21 Å²	21	51.6 Å²	51.6	8%	0.082	28%	0.284	C	S	.	.			trans	-59.9	110.5	179	-172.8	-113.2	0	0	0	113.1	L120 S123 A124 F127 L131 D132 P137 L138 Q139	L120-Y135 HydrophobicContact CD1-CD1 4.4Å; L120-Y135 HydrophobicContact CD1-CE1 3.99Å; S123-Y135 VanDerWaalsContact CB-OH 3.26Å; S123-Y135 WeakPolarHBondContact CB-OH 3.47Å; S123-Y135 PolarHBondContact O-OH 3.04Å; S123-Y135 PolarHBondContact OG-OH 3.04Å; A124-Y135 PolarHBondContact N-OH 3.43Å; F127-Y135 HydrophobicContact CD1-CE2 4.27Å; F127-Y135 HydrophobicContact CD2-CE2 4.23Å; F127-Y135 HydrophobicContact CE2-CE2 4.47Å; F127-Y135 HydrophobicContact CG-CE2 4.12Å; L131-Y135 HydrophobicContact CB-CD1 4.45Å; L131-Y135 HydrophobicContact CD1-CD1 3.76Å; L131-Y135 HydrophobicContact CD1-CE1 3.79Å; L131-Y135 HydrophobicContact CD2-CD1 3.73Å; L131-Y135 HydrophobicContact CD2-CD2 4.3Å; L131-Y135 HydrophobicContact CD2-CE1 3.63Å; L131-Y135 HydrophobicContact CD2-CE2 4.24Å; L131-Y135 HydrophobicContact CD2-CG 4.05Å; L131-Y135 HydrophobicContact CG-CD1 4.18Å; L131-Y135 HydrophobicContact CG-CE1 4.32Å; D132-Y135 PolarHBondContact OD1-N 3.17Å; Y135-P137 HydrophobicContact CD1-CB 4.23Å; Y135-P137 HydrophobicContact CD1-CG 4.2Å; Y135-P137 HydrophobicContact CE1-CB 3.77Å; Y135-P137 HydrophobicContact CE1-CG 3.68Å; Y135-P137 HydrophobicContact CE2-CG 4.38Å; Y135-L138 HydrophobicContact CD1-CB 3.8Å; Y135-L138 WeakPolarHBondContact O-CB 3.41Å; Y135-L138 PolarHBondContact O-N 3.33Å; Y135-Q139 PolarHBondContact O-N 3.09Å; Y135-Q139 VanDerWaalsContact O-N 3.17Å
136	P	87.4	Confident	88.2	Confident	71 Å²	71	47 Å²	47	46%	0.461	26%	0.26	S	S	.	.	H	α-helix	trans	-60.7	-39.8	-167.6	-25.8	35.2	0	0	0	116.3	D134 L138 Q139 Q140 M277	D134-P136 WeakPolarHBondContact O-CD 3.47Å; P136-L138 PolarHBondContact O-N 2.89Å; P136-Q139 PolarHBondContact O-N 3.33Å; P136-Q140 WeakPolarHBondContact O-CB 3.23Å; P136-Q140 PolarHBondContact O-N 2.78Å; P136-M277 HydrophobicContact CB-CE 4.29Å; P136-M277 HydrophobicContact CB-SD 4.28Å
137	P	90.3	Very high	88.6	Confident	9 Å²	9	45.8 Å²	45.8	6%	0.058	24%	0.243	C	C	.	.	H	α-helix	trans	-58.9	-29.4	174.9	-24.2	33.8	0	0	0	113.5	L120 Y135 F141 M277	L120-P137 HydrophobicContact CD1-CB 4.1Å; Y135-P137 HydrophobicContact CD1-CB 4.23Å; Y135-P137 HydrophobicContact CD1-CG 4.2Å; Y135-P137 HydrophobicContact CE1-CB 3.77Å; Y135-P137 HydrophobicContact CE1-CG 3.68Å; Y135-P137 HydrophobicContact CE2-CG 4.38Å; P137-F141 WeakPolarHBondContact O-CB 3.45Å; P137-F141 PolarHBondContact O-N 3.17Å; P137-F141 VanDerWaalsContact O-N 3.1Å; P137-M277 HydrophobicContact CG-CE 3.88Å
138	L	91.1	Very high	89.1	Confident	2 Å²	2	41.4 Å²	41.4	1%	0.01	22%	0.224	C	C	.	.	H	α-helix	trans	-82.3	-37	179.2	178.8	60.8	0	0	0	112	L120 L131 Y135 P136 F141 F142 L208 L259	L120-L138 HydrophobicContact CD1-CB 4.01Å; L120-L138 HydrophobicContact CD1-CD1 4.39Å; L120-L138 HydrophobicContact CD2-CD1 3.86Å; L131-L138 HydrophobicContact CB-CD2 4.04Å; L131-L138 HydrophobicContact CD1-CB 4.49Å; L131-L138 HydrophobicContact CD1-CD2 4.18Å; Y135-L138 HydrophobicContact CD1-CB 3.8Å; Y135-L138 WeakPolarHBondContact O-CB 3.41Å; Y135-L138 PolarHBondContact O-N 3.33Å; P136-L138 PolarHBondContact O-N 2.89Å; L138-F141 HydrophobicContact CD1-CD1 3.95Å; L138-F141 WeakPolarHBondContact O-CB 3.27Å; L138-F141 PolarHBondContact O-N 3.44Å; L138-F142 HydrophobicContact CD1-CD2 4.09Å; L138-F142 HydrophobicContact CD1-CE2 3.53Å; L138-F142 HydrophobicContact CD1-CZ 4Å; L138-F142 HydrophobicContact CD2-CE2 4.25Å; L138-F142 HydrophobicContact CG-CD2 4.12Å; L138-F142 HydrophobicContact CG-CE2 3.68Å; L138-F142 VanDerWaalsContact O-CD2 3.22Å; L138-F142 WeakPolarHBondContact O-CD2 3.31Å; L138-F142 PolarHBondContact O-N 3.48Å; L138-F142 VanDerWaalsContact O-N 3.07Å; L138-L208 HydrophobicContact CD1-CD2 3.47Å; L138-L208 VanDerWaalsContact CD1-CD2 3.47Å; L138-L259 HydrophobicContact CD2-CD1 4.17Å; L138-L259 HydrophobicContact CD2-CD2 3.64Å
139	Q	89.5	Confident	90	Very high	71 Å²	71	38.2 Å²	38.2	33%	0.332	19%	0.191	S	C	.	.	H	α-helix	trans	-59.4	-50.7	169.4	-64.5	-170.2	-6.3	0	0	110.7	S133 Y135 P136 F141 F142 V143	S133-Q139 WeakPolarHBondContact O-CG 3.49Å; S133-Q139 PolarHBondContact O-NE2 2.9Å; Y135-Q139 PolarHBondContact O-N 3.09Å; Y135-Q139 VanDerWaalsContact O-N 3.17Å; P136-Q139 PolarHBondContact O-N 3.33Å; Q139-F141 VanDerWaalsContact C-N 3.28Å; Q139-F141 PolarHBondContact O-N 3.5Å; Q139-F142 PolarHBondContact O-N 2.99Å; Q139-F142 VanDerWaalsContact O-N 3.12Å; Q139-V143 WeakPolarHBondContact O-CG2 3.43Å; Q139-V143 PolarHBondContact O-N 2.97Å
140	Q	89.6	Confident	90.4	Very high	11 Å²	11	32.8 Å²	32.8	5%	0.051	17%	0.172	C	C	.	.	H	α-helix	trans	-54.2	-43.1	175.8	-178.8	72.5	-10.3	0	0	111.9	P136 V143 V144 I273 D274 Y278	P136-Q140 WeakPolarHBondContact O-CB 3.23Å; P136-Q140 PolarHBondContact O-N 2.78Å; Q140-V143 PolarHBondContact O-N 3.47Å; Q140-V144 WeakPolarHBondContact O-CG2 3.44Å; Q140-V144 PolarHBondContact O-N 3.21Å; Q140-I273 VanDerWaalsContact NE2-CG2 3.33Å; Q140-D274 PolarHBondContact NE2-O 2.96Å; Q140-Y278 HydrophobicContact CG-CE2 4.07Å
141	F	94.2	Very high	90.7	Very high	1 Å²	1	30.2 Å²	30.2	0%	0.004	16%	0.156	C	C	.	.	H	α-helix	trans	-59.5	-48.1	174.8	166.4	-100.8	0	0	0	113.2	S116 I117 L120 P137 L138 Q139 V143 V144 M145 L208 L213 L249 L252	S116-F141 VanDerWaalsContact OG-CA 3.25Å; S116-F141 WeakPolarHBondContact OG-CA 3.4Å; S116-F141 PolarHBondContact OG-N 3.21Å; I117-F141 HydrophobicContact CG1-CD2 4.11Å; I117-F141 HydrophobicContact CG1-CE2 3.89Å; L120-F141 HydrophobicContact CD2-CB 3.61Å; L120-F141 HydrophobicContact CD2-CD1 3.9Å; L120-F141 HydrophobicContact CD2-CD2 4.09Å; L120-F141 HydrophobicContact CD2-CG 3.57Å; P137-F141 WeakPolarHBondContact O-CB 3.45Å; P137-F141 PolarHBondContact O-N 3.17Å; P137-F141 VanDerWaalsContact O-N 3.1Å; L138-F141 HydrophobicContact CD1-CD1 3.95Å; L138-F141 WeakPolarHBondContact O-CB 3.27Å; L138-F141 PolarHBondContact O-N 3.44Å; Q139-F141 VanDerWaalsContact C-N 3.28Å; Q139-F141 PolarHBondContact O-N 3.5Å; F141-V143 VanDerWaalsContact C-N 3.3Å; F141-V143 PolarHBondContact O-N 3.15Å; F141-V144 PolarHBondContact O-N 2.8Å; F141-M145 HydrophobicContact CD2-CG 3.92Å; F141-M145 HydrophobicContact CE1-CG 4.12Å; F141-M145 HydrophobicContact CE2-CG 3.34Å; F141-M145 HydrophobicContact CE2-SD 3.96Å; F141-M145 HydrophobicContact CZ-CG 3.47Å; F141-M145 VanDerWaalsContact CZ-CG 3.47Å; F141-M145 HydrophobicContact CZ-SD 4.33Å; F141-M145 WeakPolarHBondContact O-CB 3.47Å; F141-M145 WeakPolarHBondContact O-CG 3.39Å; F141-M145 PolarHBondContact O-N 2.93Å; F141-L208 HydrophobicContact CE1-CD2 4.38Å; F141-L213 HydrophobicContact CE1-CD2 4.05Å; F141-L213 HydrophobicContact CZ-CD2 3.79Å; F141-L249 HydrophobicContact CE2-CD2 3.59Å; F141-L249 HydrophobicContact CZ-CD2 3.74Å; F141-L252 HydrophobicContact CD2-CD1 4.42Å; F141-L252 HydrophobicContact CE1-CD1 4.07Å; F141-L252 HydrophobicContact CE2-CD1 3.54Å; F141-L252 HydrophobicContact CZ-CD1 3.31Å
142	F	93.3	Very high	90.6	Very high	19 Å²	19	31 Å²	31	8%	0.083	16%	0.164	C	C	.	.	H	α-helix	trans	-63.4	-36.3	177.5	-73.6	-57.9	0	0	0	112.4	L138 Q139 E146 L204 R205 L208 L259	L138-F142 HydrophobicContact CD1-CD2 4.09Å; L138-F142 HydrophobicContact CD1-CE2 3.53Å; L138-F142 HydrophobicContact CD1-CZ 4Å; L138-F142 HydrophobicContact CD2-CE2 4.25Å; L138-F142 HydrophobicContact CG-CD2 4.12Å; L138-F142 HydrophobicContact CG-CE2 3.68Å; L138-F142 VanDerWaalsContact O-CD2 3.22Å; L138-F142 WeakPolarHBondContact O-CD2 3.31Å; L138-F142 PolarHBondContact O-N 3.48Å; L138-F142 VanDerWaalsContact O-N 3.07Å; Q139-F142 PolarHBondContact O-N 2.99Å; Q139-F142 VanDerWaalsContact O-N 3.12Å; F142-E146 WeakPolarHBondContact O-CB 3.29Å; F142-E146 PolarHBondContact O-N 2.86Å; F142-L204 HydrophobicContact CD1-CB 4.08Å; F142-L204 HydrophobicContact CE1-CB 4.04Å; F142-R205 HydrophobicContact CD2-CG 4.41Å; F142-R205 HydrophobicContact CE1-CG 4.2Å; F142-R205 HydrophobicContact CE2-CG 3.85Å; F142-R205 HydrophobicContact CZ-CB 4.26Å; F142-R205 HydrophobicContact CZ-CG 3.75Å; F142-L208 HydrophobicContact CE1-CD2 4.32Å; F142-L208 HydrophobicContact CE2-CD2 4.36Å; F142-L208 HydrophobicContact CZ-CB 4.29Å; F142-L208 HydrophobicContact CZ-CD2 3.64Å; F142-L259 HydrophobicContact CE2-CD1 3.75Å; F142-L259 HydrophobicContact CZ-CD1 3.77Å
143	V	91.9	Very high	90.7	Very high	15 Å²	15	28.4 Å²	28.4	9%	0.091	15%	0.15	C	C	.	.	H	α-helix	trans	-64.8	-46.5	174.9	179	0	0	0	0	111.2	Q139 Q140 F141 E146 H147 G271 I273	Q139-V143 WeakPolarHBondContact O-CG2 3.43Å; Q139-V143 PolarHBondContact O-N 2.97Å; Q140-V143 PolarHBondContact O-N 3.47Å; F141-V143 VanDerWaalsContact C-N 3.3Å; F141-V143 PolarHBondContact O-N 3.15Å; V143-E146 PolarHBondContact O-N 2.72Å; V143-H147 PolarHBondContact O-N 3.26Å; V143-H147 VanDerWaalsContact O-N 3.13Å; V143-H147 PolarHBondContact O-ND1 3.45Å; V143-G271 VanDerWaalsContact CG2-CA 3.45Å; V143-I273 HydrophobicContact CG1-CD1 4.17Å; V143-I273 HydrophobicContact CG1-CG1 3.53Å
144	V	92.5	Very high	90.7	Very high	3 Å²	3	31.6 Å²	31.6	2%	0.018	16%	0.16	C	C	.	.	H	α-helix	trans	-65.3	-40.9	178.8	172.2	0	0	0	0	111.4	M112 A113 Q140 F141 H147 C148 I273	M112-V144 HydrophobicContact CB-CG1 4.22Å; A113-V144 HydrophobicContact CB-CG1 4.16Å; Q140-V144 WeakPolarHBondContact O-CG2 3.44Å; Q140-V144 PolarHBondContact O-N 3.21Å; F141-V144 PolarHBondContact O-N 2.8Å; V144-H147 PolarHBondContact O-N 3Å; V144-C148 PolarHBondContact O-N 2.95Å; V144-C148 PolarHBondContact O-SG 3.05Å; V144-I273 HydrophobicContact CG2-CD1 4.25Å
145	M	93.8	Very high	89.9	Confident	3 Å²	3	31.9 Å²	31.9	2%	0.015	17%	0.166	C	C	.	.	H	α-helix	trans	-64.5	-38.9	174.9	-75.5	-55.1	-55.8	0	0	112.9	F141 H147 C148 L149 L217 I245 L249	F141-M145 HydrophobicContact CD2-CG 3.92Å; F141-M145 HydrophobicContact CE1-CG 4.12Å; F141-M145 HydrophobicContact CE2-CG 3.34Å; F141-M145 HydrophobicContact CE2-SD 3.96Å; F141-M145 HydrophobicContact CZ-CG 3.47Å; F141-M145 VanDerWaalsContact CZ-CG 3.47Å; F141-M145 HydrophobicContact CZ-SD 4.33Å; F141-M145 WeakPolarHBondContact O-CB 3.47Å; F141-M145 WeakPolarHBondContact O-CG 3.39Å; F141-M145 PolarHBondContact O-N 2.93Å; M145-H147 VanDerWaalsContact C-N 3.3Å; M145-H147 PolarHBondContact O-N 2.84Å; M145-C148 PolarHBondContact O-N 3.26Å; M145-L149 HydrophobicContact CE-CD1 4.31Å; M145-L149 HydrophobicContact CE-CG 4.41Å; M145-L149 WeakPolarHBondContact O-CB 3.5Å; M145-L149 VanDerWaalsContact O-CG 3.3Å; M145-L149 WeakPolarHBondContact O-CG 3.23Å; M145-L149 PolarHBondContact O-N 2.99Å; M145-L217 HydrophobicContact CE-CD1 3.75Å; M145-I245 HydrophobicContact CE-CG2 4.42Å; M145-I245 HydrophobicContact SD-CG2 4.19Å; M145-L249 HydrophobicContact CE-CD1 3.85Å; M145-L249 HydrophobicContact CE-CD2 4.4Å; M145-L249 HydrophobicContact SD-CD1 4.37Å; M145-L249 HydrophobicContact SD-CD2 3.92Å
146	E	93.1	Very high	88.2	Confident	18 Å²	18	38.1 Å²	38.1	8%	0.084	19%	0.193	C	C	.	.	H	α-helix	trans	-61.1	-38.6	174.2	-177.2	-179.4	136.2	0	0	111.8	F142 V143 K150 L166 L197 R201	F142-E146 WeakPolarHBondContact O-CB 3.29Å; F142-E146 PolarHBondContact O-N 2.86Å; V143-E146 PolarHBondContact O-N 2.72Å; E146-K150 HydrophobicContact CG-CD 4.01Å; E146-K150 WeakPolarHBondContact O-CB 3.42Å; E146-K150 WeakPolarHBondContact O-CD 3.36Å; E146-K150 WeakPolarHBondContact O-CG 3.33Å; E146-K150 PolarHBondContact O-N 3.43Å; E146-K150 VanDerWaalsContact O-N 3.12Å; E146-K150 IonicContact OE1-NZ 3.2Å; E146-K150 PolarHBondContact OE1-NZ 3.12Å; E146-L166 HydrophobicContact CG-CD2 4.1Å; E146-L197 HydrophobicContact CG-CD1 4.31Å; E146-R201 IonicContact OE1-CZ 2.89Å; E146-R201 IonicContact OE1-NE 3.32Å; E146-R201 IonicContact OE1-NH2 3.44Å; E146-R201 PolarHBondContact OE1-NH2 2.87Å; E146-R201 IonicContact OE2-CZ 3.47Å; E146-R201 VanDerWaalsContact OE2-CZ 3.32Å; E146-R201 IonicContact OE2-NE 2.62Å; E146-R201 PolarHBondContact OE2-NE 2.71Å; E146-R201 IonicContact OE2-NH2 2.8Å; E146-R201 PolarHBondContact OE2-NH2 3.22Å
147	H	91.3	Very high	86.5	Confident	73 Å²	73	45.1 Å²	45.1	34%	0.338	22%	0.216	S	C	.	.	H	α-helix	trans	-69.3	-44	175.2	-73.7	81	0	0	0	112	L109 V143 V144 M145 L149 K150 H151	L109-H147 HydrophobicContact CD2-CB 3.88Å; V143-H147 PolarHBondContact O-N 3.26Å; V143-H147 VanDerWaalsContact O-N 3.13Å; V143-H147 PolarHBondContact O-ND1 3.45Å; V144-H147 PolarHBondContact O-N 3Å; M145-H147 VanDerWaalsContact C-N 3.3Å; M145-H147 PolarHBondContact O-N 2.84Å; H147-L149 VanDerWaalsContact C-N 3.33Å; H147-L149 PolarHBondContact O-N 3.19Å; H147-K150 PolarHBondContact O-N 3.48Å; H147-K150 VanDerWaalsContact O-N 3.11Å; H147-H151 PolarHBondContact O-N 3.26Å; H147-H151 VanDerWaalsContact O-N 3.14Å
148	C	93.1	Very high	84.4	Confident	1 Å²	1	47.8 Å²	47.8	1%	0.007	24%	0.235	C	C	.	.	H	α-helix	trans	-57.7	-45.1	176.4	-65	0	0	0	0	111.9	V144 M145 K150 L236	V144-C148 PolarHBondContact O-N 2.95Å; V144-C148 PolarHBondContact O-SG 3.05Å; M145-C148 PolarHBondContact O-N 3.26Å; C148-K150 VanDerWaalsContact C-N 3.29Å; C148-K150 PolarHBondContact O-N 3.26Å; C148-L236 HydrophobicContact CB-CD1 4.18Å; C148-L236 HydrophobicContact CB-CD2 4.01Å
149	L	92.8	Very high	82.6	Confident	1 Å²	1	57.9 Å²	57.9	1%	0.005	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-7.7	179.3	-60.5	164	0	0	0	113.7	M145 H147 L166 L204 L217 Y231 M237	M145-L149 HydrophobicContact CE-CD1 4.31Å; M145-L149 HydrophobicContact CE-CG 4.41Å; M145-L149 WeakPolarHBondContact O-CB 3.5Å; M145-L149 VanDerWaalsContact O-CG 3.3Å; M145-L149 WeakPolarHBondContact O-CG 3.23Å; M145-L149 PolarHBondContact O-N 2.99Å; H147-L149 VanDerWaalsContact C-N 3.33Å; H147-L149 PolarHBondContact O-N 3.19Å; L149-L166 HydrophobicContact CB-CD1 3.37Å; L149-L166 HydrophobicContact CD1-CD1 4.32Å; L149-L166 HydrophobicContact CG-CD1 4.4Å; L149-L204 HydrophobicContact CD1-CD1 4.09Å; L149-L204 HydrophobicContact CD1-CD2 3.88Å; L149-L217 HydrophobicContact CD2-CD1 4.44Å; L149-L217 HydrophobicContact CD2-CD2 4.02Å; L149-Y231 WeakPolarHBondContact O-CE1 3.4Å; L149-Y231 PolarHBondContact O-OH 2.94Å; L149-M237 HydrophobicContact CD2-CE 3.6Å; L149-M237 HydrophobicContact CD2-CG 4.07Å; L149-M237 HydrophobicContact CD2-SD 3.67Å
150	K	90.8	Very high	80.9	Confident	78 Å²	78	61.4 Å²	61.4	34%	0.339	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.8	-23	173.3	-81.9	173.6	174.9	178.1	0	113.5	E146 H147 C148 G152 L153	E146-K150 HydrophobicContact CG-CD 4.01Å; E146-K150 WeakPolarHBondContact O-CB 3.42Å; E146-K150 WeakPolarHBondContact O-CD 3.36Å; E146-K150 WeakPolarHBondContact O-CG 3.33Å; E146-K150 PolarHBondContact O-N 3.43Å; E146-K150 VanDerWaalsContact O-N 3.12Å; E146-K150 IonicContact OE1-NZ 3.2Å; E146-K150 PolarHBondContact OE1-NZ 3.12Å; H147-K150 PolarHBondContact O-N 3.48Å; H147-K150 VanDerWaalsContact O-N 3.11Å; C148-K150 VanDerWaalsContact C-N 3.29Å; C148-K150 PolarHBondContact O-N 3.26Å; K150-G152 PolarHBondContact O-N 2.92Å; K150-L153 WeakPolarHBondContact O-CB 3.4Å; K150-L153 PolarHBondContact O-N 3.19Å; K150-L153 VanDerWaalsContact O-N 3.15Å
151	H	92.1	Very high	78.9	Confident	13 Å²	13	64.4 Å²	64.4	6%	0.06	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	121.2	-176.7	177.5	-63.7	0	0	0	111.5	R106 L109 H147 L153 A235 L236	R106-H151 VanDerWaalsContact CG-CE1 3.46Å; R106-H151 WeakPolarHBondContact CG-CE1 3.49Å; L109-H151 HydrophobicContact CD1-CB 3.68Å; H147-H151 PolarHBondContact O-N 3.26Å; H147-H151 VanDerWaalsContact O-N 3.14Å; H151-L153 VanDerWaalsContact C-N 3.31Å; H151-L153 PolarHBondContact O-N 3.17Å; H151-A235 WeakPolarHBondContact O-CB 3.15Å; H151-L236 HydrophobicContact CB-CB 4.08Å; H151-L236 PolarHBondContact ND1-N 2.81Å
152	G	88.3	Confident	76.5	Confident	18 Å²	18	72.7 Å²	72.7	19%	0.186	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	69.5	19.9	179.6	0	0	0	0	0	115	K150 Y231 E232	K150-G152 PolarHBondContact O-N 2.92Å; G152-Y231 CarbonylContact O-C 3.6Å; G152-Y231 WeakPolarHBondContact O-CA 3.28Å; G152-E232 PolarHBondContact O-N 3.25Å
153	L	90	Very high	74.4	Confident	24 Å²	24	76 Å²	76	13%	0.126	40%	0.395	C	S	.	.	B	Isolated β-bridge	trans	-74.4	124.6	176.1	-169.6	75.7	0	0	0	111.2	K150 H151 V155 K164 P169 F230 Y231	K150-L153 WeakPolarHBondContact O-CB 3.4Å; K150-L153 PolarHBondContact O-N 3.19Å; K150-L153 VanDerWaalsContact O-N 3.15Å; H151-L153 VanDerWaalsContact C-N 3.31Å; H151-L153 PolarHBondContact O-N 3.17Å; L153-V155 PolarHBondContact O-N 3.34Å; L153-V155 VanDerWaalsContact O-N 3.08Å; L153-K164 WeakPolarHBondContact CD2-O 3.48Å; L153-P169 HydrophobicContact CD1-CG 3.94Å; L153-F230 HydrophobicContact CD1-CB 4.21Å; L153-Y231 HydrophobicContact CB-CD1 4.36Å; L153-Y231 HydrophobicContact CB-CE1 4.27Å; L153-Y231 HydrophobicContact CD1-CD1 4.09Å; L153-Y231 HydrophobicContact CD1-CD2 4.31Å; L153-Y231 HydrophobicContact CD1-CE1 3.79Å; L153-Y231 HydrophobicContact CD1-CE2 4.03Å; L153-Y231 HydrophobicContact CD1-CG 4.36Å
154	R	86.6	Confident	72.9	Confident	86 Å²	86	78.5 Å²	78.5	33%	0.325	41%	0.405	S	S	.	.			trans	-71.8	98.8	-169.5	-64	174.8	99.5	159.1	8.3	113.2	K156 S228 F230 Y231 E232	R154-K156 PolarHBondContact O-N 2.85Å; R154-S228 PolarHBondContact NH1-O 2.76Å; R154-F230 WeakPolarHBondContact CB-O 3.37Å; R154-F230 WeakPolarHBondContact CG-O 3.4Å; R154-F230 PolarHBondContact N-O 2.86Å; R154-Y231 WeakPolarHBondContact CD-O 3.26Å; R154-E232 HydrophobicContact CG-CG 3.55Å
155	V	66.4	Low	72.2	Confident	132 Å²	132	79.8 Å²	79.8	80%	0.8	41%	0.414	S	S	*	.			trans	-76.7	66.9	177.4	-166	0	0	0	0	112.2	L153 K157	L153-V155 PolarHBondContact O-N 3.34Å; L153-V155 VanDerWaalsContact O-N 3.08Å; V155-K157 PolarHBondContact O-N 3.29Å
156	K	55	Low	71.8	Confident	152 Å²	152	79.9 Å²	79.9	66%	0.661	41%	0.414	S	S	*	.			trans	-68.8	122.8	170.7	-86.5	-174	174.8	176.5	0	111	R154 S158	R154-K156 PolarHBondContact O-N 2.85Å; K156-S158 PolarHBondContact O-N 2.97Å; K156-S158 VanDerWaalsContact O-N 3.16Å
157	K	50.4	Low	71.7	Confident	217 Å²	217	79.7 Å²	79.7	94%	0.943	41%	0.413	S	S	*	.			trans	-72.3	98.6	164.4	-71	-177	178.5	178.6	0	109.5	V155	V155-K157 PolarHBondContact O-N 3.29Å
158	S	47.2	Very low	71.5	Confident	66 Å²	66	76.9 Å²	76.9	46%	0.462	40%	0.404	S	S	.	.			trans	-87.1	132.6	169.9	-178.2	0	0	0	0	110.8	K156 L160	K156-S158 PolarHBondContact O-N 2.97Å; K156-S158 VanDerWaalsContact O-N 3.16Å; S158-L160 PolarHBondContact O-N 3.42Å; S158-L160 PolarHBondContact OG-N 3.49Å
159	F	52.8	Low	71.3	Confident	213 Å²	213	76.9 Å²	76.9	93%	0.934	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-7.8	175.7	-159.6	-99.8	0	0	0	113
160	L	54.4	Low	71.3	Confident	146 Å²	146	76.8 Å²	76.8	76%	0.764	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.7	37.1	-176.3	-99.2	145.9	0	0	0	112.9	S158 F162	S158-L160 PolarHBondContact O-N 3.42Å; S158-L160 PolarHBondContact OG-N 3.49Å; L160-F162 WeakPolarHBondContact O-CD2 3.36Å; L160-F162 PolarHBondContact O-N 2.89Å
161	G	46.2	Very low	71.2	Confident	73 Å²	73	76.2 Å²	76.2	75%	0.753	40%	0.402	S	S	*	.	S	Bend	trans	84.6	-2.2	154.1	0	0	0	0	0	118.5
162	F	45.5	Very low	71	Confident	176 Å²	176	76.7 Å²	76.7	77%	0.772	40%	0.404	S	S	*	.			trans	-102.6	96.6	174	-64.4	-78.7	0	0	0	111.8	L160	L160-F162 WeakPolarHBondContact O-CD2 3.36Å; L160-F162 PolarHBondContact O-N 2.89Å
163	S	48.6	Very low	71.1	Confident	89 Å²	89	75.8 Å²	75.8	62%	0.622	40%	0.396	S	S	*	.			trans	-76.2	123.3	157.3	49.3	0	0	0	0	108.7	S165	S163-S165 PolarHBondContact O-N 2.85Å
164	K	60.9	Low	71	Confident	67 Å²	67	77 Å²	77	29%	0.291	40%	0.4	S	S	.	.			trans	-70.4	81.4	174.8	-80.8	-167.5	168.7	-158	0	109.7	L153 D229 F230	L153-K164 WeakPolarHBondContact CD2-O 3.48Å; K164-D229 PolarHBondContact NZ-O 2.85Å; K164-D229 IonicContact NZ-OD2 3.72Å; K164-D229 PolarHBondContact NZ-OD2 3.47Å; K164-F230 HydrophobicContact CB-CD1 4.4Å; K164-F230 HydrophobicContact CD-CD1 3.56Å; K164-F230 HydrophobicContact CD-CE1 3.86Å; K164-F230 HydrophobicContact CD-CG 4.24Å; K164-F230 HydrophobicContact CG-CD1 4.13Å; K164-F230 HydrophobicContact CG-CE1 4.3Å
165	S	78	Confident	71	Confident	30 Å²	30	80.5 Å²	80.5	21%	0.21	42%	0.418	C	S	.	.			trans	-73	172.6	172.1	69.9	0	0	0	0	112	S163 W167 G168 P169 P196	S163-S165 PolarHBondContact O-N 2.85Å; S165-W167 PolarHBondContact O-N 3.2Å; S165-W167 PolarHBondContact OG-N 3.26Å; S165-G168 PolarHBondContact O-N 3.42Å; S165-P169 WeakPolarHBondContact O-CD 3.34Å; S165-P196 WeakPolarHBondContact OG-CB 3.46Å
166	L	85.3	Confident	72	Confident	4 Å²	4	76.3 Å²	76.3	2%	0.021	39%	0.391	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-21.1	173.1	177.4	58.1	0	0	0	113.8	E146 L149 L170 L197 A200	E146-L166 HydrophobicContact CG-CD2 4.1Å; L149-L166 HydrophobicContact CB-CD1 3.37Å; L149-L166 HydrophobicContact CD1-CD1 4.32Å; L149-L166 HydrophobicContact CG-CD1 4.4Å; L166-L170 HydrophobicContact CD1-CD1 4.46Å; L166-L170 HydrophobicContact CG-CD1 4.34Å; L166-L170 WeakPolarHBondContact O-CG 3.29Å; L166-L197 HydrophobicContact CD2-CD1 4.15Å; L166-A200 HydrophobicContact CB-CB 4.11Å; L166-A200 HydrophobicContact CD2-CB 3.72Å; L166-A200 HydrophobicContact CG-CB 3.59Å
167	W	90.3	Very high	73.6	Confident	15 Å²	15	69.4 Å²	69.4	6%	0.057	36%	0.362	C	S	.	.	H	α-helix	trans	-63.6	-37.8	173.5	-176.3	-116.5	0	0	0	113.2	S165 L170 E171 V187 P196 R199 W203	S165-W167 PolarHBondContact O-N 3.2Å; S165-W167 PolarHBondContact OG-N 3.26Å; W167-L170 HydrophobicContact CE3-CB 4.45Å; W167-L170 PolarHBondContact O-N 2.86Å; W167-E171 HydrophobicContact CD2-CB 4.44Å; W167-E171 HydrophobicContact CZ2-CB 4.16Å; W167-E171 HydrophobicContact CZ2-CG 4.28Å; W167-E171 VanDerWaalsContact NE1-CD 3.31Å; W167-E171 PolarHBondContact NE1-OE1 2.93Å; W167-E171 WeakPolarHBondContact O-CB 3.4Å; W167-E171 PolarHBondContact O-N 3.42Å; W167-V187 HydrophobicContact CH2-CB 4.16Å; W167-V187 HydrophobicContact CH2-CG1 3.71Å; W167-V187 HydrophobicContact CZ2-CG1 4.46Å; W167-V187 HydrophobicContact CZ3-CG1 3.76Å; W167-P196 HydrophobicContact CB-CB 3.89Å; W167-R199 HydrophobicContact CD2-CB 3.84Å; W167-R199 HydrophobicContact CE3-CB 3.66Å; W167-R199 HydrophobicContact CG-CB 4.34Å; W167-R199 HydrophobicContact CZ3-CB 4.15Å; W167-W203 AromaticContact CH2-CD1 3.84Å; W167-W203 HydrophobicContact CH2-CG 4.46Å; W167-W203 HydrophobicContact CZ3-CB 3.78Å; W167-W203 AromaticContact CZ3-CD1 3.71Å; W167-W203 AromaticContact CZ3-CG 3.89Å; W167-W203 HydrophobicContact CZ3-CG 3.89Å
168	G	87.8	Confident	75.3	Confident	14 Å²	14	63.9 Å²	63.9	14%	0.144	35%	0.348	C	S	.	.	H	α-helix	trans	-58.8	-48.2	-172.9	0	0	0	0	0	114.4	S165 L170 L172	S165-G168 PolarHBondContact O-N 3.42Å; G168-L170 VanDerWaalsContact C-N 3.31Å; G168-L170 PolarHBondContact O-N 3.42Å; G168-L172 PolarHBondContact O-N 2.95Å
169	P	88.9	Confident	77.2	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-62.1	-31.5	172.1	-26.5	35.7	0	0	0	114.6	L153 S165 L172 L220 L227 F230 Y231	L153-P169 HydrophobicContact CD1-CG 3.94Å; S165-P169 WeakPolarHBondContact O-CD 3.34Å; P169-L172 WeakPolarHBondContact O-CB 3.33Å; P169-L220 VanDerWaalsContact O-CD1 3.29Å; P169-L220 WeakPolarHBondContact O-CD1 3.37Å; P169-L220 WeakPolarHBondContact O-CD2 3.38Å; P169-L227 HydrophobicContact CB-CD1 4.26Å; P169-F230 HydrophobicContact CG-CB 3.84Å; P169-F230 HydrophobicContact CG-CD1 3.96Å; P169-F230 HydrophobicContact CG-CG 3.94Å; P169-Y231 HydrophobicContact CB-CE2 3.91Å; P169-Y231 HydrophobicContact CG-CE2 3.58Å
170	L	91.1	Very high	78.9	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-82.1	-36.7	-177.5	-59	178.2	0	0	0	111.9	L166 W167 G168 L172 V173 A200 W203 L204 L217 L220	L166-L170 HydrophobicContact CD1-CD1 4.46Å; L166-L170 HydrophobicContact CG-CD1 4.34Å; L166-L170 WeakPolarHBondContact O-CG 3.29Å; W167-L170 HydrophobicContact CE3-CB 4.45Å; W167-L170 PolarHBondContact O-N 2.86Å; G168-L170 VanDerWaalsContact C-N 3.31Å; G168-L170 PolarHBondContact O-N 3.42Å; L170-L172 PolarHBondContact O-N 3.29Å; L170-V173 VanDerWaalsContact O-CB 3.32Å; L170-V173 WeakPolarHBondContact O-CB 3.47Å; L170-V173 VanDerWaalsContact O-CG2 3.31Å; L170-V173 WeakPolarHBondContact O-CG2 3.23Å; L170-V173 PolarHBondContact O-N 3.19Å; L170-A200 HydrophobicContact CD1-CB 3.71Å; L170-W203 HydrophobicContact CB-CD2 4.21Å; L170-W203 HydrophobicContact CB-CE3 4.31Å; L170-W203 HydrophobicContact CD1-CD2 4.43Å; L170-W203 HydrophobicContact CD1-CE3 3.98Å; L170-W203 HydrophobicContact CD2-CE3 4.05Å; L170-W203 HydrophobicContact CD2-CH2 4.22Å; L170-W203 HydrophobicContact CD2-CZ3 3.77Å; L170-W203 HydrophobicContact CG-CE3 4.33Å; L170-L204 HydrophobicContact CD1-CG 4.42Å; L170-L217 HydrophobicContact CD2-CD2 4.03Å; L170-L220 HydrophobicContact CD2-CD1 4.24Å
171	E	88.9	Confident	80.6	Confident	66 Å²	66	50.9 Å²	50.9	31%	0.308	29%	0.285	S	S	.	.	H	α-helix	trans	-62.8	-20.8	170.9	-169.3	175.5	-107.3	0	0	112.3	W167 V173	W167-E171 HydrophobicContact CD2-CB 4.44Å; W167-E171 HydrophobicContact CZ2-CB 4.16Å; W167-E171 HydrophobicContact CZ2-CG 4.28Å; W167-E171 VanDerWaalsContact NE1-CD 3.31Å; W167-E171 PolarHBondContact NE1-OE1 2.93Å; W167-E171 WeakPolarHBondContact O-CB 3.4Å; W167-E171 PolarHBondContact O-N 3.42Å; E171-V173 VanDerWaalsContact C-N 3.28Å; E171-V173 PolarHBondContact O-N 3.26Å
172	L	88.3	Confident	82.6	Confident	22 Å²	22	54 Å²	54	12%	0.115	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-26.6	171.3	-172.7	63.6	0	0	0	112.7	G168 P169 L170 E174 K175 L176 L220 L226	G168-L172 PolarHBondContact O-N 2.95Å; P169-L172 WeakPolarHBondContact O-CB 3.33Å; L170-L172 PolarHBondContact O-N 3.29Å; L172-E174 VanDerWaalsContact C-N 3.3Å; L172-E174 PolarHBondContact O-N 2.82Å; L172-K175 HydrophobicContact CD1-CD 4.39Å; L172-K175 WeakPolarHBondContact O-CB 3.43Å; L172-K175 PolarHBondContact O-N 3.35Å; L172-L176 HydrophobicContact CD2-CD1 4.47Å; L172-L176 HydrophobicContact CG-CD1 4.18Å; L172-L176 PolarHBondContact O-N 3.08Å; L172-L220 HydrophobicContact CB-CD2 4.06Å; L172-L220 HydrophobicContact CD2-CD2 4.08Å; L172-L220 HydrophobicContact CG-CD2 4.24Å; L172-L226 HydrophobicContact CD1-CD1 4.24Å; L172-L226 HydrophobicContact CD2-CB 3.66Å; L172-L226 HydrophobicContact CD2-CD1 4.29Å
173	V	90	Very high	84.8	Confident	0 Å²	0	46 Å²	46	0%	0	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-62.8	-37.8	-179.9	-173.7	0	0	0	0	111.2	L170 E171 K175 L176 C177 A180 W203 Y216 L220	L170-V173 VanDerWaalsContact O-CB 3.32Å; L170-V173 WeakPolarHBondContact O-CB 3.47Å; L170-V173 VanDerWaalsContact O-CG2 3.31Å; L170-V173 WeakPolarHBondContact O-CG2 3.23Å; L170-V173 PolarHBondContact O-N 3.19Å; E171-V173 VanDerWaalsContact C-N 3.28Å; E171-V173 PolarHBondContact O-N 3.26Å; V173-K175 PolarHBondContact O-N 3.28Å; V173-K175 VanDerWaalsContact O-N 3.13Å; V173-L176 CarbonylContact O-C 3.59Å; V173-L176 PolarHBondContact O-N 2.84Å; V173-C177 HydrophobicContact CG1-CB 4.16Å; V173-C177 PolarHBondContact O-N 3.33Å; V173-A180 HydrophobicContact CB-CB 4.2Å; V173-A180 HydrophobicContact CG1-CB 3.51Å; V173-W203 HydrophobicContact CB-CH2 4.48Å; V173-W203 HydrophobicContact CB-CZ2 3.91Å; V173-W203 HydrophobicContact CG1-CZ2 4.11Å; V173-W203 HydrophobicContact CG2-CH2 3.97Å; V173-W203 HydrophobicContact CG2-CZ2 3.84Å; V173-Y216 HydrophobicContact CG1-CD1 3.66Å; V173-Y216 HydrophobicContact CG1-CE1 4.46Å; V173-Y216 HydrophobicContact CG1-CG 3.81Å; V173-L220 HydrophobicContact CG2-CD1 3.82Å; V173-L220 HydrophobicContact CG2-CD2 3.72Å; V173-L220 HydrophobicContact CG2-CG 3.74Å
174	E	89.5	Confident	86.8	Confident	48 Å²	48	41.8 Å²	41.8	22%	0.224	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-54	-30.9	174.1	177.3	176.8	142.7	0	0	112.7	L172 S184 R188	L172-E174 VanDerWaalsContact C-N 3.3Å; L172-E174 PolarHBondContact O-N 2.82Å; E174-S184 WeakPolarHBondContact OE2-CB 3.33Å; E174-R188 IonicContact OE1-CZ 2.7Å; E174-R188 IonicContact OE1-NH1 3.81Å; E174-R188 IonicContact OE1-NH2 3.75Å; E174-R188 PolarHBondContact OE1-NH2 2.9Å; E174-R188 IonicContact OE2-CZ 3.72Å; E174-R188 IonicContact OE2-NH2 3.61Å; E174-R188 PolarHBondContact OE2-NH2 3.07Å
175	K	86.1	Confident	88.2	Confident	160 Å²	160	40.2 Å²	40.2	70%	0.696	22%	0.215	S	C	*	.	G	3₁₀ helix	trans	-88.6	-10.4	178.4	-56.9	-179.8	-176.4	174.7	0	113.8	L172 V173	L172-K175 HydrophobicContact CD1-CD 4.39Å; L172-K175 WeakPolarHBondContact O-CB 3.43Å; L172-K175 PolarHBondContact O-N 3.35Å; V173-K175 PolarHBondContact O-N 3.28Å; V173-K175 VanDerWaalsContact O-N 3.13Å
176	L	87.5	Confident	88.8	Confident	44 Å²	44	42 Å²	42	23%	0.23	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.9	-20.6	-179.9	-63.6	177.1	0	0	0	112.9	L172 V173 L220 R223 L226	L172-L176 HydrophobicContact CD2-CD1 4.47Å; L172-L176 HydrophobicContact CG-CD1 4.18Å; L172-L176 PolarHBondContact O-N 3.08Å; V173-L176 CarbonylContact O-C 3.59Å; V173-L176 PolarHBondContact O-N 2.84Å; L176-L220 HydrophobicContact CD1-CD2 4.15Å; L176-R223 HydrophobicContact CD1-CB 4.3Å; L176-R223 HydrophobicContact CD1-CG 4.05Å; L176-R223 HydrophobicContact CD2-CG 4.06Å; L176-L226 HydrophobicContact CD2-CD1 4.17Å
177	C	88.6	Confident	89	Confident	8 Å²	8	41.9 Å²	41.9	5%	0.054	23%	0.227	C	C	.	.			trans	-146.7	101.1	-174.5	-152.9	0	0	0	0	108.3	V173 E179 A180 Y216 L219	V173-C177 HydrophobicContact CG1-CB 4.16Å; V173-C177 PolarHBondContact O-N 3.33Å; C177-E179 PolarHBondContact O-N 3Å; C177-E179 VanDerWaalsContact O-N 3.12Å; C177-E179 PolarHBondContact SG-OE2 3.23Å; C177-A180 HydrophobicContact CB-CB 4.22Å; C177-A180 WeakPolarHBondContact O-CB 3.49Å; C177-A180 PolarHBondContact O-N 3.12Å; C177-Y216 HydrophobicContact CB-CD1 4.32Å; C177-Y216 HydrophobicContact CB-CE1 4.29Å; C177-L219 HydrophobicContact CB-CD1 3.57Å
178	P	86.3	Confident	88.9	Confident	101 Å²	101	45.9 Å²	45.9	66%	0.656	24%	0.242	S	C	*	.	G	3₁₀ helix	trans	-54.5	-30.8	179.8	-28.2	36.6	0	0	0	113.8	A180 S181	P178-A180 PolarHBondContact O-N 2.99Å; P178-S181 WeakPolarHBondContact O-CB 3.39Å; P178-S181 PolarHBondContact O-N 3.42Å
179	E	85.8	Confident	88.8	Confident	101 Å²	101	51.2 Å²	51.2	47%	0.472	27%	0.267	S	S	.	.	G	3₁₀ helix	trans	-64.6	-21.7	176.1	-51.5	94.9	135	0	0	113.1	C177 S181 Y216	C177-E179 PolarHBondContact O-N 3Å; C177-E179 VanDerWaalsContact O-N 3.12Å; C177-E179 PolarHBondContact SG-OE2 3.23Å; E179-S181 VanDerWaalsContact C-N 3.29Å; E179-Y216 PolarHBondContact O-OH 3.36Å
180	A	89	Confident	88.6	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-80.5	-9.1	172.3	0	0	0	0	0	113	V173 C177 P178 E182 I183 S184 Y216	V173-A180 HydrophobicContact CB-CB 4.2Å; V173-A180 HydrophobicContact CG1-CB 3.51Å; C177-A180 HydrophobicContact CB-CB 4.22Å; C177-A180 WeakPolarHBondContact O-CB 3.49Å; C177-A180 PolarHBondContact O-N 3.12Å; P178-A180 PolarHBondContact O-N 2.99Å; A180-E182 VanDerWaalsContact C-N 3.35Å; A180-I183 VanDerWaalsContact O-CG1 3.25Å; A180-I183 WeakPolarHBondContact O-CG1 3.4Å; A180-S184 VanDerWaalsContact O-CB 3.25Å; A180-S184 WeakPolarHBondContact O-CB 3.41Å; A180-S184 PolarHBondContact O-N 3.08Å; A180-S184 PolarHBondContact O-OG 2.86Å; A180-Y216 HydrophobicContact CB-CD1 4.14Å; A180-Y216 HydrophobicContact CB-CE1 3.74Å; A180-Y216 HydrophobicContact CB-CE2 4.46Å
181	S	89.6	Confident	88	Confident	51 Å²	51	57.9 Å²	57.9	36%	0.357	31%	0.309	S	S	.	.	H	α-helix	trans	-63.3	-40.5	177	-171.8	0	0	0	0	111.6	P178 E179 I183 S184 A185	P178-S181 WeakPolarHBondContact O-CB 3.39Å; P178-S181 PolarHBondContact O-N 3.42Å; E179-S181 VanDerWaalsContact C-N 3.29Å; S181-I183 PolarHBondContact O-N 3.26Å; S181-S184 PolarHBondContact O-N 3.15Å; S181-S184 VanDerWaalsContact O-N 3.14Å; S181-A185 WeakPolarHBondContact O-CB 3.31Å; S181-A185 PolarHBondContact O-N 2.83Å
182	E	89.3	Confident	87.4	Confident	138 Å²	138	57.6 Å²	57.6	65%	0.645	32%	0.324	S	S	*	.	H	α-helix	trans	-57.3	-47.3	179.9	-62.5	-175	168.7	0	0	112.5	A180 S186	A180-E182 VanDerWaalsContact C-N 3.35Å; E182-S186 VanDerWaalsContact O-CB 3.26Å; E182-S186 WeakPolarHBondContact O-CB 3.4Å; E182-S186 PolarHBondContact O-N 3.16Å; E182-S186 PolarHBondContact O-OG 2.84Å
183	I	91.4	Very high	87.3	Confident	8 Å²	8	57.3 Å²	57.3	4%	0.041	32%	0.323	C	S	.	.	H	α-helix	trans	-73.6	-32.7	177.5	59.2	168.3	0	0	0	112.2	A180 S181 S186 V187 W203 L206 A207 Q210 Y216	A180-I183 VanDerWaalsContact O-CG1 3.25Å; A180-I183 WeakPolarHBondContact O-CG1 3.4Å; S181-I183 PolarHBondContact O-N 3.26Å; I183-S186 PolarHBondContact O-N 3.39Å; I183-V187 WeakPolarHBondContact O-CB 3.37Å; I183-V187 WeakPolarHBondContact O-CG2 3.35Å; I183-V187 PolarHBondContact O-N 3.08Å; I183-W203 HydrophobicContact CD1-CD2 4.16Å; I183-W203 HydrophobicContact CD1-CG 4.41Å; I183-W203 HydrophobicContact CD1-CZ2 3.93Å; I183-L206 HydrophobicContact CB-CB 4.08Å; I183-L206 HydrophobicContact CB-CD1 4.06Å; I183-L206 HydrophobicContact CG2-CB 3.75Å; I183-L206 HydrophobicContact CG2-CD1 4.14Å; I183-A207 HydrophobicContact CD1-CB 4.06Å; I183-Q210 VanDerWaalsContact CG2-CD 3.44Å; I183-Q210 HydrophobicContact CG2-CG 4.24Å; I183-Y216 HydrophobicContact CD1-CD2 4.2Å; I183-Y216 HydrophobicContact CD1-CE2 3.66Å
184	S	90.8	Very high	86.9	Confident	0 Å²	0	65.9 Å²	65.9	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-77.1	-29	-177.2	-53.4	0	0	0	0	112.2	E174 A180 S181 R188 W203	E174-S184 WeakPolarHBondContact OE2-CB 3.33Å; A180-S184 VanDerWaalsContact O-CB 3.25Å; A180-S184 WeakPolarHBondContact O-CB 3.41Å; A180-S184 PolarHBondContact O-N 3.08Å; A180-S184 PolarHBondContact O-OG 2.86Å; S181-S184 PolarHBondContact O-N 3.15Å; S181-S184 VanDerWaalsContact O-N 3.14Å; S184-R188 WeakPolarHBondContact O-CB 3.42Å; S184-R188 PolarHBondContact O-N 2.84Å; S184-W203 PolarHBondContact OG-NE1 3.18Å
185	A	90	Very high	86.8	Confident	35 Å²	35	65.9 Å²	65.9	29%	0.289	36%	0.363	S	S	.	.	H	α-helix	trans	-71	-49.1	163.5	0	0	0	0	0	111.4	S181 V187 R188 D189	S181-A185 WeakPolarHBondContact O-CB 3.31Å; S181-A185 PolarHBondContact O-N 2.83Å; A185-V187 PolarHBondContact O-N 2.81Å; A185-V187 VanDerWaalsContact O-N 3.1Å; A185-R188 WeakPolarHBondContact O-CA 3.05Å; A185-R188 WeakPolarHBondContact O-CB 3.44Å; A185-R188 PolarHBondContact O-N 3.47Å; A185-D189 PolarHBondContact O-N 3.23Å
186	S	89.8	Confident	86.8	Confident	66 Å²	66	61 Å²	61	46%	0.462	35%	0.348	S	S	.	.	H	α-helix	trans	-55.7	-32.6	179.8	-64.2	0	0	0	0	113.7	E182 I183	E182-S186 VanDerWaalsContact O-CB 3.26Å; E182-S186 WeakPolarHBondContact O-CB 3.4Å; E182-S186 PolarHBondContact O-N 3.16Å; E182-S186 PolarHBondContact O-OG 2.84Å; I183-S186 PolarHBondContact O-N 3.39Å
187	V	90.5	Very high	86.8	Confident	2 Å²	2	61 Å²	61	1%	0.012	35%	0.348	C	S	.	.	H	α-helix	trans	-79.3	-30.8	175.4	167.5	0	0	0	0	112.8	W167 I183 A185 L193 R199 A202 W203 L206	W167-V187 HydrophobicContact CH2-CB 4.16Å; W167-V187 HydrophobicContact CH2-CG1 3.71Å; W167-V187 HydrophobicContact CZ2-CG1 4.46Å; W167-V187 HydrophobicContact CZ3-CG1 3.76Å; I183-V187 WeakPolarHBondContact O-CB 3.37Å; I183-V187 WeakPolarHBondContact O-CG2 3.35Å; I183-V187 PolarHBondContact O-N 3.08Å; A185-V187 PolarHBondContact O-N 2.81Å; A185-V187 VanDerWaalsContact O-N 3.1Å; V187-L193 HydrophobicContact CG1-CD2 4.36Å; V187-R199 HydrophobicContact CG1-CB 3.59Å; V187-R199 HydrophobicContact CG1-CG 3.86Å; V187-R199 VanDerWaalsContact CG1-O 3.31Å; V187-R199 WeakPolarHBondContact CG1-O 3.34Å; V187-A202 HydrophobicContact CG1-CB 4.27Å; V187-A202 HydrophobicContact CG2-CB 3.91Å; V187-W203 HydrophobicContact CG2-CB 3.97Å; V187-L206 HydrophobicContact CG2-CD1 3.81Å
188	R	88.3	Confident	86.9	Confident	100 Å²	100	60.7 Å²	60.7	38%	0.377	35%	0.345	S	S	.	.	H	α-helix	trans	-73.2	-37.1	-179.1	-166.6	-178.7	-55.6	-177.1	6.1	111.7	E174 S184 A185	E174-R188 IonicContact OE1-CZ 2.7Å; E174-R188 IonicContact OE1-NH1 3.81Å; E174-R188 IonicContact OE1-NH2 3.75Å; E174-R188 PolarHBondContact OE1-NH2 2.9Å; E174-R188 IonicContact OE2-CZ 3.72Å; E174-R188 IonicContact OE2-NH2 3.61Å; E174-R188 PolarHBondContact OE2-NH2 3.07Å; S184-R188 WeakPolarHBondContact O-CB 3.42Å; S184-R188 PolarHBondContact O-N 2.84Å; A185-R188 WeakPolarHBondContact O-CA 3.05Å; A185-R188 WeakPolarHBondContact O-CB 3.44Å; A185-R188 PolarHBondContact O-N 3.47Å
189	D	85.4	Confident	87.1	Confident	126 Å²	126	59.4 Å²	59.4	67%	0.674	33%	0.327	S	S	*	.	S	Bend	trans	-96.6	5.6	-177.7	-60.1	-29.4	0	0	0	113.4	A185 P191	A185-D189 PolarHBondContact O-N 3.23Å; D189-P191 WeakPolarHBondContact O-CD 3.46Å
190	L	84.8	Confident	87.4	Confident	25 Å²	25	54.6 Å²	54.6	13%	0.131	31%	0.305	C	S	.	.			trans	-70.6	116.1	-177.4	-163.9	76.9	0	0	0	111.8	G192 L193 V261 K262	L190-G192 PolarHBondContact O-N 3.31Å; L190-L193 HydrophobicContact CB-CB 4.43Å; L190-L193 HydrophobicContact CB-CD2 4.44Å; L190-L193 HydrophobicContact CD2-CB 4.31Å; L190-L193 HydrophobicContact CD2-CD2 3.89Å; L190-L193 PolarHBondContact O-N 2.88Å; L190-V261 HydrophobicContact CD2-CG1 3.8Å; L190-K262 HydrophobicContact CD1-CG 3.91Å
191	P	77.4	Confident	87.5	Confident	114 Å²	114	55.3 Å²	55.3	74%	0.74	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	129.5	-179.4	28.4	-34.2	0	0	0	111	D189	D189-P191 WeakPolarHBondContact O-CD 3.46Å
192	G	77.9	Confident	87.7	Confident	61 Å²	61	52.9 Å²	52.9	63%	0.629	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	109.6	-23.5	179.7	0	0	0	0	0	114.5	L190 K194	L190-G192 PolarHBondContact O-N 3.31Å; G192-K194 PolarHBondContact O-N 2.82Å
193	L	84.3	Confident	87.9	Confident	16 Å²	16	46.3 Å²	46.3	8%	0.084	26%	0.26	C	S	.	.			trans	-88.9	99.5	-169.7	-159.2	63.1	0	0	0	112.6	V187 L190 R199 A202 L266	V187-L193 HydrophobicContact CG1-CD2 4.36Å; L190-L193 HydrophobicContact CB-CB 4.43Å; L190-L193 HydrophobicContact CB-CD2 4.44Å; L190-L193 HydrophobicContact CD2-CB 4.31Å; L190-L193 HydrophobicContact CD2-CD2 3.89Å; L190-L193 PolarHBondContact O-N 2.88Å; L193-R199 HydrophobicContact CD2-CB 4.41Å; L193-R199 HydrophobicContact CD2-CG 3.86Å; L193-R199 HydrophobicContact CG-CG 4.17Å; L193-A202 HydrophobicContact CD2-CB 3.7Å; L193-L266 HydrophobicContact CD1-CB 3.79Å; L193-L266 HydrophobicContact CD1-CD1 4.41Å
194	K	82.8	Confident	88	Confident	179 Å²	179	46 Å²	46	78%	0.778	26%	0.259	S	S	*	.			trans	-94.6	-31.9	-168.3	-62.3	159.3	-170.5	164.7	0	113.3	G192 D267	G192-K194 PolarHBondContact O-N 2.82Å; K194-D267 WeakPolarHBondContact CA-OD2 3.48Å; K194-D267 WeakPolarHBondContact CB-OD2 3.41Å; K194-D267 PolarHBondContact N-OD2 3.15Å
195	T	87.6	Confident	88.1	Confident	49 Å²	49	46.5 Å²	46.5	30%	0.301	26%	0.26	S	S	.	.	S	Bend	trans	-99.6	148.9	-175.3	78.2	0	0	0	0	112.5	L197 G198 R199 D267	T195-L197 PolarHBondContact O-N 3.02Å; T195-L197 PolarHBondContact OG1-N 3.38Å; T195-G198 PolarHBondContact O-N 2.94Å; T195-G198 PolarHBondContact OG1-N 3.45Å; T195-R199 PolarHBondContact O-N 3.41Å; T195-R199 VanDerWaalsContact O-N 3.08Å; T195-D267 WeakPolarHBondContact CA-OD1 3.32Å; T195-D267 WeakPolarHBondContact CB-OD1 3.31Å; T195-D267 HydrophobicContact CG2-CB 3.93Å; T195-D267 WeakPolarHBondContact CG2-OD1 3.48Å; T195-D267 PolarHBondContact N-OD1 3.37Å; T195-D267 PolarHBondContact N-OD2 2.84Å; T195-D267 PolarHBondContact OG1-OD1 3.36Å
196	P	86.7	Confident	88.3	Confident	57 Å²	57	46.4 Å²	46.4	37%	0.37	26%	0.255	S	S	.	.	H	α-helix	trans	-61.4	-24.3	168.9	-25.8	36.3	0	0	0	114.1	S165 W167 R199 A200	S165-P196 WeakPolarHBondContact OG-CB 3.46Å; W167-P196 HydrophobicContact CB-CB 3.89Å; P196-R199 PolarHBondContact O-N 2.93Å; P196-A200 PolarHBondContact O-N 3.13Å; P196-A200 VanDerWaalsContact O-N 3.08Å
197	L	87.5	Confident	88.5	Confident	45 Å²	45	43.2 Å²	43.2	24%	0.236	23%	0.233	C	C	.	.	H	α-helix	trans	-72.2	-42.8	175.2	-178.1	59.2	0	0	0	111.2	E146 L166 T195 R199 A200 R201	E146-L197 HydrophobicContact CG-CD1 4.31Å; L166-L197 HydrophobicContact CD2-CD1 4.15Å; T195-L197 PolarHBondContact O-N 3.02Å; T195-L197 PolarHBondContact OG1-N 3.38Å; L197-R199 VanDerWaalsContact C-N 3.28Å; L197-R199 PolarHBondContact O-N 3.15Å; L197-A200 PolarHBondContact O-N 3.18Å; L197-R201 WeakPolarHBondContact O-CG 3.49Å; L197-R201 PolarHBondContact O-N 3.2Å
198	G	89.5	Confident	88.6	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-56.6	-42.1	169.6	0	0	0	0	0	112	T195 A200 R201 A202 L266	T195-G198 PolarHBondContact O-N 2.94Å; T195-G198 PolarHBondContact OG1-N 3.45Å; G198-A200 PolarHBondContact O-N 3.09Å; G198-R201 WeakPolarHBondContact O-CB 3.38Å; G198-R201 PolarHBondContact O-N 3Å; G198-A202 WeakPolarHBondContact O-CB 3.49Å; G198-A202 PolarHBondContact O-N 3.15Å; G198-L266 WeakPolarHBondContact CA-O 3.3Å
199	R	90.8	Very high	88.8	Confident	74 Å²	74	41.5 Å²	41.5	28%	0.279	23%	0.23	S	C	.	.	H	α-helix	trans	-58.5	-47.6	174	-68.8	178.2	-175.7	-163.2	-5.7	112.7	W167 V187 L193 T195 P196 L197 R201 A202 W203	W167-R199 HydrophobicContact CD2-CB 3.84Å; W167-R199 HydrophobicContact CE3-CB 3.66Å; W167-R199 HydrophobicContact CG-CB 4.34Å; W167-R199 HydrophobicContact CZ3-CB 4.15Å; V187-R199 HydrophobicContact CG1-CB 3.59Å; V187-R199 HydrophobicContact CG1-CG 3.86Å; V187-R199 VanDerWaalsContact CG1-O 3.31Å; V187-R199 WeakPolarHBondContact CG1-O 3.34Å; L193-R199 HydrophobicContact CD2-CB 4.41Å; L193-R199 HydrophobicContact CD2-CG 3.86Å; L193-R199 HydrophobicContact CG-CG 4.17Å; T195-R199 PolarHBondContact O-N 3.41Å; T195-R199 VanDerWaalsContact O-N 3.08Å; P196-R199 PolarHBondContact O-N 2.93Å; L197-R199 VanDerWaalsContact C-N 3.28Å; L197-R199 PolarHBondContact O-N 3.15Å; R199-R201 VanDerWaalsContact C-N 3.33Å; R199-R201 PolarHBondContact O-N 3.43Å; R199-A202 PolarHBondContact O-N 3.45Å; R199-W203 WeakPolarHBondContact O-CB 3.36Å; R199-W203 PolarHBondContact O-N 3.33Å
200	A	91.4	Very high	89.2	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-58.7	-42.6	173.9	0	0	0	0	0	112.8	L166 L170 P196 L197 G198 W203 L204	L166-A200 HydrophobicContact CB-CB 4.11Å; L166-A200 HydrophobicContact CD2-CB 3.72Å; L166-A200 HydrophobicContact CG-CB 3.59Å; L170-A200 HydrophobicContact CD1-CB 3.71Å; P196-A200 PolarHBondContact O-N 3.13Å; P196-A200 VanDerWaalsContact O-N 3.08Å; L197-A200 PolarHBondContact O-N 3.18Å; G198-A200 PolarHBondContact O-N 3.09Å; A200-W203 PolarHBondContact O-N 2.9Å; A200-L204 WeakPolarHBondContact O-CB 3.31Å; A200-L204 VanDerWaalsContact O-CG 3.28Å; A200-L204 WeakPolarHBondContact O-CG 3.46Å; A200-L204 PolarHBondContact O-N 3.15Å
201	R	92.1	Very high	89.7	Confident	15 Å²	15	40.7 Å²	40.7	6%	0.057	22%	0.22	C	C	.	.	H	α-helix	trans	-65.1	-39.7	178.4	-71.4	162.1	172.8	-173.6	-9.6	113.4	E146 L197 G198 R199 R205 L266 D267 Q269	E146-R201 IonicContact OE1-CZ 2.89Å; E146-R201 IonicContact OE1-NE 3.32Å; E146-R201 IonicContact OE1-NH2 3.44Å; E146-R201 PolarHBondContact OE1-NH2 2.87Å; E146-R201 IonicContact OE2-CZ 3.47Å; E146-R201 VanDerWaalsContact OE2-CZ 3.32Å; E146-R201 IonicContact OE2-NE 2.62Å; E146-R201 PolarHBondContact OE2-NE 2.71Å; E146-R201 IonicContact OE2-NH2 2.8Å; E146-R201 PolarHBondContact OE2-NH2 3.22Å; L197-R201 WeakPolarHBondContact O-CG 3.49Å; L197-R201 PolarHBondContact O-N 3.2Å; G198-R201 WeakPolarHBondContact O-CB 3.38Å; G198-R201 PolarHBondContact O-N 3Å; R199-R201 VanDerWaalsContact C-N 3.33Å; R199-R201 PolarHBondContact O-N 3.43Å; R201-R205 WeakPolarHBondContact O-CG 3.48Å; R201-R205 PolarHBondContact O-N 3.33Å; R201-R205 PolarHBondContact O-NH1 2.97Å; R201-L266 HydrophobicContact CB-CB 4.33Å; R201-L266 WeakPolarHBondContact CD-O 3.37Å; R201-L266 PolarHBondContact NH1-O 2.8Å; R201-D267 PolarHBondContact NH1-O 3.03Å; R201-Q269 PolarHBondContact NH1-O 3.08Å; R201-Q269 PolarHBondContact NH2-O 3.32Å
202	A	92.6	Very high	90.4	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-65.3	-45	174.1	0	0	0	0	0	111.2	V187 L193 G198 R199 R205 L206 V261 L266	V187-A202 HydrophobicContact CG1-CB 4.27Å; V187-A202 HydrophobicContact CG2-CB 3.91Å; L193-A202 HydrophobicContact CD2-CB 3.7Å; G198-A202 WeakPolarHBondContact O-CB 3.49Å; G198-A202 PolarHBondContact O-N 3.15Å; R199-A202 PolarHBondContact O-N 3.45Å; A202-R205 WeakPolarHBondContact O-CB 3.38Å; A202-R205 PolarHBondContact O-N 3.44Å; A202-L206 WeakPolarHBondContact O-CG 3.32Å; A202-L206 PolarHBondContact O-N 3.02Å; A202-V261 HydrophobicContact CB-CG1 3.55Å; A202-L266 HydrophobicContact CB-CD1 3.77Å
203	W	94.3	Very high	91.2	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-64.1	-43.2	179.2	-170.8	99.9	0	0	0	112.6	W167 L170 V173 I183 S184 V187 R199 A200 R205 L206 A207 L213 Y216	W167-W203 AromaticContact CH2-CD1 3.84Å; W167-W203 HydrophobicContact CH2-CG 4.46Å; W167-W203 HydrophobicContact CZ3-CB 3.78Å; W167-W203 AromaticContact CZ3-CD1 3.71Å; W167-W203 AromaticContact CZ3-CG 3.89Å; W167-W203 HydrophobicContact CZ3-CG 3.89Å; L170-W203 HydrophobicContact CB-CD2 4.21Å; L170-W203 HydrophobicContact CB-CE3 4.31Å; L170-W203 HydrophobicContact CD1-CD2 4.43Å; L170-W203 HydrophobicContact CD1-CE3 3.98Å; L170-W203 HydrophobicContact CD2-CE3 4.05Å; L170-W203 HydrophobicContact CD2-CH2 4.22Å; L170-W203 HydrophobicContact CD2-CZ3 3.77Å; L170-W203 HydrophobicContact CG-CE3 4.33Å; V173-W203 HydrophobicContact CB-CH2 4.48Å; V173-W203 HydrophobicContact CB-CZ2 3.91Å; V173-W203 HydrophobicContact CG1-CZ2 4.11Å; V173-W203 HydrophobicContact CG2-CH2 3.97Å; V173-W203 HydrophobicContact CG2-CZ2 3.84Å; I183-W203 HydrophobicContact CD1-CD2 4.16Å; I183-W203 HydrophobicContact CD1-CG 4.41Å; I183-W203 HydrophobicContact CD1-CZ2 3.93Å; S184-W203 PolarHBondContact OG-NE1 3.18Å; V187-W203 HydrophobicContact CG2-CB 3.97Å; R199-W203 WeakPolarHBondContact O-CB 3.36Å; R199-W203 PolarHBondContact O-N 3.33Å; A200-W203 PolarHBondContact O-N 2.9Å; W203-R205 VanDerWaalsContact C-N 3.31Å; W203-R205 PolarHBondContact O-N 3.33Å; W203-L206 PolarHBondContact O-N 3.23Å; W203-A207 HydrophobicContact CE3-CB 4.08Å; W203-A207 HydrophobicContact CH2-CB 4.26Å; W203-A207 HydrophobicContact CZ3-CB 3.89Å; W203-A207 VanDerWaalsContact O-CB 3.29Å; W203-A207 WeakPolarHBondContact O-CB 3.49Å; W203-A207 PolarHBondContact O-N 2.72Å; W203-L213 HydrophobicContact CZ3-CD1 4.26Å; W203-Y216 AromaticContact CH2-CD2 3.9Å; W203-Y216 HydrophobicContact CH2-CD2 3.9Å; W203-Y216 HydrophobicContact CH2-CG 4.16Å; W203-Y216 HydrophobicContact CZ2-CD2 4.07Å; W203-Y216 HydrophobicContact CZ2-CG 4.39Å
204	L	93.7	Very high	91.7	Very high	3 Å²	3	35.8 Å²	35.8	2%	0.016	17%	0.167	C	C	.	.	H	α-helix	trans	-61.5	-38.5	175.9	-71.6	169.2	0	0	0	111.9	F142 L149 L170 A200 L208 L213	F142-L204 HydrophobicContact CD1-CB 4.08Å; F142-L204 HydrophobicContact CE1-CB 4.04Å; L149-L204 HydrophobicContact CD1-CD1 4.09Å; L149-L204 HydrophobicContact CD1-CD2 3.88Å; L170-L204 HydrophobicContact CD1-CG 4.42Å; A200-L204 WeakPolarHBondContact O-CB 3.31Å; A200-L204 VanDerWaalsContact O-CG 3.28Å; A200-L204 WeakPolarHBondContact O-CG 3.46Å; A200-L204 PolarHBondContact O-N 3.15Å; L204-L208 PolarHBondContact O-N 3.01Å; L204-L208 VanDerWaalsContact O-N 3.15Å; L204-L213 HydrophobicContact CD2-CD1 3.67Å
205	R	93.3	Very high	92.3	Very high	9 Å²	9	28.6 Å²	28.6	3%	0.034	14%	0.137	C	C	.	.	H	α-helix	trans	-62.5	-50.1	173.2	-73.2	167.1	167.2	70.9	-13	111.3	F142 R201 A202 W203 L208 M209 L259 V261 E264	F142-R205 HydrophobicContact CD2-CG 4.41Å; F142-R205 HydrophobicContact CE1-CG 4.2Å; F142-R205 HydrophobicContact CE2-CG 3.85Å; F142-R205 HydrophobicContact CZ-CB 4.26Å; F142-R205 HydrophobicContact CZ-CG 3.75Å; R201-R205 WeakPolarHBondContact O-CG 3.48Å; R201-R205 PolarHBondContact O-N 3.33Å; R201-R205 PolarHBondContact O-NH1 2.97Å; A202-R205 WeakPolarHBondContact O-CB 3.38Å; A202-R205 PolarHBondContact O-N 3.44Å; W203-R205 VanDerWaalsContact C-N 3.31Å; W203-R205 PolarHBondContact O-N 3.33Å; R205-L208 PolarHBondContact O-N 2.93Å; R205-M209 WeakPolarHBondContact O-CG 3.3Å; R205-M209 PolarHBondContact O-N 3.16Å; R205-L259 HydrophobicContact CB-CB 4.44Å; R205-L259 HydrophobicContact CB-CD1 3.92Å; R205-L259 HydrophobicContact CG-CD1 3.93Å; R205-V261 HydrophobicContact CB-CG2 4.36Å; R205-E264 IonicContact CZ-OE2 2.97Å; R205-E264 IonicContact NE-OE2 2.68Å; R205-E264 PolarHBondContact NE-OE2 3Å; R205-E264 IonicContact NH2-OE2 2.85Å; R205-E264 PolarHBondContact NH2-OE2 2.82Å
206	L	93.3	Very high	92.6	Very high	33 Å²	33	26.3 Å²	26.3	17%	0.173	12%	0.123	C	C	.	.	H	α-helix	trans	-64.5	-41	179.2	-66.4	-178.5	0	0	0	113.1	I183 V187 A202 W203 L208 M209 Q210 V261	I183-L206 HydrophobicContact CB-CB 4.08Å; I183-L206 HydrophobicContact CB-CD1 4.06Å; I183-L206 HydrophobicContact CG2-CB 3.75Å; I183-L206 HydrophobicContact CG2-CD1 4.14Å; V187-L206 HydrophobicContact CG2-CD1 3.81Å; A202-L206 WeakPolarHBondContact O-CG 3.32Å; A202-L206 PolarHBondContact O-N 3.02Å; W203-L206 PolarHBondContact O-N 3.23Å; L206-L208 VanDerWaalsContact C-N 3.27Å; L206-L208 PolarHBondContact O-N 3.45Å; L206-M209 HydrophobicContact CD2-SD 4.26Å; L206-M209 PolarHBondContact O-N 3.15Å; L206-Q210 PolarHBondContact O-N 3.14Å; L206-V261 HydrophobicContact CD2-CG2 3.83Å; L206-V261 HydrophobicContact CG-CG2 4.3Å
207	A	93.9	Very high	93	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-64.1	-31.1	177.2	0	0	0	0	0	112.7	I183 W203 K211 R212 L213 Y216	I183-A207 HydrophobicContact CD1-CB 4.06Å; W203-A207 HydrophobicContact CE3-CB 4.08Å; W203-A207 HydrophobicContact CH2-CB 4.26Å; W203-A207 HydrophobicContact CZ3-CB 3.89Å; W203-A207 VanDerWaalsContact O-CB 3.29Å; W203-A207 WeakPolarHBondContact O-CB 3.49Å; W203-A207 PolarHBondContact O-N 2.72Å; A207-K211 PolarHBondContact O-N 3.12Å; A207-R212 PolarHBondContact O-N 3.09Å; A207-L213 HydrophobicContact CB-CB 4.13Å; A207-L213 HydrophobicContact CB-CD1 3.98Å; A207-L213 PolarHBondContact O-N 3.48Å; A207-Y216 HydrophobicContact CB-CD2 3.93Å; A207-Y216 HydrophobicContact CB-CE2 4.23Å
208	L	94.1	Very high	93.4	Very high	8 Å²	8	26.6 Å²	26.6	4%	0.042	11%	0.114	C	C	.	.	H	α-helix	trans	-72.6	-44.2	170.9	-173.1	69.5	0	0	0	111.5	L138 F141 F142 L204 R205 L206 Q210 K211 L213 L252	L138-L208 HydrophobicContact CD1-CD2 3.47Å; L138-L208 VanDerWaalsContact CD1-CD2 3.47Å; F141-L208 HydrophobicContact CE1-CD2 4.38Å; F142-L208 HydrophobicContact CE1-CD2 4.32Å; F142-L208 HydrophobicContact CE2-CD2 4.36Å; F142-L208 HydrophobicContact CZ-CB 4.29Å; F142-L208 HydrophobicContact CZ-CD2 3.64Å; L204-L208 PolarHBondContact O-N 3.01Å; L204-L208 VanDerWaalsContact O-N 3.15Å; R205-L208 PolarHBondContact O-N 2.93Å; L206-L208 VanDerWaalsContact C-N 3.27Å; L206-L208 PolarHBondContact O-N 3.45Å; L208-Q210 VanDerWaalsContact C-N 3.31Å; L208-Q210 PolarHBondContact O-N 3.11Å; L208-K211 WeakPolarHBondContact O-CA 3.49Å; L208-K211 PolarHBondContact O-N 3.39Å; L208-L213 HydrophobicContact CB-CD2 4.43Å; L208-L213 HydrophobicContact CD1-CD2 4.28Å; L208-L252 HydrophobicContact CD1-CB 4.03Å; L208-L252 HydrophobicContact CD1-CD1 4.11Å
209	M	92.4	Very high	93.5	Very high	58 Å²	58	29.5 Å²	29.5	29%	0.286	13%	0.129	S	C	.	.	H	α-helix	trans	-60.3	-38.4	176.2	-68.8	172.4	63.4	0	0	112.5	R205 L206 K211 L259	R205-M209 WeakPolarHBondContact O-CG 3.3Å; R205-M209 PolarHBondContact O-N 3.16Å; L206-M209 HydrophobicContact CD2-SD 4.26Å; L206-M209 PolarHBondContact O-N 3.15Å; M209-K211 PolarHBondContact O-N 2.67Å; M209-L259 HydrophobicContact CG-CB 4.41Å; M209-L259 HydrophobicContact CG-CD1 4.34Å; M209-L259 HydrophobicContact CG-CG 4.1Å; M209-L259 HydrophobicContact SD-CB 3.74Å; M209-L259 HydrophobicContact SD-CG 4.1Å; M209-L259 PolarHBondContact SD-N 3.42Å; M209-L259 VanDerWaalsContact SD-N 3.41Å
210	Q	92.8	Very high	93.5	Very high	65 Å²	65	26.1 Å²	26.1	30%	0.304	12%	0.116	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-13.2	171.5	-77.6	-173.3	-39.4	0	0	113.8	I183 L206 L208 R212 Y216	I183-Q210 VanDerWaalsContact CG2-CD 3.44Å; I183-Q210 HydrophobicContact CG2-CG 4.24Å; L206-Q210 PolarHBondContact O-N 3.14Å; L208-Q210 VanDerWaalsContact C-N 3.31Å; L208-Q210 PolarHBondContact O-N 3.11Å; Q210-R212 VanDerWaalsContact C-N 3.25Å; Q210-R212 HydrophobicContact CB-CB 4.22Å; Q210-R212 HydrophobicContact CB-CG 3.96Å; Q210-R212 WeakPolarHBondContact O-CG 3.35Å; Q210-R212 PolarHBondContact O-N 2.89Å; Q210-Y216 PolarHBondContact OE1-OH 3.39Å
211	K	94.5	Very high	93.6	Very high	68 Å²	68	27.2 Å²	27.2	30%	0.296	12%	0.122	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.3	35.9	-173.2	-41.6	-167.1	-170.2	-159.1	0	112.4	A207 L208 M209 N253 I255 D256	A207-K211 PolarHBondContact O-N 3.12Å; L208-K211 WeakPolarHBondContact O-CA 3.49Å; L208-K211 PolarHBondContact O-N 3.39Å; M209-K211 PolarHBondContact O-N 2.67Å; K211-N253 PolarHBondContact O-OD1 3.33Å; K211-I255 VanDerWaalsContact CE-O 3.26Å; K211-I255 WeakPolarHBondContact CE-O 3.49Å; K211-I255 PolarHBondContact NZ-O 3.31Å; K211-D256 IonicContact NZ-OD1 3.72Å; K211-D256 PolarHBondContact NZ-OD1 2.99Å
212	R	94.1	Very high	93.7	Very high	85 Å²	85	31.3 Å²	31.3	32%	0.321	15%	0.149	S	C	.	.			trans	-120.5	-6	-177.1	-63	-67.6	-75.7	166.4	2.3	114.1	A207 Q210 A214 D215 Y216	A207-R212 PolarHBondContact O-N 3.09Å; Q210-R212 VanDerWaalsContact C-N 3.25Å; Q210-R212 HydrophobicContact CB-CB 4.22Å; Q210-R212 HydrophobicContact CB-CG 3.96Å; Q210-R212 WeakPolarHBondContact O-CG 3.35Å; Q210-R212 PolarHBondContact O-N 2.89Å; R212-A214 VanDerWaalsContact C-N 3.28Å; R212-A214 PolarHBondContact O-N 3.06Å; R212-A214 VanDerWaalsContact O-N 3.16Å; R212-D215 IonicContact CZ-OD2 2.91Å; R212-D215 VanDerWaalsContact CZ-OD2 3.3Å; R212-D215 IonicContact NE-OD2 3.98Å; R212-D215 IonicContact NH1-OD2 2.73Å; R212-D215 PolarHBondContact NH1-OD2 2.79Å; R212-D215 IonicContact NH2-OD2 3.72Å; R212-D215 WeakPolarHBondContact O-CA 3.45Å; R212-D215 WeakPolarHBondContact O-CB 3.41Å; R212-D215 PolarHBondContact O-N 3.01Å; R212-Y216 HydrophobicContact CB-CD2 3.86Å; R212-Y216 HydrophobicContact CB-CE1 4.13Å; R212-Y216 HydrophobicContact CB-CE2 3.37Å; R212-Y216 HydrophobicContact CB-CG 4.41Å; R212-Y216 HydrophobicContact CG-CE2 4.33Å; R212-Y216 PolarHBondContact O-N 3.35Å
213	L	94.4	Very high	93.6	Very high	3 Å²	3	35.8 Å²	35.8	2%	0.016	17%	0.166	C	C	.	.	H	α-helix	trans	-48.6	-44.3	-177.2	179.7	60.3	0	0	0	113.8	F141 W203 L204 A207 L208 L217	F141-L213 HydrophobicContact CE1-CD2 4.05Å; F141-L213 HydrophobicContact CZ-CD2 3.79Å; W203-L213 HydrophobicContact CZ3-CD1 4.26Å; L204-L213 HydrophobicContact CD2-CD1 3.67Å; A207-L213 HydrophobicContact CB-CB 4.13Å; A207-L213 HydrophobicContact CB-CD1 3.98Å; A207-L213 PolarHBondContact O-N 3.48Å; L208-L213 HydrophobicContact CB-CD2 4.43Å; L208-L213 HydrophobicContact CD1-CD2 4.28Å; L213-L217 HydrophobicContact CD1-CD1 3.91Å; L213-L217 HydrophobicContact CD1-CG 4.17Å; L213-L217 HydrophobicContact CG-CD1 4.37Å; L213-L217 WeakPolarHBondContact O-CG 3.33Å; L213-L217 PolarHBondContact O-N 2.85Å; L213-L217 VanDerWaalsContact O-N 3.1Å
214	A	94.8	Very high	93.4	Very high	1 Å²	1	40.9 Å²	40.9	1%	0.008	19%	0.188	C	C	.	.	H	α-helix	trans	-65.9	-36.2	177.3	0	0	0	0	0	113.1	R212 R218 L249 V250	R212-A214 VanDerWaalsContact C-N 3.28Å; R212-A214 PolarHBondContact O-N 3.06Å; R212-A214 VanDerWaalsContact O-N 3.16Å; A214-R218 VanDerWaalsContact O-CB 3.25Å; A214-R218 WeakPolarHBondContact O-CB 3.47Å; A214-R218 PolarHBondContact O-N 3.4Å; A214-L249 HydrophobicContact CB-CB 3.68Å; A214-V250 HydrophobicContact CB-CB 4.45Å; A214-V250 HydrophobicContact CB-CG2 3.85Å
215	D	94.5	Very high	93.1	Very high	27 Å²	27	45.2 Å²	45.2	14%	0.144	21%	0.211	C	C	.	.	H	α-helix	trans	-72.8	-44.5	179.2	-70.5	-13.6	0	0	0	111.3	R212 R218 L219	R212-D215 IonicContact CZ-OD2 2.91Å; R212-D215 VanDerWaalsContact CZ-OD2 3.3Å; R212-D215 IonicContact NE-OD2 3.98Å; R212-D215 IonicContact NH1-OD2 2.73Å; R212-D215 PolarHBondContact NH1-OD2 2.79Å; R212-D215 IonicContact NH2-OD2 3.72Å; R212-D215 WeakPolarHBondContact O-CA 3.45Å; R212-D215 WeakPolarHBondContact O-CB 3.41Å; R212-D215 PolarHBondContact O-N 3.01Å; D215-R218 WeakPolarHBondContact O-CB 3.2Å; D215-R218 PolarHBondContact O-N 3.46Å; D215-R218 IonicContact OD1-CZ 3.06Å; D215-R218 IonicContact OD1-NH1 3.71Å; D215-R218 PolarHBondContact OD1-NH1 2.81Å; D215-R218 IonicContact OD1-NH2 2.7Å; D215-R218 PolarHBondContact OD1-NH2 3.34Å; D215-L219 WeakPolarHBondContact O-CG 3.13Å; D215-L219 PolarHBondContact O-N 3.37Å
216	Y	95.1	Very high	92.9	Very high	1 Å²	1	47.5 Å²	47.5	0%	0.004	22%	0.224	C	C	.	.	H	α-helix	trans	-63.3	-44.1	177.7	-64	-33	0	0	0	112.6	V173 C177 E179 A180 I183 W203 A207 Q210 R212 R218 L219 L220	V173-Y216 HydrophobicContact CG1-CD1 3.66Å; V173-Y216 HydrophobicContact CG1-CE1 4.46Å; V173-Y216 HydrophobicContact CG1-CG 3.81Å; C177-Y216 HydrophobicContact CB-CD1 4.32Å; C177-Y216 HydrophobicContact CB-CE1 4.29Å; E179-Y216 PolarHBondContact O-OH 3.36Å; A180-Y216 HydrophobicContact CB-CD1 4.14Å; A180-Y216 HydrophobicContact CB-CE1 3.74Å; A180-Y216 HydrophobicContact CB-CE2 4.46Å; I183-Y216 HydrophobicContact CD1-CD2 4.2Å; I183-Y216 HydrophobicContact CD1-CE2 3.66Å; W203-Y216 AromaticContact CH2-CD2 3.9Å; W203-Y216 HydrophobicContact CH2-CD2 3.9Å; W203-Y216 HydrophobicContact CH2-CG 4.16Å; W203-Y216 HydrophobicContact CZ2-CD2 4.07Å; W203-Y216 HydrophobicContact CZ2-CG 4.39Å; A207-Y216 HydrophobicContact CB-CD2 3.93Å; A207-Y216 HydrophobicContact CB-CE2 4.23Å; Q210-Y216 PolarHBondContact OE1-OH 3.39Å; R212-Y216 HydrophobicContact CB-CD2 3.86Å; R212-Y216 HydrophobicContact CB-CE1 4.13Å; R212-Y216 HydrophobicContact CB-CE2 3.37Å; R212-Y216 HydrophobicContact CB-CG 4.41Å; R212-Y216 HydrophobicContact CG-CE2 4.33Å; R212-Y216 PolarHBondContact O-N 3.35Å; Y216-R218 VanDerWaalsContact C-N 3.31Å; Y216-R218 PolarHBondContact O-N 3.05Å; Y216-L219 PolarHBondContact O-N 3.14Å; Y216-L220 PolarHBondContact O-N 2.91Å
217	L	94.6	Very high	92.7	Very high	0 Å²	0	46 Å²	46	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-69.5	-29.5	175.5	-65.1	-178.1	0	0	0	111.9	M145 L149 L170 L213 L220 I221 V246 L249	M145-L217 HydrophobicContact CE-CD1 3.75Å; L149-L217 HydrophobicContact CD2-CD1 4.44Å; L149-L217 HydrophobicContact CD2-CD2 4.02Å; L170-L217 HydrophobicContact CD2-CD2 4.03Å; L213-L217 HydrophobicContact CD1-CD1 3.91Å; L213-L217 HydrophobicContact CD1-CG 4.17Å; L213-L217 HydrophobicContact CG-CD1 4.37Å; L213-L217 WeakPolarHBondContact O-CG 3.33Å; L213-L217 PolarHBondContact O-N 2.85Å; L213-L217 VanDerWaalsContact O-N 3.1Å; L217-L220 HydrophobicContact CD2-CD1 3.95Å; L217-L220 PolarHBondContact O-N 3.14Å; L217-I221 PolarHBondContact O-N 2.98Å; L217-I221 VanDerWaalsContact O-N 3.13Å; L217-V246 HydrophobicContact CB-CG2 3.76Å; L217-L249 HydrophobicContact CD1-CD1 3.65Å
218	R	94.6	Very high	92.5	Very high	108 Å²	108	47.8 Å²	47.8	41%	0.408	23%	0.228	S	C	.	.	H	α-helix	trans	-62.8	-39.6	171.6	-169.3	167.2	65.5	-102.5	1.2	112.5	A214 D215 Y216 L220 I221 T222 V246	A214-R218 VanDerWaalsContact O-CB 3.25Å; A214-R218 WeakPolarHBondContact O-CB 3.47Å; A214-R218 PolarHBondContact O-N 3.4Å; D215-R218 WeakPolarHBondContact O-CB 3.2Å; D215-R218 PolarHBondContact O-N 3.46Å; D215-R218 IonicContact OD1-CZ 3.06Å; D215-R218 IonicContact OD1-NH1 3.71Å; D215-R218 PolarHBondContact OD1-NH1 2.81Å; D215-R218 IonicContact OD1-NH2 2.7Å; D215-R218 PolarHBondContact OD1-NH2 3.34Å; Y216-R218 VanDerWaalsContact C-N 3.31Å; Y216-R218 PolarHBondContact O-N 3.05Å; R218-L220 VanDerWaalsContact C-N 3.34Å; R218-L220 PolarHBondContact O-N 3.49Å; R218-I221 WeakPolarHBondContact O-CG1 3.22Å; R218-T222 WeakPolarHBondContact O-CB 3.13Å; R218-T222 PolarHBondContact O-N 3.44Å; R218-T222 PolarHBondContact O-OG1 2.99Å; R218-V246 HydrophobicContact CB-CG1 3.65Å; R218-V246 HydrophobicContact CG-CG1 4.26Å
219	L	93.1	Very high	92.2	Very high	62 Å²	62	52.3 Å²	52.3	33%	0.325	25%	0.252	S	S	.	.	H	α-helix	trans	-63.4	-39.2	175.7	-68.6	173.5	0	0	0	112	C177 D215 Y216 R223	C177-L219 HydrophobicContact CB-CD1 3.57Å; D215-L219 WeakPolarHBondContact O-CG 3.13Å; D215-L219 PolarHBondContact O-N 3.37Å; Y216-L219 PolarHBondContact O-N 3.14Å; L219-R223 PolarHBondContact O-N 3.25Å
220	L	91	Very high	92	Very high	2 Å²	2	50.9 Å²	50.9	1%	0.01	25%	0.245	C	C	.	.	H	α-helix	trans	-63.2	-53.3	175.6	-65.1	-179	0	0	0	112.3	P169 L170 L172 V173 L176 Y216 L217 R218 T222 R223 L227	P169-L220 VanDerWaalsContact O-CD1 3.29Å; P169-L220 WeakPolarHBondContact O-CD1 3.37Å; P169-L220 WeakPolarHBondContact O-CD2 3.38Å; L170-L220 HydrophobicContact CD2-CD1 4.24Å; L172-L220 HydrophobicContact CB-CD2 4.06Å; L172-L220 HydrophobicContact CD2-CD2 4.08Å; L172-L220 HydrophobicContact CG-CD2 4.24Å; V173-L220 HydrophobicContact CG2-CD1 3.82Å; V173-L220 HydrophobicContact CG2-CD2 3.72Å; V173-L220 HydrophobicContact CG2-CG 3.74Å; L176-L220 HydrophobicContact CD1-CD2 4.15Å; Y216-L220 PolarHBondContact O-N 2.91Å; L217-L220 HydrophobicContact CD2-CD1 3.95Å; L217-L220 PolarHBondContact O-N 3.14Å; R218-L220 VanDerWaalsContact C-N 3.34Å; R218-L220 PolarHBondContact O-N 3.49Å; L220-T222 PolarHBondContact O-N 2.91Å; L220-R223 CarbonylContact O-C 3.5Å; L220-R223 WeakPolarHBondContact O-CA 3.37Å; L220-R223 PolarHBondContact O-N 3.03Å; L220-L227 HydrophobicContact CB-CD1 4.36Å; L220-L227 HydrophobicContact CB-CD2 4.48Å
221	I	92.8	Very high	91.9	Very high	23 Å²	23	47.9 Å²	47.9	12%	0.118	23%	0.231	C	C	.	.	H	α-helix	trans	-68.8	-21.3	-177.3	65.7	169.3	0	0	0	113.2	L217 R218 R223 K224 L227 M237 A243 V246	L217-I221 PolarHBondContact O-N 2.98Å; L217-I221 VanDerWaalsContact O-N 3.13Å; R218-I221 WeakPolarHBondContact O-CG1 3.22Å; I221-R223 VanDerWaalsContact C-N 3.32Å; I221-K224 VanDerWaalsContact O-CG 3.25Å; I221-K224 WeakPolarHBondContact O-CG 3.3Å; I221-L227 HydrophobicContact CG2-CD2 4.45Å; I221-M237 HydrophobicContact CG2-CE 3.57Å; I221-M237 WeakPolarHBondContact CG2-O 3.44Å; I221-A243 HydrophobicContact CD1-CB 4.02Å; I221-V246 HydrophobicContact CD1-CB 3.85Å; I221-V246 HydrophobicContact CD1-CG1 4Å; I221-V246 HydrophobicContact CD1-CG2 3.94Å; I221-V246 HydrophobicContact CG2-CG2 4.45Å
222	T	93.1	Very high	91.7	Very high	101 Å²	101	48.7 Å²	48.7	62%	0.62	24%	0.236	S	C	*	.	H	α-helix	trans	-71.9	-30.2	171.4	-56.4	0	0	0	0	111.1	R218 L220 K224	R218-T222 WeakPolarHBondContact O-CB 3.13Å; R218-T222 PolarHBondContact O-N 3.44Å; R218-T222 PolarHBondContact O-OG1 2.99Å; L220-T222 PolarHBondContact O-N 2.91Å; T222-K224 PolarHBondContact O-N 3.09Å
223	R	90.5	Very high	91.4	Very high	94 Å²	94	50.4 Å²	50.4	36%	0.355	25%	0.251	S	S	.	.			trans	-98.5	55.4	177.6	-65.4	-57.6	-57.4	-91.2	3.9	112.2	L176 L219 L220 I221 D225 L226 L227	L176-R223 HydrophobicContact CD1-CB 4.3Å; L176-R223 HydrophobicContact CD1-CG 4.05Å; L176-R223 HydrophobicContact CD2-CG 4.06Å; L219-R223 PolarHBondContact O-N 3.25Å; L220-R223 CarbonylContact O-C 3.5Å; L220-R223 WeakPolarHBondContact O-CA 3.37Å; L220-R223 PolarHBondContact O-N 3.03Å; I221-R223 VanDerWaalsContact C-N 3.32Å; R223-D225 VanDerWaalsContact CA-OD1 3.23Å; R223-D225 WeakPolarHBondContact CA-OD1 3.28Å; R223-D225 IonicContact CZ-OD1 2.69Å; R223-D225 IonicContact CZ-OD2 2.72Å; R223-D225 IonicContact NE-OD1 3.15Å; R223-D225 PolarHBondContact NE-OD1 2.87Å; R223-D225 IonicContact NE-OD2 2.89Å; R223-D225 PolarHBondContact NE-OD2 3.45Å; R223-D225 IonicContact NH2-OD1 3.35Å; R223-D225 IonicContact NH2-OD2 3.96Å; R223-D225 PolarHBondContact NH2-OD2 2.69Å; R223-D225 PolarHBondContact O-N 3.33Å; R223-D225 VanDerWaalsContact O-N 3.09Å; R223-L226 HydrophobicContact CB-CB 4.42Å; R223-L226 HydrophobicContact CB-CD1 4.29Å; R223-L226 HydrophobicContact CB-CG 4.4Å; R223-L226 PolarHBondContact O-N 3.43Å; R223-L227 WeakPolarHBondContact O-CB 3.48Å; R223-L227 PolarHBondContact O-N 3.44Å
224	K	89.9	Confident	91.2	Very high	107 Å²	107	52 Å²	52	47%	0.465	26%	0.262	S	S	.	.	H	α-helix	trans	-52	-31.3	175.1	-62.5	-161.7	-176.3	-171.1	0	112.8	I221 T222 L226 L227 S228 L238	I221-K224 VanDerWaalsContact O-CG 3.25Å; I221-K224 WeakPolarHBondContact O-CG 3.3Å; T222-K224 PolarHBondContact O-N 3.09Å; K224-L226 VanDerWaalsContact C-N 3.31Å; K224-L226 PolarHBondContact O-N 2.89Å; K224-L227 PolarHBondContact O-N 3.39Å; K224-S228 WeakPolarHBondContact O-CB 3.23Å; K224-S228 PolarHBondContact O-N 3.43Å; K224-S228 PolarHBondContact O-OG 2.98Å; K224-L238 HydrophobicContact CB-CD2 3.91Å; K224-L238 HydrophobicContact CD-CD2 4.37Å; K224-L238 WeakPolarHBondContact CE-O 3.47Å; K224-L238 HydrophobicContact CG-CD2 4.05Å; K224-L238 PolarHBondContact NZ-O 3.27Å
225	D	88.8	Confident	91.1	Very high	95 Å²	95	51.9 Å²	51.9	51%	0.508	26%	0.262	S	S	.	.	H	α-helix	trans	-61.4	-32.4	176.1	64.9	-55.2	0	0	0	114	R223	R223-D225 VanDerWaalsContact CA-OD1 3.23Å; R223-D225 WeakPolarHBondContact CA-OD1 3.28Å; R223-D225 IonicContact CZ-OD1 2.69Å; R223-D225 IonicContact CZ-OD2 2.72Å; R223-D225 IonicContact NE-OD1 3.15Å; R223-D225 PolarHBondContact NE-OD1 2.87Å; R223-D225 IonicContact NE-OD2 2.89Å; R223-D225 PolarHBondContact NE-OD2 3.45Å; R223-D225 IonicContact NH2-OD1 3.35Å; R223-D225 IonicContact NH2-OD2 3.96Å; R223-D225 PolarHBondContact NH2-OD2 2.69Å; R223-D225 PolarHBondContact O-N 3.33Å; R223-D225 VanDerWaalsContact O-N 3.09Å
226	L	88.6	Confident	91	Very high	57 Å²	57	50.6 Å²	50.6	30%	0.298	26%	0.255	S	S	.	.	H	α-helix	trans	-94.6	-22.5	174.8	-56.1	-179.8	0	0	0	112.1	L172 L176 R223 K224 D229 F230	L172-L226 HydrophobicContact CD1-CD1 4.24Å; L172-L226 HydrophobicContact CD2-CB 3.66Å; L172-L226 HydrophobicContact CD2-CD1 4.29Å; L176-L226 HydrophobicContact CD2-CD1 4.17Å; R223-L226 HydrophobicContact CB-CB 4.42Å; R223-L226 HydrophobicContact CB-CD1 4.29Å; R223-L226 HydrophobicContact CB-CG 4.4Å; R223-L226 PolarHBondContact O-N 3.43Å; K224-L226 VanDerWaalsContact C-N 3.31Å; K224-L226 PolarHBondContact O-N 2.89Å; L226-D229 WeakPolarHBondContact O-CB 3.41Å; L226-F230 WeakPolarHBondContact O-CD2 3.35Å
227	L	89.3	Confident	90.9	Very high	1 Å²	1	50.8 Å²	50.8	1%	0.005	26%	0.255	C	S	.	.	H	α-helix	trans	-82.7	-32.8	-174.9	-161.5	62.5	0	0	0	112.6	P169 L220 I221 R223 K224 D229 F230 Y231 M237 L238	P169-L227 HydrophobicContact CB-CD1 4.26Å; L220-L227 HydrophobicContact CB-CD1 4.36Å; L220-L227 HydrophobicContact CB-CD2 4.48Å; I221-L227 HydrophobicContact CG2-CD2 4.45Å; R223-L227 WeakPolarHBondContact O-CB 3.48Å; R223-L227 PolarHBondContact O-N 3.44Å; K224-L227 PolarHBondContact O-N 3.39Å; L227-D229 PolarHBondContact O-N 2.94Å; L227-D229 VanDerWaalsContact O-N 3.16Å; L227-F230 PolarHBondContact O-N 2.94Å; L227-Y231 HydrophobicContact CD1-CD2 3.75Å; L227-Y231 HydrophobicContact CD1-CE2 3.54Å; L227-Y231 HydrophobicContact CG-CD2 3.74Å; L227-Y231 HydrophobicContact CG-CE2 3.99Å; L227-Y231 WeakPolarHBondContact O-CD2 3.28Å; L227-Y231 PolarHBondContact O-N 3.15Å; L227-M237 HydrophobicContact CD2-CB 4.19Å; L227-M237 WeakPolarHBondContact CD2-O 3.49Å; L227-L238 HydrophobicContact CB-CD2 3.94Å; L227-L238 HydrophobicContact CD2-CD2 4.11Å; L227-L238 HydrophobicContact CG-CD2 4.16Å
228	S	89.6	Confident	90.9	Very high	37 Å²	37	51.4 Å²	51.4	26%	0.259	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-17.7	172.3	58.3	0	0	0	0	114.1	R154 K224 F230 Y231	R154-S228 PolarHBondContact NH1-O 2.76Å; K224-S228 WeakPolarHBondContact O-CB 3.23Å; K224-S228 PolarHBondContact O-N 3.43Å; K224-S228 PolarHBondContact O-OG 2.98Å; S228-F230 PolarHBondContact O-N 3.43Å; S228-Y231 VanDerWaalsContact O-O 3.06Å
229	D	87.8	Confident	90.8	Very high	103 Å²	103	49.5 Å²	49.5	55%	0.551	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-19.9	171.8	-146.3	52.6	0	0	0	112.1	K164 L226 L227	K164-D229 PolarHBondContact NZ-O 2.85Å; K164-D229 IonicContact NZ-OD2 3.72Å; K164-D229 PolarHBondContact NZ-OD2 3.47Å; L226-D229 WeakPolarHBondContact O-CB 3.41Å; L227-D229 PolarHBondContact O-N 2.94Å; L227-D229 VanDerWaalsContact O-N 3.16Å
230	F	88.6	Confident	90.8	Very high	28 Å²	28	53.2 Å²	53.2	12%	0.123	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.3	-31.1	-179.5	-59.5	-96.4	0	0	0	113.4	L153 R154 K164 P169 L226 L227 S228	L153-F230 HydrophobicContact CD1-CB 4.21Å; R154-F230 WeakPolarHBondContact CB-O 3.37Å; R154-F230 WeakPolarHBondContact CG-O 3.4Å; R154-F230 PolarHBondContact N-O 2.86Å; K164-F230 HydrophobicContact CB-CD1 4.4Å; K164-F230 HydrophobicContact CD-CD1 3.56Å; K164-F230 HydrophobicContact CD-CE1 3.86Å; K164-F230 HydrophobicContact CD-CG 4.24Å; K164-F230 HydrophobicContact CG-CD1 4.13Å; K164-F230 HydrophobicContact CG-CE1 4.3Å; P169-F230 HydrophobicContact CG-CB 3.84Å; P169-F230 HydrophobicContact CG-CD1 3.96Å; P169-F230 HydrophobicContact CG-CG 3.94Å; L226-F230 WeakPolarHBondContact O-CD2 3.35Å; L227-F230 PolarHBondContact O-N 2.94Å; S228-F230 PolarHBondContact O-N 3.43Å
231	Y	91.3	Very high	90.9	Very high	3 Å²	3	54.6 Å²	54.6	1%	0.012	28%	0.277	C	S	.	.	B	Isolated β-bridge	trans	-113.7	149.4	-175.9	-66.8	-93.1	0	0	0	112.8	L149 G152 L153 R154 P169 L227 S228 A235 M237	L149-Y231 WeakPolarHBondContact O-CE1 3.4Å; L149-Y231 PolarHBondContact O-OH 2.94Å; G152-Y231 CarbonylContact O-C 3.6Å; G152-Y231 WeakPolarHBondContact O-CA 3.28Å; L153-Y231 HydrophobicContact CB-CD1 4.36Å; L153-Y231 HydrophobicContact CB-CE1 4.27Å; L153-Y231 HydrophobicContact CD1-CD1 4.09Å; L153-Y231 HydrophobicContact CD1-CD2 4.31Å; L153-Y231 HydrophobicContact CD1-CE1 3.79Å; L153-Y231 HydrophobicContact CD1-CE2 4.03Å; L153-Y231 HydrophobicContact CD1-CG 4.36Å; R154-Y231 WeakPolarHBondContact CD-O 3.26Å; P169-Y231 HydrophobicContact CB-CE2 3.91Å; P169-Y231 HydrophobicContact CG-CE2 3.58Å; L227-Y231 HydrophobicContact CD1-CD2 3.75Å; L227-Y231 HydrophobicContact CD1-CE2 3.54Å; L227-Y231 HydrophobicContact CG-CD2 3.74Å; L227-Y231 HydrophobicContact CG-CE2 3.99Å; L227-Y231 WeakPolarHBondContact O-CD2 3.28Å; L227-Y231 PolarHBondContact O-N 3.15Å; S228-Y231 VanDerWaalsContact O-O 3.06Å; Y231-A235 HydrophobicContact CD1-CB 3.88Å; Y231-A235 HydrophobicContact CG-CB 4.23Å; Y231-M237 HydrophobicContact CD1-CB 4.5Å; Y231-M237 HydrophobicContact CE1-CB 4.2Å; Y231-M237 HydrophobicContact CE1-CG 4.18Å; Y231-M237 HydrophobicContact CE2-CB 4.42Å
232	E	90.2	Very high	90.9	Very high	85 Å²	85	53.5 Å²	53.5	40%	0.397	27%	0.271	S	S	.	.			trans	-71.2	148.9	169.5	-61.4	-177.3	173.8	0	0	109.9	M102 G152 R154 S234 A235	M102-E232 WeakPolarHBondContact CE-OE2 3.39Å; G152-E232 PolarHBondContact O-N 3.25Å; R154-E232 HydrophobicContact CG-CG 3.55Å; E232-S234 PolarHBondContact O-N 3.47Å; E232-A235 WeakPolarHBondContact O-CB 3.29Å; E232-A235 PolarHBondContact O-N 2.8Å
233	D	87.8	Confident	91	Very high	121 Å²	121	51.2 Å²	51.2	65%	0.647	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-32	-163.4	-53.3	-45.4	0	0	0	113.3	A235	D233-A235 VanDerWaalsContact C-N 3.34Å; D233-A235 PolarHBondContact O-N 2.8Å
234	S	89.1	Confident	91.2	Very high	35 Å²	35	50 Å²	50	25%	0.245	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.4	19.1	176.9	58.4	0	0	0	0	114.7	M102 R106 E232	M102-S234 WeakPolarHBondContact CE-OG 3.43Å; M102-S234 PolarHBondContact SD-OG 3.29Å; R106-S234 WeakPolarHBondContact CD-O 3.39Å; R106-S234 PolarHBondContact NH1-O 2.89Å; E232-S234 PolarHBondContact O-N 3.47Å
235	A	92.6	Very high	91.4	Very high	0 Å²	0	45 Å²	45	0%	0	24%	0.243	C	C	.	.			trans	-76	147	179.2	0	0	0	0	0	112.9	H151 Y231 E232 D233 M237 L238 E239	H151-A235 WeakPolarHBondContact O-CB 3.15Å; Y231-A235 HydrophobicContact CD1-CB 3.88Å; Y231-A235 HydrophobicContact CG-CB 4.23Å; E232-A235 WeakPolarHBondContact O-CB 3.29Å; E232-A235 PolarHBondContact O-N 2.8Å; D233-A235 VanDerWaalsContact C-N 3.34Å; D233-A235 PolarHBondContact O-N 2.8Å; A235-M237 PolarHBondContact O-N 3.34Å; A235-L238 PolarHBondContact O-N 2.99Å; A235-E239 WeakPolarHBondContact O-CG 3.05Å; A235-E239 PolarHBondContact O-N 2.69Å; A235-E239 VanDerWaalsContact O-N 3.09Å
236	L	93.7	Very high	91.7	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-47.7	-39.9	178	-179.8	152.1	0	0	0	113.9	R106 L109 C148 H151 L238 G242 I245	R106-L236 HydrophobicContact CG-CB 4.14Å; L109-L236 HydrophobicContact CB-CD1 3.55Å; L109-L236 HydrophobicContact CD1-CD1 3.94Å; L109-L236 HydrophobicContact CG-CD1 4.41Å; C148-L236 HydrophobicContact CB-CD1 4.18Å; C148-L236 HydrophobicContact CB-CD2 4.01Å; H151-L236 HydrophobicContact CB-CB 4.08Å; H151-L236 PolarHBondContact ND1-N 2.81Å; L236-L238 VanDerWaalsContact C-N 3.33Å; L236-L238 PolarHBondContact O-N 3.44Å; L236-G242 WeakPolarHBondContact O-CA 3.37Å; L236-G242 PolarHBondContact O-N 3.02Å; L236-I245 HydrophobicContact CD1-CD1 3.87Å; L236-I245 HydrophobicContact CD2-CD1 3.77Å; L236-I245 HydrophobicContact CG-CD1 4.12Å
237	M	93	Very high	91.9	Very high	4 Å²	4	40 Å²	40	2%	0.02	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-8.9	-178.6	-67.2	-60.3	-67.5	0	0	114.7	L149 I221 L227 Y231 A235	L149-M237 HydrophobicContact CD2-CE 3.6Å; L149-M237 HydrophobicContact CD2-CG 4.07Å; L149-M237 HydrophobicContact CD2-SD 3.67Å; I221-M237 HydrophobicContact CG2-CE 3.57Å; I221-M237 WeakPolarHBondContact CG2-O 3.44Å; L227-M237 HydrophobicContact CD2-CB 4.19Å; L227-M237 WeakPolarHBondContact CD2-O 3.49Å; Y231-M237 HydrophobicContact CD1-CB 4.5Å; Y231-M237 HydrophobicContact CE1-CB 4.2Å; Y231-M237 HydrophobicContact CE1-CG 4.18Å; Y231-M237 HydrophobicContact CE2-CB 4.42Å; A235-M237 PolarHBondContact O-N 3.34Å
238	L	93	Very high	92.1	Very high	13 Å²	13	42.7 Å²	42.7	7%	0.068	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.9	-18.6	172	-72	174.8	0	0	0	112.7	K224 L227 A235 L236	K224-L238 HydrophobicContact CB-CD2 3.91Å; K224-L238 HydrophobicContact CD-CD2 4.37Å; K224-L238 WeakPolarHBondContact CE-O 3.47Å; K224-L238 HydrophobicContact CG-CD2 4.05Å; K224-L238 PolarHBondContact NZ-O 3.27Å; L227-L238 HydrophobicContact CB-CD2 3.94Å; L227-L238 HydrophobicContact CD2-CD2 4.11Å; L227-L238 HydrophobicContact CG-CD2 4.16Å; A235-L238 PolarHBondContact O-N 2.99Å; L236-L238 VanDerWaalsContact C-N 3.33Å; L236-L238 PolarHBondContact O-N 3.44Å
239	E	93.8	Very high	92.4	Very high	68 Å²	68	41 Å²	41	32%	0.318	23%	0.23	S	C	.	.	S	Bend	trans	-96.5	177.2	-176.3	-65.4	-77.1	-153.2	0	0	113.1	A235 E241 G242	A235-E239 WeakPolarHBondContact O-CG 3.05Å; A235-E239 PolarHBondContact O-N 2.69Å; A235-E239 VanDerWaalsContact O-N 3.09Å; E239-E241 VanDerWaalsContact C-N 3.28Å; E239-E241 WeakPolarHBondContact CB-OE2 3.36Å; E239-E241 PolarHBondContact O-N 2.95Å; E239-G242 PolarHBondContact O-N 3.35Å
240	E	92.4	Very high	92.7	Very high	141 Å²	141	39.3 Å²	39.3	66%	0.659	22%	0.223	S	C	*	.	H	α-helix	trans	-63.6	-30.9	-176.8	-63.6	-166.8	161.3	0	0	113	G242 A243 V244	E240-G242 VanDerWaalsContact C-N 3.31Å; E240-G242 PolarHBondContact O-N 3.26Å; E240-A243 WeakPolarHBondContact O-CB 3.4Å; E240-A243 PolarHBondContact O-N 3.04Å; E240-A243 VanDerWaalsContact O-N 3.14Å; E240-V244 PolarHBondContact O-N 3.42Å
241	E	94.1	Very high	92.8	Very high	30 Å²	30	39.4 Å²	39.4	14%	0.14	23%	0.232	C	C	.	.	H	α-helix	trans	-61.2	-38.7	180	-58.6	94.1	148.9	0	0	112	R106 L110 E239 V244 I245	R106-E241 HydrophobicContact CB-CG 4.13Å; R106-E241 WeakPolarHBondContact CB-OE1 3.37Å; R106-E241 WeakPolarHBondContact CD-OE2 3.46Å; R106-E241 IonicContact CZ-OE1 2.73Å; R106-E241 VanDerWaalsContact NE-CD 3.27Å; R106-E241 IonicContact NE-OE1 3.61Å; R106-E241 PolarHBondContact NE-OE1 2.62Å; R106-E241 IonicContact NE-OE2 3.62Å; R106-E241 PolarHBondContact NE-OE2 3.47Å; R106-E241 VanDerWaalsContact NE-OE2 3.13Å; R106-E241 IonicContact NH2-OE1 2.6Å; L110-E241 HydrophobicContact CB-CB 4.16Å; L110-E241 HydrophobicContact CB-CG 4.31Å; L110-E241 HydrophobicContact CD1-CB 4.4Å; L110-E241 HydrophobicContact CD2-CB 4.04Å; L110-E241 HydrophobicContact CD2-CG 3.79Å; L110-E241 HydrophobicContact CG-CB 4.42Å; E239-E241 VanDerWaalsContact C-N 3.28Å; E239-E241 WeakPolarHBondContact CB-OE2 3.36Å; E239-E241 PolarHBondContact O-N 2.95Å; E241-V244 PolarHBondContact O-N 2.88Å; E241-I245 WeakPolarHBondContact O-CG1 3.47Å; E241-I245 PolarHBondContact O-N 2.85Å
242	G	92.6	Very high	92.9	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-65.5	-37	175.4	0	0	0	0	0	112.9	L236 E239 E240 I245 V246	L236-G242 WeakPolarHBondContact O-CA 3.37Å; L236-G242 PolarHBondContact O-N 3.02Å; E239-G242 PolarHBondContact O-N 3.35Å; E240-G242 VanDerWaalsContact C-N 3.31Å; E240-G242 PolarHBondContact O-N 3.26Å; G242-I245 PolarHBondContact O-N 3.09Å; G242-V246 WeakPolarHBondContact O-CB 3.23Å; G242-V246 WeakPolarHBondContact O-CG2 3.33Å; G242-V246 PolarHBondContact O-N 3.06Å
243	A	93.5	Very high	92.9	Very high	53 Å²	53	38 Å²	38	44%	0.438	23%	0.228	S	C	.	.	H	α-helix	trans	-65.7	-39.8	174.2	0	0	0	0	0	112.1	I221 E240 V246 G247	I221-A243 HydrophobicContact CD1-CB 4.02Å; E240-A243 WeakPolarHBondContact O-CB 3.4Å; E240-A243 PolarHBondContact O-N 3.04Å; E240-A243 VanDerWaalsContact O-N 3.14Å; A243-V246 PolarHBondContact O-N 2.97Å; A243-G247 PolarHBondContact O-N 2.8Å
244	V	94.7	Very high	93	Very high	68 Å²	68	36.7 Å²	36.7	41%	0.412	22%	0.223	S	C	.	.	H	α-helix	trans	-64.8	-43.8	174	177.2	0	0	0	0	111.2	L110 E240 E241 G247 L248	L110-V244 HydrophobicContact CD1-CB 4.04Å; L110-V244 HydrophobicContact CD1-CG1 3.86Å; E240-V244 PolarHBondContact O-N 3.42Å; E241-V244 PolarHBondContact O-N 2.88Å; V244-G247 PolarHBondContact O-N 2.93Å; V244-L248 HydrophobicContact CG1-CD1 4.1Å; V244-L248 WeakPolarHBondContact O-CG 3.48Å; V244-L248 PolarHBondContact O-N 3.1Å
245	I	95.4	Very high	93	Very high	2 Å²	2	35.4 Å²	35.4	1%	0.01	21%	0.214	C	C	.	.	H	α-helix	trans	-59.4	-49.4	176.2	-70.5	161.6	0	0	0	110.6	L110 A113 I117 M145 L236 E241 G242 G247 L248 L249	L110-I245 HydrophobicContact CD1-CD1 4.17Å; L110-I245 HydrophobicContact CD1-CG1 3.68Å; A113-I245 HydrophobicContact CB-CD1 3.97Å; A113-I245 HydrophobicContact CB-CG1 3.8Å; A113-I245 HydrophobicContact CB-CG2 4.38Å; I117-I245 HydrophobicContact CD1-CG2 4.43Å; M145-I245 HydrophobicContact CE-CG2 4.42Å; M145-I245 HydrophobicContact SD-CG2 4.19Å; L236-I245 HydrophobicContact CD1-CD1 3.87Å; L236-I245 HydrophobicContact CD2-CD1 3.77Å; L236-I245 HydrophobicContact CG-CD1 4.12Å; E241-I245 WeakPolarHBondContact O-CG1 3.47Å; E241-I245 PolarHBondContact O-N 2.85Å; G242-I245 PolarHBondContact O-N 3.09Å; I245-G247 VanDerWaalsContact C-N 3.28Å; I245-G247 PolarHBondContact O-N 2.97Å; I245-L248 WeakPolarHBondContact O-CB 3.4Å; I245-L248 PolarHBondContact O-N 3.43Å; I245-L249 HydrophobicContact CG2-CD1 4.43Å; I245-L249 HydrophobicContact CG2-CG 4.44Å; I245-L249 WeakPolarHBondContact O-CG 3.3Å; I245-L249 PolarHBondContact O-N 3.26Å
246	V	95.4	Very high	92.8	Very high	4 Å²	4	39 Å²	39	2%	0.024	23%	0.233	C	C	.	.	H	α-helix	trans	-61.2	-36	178.6	168.1	0	0	0	0	112.4	L217 R218 I221 G242 A243 L249	L217-V246 HydrophobicContact CB-CG2 3.76Å; R218-V246 HydrophobicContact CB-CG1 3.65Å; R218-V246 HydrophobicContact CG-CG1 4.26Å; I221-V246 HydrophobicContact CD1-CB 3.85Å; I221-V246 HydrophobicContact CD1-CG1 4Å; I221-V246 HydrophobicContact CD1-CG2 3.94Å; I221-V246 HydrophobicContact CG2-CG2 4.45Å; G242-V246 WeakPolarHBondContact O-CB 3.23Å; G242-V246 WeakPolarHBondContact O-CG2 3.33Å; G242-V246 PolarHBondContact O-N 3.06Å; A243-V246 PolarHBondContact O-N 2.97Å; V246-L249 PolarHBondContact O-N 3.13Å
247	G	93.2	Very high	92.6	Very high	45 Å²	45	39.6 Å²	39.6	46%	0.464	24%	0.238	S	C	.	.	H	α-helix	trans	-62.1	-42.5	171.4	0	0	0	0	0	113	A243 V244 I245 V250	A243-G247 PolarHBondContact O-N 2.8Å; V244-G247 PolarHBondContact O-N 2.93Å; I245-G247 VanDerWaalsContact C-N 3.28Å; I245-G247 PolarHBondContact O-N 2.97Å; G247-V250 WeakPolarHBondContact O-CB 3.25Å; G247-V250 WeakPolarHBondContact O-CG2 3.41Å; G247-V250 PolarHBondContact O-N 3.18Å
248	L	93.4	Very high	92.4	Very high	56 Å²	56	45 Å²	45	29%	0.293	27%	0.267	S	S	.	.	H	α-helix	trans	-67.3	-34.7	177.5	-67.3	164.9	0	0	0	112.7	K114 I117 V244 I245 V250 G251	K114-L248 HydrophobicContact CB-CD1 4.49Å; K114-L248 HydrophobicContact CG-CD1 3.53Å; I117-L248 HydrophobicContact CD1-CB 3.94Å; I117-L248 HydrophobicContact CG2-CB 4.28Å; V244-L248 HydrophobicContact CG1-CD1 4.1Å; V244-L248 WeakPolarHBondContact O-CG 3.48Å; V244-L248 PolarHBondContact O-N 3.1Å; I245-L248 WeakPolarHBondContact O-CB 3.4Å; I245-L248 PolarHBondContact O-N 3.43Å; L248-V250 PolarHBondContact O-N 3.33Å; L248-V250 VanDerWaalsContact O-N 3.15Å; L248-G251 PolarHBondContact O-N 2.98Å
249	L	95.8	Very high	92.1	Very high	1 Å²	1	44.7 Å²	44.7	1%	0.005	27%	0.266	C	S	.	.	H	α-helix	trans	-59.8	-23.5	177.9	-68.4	176.3	0	0	0	113.4	I117 F141 M145 A214 L217 I245 V246 G251 L252	I117-L249 HydrophobicContact CD1-CD2 3.62Å; I117-L249 HydrophobicContact CD1-CG 4.13Å; I117-L249 HydrophobicContact CG1-CD2 4.04Å; F141-L249 HydrophobicContact CE2-CD2 3.59Å; F141-L249 HydrophobicContact CZ-CD2 3.74Å; M145-L249 HydrophobicContact CE-CD1 3.85Å; M145-L249 HydrophobicContact CE-CD2 4.4Å; M145-L249 HydrophobicContact SD-CD1 4.37Å; M145-L249 HydrophobicContact SD-CD2 3.92Å; A214-L249 HydrophobicContact CB-CB 3.68Å; L217-L249 HydrophobicContact CD1-CD1 3.65Å; I245-L249 HydrophobicContact CG2-CD1 4.43Å; I245-L249 HydrophobicContact CG2-CG 4.44Å; I245-L249 WeakPolarHBondContact O-CG 3.3Å; I245-L249 PolarHBondContact O-N 3.26Å; V246-L249 PolarHBondContact O-N 3.13Å; L249-G251 PolarHBondContact O-N 3.43Å; L249-L252 HydrophobicContact CB-CD1 4.44Å; L249-L252 HydrophobicContact CD2-CD1 3.46Å; L249-L252 VanDerWaalsContact CD2-CD1 3.46Å; L249-L252 VanDerWaalsContact O-CB 3.29Å; L249-L252 WeakPolarHBondContact O-CB 3.38Å; L249-L252 PolarHBondContact O-N 3.39Å
250	V	93.6	Very high	91.4	Very high	69 Å²	69	45.3 Å²	45.3	42%	0.418	28%	0.276	S	S	.	.	G	3₁₀ helix	trans	-59	-30.1	175.4	-178.5	0	0	0	0	111.3	A214 G247 L248 L252 N253	A214-V250 HydrophobicContact CB-CB 4.45Å; A214-V250 HydrophobicContact CB-CG2 3.85Å; G247-V250 WeakPolarHBondContact O-CB 3.25Å; G247-V250 WeakPolarHBondContact O-CG2 3.41Å; G247-V250 PolarHBondContact O-N 3.18Å; L248-V250 PolarHBondContact O-N 3.33Å; L248-V250 VanDerWaalsContact O-N 3.15Å; V250-L252 PolarHBondContact O-N 3.34Å; V250-N253 WeakPolarHBondContact O-CB 3.48Å; V250-N253 PolarHBondContact O-N 3.29Å
251	G	90.4	Very high	90.7	Very high	29 Å²	29	39.3 Å²	39.3	30%	0.299	25%	0.249	S	C	.	.	G	3₁₀ helix	trans	-63.6	-21.1	174.7	0	0	0	0	0	114.2	L248 L249 N253 V254	L248-G251 PolarHBondContact O-N 2.98Å; L249-G251 PolarHBondContact O-N 3.43Å; G251-N253 VanDerWaalsContact C-N 3.25Å; G251-N253 PolarHBondContact O-N 2.94Å; G251-V254 WeakPolarHBondContact O-CG2 3.41Å
252	L	92.9	Very high	89.6	Confident	3 Å²	3	45.9 Å²	45.9	2%	0.016	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-73.9	-14.6	177.4	-58	174.3	0	0	0	113	I117 L120 I121 F141 L208 L249 V250 V254 I255	I117-L252 HydrophobicContact CG2-CD2 4.2Å; I117-L252 HydrophobicContact CG2-CG 4.4Å; L120-L252 HydrophobicContact CD2-CD2 3.81Å; L120-L252 HydrophobicContact CG-CD2 4.23Å; I121-L252 HydrophobicContact CD1-CD2 4.17Å; I121-L252 HydrophobicContact CG1-CD2 3.8Å; F141-L252 HydrophobicContact CD2-CD1 4.42Å; F141-L252 HydrophobicContact CE1-CD1 4.07Å; F141-L252 HydrophobicContact CE2-CD1 3.54Å; F141-L252 HydrophobicContact CZ-CD1 3.31Å; L208-L252 HydrophobicContact CD1-CB 4.03Å; L208-L252 HydrophobicContact CD1-CD1 4.11Å; L249-L252 HydrophobicContact CB-CD1 4.44Å; L249-L252 HydrophobicContact CD2-CD1 3.46Å; L249-L252 VanDerWaalsContact CD2-CD1 3.46Å; L249-L252 VanDerWaalsContact O-CB 3.29Å; L249-L252 WeakPolarHBondContact O-CB 3.38Å; L249-L252 PolarHBondContact O-N 3.39Å; V250-L252 PolarHBondContact O-N 3.34Å; L252-V254 PolarHBondContact O-N 2.93Å; L252-V254 VanDerWaalsContact O-N 3.08Å; L252-I255 HydrophobicContact CB-CD1 4.46Å; L252-I255 HydrophobicContact CD2-CD1 3.63Å; L252-I255 VanDerWaalsContact O-CB 3.3Å; L252-I255 WeakPolarHBondContact O-CB 3.34Å; L252-I255 PolarHBondContact O-N 2.89Å
253	N	91.4	Very high	88.3	Confident	57 Å²	57	49.7 Å²	49.7	31%	0.305	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	-65.7	-12.6	-179.8	-67.7	1.9	0	0	0	113.2	K211 V250 G251	K211-N253 PolarHBondContact O-OD1 3.33Å; V250-N253 WeakPolarHBondContact O-CB 3.48Å; V250-N253 PolarHBondContact O-N 3.29Å; G251-N253 VanDerWaalsContact C-N 3.25Å; G251-N253 PolarHBondContact O-N 2.94Å
254	V	89.1	Confident	87.2	Confident	92 Å²	92	49.7 Å²	49.7	56%	0.558	31%	0.308	S	S	*	.	G	3₁₀ helix	trans	-80.9	-16.2	171.7	-48.8	0	0	0	0	113.2	L125 G251 L252	L125-V254 HydrophobicContact CD2-CG2 4.06Å; L125-V254 HydrophobicContact CG-CG2 4.44Å; G251-V254 WeakPolarHBondContact O-CG2 3.41Å; L252-V254 PolarHBondContact O-N 2.93Å; L252-V254 VanDerWaalsContact O-N 3.08Å
255	I	89.4	Confident	86.5	Confident	9 Å²	9	51 Å²	51	5%	0.046	31%	0.312	C	S	.	.			trans	-77.7	146.4	-177.3	-58.8	-176.9	0	0	0	109.3	L120 I121 A124 L131 K211 L252	L120-I255 HydrophobicContact CD1-CD1 4.21Å; L120-I255 HydrophobicContact CD2-CD1 4.14Å; L120-I255 HydrophobicContact CG-CD1 3.7Å; I121-I255 HydrophobicContact CG1-CD1 4.23Å; A124-I255 HydrophobicContact CB-CD1 4.14Å; A124-I255 HydrophobicContact CB-CG1 4.18Å; A124-I255 HydrophobicContact CB-CG2 4.39Å; L131-I255 HydrophobicContact CD1-CG2 3.51Å; L131-I255 HydrophobicContact CG-CG2 4.07Å; K211-I255 VanDerWaalsContact CE-O 3.26Å; K211-I255 WeakPolarHBondContact CE-O 3.49Å; K211-I255 PolarHBondContact NZ-O 3.31Å; L252-I255 HydrophobicContact CB-CD1 4.46Å; L252-I255 HydrophobicContact CD2-CD1 3.63Å; L252-I255 VanDerWaalsContact O-CB 3.3Å; L252-I255 WeakPolarHBondContact O-CB 3.34Å; L252-I255 PolarHBondContact O-N 2.89Å
256	D	87.6	Confident	85.9	Confident	75 Å²	75	51 Å²	51	40%	0.401	31%	0.312	S	S	.	.			trans	-113.9	127.9	170.4	-157.8	61.6	0	0	0	108.6	T130 L131 K211	T130-D256 CarbonylContact C-O 3.36Å; T130-D256 WeakPolarHBondContact CA-O 3.23Å; T130-D256 WeakPolarHBondContact CB-OD2 3.18Å; T130-D256 HydrophobicContact CG2-CB 4.49Å; T130-D256 VanDerWaalsContact CG2-OD2 3.29Å; T130-D256 WeakPolarHBondContact CG2-OD2 3.33Å; T130-D256 PolarHBondContact OG1-OD2 3.48Å; L131-D256 PolarHBondContact N-O 3.24Å; K211-D256 IonicContact NZ-OD1 3.72Å; K211-D256 PolarHBondContact NZ-OD1 2.99Å
257	A	89.5	Confident	85.3	Confident	13 Å²	13	52.2 Å²	52.2	11%	0.107	32%	0.319	C	S	.	.	B	Isolated β-bridge	trans	-145.4	139.1	-172.7	0	0	0	0	0	110.7	L131 L259	L131-A257 HydrophobicContact CB-CB 4.27Å; L131-A257 CarbonylContact O-C 3.58Å; L131-A257 WeakPolarHBondContact O-CA 3.31Å; A257-L259 HydrophobicContact CB-CD2 4.22Å; A257-L259 HydrophobicContact CB-CG 4.27Å
258	N	88.5	Confident	84.6	Confident	117 Å²	117	53.8 Å²	53.8	63%	0.626	32%	0.322	S	S	*	.			trans	-134.5	90.3	-179.4	-176.6	29	0	0	0	109.5	T130 L131	T130-N258 HydrophobicContact CG2-CB 3.75Å; L131-N258 PolarHBondContact O-N 3.1Å
259	L	87.4	Confident	83.5	Confident	7 Å²	7	54.1 Å²	54.1	4%	0.037	32%	0.323	C	S	.	.			trans	-103.3	131.5	-163.2	-49.4	179.6	0	0	0	111.2	D132 L138 F142 R205 M209 A257 V261	D132-L259 VanDerWaalsContact C-CD2 3.49Å; L138-L259 HydrophobicContact CD2-CD1 4.17Å; L138-L259 HydrophobicContact CD2-CD2 3.64Å; F142-L259 HydrophobicContact CE2-CD1 3.75Å; F142-L259 HydrophobicContact CZ-CD1 3.77Å; R205-L259 HydrophobicContact CB-CB 4.44Å; R205-L259 HydrophobicContact CB-CD1 3.92Å; R205-L259 HydrophobicContact CG-CD1 3.93Å; M209-L259 HydrophobicContact CG-CB 4.41Å; M209-L259 HydrophobicContact CG-CD1 4.34Å; M209-L259 HydrophobicContact CG-CG 4.1Å; M209-L259 HydrophobicContact SD-CB 3.74Å; M209-L259 HydrophobicContact SD-CG 4.1Å; M209-L259 PolarHBondContact SD-N 3.42Å; M209-L259 VanDerWaalsContact SD-N 3.41Å; A257-L259 HydrophobicContact CB-CD2 4.22Å; A257-L259 HydrophobicContact CB-CG 4.27Å; L259-V261 VanDerWaalsContact C-N 3.34Å; L259-V261 PolarHBondContact O-N 2.95Å
260	C	78.7	Confident	82.1	Confident	81 Å²	81	60.1 Å²	60.1	55%	0.547	36%	0.359	S	S	.	.			trans	-86.3	70.1	-169.8	-160.7	0	0	0	0	112.9	S133 K262 E264	S133-C260 PolarHBondContact OG-N 3.39Å; S133-C260 VanDerWaalsContact OG-N 3.13Å; C260-K262 PolarHBondContact O-N 2.87Å; C260-E264 VanDerWaalsContact O-OE1 3.1Å
261	V	78.5	Confident	80.7	Confident	15 Å²	15	58 Å²	58	9%	0.091	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-19.1	-179.4	-154.8	0	0	0	0	113.1	L190 A202 R205 L206 L259 G263 L266	L190-V261 HydrophobicContact CD2-CG1 3.8Å; A202-V261 HydrophobicContact CB-CG1 3.55Å; R205-V261 HydrophobicContact CB-CG2 4.36Å; L206-V261 HydrophobicContact CD2-CG2 3.83Å; L206-V261 HydrophobicContact CG-CG2 4.3Å; L259-V261 VanDerWaalsContact C-N 3.34Å; L259-V261 PolarHBondContact O-N 2.95Å; V261-G263 PolarHBondContact O-N 2.95Å; V261-L266 HydrophobicContact CG1-CD1 3.84Å
262	K	71.3	Confident	79.8	Confident	167 Å²	167	62.4 Å²	62.4	73%	0.726	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.9	94.8	176.2	-71.3	-180	179.4	177.1	0	111.6	L190 C260	L190-K262 HydrophobicContact CD1-CG 3.91Å; C260-K262 PolarHBondContact O-N 2.87Å
263	G	63.9	Low	79.1	Confident	80 Å²	80	63.8 Å²	63.8	83%	0.825	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	123.8	-15.3	170.7	0	0	0	0	0	114.9	V261	V261-G263 PolarHBondContact O-N 2.95Å
264	E	71.2	Confident	78.3	Confident	53 Å²	53	64.4 Å²	64.4	25%	0.248	38%	0.383	C	S	.	.			trans	-66.9	135.2	168.2	-74.2	173.8	-134.6	0	0	111.2	S133 R205 C260 L266	S133-E264 WeakPolarHBondContact CB-OE1 3.13Å; S133-E264 PolarHBondContact OG-OE1 3.44Å; R205-E264 IonicContact CZ-OE2 2.97Å; R205-E264 IonicContact NE-OE2 2.68Å; R205-E264 PolarHBondContact NE-OE2 3Å; R205-E264 IonicContact NH2-OE2 2.85Å; R205-E264 PolarHBondContact NH2-OE2 2.82Å; C260-E264 VanDerWaalsContact O-OE1 3.1Å; E264-L266 VanDerWaalsContact C-N 3.26Å; E264-L266 HydrophobicContact CB-CD2 3.8Å; E264-L266 HydrophobicContact CB-CG 3.97Å; E264-L266 PolarHBondContact O-N 2.95Å; E264-L266 WeakPolarHBondContact OE2-CD2 3.45Å
265	D	79.5	Confident	77.5	Confident	96 Å²	96	65 Å²	65	51%	0.513	38%	0.378	S	S	.	.			trans	-78.2	79.2	168	-172.8	-5.1	0	0	0	110.7	D267 S268 Q269	D265-D267 PolarHBondContact O-N 2.95Å; D265-D267 PolarHBondContact OD1-N 2.77Å; D265-D267 VanDerWaalsContact OD1-N 3.11Å; D265-S268 VanDerWaalsContact CG-OG 3.28Å; D265-S268 PolarHBondContact OD1-N 2.87Å; D265-S268 PolarHBondContact OD1-OG 2.85Å; D265-S268 WeakPolarHBondContact OD2-CB 3.35Å; D265-S268 PolarHBondContact OD2-OG 3.21Å; D265-Q269 PolarHBondContact O-N 3.46Å
266	L	83.4	Confident	76.6	Confident	2 Å²	2	68.4 Å²	68.4	1%	0.01	40%	0.402	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-15	176.1	-58.8	-177.6	0	0	0	113.2	L193 G198 R201 A202 V261 E264	L193-L266 HydrophobicContact CD1-CB 3.79Å; L193-L266 HydrophobicContact CD1-CD1 4.41Å; G198-L266 WeakPolarHBondContact CA-O 3.3Å; R201-L266 HydrophobicContact CB-CB 4.33Å; R201-L266 WeakPolarHBondContact CD-O 3.37Å; R201-L266 PolarHBondContact NH1-O 2.8Å; A202-L266 HydrophobicContact CB-CD1 3.77Å; V261-L266 HydrophobicContact CG1-CD1 3.84Å; E264-L266 VanDerWaalsContact C-N 3.26Å; E264-L266 HydrophobicContact CB-CD2 3.8Å; E264-L266 HydrophobicContact CB-CG 3.97Å; E264-L266 PolarHBondContact O-N 2.95Å; E264-L266 WeakPolarHBondContact OE2-CD2 3.45Å
267	D	82.5	Confident	75.4	Confident	29 Å²	29	68.9 Å²	68.9	16%	0.155	40%	0.403	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77	-47.5	177	-74.6	-34.4	0	0	0	110.7	K194 T195 R201 D265	K194-D267 WeakPolarHBondContact CA-OD2 3.48Å; K194-D267 WeakPolarHBondContact CB-OD2 3.41Å; K194-D267 PolarHBondContact N-OD2 3.15Å; T195-D267 WeakPolarHBondContact CA-OD1 3.32Å; T195-D267 WeakPolarHBondContact CB-OD1 3.31Å; T195-D267 HydrophobicContact CG2-CB 3.93Å; T195-D267 WeakPolarHBondContact CG2-OD1 3.48Å; T195-D267 PolarHBondContact N-OD1 3.37Å; T195-D267 PolarHBondContact N-OD2 2.84Å; T195-D267 PolarHBondContact OG1-OD1 3.36Å; R201-D267 PolarHBondContact NH1-O 3.03Å; D265-D267 PolarHBondContact O-N 2.95Å; D265-D267 PolarHBondContact OD1-N 2.77Å; D265-D267 VanDerWaalsContact OD1-N 3.11Å
268	S	79.4	Confident	74.2	Confident	78 Å²	78	71.1 Å²	71.1	55%	0.545	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-9.8	-175.3	-45	0	0	0	0	114.6	D265 V270	D265-S268 VanDerWaalsContact CG-OG 3.28Å; D265-S268 PolarHBondContact OD1-N 2.87Å; D265-S268 PolarHBondContact OD1-OG 2.85Å; D265-S268 WeakPolarHBondContact OD2-CB 3.35Å; D265-S268 PolarHBondContact OD2-OG 3.21Å; S268-V270 PolarHBondContact O-N 3.01Å; S268-V270 VanDerWaalsContact O-N 3.1Å
269	Q	70.6	Confident	72.9	Confident	64 Å²	64	71.3 Å²	71.3	30%	0.299	41%	0.41	S	S	.	.			trans	-53.8	117	-175.8	-169.3	172.8	31.2	0	0	111.8	R201 D265	R201-Q269 PolarHBondContact NH1-O 3.08Å; R201-Q269 PolarHBondContact NH2-O 3.32Å; D265-Q269 PolarHBondContact O-N 3.46Å
270	V	66.3	Low	71	Confident	126 Å²	126	79.8 Å²	79.8	76%	0.764	45%	0.446	S	S	*	.			trans	-97.3	109.9	173.8	179.9	0	0	0	0	108.4	S268 V272	S268-V270 PolarHBondContact O-N 3.01Å; S268-V270 VanDerWaalsContact O-N 3.1Å; V270-V272 PolarHBondContact O-N 3.49Å
271	G	63.3	Low	69	Low	26 Å²	26	82.9 Å²	82.9	27%	0.268	46%	0.457	S	S	.	.			trans	-80.2	108.8	177.6	0	0	0	0	0	111.8	V143	V143-G271 VanDerWaalsContact CG2-CA 3.45Å
272	V	71.6	Confident	66.9	Low	120 Å²	120	89.5 Å²	89.5	73%	0.727	49%	0.492	S	S	*	.			trans	-93	134.4	166	-178.6	0	0	0	0	108.2	V270	V270-V272 PolarHBondContact O-N 3.49Å
273	I	77.5	Confident	65.2	Low	32 Å²	32	88.7 Å²	88.7	16%	0.164	49%	0.493	C	S	.	.			trans	-90.6	106.7	-179.8	-64.9	-178.7	0	0	0	108.3	M112 Q140 V143 V144 F275	M112-I273 HydrophobicContact CE-CD1 3.44Å; M112-I273 VanDerWaalsContact CE-CD1 3.44Å; M112-I273 HydrophobicContact CE-CG2 3.92Å; Q140-I273 VanDerWaalsContact NE2-CG2 3.33Å; V143-I273 HydrophobicContact CG1-CD1 4.17Å; V143-I273 HydrophobicContact CG1-CG1 3.53Å; V144-I273 HydrophobicContact CG2-CD1 4.25Å; I273-F275 HydrophobicContact CB-CE2 4.35Å; I273-F275 HydrophobicContact CG2-CD2 4.26Å; I273-F275 HydrophobicContact CG2-CE1 4.23Å; I273-F275 HydrophobicContact CG2-CE2 3.71Å; I273-F275 HydrophobicContact CG2-CZ 3.7Å; I273-F275 PolarHBondContact O-N 2.95Å
274	D	74.5	Confident	63.6	Low	71 Å²	71	91.8 Å²	91.8	38%	0.38	49%	0.49	S	S	.	.			trans	-84.4	114.6	178.8	-174.3	12.2	0	0	0	111.4	Q140 S276	Q140-D274 PolarHBondContact NE2-O 2.96Å; D274-S276 VanDerWaalsContact CG-OG 3.23Å; D274-S276 WeakPolarHBondContact OD1-CB 3.39Å; D274-S276 PolarHBondContact OD1-N 2.91Å; D274-S276 PolarHBondContact OD1-OG 3.23Å; D274-S276 PolarHBondContact OD2-OG 3.49Å
275	F	73.1	Confident	61.6	Low	104 Å²	104	95.7 Å²	95.7	46%	0.456	51%	0.513	S	S	.	.			trans	-85.8	-14.6	175.2	-68.9	-80.8	0	0	0	113.1	M112 I273 M277 Y278 L279	M112-F275 HydrophobicContact CE-CE1 4.49Å; M112-F275 HydrophobicContact CE-CZ 3.92Å; M112-F275 HydrophobicContact CG-CE1 4.34Å; M112-F275 HydrophobicContact SD-CZ 4.3Å; I273-F275 HydrophobicContact CB-CE2 4.35Å; I273-F275 HydrophobicContact CG2-CD2 4.26Å; I273-F275 HydrophobicContact CG2-CE1 4.23Å; I273-F275 HydrophobicContact CG2-CE2 3.71Å; I273-F275 HydrophobicContact CG2-CZ 3.7Å; I273-F275 PolarHBondContact O-N 2.95Å; F275-M277 PolarHBondContact O-N 3.07Å; F275-Y278 PolarHBondContact O-N 3.38Å; F275-L279 HydrophobicContact CB-CD1 4.1Å; F275-L279 WeakPolarHBondContact O-CG 3.36Å; F275-L279 PolarHBondContact O-N 2.86Å
276	S	70.4	Confident	59.3	Low	80 Å²	80	99.6 Å²	99.6	56%	0.559	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-32.8	-178.9	82.5	0	0	0	0	112.4	D274 Y278 L279	D274-S276 VanDerWaalsContact CG-OG 3.23Å; D274-S276 WeakPolarHBondContact OD1-CB 3.39Å; D274-S276 PolarHBondContact OD1-N 2.91Å; D274-S276 PolarHBondContact OD1-OG 3.23Å; D274-S276 PolarHBondContact OD2-OG 3.49Å; S276-Y278 PolarHBondContact O-N 3.32Å; S276-L279 PolarHBondContact O-N 3.29Å
277	M	61.5	Low	57	Low	85 Å²	85	108.4 Å²	108.4	42%	0.419	56%	0.555	S	S	.	*	T	Hydrogen-bonded Turn	trans	-62.9	-21.9	175.2	-57.9	-164.7	75.4	0	0	114.1	P136 P137 F275	P136-M277 HydrophobicContact CB-CE 4.29Å; P136-M277 HydrophobicContact CB-SD 4.28Å; P137-M277 HydrophobicContact CG-CE 3.88Å; F275-M277 PolarHBondContact O-N 3.07Å
278	Y	64.5	Low	54.5	Low	60 Å²	60	111 Å²	111	24%	0.235	58%	0.575	C	S	.	*	T	Hydrogen-bonded Turn	trans	-109	-21.9	-176.8	-55.4	-80.6	0	0	0	112.6	L115 Q140 F275 S276 K280	L115-Y278 HydrophobicContact CB-CD1 4.11Å; L115-Y278 HydrophobicContact CB-CE1 4.26Å; L115-Y278 VanDerWaalsContact O-CE1 3.31Å; L115-Y278 WeakPolarHBondContact O-CE1 3.23Å; Q140-Y278 HydrophobicContact CG-CE2 4.07Å; F275-Y278 PolarHBondContact O-N 3.38Å; S276-Y278 PolarHBondContact O-N 3.32Å; Y278-K280 VanDerWaalsContact C-N 3.34Å; Y278-K280 PolarHBondContact O-N 2.84Å; Y278-K280 VanDerWaalsContact O-N 3.09Å
279	L	61.4	Low	52.2	Low	121 Å²	121	115.5 Å²	115.5	63%	0.634	59%	0.588	S	S	*	*			trans	-82.8	72.9	176.7	-68.7	169.9	0	0	0	111.3	F275 S276 N281	F275-L279 HydrophobicContact CB-CD1 4.1Å; F275-L279 WeakPolarHBondContact O-CG 3.36Å; F275-L279 PolarHBondContact O-N 2.86Å; S276-L279 PolarHBondContact O-N 3.29Å; L279-N281 PolarHBondContact O-N 3.04Å
280	K	47.3	Very low	50.3	Low	185 Å²	185	120.2 Å²	120.2	80%	0.804	61%	0.61	S	S	*	*			trans	-73.3	108.6	164.4	-74	-172.1	175.9	-176.9	0	109.7	Y278 D282	Y278-K280 VanDerWaalsContact C-N 3.34Å; Y278-K280 PolarHBondContact O-N 2.84Å; Y278-K280 VanDerWaalsContact O-N 3.09Å; K280-D282 PolarHBondContact O-N 3.25Å
281	N	37.6	Very low	48.8	Very low	146 Å²	146	118.6 Å²	118.6	78%	0.781	60%	0.604	S	S	*	*			trans	-79.8	101.3	170.4	-74.8	-10.5	0	0	0	110.2	L279	L279-N281 PolarHBondContact O-N 3.04Å
282	D	33.7	Very low	47.3	Very low	154 Å²	154	126.2 Å²	126.2	82%	0.824	63%	0.63	S	S	*	*			trans	-87.2	92.9	157.6	-72.1	-45.1	0	0	0	108.4	K280	K280-D282 PolarHBondContact O-N 3.25Å
283	M	35.4	Very low	45.9	Very low	151 Å²	151	128.4 Å²	128.4	74%	0.744	63%	0.632	S	S	*	*			trans	-147	101.5	164.9	-81.3	-55.4	-58.4	0	0	111.1
284	D	30.6	Very low	44.2	Very low	144 Å²	144	130.7 Å²	130.7	77%	0.77	66%	0.664	S	S	*	*			trans	57.9	118.4	143.9	-58.7	-9.5	0	0	0	123.1
285	D	29.7	Very low	42.7	Very low	135 Å²	135	134.5 Å²	134.5	72%	0.722	68%	0.684	S	S	*	*			trans	-68.2	128.8	158.5	157.1	44	0	0	0	112.6
286	Y	31.6	Very low	41.4	Very low	179 Å²	179	139.9 Å²	139.9	70%	0.702	70%	0.701	S	S	*	*			trans	-166.3	123.1	134.6	-130.1	-116.5	0	0	0	114.6
287	R	34.1	Very low	40.4	Very low	186 Å²	186	143.7 Å²	143.7	70%	0.702	72%	0.715	S	S	*	*			trans	17.5	144.1	136.3	-46.3	174.4	79.8	176.6	4	119.2
288	S	29.8	Very low	39.8	Very low	83 Å²	83	145.9 Å²	145.9	58%	0.58	74%	0.739	S	S	*	*			cis	177.9	144.3	4.1	42.9	0	0	0	0	112.1
289	E	31.1	Very low	39.3	Very low	174 Å²	174	151.2 Å²	151.2	81%	0.813	77%	0.766	S	S	*	*			trans	61.8	158.9	158.7	-78.4	76	-76.4	0	0	122.5
290	E	31.6	Very low	38.9	Very low	163 Å²	163	152.7 Å²	152.7	76%	0.762	77%	0.773	S	S	*	*			cis	-171.2	163.3	-27.1	-140	-66.2	92.9	0	0	112.4
291	S	33.7	Very low	38.8	Very low	92 Å²	92	148.7 Å²	148.7	64%	0.643	77%	0.774	S	S	*	*			trans	81.9	165.9	155.4	85.6	0	0	0	0	120.6
292	F	32.8	Very low	39.3	Very low	186 Å²	186	147.3 Å²	147.3	82%	0.816	78%	0.776	S	S	*	*			cis	-156.2	-157.9	-0.5	-156.6	-118.8	0	0	0	114.7
293	H	41.2	Very low	39.9	Very low	166 Å²	166	148.4 Å²	148.4	77%	0.769	78%	0.78	S	S	*	*			trans	-112.7	138	-167.7	-73.5	-96.6	0	0	0	119.8
294	G	41.8	Very low	40.2	Very low	80 Å²	80	149.4 Å²	149.4	83%	0.825	79%	0.788	S	S	*	*				85.9	113.5	117.6	0	0	0	0	0	130.8
295	N	44.5	Very low	40.9	Very low	150 Å²	150	148.6 Å²	148.6	80%	0.802	78%	0.783	S	S	*	*				79.2	132.7	120.3	-138.8	6.5	0	0	0	130.8
296	R	44.8	Very low	41.3	Very low	218 Å²	218	150 Å²	150	82%	0.823	79%	0.786	S	S	*	*			trans	103.3	0	144.2	-90.9	166.2	-176.9	-162.4	-1.5	130.5
297	N	50	Low	41.5	Very low	159 Å²	159	150 Å²	150	85%	0.85	79%	0.789	S	S	*	*				0	0	0	-41.2	-10.9	0	0	0	122.4
298	S	49.3	Very low	41.6	Very low	131 Å²	131	146.7 Å²	146.7	92%	0.916	79%	0.785	S	S	*	*				0	0	0	-161.6	0	0	0	0	122.9
299	Q	53.2	Low	42.5	Very low	172 Å²	172	150.1 Å²	150.1	80%	0.804	79%	0.787	S	S	*	*				0	0	0	-145.5	-177.5	11.2	0	0	117.5
300	I	52.1	Low	43.5	Very low	152 Å²	152	147 Å²	147	78%	0.779	78%	0.779	S	S	*	*				0	0	0	-14.1	160.5	0	0	0	116.8
301	A	46.8	Very low	44.8	Very low	101 Å²	101	148.2 Å²	148.2	84%	0.835	79%	0.785	S	S	*	*				0	0	0	0	0	0	0	0	117.2
302	S	47.5	Very low	45.9	Very low	118 Å²	118	145.9 Å²	145.9	83%	0.825	76%	0.764	S	S	*	*				0	155.8	0	-169.3	0	0	0	0	116.7
303	I	46.6	Very low	46.8	Very low	177 Å²	177	143.5 Å²	143.5	91%	0.908	76%	0.759	S	S	*	*			trans	-164.5	169.9	178.1	-1.5	168.1	0	0	0	121.1
304	L	41.5	Very low	47.3	Very low	171 Å²	171	143.1 Å²	143.1	90%	0.895	76%	0.763	S	S	*	*			trans	-171.1	163.8	171.7	-121.4	178.9	0	0	0	120.8
305	D	44.6	Very low	48.1	Very low	127 Å²	127	146.5 Å²	146.5	68%	0.679	75%	0.75	S	S	*	*			trans	-171	-174.1	167.6	-154.5	6	0	0	0	114.1
306	Q	39.5	Very low	48.9	Very low	165 Å²	165	144 Å²	144	77%	0.771	73%	0.734	S	S	*	*			cis	-168.1	163.6	-1.8	-155.5	179.6	98.3	0	0	115.8
307	K	35	Very low	49.3	Very low	180 Å²	180	140.1 Å²	140.1	78%	0.783	73%	0.729	S	S	*	*			trans	-170.1	-174.6	160.9	-137.5	-172.4	174.9	-145.4	0	114.7
308	N	37.1	Very low	49.6	Very low	115 Å²	115	138 Å²	138	62%	0.615	72%	0.718	S	S	*	*			cis	-176.3	161.5	5.6	-177.1	87.4	0	0	0	112
309	Y	47.7	Very low	50.2	Low	156 Å²	156	135.1 Å²	135.1	61%	0.612	70%	0.697	S	S	*	*			cis	-161.9	-45.2	-35.9	-176.7	-123.3	0	0	0	121.7
310	V	51.3	Low	51.1	Low	107 Å²	107	131 Å²	131	65%	0.648	68%	0.684	S	S	*	*			trans	-118.9	144.8	-145.9	-134.8	0	0	0	0	122.5	E312	V310-E312 HydrophobicContact CG1-CB 4.09Å
311	E	58.9	Low	51.6	Low	190 Å²	190	128 Å²	128	89%	0.888	67%	0.673	S	S	*	*			trans	-169.5	47.3	159.8	-99.9	-174.9	139.4	0	0	111.4
312	E	58.3	Low	52.3	Low	43 Å²	43	129.8 Å²	129.8	20%	0.201	66%	0.663	C	S	.	*			trans	-92.7	-33.5	-132.8	-168.4	56.8	-154.9	0	0	119.2	V310 R315	V310-E312 HydrophobicContact CG1-CB 4.09Å; E312-R315 WeakPolarHBondContact O-CB 3.46Å; E312-R315 PolarHBondContact O-N 3.4Å; E312-R315 IonicContact OE1-CZ 3.14Å; E312-R315 IonicContact OE1-NE 3.09Å; E312-R315 PolarHBondContact OE1-NE 3.01Å; E312-R315 IonicContact OE1-NH2 2.86Å; E312-R315 PolarHBondContact OE1-NH2 3.06Å; E312-R315 IonicContact OE2-CZ 3.17Å; E312-R315 IonicContact OE2-NE 2.76Å; E312-R315 PolarHBondContact OE2-NE 2.68Å; E312-R315 VanDerWaalsContact OE2-NE 3.09Å; E312-R315 IonicContact OE2-NH2 3.37Å; E312-R315 PolarHBondContact OE2-NH2 2.7Å
313	L	52	Low	53.4	Low	136 Å²	136	125.6 Å²	125.6	71%	0.712	64%	0.639	S	S	*	*	H	α-helix	trans	-76.7	-43.8	-155.6	-147.4	74.8	0	0	0	114.9	R315 Q316	L313-R315 PolarHBondContact O-N 3.01Å; L313-Q316 WeakPolarHBondContact O-CB 3.43Å; L313-Q316 PolarHBondContact O-N 3.44Å; L313-Q316 VanDerWaalsContact O-N 3.07Å
314	N	51.3	Low	54.6	Low	158 Å²	158	122.1 Å²	122.1	85%	0.845	62%	0.622	S	S	*	*	H	α-helix	trans	-68.8	-14.2	174	-96.3	-21.7	0	0	0	112.8	Q316	N314-Q316 VanDerWaalsContact C-N 3.29Å
315	R	58.7	Low	56	Low	150 Å²	150	120.5 Å²	120.5	57%	0.566	61%	0.609	S	S	*	*	H	α-helix	trans	-66.1	-31.7	169.9	-159.2	173.7	73.3	146.3	0.5	111.5	E312 L313 L317 S319	E312-R315 WeakPolarHBondContact O-CB 3.46Å; E312-R315 PolarHBondContact O-N 3.4Å; E312-R315 IonicContact OE1-CZ 3.14Å; E312-R315 IonicContact OE1-NE 3.09Å; E312-R315 PolarHBondContact OE1-NE 3.01Å; E312-R315 IonicContact OE1-NH2 2.86Å; E312-R315 PolarHBondContact OE1-NH2 3.06Å; E312-R315 IonicContact OE2-CZ 3.17Å; E312-R315 IonicContact OE2-NE 2.76Å; E312-R315 PolarHBondContact OE2-NE 2.68Å; E312-R315 VanDerWaalsContact OE2-NE 3.09Å; E312-R315 IonicContact OE2-NH2 3.37Å; E312-R315 PolarHBondContact OE2-NH2 2.7Å; L313-R315 PolarHBondContact O-N 3.01Å; R315-L317 PolarHBondContact O-N 2.84Å; R315-S319 WeakPolarHBondContact O-CB 3.39Å; R315-S319 PolarHBondContact O-N 3.43Å
316	Q	60.4	Low	57.2	Low	99 Å²	99	118 Å²	118	46%	0.463	60%	0.602	S	S	.	*	H	α-helix	trans	-67.9	-36.2	-169.3	-66.3	-173.8	-25.4	0	0	114.5	L313 N314 S319 T320	L313-Q316 WeakPolarHBondContact O-CB 3.43Å; L313-Q316 PolarHBondContact O-N 3.44Å; L313-Q316 VanDerWaalsContact O-N 3.07Å; N314-Q316 VanDerWaalsContact C-N 3.29Å; Q316-S319 WeakPolarHBondContact O-CB 3.43Å; Q316-S319 PolarHBondContact O-N 2.85Å; Q316-T320 PolarHBondContact O-N 2.73Å; Q316-T320 PolarHBondContact O-OG1 3.08Å
317	L	52.3	Low	59.1	Low	136 Å²	136	118.4 Å²	118.4	71%	0.712	60%	0.596	S	S	*	*	H	α-helix	trans	-73.3	-43.8	-179.1	-161.6	67.6	0	0	0	111.6	R315 S319 T320 V321	R315-L317 PolarHBondContact O-N 2.84Å; L317-S319 VanDerWaalsContact C-N 3.3Å; L317-S319 PolarHBondContact O-N 3.03Å; L317-T320 WeakPolarHBondContact O-CB 3.2Å; L317-T320 PolarHBondContact O-N 3.46Å; L317-T320 VanDerWaalsContact O-N 3.15Å; L317-V321 PolarHBondContact O-N 3.41Å
318	N	57.9	Low	61.1	Low	115 Å²	115	113.6 Å²	113.6	62%	0.615	58%	0.582	S	S	*	*	H	α-helix	trans	-62.3	-37.4	170.5	-89.2	-23	0	0	0	112	T320 V321 H322	N318-T320 VanDerWaalsContact C-N 3.3Å; N318-T320 PolarHBondContact O-N 3.36Å; N318-V321 PolarHBondContact O-N 3.26Å; N318-H322 WeakPolarHBondContact O-CB 3.11Å; N318-H322 PolarHBondContact O-N 2.95Å; N318-H322 PolarHBondContact O-ND1 3.28Å
319	S	61.1	Low	63	Low	70 Å²	70	111.4 Å²	111.4	49%	0.49	57%	0.57	S	S	.	*	H	α-helix	trans	-62.3	-34	173.7	-174.1	0	0	0	0	112.4	R315 Q316 L317 G323	R315-S319 WeakPolarHBondContact O-CB 3.39Å; R315-S319 PolarHBondContact O-N 3.43Å; Q316-S319 WeakPolarHBondContact O-CB 3.43Å; Q316-S319 PolarHBondContact O-N 2.85Å; L317-S319 VanDerWaalsContact C-N 3.3Å; L317-S319 PolarHBondContact O-N 3.03Å; S319-G323 WeakPolarHBondContact O-CA 3.4Å; S319-G323 PolarHBondContact O-N 3.41Å
320	T	71.5	Confident	64.4	Low	85 Å²	85	107.5 Å²	107.5	52%	0.521	57%	0.566	S	S	.	*	H	α-helix	trans	-66.3	-44.2	177	-54.2	0	0	0	0	112.1	Q316 L317 N318 G323 L324	Q316-T320 PolarHBondContact O-N 2.73Å; Q316-T320 PolarHBondContact O-OG1 3.08Å; L317-T320 WeakPolarHBondContact O-CB 3.2Å; L317-T320 PolarHBondContact O-N 3.46Å; L317-T320 VanDerWaalsContact O-N 3.15Å; N318-T320 VanDerWaalsContact C-N 3.3Å; N318-T320 PolarHBondContact O-N 3.36Å; T320-G323 PolarHBondContact O-N 3.08Å; T320-L324 PolarHBondContact O-N 3.43Å; T320-L324 VanDerWaalsContact O-N 3.09Å
321	V	63.6	Low	65.8	Low	90 Å²	90	108 Å²	108	55%	0.545	56%	0.564	S	S	.	*	H	α-helix	trans	-71.1	-42.9	178.5	180	0	0	0	0	111.4	L317 N318 G323 L324 H325	L317-V321 PolarHBondContact O-N 3.41Å; N318-V321 PolarHBondContact O-N 3.26Å; V321-G323 PolarHBondContact O-N 2.57Å; V321-L324 PolarHBondContact O-N 3.11Å; V321-H325 PolarHBondContact O-N 2.87Å; V321-H325 VanDerWaalsContact O-N 3.15Å
322	H	62.1	Low	66.7	Low	137 Å²	137	104.9 Å²	104.9	63%	0.634	55%	0.549	S	S	*	.	H	α-helix	trans	-60.3	-36.2	170.5	-80	78.9	0	0	0	111.8	N318 H325 S326	N318-H322 WeakPolarHBondContact O-CB 3.11Å; N318-H322 PolarHBondContact O-N 2.95Å; N318-H322 PolarHBondContact O-ND1 3.28Å; H322-H325 PolarHBondContact O-N 3.23Å; H322-S326 WeakPolarHBondContact O-CB 3.2Å; H322-S326 PolarHBondContact O-N 3.18Å
323	G	70.6	Confident	67.8	Low	30 Å²	30	109.2 Å²	109.2	31%	0.309	57%	0.567	S	S	.	*	H	α-helix	trans	-65.8	-34.8	178	0	0	0	0	0	113.1	S319 T320 V321 R327	S319-G323 WeakPolarHBondContact O-CA 3.4Å; S319-G323 PolarHBondContact O-N 3.41Å; T320-G323 PolarHBondContact O-N 3.08Å; V321-G323 PolarHBondContact O-N 2.57Å; G323-R327 WeakPolarHBondContact O-CB 3.47Å; G323-R327 WeakPolarHBondContact O-CG 3.36Å; G323-R327 PolarHBondContact O-N 3.35Å; G323-R327 VanDerWaalsContact O-N 3.07Å
324	L	70.5	Confident	69.3	Low	105 Å²	105	105.5 Å²	105.5	55%	0.55	55%	0.553	S	S	.	*	H	α-helix	trans	-72.6	-44.3	173.3	-70.8	175.9	0	0	0	112.2	T320 V321 R327 V328	T320-L324 PolarHBondContact O-N 3.43Å; T320-L324 VanDerWaalsContact O-N 3.09Å; V321-L324 PolarHBondContact O-N 3.11Å; L324-R327 PolarHBondContact O-N 2.65Å; L324-V328 PolarHBondContact O-N 3.25Å; L324-V328 VanDerWaalsContact O-N 3.13Å
325	H	71.4	Confident	70.7	Confident	136 Å²	136	102.7 Å²	102.7	63%	0.63	54%	0.538	S	S	*	.	H	α-helix	trans	-60.9	-49.1	173.2	-98.5	74.3	0	0	0	111.8	V321 H322 R327 V328 D329	V321-H325 PolarHBondContact O-N 2.87Å; V321-H325 VanDerWaalsContact O-N 3.15Å; H322-H325 PolarHBondContact O-N 3.23Å; H325-R327 PolarHBondContact O-N 3Å; H325-V328 WeakPolarHBondContact O-CA 3.29Å; H325-V328 WeakPolarHBondContact O-CB 3.47Å; H325-V328 PolarHBondContact O-N 3.4Å; H325-D329 PolarHBondContact O-N 2.93Å
326	S	70.1	Confident	71.9	Confident	76 Å²	76	99.1 Å²	99.1	53%	0.531	54%	0.536	S	S	.	.	H	α-helix	trans	-57	-33.5	176.7	-179	0	0	0	0	112.7	H322 S330	H322-S326 WeakPolarHBondContact O-CB 3.2Å; H322-S326 PolarHBondContact O-N 3.18Å; S326-S330 WeakPolarHBondContact O-CB 3.28Å; S326-S330 PolarHBondContact O-N 2.84Å
327	R	78.6	Confident	72.9	Confident	173 Å²	173	100 Å²	100	65%	0.653	54%	0.538	S	S	*	.	H	α-helix	trans	-72.1	-33.6	172.9	-78.5	177.8	68.5	-178.1	1.2	113.5	G323 L324 H325 L331	G323-R327 WeakPolarHBondContact O-CB 3.47Å; G323-R327 WeakPolarHBondContact O-CG 3.36Å; G323-R327 PolarHBondContact O-N 3.35Å; G323-R327 VanDerWaalsContact O-N 3.07Å; L324-R327 PolarHBondContact O-N 2.65Å; H325-R327 PolarHBondContact O-N 3Å; R327-L331 WeakPolarHBondContact O-CB 3.45Å; R327-L331 VanDerWaalsContact O-CG 3.23Å; R327-L331 WeakPolarHBondContact O-CG 3.47Å; R327-L331 PolarHBondContact O-N 3.3Å
328	V	78.3	Confident	74.5	Confident	78 Å²	78	97.7 Å²	97.7	47%	0.473	53%	0.526	S	S	.	.	H	α-helix	trans	-68	-53	172.2	175.5	0	0	0	0	109.8	L324 H325 S330 L331 E332	L324-V328 PolarHBondContact O-N 3.25Å; L324-V328 VanDerWaalsContact O-N 3.13Å; H325-V328 WeakPolarHBondContact O-CA 3.29Å; H325-V328 WeakPolarHBondContact O-CB 3.47Å; H325-V328 PolarHBondContact O-N 3.4Å; V328-S330 VanDerWaalsContact C-N 3.26Å; V328-S330 PolarHBondContact O-N 2.7Å; V328-L331 CarbonylContact O-C 3.58Å; V328-L331 PolarHBondContact O-N 3.27Å; V328-E332 HydrophobicContact CG1-CG 4.47Å; V328-E332 PolarHBondContact O-N 3.26Å
329	D	76.3	Confident	75.7	Confident	70 Å²	70	97.4 Å²	97.4	37%	0.374	52%	0.523	S	S	.	.	H	α-helix	trans	-47.2	-47	172.3	-101.8	59	0	0	0	112.8	H325 E332 K333	H325-D329 PolarHBondContact O-N 2.93Å; D329-E332 PolarHBondContact O-N 3.33Å; D329-K333 WeakPolarHBondContact O-CB 3.5Å; D329-K333 VanDerWaalsContact O-CD 3.31Å; D329-K333 WeakPolarHBondContact O-CD 3.43Å; D329-K333 VanDerWaalsContact O-CG 3.24Å; D329-K333 WeakPolarHBondContact O-CG 3.35Å; D329-K333 PolarHBondContact O-N 3.23Å; D329-K333 IonicContact OD2-NZ 2.65Å; D329-K333 PolarHBondContact OD2-NZ 3.5Å
330	S	77.9	Confident	76.9	Confident	74 Å²	74	100.1 Å²	100.1	52%	0.517	53%	0.529	S	S	.	.	H	α-helix	trans	-67.6	-38.6	179.9	-175.9	0	0	0	0	112.1	S326 V328 S334	S326-S330 WeakPolarHBondContact O-CB 3.28Å; S326-S330 PolarHBondContact O-N 2.84Å; V328-S330 VanDerWaalsContact C-N 3.26Å; V328-S330 PolarHBondContact O-N 2.7Å; S330-S334 WeakPolarHBondContact O-CB 3.05Å; S330-S334 PolarHBondContact O-N 3.49Å
331	L	79	Confident	77.6	Confident	116 Å²	116	100 Å²	100	61%	0.607	52%	0.522	S	S	*	.	H	α-helix	trans	-69.7	-38.1	174.9	-74.6	169.5	0	0	0	112.3	R327 V328 S334 N335	R327-L331 WeakPolarHBondContact O-CB 3.45Å; R327-L331 VanDerWaalsContact O-CG 3.23Å; R327-L331 WeakPolarHBondContact O-CG 3.47Å; R327-L331 PolarHBondContact O-N 3.3Å; V328-L331 CarbonylContact O-C 3.58Å; V328-L331 PolarHBondContact O-N 3.27Å; L331-S334 PolarHBondContact O-N 2.97Å; L331-N335 VanDerWaalsContact O-CB 3.27Å; L331-N335 WeakPolarHBondContact O-CB 3.36Å; L331-N335 PolarHBondContact O-N 3.3Å
332	E	78.5	Confident	78.7	Confident	125 Å²	125	100.3 Å²	100.3	58%	0.584	52%	0.524	S	S	*	.	H	α-helix	trans	-67.7	-42	175.4	-69.5	-172.4	165	0	0	112	V328 D329 N335 S336	V328-E332 HydrophobicContact CG1-CG 4.47Å; V328-E332 PolarHBondContact O-N 3.26Å; D329-E332 PolarHBondContact O-N 3.33Å; E332-N335 PolarHBondContact O-N 2.68Å; E332-S336 WeakPolarHBondContact O-CB 3.42Å; E332-S336 PolarHBondContact O-N 3.21Å; E332-S336 PolarHBondContact O-OG 3.12Å
333	K	81.6	Confident	79.9	Confident	134 Å²	134	96.1 Å²	96.1	58%	0.583	51%	0.51	S	S	*	.	H	α-helix	trans	-63	-41.5	172.4	-73	160.5	-176.2	150.9	0	111.6	D329 S336 K337	D329-K333 WeakPolarHBondContact O-CB 3.5Å; D329-K333 VanDerWaalsContact O-CD 3.31Å; D329-K333 WeakPolarHBondContact O-CD 3.43Å; D329-K333 VanDerWaalsContact O-CG 3.24Å; D329-K333 WeakPolarHBondContact O-CG 3.35Å; D329-K333 PolarHBondContact O-N 3.23Å; D329-K333 IonicContact OD2-NZ 2.65Å; D329-K333 PolarHBondContact OD2-NZ 3.5Å; K333-S336 PolarHBondContact O-N 3.05Å; K333-K337 WeakPolarHBondContact O-CB 3.42Å; K333-K337 PolarHBondContact O-N 3.07Å
334	S	82.9	Confident	80.8	Confident	59 Å²	59	99 Å²	99	41%	0.413	52%	0.515	S	S	.	.	H	α-helix	trans	-63.9	-46.2	175.2	-173.4	0	0	0	0	112.1	S330 L331 S336 K337 L338	S330-S334 WeakPolarHBondContact O-CB 3.05Å; S330-S334 PolarHBondContact O-N 3.49Å; L331-S334 PolarHBondContact O-N 2.97Å; S334-S336 VanDerWaalsContact C-N 3.34Å; S334-S336 PolarHBondContact O-N 3.39Å; S334-K337 PolarHBondContact O-N 2.93Å; S334-L338 WeakPolarHBondContact O-CG 3.22Å; S334-L338 PolarHBondContact O-N 3.3Å
335	N	80.9	Confident	81.5	Confident	98 Å²	98	97.8 Å²	97.8	52%	0.524	51%	0.513	S	S	.	.	H	α-helix	trans	-63.3	-40.5	177.6	-164.5	26.7	0	0	0	111.6	L331 E332 L338 I339	L331-N335 VanDerWaalsContact O-CB 3.27Å; L331-N335 WeakPolarHBondContact O-CB 3.36Å; L331-N335 PolarHBondContact O-N 3.3Å; E332-N335 PolarHBondContact O-N 2.68Å; N335-L338 PolarHBondContact O-N 3.07Å; N335-I339 VanDerWaalsContact O-CG1 3.31Å; N335-I339 WeakPolarHBondContact O-CG1 3.49Å; N335-I339 PolarHBondContact O-N 3.13Å
336	S	83.6	Confident	82.4	Confident	75 Å²	75	98.2 Å²	98.2	52%	0.524	51%	0.512	S	S	.	.	H	α-helix	trans	-60.4	-45.1	173.4	-56.2	0	0	0	0	111.9	E332 K333 S334 I339 E340	E332-S336 WeakPolarHBondContact O-CB 3.42Å; E332-S336 PolarHBondContact O-N 3.21Å; E332-S336 PolarHBondContact O-OG 3.12Å; K333-S336 PolarHBondContact O-N 3.05Å; S334-S336 VanDerWaalsContact C-N 3.34Å; S334-S336 PolarHBondContact O-N 3.39Å; S336-I339 PolarHBondContact O-N 3.04Å; S336-E340 PolarHBondContact O-N 3.24Å
337	K	82.7	Confident	83.3	Confident	118 Å²	118	100.2 Å²	100.2	51%	0.513	51%	0.508	S	S	.	.	H	α-helix	trans	-65.1	-38.6	176.5	-173.6	170.5	-175.6	-74.7	0	112.6	K333 S334 E340 E341	K333-K337 WeakPolarHBondContact O-CB 3.42Å; K333-K337 PolarHBondContact O-N 3.07Å; S334-K337 PolarHBondContact O-N 2.93Å; K337-E340 WeakPolarHBondContact O-CB 3.34Å; K337-E340 PolarHBondContact O-N 3.35Å; K337-E341 IonicContact NZ-OE1 2.64Å; K337-E341 PolarHBondContact NZ-OE1 3.33Å; K337-E341 WeakPolarHBondContact O-CB 3.45Å; K337-E341 WeakPolarHBondContact O-CG 3.43Å; K337-E341 PolarHBondContact O-N 3.44Å
338	L	84.5	Confident	83.9	Confident	87 Å²	87	96.1 Å²	96.1	46%	0.455	50%	0.5	S	S	.	.	H	α-helix	trans	-65.5	-37.1	174.6	-72.8	168.9	0	0	0	112	S334 N335 E340 E341 V342	S334-L338 WeakPolarHBondContact O-CG 3.22Å; S334-L338 PolarHBondContact O-N 3.3Å; N335-L338 PolarHBondContact O-N 3.07Å; L338-E340 VanDerWaalsContact C-N 3.34Å; L338-E341 PolarHBondContact O-N 2.97Å; L338-V342 WeakPolarHBondContact O-CB 3.48Å; L338-V342 VanDerWaalsContact O-CG2 3.23Å; L338-V342 WeakPolarHBondContact O-CG2 3.42Å; L338-V342 PolarHBondContact O-N 3.27Å
339	I	84.1	Confident	84.5	Confident	109 Å²	109	97.4 Å²	97.4	56%	0.559	51%	0.507	S	S	*	.	H	α-helix	trans	-64.2	-41	172.8	-69.1	162.9	0	0	0	110.7	N335 S336 V342 S343	N335-I339 VanDerWaalsContact O-CG1 3.31Å; N335-I339 WeakPolarHBondContact O-CG1 3.49Å; N335-I339 PolarHBondContact O-N 3.13Å; S336-I339 PolarHBondContact O-N 3.04Å; I339-V342 PolarHBondContact O-N 3.17Å; I339-S343 PolarHBondContact O-N 3.19Å
340	E	85.9	Confident	85.2	Confident	128 Å²	128	98.8 Å²	98.8	60%	0.598	51%	0.514	S	S	*	.	H	α-helix	trans	-64.2	-47.7	175.4	-173.1	169.6	-148.9	0	0	112	S336 K337 L338 V342 S343 E344	S336-E340 PolarHBondContact O-N 3.24Å; K337-E340 WeakPolarHBondContact O-CB 3.34Å; K337-E340 PolarHBondContact O-N 3.35Å; L338-E340 VanDerWaalsContact C-N 3.34Å; E340-V342 VanDerWaalsContact C-N 3.34Å; E340-V342 PolarHBondContact O-N 3.05Å; E340-S343 CarbonylContact O-C 3.57Å; E340-S343 WeakPolarHBondContact O-CA 3.25Å; E340-S343 WeakPolarHBondContact O-CB 3.36Å; E340-S343 PolarHBondContact O-N 3.44Å; E340-S343 PolarHBondContact O-OG 3.47Å; E340-E344 PolarHBondContact O-N 2.88Å
341	E	86.9	Confident	85.7	Confident	83 Å²	83	98.4 Å²	98.4	39%	0.388	51%	0.508	S	S	.	.	H	α-helix	trans	-61.7	-37.4	175.5	-74.3	174.4	-173.8	0	0	112.8	K337 L338 S343 E344 T345	K337-E341 IonicContact NZ-OE1 2.64Å; K337-E341 PolarHBondContact NZ-OE1 3.33Å; K337-E341 WeakPolarHBondContact O-CB 3.45Å; K337-E341 WeakPolarHBondContact O-CG 3.43Å; K337-E341 PolarHBondContact O-N 3.44Å; L338-E341 PolarHBondContact O-N 2.97Å; E341-S343 VanDerWaalsContact C-N 3.32Å; E341-E344 PolarHBondContact O-N 3.43Å; E341-T345 WeakPolarHBondContact O-CB 3.47Å; E341-T345 WeakPolarHBondContact O-CG2 3.11Å; E341-T345 PolarHBondContact O-N 2.9Å; E341-T345 PolarHBondContact O-OG1 2.88Å
342	V	86.3	Confident	86.1	Confident	95 Å²	95	95 Å²	95	58%	0.576	50%	0.497	S	S	*	.	H	α-helix	trans	-67	-34	171.7	167.8	0	0	0	0	111.2	L338 I339 E340 T345 K346	L338-V342 WeakPolarHBondContact O-CB 3.48Å; L338-V342 VanDerWaalsContact O-CG2 3.23Å; L338-V342 WeakPolarHBondContact O-CG2 3.42Å; L338-V342 PolarHBondContact O-N 3.27Å; I339-V342 PolarHBondContact O-N 3.17Å; E340-V342 VanDerWaalsContact C-N 3.34Å; E340-V342 PolarHBondContact O-N 3.05Å; V342-T345 WeakPolarHBondContact CA-OG1 3.38Å; V342-T345 PolarHBondContact O-OG1 3.5Å; V342-K346 WeakPolarHBondContact O-CB 3.23Å; V342-K346 PolarHBondContact O-N 3.1Å; V342-K346 VanDerWaalsContact O-N 3.09Å
343	S	87.4	Confident	86.7	Confident	49 Å²	49	91.5 Å²	91.5	34%	0.343	49%	0.486	S	S	.	.	H	α-helix	trans	-68.8	-39	173.1	91	0	0	0	0	112.4	I339 E340 E341 R347	I339-S343 PolarHBondContact O-N 3.19Å; E340-S343 CarbonylContact O-C 3.57Å; E340-S343 WeakPolarHBondContact O-CA 3.25Å; E340-S343 WeakPolarHBondContact O-CB 3.36Å; E340-S343 PolarHBondContact O-N 3.44Å; E340-S343 PolarHBondContact O-OG 3.47Å; E341-S343 VanDerWaalsContact C-N 3.32Å; S343-R347 WeakPolarHBondContact O-CG 2.81Å; S343-R347 PolarHBondContact O-N 3Å
344	E	88.6	Confident	87.1	Confident	90 Å²	90	88.2 Å²	88.2	42%	0.421	48%	0.477	S	S	.	.	H	α-helix	trans	-67.1	-53.8	179.3	-174.1	105.6	-76.1	0	0	111.1	E340 E341 K346 R347 N348	E340-E344 PolarHBondContact O-N 2.88Å; E341-E344 PolarHBondContact O-N 3.43Å; E344-K346 VanDerWaalsContact C-N 3.28Å; E344-K346 PolarHBondContact O-N 3.46Å; E344-R347 WeakPolarHBondContact O-CB 3.22Å; E344-R347 PolarHBondContact O-N 2.95Å; E344-R347 VanDerWaalsContact O-N 3.09Å; E344-R347 IonicContact OE1-CZ 2.66Å; E344-R347 IonicContact OE1-NH1 2.75Å; E344-R347 PolarHBondContact OE1-NH1 3.49Å; E344-R347 IonicContact OE1-NH2 3.13Å; E344-R347 PolarHBondContact OE1-NH2 2.93Å; E344-N348 VanDerWaalsContact O-CG 3.24Å; E344-N348 PolarHBondContact O-N 3.4Å; E344-N348 PolarHBondContact O-ND2 2.81Å
345	T	86.1	Confident	87.5	Confident	81 Å²	81	91 Å²	91	50%	0.497	48%	0.484	S	S	.	.	H	α-helix	trans	-59.9	-38.2	176.3	50.3	0	0	0	0	111.7	E341 V342 N348 V349	E341-T345 WeakPolarHBondContact O-CB 3.47Å; E341-T345 WeakPolarHBondContact O-CG2 3.11Å; E341-T345 PolarHBondContact O-N 2.9Å; E341-T345 PolarHBondContact O-OG1 2.88Å; V342-T345 WeakPolarHBondContact CA-OG1 3.38Å; V342-T345 PolarHBondContact O-OG1 3.5Å; T345-N348 PolarHBondContact O-N 3.45Å; T345-V349 WeakPolarHBondContact O-CB 3.28Å; T345-V349 VanDerWaalsContact O-CG2 3.31Å; T345-V349 WeakPolarHBondContact O-CG2 3.25Å; T345-V349 PolarHBondContact O-N 2.76Å
346	K	89.1	Confident	87.8	Confident	144 Å²	144	89.5 Å²	89.5	63%	0.626	48%	0.478	S	S	*	.	H	α-helix	trans	-63.7	-41.2	173	-174.5	175.7	-178.8	179.8	0	112.8	V342 E344 I350	V342-K346 WeakPolarHBondContact O-CB 3.23Å; V342-K346 PolarHBondContact O-N 3.1Å; V342-K346 VanDerWaalsContact O-N 3.09Å; E344-K346 VanDerWaalsContact C-N 3.28Å; E344-K346 PolarHBondContact O-N 3.46Å; K346-I350 HydrophobicContact CG-CD1 4.31Å; K346-I350 WeakPolarHBondContact O-CD1 3.36Å; K346-I350 VanDerWaalsContact O-CG1 3.3Å; K346-I350 WeakPolarHBondContact O-CG1 3.32Å; K346-I350 PolarHBondContact O-N 3.36Å
347	R	90.4	Very high	88.2	Confident	118 Å²	118	91.7 Å²	91.7	45%	0.445	48%	0.479	S	S	.	.	H	α-helix	trans	-61.3	-46.4	172.6	-79	-178.2	-77.6	105.3	-6.7	111.1	S343 E344 V349 I350 T351	S343-R347 WeakPolarHBondContact O-CG 2.81Å; S343-R347 PolarHBondContact O-N 3Å; E344-R347 WeakPolarHBondContact O-CB 3.22Å; E344-R347 PolarHBondContact O-N 2.95Å; E344-R347 VanDerWaalsContact O-N 3.09Å; E344-R347 IonicContact OE1-CZ 2.66Å; E344-R347 IonicContact OE1-NH1 2.75Å; E344-R347 PolarHBondContact OE1-NH1 3.49Å; E344-R347 IonicContact OE1-NH2 3.13Å; E344-R347 PolarHBondContact OE1-NH2 2.93Å; R347-V349 PolarHBondContact O-N 3.19Å; R347-I350 WeakPolarHBondContact O-CB 3.48Å; R347-I350 PolarHBondContact O-N 2.96Å; R347-I350 VanDerWaalsContact O-N 3.1Å; R347-T351 PolarHBondContact O-N 2.87Å; R347-T351 PolarHBondContact O-OG1 2.91Å
348	N	91.3	Very high	88.7	Confident	88 Å²	88	91.7 Å²	91.7	47%	0.471	48%	0.483	S	S	.	.	H	α-helix	trans	-67.2	-33.8	-178.3	-64.2	-13.2	0	0	0	112.9	E344 T345 T351 A352	E344-N348 VanDerWaalsContact O-CG 3.24Å; E344-N348 PolarHBondContact O-N 3.4Å; E344-N348 PolarHBondContact O-ND2 2.81Å; T345-N348 PolarHBondContact O-N 3.45Å; N348-T351 WeakPolarHBondContact CA-OG1 3.37Å; N348-T351 PolarHBondContact O-OG1 3.32Å; N348-T351 VanDerWaalsContact O-OG1 3.04Å; N348-A352 VanDerWaalsContact O-CB 3.27Å; N348-A352 WeakPolarHBondContact O-CB 3.44Å; N348-A352 PolarHBondContact O-N 3.04Å
349	V	90	Very high	88.9	Confident	105 Å²	105	92.6 Å²	92.6	64%	0.636	49%	0.488	S	S	*	.	H	α-helix	trans	-67.2	-36.3	171.4	167.5	0	0	0	0	111.5	T345 R347 S353	T345-V349 WeakPolarHBondContact O-CB 3.28Å; T345-V349 VanDerWaalsContact O-CG2 3.31Å; T345-V349 WeakPolarHBondContact O-CG2 3.25Å; T345-V349 PolarHBondContact O-N 2.76Å; R347-V349 PolarHBondContact O-N 3.19Å; V349-S353 VanDerWaalsContact O-CB 3.23Å; V349-S353 WeakPolarHBondContact O-CB 3.41Å; V349-S353 PolarHBondContact O-N 3.46Å
350	I	90.7	Very high	89.2	Confident	99 Å²	99	95.9 Å²	95.9	51%	0.508	49%	0.494	S	S	.	.	H	α-helix	trans	-68.6	-47	176.6	-68.8	164.9	0	0	0	110.8	K346 R347 S353 T354	K346-I350 HydrophobicContact CG-CD1 4.31Å; K346-I350 WeakPolarHBondContact O-CD1 3.36Å; K346-I350 VanDerWaalsContact O-CG1 3.3Å; K346-I350 WeakPolarHBondContact O-CG1 3.32Å; K346-I350 PolarHBondContact O-N 3.36Å; R347-I350 WeakPolarHBondContact O-CB 3.48Å; R347-I350 PolarHBondContact O-N 2.96Å; R347-I350 VanDerWaalsContact O-N 3.1Å; I350-S353 WeakPolarHBondContact O-CB 3.47Å; I350-S353 PolarHBondContact O-N 2.9Å; I350-T354 PolarHBondContact O-N 3.38Å; I350-T354 PolarHBondContact O-OG1 2.81Å
351	T	89.8	Confident	89.5	Confident	66 Å²	66	94.5 Å²	94.5	41%	0.405	49%	0.489	S	S	.	.	H	α-helix	trans	-62.3	-49.6	178.5	52.6	0	0	0	0	111.4	R347 N348 S353 T354 E355	R347-T351 PolarHBondContact O-N 2.87Å; R347-T351 PolarHBondContact O-OG1 2.91Å; N348-T351 WeakPolarHBondContact CA-OG1 3.37Å; N348-T351 PolarHBondContact O-OG1 3.32Å; N348-T351 VanDerWaalsContact O-OG1 3.04Å; T351-S353 VanDerWaalsContact C-N 3.26Å; T351-S353 PolarHBondContact O-N 3.38Å; T351-T354 WeakPolarHBondContact CA-OG1 3.21Å; T351-T354 WeakPolarHBondContact O-CA 3.29Å; T351-T354 PolarHBondContact O-N 3.13Å; T351-T354 PolarHBondContact O-OG1 2.99Å; T351-E355 WeakPolarHBondContact O-CG 3.31Å; T351-E355 PolarHBondContact O-N 3.01Å
352	A	87.2	Confident	89.7	Confident	44 Å²	44	93.2 Å²	93.2	36%	0.364	49%	0.49	S	S	.	.	H	α-helix	trans	-59.3	-34.5	175.6	0	0	0	0	0	112.7	N348 T356	N348-A352 VanDerWaalsContact O-CB 3.27Å; N348-A352 WeakPolarHBondContact O-CB 3.44Å; N348-A352 PolarHBondContact O-N 3.04Å; A352-T356 VanDerWaalsContact O-CB 3.28Å; A352-T356 WeakPolarHBondContact O-CB 3.43Å; A352-T356 PolarHBondContact O-N 3.02Å; A352-T356 PolarHBondContact O-OG1 2.75Å
353	S	90.2	Very high	89.9	Confident	51 Å²	51	93 Å²	93	36%	0.357	49%	0.485	S	S	.	.	H	α-helix	trans	-66.4	-39.6	172.8	-170.2	0	0	0	0	112.4	V349 I350 T351 K357	V349-S353 VanDerWaalsContact O-CB 3.23Å; V349-S353 WeakPolarHBondContact O-CB 3.41Å; V349-S353 PolarHBondContact O-N 3.46Å; I350-S353 WeakPolarHBondContact O-CB 3.47Å; I350-S353 PolarHBondContact O-N 2.9Å; T351-S353 VanDerWaalsContact C-N 3.26Å; T351-S353 PolarHBondContact O-N 3.38Å; S353-K357 WeakPolarHBondContact O-CD 3.33Å; S353-K357 VanDerWaalsContact O-CG 3.29Å; S353-K357 WeakPolarHBondContact O-CG 3.31Å; S353-K357 PolarHBondContact O-N 2.92Å; S353-K357 PolarHBondContact OG-NZ 3.35Å
354	T	90.9	Very high	90.1	Very high	66 Å²	66	96 Å²	96	41%	0.405	50%	0.495	S	S	.	.	H	α-helix	trans	-69.8	-42.8	175.4	49.2	0	0	0	0	112.6	I350 T351 T356 K357 L358	I350-T354 PolarHBondContact O-N 3.38Å; I350-T354 PolarHBondContact O-OG1 2.81Å; T351-T354 WeakPolarHBondContact CA-OG1 3.21Å; T351-T354 WeakPolarHBondContact O-CA 3.29Å; T351-T354 PolarHBondContact O-N 3.13Å; T351-T354 PolarHBondContact O-OG1 2.99Å; T354-T356 PolarHBondContact O-N 3.06Å; T354-K357 WeakPolarHBondContact O-CB 3.32Å; T354-K357 PolarHBondContact O-N 3.39Å; T354-K357 VanDerWaalsContact O-N 3.15Å; T354-L358 WeakPolarHBondContact O-CG 3.47Å; T354-L358 PolarHBondContact O-N 2.88Å
355	E	91.1	Very high	90.2	Very high	117 Å²	117	96.8 Å²	96.8	55%	0.547	50%	0.502	S	S	.	.	H	α-helix	trans	-61.2	-44.6	174.8	-71.3	172	-177.4	0	0	111.3	T351 K357 L358 L359	T351-E355 WeakPolarHBondContact O-CG 3.31Å; T351-E355 PolarHBondContact O-N 3.01Å; E355-K357 PolarHBondContact O-N 3.29Å; E355-L358 PolarHBondContact O-N 2.96Å; E355-L358 VanDerWaalsContact O-N 3.17Å; E355-L359 WeakPolarHBondContact O-CB 3.32Å; E355-L359 WeakPolarHBondContact O-CG 3.49Å; E355-L359 PolarHBondContact O-N 2.94Å
356	T	87.4	Confident	90.4	Very high	67 Å²	67	98 Å²	98	41%	0.411	51%	0.505	S	S	.	.	H	α-helix	trans	-58.5	-36	175.3	-60.5	0	0	0	0	112.1	A352 T354 R360	A352-T356 VanDerWaalsContact O-CB 3.28Å; A352-T356 WeakPolarHBondContact O-CB 3.43Å; A352-T356 PolarHBondContact O-N 3.02Å; A352-T356 PolarHBondContact O-OG1 2.75Å; T354-T356 PolarHBondContact O-N 3.06Å; T356-R360 VanDerWaalsContact O-CG 3.26Å; T356-R360 WeakPolarHBondContact O-CG 3.49Å; T356-R360 PolarHBondContact O-N 3.25Å; T356-R360 VanDerWaalsContact O-N 3.12Å
357	K	91.1	Very high	90.5	Very high	121 Å²	121	95.4 Å²	95.4	53%	0.526	50%	0.497	S	S	.	.	H	α-helix	trans	-70.9	-45.5	175.4	-70.2	161.9	-173.4	166.2	0	111.5	S353 T354 E355 R360 I361	S353-K357 WeakPolarHBondContact O-CD 3.33Å; S353-K357 VanDerWaalsContact O-CG 3.29Å; S353-K357 WeakPolarHBondContact O-CG 3.31Å; S353-K357 PolarHBondContact O-N 2.92Å; S353-K357 PolarHBondContact OG-NZ 3.35Å; T354-K357 WeakPolarHBondContact O-CB 3.32Å; T354-K357 PolarHBondContact O-N 3.39Å; T354-K357 VanDerWaalsContact O-N 3.15Å; E355-K357 PolarHBondContact O-N 3.29Å; K357-R360 PolarHBondContact O-N 3.4Å; K357-I361 WeakPolarHBondContact O-CG1 3.29Å; K357-I361 PolarHBondContact O-N 3.48Å
358	L	92.5	Very high	90.4	Very high	117 Å²	117	94 Å²	94	61%	0.613	50%	0.502	S	S	*	.	H	α-helix	trans	-63.3	-41.9	177.5	-68.4	172.7	0	0	0	111.9	T354 E355 R360 I361 S362	T354-L358 WeakPolarHBondContact O-CG 3.47Å; T354-L358 PolarHBondContact O-N 2.88Å; E355-L358 PolarHBondContact O-N 2.96Å; E355-L358 VanDerWaalsContact O-N 3.17Å; L358-R360 PolarHBondContact O-N 3.3Å; L358-I361 PolarHBondContact O-N 2.85Å; L358-S362 WeakPolarHBondContact O-CB 3.49Å; L358-S362 PolarHBondContact O-N 2.96Å
359	L	90.6	Very high	90.3	Very high	106 Å²	106	93.5 Å²	93.5	56%	0.555	51%	0.506	S	S	*	.	H	α-helix	trans	-65	-35.4	175	-71.9	171.3	0	0	0	112.2	E355 N363	E355-L359 WeakPolarHBondContact O-CB 3.32Å; E355-L359 WeakPolarHBondContact O-CG 3.49Å; E355-L359 PolarHBondContact O-N 2.94Å; L359-N363 WeakPolarHBondContact O-CB 3.45Å; L359-N363 PolarHBondContact O-N 3.48Å; L359-N363 PolarHBondContact O-ND2 2.84Å
360	R	90.4	Very high	90.2	Very high	179 Å²	179	91.2 Å²	91.2	68%	0.675	50%	0.498	S	S	*	.	H	α-helix	trans	-64.6	-44.2	171.8	-76.7	173	-174.6	-164.9	2.4	111.9	T356 K357 L358 N363 M364	T356-R360 VanDerWaalsContact O-CG 3.26Å; T356-R360 WeakPolarHBondContact O-CG 3.49Å; T356-R360 PolarHBondContact O-N 3.25Å; T356-R360 VanDerWaalsContact O-N 3.12Å; K357-R360 PolarHBondContact O-N 3.4Å; L358-R360 PolarHBondContact O-N 3.3Å; R360-N363 PolarHBondContact O-N 3.28Å; R360-M364 WeakPolarHBondContact O-CG 3.4Å; R360-M364 PolarHBondContact O-N 3.15Å
361	I	91.8	Very high	90.2	Very high	98 Å²	98	92.9 Å²	92.9	50%	0.503	50%	0.501	S	S	.	.	H	α-helix	trans	-63.2	-46.6	176.7	-65.9	164.1	0	0	0	110.3	K357 L358 N363 M364 N365	K357-I361 WeakPolarHBondContact O-CG1 3.29Å; K357-I361 PolarHBondContact O-N 3.48Å; L358-I361 PolarHBondContact O-N 2.85Å; I361-N363 PolarHBondContact O-N 2.99Å; I361-M364 PolarHBondContact O-N 3.05Å; I361-N365 PolarHBondContact O-N 3.1Å
362	S	90.9	Very high	90.2	Very high	57 Å²	57	92.4 Å²	92.4	40%	0.399	50%	0.504	S	S	.	.	H	α-helix	trans	-58.4	-46.4	176.3	-172.6	0	0	0	0	112.1	L358 M364 N365 L366	L358-S362 WeakPolarHBondContact O-CB 3.49Å; L358-S362 PolarHBondContact O-N 2.96Å; S362-M364 PolarHBondContact O-N 2.89Å; S362-N365 PolarHBondContact O-N 3.16Å; S362-L366 WeakPolarHBondContact O-CB 3.36Å; S362-L366 WeakPolarHBondContact O-CG 3.44Å; S362-L366 PolarHBondContact O-N 2.84Å
363	N	89.9	Confident	90.3	Very high	91 Å²	91	96 Å²	96	49%	0.487	52%	0.517	S	S	.	.	H	α-helix	trans	-63.9	-35.6	176	-82.1	-67	0	0	0	113.3	L359 R360 I361 L367	L359-N363 WeakPolarHBondContact O-CB 3.45Å; L359-N363 PolarHBondContact O-N 3.48Å; L359-N363 PolarHBondContact O-ND2 2.84Å; R360-N363 PolarHBondContact O-N 3.28Å; I361-N363 PolarHBondContact O-N 2.99Å; N363-L367 VanDerWaalsContact O-CB 3.23Å; N363-L367 WeakPolarHBondContact O-CB 3.25Å; N363-L367 PolarHBondContact O-N 3Å
364	M	91	Very high	90.4	Very high	111 Å²	111	101.1 Å²	101.1	55%	0.547	53%	0.532	S	S	.	.	H	α-helix	trans	-67.2	-38.9	173.2	-71.2	-63.9	100.7	0	0	112.2	R360 I361 S362 L367 T368	R360-M364 WeakPolarHBondContact O-CG 3.4Å; R360-M364 PolarHBondContact O-N 3.15Å; I361-M364 PolarHBondContact O-N 3.05Å; S362-M364 PolarHBondContact O-N 2.89Å; M364-L367 HydrophobicContact CE-CD2 3.99Å; M364-L367 PolarHBondContact O-N 3.44Å; M364-T368 WeakPolarHBondContact O-CB 3.19Å; M364-T368 PolarHBondContact O-N 2.72Å; M364-T368 PolarHBondContact O-OG1 3.15Å
365	N	91.1	Very high	90.4	Very high	107 Å²	107	102.2 Å²	102.2	57%	0.572	54%	0.539	S	S	*	.	H	α-helix	trans	-66	-44.9	175	-67.8	-9.3	0	0	0	111.4	I361 S362 T368 S369	I361-N365 PolarHBondContact O-N 3.1Å; S362-N365 PolarHBondContact O-N 3.16Å; N365-T368 PolarHBondContact O-N 2.71Å; N365-S369 WeakPolarHBondContact O-CB 3.48Å; N365-S369 PolarHBondContact O-N 2.97Å
366	L	90.1	Very high	90.3	Very high	107 Å²	107	100 Å²	100	56%	0.56	53%	0.534	S	S	*	.	H	α-helix	trans	-61.4	-44.2	174.6	-72.3	170.5	0	0	0	112	S362 T368 S369 A370	S362-L366 WeakPolarHBondContact O-CB 3.36Å; S362-L366 WeakPolarHBondContact O-CG 3.44Å; S362-L366 PolarHBondContact O-N 2.84Å; L366-T368 VanDerWaalsContact C-N 3.3Å; L366-T368 PolarHBondContact O-N 3.4Å; L366-S369 PolarHBondContact O-N 3.21Å; L366-A370 VanDerWaalsContact O-CB 3.29Å; L366-A370 WeakPolarHBondContact O-CB 3.47Å; L366-A370 PolarHBondContact O-N 3Å
367	L	91.2	Very high	90.4	Very high	88 Å²	88	103.2 Å²	103.2	46%	0.461	54%	0.544	S	S	.	.	H	α-helix	trans	-64.3	-35.2	177.2	-172.8	69.4	0	0	0	112.1	N363 M364 K371	N363-L367 VanDerWaalsContact O-CB 3.23Å; N363-L367 WeakPolarHBondContact O-CB 3.25Å; N363-L367 PolarHBondContact O-N 3Å; M364-L367 HydrophobicContact CE-CD2 3.99Å; M364-L367 PolarHBondContact O-N 3.44Å; L367-K371 VanDerWaalsContact O-CG 3.31Å; L367-K371 WeakPolarHBondContact O-CG 3.26Å; L367-K371 PolarHBondContact O-N 3.25Å; L367-K371 VanDerWaalsContact O-N 3.15Å
368	T	89.4	Confident	90.4	Very high	89 Å²	89	99.2 Å²	99.2	55%	0.546	54%	0.537	S	S	.	.	H	α-helix	trans	-71.9	-43.8	176	-55.9	0	0	0	0	111.1	M364 N365 L366 K371 A372	M364-T368 WeakPolarHBondContact O-CB 3.19Å; M364-T368 PolarHBondContact O-N 2.72Å; M364-T368 PolarHBondContact O-OG1 3.15Å; N365-T368 PolarHBondContact O-N 2.71Å; L366-T368 VanDerWaalsContact C-N 3.3Å; L366-T368 PolarHBondContact O-N 3.4Å; T368-K371 WeakPolarHBondContact O-CB 3.42Å; T368-K371 PolarHBondContact O-N 3.05Å; T368-A372 PolarHBondContact O-N 3.49Å
369	S	88.5	Confident	90.3	Very high	78 Å²	78	98.1 Å²	98.1	55%	0.545	53%	0.532	S	S	.	.	H	α-helix	trans	-62.9	-41.9	175.4	-168.4	0	0	0	0	112	N365 L366 K371 A372 L373	N365-S369 WeakPolarHBondContact O-CB 3.48Å; N365-S369 PolarHBondContact O-N 2.97Å; L366-S369 PolarHBondContact O-N 3.21Å; S369-K371 VanDerWaalsContact C-N 3.34Å; S369-K371 PolarHBondContact O-N 3.23Å; S369-A372 PolarHBondContact O-N 3.3Å; S369-L373 WeakPolarHBondContact O-CB 3.29Å; S369-L373 PolarHBondContact O-N 3.46Å
370	A	88.6	Confident	90.2	Very high	57 Å²	57	96.2 Å²	96.2	47%	0.471	52%	0.524	S	S	.	.	H	α-helix	trans	-64.2	-35.2	175.2	0	0	0	0	0	113	L366 K374	L366-A370 VanDerWaalsContact O-CB 3.29Å; L366-A370 WeakPolarHBondContact O-CB 3.47Å; L366-A370 PolarHBondContact O-N 3Å; A370-K374 WeakPolarHBondContact O-CB 3.47Å; A370-K374 PolarHBondContact O-N 3.48Å; A370-K374 VanDerWaalsContact O-N 3.08Å
371	K	89.8	Confident	90.3	Very high	134 Å²	134	89.5 Å²	89.5	58%	0.583	51%	0.505	S	S	*	.	H	α-helix	trans	-65.4	-47.1	171.4	-75.7	171	-179.4	-179.7	0	111.4	L367 T368 S369 K374 V375	L367-K371 VanDerWaalsContact O-CG 3.31Å; L367-K371 WeakPolarHBondContact O-CG 3.26Å; L367-K371 PolarHBondContact O-N 3.25Å; L367-K371 VanDerWaalsContact O-N 3.15Å; T368-K371 WeakPolarHBondContact O-CB 3.42Å; T368-K371 PolarHBondContact O-N 3.05Å; S369-K371 VanDerWaalsContact C-N 3.34Å; S369-K371 PolarHBondContact O-N 3.23Å; K371-K374 PolarHBondContact O-N 3.13Å; K371-V375 WeakPolarHBondContact O-CG2 3.32Å; K371-V375 PolarHBondContact O-N 2.87Å; K371-V375 VanDerWaalsContact O-N 3.08Å
372	A	89.6	Confident	90.3	Very high	56 Å²	56	89.5 Å²	89.5	46%	0.463	51%	0.509	S	S	.	.	H	α-helix	trans	-60.3	-46.6	177.2	0	0	0	0	0	111.7	T368 S369 K374 V375 T376	T368-A372 PolarHBondContact O-N 3.49Å; S369-A372 PolarHBondContact O-N 3.3Å; A372-K374 VanDerWaalsContact C-N 3.31Å; A372-K374 PolarHBondContact O-N 2.69Å; A372-V375 PolarHBondContact O-N 2.96Å; A372-V375 VanDerWaalsContact O-N 3.12Å; A372-T376 PolarHBondContact O-N 3.31Å; A372-T376 PolarHBondContact O-OG1 2.76Å
373	L	91.2	Very high	90.3	Very high	119 Å²	119	93.3 Å²	93.3	62%	0.623	52%	0.521	S	S	*	.	H	α-helix	trans	-56.9	-44.4	176.5	-164.8	76.1	0	0	0	111.3	S369 V375 T376 Q377	S369-L373 WeakPolarHBondContact O-CB 3.29Å; S369-L373 PolarHBondContact O-N 3.46Å; L373-V375 VanDerWaalsContact C-N 3.35Å; L373-V375 PolarHBondContact O-N 2.96Å; L373-T376 WeakPolarHBondContact CA-OG1 3.41Å; L373-T376 PolarHBondContact O-N 3.35Å; L373-T376 PolarHBondContact O-OG1 2.9Å; L373-Q377 WeakPolarHBondContact O-CB 3.09Å; L373-Q377 PolarHBondContact O-N 2.98Å
374	K	91.4	Very high	90.2	Very high	158 Å²	158	94.8 Å²	94.8	69%	0.687	52%	0.519	S	S	*	.	H	α-helix	trans	-65.6	-33.2	178.2	-172.3	171.1	-178.1	176.1	0	113.3	A370 K371 A372 G378	A370-K374 WeakPolarHBondContact O-CB 3.47Å; A370-K374 PolarHBondContact O-N 3.48Å; A370-K374 VanDerWaalsContact O-N 3.08Å; K371-K374 PolarHBondContact O-N 3.13Å; A372-K374 VanDerWaalsContact C-N 3.31Å; A372-K374 PolarHBondContact O-N 2.69Å; K374-G378 PolarHBondContact O-N 3.3Å
375	V	91.4	Very high	90.1	Very high	89 Å²	89	92.6 Å²	92.6	54%	0.539	51%	0.51	S	S	.	.	H	α-helix	trans	-65.8	-53.9	171.7	173.1	0	0	0	0	109.6	K371 A372 L373 Q377 G378 D379	K371-V375 WeakPolarHBondContact O-CG2 3.32Å; K371-V375 PolarHBondContact O-N 2.87Å; K371-V375 VanDerWaalsContact O-N 3.08Å; A372-V375 PolarHBondContact O-N 2.96Å; A372-V375 VanDerWaalsContact O-N 3.12Å; L373-V375 VanDerWaalsContact C-N 3.35Å; L373-V375 PolarHBondContact O-N 2.96Å; V375-Q377 PolarHBondContact O-N 3.24Å; V375-Q377 VanDerWaalsContact O-N 3.15Å; V375-G378 WeakPolarHBondContact O-CA 3.23Å; V375-G378 PolarHBondContact O-N 2.76Å; V375-D379 WeakPolarHBondContact CG1-OD2 3.24Å; V375-D379 PolarHBondContact O-N 2.71Å
376	T	88.3	Confident	90	Very high	72 Å²	72	91 Å²	91	44%	0.442	50%	0.504	S	S	.	.	H	α-helix	trans	-60.7	-28.7	178.8	55.8	0	0	0	0	113.7	A372 L373 T380	A372-T376 PolarHBondContact O-N 3.31Å; A372-T376 PolarHBondContact O-OG1 2.76Å; L373-T376 WeakPolarHBondContact CA-OG1 3.41Å; L373-T376 PolarHBondContact O-N 3.35Å; L373-T376 PolarHBondContact O-OG1 2.9Å; T376-T380 WeakPolarHBondContact O-CB 3.49Å; T376-T380 WeakPolarHBondContact O-CG2 3.4Å; T376-T380 PolarHBondContact O-N 2.98Å; T376-T380 PolarHBondContact O-OG1 3.41Å
377	Q	90.5	Very high	90	Very high	134 Å²	134	93.6 Å²	93.6	63%	0.626	51%	0.507	S	S	*	.	H	α-helix	trans	-70.7	-32	173.1	-170.8	179.9	17.7	0	0	112.5	L373 V375 S381	L373-Q377 WeakPolarHBondContact O-CB 3.09Å; L373-Q377 PolarHBondContact O-N 2.98Å; V375-Q377 PolarHBondContact O-N 3.24Å; V375-Q377 VanDerWaalsContact O-N 3.15Å; Q377-S381 PolarHBondContact O-N 3.08Å
378	G	90.1	Very high	89.9	Confident	36 Å²	36	95 Å²	95	37%	0.371	51%	0.51	S	S	.	.	H	α-helix	trans	-68.3	-52.9	170.1	0	0	0	0	0	111.3	K374 V375 T380 S381 V382	K374-G378 PolarHBondContact O-N 3.3Å; V375-G378 WeakPolarHBondContact O-CA 3.23Å; V375-G378 PolarHBondContact O-N 2.76Å; G378-T380 PolarHBondContact O-N 3.48Å; G378-S381 WeakPolarHBondContact O-CA 3.38Å; G378-S381 WeakPolarHBondContact O-CB 3.4Å; G378-S381 PolarHBondContact O-N 3.26Å; G378-V382 PolarHBondContact O-N 2.86Å
379	D	91.3	Very high	89.8	Confident	95 Å²	95	97.9 Å²	97.9	51%	0.508	52%	0.517	S	S	.	.	H	α-helix	trans	-57.3	-50.2	-178.1	-55.3	-33.9	0	0	0	111.5	V375 S381 V382 E383	V375-D379 WeakPolarHBondContact CG1-OD2 3.24Å; V375-D379 PolarHBondContact O-N 2.71Å; D379-S381 PolarHBondContact O-N 2.94Å; D379-V382 PolarHBondContact O-N 3.48Å; D379-V382 VanDerWaalsContact O-N 3.15Å; D379-E383 WeakPolarHBondContact O-CB 3.23Å; D379-E383 PolarHBondContact O-N 3.23Å
380	T	87.7	Confident	89.8	Confident	65 Å²	65	97.5 Å²	97.5	40%	0.399	51%	0.514	S	S	.	.	H	α-helix	trans	-68.7	-11.7	176.2	56.8	0	0	0	0	113.9	T376 G378 R384	T376-T380 WeakPolarHBondContact O-CB 3.49Å; T376-T380 WeakPolarHBondContact O-CG2 3.4Å; T376-T380 PolarHBondContact O-N 2.98Å; T376-T380 PolarHBondContact O-OG1 3.41Å; G378-T380 PolarHBondContact O-N 3.48Å; T380-R384 VanDerWaalsContact O-CB 3.3Å; T380-R384 WeakPolarHBondContact O-CB 3.31Å; T380-R384 PolarHBondContact O-N 3.04Å; T380-R384 PolarHBondContact O-NH2 2.93Å
381	S	91.9	Very high	89.8	Confident	38 Å²	38	99.9 Å²	99.9	27%	0.266	51%	0.511	S	S	.	.	H	α-helix	trans	-82.7	-46.4	166.4	-152.7	0	0	0	0	111.6	Q377 G378 D379 E383 R384 D385	Q377-S381 PolarHBondContact O-N 3.08Å; G378-S381 WeakPolarHBondContact O-CA 3.38Å; G378-S381 WeakPolarHBondContact O-CB 3.4Å; G378-S381 PolarHBondContact O-N 3.26Å; D379-S381 PolarHBondContact O-N 2.94Å; S381-E383 VanDerWaalsContact C-N 3.3Å; S381-E383 PolarHBondContact O-N 2.95Å; S381-R384 PolarHBondContact O-N 3.07Å; S381-R384 VanDerWaalsContact O-N 3.15Å; S381-R384 PolarHBondContact OG-NH1 3.08Å; S381-D385 WeakPolarHBondContact O-CB 3.5Å; S381-D385 VanDerWaalsContact O-CG 3.3Å; S381-D385 PolarHBondContact O-N 3.4Å; S381-D385 VanDerWaalsContact O-OD2 3.05Å; S381-D385 PolarHBondContact OG-OD2 3.46Å
382	V	92.3	Very high	89.7	Confident	98 Å²	98	98.9 Å²	98.9	59%	0.594	51%	0.509	S	S	*	.	H	α-helix	trans	-59.1	-43	176.5	177.3	0	0	0	0	110.9	G378 D379 D385 T386	G378-V382 PolarHBondContact O-N 2.86Å; D379-V382 PolarHBondContact O-N 3.48Å; D379-V382 VanDerWaalsContact O-N 3.15Å; V382-D385 PolarHBondContact O-N 3.23Å; V382-T386 VanDerWaalsContact O-CB 3.29Å; V382-T386 WeakPolarHBondContact O-CB 3.34Å; V382-T386 PolarHBondContact O-N 3.09Å; V382-T386 PolarHBondContact O-OG1 3.48Å
383	E	90.1	Very high	89.8	Confident	138 Å²	138	97.7 Å²	97.7	65%	0.645	50%	0.501	S	S	*	.	H	α-helix	trans	-59.9	-47.3	173.8	-175.1	178.6	-150.7	0	0	112.1	D379 S381 D385 T386 Y387	D379-E383 WeakPolarHBondContact O-CB 3.23Å; D379-E383 PolarHBondContact O-N 3.23Å; S381-E383 VanDerWaalsContact C-N 3.3Å; S381-E383 PolarHBondContact O-N 2.95Å; E383-D385 PolarHBondContact O-N 3.38Å; E383-T386 PolarHBondContact O-N 3.03Å; E383-Y387 WeakPolarHBondContact O-CB 3.47Å; E383-Y387 PolarHBondContact O-N 2.67Å
384	R	88.5	Confident	89.8	Confident	121 Å²	121	96.9 Å²	96.9	46%	0.457	50%	0.497	S	S	.	.	H	α-helix	trans	-62.5	-41.2	178.8	-171.1	-166.8	-45.6	107	10.8	112.3	T380 S381 Y387 K388	T380-R384 VanDerWaalsContact O-CB 3.3Å; T380-R384 WeakPolarHBondContact O-CB 3.31Å; T380-R384 PolarHBondContact O-N 3.04Å; T380-R384 PolarHBondContact O-NH2 2.93Å; S381-R384 PolarHBondContact O-N 3.07Å; S381-R384 VanDerWaalsContact O-N 3.15Å; S381-R384 PolarHBondContact OG-NH1 3.08Å; R384-Y387 PolarHBondContact O-N 2.85Å; R384-K388 WeakPolarHBondContact O-CG 3.46Å; R384-K388 PolarHBondContact O-N 2.81Å
385	D	89.7	Confident	89.6	Confident	66 Å²	66	92.3 Å²	92.3	35%	0.353	48%	0.481	S	S	.	.	H	α-helix	trans	-77.9	-32.6	-176.9	-63.6	-39.9	0	0	0	111.3	S381 V382 E383 K388 Q389	S381-D385 WeakPolarHBondContact O-CB 3.5Å; S381-D385 VanDerWaalsContact O-CG 3.3Å; S381-D385 PolarHBondContact O-N 3.4Å; S381-D385 VanDerWaalsContact O-OD2 3.05Å; S381-D385 PolarHBondContact OG-OD2 3.46Å; V382-D385 PolarHBondContact O-N 3.23Å; E383-D385 PolarHBondContact O-N 3.38Å; D385-K388 PolarHBondContact O-N 2.89Å; D385-K388 WeakPolarHBondContact OD1-CE 3.42Å; D385-K388 IonicContact OD1-NZ 3.19Å; D385-K388 PolarHBondContact OD1-NZ 2.86Å; D385-Q389 WeakPolarHBondContact O-CB 3.32Å; D385-Q389 PolarHBondContact O-N 3.4Å
386	T	89.2	Confident	89.7	Confident	73 Å²	73	93.3 Å²	93.3	45%	0.448	48%	0.479	S	S	.	.	H	α-helix	trans	-61.7	-46.6	166.7	-55.6	0	0	0	0	110.8	V382 E383 K388 Q389 S390	V382-T386 VanDerWaalsContact O-CB 3.29Å; V382-T386 WeakPolarHBondContact O-CB 3.34Å; V382-T386 PolarHBondContact O-N 3.09Å; V382-T386 PolarHBondContact O-OG1 3.48Å; E383-T386 PolarHBondContact O-N 3.03Å; T386-K388 PolarHBondContact O-N 3.01Å; T386-Q389 PolarHBondContact O-N 3.38Å; T386-S390 PolarHBondContact O-N 2.98Å; T386-S390 PolarHBondContact O-OG 3.12Å; T386-S390 VanDerWaalsContact O-OG 3.08Å
387	Y	89	Confident	90	Very high	161 Å²	161	96.1 Å²	96.1	63%	0.631	49%	0.489	S	S	*	.	H	α-helix	trans	-61.9	-43.4	176.8	-178	-93.5	0	0	0	112.2	E383 R384 Q389 S390 R391	E383-Y387 WeakPolarHBondContact O-CB 3.47Å; E383-Y387 PolarHBondContact O-N 2.67Å; R384-Y387 PolarHBondContact O-N 2.85Å; Y387-Q389 PolarHBondContact O-N 3.14Å; Y387-S390 PolarHBondContact O-N 2.98Å; Y387-R391 HydrophobicContact CE1-CB 4.49Å; Y387-R391 WeakPolarHBondContact O-CB 2.93Å; Y387-R391 PolarHBondContact O-N 3.36Å
388	K	88.7	Confident	90	Very high	117 Å²	117	97.8 Å²	97.8	51%	0.509	49%	0.491	S	S	.	.	H	α-helix	trans	-56.2	-49.2	172.7	-73.9	172.7	-169.9	163.7	0	111.4	R384 D385 T386 R391 Q392	R384-K388 WeakPolarHBondContact O-CG 3.46Å; R384-K388 PolarHBondContact O-N 2.81Å; D385-K388 PolarHBondContact O-N 2.89Å; D385-K388 WeakPolarHBondContact OD1-CE 3.42Å; D385-K388 IonicContact OD1-NZ 3.19Å; D385-K388 PolarHBondContact OD1-NZ 2.86Å; T386-K388 PolarHBondContact O-N 3.01Å; K388-R391 PolarHBondContact O-N 2.9Å; K388-Q392 WeakPolarHBondContact O-CB 3.34Å; K388-Q392 PolarHBondContact O-N 3.06Å
389	Q	88.2	Confident	90.1	Very high	151 Å²	151	100.7 Å²	100.7	71%	0.706	50%	0.498	S	S	*	.	H	α-helix	trans	-66.7	-41.1	-175.4	-164	171.8	21.2	0	0	111.6	D385 T386 Y387 G393	D385-Q389 WeakPolarHBondContact O-CB 3.32Å; D385-Q389 PolarHBondContact O-N 3.4Å; T386-Q389 PolarHBondContact O-N 3.38Å; Y387-Q389 PolarHBondContact O-N 3.14Å; Q389-G393 PolarHBondContact O-N 3.1Å
390	S	88.3	Confident	90.3	Very high	69 Å²	69	99.6 Å²	99.6	48%	0.483	49%	0.49	S	S	.	.	H	α-helix	trans	-64.7	-40.7	172	-56.7	0	0	0	0	112.5	T386 Y387 G393 L394	T386-S390 PolarHBondContact O-N 2.98Å; T386-S390 PolarHBondContact O-OG 3.12Å; T386-S390 VanDerWaalsContact O-OG 3.08Å; Y387-S390 PolarHBondContact O-N 2.98Å; S390-G393 PolarHBondContact O-N 3.37Å; S390-L394 WeakPolarHBondContact O-CD1 3.05Å; S390-L394 PolarHBondContact O-N 3.26Å
391	R	89	Confident	90.6	Very high	107 Å²	107	99.1 Å²	99.1	40%	0.404	49%	0.492	S	S	.	.	H	α-helix	trans	-66.2	-42.2	179.1	-170.9	73.4	-165.8	75.7	11.4	111.4	Y387 K388 L394 D395	Y387-R391 HydrophobicContact CE1-CB 4.49Å; Y387-R391 WeakPolarHBondContact O-CB 2.93Å; Y387-R391 PolarHBondContact O-N 3.36Å; K388-R391 PolarHBondContact O-N 2.9Å; R391-L394 WeakPolarHBondContact O-CB 3.25Å; R391-L394 PolarHBondContact O-N 2.95Å; R391-D395 IonicContact CZ-OD1 2.84Å; R391-D395 IonicContact CZ-OD2 3.52Å; R391-D395 IonicContact NH1-OD1 2.81Å; R391-D395 PolarHBondContact NH1-OD1 2.88Å; R391-D395 IonicContact NH1-OD2 2.69Å; R391-D395 PolarHBondContact NH1-OD2 3.37Å; R391-D395 IonicContact NH2-OD1 3.35Å; R391-D395 PolarHBondContact NH2-OD1 2.66Å; R391-D395 IonicContact NH2-OD2 3.13Å; R391-D395 PolarHBondContact NH2-OD2 2.96Å; R391-D395 PolarHBondContact O-N 3.38Å
392	Q	87.6	Confident	90.6	Very high	114 Å²	114	105.5 Å²	105.5	53%	0.533	51%	0.51	S	S	.	.	H	α-helix	trans	-60.8	-47.5	173.4	178.1	178.8	-18.9	0	0	111.1	K388 L394 D395 E396	K388-Q392 WeakPolarHBondContact O-CB 3.34Å; K388-Q392 PolarHBondContact O-N 3.06Å; Q392-L394 VanDerWaalsContact C-N 3.27Å; Q392-L394 PolarHBondContact O-N 3.48Å; Q392-D395 PolarHBondContact O-N 2.98Å; Q392-E396 HydrophobicContact CG-CG 4.37Å; Q392-E396 VanDerWaalsContact CG-OE1 3.29Å; Q392-E396 WeakPolarHBondContact CG-OE1 3.25Å; Q392-E396 PolarHBondContact NE2-OE1 3.01Å; Q392-E396 WeakPolarHBondContact O-CB 3.47Å; Q392-E396 WeakPolarHBondContact O-CG 3.34Å; Q392-E396 PolarHBondContact O-N 3.18Å
393	G	91.9	Very high	90.8	Very high	30 Å²	30	106.1 Å²	106.1	31%	0.309	50%	0.502	S	S	.	.	H	α-helix	trans	-59.7	-35.5	175.7	0	0	0	0	0	113.3	Q389 S390 M397	Q389-G393 PolarHBondContact O-N 3.1Å; S390-G393 PolarHBondContact O-N 3.37Å; G393-M397 WeakPolarHBondContact O-CB 3.21Å; G393-M397 PolarHBondContact O-N 3.29Å
394	L	90.3	Very high	91	Very high	102 Å²	102	104.6 Å²	104.6	53%	0.534	50%	0.495	S	S	.	.	H	α-helix	trans	-67.2	-43.2	170.6	-100.2	85.9	0	0	0	112.8	S390 R391 Q392 M397 Y398	S390-L394 WeakPolarHBondContact O-CD1 3.05Å; S390-L394 PolarHBondContact O-N 3.26Å; R391-L394 WeakPolarHBondContact O-CB 3.25Å; R391-L394 PolarHBondContact O-N 2.95Å; Q392-L394 VanDerWaalsContact C-N 3.27Å; Q392-L394 PolarHBondContact O-N 3.48Å; L394-M397 PolarHBondContact O-N 2.98Å; L394-Y398 VanDerWaalsContact O-CB 3.31Å; L394-Y398 WeakPolarHBondContact O-CB 3.36Å; L394-Y398 PolarHBondContact O-N 3.08Å
395	D	88.8	Confident	91.3	Very high	63 Å²	63	104.1 Å²	104.1	34%	0.337	50%	0.501	S	S	.	.	H	α-helix	trans	-68.6	-36.1	179.4	-71	-37.6	0	0	0	111.6	R391 Q392 Y398 N399	R391-D395 IonicContact CZ-OD1 2.84Å; R391-D395 IonicContact CZ-OD2 3.52Å; R391-D395 IonicContact NH1-OD1 2.81Å; R391-D395 PolarHBondContact NH1-OD1 2.88Å; R391-D395 IonicContact NH1-OD2 2.69Å; R391-D395 PolarHBondContact NH1-OD2 3.37Å; R391-D395 IonicContact NH2-OD1 3.35Å; R391-D395 PolarHBondContact NH2-OD1 2.66Å; R391-D395 IonicContact NH2-OD2 3.13Å; R391-D395 PolarHBondContact NH2-OD2 2.96Å; R391-D395 PolarHBondContact O-N 3.38Å; Q392-D395 PolarHBondContact O-N 2.98Å; D395-Y398 PolarHBondContact O-N 3.13Å; D395-N399 WeakPolarHBondContact O-CB 3.37Å; D395-N399 VanDerWaalsContact O-CG 3.23Å; D395-N399 PolarHBondContact O-N 2.66Å; D395-N399 PolarHBondContact O-ND2 2.99Å
396	E	92.8	Very high	91.5	Very high	110 Å²	110	108.6 Å²	108.6	51%	0.514	52%	0.517	S	S	.	.	H	α-helix	trans	-61.3	-49.2	170.3	-74.2	170.5	-173	0	0	111	Q392 Y398 N399 E400	Q392-E396 HydrophobicContact CG-CG 4.37Å; Q392-E396 VanDerWaalsContact CG-OE1 3.29Å; Q392-E396 WeakPolarHBondContact CG-OE1 3.25Å; Q392-E396 PolarHBondContact NE2-OE1 3.01Å; Q392-E396 WeakPolarHBondContact O-CB 3.47Å; Q392-E396 WeakPolarHBondContact O-CG 3.34Å; Q392-E396 PolarHBondContact O-N 3.18Å; E396-Y398 VanDerWaalsContact C-N 3.33Å; E396-Y398 PolarHBondContact O-N 2.54Å; E396-N399 PolarHBondContact O-N 3.41Å; E396-E400 WeakPolarHBondContact O-CB 3.41Å; E396-E400 PolarHBondContact O-N 3.42Å
397	M	93.6	Very high	91.8	Very high	131 Å²	131	109.7 Å²	109.7	65%	0.645	52%	0.517	S	S	*	.	H	α-helix	trans	-62.2	-38.2	176.9	-158.3	-160.4	-44.1	0	0	112.4	G393 L394 E400 A401	G393-M397 WeakPolarHBondContact O-CB 3.21Å; G393-M397 PolarHBondContact O-N 3.29Å; L394-M397 PolarHBondContact O-N 2.98Å; M397-E400 PolarHBondContact O-N 3.04Å; M397-A401 WeakPolarHBondContact O-CB 3.46Å; M397-A401 PolarHBondContact O-N 3.29Å
398	Y	91.6	Very high	92.1	Very high	169 Å²	169	108 Å²	108	66%	0.663	52%	0.515	S	S	*	.	H	α-helix	trans	-71.5	-38.2	178.5	-166.9	-90.8	0	0	0	112.2	L394 D395 E396 R402	L394-Y398 VanDerWaalsContact O-CB 3.31Å; L394-Y398 WeakPolarHBondContact O-CB 3.36Å; L394-Y398 PolarHBondContact O-N 3.08Å; D395-Y398 PolarHBondContact O-N 3.13Å; E396-Y398 VanDerWaalsContact C-N 3.33Å; E396-Y398 PolarHBondContact O-N 2.54Å; Y398-R402 WeakPolarHBondContact O-CB 3.41Å; Y398-R402 PolarHBondContact O-N 3.21Å
399	N	92.7	Very high	92.4	Very high	97 Å²	97	106 Å²	106	52%	0.519	52%	0.515	S	S	.	.	H	α-helix	trans	-66.2	-40.2	173.3	-75.8	-44.8	0	0	0	111.6	D395 E396 R402 R403	D395-N399 WeakPolarHBondContact O-CB 3.37Å; D395-N399 VanDerWaalsContact O-CG 3.23Å; D395-N399 PolarHBondContact O-N 2.66Å; D395-N399 PolarHBondContact O-ND2 2.99Å; E396-N399 PolarHBondContact O-N 3.41Å; N399-R402 PolarHBondContact O-N 3.08Å; N399-R403 WeakPolarHBondContact O-CB 3.37Å; N399-R403 PolarHBondContact O-N 2.93Å
400	E	94.8	Very high	92.8	Very high	72 Å²	72	103.7 Å²	103.7	34%	0.336	50%	0.504	S	S	.	.	H	α-helix	trans	-66.4	-46.9	175.7	175.9	56.1	-165	0	0	112	E396 M397 R402 R403 Q404	E396-E400 WeakPolarHBondContact O-CB 3.41Å; E396-E400 PolarHBondContact O-N 3.42Å; M397-E400 PolarHBondContact O-N 3.04Å; E400-R402 PolarHBondContact O-N 2.89Å; E400-R403 WeakPolarHBondContact O-CB 3.11Å; E400-R403 PolarHBondContact O-N 3.42Å; E400-R403 VanDerWaalsContact O-N 3.08Å; E400-R403 IonicContact OE1-CZ 3.17Å; E400-R403 IonicContact OE1-NE 3.54Å; E400-R403 IonicContact OE1-NH2 3.87Å; E400-R403 PolarHBondContact OE1-NH2 3.4Å; E400-R403 IonicContact OE2-CZ 2.81Å; E400-R403 IonicContact OE2-NE 3.74Å; E400-R403 PolarHBondContact OE2-NE 2.86Å; E400-R403 IonicContact OE2-NH2 3.6Å; E400-R403 PolarHBondContact OE2-NH2 3Å; E400-Q404 WeakPolarHBondContact O-CG 3.4Å; E400-Q404 PolarHBondContact O-N 3.33Å; E400-Q404 PolarHBondContact OE1-NE2 3.06Å
401	A	92.9	Very high	93.2	Very high	54 Å²	54	105.6 Å²	105.6	45%	0.446	51%	0.508	S	S	.	.	H	α-helix	trans	-59.7	-36.3	173.8	0	0	0	0	0	112.1	M397 L405	M397-A401 WeakPolarHBondContact O-CB 3.46Å; M397-A401 PolarHBondContact O-N 3.29Å; A401-L405 VanDerWaalsContact O-CB 3.32Å; A401-L405 WeakPolarHBondContact O-CB 3.5Å; A401-L405 PolarHBondContact O-N 3.39Å
402	R	93.6	Very high	93.5	Very high	172 Å²	172	108.5 Å²	108.5	65%	0.649	52%	0.519	S	S	*	.	H	α-helix	trans	-70.8	-33.2	174.7	-171	179.8	-173.5	-167.8	2.6	112.8	Y398 N399 E400 K406	Y398-R402 WeakPolarHBondContact O-CB 3.41Å; Y398-R402 PolarHBondContact O-N 3.21Å; N399-R402 PolarHBondContact O-N 3.08Å; E400-R402 PolarHBondContact O-N 2.89Å; R402-K406 PolarHBondContact O-N 3.15Å; R402-K406 VanDerWaalsContact O-N 3.08Å
403	R	95.4	Very high	93.9	Very high	112 Å²	112	107.4 Å²	107.4	42%	0.423	51%	0.514	S	S	.	.	H	α-helix	trans	-65.5	-52.7	173	-174.8	-173.3	71.4	78.9	6.1	110.2	N399 E400 L405 K406 E407	N399-R403 WeakPolarHBondContact O-CB 3.37Å; N399-R403 PolarHBondContact O-N 2.93Å; E400-R403 WeakPolarHBondContact O-CB 3.11Å; E400-R403 PolarHBondContact O-N 3.42Å; E400-R403 VanDerWaalsContact O-N 3.08Å; E400-R403 IonicContact OE1-CZ 3.17Å; E400-R403 IonicContact OE1-NE 3.54Å; E400-R403 IonicContact OE1-NH2 3.87Å; E400-R403 PolarHBondContact OE1-NH2 3.4Å; E400-R403 IonicContact OE2-CZ 2.81Å; E400-R403 IonicContact OE2-NE 3.74Å; E400-R403 PolarHBondContact OE2-NE 2.86Å; E400-R403 IonicContact OE2-NH2 3.6Å; E400-R403 PolarHBondContact OE2-NH2 3Å; R403-L405 VanDerWaalsContact C-N 3.35Å; R403-L405 PolarHBondContact O-N 3.4Å; R403-K406 WeakPolarHBondContact O-CB 3.42Å; R403-K406 PolarHBondContact O-N 3.11Å; R403-E407 VanDerWaalsContact CG-OE1 3.23Å; R403-E407 WeakPolarHBondContact CG-OE1 3.3Å; R403-E407 IonicContact CZ-OE1 3.34Å; R403-E407 IonicContact CZ-OE2 3.66Å; R403-E407 IonicContact NH1-OE1 2.99Å; R403-E407 PolarHBondContact NH1-OE1 2.82Å; R403-E407 IonicContact NH1-OE2 2.85Å; R403-E407 PolarHBondContact NH1-OE2 3.42Å; R403-E407 PolarHBondContact O-N 2.88Å
404	Q	95.1	Very high	94.2	Very high	105 Å²	105	109.6 Å²	109.6	49%	0.491	52%	0.519	S	S	.	.	H	α-helix	trans	-57	-45.4	176.4	-67.8	176.5	10.5	0	0	111.8	E400 K406 E407 E408	E400-Q404 WeakPolarHBondContact O-CG 3.4Å; E400-Q404 PolarHBondContact O-N 3.33Å; E400-Q404 PolarHBondContact OE1-NE2 3.06Å; Q404-K406 VanDerWaalsContact C-N 3.32Å; Q404-K406 PolarHBondContact O-N 3.48Å; Q404-E407 PolarHBondContact O-N 3.18Å; Q404-E408 WeakPolarHBondContact O-CB 3.34Å; Q404-E408 PolarHBondContact O-N 3.24Å
405	L	93.8	Very high	94.5	Very high	112 Å²	112	109.3 Å²	109.3	59%	0.586	52%	0.521	S	S	*	.	H	α-helix	trans	-61.8	-37.1	175.9	-179.3	62	0	0	0	112.6	A401 R403 C409	A401-L405 VanDerWaalsContact O-CB 3.32Å; A401-L405 WeakPolarHBondContact O-CB 3.5Å; A401-L405 PolarHBondContact O-N 3.39Å; R403-L405 VanDerWaalsContact C-N 3.35Å; R403-L405 PolarHBondContact O-N 3.4Å; L405-C409 VanDerWaalsContact O-CB 3.31Å; L405-C409 WeakPolarHBondContact O-CB 3.46Å; L405-C409 PolarHBondContact O-N 3.35Å; L405-C409 PolarHBondContact O-SG 3.35Å
406	K	94.5	Very high	94.8	Very high	159 Å²	159	110.3 Å²	110.3	69%	0.691	52%	0.524	S	S	*	.	H	α-helix	trans	-67.6	-42.4	175.6	-170.7	-169.7	174.9	-167.2	0	111.3	R402 R403 Q404 C409 Q410	R402-K406 PolarHBondContact O-N 3.15Å; R402-K406 VanDerWaalsContact O-N 3.08Å; R403-K406 WeakPolarHBondContact O-CB 3.42Å; R403-K406 PolarHBondContact O-N 3.11Å; Q404-K406 VanDerWaalsContact C-N 3.32Å; Q404-K406 PolarHBondContact O-N 3.48Å; K406-C409 PolarHBondContact O-N 2.87Å; K406-Q410 WeakPolarHBondContact O-CB 3.31Å; K406-Q410 PolarHBondContact O-N 3.01Å
407	E	96.4	Very high	94.9	Very high	97 Å²	97	109.2 Å²	109.2	45%	0.453	52%	0.521	S	S	.	.	H	α-helix	trans	-66.2	-44.2	179.3	-74	165.6	-167.1	0	0	111.4	R403 Q404 Q410 L411	R403-E407 VanDerWaalsContact CG-OE1 3.23Å; R403-E407 WeakPolarHBondContact CG-OE1 3.3Å; R403-E407 IonicContact CZ-OE1 3.34Å; R403-E407 IonicContact CZ-OE2 3.66Å; R403-E407 IonicContact NH1-OE1 2.99Å; R403-E407 PolarHBondContact NH1-OE1 2.82Å; R403-E407 IonicContact NH1-OE2 2.85Å; R403-E407 PolarHBondContact NH1-OE2 3.42Å; R403-E407 PolarHBondContact O-N 2.88Å; Q404-E407 PolarHBondContact O-N 3.18Å; E407-Q410 PolarHBondContact O-N 3.48Å; E407-L411 WeakPolarHBondContact O-CB 3.27Å; E407-L411 PolarHBondContact O-N 3.25Å
408	E	94.6	Very high	95	Very high	124 Å²	124	107.9 Å²	107.9	58%	0.579	51%	0.513	S	S	*	.	H	α-helix	trans	-63.2	-41.9	175	-172	66	-166.5	0	0	112	Q404 Q410 L411 R412	Q404-E408 WeakPolarHBondContact O-CB 3.34Å; Q404-E408 PolarHBondContact O-N 3.24Å; E408-Q410 VanDerWaalsContact C-N 3.34Å; E408-Q410 PolarHBondContact O-N 3.44Å; E408-L411 PolarHBondContact O-N 2.69Å; E408-R412 VanDerWaalsContact O-CB 3.24Å; E408-R412 WeakPolarHBondContact O-CB 3.47Å; E408-R412 PolarHBondContact O-N 2.7Å
409	C	95.3	Very high	95.3	Very high	75 Å²	75	105 Å²	105	51%	0.507	51%	0.509	S	S	.	.	H	α-helix	trans	-63.5	-37.8	174.2	-75.6	0	0	0	0	112.6	L405 K406 Q413	L405-C409 VanDerWaalsContact O-CB 3.31Å; L405-C409 WeakPolarHBondContact O-CB 3.46Å; L405-C409 PolarHBondContact O-N 3.35Å; L405-C409 PolarHBondContact O-SG 3.35Å; K406-C409 PolarHBondContact O-N 2.87Å; C409-Q413 WeakPolarHBondContact O-CB 3.41Å; C409-Q413 PolarHBondContact O-N 2.92Å
410	Q	96.1	Very high	95.4	Very high	103 Å²	103	105.3 Å²	105.3	48%	0.481	51%	0.514	S	S	.	.	H	α-helix	trans	-67.7	-50.5	175.4	-174.8	63.5	57.9	0	0	110.8	K406 E407 E408 R412 Q413 D414	K406-Q410 WeakPolarHBondContact O-CB 3.31Å; K406-Q410 PolarHBondContact O-N 3.01Å; E407-Q410 PolarHBondContact O-N 3.48Å; E408-Q410 VanDerWaalsContact C-N 3.34Å; E408-Q410 PolarHBondContact O-N 3.44Å; Q410-R412 PolarHBondContact O-N 3.4Å; Q410-Q413 WeakPolarHBondContact O-CB 3.41Å; Q410-Q413 PolarHBondContact O-N 3.11Å; Q410-D414 PolarHBondContact NE2-OD1 2.86Å; Q410-D414 PolarHBondContact O-N 3.18Å
411	L	96.6	Very high	95.4	Very high	109 Å²	109	104.3 Å²	104.3	57%	0.571	52%	0.518	S	S	*	.	H	α-helix	trans	-57.5	-39.9	179.9	-159.3	79.2	0	0	0	111.4	E407 E408 D414 V415	E407-L411 WeakPolarHBondContact O-CB 3.27Å; E407-L411 PolarHBondContact O-N 3.25Å; E408-L411 PolarHBondContact O-N 2.69Å; L411-D414 PolarHBondContact O-N 2.86Å; L411-V415 WeakPolarHBondContact O-CG2 3.46Å; L411-V415 PolarHBondContact O-N 3.34Å
412	R	95.8	Very high	95.6	Very high	168 Å²	168	106 Å²	106	63%	0.634	52%	0.517	S	S	*	.	H	α-helix	trans	-66.5	-42.7	174.3	-176.3	176.6	176.8	160.5	5.8	112.7	E408 Q410 D414 V415 E416	E408-R412 VanDerWaalsContact O-CB 3.24Å; E408-R412 WeakPolarHBondContact O-CB 3.47Å; E408-R412 PolarHBondContact O-N 2.7Å; Q410-R412 PolarHBondContact O-N 3.4Å; R412-D414 VanDerWaalsContact C-N 3.3Å; R412-D414 PolarHBondContact O-N 3.23Å; R412-V415 PolarHBondContact O-N 3.02Å; R412-E416 IonicContact CZ-OE1 3.8Å; R412-E416 IonicContact NE-OE1 3.47Å; R412-E416 PolarHBondContact NE-OE1 2.74Å; R412-E416 IonicContact NH2-OE1 3.06Å; R412-E416 WeakPolarHBondContact O-CB 3.39Å; R412-E416 WeakPolarHBondContact O-CG 3.26Å; R412-E416 PolarHBondContact O-N 2.68Å
413	Q	96.1	Very high	95.7	Very high	92 Å²	92	101.1 Å²	101.1	43%	0.43	51%	0.506	S	S	.	.	H	α-helix	trans	-62.8	-39	175.4	-175.7	63.3	82	0	0	111.4	C409 Q410 E416 N417	C409-Q413 WeakPolarHBondContact O-CB 3.41Å; C409-Q413 PolarHBondContact O-N 2.92Å; Q410-Q413 WeakPolarHBondContact O-CB 3.41Å; Q410-Q413 PolarHBondContact O-N 3.11Å; Q413-E416 PolarHBondContact O-N 2.68Å; Q413-N417 PolarHBondContact NE2-OD1 2.88Å; Q413-N417 VanDerWaalsContact NE2-OD1 3.09Å; Q413-N417 WeakPolarHBondContact O-CB 3.26Å; Q413-N417 PolarHBondContact O-N 2.81Å; Q413-N417 PolarHBondContact O-ND2 3.28Å; Q413-N417 PolarHBondContact O-OD1 3.39Å
414	D	96.6	Very high	95.7	Very high	76 Å²	76	98.3 Å²	98.3	41%	0.406	50%	0.503	S	S	.	.	H	α-helix	trans	-66.2	-40.7	177.7	-61.1	-23.9	0	0	0	111.2	Q410 L411 R412 N417 E418	Q410-D414 PolarHBondContact NE2-OD1 2.86Å; Q410-D414 PolarHBondContact O-N 3.18Å; L411-D414 PolarHBondContact O-N 2.86Å; R412-D414 VanDerWaalsContact C-N 3.3Å; R412-D414 PolarHBondContact O-N 3.23Å; D414-N417 PolarHBondContact O-N 3.19Å; D414-E418 WeakPolarHBondContact O-CB 3.29Å; D414-E418 PolarHBondContact O-N 3.04Å
415	V	96.4	Very high	95.8	Very high	95 Å²	95	98.4 Å²	98.4	58%	0.576	51%	0.505	S	S	*	.	H	α-helix	trans	-67.2	-38.8	172.9	169.5	0	0	0	0	112.3	L411 R412 N417 L419	L411-V415 WeakPolarHBondContact O-CG2 3.46Å; L411-V415 PolarHBondContact O-N 3.34Å; R412-V415 PolarHBondContact O-N 3.02Å; V415-N417 VanDerWaalsContact C-N 3.34Å; V415-L419 VanDerWaalsContact O-CB 3.31Å; V415-L419 WeakPolarHBondContact O-CB 3.44Å; V415-L419 PolarHBondContact O-N 2.81Å
416	E	95.3	Very high	95.9	Very high	84 Å²	84	98.6 Å²	98.6	39%	0.393	50%	0.501	S	S	.	.	H	α-helix	trans	-67	-36	175	-74.5	175.6	-165.2	0	0	111.2	R412 Q413 V420	R412-E416 IonicContact CZ-OE1 3.8Å; R412-E416 IonicContact NE-OE1 3.47Å; R412-E416 PolarHBondContact NE-OE1 2.74Å; R412-E416 IonicContact NH2-OE1 3.06Å; R412-E416 WeakPolarHBondContact O-CB 3.39Å; R412-E416 WeakPolarHBondContact O-CG 3.26Å; R412-E416 PolarHBondContact O-N 2.68Å; Q413-E416 PolarHBondContact O-N 2.68Å; E416-V420 WeakPolarHBondContact O-CG2 3.4Å; E416-V420 PolarHBondContact O-N 3.16Å; E416-V420 VanDerWaalsContact O-N 3.11Å
417	N	95.4	Very high	96	Very high	87 Å²	87	97.1 Å²	97.1	47%	0.465	50%	0.497	S	S	.	.	H	α-helix	trans	-66.2	-47.3	173.5	-66.7	-20.7	0	0	0	112.1	Q413 D414 V415 L419 V420 A421	Q413-N417 PolarHBondContact NE2-OD1 2.88Å; Q413-N417 VanDerWaalsContact NE2-OD1 3.09Å; Q413-N417 WeakPolarHBondContact O-CB 3.26Å; Q413-N417 PolarHBondContact O-N 2.81Å; Q413-N417 PolarHBondContact O-ND2 3.28Å; Q413-N417 PolarHBondContact O-OD1 3.39Å; D414-N417 PolarHBondContact O-N 3.19Å; V415-N417 VanDerWaalsContact C-N 3.34Å; N417-L419 VanDerWaalsContact C-N 3.33Å; N417-L419 PolarHBondContact O-N 3.26Å; N417-V420 PolarHBondContact O-N 2.66Å; N417-A421 PolarHBondContact O-N 3.05Å
418	E	97.1	Very high	95.9	Very high	103 Å²	103	98 Å²	98	48%	0.481	50%	0.501	S	S	.	.	H	α-helix	trans	-61.5	-40.8	175.8	178	59	-154.8	0	0	111.1	D414 V420 A421 Q422	D414-E418 WeakPolarHBondContact O-CB 3.29Å; D414-E418 PolarHBondContact O-N 3.04Å; E418-V420 VanDerWaalsContact C-N 3.32Å; E418-V420 PolarHBondContact O-N 3.47Å; E418-A421 WeakPolarHBondContact O-CB 3.42Å; E418-A421 PolarHBondContact O-N 2.97Å; E418-Q422 HydrophobicContact CG-CG 4.37Å; E418-Q422 WeakPolarHBondContact O-CB 3.41Å; E418-Q422 VanDerWaalsContact O-CG 3.28Å; E418-Q422 WeakPolarHBondContact O-CG 3.28Å; E418-Q422 PolarHBondContact O-N 3.25Å; E418-Q422 WeakPolarHBondContact OE1-CG 3.48Å; E418-Q422 PolarHBondContact OE1-NE2 3.23Å
419	L	95.9	Very high	96	Very high	109 Å²	109	98.4 Å²	98.4	57%	0.571	50%	0.504	S	S	*	.	H	α-helix	trans	-61.1	-40	175.6	-179.5	61.1	0	0	0	112.1	V415 N417 V423	V415-L419 VanDerWaalsContact O-CB 3.31Å; V415-L419 WeakPolarHBondContact O-CB 3.44Å; V415-L419 PolarHBondContact O-N 2.81Å; N417-L419 VanDerWaalsContact C-N 3.33Å; N417-L419 PolarHBondContact O-N 3.26Å; L419-V423 HydrophobicContact CD1-CG2 4.48Å; L419-V423 WeakPolarHBondContact O-CB 3.49Å; L419-V423 VanDerWaalsContact O-CG2 3.27Å; L419-V423 WeakPolarHBondContact O-CG2 3.46Å; L419-V423 PolarHBondContact O-N 2.99Å
420	V	96.3	Very high	96	Very high	104 Å²	104	98.1 Å²	98.1	63%	0.63	50%	0.496	S	S	*	.	H	α-helix	trans	-64.6	-42.1	174.2	169.7	0	0	0	0	111.3	E416 N417 E418 V423 S424	E416-V420 WeakPolarHBondContact O-CG2 3.4Å; E416-V420 PolarHBondContact O-N 3.16Å; E416-V420 VanDerWaalsContact O-N 3.11Å; N417-V420 PolarHBondContact O-N 2.66Å; E418-V420 VanDerWaalsContact C-N 3.32Å; E418-V420 PolarHBondContact O-N 3.47Å; V420-V423 PolarHBondContact O-N 3.47Å; V420-S424 PolarHBondContact O-N 3.31Å
421	A	95.1	Very high	96	Very high	50 Å²	50	98.4 Å²	98.4	41%	0.413	50%	0.5	S	S	.	.	H	α-helix	trans	-62.6	-46	176	0	0	0	0	0	112.2	N417 E418 V423 S424 M425	N417-A421 PolarHBondContact O-N 3.05Å; E418-A421 WeakPolarHBondContact O-CB 3.42Å; E418-A421 PolarHBondContact O-N 2.97Å; A421-V423 VanDerWaalsContact C-N 3.31Å; A421-V423 PolarHBondContact O-N 2.95Å; A421-S424 PolarHBondContact O-N 2.97Å; A421-M425 WeakPolarHBondContact O-CB 3.26Å; A421-M425 PolarHBondContact O-N 3.06Å
422	Q	95.8	Very high	95.9	Very high	91 Å²	91	95.9 Å²	95.9	43%	0.425	50%	0.495	S	S	.	.	H	α-helix	trans	-60.3	-38.6	175	-69.6	-69.6	-22.9	0	0	112.1	E418 K426	E418-Q422 HydrophobicContact CG-CG 4.37Å; E418-Q422 WeakPolarHBondContact O-CB 3.41Å; E418-Q422 VanDerWaalsContact O-CG 3.28Å; E418-Q422 WeakPolarHBondContact O-CG 3.28Å; E418-Q422 PolarHBondContact O-N 3.25Å; E418-Q422 WeakPolarHBondContact OE1-CG 3.48Å; E418-Q422 PolarHBondContact OE1-NE2 3.23Å; Q422-K426 VanDerWaalsContact O-CB 3.26Å; Q422-K426 WeakPolarHBondContact O-CB 3.46Å; Q422-K426 PolarHBondContact O-N 2.91Å
423	V	96.1	Very high	96	Very high	69 Å²	69	92.7 Å²	92.7	42%	0.418	49%	0.488	S	S	.	.	H	α-helix	trans	-67.1	-42.3	175.4	168.4	0	0	0	0	111.7	L419 V420 A421 K426 Q427	L419-V423 HydrophobicContact CD1-CG2 4.48Å; L419-V423 WeakPolarHBondContact O-CB 3.49Å; L419-V423 VanDerWaalsContact O-CG2 3.27Å; L419-V423 WeakPolarHBondContact O-CG2 3.46Å; L419-V423 PolarHBondContact O-N 2.99Å; V420-V423 PolarHBondContact O-N 3.47Å; A421-V423 VanDerWaalsContact C-N 3.31Å; A421-V423 PolarHBondContact O-N 2.95Å; V423-K426 PolarHBondContact O-N 3.4Å; V423-Q427 WeakPolarHBondContact O-CG 3.5Å; V423-Q427 PolarHBondContact O-N 3.02Å
424	S	95.6	Very high	96	Very high	53 Å²	53	93.3 Å²	93.3	37%	0.371	49%	0.49	S	S	.	.	H	α-helix	trans	-62	-52.1	174.9	-164	0	0	0	0	111.2	V420 A421 K426 Q427 E428	V420-S424 PolarHBondContact O-N 3.31Å; A421-S424 PolarHBondContact O-N 2.97Å; S424-K426 VanDerWaalsContact C-N 3.26Å; S424-K426 PolarHBondContact O-N 2.86Å; S424-Q427 WeakPolarHBondContact O-CA 3.49Å; S424-Q427 WeakPolarHBondContact O-CB 3.5Å; S424-Q427 PolarHBondContact O-N 2.95Å; S424-E428 WeakPolarHBondContact O-CG 3.34Å; S424-E428 PolarHBondContact O-N 2.92Å; S424-E428 PolarHBondContact OG-OE1 3.17Å
425	M	96.3	Very high	95.9	Very high	107 Å²	107	94.8 Å²	94.8	53%	0.527	50%	0.497	S	S	.	.	H	α-helix	trans	-61.5	-33.8	-179.2	-171.6	170.6	61	0	0	112.1	A421 M429	A421-M425 WeakPolarHBondContact O-CB 3.26Å; A421-M425 PolarHBondContact O-N 3.06Å; M425-M429 VanDerWaalsContact O-CB 3.27Å; M425-M429 WeakPolarHBondContact O-CB 3.3Å; M425-M429 PolarHBondContact O-N 2.86Å
426	K	96.3	Very high	95.9	Very high	116 Å²	116	95.1 Å²	95.1	50%	0.504	50%	0.495	S	S	.	.	H	α-helix	trans	-66.3	-41.6	171.2	-176.2	175.4	-175	-75.9	0	112.5	Q422 V423 S424 M429 E430	Q422-K426 VanDerWaalsContact O-CB 3.26Å; Q422-K426 WeakPolarHBondContact O-CB 3.46Å; Q422-K426 PolarHBondContact O-N 2.91Å; V423-K426 PolarHBondContact O-N 3.4Å; S424-K426 VanDerWaalsContact C-N 3.26Å; S424-K426 PolarHBondContact O-N 2.86Å; K426-M429 PolarHBondContact O-N 2.75Å; K426-E430 IonicContact NZ-OE1 2.65Å; K426-E430 PolarHBondContact NZ-OE1 2.96Å; K426-E430 WeakPolarHBondContact O-CB 3.42Å; K426-E430 WeakPolarHBondContact O-CG 3.32Å; K426-E430 PolarHBondContact O-N 3.3Å
427	Q	96	Very high	96	Very high	127 Å²	127	95.4 Å²	95.4	59%	0.593	50%	0.496	S	S	*	.	H	α-helix	trans	-65.9	-41.5	177.3	-71.6	174.7	18.8	0	0	111.6	V423 S424 E430 L431	V423-Q427 WeakPolarHBondContact O-CG 3.5Å; V423-Q427 PolarHBondContact O-N 3.02Å; S424-Q427 WeakPolarHBondContact O-CA 3.49Å; S424-Q427 WeakPolarHBondContact O-CB 3.5Å; S424-Q427 PolarHBondContact O-N 2.95Å; Q427-E430 PolarHBondContact O-N 3.27Å; Q427-L431 WeakPolarHBondContact O-CB 3.44Å; Q427-L431 PolarHBondContact O-N 3.43Å
428	E	96	Very high	96	Very high	117 Å²	117	96.5 Å²	96.5	55%	0.547	50%	0.497	S	S	.	.	H	α-helix	trans	-62.6	-45	173.9	-70.3	165.9	-130.6	0	0	111.6	S424 L431 A432	S424-E428 WeakPolarHBondContact O-CG 3.34Å; S424-E428 PolarHBondContact O-N 2.92Å; S424-E428 PolarHBondContact OG-OE1 3.17Å; E428-L431 PolarHBondContact O-N 2.87Å; E428-A432 WeakPolarHBondContact O-CB 3.42Å; E428-A432 PolarHBondContact O-N 3.44Å
429	M	95.1	Very high	96	Very high	131 Å²	131	94.2 Å²	94.2	65%	0.645	49%	0.488	S	S	*	.	H	α-helix	trans	-65.1	-40.3	176.1	-175.9	170.2	61.1	0	0	112.4	M425 K426 L431 A432 M433	M425-M429 VanDerWaalsContact O-CB 3.27Å; M425-M429 WeakPolarHBondContact O-CB 3.3Å; M425-M429 PolarHBondContact O-N 2.86Å; K426-M429 PolarHBondContact O-N 2.75Å; M429-L431 VanDerWaalsContact C-N 3.34Å; M429-A432 PolarHBondContact O-N 3.04Å; M429-M433 WeakPolarHBondContact O-CB 3.25Å; M429-M433 PolarHBondContact O-N 3.09Å
430	E	96.1	Very high	96.1	Very high	70 Å²	70	92.6 Å²	92.6	33%	0.327	48%	0.479	S	S	.	.	H	α-helix	trans	-64.7	-36	173.6	-82.8	-170.4	-146.6	0	0	112.7	K426 Q427 K434	K426-E430 IonicContact NZ-OE1 2.65Å; K426-E430 PolarHBondContact NZ-OE1 2.96Å; K426-E430 WeakPolarHBondContact O-CB 3.42Å; K426-E430 WeakPolarHBondContact O-CG 3.32Å; K426-E430 PolarHBondContact O-N 3.3Å; Q427-E430 PolarHBondContact O-N 3.27Å; E430-K434 VanDerWaalsContact O-CD 3.3Å; E430-K434 WeakPolarHBondContact O-CD 3.41Å; E430-K434 VanDerWaalsContact O-CG 3.25Å; E430-K434 WeakPolarHBondContact O-CG 3.34Å; E430-K434 PolarHBondContact O-N 2.98Å; E430-K434 VanDerWaalsContact O-N 3.09Å; E430-K434 IonicContact OE2-NZ 3.16Å; E430-K434 PolarHBondContact OE2-NZ 3.35Å
431	L	96	Very high	96.1	Very high	108 Å²	108	93 Å²	93	57%	0.565	47%	0.474	S	S	*	.	H	α-helix	trans	-68.8	-45.9	175.2	-179.5	62	0	0	0	111	Q427 E428 M429 M433 K434 L435	Q427-L431 WeakPolarHBondContact O-CB 3.44Å; Q427-L431 PolarHBondContact O-N 3.43Å; E428-L431 PolarHBondContact O-N 2.87Å; M429-L431 VanDerWaalsContact C-N 3.34Å; L431-M433 VanDerWaalsContact C-N 3.32Å; L431-M433 PolarHBondContact O-N 2.92Å; L431-K434 PolarHBondContact O-N 2.75Å; L431-L435 HydrophobicContact CG-CD1 4.27Å; L431-L435 WeakPolarHBondContact O-CG 3.27Å; L431-L435 PolarHBondContact O-N 2.87Å
432	A	95.1	Very high	96.1	Very high	57 Å²	57	95.4 Å²	95.4	47%	0.471	48%	0.476	S	S	.	.	H	α-helix	trans	-60.4	-40.8	175.5	0	0	0	0	0	111.9	E428 M429 L435 L436	E428-A432 WeakPolarHBondContact O-CB 3.42Å; E428-A432 PolarHBondContact O-N 3.44Å; M429-A432 PolarHBondContact O-N 3.04Å; A432-L435 PolarHBondContact O-N 3.44Å; A432-L436 WeakPolarHBondContact O-CB 3.47Å; A432-L436 PolarHBondContact O-N 3.46Å
433	M	96.6	Very high	96.1	Very high	100 Å²	100	96.6 Å²	96.6	49%	0.493	48%	0.48	S	S	.	.	H	α-helix	trans	-62.3	-47.6	175.3	-167.5	-179.5	83.6	0	0	111.5	M429 L431 L435 L436 E437	M429-M433 WeakPolarHBondContact O-CB 3.25Å; M429-M433 PolarHBondContact O-N 3.09Å; L431-M433 VanDerWaalsContact C-N 3.32Å; L431-M433 PolarHBondContact O-N 2.92Å; M433-L435 VanDerWaalsContact C-N 3.3Å; M433-L435 PolarHBondContact O-N 2.88Å; M433-L436 PolarHBondContact O-N 3.41Å; M433-L436 VanDerWaalsContact O-N 3.16Å; M433-E437 WeakPolarHBondContact O-CB 3.44Å; M433-E437 WeakPolarHBondContact O-CG 3.37Å; M433-E437 PolarHBondContact O-N 2.9Å
434	K	96.4	Very high	96.1	Very high	106 Å²	106	98.1 Å²	98.1	46%	0.461	48%	0.483	S	S	.	.	H	α-helix	trans	-62.8	-34.5	177.5	-71.5	160.3	-168.9	153.1	0	112.8	E430 L431 K438	E430-K434 VanDerWaalsContact O-CD 3.3Å; E430-K434 WeakPolarHBondContact O-CD 3.41Å; E430-K434 VanDerWaalsContact O-CG 3.25Å; E430-K434 WeakPolarHBondContact O-CG 3.34Å; E430-K434 PolarHBondContact O-N 2.98Å; E430-K434 VanDerWaalsContact O-N 3.09Å; E430-K434 IonicContact OE2-NZ 3.16Å; E430-K434 PolarHBondContact OE2-NZ 3.35Å; L431-K434 PolarHBondContact O-N 2.75Å; K434-K438 WeakPolarHBondContact O-CB 3.43Å; K434-K438 PolarHBondContact O-N 3.05Å
435	L	96	Very high	96.1	Very high	106 Å²	106	100.9 Å²	100.9	56%	0.555	49%	0.493	S	S	*	.	H	α-helix	trans	-69.6	-40.2	173.9	-71	170.7	0	0	0	112	L431 A432 M433 K438 D439	L431-L435 HydrophobicContact CG-CD1 4.27Å; L431-L435 WeakPolarHBondContact O-CG 3.27Å; L431-L435 PolarHBondContact O-N 2.87Å; A432-L435 PolarHBondContact O-N 3.44Å; M433-L435 VanDerWaalsContact C-N 3.3Å; M433-L435 PolarHBondContact O-N 2.88Å; L435-K438 PolarHBondContact O-N 3.37Å; L435-D439 WeakPolarHBondContact O-CB 3.33Å; L435-D439 PolarHBondContact O-N 2.76Å
436	L	96.4	Very high	96.1	Very high	102 Å²	102	99.9 Å²	99.9	53%	0.534	49%	0.494	S	S	.	.	H	α-helix	trans	-68.4	-41.7	175.4	-176.4	64.4	0	0	0	112	A432 M433 K438 D439 I440	A432-L436 WeakPolarHBondContact O-CB 3.47Å; A432-L436 PolarHBondContact O-N 3.46Å; M433-L436 PolarHBondContact O-N 3.41Å; M433-L436 VanDerWaalsContact O-N 3.16Å; L436-K438 VanDerWaalsContact C-N 3.32Å; L436-K438 PolarHBondContact O-N 3.44Å; L436-D439 PolarHBondContact O-N 2.8Å; L436-I440 HydrophobicContact CD1-CD1 4.42Å; L436-I440 HydrophobicContact CG-CD1 4.03Å; L436-I440 WeakPolarHBondContact O-CB 3.24Å; L436-I440 VanDerWaalsContact O-CG1 3.24Å; L436-I440 WeakPolarHBondContact O-CG1 3.44Å; L436-I440 PolarHBondContact O-N 3.34Å
437	E	96.3	Very high	96.1	Very high	90 Å²	90	98.6 Å²	98.6	42%	0.421	49%	0.492	S	S	.	.	H	α-helix	trans	-56.6	-46.2	171.5	-74.7	172.2	160.8	0	0	110.7	M433 I440 H441	M433-E437 WeakPolarHBondContact O-CB 3.44Å; M433-E437 WeakPolarHBondContact O-CG 3.37Å; M433-E437 PolarHBondContact O-N 2.9Å; E437-I440 PolarHBondContact O-N 3.16Å; E437-H441 PolarHBondContact O-N 2.94Å; E437-H441 PolarHBondContact O-ND1 3Å
438	K	96.6	Very high	96.2	Very high	111 Å²	111	97.5 Å²	97.5	48%	0.483	49%	0.489	S	S	.	.	H	α-helix	trans	-60.8	-49.2	176.3	-179.6	179.3	176.7	-79.4	0	112.3	K434 L435 L436 I440 H441 E442	K434-K438 WeakPolarHBondContact O-CB 3.43Å; K434-K438 PolarHBondContact O-N 3.05Å; L435-K438 PolarHBondContact O-N 3.37Å; L436-K438 VanDerWaalsContact C-N 3.32Å; L436-K438 PolarHBondContact O-N 3.44Å; K438-I440 VanDerWaalsContact C-N 3.28Å; K438-I440 PolarHBondContact O-N 2.63Å; K438-H441 PolarHBondContact O-N 3.19Å; K438-H441 VanDerWaalsContact O-N 3.12Å; K438-E442 WeakPolarHBondContact CE-OE1 3.47Å; K438-E442 HydrophobicContact CG-CG 4.49Å; K438-E442 IonicContact NZ-OE1 3.38Å; K438-E442 PolarHBondContact NZ-OE1 3.27Å; K438-E442 IonicContact NZ-OE2 3.43Å; K438-E442 PolarHBondContact NZ-OE2 3.12Å; K438-E442 PolarHBondContact O-N 3.37Å
439	D	96.9	Very high	96.2	Very high	55 Å²	55	93.4 Å²	93.4	29%	0.294	48%	0.478	S	S	.	.	H	α-helix	trans	-59	-38.4	177.5	170.1	79.5	0	0	0	112.1	L435 L436 K443	L435-D439 WeakPolarHBondContact O-CB 3.33Å; L435-D439 PolarHBondContact O-N 2.76Å; L436-D439 PolarHBondContact O-N 2.8Å; D439-K443 VanDerWaalsContact O-CB 3.3Å; D439-K443 WeakPolarHBondContact O-CB 3.47Å; D439-K443 WeakPolarHBondContact O-CD 3.29Å; D439-K443 VanDerWaalsContact O-CG 3.27Å; D439-K443 WeakPolarHBondContact O-CG 3.3Å; D439-K443 PolarHBondContact O-N 3.43Å; D439-K443 WeakPolarHBondContact OD1-CE 3.37Å; D439-K443 IonicContact OD1-NZ 3.45Å; D439-K443 PolarHBondContact OD1-NZ 2.92Å; D439-K443 WeakPolarHBondContact OD2-CE 3.47Å; D439-K443 IonicContact OD2-NZ 3.87Å; D439-K443 PolarHBondContact OD2-NZ 2.97Å
440	I	96.4	Very high	96.2	Very high	75 Å²	75	92.5 Å²	92.5	39%	0.385	48%	0.476	S	S	.	.	H	α-helix	trans	-63.6	-43.1	173.8	-72.2	166	0	0	0	111.4	L436 E437 K438 K443 Q444	L436-I440 HydrophobicContact CD1-CD1 4.42Å; L436-I440 HydrophobicContact CG-CD1 4.03Å; L436-I440 WeakPolarHBondContact O-CB 3.24Å; L436-I440 VanDerWaalsContact O-CG1 3.24Å; L436-I440 WeakPolarHBondContact O-CG1 3.44Å; L436-I440 PolarHBondContact O-N 3.34Å; E437-I440 PolarHBondContact O-N 3.16Å; K438-I440 VanDerWaalsContact C-N 3.28Å; K438-I440 PolarHBondContact O-N 2.63Å; I440-K443 PolarHBondContact O-N 2.88Å; I440-Q444 VanDerWaalsContact O-CG 3.29Å; I440-Q444 WeakPolarHBondContact O-CG 3.07Å; I440-Q444 PolarHBondContact O-N 3.16Å
441	H	96.4	Very high	96.2	Very high	113 Å²	113	96.8 Å²	96.8	52%	0.523	49%	0.489	S	S	.	.	H	α-helix	trans	-66.8	-45.6	176.8	-72.3	85.1	0	0	0	111.8	E437 K438 K443 Q444 D445	E437-H441 PolarHBondContact O-N 2.94Å; E437-H441 PolarHBondContact O-ND1 3Å; K438-H441 PolarHBondContact O-N 3.19Å; K438-H441 VanDerWaalsContact O-N 3.12Å; H441-K443 PolarHBondContact O-N 2.83Å; H441-Q444 PolarHBondContact O-N 2.78Å; H441-D445 PolarHBondContact O-N 2.74Å
442	E	95.9	Very high	96.3	Very high	99 Å²	99	97.4 Å²	97.4	46%	0.463	49%	0.488	S	S	.	.	H	α-helix	trans	-60.6	-34.1	176.5	-70.5	178.9	143.7	0	0	112	K438 T446	K438-E442 WeakPolarHBondContact CE-OE1 3.47Å; K438-E442 HydrophobicContact CG-CG 4.49Å; K438-E442 IonicContact NZ-OE1 3.38Å; K438-E442 PolarHBondContact NZ-OE1 3.27Å; K438-E442 IonicContact NZ-OE2 3.43Å; K438-E442 PolarHBondContact NZ-OE2 3.12Å; K438-E442 PolarHBondContact O-N 3.37Å; E442-T446 PolarHBondContact O-N 3.22Å; E442-T446 VanDerWaalsContact O-N 3.16Å; E442-T446 PolarHBondContact O-OG1 2.9Å
443	K	95.4	Very high	96.3	Very high	117 Å²	117	100 Å²	100	51%	0.509	49%	0.491	S	S	.	.	H	α-helix	trans	-74	-31	172.3	-75.8	168.1	178.9	161.7	0	113.7	D439 I440 H441 T446 L447	D439-K443 VanDerWaalsContact O-CB 3.3Å; D439-K443 WeakPolarHBondContact O-CB 3.47Å; D439-K443 WeakPolarHBondContact O-CD 3.29Å; D439-K443 VanDerWaalsContact O-CG 3.27Å; D439-K443 WeakPolarHBondContact O-CG 3.3Å; D439-K443 PolarHBondContact O-N 3.43Å; D439-K443 WeakPolarHBondContact OD1-CE 3.37Å; D439-K443 IonicContact OD1-NZ 3.45Å; D439-K443 PolarHBondContact OD1-NZ 2.92Å; D439-K443 WeakPolarHBondContact OD2-CE 3.47Å; D439-K443 IonicContact OD2-NZ 3.87Å; D439-K443 PolarHBondContact OD2-NZ 2.97Å; I440-K443 PolarHBondContact O-N 2.88Å; H441-K443 PolarHBondContact O-N 2.83Å; K443-T446 WeakPolarHBondContact CA-OG1 3.27Å; K443-T446 PolarHBondContact O-OG1 3.38Å; K443-L447 WeakPolarHBondContact O-CB 3.14Å; K443-L447 PolarHBondContact O-N 2.97Å; K443-L447 VanDerWaalsContact O-N 3.09Å
444	Q	96.3	Very high	96.3	Very high	101 Å²	101	99.8 Å²	99.8	47%	0.472	49%	0.491	S	S	.	.	H	α-helix	trans	-70.8	-45	173	-76	175.8	18.1	0	0	111.3	I440 H441 L447 I448	I440-Q444 VanDerWaalsContact O-CG 3.29Å; I440-Q444 WeakPolarHBondContact O-CG 3.07Å; I440-Q444 PolarHBondContact O-N 3.16Å; H441-Q444 PolarHBondContact O-N 2.78Å; Q444-L447 CarbonylContact O-C 3.55Å; Q444-L447 PolarHBondContact O-N 2.96Å; Q444-I448 VanDerWaalsContact O-CG1 3.3Å; Q444-I448 WeakPolarHBondContact O-CG1 3.45Å; Q444-I448 PolarHBondContact O-N 2.69Å
445	D	96	Very high	96.3	Very high	110 Å²	110	98.9 Å²	98.9	59%	0.588	49%	0.491	S	S	*	.	H	α-helix	trans	-62.3	-44.4	177.9	-74.1	-23.4	0	0	0	112	H441 L447 I448 G449	H441-D445 PolarHBondContact O-N 2.74Å; D445-L447 VanDerWaalsContact C-N 3.35Å; D445-L447 PolarHBondContact O-N 3.35Å; D445-I448 PolarHBondContact O-N 3.19Å; D445-G449 PolarHBondContact O-N 3.1Å
446	T	95.6	Very high	96.4	Very high	87 Å²	87	98.5 Å²	98.5	53%	0.534	49%	0.487	S	S	.	.	H	α-helix	trans	-65.4	-36.2	174.3	45.2	0	0	0	0	112.5	E442 K443 G449 L450	E442-T446 PolarHBondContact O-N 3.22Å; E442-T446 VanDerWaalsContact O-N 3.16Å; E442-T446 PolarHBondContact O-OG1 2.9Å; K443-T446 WeakPolarHBondContact CA-OG1 3.27Å; K443-T446 PolarHBondContact O-OG1 3.38Å; T446-G449 PolarHBondContact O-N 3.09Å; T446-L450 WeakPolarHBondContact O-CB 3.48Å; T446-L450 VanDerWaalsContact O-CG 3.31Å; T446-L450 WeakPolarHBondContact O-CG 3.28Å; T446-L450 PolarHBondContact O-N 3.25Å
447	L	97	Very high	96.3	Very high	88 Å²	88	97.9 Å²	97.9	46%	0.461	49%	0.487	S	S	.	.	H	α-helix	trans	-68.4	-32	173.6	177.6	148.9	0	0	0	112.9	K443 Q444 D445 R451	K443-L447 WeakPolarHBondContact O-CB 3.14Å; K443-L447 PolarHBondContact O-N 2.97Å; K443-L447 VanDerWaalsContact O-N 3.09Å; Q444-L447 CarbonylContact O-C 3.55Å; Q444-L447 PolarHBondContact O-N 2.96Å; D445-L447 VanDerWaalsContact C-N 3.35Å; D445-L447 PolarHBondContact O-N 3.35Å; L447-R451 VanDerWaalsContact CD2-NE 3.28Å; L447-R451 VanDerWaalsContact O-CG 3.28Å; L447-R451 WeakPolarHBondContact O-CG 3.3Å; L447-R451 PolarHBondContact O-N 2.92Å; L447-R451 VanDerWaalsContact O-N 3.1Å
448	I	97.1	Very high	96.3	Very high	104 Å²	104	98.6 Å²	98.6	53%	0.533	49%	0.489	S	S	.	.	H	α-helix	trans	-67.6	-46.5	170.8	-70.5	162.8	0	0	0	110	Q444 D445 L450 R451 H452	Q444-I448 VanDerWaalsContact O-CG1 3.3Å; Q444-I448 WeakPolarHBondContact O-CG1 3.45Å; Q444-I448 PolarHBondContact O-N 2.69Å; D445-I448 PolarHBondContact O-N 3.19Å; I448-L450 PolarHBondContact O-N 3.45Å; I448-R451 WeakPolarHBondContact O-CB 3.47Å; I448-R451 PolarHBondContact O-N 3.25Å; I448-H452 PolarHBondContact O-N 3.45Å
449	G	96.6	Very high	96.3	Very high	32 Å²	32	96.2 Å²	96.2	33%	0.33	49%	0.49	S	S	.	.	H	α-helix	trans	-58.4	-45.1	175.6	0	0	0	0	0	113.1	D445 T446 R451 H452 Q453	D445-G449 PolarHBondContact O-N 3.1Å; T446-G449 PolarHBondContact O-N 3.09Å; G449-R451 VanDerWaalsContact C-N 3.34Å; G449-R451 PolarHBondContact O-N 2.91Å; G449-H452 PolarHBondContact O-N 2.87Å; G449-Q453 WeakPolarHBondContact O-CG 3.31Å; G449-Q453 PolarHBondContact O-N 3.48Å
450	L	95.6	Very high	96.2	Very high	112 Å²	112	98.7 Å²	98.7	59%	0.586	50%	0.502	S	S	*	.	H	α-helix	trans	-65.1	-34.2	176.2	-72.6	169.7	0	0	0	112.9	T446 I448 L454	T446-L450 WeakPolarHBondContact O-CB 3.48Å; T446-L450 VanDerWaalsContact O-CG 3.31Å; T446-L450 WeakPolarHBondContact O-CG 3.28Å; T446-L450 PolarHBondContact O-N 3.25Å; I448-L450 PolarHBondContact O-N 3.45Å; L450-L454 VanDerWaalsContact O-CB 3.31Å; L450-L454 WeakPolarHBondContact O-CB 3.48Å; L450-L454 PolarHBondContact O-N 2.98Å
451	R	96.6	Very high	96.1	Very high	159 Å²	159	98.8 Å²	98.8	60%	0.6	50%	0.503	S	S	*	.	H	α-helix	trans	-65.9	-43.1	172	-76.6	170.8	-176.4	-90.9	0.7	111.5	L447 I448 G449 L454 D455	L447-R451 VanDerWaalsContact CD2-NE 3.28Å; L447-R451 VanDerWaalsContact O-CG 3.28Å; L447-R451 WeakPolarHBondContact O-CG 3.3Å; L447-R451 PolarHBondContact O-N 2.92Å; L447-R451 VanDerWaalsContact O-N 3.1Å; I448-R451 WeakPolarHBondContact O-CB 3.47Å; I448-R451 PolarHBondContact O-N 3.25Å; G449-R451 VanDerWaalsContact C-N 3.34Å; G449-R451 PolarHBondContact O-N 2.91Å; R451-L454 PolarHBondContact O-N 2.63Å; R451-D455 PolarHBondContact O-N 3.36Å
452	H	96.7	Very high	96.1	Very high	121 Å²	121	97.3 Å²	97.3	56%	0.56	50%	0.502	S	S	*	.	H	α-helix	trans	-61.2	-49.6	177.6	-169.8	41.5	0	0	0	111.3	I448 G449 L454 D455 E456	I448-H452 PolarHBondContact O-N 3.45Å; G449-H452 PolarHBondContact O-N 2.87Å; H452-L454 VanDerWaalsContact C-N 3.3Å; H452-L454 PolarHBondContact O-N 2.97Å; H452-D455 PolarHBondContact O-N 3.04Å; H452-E456 WeakPolarHBondContact O-CG 3.49Å; H452-E456 PolarHBondContact O-N 3.46Å
453	Q	96.2	Very high	96.1	Very high	111 Å²	111	97 Å²	97	52%	0.519	50%	0.501	S	S	.	.	H	α-helix	trans	-57.9	-39.4	174.9	-71.7	176.9	-8.9	0	0	112.7	G449 D455 E456 V457	G449-Q453 WeakPolarHBondContact O-CG 3.31Å; G449-Q453 PolarHBondContact O-N 3.48Å; Q453-D455 VanDerWaalsContact C-N 3.31Å; Q453-D455 PolarHBondContact O-N 3.02Å; Q453-E456 PolarHBondContact O-N 3.02Å; Q453-V457 WeakPolarHBondContact O-CB 3.47Å; Q453-V457 VanDerWaalsContact O-CG2 3.28Å; Q453-V457 WeakPolarHBondContact O-CG2 3.31Å; Q453-V457 PolarHBondContact O-N 2.9Å
454	L	96.1	Very high	96.1	Very high	97 Å²	97	97.4 Å²	97.4	51%	0.508	51%	0.506	S	S	.	.	H	α-helix	trans	-64.5	-35.7	175.9	177.6	61.9	0	0	0	112.1	L450 R451 H452 K458	L450-L454 VanDerWaalsContact O-CB 3.31Å; L450-L454 WeakPolarHBondContact O-CB 3.48Å; L450-L454 PolarHBondContact O-N 2.98Å; R451-L454 PolarHBondContact O-N 2.63Å; H452-L454 VanDerWaalsContact C-N 3.3Å; H452-L454 PolarHBondContact O-N 2.97Å; L454-K458 VanDerWaalsContact O-CG 3.29Å; L454-K458 WeakPolarHBondContact O-CG 3.29Å; L454-K458 PolarHBondContact O-N 2.9Å
455	D	96.6	Very high	96	Very high	86 Å²	86	98.9 Å²	98.9	46%	0.46	51%	0.508	S	S	.	.	H	α-helix	trans	-78.1	-34	177.3	-69.4	-26.4	0	0	0	112.5	R451 H452 Q453 K458 A459	R451-D455 PolarHBondContact O-N 3.36Å; H452-D455 PolarHBondContact O-N 3.04Å; Q453-D455 VanDerWaalsContact C-N 3.31Å; Q453-D455 PolarHBondContact O-N 3.02Å; D455-K458 PolarHBondContact O-N 3.46Å; D455-K458 WeakPolarHBondContact OD1-CD 3.35Å; D455-K458 IonicContact OD1-NZ 3.82Å; D455-K458 PolarHBondContact OD1-NZ 3.27Å; D455-A459 PolarHBondContact O-N 3.33Å
456	E	97.2	Very high	95.9	Very high	98 Å²	98	99.1 Å²	99.1	46%	0.458	51%	0.505	S	S	.	.	H	α-helix	trans	-59.3	-48.1	166.8	-69.2	-178.7	128.2	0	0	111.3	H452 Q453 K458 A459 I460	H452-E456 WeakPolarHBondContact O-CG 3.49Å; H452-E456 PolarHBondContact O-N 3.46Å; Q453-E456 PolarHBondContact O-N 3.02Å; E456-K458 VanDerWaalsContact C-N 3.31Å; E456-K458 PolarHBondContact O-N 3.42Å; E456-A459 WeakPolarHBondContact O-CB 3.39Å; E456-A459 PolarHBondContact O-N 3.1Å; E456-A459 VanDerWaalsContact O-N 3.1Å; E456-I460 WeakPolarHBondContact O-CG1 3.28Å; E456-I460 PolarHBondContact O-N 2.92Å
457	V	95.6	Very high	95.9	Very high	89 Å²	89	101.1 Å²	101.1	54%	0.539	51%	0.507	S	S	.	.	H	α-helix	trans	-62.7	-36.7	177.8	168.5	0	0	0	0	111.6	Q453 N461	Q453-V457 WeakPolarHBondContact O-CB 3.47Å; Q453-V457 VanDerWaalsContact O-CG2 3.28Å; Q453-V457 WeakPolarHBondContact O-CG2 3.31Å; Q453-V457 PolarHBondContact O-N 2.9Å; V457-N461 VanDerWaalsContact O-CB 3.24Å; V457-N461 WeakPolarHBondContact O-CB 3.43Å; V457-N461 PolarHBondContact O-N 3.07Å
458	K	95.8	Very high	95.8	Very high	106 Å²	106	102.1 Å²	102.1	46%	0.461	51%	0.51	S	S	.	.	H	α-helix	trans	-62.6	-45.4	171	-73.1	167.2	-162	156.1	0	111.7	L454 D455 E456 N461 V462	L454-K458 VanDerWaalsContact O-CG 3.29Å; L454-K458 WeakPolarHBondContact O-CG 3.29Å; L454-K458 PolarHBondContact O-N 2.9Å; D455-K458 PolarHBondContact O-N 3.46Å; D455-K458 WeakPolarHBondContact OD1-CD 3.35Å; D455-K458 IonicContact OD1-NZ 3.82Å; D455-K458 PolarHBondContact OD1-NZ 3.27Å; E456-K458 VanDerWaalsContact C-N 3.31Å; E456-K458 PolarHBondContact O-N 3.42Å; K458-N461 PolarHBondContact O-N 3.27Å; K458-V462 WeakPolarHBondContact O-CG2 3.48Å; K458-V462 PolarHBondContact O-N 3.39Å
459	A	95.9	Very high	95.7	Very high	61 Å²	61	102.9 Å²	102.9	50%	0.504	51%	0.512	S	S	.	.	H	α-helix	trans	-61.7	-47.6	179.6	0	0	0	0	0	111.5	D455 E456 N461 V462 E463	D455-A459 PolarHBondContact O-N 3.33Å; E456-A459 WeakPolarHBondContact O-CB 3.39Å; E456-A459 PolarHBondContact O-N 3.1Å; E456-A459 VanDerWaalsContact O-N 3.1Å; A459-N461 VanDerWaalsContact C-N 3.31Å; A459-N461 PolarHBondContact O-N 2.93Å; A459-V462 PolarHBondContact O-N 3.27Å; A459-E463 WeakPolarHBondContact O-CB 3.19Å; A459-E463 PolarHBondContact O-N 2.94Å
460	I	95.3	Very high	95.6	Very high	107 Å²	107	104.8 Å²	104.8	55%	0.549	52%	0.52	S	S	.	.	H	α-helix	trans	-58.3	-42.7	174.9	-67.2	164.8	0	0	0	111	E456 E463 M464	E456-I460 WeakPolarHBondContact O-CG1 3.28Å; E456-I460 PolarHBondContact O-N 2.92Å; I460-E463 PolarHBondContact O-N 3.4Å; I460-M464 WeakPolarHBondContact O-CB 3.32Å; I460-M464 PolarHBondContact O-N 3.39Å
461	N	94.6	Very high	95.4	Very high	76 Å²	76	102.6 Å²	102.6	41%	0.406	51%	0.514	S	S	.	.	H	α-helix	trans	-65.1	-44.7	179	-165.1	4.3	0	0	0	111.5	V457 K458 A459 M464 Y465	V457-N461 VanDerWaalsContact O-CB 3.24Å; V457-N461 WeakPolarHBondContact O-CB 3.43Å; V457-N461 PolarHBondContact O-N 3.07Å; K458-N461 PolarHBondContact O-N 3.27Å; A459-N461 VanDerWaalsContact C-N 3.31Å; A459-N461 PolarHBondContact O-N 2.93Å; N461-M464 PolarHBondContact O-N 2.59Å; N461-Y465 WeakPolarHBondContact O-CD2 3.24Å; N461-Y465 PolarHBondContact O-N 2.98Å; N461-Y465 WeakPolarHBondContact OD1-CD2 3.37Å; N461-Y465 VanDerWaalsContact OD1-CE2 3.3Å; N461-Y465 WeakPolarHBondContact OD1-CE2 3.36Å
462	V	95.9	Very high	95.3	Very high	83 Å²	83	98.7 Å²	98.7	50%	0.503	51%	0.505	S	S	.	.	H	α-helix	trans	-61.5	-44.9	174.8	171	0	0	0	0	111.5	K458 A459 M464 Y465 Q466	K458-V462 WeakPolarHBondContact O-CG2 3.48Å; K458-V462 PolarHBondContact O-N 3.39Å; A459-V462 PolarHBondContact O-N 3.27Å; V462-M464 VanDerWaalsContact C-N 3.34Å; V462-M464 PolarHBondContact O-N 2.86Å; V462-Y465 PolarHBondContact O-N 2.78Å; V462-Q466 WeakPolarHBondContact O-CG 3.46Å; V462-Q466 PolarHBondContact O-N 3.32Å
463	E	95.7	Very high	95.2	Very high	93 Å²	93	98 Å²	98	44%	0.435	50%	0.502	S	S	.	.	H	α-helix	trans	-62	-41.4	176.4	-166	-164.7	149.8	0	0	111.6	A459 I460 Q466 K467	A459-E463 WeakPolarHBondContact O-CB 3.19Å; A459-E463 PolarHBondContact O-N 2.94Å; I460-E463 PolarHBondContact O-N 3.4Å; E463-Q466 PolarHBondContact O-N 3.47Å; E463-K467 HydrophobicContact CG-CD 4.34Å; E463-K467 WeakPolarHBondContact O-CB 3.43Å; E463-K467 WeakPolarHBondContact O-CG 3.23Å; E463-K467 PolarHBondContact O-N 3.47Å; E463-K467 WeakPolarHBondContact OE1-CE 3.38Å; E463-K467 IonicContact OE1-NZ 2.72Å; E463-K467 PolarHBondContact OE1-NZ 2.85Å
464	M	95	Very high	95.1	Very high	125 Å²	125	97.5 Å²	97.5	62%	0.616	50%	0.5	S	S	*	.	H	α-helix	trans	-66.7	-39.3	177.2	-167.7	170.3	74.1	0	0	111.9	I460 N461 V462 K467 M468	I460-M464 WeakPolarHBondContact O-CB 3.32Å; I460-M464 PolarHBondContact O-N 3.39Å; N461-M464 PolarHBondContact O-N 2.59Å; V462-M464 VanDerWaalsContact C-N 3.34Å; V462-M464 PolarHBondContact O-N 2.86Å; M464-K467 PolarHBondContact O-N 2.88Å; M464-M468 VanDerWaalsContact O-CB 3.23Å; M464-M468 WeakPolarHBondContact O-CB 3.47Å; M464-M468 PolarHBondContact O-N 3.32Å
465	Y	94.5	Very high	94.9	Very high	131 Å²	131	97.2 Å²	97.2	51%	0.514	50%	0.497	S	S	.	.	H	α-helix	trans	-62.2	-43.4	171.9	-94.7	-77.7	0	0	0	112.2	N461 V462 M468 Q469	N461-Y465 WeakPolarHBondContact O-CD2 3.24Å; N461-Y465 PolarHBondContact O-N 2.98Å; N461-Y465 WeakPolarHBondContact OD1-CD2 3.37Å; N461-Y465 VanDerWaalsContact OD1-CE2 3.3Å; N461-Y465 WeakPolarHBondContact OD1-CE2 3.36Å; V462-Y465 PolarHBondContact O-N 2.78Å; Y465-M468 HydrophobicContact CD1-CE 3.54Å; Y465-M468 HydrophobicContact CE1-CE 3.64Å; Y465-M468 HydrophobicContact CG-CE 4.39Å; Y465-M468 PolarHBondContact O-N 2.96Å; Y465-Q469 WeakPolarHBondContact O-CG 3.33Å; Y465-Q469 PolarHBondContact O-N 2.69Å
466	Q	94.9	Very high	94.8	Very high	115 Å²	115	98.4 Å²	98.4	54%	0.537	50%	0.498	S	S	.	.	H	α-helix	trans	-64.3	-44.6	176.8	-71.8	174.5	0.2	0	0	111.9	V462 E463 Q469 S470	V462-Q466 WeakPolarHBondContact O-CG 3.46Å; V462-Q466 PolarHBondContact O-N 3.32Å; E463-Q466 PolarHBondContact O-N 3.47Å; Q466-Q469 PolarHBondContact O-N 2.9Å; Q466-S470 WeakPolarHBondContact O-CB 3.41Å; Q466-S470 PolarHBondContact O-N 3.3Å; Q466-S470 PolarHBondContact O-OG 2.94Å
467	K	95.3	Very high	94.6	Very high	130 Å²	130	99 Å²	99	57%	0.565	50%	0.499	S	S	*	.	H	α-helix	trans	-62.8	-39.8	174.6	-78.4	174.5	168.2	172.6	0	112.3	E463 M464 S470 S471	E463-K467 HydrophobicContact CG-CD 4.34Å; E463-K467 WeakPolarHBondContact O-CB 3.43Å; E463-K467 WeakPolarHBondContact O-CG 3.23Å; E463-K467 PolarHBondContact O-N 3.47Å; E463-K467 WeakPolarHBondContact OE1-CE 3.38Å; E463-K467 IonicContact OE1-NZ 2.72Å; E463-K467 PolarHBondContact OE1-NZ 2.85Å; M464-K467 PolarHBondContact O-N 2.88Å; K467-S470 PolarHBondContact O-N 3.39Å; K467-S471 VanDerWaalsContact O-CB 3.3Å; K467-S471 WeakPolarHBondContact O-CB 3.35Å; K467-S471 PolarHBondContact O-N 3.37Å
468	M	94.7	Very high	94.5	Very high	108 Å²	108	99.4 Å²	99.4	53%	0.532	49%	0.494	S	S	.	.	H	α-helix	trans	-64.1	-46.3	175.9	-177.2	174.4	62.4	0	0	111.6	M464 Y465 S471 D472	M464-M468 VanDerWaalsContact O-CB 3.23Å; M464-M468 WeakPolarHBondContact O-CB 3.47Å; M464-M468 PolarHBondContact O-N 3.32Å; Y465-M468 HydrophobicContact CD1-CE 3.54Å; Y465-M468 HydrophobicContact CE1-CE 3.64Å; Y465-M468 HydrophobicContact CG-CE 4.39Å; Y465-M468 PolarHBondContact O-N 2.96Å; M468-S471 PolarHBondContact O-N 2.65Å; M468-D472 WeakPolarHBondContact O-CB 3.3Å; M468-D472 PolarHBondContact O-N 3.24Å
469	Q	94.1	Very high	94.4	Very high	121 Å²	121	98.2 Å²	98.2	57%	0.565	49%	0.492	S	S	*	.	H	α-helix	trans	-61.3	-44.9	175	-73.5	175.6	-4.5	0	0	112.1	Y465 Q466 S471 D472 E473	Y465-Q469 WeakPolarHBondContact O-CG 3.33Å; Y465-Q469 PolarHBondContact O-N 2.69Å; Q466-Q469 PolarHBondContact O-N 2.9Å; Q469-S471 VanDerWaalsContact C-N 3.3Å; Q469-S471 PolarHBondContact O-N 3.46Å; Q469-D472 PolarHBondContact O-N 2.93Å; Q469-E473 PolarHBondContact O-N 3.31Å
470	S	94.3	Very high	94.3	Very high	72 Å²	72	99.9 Å²	99.9	50%	0.503	49%	0.492	S	S	.	.	H	α-helix	trans	-60.1	-40.9	176.5	-52.8	0	0	0	0	112	Q466 K467 E474	Q466-S470 WeakPolarHBondContact O-CB 3.41Å; Q466-S470 PolarHBondContact O-N 3.3Å; Q466-S470 PolarHBondContact O-OG 2.94Å; K467-S470 PolarHBondContact O-N 3.39Å; S470-E474 PolarHBondContact O-N 2.81Å
471	S	92.3	Very high	94.2	Very high	65 Å²	65	98.2 Å²	98.2	46%	0.455	49%	0.487	S	S	.	.	H	α-helix	trans	-69.3	-41	177.8	-170.2	0	0	0	0	112.5	K467 M468 Q469 E474 M475	K467-S471 VanDerWaalsContact O-CB 3.3Å; K467-S471 WeakPolarHBondContact O-CB 3.35Å; K467-S471 PolarHBondContact O-N 3.37Å; M468-S471 PolarHBondContact O-N 2.65Å; Q469-S471 VanDerWaalsContact C-N 3.3Å; Q469-S471 PolarHBondContact O-N 3.46Å; S471-E474 PolarHBondContact O-N 3.31Å; S471-M475 WeakPolarHBondContact O-CB 3.46Å; S471-M475 WeakPolarHBondContact O-CG 3.3Å; S471-M475 PolarHBondContact O-N 3Å
472	D	94.4	Very high	94.1	Very high	77 Å²	77	98.5 Å²	98.5	41%	0.412	49%	0.488	S	S	.	.	H	α-helix	trans	-64.9	-39.9	174.9	174	58.1	0	0	0	111.8	M468 Q469 M475 K476	M468-D472 WeakPolarHBondContact O-CB 3.3Å; M468-D472 PolarHBondContact O-N 3.24Å; Q469-D472 PolarHBondContact O-N 2.93Å; D472-M475 PolarHBondContact O-N 2.64Å; D472-K476 WeakPolarHBondContact O-CG 3.44Å; D472-K476 PolarHBondContact O-N 3.27Å; D472-K476 WeakPolarHBondContact OD1-CE 3.2Å; D472-K476 IonicContact OD1-NZ 2.76Å; D472-K476 WeakPolarHBondContact OD2-CE 3.28Å; D472-K476 IonicContact OD2-NZ 3.31Å; D472-K476 PolarHBondContact OD2-NZ 2.9Å
473	E	94.3	Very high	94	Very high	106 Å²	106	97.8 Å²	97.8	50%	0.495	49%	0.487	S	S	.	.	H	α-helix	trans	-60.3	-44.3	169.3	-88.1	-161.3	-150.8	0	0	112.9	Q469 M475 K476 K477	Q469-E473 PolarHBondContact O-N 3.31Å; E473-M475 VanDerWaalsContact C-N 3.35Å; E473-K476 PolarHBondContact O-N 3.35Å; E473-K477 VanDerWaalsContact O-CD 3.28Å; E473-K477 WeakPolarHBondContact O-CD 3.34Å; E473-K477 WeakPolarHBondContact O-CG 3.4Å; E473-K477 PolarHBondContact O-N 3.02Å; E473-K477 IonicContact OE2-NZ 2.71Å; E473-K477 PolarHBondContact OE2-NZ 3.46Å
474	E	94	Very high	93.9	Very high	102 Å²	102	99.9 Å²	99.9	48%	0.477	49%	0.491	S	S	.	.	H	α-helix	trans	-63.1	-40	174.2	-89.5	-162.7	-152.2	0	0	112.3	S470 S471 K477 K478	S470-E474 PolarHBondContact O-N 2.81Å; S471-E474 PolarHBondContact O-N 3.31Å; E474-K477 PolarHBondContact O-N 3.44Å; E474-K478 WeakPolarHBondContact O-CB 3.21Å; E474-K478 WeakPolarHBondContact O-CD 3.4Å; E474-K478 WeakPolarHBondContact O-CG 3.33Å; E474-K478 PolarHBondContact O-N 3.49Å; E474-K478 WeakPolarHBondContact OE2-CE 3.4Å; E474-K478 IonicContact OE2-NZ 3.84Å; E474-K478 PolarHBondContact OE2-NZ 2.94Å
475	M	93.4	Very high	93.8	Very high	90 Å²	90	98.6 Å²	98.6	44%	0.443	49%	0.485	S	S	.	.	H	α-helix	trans	-65.9	-39	177.3	-76.4	-59.6	-61.1	0	0	111.8	S471 D472 E473 K478 N479	S471-M475 WeakPolarHBondContact O-CB 3.46Å; S471-M475 WeakPolarHBondContact O-CG 3.3Å; S471-M475 PolarHBondContact O-N 3Å; D472-M475 PolarHBondContact O-N 2.64Å; E473-M475 VanDerWaalsContact C-N 3.35Å; M475-K478 PolarHBondContact O-N 2.84Å; M475-K478 HydrophobicContact SD-CD 4.23Å; M475-N479 WeakPolarHBondContact O-CB 3.39Å; M475-N479 PolarHBondContact O-N 3.27Å; M475-N479 PolarHBondContact O-ND2 3.33Å; M475-N479 PolarHBondContact O-OD1 2.86Å
476	K	93.7	Very high	93.7	Very high	112 Å²	112	97.2 Å²	97.2	49%	0.487	48%	0.484	S	S	.	.	H	α-helix	trans	-60.1	-50.7	170.8	-73.8	161.7	178	166.9	0	111.2	D472 E473 K478 N479 D480	D472-K476 WeakPolarHBondContact O-CG 3.44Å; D472-K476 PolarHBondContact O-N 3.27Å; D472-K476 WeakPolarHBondContact OD1-CE 3.2Å; D472-K476 IonicContact OD1-NZ 2.76Å; D472-K476 WeakPolarHBondContact OD2-CE 3.28Å; D472-K476 IonicContact OD2-NZ 3.31Å; D472-K476 PolarHBondContact OD2-NZ 2.9Å; E473-K476 PolarHBondContact O-N 3.35Å; K476-K478 VanDerWaalsContact C-N 3.27Å; K476-K478 PolarHBondContact O-N 3.3Å; K476-N479 PolarHBondContact O-N 3.34Å; K476-N479 VanDerWaalsContact O-N 3.14Å; K476-D480 VanDerWaalsContact O-CG 3.29Å; K476-D480 PolarHBondContact O-N 3.12Å
477	K	93.3	Very high	93.6	Very high	110 Å²	110	98.2 Å²	98.2	48%	0.478	49%	0.489	S	S	.	.	H	α-helix	trans	-58.3	-37	176.5	-66.8	158	-163.5	165.6	0	112.3	E473 E474 V481	E473-K477 VanDerWaalsContact O-CD 3.28Å; E473-K477 WeakPolarHBondContact O-CD 3.34Å; E473-K477 WeakPolarHBondContact O-CG 3.4Å; E473-K477 PolarHBondContact O-N 3.02Å; E473-K477 IonicContact OE2-NZ 2.71Å; E473-K477 PolarHBondContact OE2-NZ 3.46Å; E474-K477 PolarHBondContact O-N 3.44Å; K477-V481 WeakPolarHBondContact O-CG2 3.42Å; K477-V481 PolarHBondContact O-N 2.9Å
478	K	92.9	Very high	93.5	Very high	98 Å²	98	98 Å²	98	43%	0.426	49%	0.488	S	S	.	.	H	α-helix	trans	-70.5	-43.8	175.3	-72.2	161.1	-167.2	165.4	0	111.9	E474 M475 K476 D480 V481 I482	E474-K478 WeakPolarHBondContact O-CB 3.21Å; E474-K478 WeakPolarHBondContact O-CD 3.4Å; E474-K478 WeakPolarHBondContact O-CG 3.33Å; E474-K478 PolarHBondContact O-N 3.49Å; E474-K478 WeakPolarHBondContact OE2-CE 3.4Å; E474-K478 IonicContact OE2-NZ 3.84Å; E474-K478 PolarHBondContact OE2-NZ 2.94Å; M475-K478 PolarHBondContact O-N 2.84Å; M475-K478 HydrophobicContact SD-CD 4.23Å; K476-K478 VanDerWaalsContact C-N 3.27Å; K476-K478 PolarHBondContact O-N 3.3Å; K478-D480 PolarHBondContact O-N 3.38Å; K478-V481 WeakPolarHBondContact O-CB 3.45Å; K478-V481 PolarHBondContact O-N 2.89Å; K478-V481 VanDerWaalsContact O-N 3.12Å; K478-I482 WeakPolarHBondContact O-CG1 3.39Å; K478-I482 PolarHBondContact O-N 3.14Å
479	N	93.4	Very high	93.4	Very high	81 Å²	81	96.8 Å²	96.8	43%	0.433	49%	0.486	S	S	.	.	H	α-helix	trans	-61.5	-43.1	175.3	-70.2	-11.9	0	0	0	111.5	M475 K476 V481 I482 S483	M475-N479 WeakPolarHBondContact O-CB 3.39Å; M475-N479 PolarHBondContact O-N 3.27Å; M475-N479 PolarHBondContact O-ND2 3.33Å; M475-N479 PolarHBondContact O-OD1 2.86Å; K476-N479 PolarHBondContact O-N 3.34Å; K476-N479 VanDerWaalsContact O-N 3.14Å; N479-V481 PolarHBondContact O-N 2.89Å; N479-I482 PolarHBondContact O-N 2.76Å; N479-S483 PolarHBondContact O-N 3.27Å
480	D	93.7	Very high	93.4	Very high	95 Å²	95	96.4 Å²	96.4	51%	0.508	49%	0.488	S	S	.	.	H	α-helix	trans	-59.3	-35.3	174.3	-64.8	-25.3	0	0	0	111.9	K476 K478 R484	K476-D480 VanDerWaalsContact O-CG 3.29Å; K476-D480 PolarHBondContact O-N 3.12Å; K478-D480 PolarHBondContact O-N 3.38Å; D480-R484 WeakPolarHBondContact O-CG 3.43Å; D480-R484 PolarHBondContact O-N 3.5Å; D480-R484 PolarHBondContact O-NE 3.49Å; D480-R484 PolarHBondContact O-NH2 3.46Å
481	V	92.9	Very high	93.4	Very high	73 Å²	73	99.4 Å²	99.4	44%	0.442	49%	0.494	S	S	.	.	H	α-helix	trans	-70.5	-43.7	173.4	170.6	0	0	0	0	111	K477 K478 N479 R484 L485	K477-V481 WeakPolarHBondContact O-CG2 3.42Å; K477-V481 PolarHBondContact O-N 2.9Å; K478-V481 WeakPolarHBondContact O-CB 3.45Å; K478-V481 PolarHBondContact O-N 2.89Å; K478-V481 VanDerWaalsContact O-N 3.12Å; N479-V481 PolarHBondContact O-N 2.89Å; V481-R484 PolarHBondContact O-N 3.26Å; V481-L485 HydrophobicContact CG1-CD1 3.95Å; V481-L485 HydrophobicContact CG1-CG 4.42Å; V481-L485 WeakPolarHBondContact O-CG 3.38Å; V481-L485 PolarHBondContact O-N 3.07Å
482	I	93.1	Very high	93.3	Very high	82 Å²	82	101.2 Å²	101.2	42%	0.421	50%	0.498	S	S	.	.	H	α-helix	trans	-58	-52.3	177.4	-69.4	163.9	0	0	0	110.4	K478 N479 R484 L485 E486	K478-I482 WeakPolarHBondContact O-CG1 3.39Å; K478-I482 PolarHBondContact O-N 3.14Å; N479-I482 PolarHBondContact O-N 2.76Å; I482-R484 VanDerWaalsContact C-N 3.29Å; I482-R484 PolarHBondContact O-N 3.32Å; I482-L485 CarbonylContact O-C 3.6Å; I482-L485 WeakPolarHBondContact O-CA 3.37Å; I482-L485 WeakPolarHBondContact O-CB 3.32Å; I482-L485 PolarHBondContact O-N 3.14Å; I482-E486 HydrophobicContact CG2-CG 4.18Å; I482-E486 WeakPolarHBondContact O-CG 3.36Å; I482-E486 PolarHBondContact O-N 3.44Å
483	S	94.1	Very high	93.3	Very high	68 Å²	68	101.5 Å²	101.5	48%	0.476	50%	0.502	S	S	.	.	H	α-helix	trans	-63.9	-31	-178.9	-60.7	0	0	0	0	113.8	N479 L485 E486 E487	N479-S483 PolarHBondContact O-N 3.27Å; S483-L485 VanDerWaalsContact C-N 3.35Å; S483-E486 WeakPolarHBondContact CA-OE2 3.42Å; S483-E486 PolarHBondContact O-N 3.46Å; S483-E486 PolarHBondContact OG-OE2 2.88Å; S483-E487 WeakPolarHBondContact O-CB 3.37Å; S483-E487 PolarHBondContact O-N 3Å
484	R	93.8	Very high	93.2	Very high	137 Å²	137	99.4 Å²	99.4	52%	0.517	50%	0.503	S	S	.	.	H	α-helix	trans	-72.3	-24.9	170.6	-75.1	176	-68.2	-169.9	-4.1	113.4	D480 V481 I482 K488	D480-R484 WeakPolarHBondContact O-CG 3.43Å; D480-R484 PolarHBondContact O-N 3.5Å; D480-R484 PolarHBondContact O-NE 3.49Å; D480-R484 PolarHBondContact O-NH2 3.46Å; V481-R484 PolarHBondContact O-N 3.26Å; I482-R484 VanDerWaalsContact C-N 3.29Å; I482-R484 PolarHBondContact O-N 3.32Å; R484-K488 VanDerWaalsContact O-CG 3.32Å; R484-K488 WeakPolarHBondContact O-CG 3.45Å; R484-K488 PolarHBondContact O-N 2.81Å
485	L	92	Very high	93.1	Very high	97 Å²	97	97.7 Å²	97.7	51%	0.508	50%	0.5	S	S	.	.	H	α-helix	trans	-80.5	-36.1	171.4	-69.5	171.7	0	0	0	111.5	V481 I482 S483 K488 T489	V481-L485 HydrophobicContact CG1-CD1 3.95Å; V481-L485 HydrophobicContact CG1-CG 4.42Å; V481-L485 WeakPolarHBondContact O-CG 3.38Å; V481-L485 PolarHBondContact O-N 3.07Å; I482-L485 CarbonylContact O-C 3.6Å; I482-L485 WeakPolarHBondContact O-CA 3.37Å; I482-L485 WeakPolarHBondContact O-CB 3.32Å; I482-L485 PolarHBondContact O-N 3.14Å; S483-L485 VanDerWaalsContact C-N 3.35Å; L485-K488 PolarHBondContact O-N 2.69Å; L485-T489 VanDerWaalsContact O-CB 3.29Å; L485-T489 WeakPolarHBondContact O-CB 3.29Å; L485-T489 PolarHBondContact O-N 2.92Å; L485-T489 PolarHBondContact O-OG1 2.83Å
486	E	92.6	Very high	93	Very high	103 Å²	103	98.4 Å²	98.4	48%	0.481	50%	0.503	S	S	.	.	H	α-helix	trans	-63	-47.4	171.9	-68.4	172.8	144.7	0	0	110.9	I482 S483 K488 T489 N490	I482-E486 HydrophobicContact CG2-CG 4.18Å; I482-E486 WeakPolarHBondContact O-CG 3.36Å; I482-E486 PolarHBondContact O-N 3.44Å; S483-E486 WeakPolarHBondContact CA-OE2 3.42Å; S483-E486 PolarHBondContact O-N 3.46Å; S483-E486 PolarHBondContact OG-OE2 2.88Å; E486-K488 PolarHBondContact O-N 2.89Å; E486-T489 PolarHBondContact O-N 2.99Å; E486-T489 VanDerWaalsContact O-N 3.14Å; E486-N490 WeakPolarHBondContact O-CB 3.24Å; E486-N490 VanDerWaalsContact O-CG 3.3Å; E486-N490 PolarHBondContact O-N 3.32Å; E486-N490 PolarHBondContact O-ND2 3.29Å; E486-N490 VanDerWaalsContact O-ND2 3.15Å
487	E	93.4	Very high	93	Very high	136 Å²	136	100.1 Å²	100.1	64%	0.636	51%	0.511	S	S	*	.	H	α-helix	trans	-56.6	-48.1	174.4	-175.7	-179.9	-154	0	0	111.7	S483 T489 N490 Q491	S483-E487 WeakPolarHBondContact O-CB 3.37Å; S483-E487 PolarHBondContact O-N 3Å; E487-T489 VanDerWaalsContact C-N 3.35Å; E487-T489 PolarHBondContact O-N 3.43Å; E487-N490 PolarHBondContact O-N 3.47Å; E487-Q491 WeakPolarHBondContact O-CB 3.41Å; E487-Q491 PolarHBondContact O-N 3.49Å
488	K	92.9	Very high	92.9	Very high	126 Å²	126	100.7 Å²	100.7	55%	0.548	52%	0.515	S	S	.	.	H	α-helix	trans	-62.6	-38.8	174.7	-77.4	178.5	177.8	-176.1	0	112.7	R484 L485 E486 Q491 I492	R484-K488 VanDerWaalsContact O-CG 3.32Å; R484-K488 WeakPolarHBondContact O-CG 3.45Å; R484-K488 PolarHBondContact O-N 2.81Å; L485-K488 PolarHBondContact O-N 2.69Å; E486-K488 PolarHBondContact O-N 2.89Å; K488-Q491 PolarHBondContact O-N 2.84Å; K488-I492 WeakPolarHBondContact O-CB 3.4Å; K488-I492 VanDerWaalsContact O-CG1 3.24Å; K488-I492 WeakPolarHBondContact O-CG1 3.48Å; K488-I492 PolarHBondContact O-N 3.15Å
489	T	92.6	Very high	92.8	Very high	82 Å²	82	100.9 Å²	100.9	50%	0.503	52%	0.52	S	S	.	.	H	α-helix	trans	-66.7	-41.1	178.3	-59	0	0	0	0	110.9	L485 E486 E487 I492 T493	L485-T489 VanDerWaalsContact O-CB 3.29Å; L485-T489 WeakPolarHBondContact O-CB 3.29Å; L485-T489 PolarHBondContact O-N 2.92Å; L485-T489 PolarHBondContact O-OG1 2.83Å; E486-T489 PolarHBondContact O-N 2.99Å; E486-T489 VanDerWaalsContact O-N 3.14Å; E487-T489 VanDerWaalsContact C-N 3.35Å; E487-T489 PolarHBondContact O-N 3.43Å; T489-I492 PolarHBondContact O-N 2.83Å; T489-T493 VanDerWaalsContact O-CB 3.3Å; T489-T493 WeakPolarHBondContact O-CB 3.3Å; T489-T493 PolarHBondContact O-N 3.35Å; T489-T493 PolarHBondContact O-OG1 3.4Å
490	N	93.4	Very high	92.7	Very high	112 Å²	112	102 Å²	102	60%	0.599	52%	0.523	S	S	*	.	H	α-helix	trans	-64.2	-42.6	173.7	-71.7	-36.2	0	0	0	111.6	E486 E487 T493 A494	E486-N490 WeakPolarHBondContact O-CB 3.24Å; E486-N490 VanDerWaalsContact O-CG 3.3Å; E486-N490 PolarHBondContact O-N 3.32Å; E486-N490 PolarHBondContact O-ND2 3.29Å; E486-N490 VanDerWaalsContact O-ND2 3.15Å; E487-N490 PolarHBondContact O-N 3.47Å; N490-T493 PolarHBondContact O-N 2.7Å; N490-A494 WeakPolarHBondContact O-CB 3.33Å; N490-A494 PolarHBondContact O-N 3.02Å
491	Q	94.4	Very high	92.6	Very high	136 Å²	136	102.8 Å²	102.8	64%	0.636	52%	0.523	S	S	*	.	H	α-helix	trans	-63.2	-46.4	175.3	-174.8	174.9	69.8	0	0	111.9	E487 K488 T493 A494 T495	E487-Q491 WeakPolarHBondContact O-CB 3.41Å; E487-Q491 PolarHBondContact O-N 3.49Å; K488-Q491 PolarHBondContact O-N 2.84Å; Q491-T493 PolarHBondContact O-N 3.46Å; Q491-A494 PolarHBondContact O-N 3.36Å; Q491-T495 WeakPolarHBondContact O-CG2 3.44Å; Q491-T495 PolarHBondContact O-N 2.9Å; Q491-T495 PolarHBondContact O-OG1 3.35Å
492	I	91.6	Very high	92.6	Very high	103 Å²	103	106.6 Å²	106.6	53%	0.528	53%	0.53	S	S	.	.	H	α-helix	trans	-59.6	-47.8	175.1	-71.3	165	0	0	0	110.1	K488 T489 A494 T495 M496	K488-I492 WeakPolarHBondContact O-CB 3.4Å; K488-I492 VanDerWaalsContact O-CG1 3.24Å; K488-I492 WeakPolarHBondContact O-CG1 3.48Å; K488-I492 PolarHBondContact O-N 3.15Å; T489-I492 PolarHBondContact O-N 2.83Å; I492-A494 VanDerWaalsContact C-N 3.31Å; I492-A494 PolarHBondContact O-N 2.8Å; I492-T495 PolarHBondContact O-N 2.8Å; I492-T495 VanDerWaalsContact O-N 3.13Å; I492-T495 PolarHBondContact O-OG1 3.05Å; I492-M496 WeakPolarHBondContact O-CB 3.4Å; I492-M496 PolarHBondContact O-N 3.13Å
493	T	93.1	Very high	92.4	Very high	82 Å²	82	107.8 Å²	107.8	50%	0.503	54%	0.536	S	S	.	.	H	α-helix	trans	-58.6	-41.2	178.2	-57.5	0	0	0	0	112	T489 N490 Q491 M496 K497	T489-T493 VanDerWaalsContact O-CB 3.3Å; T489-T493 WeakPolarHBondContact O-CB 3.3Å; T489-T493 PolarHBondContact O-N 3.35Å; T489-T493 PolarHBondContact O-OG1 3.4Å; N490-T493 PolarHBondContact O-N 2.7Å; Q491-T493 PolarHBondContact O-N 3.46Å; T493-M496 PolarHBondContact O-N 3.48Å; T493-K497 WeakPolarHBondContact O-CB 3.27Å; T493-K497 PolarHBondContact O-N 2.86Å
494	A	92.7	Very high	92.3	Very high	62 Å²	62	109.2 Å²	109.2	51%	0.512	54%	0.535	S	S	.	.	H	α-helix	trans	-64.1	-44.8	174.9	0	0	0	0	0	112.1	N490 Q491 I492 K497 Q498	N490-A494 WeakPolarHBondContact O-CB 3.33Å; N490-A494 PolarHBondContact O-N 3.02Å; Q491-A494 PolarHBondContact O-N 3.36Å; I492-A494 VanDerWaalsContact C-N 3.31Å; I492-A494 PolarHBondContact O-N 2.8Å; A494-K497 PolarHBondContact O-N 2.93Å; A494-Q498 PolarHBondContact O-N 3.46Å
495	T	92	Very high	92.1	Very high	66 Å²	66	106.1 Å²	106.1	41%	0.405	53%	0.527	S	S	.	.	H	α-helix	trans	-66.9	-36.9	176.4	60.6	0	0	0	0	112.8	Q491 I492 Q498 L499	Q491-T495 WeakPolarHBondContact O-CG2 3.44Å; Q491-T495 PolarHBondContact O-N 2.9Å; Q491-T495 PolarHBondContact O-OG1 3.35Å; I492-T495 PolarHBondContact O-N 2.8Å; I492-T495 VanDerWaalsContact O-N 3.13Å; I492-T495 PolarHBondContact O-OG1 3.05Å; T495-Q498 PolarHBondContact O-N 3.29Å; T495-L499 WeakPolarHBondContact O-CG 3.29Å; T495-L499 PolarHBondContact O-N 2.83Å
496	M	91.9	Very high	91.9	Very high	106 Å²	106	104.2 Å²	104.2	52%	0.522	53%	0.525	S	S	.	.	H	α-helix	trans	-62.2	-49.7	175.4	178.8	167.1	168.5	0	0	110.4	I492 T493 Q498 L499 E500	I492-M496 WeakPolarHBondContact O-CB 3.4Å; I492-M496 PolarHBondContact O-N 3.13Å; T493-M496 PolarHBondContact O-N 3.48Å; M496-Q498 VanDerWaalsContact C-N 3.27Å; M496-Q498 PolarHBondContact O-N 2.92Å; M496-L499 CarbonylContact O-C 3.56Å; M496-L499 WeakPolarHBondContact O-CA 3.49Å; M496-L499 WeakPolarHBondContact O-CB 3.5Å; M496-L499 PolarHBondContact O-N 3.1Å; M496-E500 VanDerWaalsContact CE-OE1 3.27Å; M496-E500 WeakPolarHBondContact CE-OE1 3.45Å; M496-E500 HydrophobicContact CG-CG 4.47Å; M496-E500 WeakPolarHBondContact O-CG 3.5Å; M496-E500 PolarHBondContact O-N 3.29Å
497	K	92.4	Very high	91.8	Very high	148 Å²	148	103.7 Å²	103.7	64%	0.643	52%	0.523	S	S	*	.	H	α-helix	trans	-58.8	-36.8	175.3	-173.5	175.2	179.9	177.1	0	112.9	T493 A494 Q501	T493-K497 WeakPolarHBondContact O-CB 3.27Å; T493-K497 PolarHBondContact O-N 2.86Å; A494-K497 PolarHBondContact O-N 2.93Å; K497-Q501 PolarHBondContact O-N 3.3Å
498	Q	92.9	Very high	91.6	Very high	122 Å²	122	104.4 Å²	104.4	57%	0.57	52%	0.519	S	S	*	.	H	α-helix	trans	-67.9	-37.5	174.4	-168.3	-174.7	15.3	0	0	112.2	A494 T495 M496 R502	A494-Q498 PolarHBondContact O-N 3.46Å; T495-Q498 PolarHBondContact O-N 3.29Å; M496-Q498 VanDerWaalsContact C-N 3.27Å; M496-Q498 PolarHBondContact O-N 2.92Å; Q498-R502 WeakPolarHBondContact O-CB 3.43Å; Q498-R502 VanDerWaalsContact O-CG 3.29Å; Q498-R502 WeakPolarHBondContact O-CG 3.35Å; Q498-R502 PolarHBondContact O-N 2.98Å; Q498-R502 VanDerWaalsContact O-N 3.1Å
499	L	90.3	Very high	91.5	Very high	102 Å²	102	105.1 Å²	105.1	53%	0.534	53%	0.525	S	S	.	.	H	α-helix	trans	-70.8	-39.8	175.5	-70.8	169.9	0	0	0	112	T495 M496 R502 L503	T495-L499 WeakPolarHBondContact O-CG 3.29Å; T495-L499 PolarHBondContact O-N 2.83Å; M496-L499 CarbonylContact O-C 3.56Å; M496-L499 WeakPolarHBondContact O-CA 3.49Å; M496-L499 WeakPolarHBondContact O-CB 3.5Å; M496-L499 PolarHBondContact O-N 3.1Å; L499-R502 PolarHBondContact O-N 3.21Å; L499-L503 WeakPolarHBondContact O-CB 3.38Å; L499-L503 PolarHBondContact O-N 3.03Å
500	E	91.4	Very high	91.3	Very high	104 Å²	104	107.6 Å²	107.6	49%	0.486	53%	0.525	S	S	.	.	H	α-helix	trans	-59.9	-46.2	173	-72.1	172.7	159.8	0	0	111.6	M496 L503 Q504	M496-E500 VanDerWaalsContact CE-OE1 3.27Å; M496-E500 WeakPolarHBondContact CE-OE1 3.45Å; M496-E500 HydrophobicContact CG-CG 4.47Å; M496-E500 WeakPolarHBondContact O-CG 3.5Å; M496-E500 PolarHBondContact O-N 3.29Å; E500-L503 PolarHBondContact O-N 2.92Å; E500-Q504 PolarHBondContact O-N 3.39Å
501	Q	91.4	Very high	91.1	Very high	112 Å²	112	105.6 Å²	105.6	52%	0.523	52%	0.519	S	S	.	.	H	α-helix	trans	-60.4	-47.5	175.2	-178.7	179.8	-22.9	0	0	111.3	K497 L503 Q504 E505	K497-Q501 PolarHBondContact O-N 3.3Å; Q501-L503 VanDerWaalsContact C-N 3.3Å; Q501-L503 PolarHBondContact O-N 2.82Å; Q501-Q504 PolarHBondContact O-N 2.84Å; Q501-E505 WeakPolarHBondContact CG-OE1 3.38Å; Q501-E505 PolarHBondContact NE2-OE1 3.33Å; Q501-E505 WeakPolarHBondContact O-CG 3.34Å; Q501-E505 PolarHBondContact O-N 2.97Å
502	R	91.8	Very high	90.8	Very high	153 Å²	153	102.8 Å²	102.8	58%	0.577	52%	0.515	S	S	*	.	H	α-helix	trans	-62.8	-34.9	177.8	-74.8	175.7	63.9	-156.3	-3.3	112.9	Q498 L499 A506	Q498-R502 WeakPolarHBondContact O-CB 3.43Å; Q498-R502 VanDerWaalsContact O-CG 3.29Å; Q498-R502 WeakPolarHBondContact O-CG 3.35Å; Q498-R502 PolarHBondContact O-N 2.98Å; Q498-R502 VanDerWaalsContact O-N 3.1Å; L499-R502 PolarHBondContact O-N 3.21Å; R502-A506 WeakPolarHBondContact O-CB 3.37Å; R502-A506 PolarHBondContact O-N 2.89Å
503	L	90.3	Very high	90.5	Very high	106 Å²	106	101.1 Å²	101.1	56%	0.555	52%	0.516	S	S	*	.	H	α-helix	trans	-65.7	-48.5	173.5	178.9	61.7	0	0	0	110.4	L499 E500 Q501 E505 A506 E507	L499-L503 WeakPolarHBondContact O-CB 3.38Å; L499-L503 PolarHBondContact O-N 3.03Å; E500-L503 PolarHBondContact O-N 2.92Å; Q501-L503 VanDerWaalsContact C-N 3.3Å; Q501-L503 PolarHBondContact O-N 2.82Å; L503-E505 VanDerWaalsContact C-N 3.3Å; L503-E505 PolarHBondContact O-N 3.41Å; L503-A506 CarbonylContact O-C 3.59Å; L503-A506 PolarHBondContact O-N 2.72Å; L503-A506 VanDerWaalsContact O-N 3.15Å; L503-E507 HydrophobicContact CD1-CG 4.38Å; L503-E507 WeakPolarHBondContact O-CG 3.19Å; L503-E507 PolarHBondContact O-N 2.89Å
504	Q	90.9	Very high	90.2	Very high	98 Å²	98	102 Å²	102	46%	0.458	52%	0.515	S	S	.	.	H	α-helix	trans	-62.3	-36.8	178.3	-165.2	-175.3	50.4	0	0	112.3	E500 Q501 R508	E500-Q504 PolarHBondContact O-N 3.39Å; Q501-Q504 PolarHBondContact O-N 2.84Å; Q504-R508 VanDerWaalsContact O-CG 3.28Å; Q504-R508 WeakPolarHBondContact O-CG 3.36Å; Q504-R508 PolarHBondContact O-N 3.15Å
505	E	91.1	Very high	89.9	Confident	73 Å²	73	103.6 Å²	103.6	34%	0.341	51%	0.512	S	S	.	.	H	α-helix	trans	-64.4	-47.4	172.3	-73.5	166.5	-178.6	0	0	111.2	Q501 L503 E507 R508 H509	Q501-E505 WeakPolarHBondContact CG-OE1 3.38Å; Q501-E505 PolarHBondContact NE2-OE1 3.33Å; Q501-E505 WeakPolarHBondContact O-CG 3.34Å; Q501-E505 PolarHBondContact O-N 2.97Å; L503-E505 VanDerWaalsContact C-N 3.3Å; L503-E505 PolarHBondContact O-N 3.41Å; E505-E507 VanDerWaalsContact C-N 3.33Å; E505-E507 PolarHBondContact O-N 2.79Å; E505-R508 PolarHBondContact O-N 3.37Å; E505-H509 PolarHBondContact O-CD2 3.24Å; E505-H509 PolarHBondContact O-N 3.43Å
506	A	87	Confident	89.7	Confident	56 Å²	56	102.1 Å²	102.1	46%	0.463	51%	0.509	S	S	.	.	H	α-helix	trans	-62	-37.3	175.9	0	0	0	0	0	112.9	R502 L503 H509 R510	R502-A506 WeakPolarHBondContact O-CB 3.37Å; R502-A506 PolarHBondContact O-N 2.89Å; L503-A506 CarbonylContact O-C 3.59Å; L503-A506 PolarHBondContact O-N 2.72Å; L503-A506 VanDerWaalsContact O-N 3.15Å; A506-H509 PolarHBondContact O-N 2.95Å; A506-R510 WeakPolarHBondContact O-CB 3.37Å; A506-R510 PolarHBondContact O-N 3.04Å
507	E	89.6	Confident	89.4	Confident	93 Å²	93	99.5 Å²	99.5	44%	0.435	50%	0.502	S	S	.	.	H	α-helix	trans	-66.2	-40.5	174.4	-74.7	-178.4	149.8	0	0	112.5	L503 E505 R510 S511	L503-E507 HydrophobicContact CD1-CG 4.38Å; L503-E507 WeakPolarHBondContact O-CG 3.19Å; L503-E507 PolarHBondContact O-N 2.89Å; E505-E507 VanDerWaalsContact C-N 3.33Å; E505-E507 PolarHBondContact O-N 2.79Å; E507-R510 PolarHBondContact O-N 2.85Å; E507-S511 VanDerWaalsContact O-CB 3.29Å; E507-S511 WeakPolarHBondContact O-CB 3.38Å; E507-S511 PolarHBondContact O-N 3.08Å
508	R	90.2	Very high	89.2	Confident	150 Å²	150	101.8 Å²	101.8	57%	0.566	51%	0.506	S	S	*	.	H	α-helix	trans	-62.8	-43.7	172.9	-72	169.6	-172.7	170.9	7.4	111.2	Q504 E505 S511 S512	Q504-R508 VanDerWaalsContact O-CG 3.28Å; Q504-R508 WeakPolarHBondContact O-CG 3.36Å; Q504-R508 PolarHBondContact O-N 3.15Å; E505-R508 PolarHBondContact O-N 3.37Å; R508-S511 PolarHBondContact O-N 2.84Å; R508-S512 WeakPolarHBondContact O-CB 3.4Å; R508-S512 PolarHBondContact O-N 3.39Å
509	H	90.1	Very high	88.9	Confident	142 Å²	142	102.9 Å²	102.9	66%	0.657	51%	0.505	S	S	*	.	H	α-helix	trans	-62.7	-44.5	174.8	-73.7	-61	0	0	0	112.2	E505 A506 S512 A513	E505-H509 PolarHBondContact O-CD2 3.24Å; E505-H509 PolarHBondContact O-N 3.43Å; A506-H509 PolarHBondContact O-N 2.95Å; H509-S512 PolarHBondContact O-N 3.4Å; H509-A513 WeakPolarHBondContact O-CB 3.28Å; H509-A513 PolarHBondContact O-N 2.97Å
510	R	89	Confident	88.7	Confident	133 Å²	133	104.6 Å²	104.6	50%	0.502	51%	0.509	S	S	.	.	H	α-helix	trans	-59.8	-49.2	175.1	-178	-179.3	65.4	77.6	1.8	111.4	A506 E507 S512 A513 E514	A506-R510 WeakPolarHBondContact O-CB 3.37Å; A506-R510 PolarHBondContact O-N 3.04Å; E507-R510 PolarHBondContact O-N 2.85Å; R510-S512 PolarHBondContact O-N 3.34Å; R510-A513 PolarHBondContact O-N 3.45Å; R510-E514 WeakPolarHBondContact CD-OE1 3.4Å; R510-E514 HydrophobicContact CG-CG 4.39Å; R510-E514 WeakPolarHBondContact CG-OE1 3.43Å; R510-E514 IonicContact CZ-OE1 3Å; R510-E514 IonicContact NE-OE1 3.99Å; R510-E514 IonicContact NH1-OE1 2.71Å; R510-E514 PolarHBondContact NH1-OE1 3.46Å; R510-E514 IonicContact NH1-OE2 3.43Å; R510-E514 PolarHBondContact NH1-OE2 2.83Å; R510-E514 WeakPolarHBondContact O-CB 3.29Å; R510-E514 WeakPolarHBondContact O-CG 3.4Å; R510-E514 PolarHBondContact O-N 3.21Å
511	S	88.6	Confident	88.5	Confident	70 Å²	70	106.4 Å²	106.4	49%	0.49	52%	0.515	S	S	.	.	H	α-helix	trans	-58.8	-45.7	178.9	-175.4	0	0	0	0	111.7	E507 R508 A513 E514 E515	E507-S511 VanDerWaalsContact O-CB 3.29Å; E507-S511 WeakPolarHBondContact O-CB 3.38Å; E507-S511 PolarHBondContact O-N 3.08Å; R508-S511 PolarHBondContact O-N 2.84Å; S511-A513 PolarHBondContact O-N 3.47Å; S511-E514 PolarHBondContact O-N 2.96Å; S511-E515 WeakPolarHBondContact O-CB 3.36Å; S511-E515 PolarHBondContact O-N 2.93Å
512	S	88.9	Confident	88.3	Confident	78 Å²	78	106 Å²	106	55%	0.545	52%	0.515	S	S	.	.	H	α-helix	trans	-64.1	-38.7	176.3	-174.4	0	0	0	0	112.9	R508 H509 R510 E515 G516	R508-S512 WeakPolarHBondContact O-CB 3.4Å; R508-S512 PolarHBondContact O-N 3.39Å; H509-S512 PolarHBondContact O-N 3.4Å; R510-S512 PolarHBondContact O-N 3.34Å; S512-E515 PolarHBondContact O-N 3.47Å; S512-G516 PolarHBondContact O-N 3.39Å
513	A	85	Confident	88.2	Confident	67 Å²	67	103.5 Å²	103.5	55%	0.554	51%	0.514	S	S	*	.	H	α-helix	trans	-69.8	-37.9	175.5	0	0	0	0	0	112.8	H509 R510 S511 G516 S517	H509-A513 WeakPolarHBondContact O-CB 3.28Å; H509-A513 PolarHBondContact O-N 2.97Å; R510-A513 PolarHBondContact O-N 3.45Å; S511-A513 PolarHBondContact O-N 3.47Å; A513-G516 PolarHBondContact O-N 2.85Å; A513-S517 WeakPolarHBondContact O-CB 3.27Å; A513-S517 PolarHBondContact O-N 2.91Å
514	E	87.3	Confident	88	Confident	101 Å²	101	105 Å²	105	47%	0.472	52%	0.516	S	S	.	.	H	α-helix	trans	-66	-40.7	173.4	-77.4	171.6	-168.3	0	0	111.4	R510 S511 S517 R518	R510-E514 WeakPolarHBondContact CD-OE1 3.4Å; R510-E514 HydrophobicContact CG-CG 4.39Å; R510-E514 WeakPolarHBondContact CG-OE1 3.43Å; R510-E514 IonicContact CZ-OE1 3Å; R510-E514 IonicContact NE-OE1 3.99Å; R510-E514 IonicContact NH1-OE1 2.71Å; R510-E514 PolarHBondContact NH1-OE1 3.46Å; R510-E514 IonicContact NH1-OE2 3.43Å; R510-E514 PolarHBondContact NH1-OE2 2.83Å; R510-E514 WeakPolarHBondContact O-CB 3.29Å; R510-E514 WeakPolarHBondContact O-CG 3.4Å; R510-E514 PolarHBondContact O-N 3.21Å; S511-E514 PolarHBondContact O-N 2.96Å; E514-S517 PolarHBondContact O-N 3.49Å; E514-R518 WeakPolarHBondContact O-CB 3.24Å; E514-R518 PolarHBondContact O-N 2.93Å
515	E	86.3	Confident	87.8	Confident	95 Å²	95	102.6 Å²	102.6	44%	0.444	51%	0.513	S	S	.	.	H	α-helix	trans	-65.3	-44.7	174.2	-151.9	-142.8	134.7	0	0	111.3	S511 S512 S517 R518 R519	S511-E515 WeakPolarHBondContact O-CB 3.36Å; S511-E515 PolarHBondContact O-N 2.93Å; S512-E515 PolarHBondContact O-N 3.47Å; E515-S517 PolarHBondContact O-N 2.88Å; E515-R518 WeakPolarHBondContact O-CB 3.38Å; E515-R518 PolarHBondContact O-N 3.48Å; E515-R518 VanDerWaalsContact O-N 3.11Å; E515-R519 WeakPolarHBondContact O-CG 3.43Å; E515-R519 PolarHBondContact O-N 3.28Å; E515-R519 IonicContact OE1-CZ 3.26Å; E515-R519 IonicContact OE1-NE 2.71Å; E515-R519 PolarHBondContact OE1-NE 3.03Å; E515-R519 IonicContact OE1-NH2 3.61Å; E515-R519 PolarHBondContact OE1-NH2 3.11Å; E515-R519 IonicContact OE2-NH2 3.72Å; E515-R519 PolarHBondContact OE2-NH2 2.86Å
516	G	86.6	Confident	87.7	Confident	35 Å²	35	103.5 Å²	103.5	36%	0.361	52%	0.52	S	S	.	.	H	α-helix	trans	-59.2	-43.1	173.3	0	0	0	0	0	112.8	S512 A513 R518 R519 F520	S512-G516 PolarHBondContact O-N 3.39Å; A513-G516 PolarHBondContact O-N 2.85Å; G516-R518 VanDerWaalsContact C-N 3.33Å; G516-R518 PolarHBondContact O-N 3.46Å; G516-R519 PolarHBondContact O-N 3.39Å; G516-F520 WeakPolarHBondContact O-CB 3.44Å; G516-F520 PolarHBondContact O-N 3.46Å
517	S	87.1	Confident	87.8	Confident	51 Å²	51	106.7 Å²	106.7	36%	0.357	52%	0.524	S	S	.	.	H	α-helix	trans	-63.1	-37.8	173.1	-170.8	0	0	0	0	112	A513 E514 E515 K521	A513-S517 WeakPolarHBondContact O-CB 3.27Å; A513-S517 PolarHBondContact O-N 2.91Å; E514-S517 PolarHBondContact O-N 3.49Å; E515-S517 PolarHBondContact O-N 2.88Å; S517-K521 WeakPolarHBondContact O-CB 3.43Å; S517-K521 VanDerWaalsContact O-CG 3.24Å; S517-K521 WeakPolarHBondContact O-CG 3.31Å; S517-K521 PolarHBondContact O-N 3.19Å
518	R	87.2	Confident	87.6	Confident	197 Å²	197	104.4 Å²	104.4	74%	0.743	52%	0.521	S	S	*	.	H	α-helix	trans	-67.6	-42.6	176.6	-171.6	-179.4	179.3	97.8	3.2	111.9	E514 E515 G516 K521 L522	E514-R518 WeakPolarHBondContact O-CB 3.24Å; E514-R518 PolarHBondContact O-N 2.93Å; E515-R518 WeakPolarHBondContact O-CB 3.38Å; E515-R518 PolarHBondContact O-N 3.48Å; E515-R518 VanDerWaalsContact O-N 3.11Å; G516-R518 VanDerWaalsContact C-N 3.33Å; G516-R518 PolarHBondContact O-N 3.46Å; R518-K521 PolarHBondContact O-N 2.69Å; R518-L522 WeakPolarHBondContact O-CB 3.49Å; R518-L522 PolarHBondContact O-N 2.93Å
519	R	87.6	Confident	87.5	Confident	145 Å²	145	101.3 Å²	101.3	55%	0.547	52%	0.515	S	S	.	.	H	α-helix	trans	-61.1	-51.4	172.7	-65	-176.2	-155	166.1	6.9	110.6	E515 G516 K521 L522 D523	E515-R519 WeakPolarHBondContact O-CG 3.43Å; E515-R519 PolarHBondContact O-N 3.28Å; E515-R519 IonicContact OE1-CZ 3.26Å; E515-R519 IonicContact OE1-NE 2.71Å; E515-R519 PolarHBondContact OE1-NE 3.03Å; E515-R519 IonicContact OE1-NH2 3.61Å; E515-R519 PolarHBondContact OE1-NH2 3.11Å; E515-R519 IonicContact OE2-NH2 3.72Å; E515-R519 PolarHBondContact OE2-NH2 2.86Å; G516-R519 PolarHBondContact O-N 3.39Å; R519-K521 VanDerWaalsContact C-N 3.32Å; R519-K521 PolarHBondContact O-N 2.88Å; R519-L522 WeakPolarHBondContact O-CA 3.42Å; R519-L522 WeakPolarHBondContact O-CB 3.36Å; R519-L522 PolarHBondContact O-N 2.91Å; R519-D523 PolarHBondContact O-N 2.85Å
520	F	86	Confident	87.5	Confident	138 Å²	138	96.9 Å²	96.9	61%	0.605	50%	0.501	S	S	*	.	H	α-helix	trans	-57	-41.8	177.9	-177.9	-93.8	0	0	0	112.9	G516 D523 F524	G516-F520 WeakPolarHBondContact O-CB 3.44Å; G516-F520 PolarHBondContact O-N 3.46Å; F520-D523 PolarHBondContact O-N 2.86Å; F520-F524 VanDerWaalsContact O-CB 3.24Å; F520-F524 WeakPolarHBondContact O-CB 3.34Å; F520-F524 PolarHBondContact O-N 2.81Å
521	K	86.7	Confident	87.4	Confident	141 Å²	141	94.5 Å²	94.5	61%	0.613	50%	0.497	S	S	*	.	H	α-helix	trans	-63.6	-39.1	174.3	-76.5	169.3	-178.8	173.2	0	112.6	S517 R518 R519 A525	S517-K521 WeakPolarHBondContact O-CB 3.43Å; S517-K521 VanDerWaalsContact O-CG 3.24Å; S517-K521 WeakPolarHBondContact O-CG 3.31Å; S517-K521 PolarHBondContact O-N 3.19Å; R518-K521 PolarHBondContact O-N 2.69Å; R519-K521 VanDerWaalsContact C-N 3.32Å; R519-K521 PolarHBondContact O-N 2.88Å; K521-A525 VanDerWaalsContact O-CB 3.27Å; K521-A525 WeakPolarHBondContact O-CB 3.24Å; K521-A525 PolarHBondContact O-N 3.49Å
522	L	88.1	Confident	87.4	Confident	103 Å²	103	95.6 Å²	95.6	54%	0.539	50%	0.495	S	S	.	.	H	α-helix	trans	-67.7	-45.7	176.4	-179.2	61.9	0	0	0	111.4	R518 R519 F524 A525 N526	R518-L522 WeakPolarHBondContact O-CB 3.49Å; R518-L522 PolarHBondContact O-N 2.93Å; R519-L522 WeakPolarHBondContact O-CA 3.42Å; R519-L522 WeakPolarHBondContact O-CB 3.36Å; R519-L522 PolarHBondContact O-N 2.91Å; L522-F524 PolarHBondContact O-N 2.86Å; L522-A525 PolarHBondContact O-N 3.11Å; L522-N526 WeakPolarHBondContact O-CB 3.42Å; L522-N526 PolarHBondContact O-N 2.82Å; L522-N526 PolarHBondContact O-ND2 3.48Å
523	D	87.9	Confident	87.4	Confident	101 Å²	101	99.8 Å²	99.8	54%	0.54	50%	0.498	S	S	.	.	H	α-helix	trans	-64.2	-40.2	177.6	-65.3	-33.3	0	0	0	111.7	R519 F520 K527	R519-D523 PolarHBondContact O-N 2.85Å; F520-D523 PolarHBondContact O-N 2.86Å; D523-K527 VanDerWaalsContact O-CB 3.31Å; D523-K527 WeakPolarHBondContact O-CB 3.48Å; D523-K527 PolarHBondContact O-N 3Å
524	F	86.8	Confident	87.6	Confident	138 Å²	138	101.5 Å²	101.5	61%	0.605	50%	0.495	S	S	*	.	H	α-helix	trans	-66.5	-41.2	174.4	-166.5	-85.9	0	0	0	112	F520 L522 K527 A528	F520-F524 VanDerWaalsContact O-CB 3.24Å; F520-F524 WeakPolarHBondContact O-CB 3.34Å; F520-F524 PolarHBondContact O-N 2.81Å; L522-F524 PolarHBondContact O-N 2.86Å; F524-K527 PolarHBondContact O-N 3.35Å; F524-A528 WeakPolarHBondContact O-CB 3.4Å; F524-A528 PolarHBondContact O-N 3.13Å
525	A	86.7	Confident	87.6	Confident	48 Å²	48	100.6 Å²	100.6	40%	0.397	49%	0.493	S	S	.	.	H	α-helix	trans	-63.2	-47.8	174.3	0	0	0	0	0	111.6	K521 L522 K527 A528 D529	K521-A525 VanDerWaalsContact O-CB 3.27Å; K521-A525 WeakPolarHBondContact O-CB 3.24Å; K521-A525 PolarHBondContact O-N 3.49Å; L522-A525 PolarHBondContact O-N 3.11Å; A525-K527 PolarHBondContact O-N 2.78Å; A525-A528 WeakPolarHBondContact O-CB 3.49Å; A525-A528 PolarHBondContact O-N 3.29Å; A525-A528 VanDerWaalsContact O-N 3.13Å; A525-D529 PolarHBondContact O-N 3.19Å
526	N	88.6	Confident	87.7	Confident	92 Å²	92	99.5 Å²	99.5	49%	0.492	49%	0.487	S	S	.	.	H	α-helix	trans	-57.1	-37.7	174.1	-70.8	-28.4	0	0	0	111.9	L522 S530	L522-N526 WeakPolarHBondContact O-CB 3.42Å; L522-N526 PolarHBondContact O-N 2.82Å; L522-N526 PolarHBondContact O-ND2 3.48Å; N526-S530 WeakPolarHBondContact O-CB 3.4Å; N526-S530 PolarHBondContact O-N 2.81Å
527	K	89.8	Confident	87.9	Confident	122 Å²	122	102.5 Å²	102.5	53%	0.53	50%	0.495	S	S	.	.	H	α-helix	trans	-73.1	-37.8	176.8	-170	59.4	173.6	-179.9	0	112.4	D523 F524 A525 S530 L531	D523-K527 VanDerWaalsContact O-CB 3.31Å; D523-K527 WeakPolarHBondContact O-CB 3.48Å; D523-K527 PolarHBondContact O-N 3Å; F524-K527 PolarHBondContact O-N 3.35Å; A525-K527 PolarHBondContact O-N 2.78Å; K527-S530 PolarHBondContact O-N 3.05Å; K527-L531 HydrophobicContact CG-CD1 4.34Å; K527-L531 WeakPolarHBondContact O-CG 3.38Å; K527-L531 PolarHBondContact O-N 3.47Å
528	A	85.4	Confident	88	Confident	45 Å²	45	108 Å²	108	37%	0.372	51%	0.508	S	S	.	.	H	α-helix	trans	-62.9	-48.4	173.2	0	0	0	0	0	110.9	F524 A525 S530 L531 Q532	F524-A528 WeakPolarHBondContact O-CB 3.4Å; F524-A528 PolarHBondContact O-N 3.13Å; A525-A528 WeakPolarHBondContact O-CB 3.49Å; A525-A528 PolarHBondContact O-N 3.29Å; A525-A528 VanDerWaalsContact O-N 3.13Å; A528-S530 VanDerWaalsContact C-N 3.31Å; A528-S530 PolarHBondContact O-N 2.85Å; A528-L531 PolarHBondContact O-N 3.27Å; A528-L531 VanDerWaalsContact O-N 3.11Å; A528-Q532 WeakPolarHBondContact O-CB 3.38Å; A528-Q532 PolarHBondContact O-N 3.29Å
529	D	88.2	Confident	88.1	Confident	85 Å²	85	103.2 Å²	103.2	46%	0.455	49%	0.494	S	S	.	.	H	α-helix	trans	-54.1	-44.8	172.1	-106.7	51.4	0	0	0	112.3	A525 L531 Q532 R533	A525-D529 PolarHBondContact O-N 3.19Å; D529-L531 VanDerWaalsContact C-N 3.33Å; D529-L531 PolarHBondContact O-N 2.98Å; D529-Q532 PolarHBondContact O-N 3.03Å; D529-R533 VanDerWaalsContact O-CG 3.29Å; D529-R533 WeakPolarHBondContact O-CG 3.46Å; D529-R533 PolarHBondContact O-N 2.89Å; D529-R533 IonicContact OD2-CZ 3.26Å; D529-R533 IonicContact OD2-NE 2.72Å; D529-R533 IonicContact OD2-NH2 2.85Å; D529-R533 PolarHBondContact OD2-NH2 3.13Å
530	S	89.5	Confident	88.2	Confident	50 Å²	50	102.4 Å²	102.4	35%	0.35	49%	0.494	S	S	.	.	H	α-helix	trans	-65.4	-34.1	178.3	-179.1	0	0	0	0	113	N526 K527 A528 Q534	N526-S530 WeakPolarHBondContact O-CB 3.4Å; N526-S530 PolarHBondContact O-N 2.81Å; K527-S530 PolarHBondContact O-N 3.05Å; A528-S530 VanDerWaalsContact C-N 3.31Å; A528-S530 PolarHBondContact O-N 2.85Å; S530-Q534 WeakPolarHBondContact O-CG 3.32Å; S530-Q534 PolarHBondContact O-N 3.47Å; S530-Q534 PolarHBondContact O-NE2 2.84Å; S530-Q534 VanDerWaalsContact O-NE2 3.15Å
531	L	87.5	Confident	88.4	Confident	83 Å²	83	99.9 Å²	99.9	44%	0.435	48%	0.484	S	S	.	.	H	α-helix	trans	-78.3	-40	175.4	-71.6	169.2	0	0	0	111.6	K527 A528 D529 R533 Q534 I535	K527-L531 HydrophobicContact CG-CD1 4.34Å; K527-L531 WeakPolarHBondContact O-CG 3.38Å; K527-L531 PolarHBondContact O-N 3.47Å; A528-L531 PolarHBondContact O-N 3.27Å; A528-L531 VanDerWaalsContact O-N 3.11Å; D529-L531 VanDerWaalsContact C-N 3.33Å; D529-L531 PolarHBondContact O-N 2.98Å; L531-R533 PolarHBondContact O-N 3.15Å; L531-Q534 CarbonylContact O-C 3.57Å; L531-Q534 WeakPolarHBondContact O-CA 3.39Å; L531-Q534 WeakPolarHBondContact O-CB 3.45Å; L531-Q534 PolarHBondContact O-N 3.43Å; L531-I535 WeakPolarHBondContact O-CG1 3.33Å; L531-I535 PolarHBondContact O-N 3.36Å
532	Q	88.3	Confident	88.4	Confident	93 Å²	93	98.1 Å²	98.1	44%	0.435	48%	0.481	S	S	.	.	H	α-helix	trans	-58.8	-46.5	175.9	-179.3	56.7	35	0	0	111.1	A528 D529 Q534 I535 E536	A528-Q532 WeakPolarHBondContact O-CB 3.38Å; A528-Q532 PolarHBondContact O-N 3.29Å; D529-Q532 PolarHBondContact O-N 3.03Å; Q532-Q534 VanDerWaalsContact C-N 3.26Å; Q532-Q534 PolarHBondContact O-N 3.18Å; Q532-I535 WeakPolarHBondContact O-CB 3.5Å; Q532-I535 PolarHBondContact O-N 3.34Å; Q532-I535 VanDerWaalsContact O-N 3.12Å; Q532-E536 PolarHBondContact NE2-OE1 2.77Å; Q532-E536 VanDerWaalsContact NE2-OE1 3.13Å; Q532-E536 WeakPolarHBondContact O-CG 3.33Å; Q532-E536 PolarHBondContact O-N 3.01Å
533	R	88.4	Confident	88.5	Confident	165 Å²	165	99 Å²	99	62%	0.623	48%	0.483	S	S	*	.	H	α-helix	trans	-63.9	-28.7	174.1	-66.5	173.2	-155.8	-175.3	8.7	113.3	D529 L531 L537	D529-R533 VanDerWaalsContact O-CG 3.29Å; D529-R533 WeakPolarHBondContact O-CG 3.46Å; D529-R533 PolarHBondContact O-N 2.89Å; D529-R533 IonicContact OD2-CZ 3.26Å; D529-R533 IonicContact OD2-NE 2.72Å; D529-R533 IonicContact OD2-NH2 2.85Å; D529-R533 PolarHBondContact OD2-NH2 3.13Å; L531-R533 PolarHBondContact O-N 3.15Å; R533-L537 WeakPolarHBondContact O-CB 3.33Å; R533-L537 PolarHBondContact O-N 2.94Å
534	Q	90.2	Very high	88.5	Confident	103 Å²	103	99.3 Å²	99.3	48%	0.481	48%	0.481	S	S	.	.	H	α-helix	trans	-74	-39.3	172.1	-76.6	174.4	60.9	0	0	111.7	S530 L531 Q532 L537 R538	S530-Q534 WeakPolarHBondContact O-CG 3.32Å; S530-Q534 PolarHBondContact O-N 3.47Å; S530-Q534 PolarHBondContact O-NE2 2.84Å; S530-Q534 VanDerWaalsContact O-NE2 3.15Å; L531-Q534 CarbonylContact O-C 3.57Å; L531-Q534 WeakPolarHBondContact O-CA 3.39Å; L531-Q534 WeakPolarHBondContact O-CB 3.45Å; L531-Q534 PolarHBondContact O-N 3.43Å; Q532-Q534 VanDerWaalsContact C-N 3.26Å; Q532-Q534 PolarHBondContact O-N 3.18Å; Q534-L537 PolarHBondContact O-N 3.12Å; Q534-R538 WeakPolarHBondContact O-CG 3.38Å; Q534-R538 PolarHBondContact O-N 2.93Å
535	I	87.4	Confident	88.5	Confident	82 Å²	82	98 Å²	98	42%	0.421	48%	0.479	S	S	.	.	H	α-helix	trans	-60.4	-52.8	173.8	-68.9	164.7	0	0	0	109.5	L531 Q532 L537 R538 E539	L531-I535 WeakPolarHBondContact O-CG1 3.33Å; L531-I535 PolarHBondContact O-N 3.36Å; Q532-I535 WeakPolarHBondContact O-CB 3.5Å; Q532-I535 PolarHBondContact O-N 3.34Å; Q532-I535 VanDerWaalsContact O-N 3.12Å; I535-L537 PolarHBondContact O-N 3.31Å; I535-R538 CarbonylContact O-C 3.51Å; I535-R538 WeakPolarHBondContact O-CA 3.43Å; I535-R538 WeakPolarHBondContact O-CB 3.48Å; I535-R538 PolarHBondContact O-N 3.19Å; I535-E539 HydrophobicContact CG2-CG 4.16Å; I535-E539 WeakPolarHBondContact O-CG 3.37Å; I535-E539 PolarHBondContact O-N 3.08Å
536	E	88.3	Confident	88.6	Confident	72 Å²	72	102 Å²	102	34%	0.336	49%	0.49	S	S	.	.	H	α-helix	trans	-57	-34.9	177.2	-71.7	169.6	-154.1	0	0	113.4	Q532 K540	Q532-E536 PolarHBondContact NE2-OE1 2.77Å; Q532-E536 VanDerWaalsContact NE2-OE1 3.13Å; Q532-E536 WeakPolarHBondContact O-CG 3.33Å; Q532-E536 PolarHBondContact O-N 3.01Å; E536-K540 WeakPolarHBondContact O-CB 3.37Å; E536-K540 WeakPolarHBondContact O-CD 3.46Å; E536-K540 VanDerWaalsContact O-CG 3.27Å; E536-K540 WeakPolarHBondContact O-CG 3.33Å; E536-K540 PolarHBondContact O-N 3.2Å; E536-K540 VanDerWaalsContact O-N 3.08Å
537	L	91.2	Very high	88.5	Confident	99 Å²	99	101 Å²	101	52%	0.518	49%	0.487	S	S	.	.	H	α-helix	trans	-70.6	-39.1	174.4	-179.2	62.3	0	0	0	111.8	R533 Q534 I535 Q541	R533-L537 WeakPolarHBondContact O-CB 3.33Å; R533-L537 PolarHBondContact O-N 2.94Å; Q534-L537 PolarHBondContact O-N 3.12Å; I535-L537 PolarHBondContact O-N 3.31Å; L537-Q541 WeakPolarHBondContact O-CG 3.45Å; L537-Q541 PolarHBondContact O-N 3.36Å
538	R	88.8	Confident	88.5	Confident	166 Å²	166	98.5 Å²	98.5	63%	0.626	48%	0.48	S	S	*	.	H	α-helix	trans	-70.5	-36.9	174.8	-68.6	-52.5	-167.9	157	8	112.3	Q534 I535 Q541 L542	Q534-R538 WeakPolarHBondContact O-CG 3.38Å; Q534-R538 PolarHBondContact O-N 2.93Å; I535-R538 CarbonylContact O-C 3.51Å; I535-R538 WeakPolarHBondContact O-CA 3.43Å; I535-R538 WeakPolarHBondContact O-CB 3.48Å; I535-R538 PolarHBondContact O-N 3.19Å; R538-Q541 VanDerWaalsContact CD-OE1 3.26Å; R538-Q541 VanDerWaalsContact NH1-OE1 3.08Å; R538-Q541 WeakPolarHBondContact O-CB 3.29Å; R538-Q541 PolarHBondContact O-N 3.44Å; R538-L542 WeakPolarHBondContact O-CB 3.27Å; R538-L542 WeakPolarHBondContact O-CG 3.48Å; R538-L542 PolarHBondContact O-N 2.83Å
539	E	89.3	Confident	88.7	Confident	96 Å²	96	100.1 Å²	100.1	45%	0.449	48%	0.482	S	S	.	.	H	α-helix	trans	-62.6	-44.2	173.5	-71.9	172.7	157.7	0	0	111	I535 Q541 L542 Q543	I535-E539 HydrophobicContact CG2-CG 4.16Å; I535-E539 WeakPolarHBondContact O-CG 3.37Å; I535-E539 PolarHBondContact O-N 3.08Å; E539-Q541 VanDerWaalsContact C-N 3.34Å; E539-Q541 PolarHBondContact O-N 3.24Å; E539-L542 PolarHBondContact O-N 3.47Å; E539-Q543 WeakPolarHBondContact O-CB 3.36Å; E539-Q543 WeakPolarHBondContact O-CG 2.8Å; E539-Q543 PolarHBondContact O-N 2.8Å
540	K	89.7	Confident	88.7	Confident	129 Å²	129	101.8 Å²	101.8	56%	0.561	49%	0.485	S	S	*	.	H	α-helix	trans	-62.7	-38.5	172.6	-73.3	163.2	-174.2	157.7	0	112.5	E536 Q544	E536-K540 WeakPolarHBondContact O-CB 3.37Å; E536-K540 WeakPolarHBondContact O-CD 3.46Å; E536-K540 VanDerWaalsContact O-CG 3.27Å; E536-K540 WeakPolarHBondContact O-CG 3.33Å; E536-K540 PolarHBondContact O-N 3.2Å; E536-K540 VanDerWaalsContact O-N 3.08Å; K540-Q544 WeakPolarHBondContact O-CB 3.41Å; K540-Q544 PolarHBondContact O-N 3.25Å
541	Q	89.3	Confident	88.7	Confident	84 Å²	84	104.3 Å²	104.3	39%	0.393	49%	0.493	S	S	.	.	H	α-helix	trans	-65.7	-40.7	173	-75.5	177.1	-8.7	0	0	112.3	L537 R538 E539 Q544 L545	L537-Q541 WeakPolarHBondContact O-CG 3.45Å; L537-Q541 PolarHBondContact O-N 3.36Å; R538-Q541 VanDerWaalsContact CD-OE1 3.26Å; R538-Q541 VanDerWaalsContact NH1-OE1 3.08Å; R538-Q541 WeakPolarHBondContact O-CB 3.29Å; R538-Q541 PolarHBondContact O-N 3.44Å; E539-Q541 VanDerWaalsContact C-N 3.34Å; E539-Q541 PolarHBondContact O-N 3.24Å; Q541-Q544 PolarHBondContact O-N 2.87Å; Q541-L545 WeakPolarHBondContact O-CB 3.49Å; Q541-L545 VanDerWaalsContact O-CG 3.27Å; Q541-L545 WeakPolarHBondContact O-CG 3.43Å; Q541-L545 PolarHBondContact O-N 3.37Å
542	L	87.9	Confident	88.8	Confident	105 Å²	105	103.9 Å²	103.9	55%	0.55	49%	0.489	S	S	.	.	H	α-helix	trans	-66.1	-45.7	176.2	-74.6	169.1	0	0	0	111.2	R538 E539 Q544 L545 E546	R538-L542 WeakPolarHBondContact O-CB 3.27Å; R538-L542 WeakPolarHBondContact O-CG 3.48Å; R538-L542 PolarHBondContact O-N 2.83Å; E539-L542 PolarHBondContact O-N 3.47Å; L542-Q544 VanDerWaalsContact C-N 3.33Å; L542-Q544 PolarHBondContact O-N 2.77Å; L542-L545 CarbonylContact O-C 3.58Å; L542-L545 PolarHBondContact O-N 3.37Å; L542-E546 WeakPolarHBondContact O-CB 3.2Å; L542-E546 WeakPolarHBondContact O-CG 3.12Å; L542-E546 PolarHBondContact O-N 3.2Å
543	Q	88.5	Confident	88.8	Confident	121 Å²	121	106.9 Å²	106.9	57%	0.565	50%	0.496	S	S	*	.	H	α-helix	trans	-58.7	-43.1	175.1	-74.3	173.7	-3.8	0	0	111.9	E539 E546 T547	E539-Q543 WeakPolarHBondContact O-CB 3.36Å; E539-Q543 WeakPolarHBondContact O-CG 2.8Å; E539-Q543 PolarHBondContact O-N 2.8Å; Q543-E546 PolarHBondContact O-N 2.98Å; Q543-T547 PolarHBondContact O-N 3.48Å; Q543-T547 PolarHBondContact O-OG1 3.03Å
544	Q	89.2	Confident	88.8	Confident	108 Å²	108	104.1 Å²	104.1	51%	0.505	49%	0.49	S	S	.	.	H	α-helix	trans	-61.3	-49.3	174.5	-175	62.7	57.2	0	0	111.2	K540 Q541 L542 E546 T547 D548	K540-Q544 WeakPolarHBondContact O-CB 3.41Å; K540-Q544 PolarHBondContact O-N 3.25Å; Q541-Q544 PolarHBondContact O-N 2.87Å; L542-Q544 VanDerWaalsContact C-N 3.33Å; L542-Q544 PolarHBondContact O-N 2.77Å; Q544-E546 VanDerWaalsContact C-N 3.3Å; Q544-E546 PolarHBondContact O-N 3.41Å; Q544-T547 WeakPolarHBondContact CA-OG1 3.35Å; Q544-T547 PolarHBondContact O-N 3.01Å; Q544-T547 VanDerWaalsContact O-N 3.12Å; Q544-T547 PolarHBondContact O-OG1 2.92Å; Q544-D548 PolarHBondContact NE2-OD1 2.93Å; Q544-D548 PolarHBondContact O-N 2.86Å
545	L	87.1	Confident	88.7	Confident	110 Å²	110	108 Å²	108	58%	0.576	50%	0.501	S	S	*	.	H	α-helix	trans	-64.9	-31	178.7	-71	169.4	0	0	0	112.9	Q541 L542 L549	Q541-L545 WeakPolarHBondContact O-CB 3.49Å; Q541-L545 VanDerWaalsContact O-CG 3.27Å; Q541-L545 WeakPolarHBondContact O-CG 3.43Å; Q541-L545 PolarHBondContact O-N 3.37Å; L542-L545 CarbonylContact O-C 3.58Å; L542-L545 PolarHBondContact O-N 3.37Å; L545-L549 WeakPolarHBondContact O-CB 3.47Å; L545-L549 PolarHBondContact O-N 3.5Å
546	E	89	Confident	88.7	Confident	133 Å²	133	111.8 Å²	111.8	62%	0.621	51%	0.51	S	S	*	.	H	α-helix	trans	-69.7	-39.4	171.6	-77.1	-177.6	166.9	0	0	111.6	L542 Q543 Q544 K550	L542-E546 WeakPolarHBondContact O-CB 3.2Å; L542-E546 WeakPolarHBondContact O-CG 3.12Å; L542-E546 PolarHBondContact O-N 3.2Å; Q543-E546 PolarHBondContact O-N 2.98Å; Q544-E546 VanDerWaalsContact C-N 3.3Å; Q544-E546 PolarHBondContact O-N 3.41Å; E546-K550 VanDerWaalsContact O-CB 3.29Å; E546-K550 WeakPolarHBondContact O-CB 3.25Å; E546-K550 PolarHBondContact O-N 3.35Å
547	T	86.5	Confident	88.6	Confident	69 Å²	69	113.3 Å²	113.3	42%	0.423	52%	0.517	S	S	.	.	H	α-helix	trans	-67.2	-40.4	171.9	50.7	0	0	0	0	112.2	Q543 Q544 K550 I551	Q543-T547 PolarHBondContact O-N 3.48Å; Q543-T547 PolarHBondContact O-OG1 3.03Å; Q544-T547 WeakPolarHBondContact CA-OG1 3.35Å; Q544-T547 PolarHBondContact O-N 3.01Å; Q544-T547 VanDerWaalsContact O-N 3.12Å; Q544-T547 PolarHBondContact O-OG1 2.92Å; T547-K550 WeakPolarHBondContact O-CB 3.47Å; T547-K550 PolarHBondContact O-N 3.25Å; T547-I551 WeakPolarHBondContact O-CD1 3.44Å; T547-I551 VanDerWaalsContact O-CG1 3.27Å; T547-I551 WeakPolarHBondContact O-CG1 3.27Å; T547-I551 PolarHBondContact O-N 3.01Å
548	D	89.3	Confident	88.5	Confident	71 Å²	71	112 Å²	112	38%	0.38	51%	0.513	S	S	.	.	H	α-helix	trans	-65.9	-42.4	177.5	-61.3	-19.2	0	0	0	110.9	Q544 K550 I551 E552	Q544-D548 PolarHBondContact NE2-OD1 2.93Å; Q544-D548 PolarHBondContact O-N 2.86Å; D548-K550 VanDerWaalsContact C-N 3.35Å; D548-I551 PolarHBondContact O-N 3.45Å; D548-E552 PolarHBondContact O-N 3.29Å
549	L	88.2	Confident	88.3	Confident	79 Å²	79	109 Å²	109	41%	0.414	51%	0.509	S	S	.	.	H	α-helix	trans	-67	-33.6	174.2	179.6	61.6	0	0	0	112.3	L545 R553	L545-L549 WeakPolarHBondContact O-CB 3.47Å; L545-L549 PolarHBondContact O-N 3.5Å; L549-R553 WeakPolarHBondContact O-CB 3.29Å; L549-R553 WeakPolarHBondContact O-CD 3.27Å; L549-R553 WeakPolarHBondContact O-CG 3.5Å; L549-R553 PolarHBondContact O-N 2.88Å
550	K	89.8	Confident	88.2	Confident	119 Å²	119	108.5 Å²	108.5	52%	0.517	51%	0.507	S	S	.	.	H	α-helix	trans	-65.8	-44.6	171.9	-178.4	-176.2	166.1	-173.5	0	110.7	E546 T547 D548 R553 E554	E546-K550 VanDerWaalsContact O-CB 3.29Å; E546-K550 WeakPolarHBondContact O-CB 3.25Å; E546-K550 PolarHBondContact O-N 3.35Å; T547-K550 WeakPolarHBondContact O-CB 3.47Å; T547-K550 PolarHBondContact O-N 3.25Å; D548-K550 VanDerWaalsContact C-N 3.35Å; K550-R553 PolarHBondContact O-N 2.82Å; K550-E554 WeakPolarHBondContact CE-OE1 3.46Å; K550-E554 IonicContact NZ-OE1 3.09Å; K550-E554 WeakPolarHBondContact O-CG 3.45Å; K550-E554 PolarHBondContact O-N 2.74Å
551	I	89.1	Confident	88	Confident	104 Å²	104	105.5 Å²	105.5	53%	0.533	50%	0.497	S	S	.	.	H	α-helix	trans	-62.6	-42.9	176.3	-68.1	162.1	0	0	0	110.5	T547 D548 R553 E554 W555	T547-I551 WeakPolarHBondContact O-CD1 3.44Å; T547-I551 VanDerWaalsContact O-CG1 3.27Å; T547-I551 WeakPolarHBondContact O-CG1 3.27Å; T547-I551 PolarHBondContact O-N 3.01Å; D548-I551 PolarHBondContact O-N 3.45Å; I551-R553 PolarHBondContact O-N 3.12Å; I551-E554 PolarHBondContact O-N 3.22Å; I551-W555 VanDerWaalsContact O-CB 3.27Å; I551-W555 WeakPolarHBondContact O-CB 3.49Å; I551-W555 PolarHBondContact O-N 2.9Å
552	E	89.6	Confident	87.9	Confident	73 Å²	73	104.5 Å²	104.5	34%	0.341	49%	0.494	S	S	.	.	H	α-helix	trans	-58.5	-45.8	173.6	-171.5	-84.2	168.3	0	0	111.4	D548 E554 W555 R556	D548-E552 PolarHBondContact O-N 3.29Å; E552-E554 PolarHBondContact O-N 3.26Å; E552-W555 PolarHBondContact O-N 3.25Å; E552-R556 WeakPolarHBondContact O-CB 3.37Å; E552-R556 PolarHBondContact O-N 2.98Å; E552-R556 WeakPolarHBondContact OE1-CD 3.42Å; E552-R556 IonicContact OE1-CZ 2.67Å; E552-R556 IonicContact OE1-NE 3.3Å; E552-R556 IonicContact OE1-NH1 2.85Å; E552-R556 PolarHBondContact OE1-NH1 3.49Å
553	R	87.9	Confident	87.9	Confident	156 Å²	156	104.6 Å²	104.6	59%	0.589	50%	0.495	S	S	*	.	H	α-helix	trans	-63.1	-43	178.6	-73.7	166.3	177.5	-178.1	0.5	112.5	L549 K550 I551 Q557	L549-R553 WeakPolarHBondContact O-CB 3.29Å; L549-R553 WeakPolarHBondContact O-CD 3.27Å; L549-R553 WeakPolarHBondContact O-CG 3.5Å; L549-R553 PolarHBondContact O-N 2.88Å; K550-R553 PolarHBondContact O-N 2.82Å; I551-R553 PolarHBondContact O-N 3.12Å; R553-Q557 VanDerWaalsContact O-CB 3.25Å; R553-Q557 WeakPolarHBondContact O-CB 3.48Å; R553-Q557 PolarHBondContact O-N 2.93Å
554	E	88	Confident	87.8	Confident	107 Å²	107	102 Å²	102	50%	0.5	49%	0.485	S	S	.	.	H	α-helix	trans	-67.1	-40.2	177.3	-72.8	175.7	173.3	0	0	111.4	K550 I551 E552 T558	K550-E554 WeakPolarHBondContact CE-OE1 3.46Å; K550-E554 IonicContact NZ-OE1 3.09Å; K550-E554 WeakPolarHBondContact O-CG 3.45Å; K550-E554 PolarHBondContact O-N 2.74Å; I551-E554 PolarHBondContact O-N 3.22Å; E552-E554 PolarHBondContact O-N 3.26Å; E554-T558 WeakPolarHBondContact O-CB 3.44Å; E554-T558 PolarHBondContact O-N 3.27Å; E554-T558 PolarHBondContact O-OG1 2.77Å
555	W	88.1	Confident	87.7	Confident	186 Å²	186	104.2 Å²	104.2	71%	0.705	49%	0.488	S	S	*	.	H	α-helix	trans	-67.6	-42.7	175.9	-159.2	69.2	0	0	0	112	I551 E552 T558 L559	I551-W555 VanDerWaalsContact O-CB 3.27Å; I551-W555 WeakPolarHBondContact O-CB 3.49Å; I551-W555 PolarHBondContact O-N 2.9Å; E552-W555 PolarHBondContact O-N 3.25Å; W555-T558 WeakPolarHBondContact O-CB 3.29Å; W555-T558 PolarHBondContact O-N 3.36Å; W555-L559 WeakPolarHBondContact O-CB 3.11Å; W555-L559 PolarHBondContact O-N 3.06Å
556	R	87.1	Confident	87.6	Confident	160 Å²	160	104.1 Å²	104.1	60%	0.604	49%	0.485	S	S	*	.	H	α-helix	trans	-66.5	-38.6	176	-169.9	-172.1	-163.5	125.4	-3.3	112.3	E552 T558 L559 Q560	E552-R556 WeakPolarHBondContact O-CB 3.37Å; E552-R556 PolarHBondContact O-N 2.98Å; E552-R556 WeakPolarHBondContact OE1-CD 3.42Å; E552-R556 IonicContact OE1-CZ 2.67Å; E552-R556 IonicContact OE1-NE 3.3Å; E552-R556 IonicContact OE1-NH1 2.85Å; E552-R556 PolarHBondContact OE1-NH1 3.49Å; R556-T558 VanDerWaalsContact C-N 3.34Å; R556-L559 PolarHBondContact O-N 2.97Å; R556-Q560 VanDerWaalsContact O-CB 3.29Å; R556-Q560 WeakPolarHBondContact O-CB 3.27Å; R556-Q560 PolarHBondContact O-N 3.47Å
557	Q	87.6	Confident	87.4	Confident	105 Å²	105	106.6 Å²	106.6	49%	0.491	49%	0.489	S	S	.	.	H	α-helix	trans	-65.8	-38.9	172.7	-176.8	62.2	68.5	0	0	111.2	R553 Q560 N561	R553-Q557 VanDerWaalsContact O-CB 3.25Å; R553-Q557 WeakPolarHBondContact O-CB 3.48Å; R553-Q557 PolarHBondContact O-N 2.93Å; Q557-Q560 PolarHBondContact O-N 3.17Å; Q557-N561 PolarHBondContact NE2-OD1 3.36Å; Q557-N561 PolarHBondContact O-N 2.75Å; Q557-N561 PolarHBondContact O-ND2 3.21Å; Q557-N561 PolarHBondContact O-OD1 2.79Å
558	T	87.9	Confident	87.4	Confident	71 Å²	71	108.1 Å²	108.1	44%	0.436	49%	0.494	S	S	.	.	H	α-helix	trans	-62.4	-51.1	173.9	-55.9	0	0	0	0	110.4	E554 W555 R556 Q560 N561 D562	E554-T558 WeakPolarHBondContact O-CB 3.44Å; E554-T558 PolarHBondContact O-N 3.27Å; E554-T558 PolarHBondContact O-OG1 2.77Å; W555-T558 WeakPolarHBondContact O-CB 3.29Å; W555-T558 PolarHBondContact O-N 3.36Å; R556-T558 VanDerWaalsContact C-N 3.34Å; T558-Q560 VanDerWaalsContact C-N 3.28Å; T558-Q560 PolarHBondContact O-N 2.74Å; T558-N561 WeakPolarHBondContact O-CA 3.47Å; T558-N561 WeakPolarHBondContact O-CB 3.37Å; T558-N561 PolarHBondContact O-N 2.91Å; T558-D562 PolarHBondContact O-N 2.73Å
559	L	86.1	Confident	87.2	Confident	102 Å²	102	108.7 Å²	108.7	53%	0.534	50%	0.496	S	S	.	.	H	α-helix	trans	-60.3	-35	177.2	-167.7	70.3	0	0	0	112.8	W555 R556 D562 L563	W555-L559 WeakPolarHBondContact O-CB 3.11Å; W555-L559 PolarHBondContact O-N 3.06Å; R556-L559 PolarHBondContact O-N 2.97Å; L559-D562 PolarHBondContact O-N 2.89Å; L559-L563 VanDerWaalsContact O-CB 3.31Å; L559-L563 WeakPolarHBondContact O-CB 3.41Å; L559-L563 PolarHBondContact O-N 2.9Å
560	Q	86.3	Confident	87.1	Confident	86 Å²	86	109.2 Å²	109.2	40%	0.402	50%	0.502	S	S	.	.	H	α-helix	trans	-70.7	-35.3	174	-176.1	61.3	74.8	0	0	112.3	R556 Q557 T558 N564	R556-Q560 VanDerWaalsContact O-CB 3.29Å; R556-Q560 WeakPolarHBondContact O-CB 3.27Å; R556-Q560 PolarHBondContact O-N 3.47Å; Q557-Q560 PolarHBondContact O-N 3.17Å; T558-Q560 VanDerWaalsContact C-N 3.28Å; T558-Q560 PolarHBondContact O-N 2.74Å; Q560-N564 PolarHBondContact NE2-OD1 3.47Å; Q560-N564 VanDerWaalsContact NE2-OD1 3.08Å; Q560-N564 WeakPolarHBondContact O-CB 3.35Å; Q560-N564 PolarHBondContact O-N 3.06Å; Q560-N564 PolarHBondContact O-ND2 3.29Å; Q560-N564 PolarHBondContact O-OD1 3.42Å
561	N	86.3	Confident	86.8	Confident	67 Å²	67	106.9 Å²	106.9	36%	0.358	50%	0.5	S	S	.	.	H	α-helix	trans	-67.4	-40.1	173.1	-64.6	-17.9	0	0	0	110.8	Q557 T558 N564 R565	Q557-N561 PolarHBondContact NE2-OD1 3.36Å; Q557-N561 PolarHBondContact O-N 2.75Å; Q557-N561 PolarHBondContact O-ND2 3.21Å; Q557-N561 PolarHBondContact O-OD1 2.79Å; T558-N561 WeakPolarHBondContact O-CA 3.47Å; T558-N561 WeakPolarHBondContact O-CB 3.37Å; T558-N561 PolarHBondContact O-N 2.91Å; N561-N564 PolarHBondContact O-N 3.08Å; N561-R565 WeakPolarHBondContact O-CG 3.41Å; N561-R565 PolarHBondContact O-N 2.77Å
562	D	87.7	Confident	86.6	Confident	63 Å²	63	108 Å²	108	34%	0.337	50%	0.504	S	S	.	.	H	α-helix	trans	-68.4	-42.7	175.9	-66.3	-33.4	0	0	0	111.9	T558 L559 N564 R565 E566	T558-D562 PolarHBondContact O-N 2.73Å; L559-D562 PolarHBondContact O-N 2.89Å; D562-N564 PolarHBondContact O-N 3.34Å; D562-R565 WeakPolarHBondContact O-CB 3.48Å; D562-R565 PolarHBondContact O-N 3.34Å; D562-R565 VanDerWaalsContact O-N 3.1Å; D562-R565 IonicContact OD1-CZ 3.88Å; D562-R565 IonicContact OD1-NH1 2.66Å; D562-R565 PolarHBondContact OD1-NH1 2.85Å; D562-E566 WeakPolarHBondContact O-CG 3.09Å; D562-E566 PolarHBondContact O-N 2.87Å
563	L	87.8	Confident	86.2	Confident	107 Å²	107	109.2 Å²	109.2	56%	0.56	51%	0.512	S	S	*	.	H	α-helix	trans	-59.4	-34.4	172	-177.9	62.2	0	0	0	112.4	L559 R567	L559-L563 VanDerWaalsContact O-CB 3.31Å; L559-L563 WeakPolarHBondContact O-CB 3.41Å; L559-L563 PolarHBondContact O-N 2.9Å; L563-R567 VanDerWaalsContact O-CB 3.27Å; L563-R567 WeakPolarHBondContact O-CB 3.37Å; L563-R567 PolarHBondContact O-N 2.79Å
564	N	86.2	Confident	86	Confident	66 Å²	66	105 Å²	105	35%	0.353	51%	0.506	S	S	.	.	H	α-helix	trans	-70.3	-42.7	173.4	-68.8	-10.7	0	0	0	111.6	Q560 N561 D562 E566 R567 D568	Q560-N564 PolarHBondContact NE2-OD1 3.47Å; Q560-N564 VanDerWaalsContact NE2-OD1 3.08Å; Q560-N564 WeakPolarHBondContact O-CB 3.35Å; Q560-N564 PolarHBondContact O-N 3.06Å; Q560-N564 PolarHBondContact O-ND2 3.29Å; Q560-N564 PolarHBondContact O-OD1 3.42Å; N561-N564 PolarHBondContact O-N 3.08Å; D562-N564 PolarHBondContact O-N 3.34Å; N564-E566 PolarHBondContact O-N 3.39Å; N564-R567 WeakPolarHBondContact O-CB 3.49Å; N564-R567 PolarHBondContact O-N 3.04Å; N564-R567 VanDerWaalsContact O-N 3.17Å; N564-D568 VanDerWaalsContact O-CG 3.3Å; N564-D568 PolarHBondContact O-N 2.87Å
565	R	85.8	Confident	85.6	Confident	154 Å²	154	103.1 Å²	103.1	58%	0.581	50%	0.502	S	S	*	.	H	α-helix	trans	-58.3	-47.3	174.3	-71	164.3	176.1	151.3	-2.5	112	N561 D562 R567 D568 M569	N561-R565 WeakPolarHBondContact O-CG 3.41Å; N561-R565 PolarHBondContact O-N 2.77Å; D562-R565 WeakPolarHBondContact O-CB 3.48Å; D562-R565 PolarHBondContact O-N 3.34Å; D562-R565 VanDerWaalsContact O-N 3.1Å; D562-R565 IonicContact OD1-CZ 3.88Å; D562-R565 IonicContact OD1-NH1 2.66Å; D562-R565 PolarHBondContact OD1-NH1 2.85Å; R565-R567 VanDerWaalsContact C-N 3.32Å; R565-R567 PolarHBondContact O-N 2.85Å; R565-D568 PolarHBondContact O-N 3.17Å; R565-M569 VanDerWaalsContact O-CB 3.32Å; R565-M569 WeakPolarHBondContact O-CB 3.38Å; R565-M569 PolarHBondContact O-N 3.49Å
566	E	84.8	Confident	85.3	Confident	109 Å²	109	99 Å²	99	51%	0.509	49%	0.491	S	S	.	.	H	α-helix	trans	-61.4	-40.1	175.3	-70.4	-58.9	134.4	0	0	111.5	D562 N564 M569 V570	D562-E566 WeakPolarHBondContact O-CG 3.09Å; D562-E566 PolarHBondContact O-N 2.87Å; N564-E566 PolarHBondContact O-N 3.39Å; E566-M569 VanDerWaalsContact CD-CE 3.46Å; E566-M569 PolarHBondContact O-N 2.96Å; E566-M569 WeakPolarHBondContact OE1-CE 3.31Å; E566-M569 VanDerWaalsContact OE2-CE 3.25Å; E566-M569 WeakPolarHBondContact OE2-CE 3.16Å; E566-V570 WeakPolarHBondContact O-CB 3.23Å; E566-V570 VanDerWaalsContact O-CG2 3.27Å; E566-V570 WeakPolarHBondContact O-CG2 3.5Å; E566-V570 PolarHBondContact O-N 3.1Å
567	R	86.6	Confident	84.8	Confident	184 Å²	184	94.1 Å²	94.1	69%	0.694	48%	0.484	S	S	*	.	H	α-helix	trans	-65.8	-41.8	176.5	-171.5	-179.3	-168.2	171	4.6	112.7	L563 N564 R565 V570 S571	L563-R567 VanDerWaalsContact O-CB 3.27Å; L563-R567 WeakPolarHBondContact O-CB 3.37Å; L563-R567 PolarHBondContact O-N 2.79Å; N564-R567 WeakPolarHBondContact O-CB 3.49Å; N564-R567 PolarHBondContact O-N 3.04Å; N564-R567 VanDerWaalsContact O-N 3.17Å; R565-R567 VanDerWaalsContact C-N 3.32Å; R565-R567 PolarHBondContact O-N 2.85Å; R567-V570 PolarHBondContact O-N 3.32Å; R567-S571 WeakPolarHBondContact O-CB 3.43Å; R567-S571 PolarHBondContact O-N 3.28Å
568	D	85.9	Confident	84.6	Confident	102 Å²	102	94.6 Å²	94.6	55%	0.545	49%	0.49	S	S	.	.	H	α-helix	trans	-67.6	-40	177.3	-68.9	-22.3	0	0	0	110.8	N564 R565 S571 Q572	N564-D568 VanDerWaalsContact O-CG 3.3Å; N564-D568 PolarHBondContact O-N 2.87Å; R565-D568 PolarHBondContact O-N 3.17Å; D568-S571 WeakPolarHBondContact O-CB 3.45Å; D568-S571 PolarHBondContact O-N 2.9Å; D568-Q572 WeakPolarHBondContact O-CG 3.41Å; D568-Q572 PolarHBondContact O-N 2.95Å
569	M	85.3	Confident	84.2	Confident	83 Å²	83	97.2 Å²	97.2	41%	0.409	50%	0.497	S	S	.	.	H	α-helix	trans	-64.6	-42.7	173.6	-178	163	55.1	0	0	112.1	R565 E566 S571 Q572 L573	R565-M569 VanDerWaalsContact O-CB 3.32Å; R565-M569 WeakPolarHBondContact O-CB 3.38Å; R565-M569 PolarHBondContact O-N 3.49Å; E566-M569 VanDerWaalsContact CD-CE 3.46Å; E566-M569 PolarHBondContact O-N 2.96Å; E566-M569 WeakPolarHBondContact OE1-CE 3.31Å; E566-M569 VanDerWaalsContact OE2-CE 3.25Å; E566-M569 WeakPolarHBondContact OE2-CE 3.16Å; M569-S571 VanDerWaalsContact C-N 3.28Å; M569-S571 PolarHBondContact O-N 3.02Å; M569-Q572 PolarHBondContact O-N 2.85Å; M569-L573 HydrophobicContact CG-CD1 4.14Å; M569-L573 WeakPolarHBondContact O-CB 3.46Å; M569-L573 VanDerWaalsContact O-CG 3.31Å; M569-L573 WeakPolarHBondContact O-CG 3.27Å; M569-L573 PolarHBondContact O-N 3.25Å
570	V	85.3	Confident	83.8	Confident	90 Å²	90	97.8 Å²	97.8	55%	0.545	50%	0.499	S	S	.	.	H	α-helix	trans	-62.5	-35.6	171.3	166.9	0	0	0	0	111.4	E566 R567 S574	E566-V570 WeakPolarHBondContact O-CB 3.23Å; E566-V570 VanDerWaalsContact O-CG2 3.27Å; E566-V570 WeakPolarHBondContact O-CG2 3.5Å; E566-V570 PolarHBondContact O-N 3.1Å; R567-V570 PolarHBondContact O-N 3.32Å; V570-S574 WeakPolarHBondContact O-CB 3.34Å; V570-S574 PolarHBondContact O-N 2.65Å
571	S	83.7	Confident	83.4	Confident	69 Å²	69	97.7 Å²	97.7	48%	0.483	50%	0.502	S	S	.	.	H	α-helix	trans	-67.7	-40.4	175.1	-165.3	0	0	0	0	112.3	R567 D568 M569 T575	R567-S571 WeakPolarHBondContact O-CB 3.43Å; R567-S571 PolarHBondContact O-N 3.28Å; D568-S571 WeakPolarHBondContact O-CB 3.45Å; D568-S571 PolarHBondContact O-N 2.9Å; M569-S571 VanDerWaalsContact C-N 3.28Å; M569-S571 PolarHBondContact O-N 3.02Å; S571-T575 WeakPolarHBondContact O-CB 3.34Å; S571-T575 PolarHBondContact O-N 3.06Å; S571-T575 PolarHBondContact O-OG1 2.96Å
572	Q	84	Confident	83	Confident	129 Å²	129	96.3 Å²	96.3	60%	0.603	50%	0.503	S	S	*	.	H	α-helix	trans	-62.1	-53.8	172.1	-74.6	-179.6	-23.2	0	0	111.2	D568 M569 S574 T575 E576	D568-Q572 WeakPolarHBondContact O-CG 3.41Å; D568-Q572 PolarHBondContact O-N 2.95Å; M569-Q572 PolarHBondContact O-N 2.85Å; Q572-S574 VanDerWaalsContact C-N 3.27Å; Q572-S574 PolarHBondContact O-N 2.79Å; Q572-T575 CarbonylContact O-C 3.57Å; Q572-T575 WeakPolarHBondContact O-CA 3.42Å; Q572-T575 WeakPolarHBondContact O-CB 3.41Å; Q572-T575 PolarHBondContact O-N 2.83Å; Q572-E576 PolarHBondContact O-N 3.47Å
573	L	82.4	Confident	82.6	Confident	98 Å²	98	99.2 Å²	99.2	51%	0.513	52%	0.518	S	S	.	.	H	α-helix	trans	-60	-35.1	178.4	-68.9	169.3	0	0	0	112.6	M569 A577	M569-L573 HydrophobicContact CG-CD1 4.14Å; M569-L573 WeakPolarHBondContact O-CB 3.46Å; M569-L573 VanDerWaalsContact O-CG 3.31Å; M569-L573 WeakPolarHBondContact O-CG 3.27Å; M569-L573 PolarHBondContact O-N 3.25Å; L573-A577 VanDerWaalsContact O-CB 3.29Å; L573-A577 WeakPolarHBondContact O-CB 3.5Å; L573-A577 PolarHBondContact O-N 3.03Å
574	S	82.8	Confident	82.2	Confident	66 Å²	66	100.2 Å²	100.2	46%	0.462	52%	0.518	S	S	.	.	H	α-helix	trans	-68	-36.6	173.3	-173	0	0	0	0	112.2	V570 Q572 A577 L578	V570-S574 WeakPolarHBondContact O-CB 3.34Å; V570-S574 PolarHBondContact O-N 2.65Å; Q572-S574 VanDerWaalsContact C-N 3.27Å; Q572-S574 PolarHBondContact O-N 2.79Å; S574-A577 PolarHBondContact O-N 3.21Å; S574-L578 WeakPolarHBondContact O-CG 3.32Å; S574-L578 PolarHBondContact O-N 2.97Å
575	T	81	Confident	82	Confident	68 Å²	68	104.2 Å²	104.2	42%	0.417	53%	0.532	S	S	.	.	H	α-helix	trans	-68.3	-43	174.7	-56.1	0	0	0	0	111.4	S571 Q572 L578 Q579	S571-T575 WeakPolarHBondContact O-CB 3.34Å; S571-T575 PolarHBondContact O-N 3.06Å; S571-T575 PolarHBondContact O-OG1 2.96Å; Q572-T575 CarbonylContact O-C 3.57Å; Q572-T575 WeakPolarHBondContact O-CA 3.42Å; Q572-T575 WeakPolarHBondContact O-CB 3.41Å; Q572-T575 PolarHBondContact O-N 2.83Å; T575-L578 WeakPolarHBondContact O-CB 3.39Å; T575-L578 PolarHBondContact O-N 3.31Å; T575-Q579 WeakPolarHBondContact O-CG 3.47Å; T575-Q579 PolarHBondContact O-N 2.95Å
576	E	80.8	Confident	81.6	Confident	101 Å²	101	100.8 Å²	100.8	47%	0.472	52%	0.523	S	S	.	.	H	α-helix	trans	-62	-44.1	173.4	-70.1	175.4	-172	0	0	111.5	Q572 L578 Q579 I580	Q572-E576 PolarHBondContact O-N 3.47Å; E576-L578 VanDerWaalsContact C-N 3.3Å; E576-L578 PolarHBondContact O-N 3.26Å; E576-Q579 WeakPolarHBondContact O-CB 3.46Å; E576-Q579 PolarHBondContact O-N 3.43Å; E576-Q579 VanDerWaalsContact O-N 3.14Å; E576-I580 WeakPolarHBondContact O-CG1 3.44Å; E576-I580 PolarHBondContact O-N 3.46Å
577	A	77.4	Confident	81.3	Confident	56 Å²	56	101.9 Å²	101.9	46%	0.463	53%	0.526	S	S	.	.	H	α-helix	trans	-61.2	-36.6	174.7	0	0	0	0	0	112.5	L573 S574 N581	L573-A577 VanDerWaalsContact O-CB 3.29Å; L573-A577 WeakPolarHBondContact O-CB 3.5Å; L573-A577 PolarHBondContact O-N 3.03Å; S574-A577 PolarHBondContact O-N 3.21Å; A577-N581 VanDerWaalsContact O-CB 3.31Å; A577-N581 WeakPolarHBondContact O-CB 3.27Å; A577-N581 PolarHBondContact O-N 2.94Å
578	L	81.9	Confident	81.1	Confident	116 Å²	116	97.6 Å²	97.6	61%	0.607	51%	0.514	S	S	*	.	H	α-helix	trans	-67.3	-40	172.6	-77.7	167.4	0	0	0	112.4	S574 T575 E576 N581 G582	S574-L578 WeakPolarHBondContact O-CG 3.32Å; S574-L578 PolarHBondContact O-N 2.97Å; T575-L578 WeakPolarHBondContact O-CB 3.39Å; T575-L578 PolarHBondContact O-N 3.31Å; E576-L578 VanDerWaalsContact C-N 3.3Å; E576-L578 PolarHBondContact O-N 3.26Å; L578-N581 PolarHBondContact O-N 2.84Å; L578-G582 PolarHBondContact O-N 2.99Å
579	Q	79.8	Confident	80.9	Confident	125 Å²	125	97.5 Å²	97.5	58%	0.584	51%	0.506	S	S	*	.	H	α-helix	trans	-63.6	-45.6	174	-70.9	178.4	9.1	0	0	111.7	T575 E576 N581 G582 L583	T575-Q579 WeakPolarHBondContact O-CG 3.47Å; T575-Q579 PolarHBondContact O-N 2.95Å; E576-Q579 WeakPolarHBondContact O-CB 3.46Å; E576-Q579 PolarHBondContact O-N 3.43Å; E576-Q579 VanDerWaalsContact O-N 3.14Å; Q579-N581 VanDerWaalsContact C-N 3.3Å; Q579-N581 PolarHBondContact O-N 3.38Å; Q579-G582 WeakPolarHBondContact O-CA 3.31Å; Q579-G582 PolarHBondContact O-N 3.01Å; Q579-G582 VanDerWaalsContact O-N 3.13Å; Q579-L583 WeakPolarHBondContact O-CG 3.44Å; Q579-L583 PolarHBondContact O-N 3.27Å
580	I	77.3	Confident	80.6	Confident	115 Å²	115	97.8 Å²	97.8	59%	0.59	51%	0.508	S	S	*	.	H	α-helix	trans	-59.6	-40.9	174.7	-69	166.6	0	0	0	110.8	E576 L583 K584	E576-I580 WeakPolarHBondContact O-CG1 3.44Å; E576-I580 PolarHBondContact O-N 3.46Å; I580-L583 PolarHBondContact O-N 2.97Å; I580-K584 WeakPolarHBondContact O-CB 3.21Å; I580-K584 PolarHBondContact O-N 3.48Å
581	N	78.8	Confident	80.2	Confident	84 Å²	84	98.1 Å²	98.1	45%	0.449	50%	0.504	S	S	.	.	H	α-helix	trans	-70.2	-31.3	177.1	-160.2	17.5	0	0	0	112.4	A577 L578 Q579 K585	A577-N581 VanDerWaalsContact O-CB 3.31Å; A577-N581 WeakPolarHBondContact O-CB 3.27Å; A577-N581 PolarHBondContact O-N 2.94Å; L578-N581 PolarHBondContact O-N 2.84Å; Q579-N581 VanDerWaalsContact C-N 3.3Å; Q579-N581 PolarHBondContact O-N 3.38Å; N581-K585 PolarHBondContact O-N 3.33Å; N581-K585 VanDerWaalsContact O-N 3.14Å
582	G	78.6	Confident	80.1	Confident	38 Å²	38	100.7 Å²	100.7	39%	0.392	51%	0.508	S	S	.	.	H	α-helix	trans	-63.7	-51.4	169.1	0	0	0	0	0	112.3	L578 Q579 K584 K585 E586	L578-G582 PolarHBondContact O-N 2.99Å; Q579-G582 WeakPolarHBondContact O-CA 3.31Å; Q579-G582 PolarHBondContact O-N 3.01Å; Q579-G582 VanDerWaalsContact O-N 3.13Å; G582-K584 VanDerWaalsContact C-N 3.27Å; G582-K584 PolarHBondContact O-N 3.23Å; G582-K585 WeakPolarHBondContact O-CB 3.43Å; G582-K585 PolarHBondContact O-N 3.1Å; G582-K585 VanDerWaalsContact O-N 3.1Å; G582-E586 PolarHBondContact O-N 3.23Å
583	L	78.8	Confident	79.7	Confident	124 Å²	124	98.2 Å²	98.2	65%	0.649	50%	0.497	S	S	*	.	H	α-helix	trans	-58.4	-38.2	174.6	-70.3	168.7	0	0	0	112	Q579 I580 K585 E586 F587	Q579-L583 WeakPolarHBondContact O-CG 3.44Å; Q579-L583 PolarHBondContact O-N 3.27Å; I580-L583 PolarHBondContact O-N 2.97Å; L583-K585 PolarHBondContact O-N 3.49Å; L583-E586 PolarHBondContact O-N 2.78Å; L583-F587 WeakPolarHBondContact O-CB 3.46Å; L583-F587 PolarHBondContact O-N 2.96Å
584	K	80	Confident	79.3	Confident	127 Å²	127	97.5 Å²	97.5	55%	0.552	49%	0.493	S	S	*	.	H	α-helix	trans	-62.2	-41	174.8	-175.3	179.6	178.1	-178.2	0	112.3	I580 G582 H588	I580-K584 WeakPolarHBondContact O-CB 3.21Å; I580-K584 PolarHBondContact O-N 3.48Å; G582-K584 VanDerWaalsContact C-N 3.27Å; G582-K584 PolarHBondContact O-N 3.23Å; K584-H588 PolarHBondContact O-N 3.18Å; K584-H588 VanDerWaalsContact O-N 3.16Å; K584-H588 PolarHBondContact O-ND1 2.87Å
585	K	80.7	Confident	79.1	Confident	151 Å²	151	98.9 Å²	98.9	66%	0.657	50%	0.495	S	S	*	.	H	α-helix	trans	-65.8	-44.4	175.1	-74.6	-179.6	177.8	-175.5	0	111.7	N581 G582 L583 F587 H588 R589	N581-K585 PolarHBondContact O-N 3.33Å; N581-K585 VanDerWaalsContact O-N 3.14Å; G582-K585 WeakPolarHBondContact O-CB 3.43Å; G582-K585 PolarHBondContact O-N 3.1Å; G582-K585 VanDerWaalsContact O-N 3.1Å; L583-K585 PolarHBondContact O-N 3.49Å; K585-F587 VanDerWaalsContact C-N 3.31Å; K585-F587 PolarHBondContact O-N 2.87Å; K585-H588 PolarHBondContact O-N 2.91Å; K585-H588 VanDerWaalsContact O-N 3.13Å; K585-R589 PolarHBondContact O-N 3.46Å
586	E	78.4	Confident	78.9	Confident	81 Å²	81	101.7 Å²	101.7	38%	0.379	50%	0.503	S	S	.	.	H	α-helix	trans	-64.3	-37.5	178.2	-174.7	57.5	-162.7	0	0	111.8	G582 L583 H588 R589 L590	G582-E586 PolarHBondContact O-N 3.23Å; L583-E586 PolarHBondContact O-N 2.78Å; E586-H588 PolarHBondContact O-N 2.99Å; E586-R589 VanDerWaalsContact CD-NE 3.32Å; E586-R589 WeakPolarHBondContact O-CB 3.21Å; E586-R589 PolarHBondContact O-N 2.85Å; E586-R589 IonicContact OE1-CZ 2.66Å; E586-R589 VanDerWaalsContact OE1-CZ 3.31Å; E586-R589 IonicContact OE1-NE 2.59Å; E586-R589 PolarHBondContact OE1-NE 3.46Å; E586-R589 VanDerWaalsContact OE1-NE 3.09Å; E586-R589 IonicContact OE1-NH2 2.69Å; E586-R589 PolarHBondContact OE1-NH2 3.14Å; E586-R589 WeakPolarHBondContact OE2-CD 3.36Å; E586-R589 IonicContact OE2-CZ 2.74Å; E586-R589 IonicContact OE2-NE 2.63Å; E586-R589 PolarHBondContact OE2-NE 3.02Å; E586-R589 IonicContact OE2-NH2 2.63Å; E586-L590 HydrophobicContact CG-CD1 4.16Å; E586-L590 WeakPolarHBondContact O-CG 3.45Å; E586-L590 PolarHBondContact O-N 3.16Å
587	F	78.8	Confident	78.6	Confident	132 Å²	132	102.1 Å²	102.1	58%	0.579	51%	0.508	S	S	*	.	H	α-helix	trans	-59.4	-42.6	170.9	-177.4	-87.8	0	0	0	112.5	L583 K585 Q591	L583-F587 WeakPolarHBondContact O-CB 3.46Å; L583-F587 PolarHBondContact O-N 2.96Å; K585-F587 VanDerWaalsContact C-N 3.31Å; K585-F587 PolarHBondContact O-N 2.87Å; F587-Q591 VanDerWaalsContact O-CB 3.29Å; F587-Q591 WeakPolarHBondContact O-CB 3.45Å; F587-Q591 PolarHBondContact O-N 3.28Å
588	H	81.1	Confident	78.4	Confident	95 Å²	95	105 Å²	105	44%	0.44	51%	0.51	S	S	.	.	H	α-helix	trans	-66.4	-40.4	175.9	-73.9	58.3	0	0	0	111.5	K584 K585 E586 L590 Q591 E592	K584-H588 PolarHBondContact O-N 3.18Å; K584-H588 VanDerWaalsContact O-N 3.16Å; K584-H588 PolarHBondContact O-ND1 2.87Å; K585-H588 PolarHBondContact O-N 2.91Å; K585-H588 VanDerWaalsContact O-N 3.13Å; E586-H588 PolarHBondContact O-N 2.99Å; H588-L590 PolarHBondContact O-N 3.45Å; H588-Q591 WeakPolarHBondContact O-CB 3.19Å; H588-Q591 PolarHBondContact O-N 3.42Å; H588-Q591 VanDerWaalsContact O-N 3.15Å; H588-E592 PolarHBondContact O-N 2.94Å
589	R	82.2	Confident	78	Confident	100 Å²	100	102.6 Å²	102.6	38%	0.377	50%	0.5	S	S	.	.	H	α-helix	trans	-58.9	-48.2	176.4	-163.1	-169.2	71.5	65.1	15	111.7	K585 E586 Q591 E592 E593	K585-R589 PolarHBondContact O-N 3.46Å; E586-R589 VanDerWaalsContact CD-NE 3.32Å; E586-R589 WeakPolarHBondContact O-CB 3.21Å; E586-R589 PolarHBondContact O-N 2.85Å; E586-R589 IonicContact OE1-CZ 2.66Å; E586-R589 VanDerWaalsContact OE1-CZ 3.31Å; E586-R589 IonicContact OE1-NE 2.59Å; E586-R589 PolarHBondContact OE1-NE 3.46Å; E586-R589 VanDerWaalsContact OE1-NE 3.09Å; E586-R589 IonicContact OE1-NH2 2.69Å; E586-R589 PolarHBondContact OE1-NH2 3.14Å; E586-R589 WeakPolarHBondContact OE2-CD 3.36Å; E586-R589 IonicContact OE2-CZ 2.74Å; E586-R589 IonicContact OE2-NE 2.63Å; E586-R589 PolarHBondContact OE2-NE 3.02Å; E586-R589 IonicContact OE2-NH2 2.63Å; R589-Q591 VanDerWaalsContact C-N 3.3Å; R589-Q591 PolarHBondContact O-N 3.45Å; R589-E592 PolarHBondContact O-N 2.9Å; R589-E593 IonicContact CZ-OE1 2.7Å; R589-E593 IonicContact CZ-OE2 2.69Å; R589-E593 IonicContact NH1-OE1 2.76Å; R589-E593 PolarHBondContact NH1-OE1 2.88Å; R589-E593 IonicContact NH1-OE2 3.05Å; R589-E593 PolarHBondContact NH1-OE2 3.22Å; R589-E593 IonicContact NH2-OE2 2.74Å; R589-E593 PolarHBondContact NH2-OE2 3.29Å; R589-E593 PolarHBondContact O-N 3.34Å
590	L	77.9	Confident	77.9	Confident	89 Å²	89	100.9 Å²	100.9	47%	0.466	49%	0.494	S	S	.	.	H	α-helix	trans	-65.8	-31.5	175.8	-68.9	166.3	0	0	0	112.5	E586 H588 N594	E586-L590 HydrophobicContact CG-CD1 4.16Å; E586-L590 WeakPolarHBondContact O-CG 3.45Å; E586-L590 PolarHBondContact O-N 3.16Å; H588-L590 PolarHBondContact O-N 3.45Å; L590-N594 WeakPolarHBondContact O-CB 3.33Å; L590-N594 PolarHBondContact O-N 3.01Å
591	Q	78.6	Confident	77.4	Confident	96 Å²	96	98.9 Å²	98.9	45%	0.449	49%	0.489	S	S	.	.	H	α-helix	trans	-70.8	-39.2	175	-172.5	173.8	2.4	0	0	111.9	F587 H588 R589 N594 I595	F587-Q591 VanDerWaalsContact O-CB 3.29Å; F587-Q591 WeakPolarHBondContact O-CB 3.45Å; F587-Q591 PolarHBondContact O-N 3.28Å; H588-Q591 WeakPolarHBondContact O-CB 3.19Å; H588-Q591 PolarHBondContact O-N 3.42Å; H588-Q591 VanDerWaalsContact O-N 3.15Å; R589-Q591 VanDerWaalsContact C-N 3.3Å; R589-Q591 PolarHBondContact O-N 3.45Å; Q591-N594 PolarHBondContact O-N 3.06Å; Q591-I595 WeakPolarHBondContact O-CG1 3.44Å; Q591-I595 PolarHBondContact O-N 3.3Å; Q591-I595 VanDerWaalsContact O-N 3.14Å
592	E	79.7	Confident	77	Confident	123 Å²	123	100 Å²	100	58%	0.575	49%	0.492	S	S	*	.	H	α-helix	trans	-66.3	-43.3	172.8	-72.4	179.2	159	0	0	111.7	H588 R589 N594 I595 Q596	H588-E592 PolarHBondContact O-N 2.94Å; R589-E592 PolarHBondContact O-N 2.9Å; E592-N594 VanDerWaalsContact C-N 3.3Å; E592-N594 PolarHBondContact O-N 2.86Å; E592-I595 PolarHBondContact O-N 2.9Å; E592-I595 VanDerWaalsContact O-N 3.13Å; E592-Q596 WeakPolarHBondContact O-CG 3.4Å; E592-Q596 PolarHBondContact O-N 3.36Å
593	E	76.1	Confident	76.6	Confident	78 Å²	78	102.3 Å²	102.3	36%	0.364	50%	0.496	S	S	.	.	H	α-helix	trans	-58.5	-40.4	172.3	-74.6	179	147.6	0	0	111.8	R589 I595 Q596 L597	R589-E593 IonicContact CZ-OE1 2.7Å; R589-E593 IonicContact CZ-OE2 2.69Å; R589-E593 IonicContact NH1-OE1 2.76Å; R589-E593 PolarHBondContact NH1-OE1 2.88Å; R589-E593 IonicContact NH1-OE2 3.05Å; R589-E593 PolarHBondContact NH1-OE2 3.22Å; R589-E593 IonicContact NH2-OE2 2.74Å; R589-E593 PolarHBondContact NH2-OE2 3.29Å; R589-E593 PolarHBondContact O-N 3.34Å; E593-I595 VanDerWaalsContact C-N 3.31Å; E593-I595 PolarHBondContact O-N 3.4Å; E593-Q596 PolarHBondContact O-N 3.44Å; E593-L597 WeakPolarHBondContact O-CB 3.38Å; E593-L597 VanDerWaalsContact O-CG 3.31Å; E593-L597 WeakPolarHBondContact O-CG 3.18Å; E593-L597 PolarHBondContact O-N 3.3Å
594	N	73.8	Confident	75.8	Confident	82 Å²	82	102.2 Å²	102.2	44%	0.439	49%	0.492	S	S	.	.	H	α-helix	trans	-65.6	-31.5	176.6	-165.8	-99.1	0	0	0	113.3	L590 Q591 E592 K598	L590-N594 WeakPolarHBondContact O-CB 3.33Å; L590-N594 PolarHBondContact O-N 3.01Å; Q591-N594 PolarHBondContact O-N 3.06Å; E592-N594 VanDerWaalsContact C-N 3.3Å; E592-N594 PolarHBondContact O-N 2.86Å; N594-K598 WeakPolarHBondContact O-CD 3.48Å; N594-K598 WeakPolarHBondContact O-CG 3.35Å; N594-K598 PolarHBondContact O-N 2.99Å; N594-K598 WeakPolarHBondContact OD1-CE 3.41Å; N594-K598 PolarHBondContact OD1-NZ 2.98Å
595	I	80.2	Confident	75	Confident	95 Å²	95	102.9 Å²	102.9	49%	0.487	50%	0.497	S	S	.	.	H	α-helix	trans	-74	-48.1	175.5	-68.7	164.1	0	0	0	110.1	Q591 E592 E593 L597 K598 T599	Q591-I595 WeakPolarHBondContact O-CG1 3.44Å; Q591-I595 PolarHBondContact O-N 3.3Å; Q591-I595 VanDerWaalsContact O-N 3.14Å; E592-I595 PolarHBondContact O-N 2.9Å; E592-I595 VanDerWaalsContact O-N 3.13Å; E593-I595 VanDerWaalsContact C-N 3.31Å; E593-I595 PolarHBondContact O-N 3.4Å; I595-L597 VanDerWaalsContact C-N 3.33Å; I595-L597 PolarHBondContact O-N 3.34Å; I595-K598 WeakPolarHBondContact O-CB 3.38Å; I595-K598 PolarHBondContact O-N 3.12Å; I595-K598 VanDerWaalsContact O-N 3.09Å; I595-T599 PolarHBondContact O-N 3.49Å; I595-T599 PolarHBondContact O-OG1 2.99Å
596	Q	77	Confident	74.1	Confident	127 Å²	127	101.5 Å²	101.5	59%	0.593	49%	0.491	S	S	*	.	H	α-helix	trans	-59	-43	178.8	-69.8	-179.8	12.3	0	0	112.1	E592 E593 K598 T599 I600	E592-Q596 WeakPolarHBondContact O-CG 3.4Å; E592-Q596 PolarHBondContact O-N 3.36Å; E593-Q596 PolarHBondContact O-N 3.44Å; Q596-K598 VanDerWaalsContact C-N 3.28Å; Q596-K598 PolarHBondContact O-N 2.94Å; Q596-T599 PolarHBondContact O-N 3.39Å; Q596-I600 WeakPolarHBondContact O-CG1 3.31Å; Q596-I600 PolarHBondContact O-N 3.15Å; Q596-I600 VanDerWaalsContact O-N 3.1Å
597	L	74.5	Confident	73.3	Confident	110 Å²	110	100.7 Å²	100.7	58%	0.576	50%	0.498	S	S	*	.	H	α-helix	trans	-63.4	-30.6	177.1	-73.7	168.8	0	0	0	113.2	E593 I595 C601	E593-L597 WeakPolarHBondContact O-CB 3.38Å; E593-L597 VanDerWaalsContact O-CG 3.31Å; E593-L597 WeakPolarHBondContact O-CG 3.18Å; E593-L597 PolarHBondContact O-N 3.3Å; I595-L597 VanDerWaalsContact C-N 3.33Å; I595-L597 PolarHBondContact O-N 3.34Å; L597-C601 PolarHBondContact O-N 3.27Å; L597-C601 PolarHBondContact O-SG 3.01Å; L597-C601 VanDerWaalsContact O-SG 3.42Å
598	K	72	Confident	72.2	Confident	118 Å²	118	100.6 Å²	100.6	51%	0.513	50%	0.503	S	S	.	.	H	α-helix	trans	-70.1	-47.2	174.7	-78.5	165.9	173	154.2	0	112	N594 I595 Q596 I600 C601 E602	N594-K598 WeakPolarHBondContact O-CD 3.48Å; N594-K598 WeakPolarHBondContact O-CG 3.35Å; N594-K598 PolarHBondContact O-N 2.99Å; N594-K598 WeakPolarHBondContact OD1-CE 3.41Å; N594-K598 PolarHBondContact OD1-NZ 2.98Å; I595-K598 WeakPolarHBondContact O-CB 3.38Å; I595-K598 PolarHBondContact O-N 3.12Å; I595-K598 VanDerWaalsContact O-N 3.09Å; Q596-K598 VanDerWaalsContact C-N 3.28Å; Q596-K598 PolarHBondContact O-N 2.94Å; K598-I600 VanDerWaalsContact C-N 3.26Å; K598-I600 PolarHBondContact O-N 3.37Å; K598-C601 WeakPolarHBondContact O-CB 3.48Å; K598-C601 PolarHBondContact O-N 3.42Å; K598-E602 PolarHBondContact O-N 2.9Å
599	T	74.7	Confident	71	Confident	64 Å²	64	103.6 Å²	103.6	39%	0.393	52%	0.517	S	S	.	.	H	α-helix	trans	-60.7	-36.9	178.2	-50	0	0	0	0	111.8	I595 Q596 C601 E602 D603	I595-T599 PolarHBondContact O-N 3.49Å; I595-T599 PolarHBondContact O-OG1 2.99Å; Q596-T599 PolarHBondContact O-N 3.39Å; T599-C601 VanDerWaalsContact C-N 3.31Å; T599-C601 PolarHBondContact O-N 3.04Å; T599-E602 PolarHBondContact O-N 3.16Å; T599-D603 PolarHBondContact O-N 2.69Å
600	I	75.8	Confident	69.9	Low	89 Å²	89	104.7 Å²	104.7	46%	0.456	53%	0.527	S	S	.	.	H	α-helix	trans	-62.1	-36.5	175	-69.4	166.3	0	0	0	111.9	Q596 K598 Q604	Q596-I600 WeakPolarHBondContact O-CG1 3.31Å; Q596-I600 PolarHBondContact O-N 3.15Å; Q596-I600 VanDerWaalsContact O-N 3.1Å; K598-I600 VanDerWaalsContact C-N 3.26Å; K598-I600 PolarHBondContact O-N 3.37Å; I600-Q604 VanDerWaalsContact O-CG 3.27Å; I600-Q604 WeakPolarHBondContact O-CG 3.29Å; I600-Q604 PolarHBondContact O-N 3.37Å
601	C	67	Low	68.7	Low	73 Å²	73	106.4 Å²	106.4	49%	0.493	54%	0.535	S	S	.	.	H	α-helix	trans	-68.7	-46.7	173.4	-66.5	0	0	0	0	111.9	L597 K598 T599 D603 Q604 E605	L597-C601 PolarHBondContact O-N 3.27Å; L597-C601 PolarHBondContact O-SG 3.01Å; L597-C601 VanDerWaalsContact O-SG 3.42Å; K598-C601 WeakPolarHBondContact O-CB 3.48Å; K598-C601 PolarHBondContact O-N 3.42Å; T599-C601 VanDerWaalsContact C-N 3.31Å; T599-C601 PolarHBondContact O-N 3.04Å; C601-D603 VanDerWaalsContact C-N 3.29Å; C601-D603 PolarHBondContact O-N 2.72Å; C601-Q604 PolarHBondContact O-N 3.25Å; C601-Q604 VanDerWaalsContact O-N 3.09Å; C601-E605 PolarHBondContact O-N 3.5Å
602	E	70.6	Confident	67.3	Low	107 Å²	107	104.5 Å²	104.5	50%	0.5	54%	0.542	S	S	.	.	H	α-helix	trans	-60.6	-35.3	-178.5	-68.6	173.6	161.6	0	0	112.8	K598 T599 K606	K598-E602 PolarHBondContact O-N 2.9Å; T599-E602 PolarHBondContact O-N 3.16Å; E602-K606 PolarHBondContact O-N 3.28Å
603	D	70.9	Confident	65.8	Low	88 Å²	88	103 Å²	103	47%	0.471	55%	0.545	S	S	.	.	H	α-helix	trans	-79.5	-26	175.9	-74.5	-22.3	0	0	0	113.1	T599 C601 K606 A607	T599-D603 PolarHBondContact O-N 2.69Å; C601-D603 VanDerWaalsContact C-N 3.29Å; C601-D603 PolarHBondContact O-N 2.72Å; D603-K606 IonicContact OD1-NZ 2.87Å; D603-K606 PolarHBondContact OD1-NZ 2.89Å; D603-A607 PolarHBondContact O-N 3.34Å
604	Q	61.2	Low	64.5	Low	122 Å²	122	106.1 Å²	106.1	57%	0.57	56%	0.557	S	S	*	*	H	α-helix	trans	-70.6	-34.7	171.1	-75.7	176.5	19.2	0	0	112.3	I600 C601 A607 L608	I600-Q604 VanDerWaalsContact O-CG 3.27Å; I600-Q604 WeakPolarHBondContact O-CG 3.29Å; I600-Q604 PolarHBondContact O-N 3.37Å; C601-Q604 PolarHBondContact O-N 3.25Å; C601-Q604 VanDerWaalsContact O-N 3.09Å; Q604-A607 PolarHBondContact O-N 2.99Å; Q604-L608 PolarHBondContact O-N 2.95Å
605	E	64.8	Low	63.2	Low	141 Å²	141	109.7 Å²	109.7	66%	0.659	58%	0.576	S	S	*	*	H	α-helix	trans	-65.1	-44.1	175	-70.6	-177.4	149	0	0	111.7	C601 A607 L608 E609	C601-E605 PolarHBondContact O-N 3.5Å; E605-A607 VanDerWaalsContact C-N 3.34Å; E605-A607 PolarHBondContact O-N 3Å; E605-L608 PolarHBondContact O-N 2.71Å; E605-E609 PolarHBondContact O-N 3.26Å
606	K	61.2	Low	61.3	Low	121 Å²	121	110.5 Å²	110.5	53%	0.526	59%	0.59	S	S	.	*	H	α-helix	trans	-61.8	-38.3	175	-67.5	174.1	-157.8	143.5	0	113.2	E602 D603 L608 E609 E610	E602-K606 PolarHBondContact O-N 3.28Å; D603-K606 IonicContact OD1-NZ 2.87Å; D603-K606 PolarHBondContact OD1-NZ 2.89Å; K606-L608 PolarHBondContact O-N 2.72Å; K606-E609 PolarHBondContact O-N 2.86Å; K606-E609 VanDerWaalsContact O-N 3.14Å; K606-E610 PolarHBondContact O-N 2.85Å
607	A	60.3	Low	59.4	Low	65 Å²	65	112.8 Å²	112.8	54%	0.537	60%	0.6	S	S	.	*	H	α-helix	trans	-63.2	-28.6	-179.7	0	0	0	0	0	112.9	D603 Q604 E605	D603-A607 PolarHBondContact O-N 3.34Å; Q604-A607 PolarHBondContact O-N 2.99Å; E605-A607 VanDerWaalsContact C-N 3.34Å; E605-A607 PolarHBondContact O-N 3Å
608	L	55.7	Low	57.7	Low	129 Å²	129	113 Å²	113	68%	0.675	61%	0.611	S	S	*	*	H	α-helix	trans	-75.1	-34	174.7	-71.1	166.7	0	0	0	112.4	Q604 E605 K606 L611	Q604-L608 PolarHBondContact O-N 2.95Å; E605-L608 PolarHBondContact O-N 2.71Å; K606-L608 PolarHBondContact O-N 2.72Å; L608-L611 PolarHBondContact O-N 3.1Å
609	E	57.1	Low	56.1	Low	159 Å²	159	117.5 Å²	117.5	74%	0.743	63%	0.631	S	S	*	*	H	α-helix	trans	-70.6	-40.1	-177.1	-157.5	168.8	-139.9	0	0	112.3	E605 K606 L611	E605-E609 PolarHBondContact O-N 3.26Å; K606-E609 PolarHBondContact O-N 2.86Å; K606-E609 VanDerWaalsContact O-N 3.14Å; E609-L611 PolarHBondContact O-N 3.34Å
610	E	57.9	Low	54.3	Low	123 Å²	123	122.1 Å²	122.1	58%	0.575	65%	0.652	S	S	*	*	H	α-helix	trans	-65.6	-34.6	174	-82.6	-153	-163.9	0	0	113.8	K606 G612 S613 K614	K606-E610 PolarHBondContact O-N 2.85Å; E610-G612 VanDerWaalsContact C-N 3.31Å; E610-G612 PolarHBondContact O-N 3.09Å; E610-S613 PolarHBondContact O-N 3.03Å; E610-K614 IonicContact OE2-NZ 2.69Å; E610-K614 PolarHBondContact OE2-NZ 3.4Å
611	L	52.9	Low	52.5	Low	124 Å²	124	127.2 Å²	127.2	65%	0.649	67%	0.671	S	S	*	*	H	α-helix	trans	-68.2	-32.6	-175.1	-170.9	63.8	0	0	0	111.8	L608 E609 S613	L608-L611 PolarHBondContact O-N 3.1Å; E609-L611 PolarHBondContact O-N 3.34Å; L611-S613 PolarHBondContact O-N 2.88Å
612	G	49.9	Very low	51.3	Low	56 Å²	56	130.7 Å²	130.7	58%	0.577	68%	0.683	S	S	*	*	H	α-helix	trans	-64.1	-36.8	177.2	0	0	0	0	0	113.8	E610	E610-G612 VanDerWaalsContact C-N 3.31Å; E610-G612 PolarHBondContact O-N 3.09Å
613	S	48.3	Very low	49.5	Very low	93 Å²	93	135.5 Å²	135.5	65%	0.65	71%	0.706	S	S	*	*	H	α-helix	trans	-72	-37.9	-175.8	-67	0	0	0	0	113.1	E610 L611 L615 S616	E610-S613 PolarHBondContact O-N 3.03Å; L611-S613 PolarHBondContact O-N 2.88Å; S613-L615 VanDerWaalsContact C-N 3.27Å; S613-L615 PolarHBondContact O-N 3.42Å; S613-S616 PolarHBondContact O-N 3.13Å
614	K	48.8	Very low	47.5	Very low	143 Å²	143	137.6 Å²	137.6	62%	0.622	72%	0.717	S	S	*	*	H	α-helix	trans	-73.4	-14.2	-174.3	-72.4	162	-177.8	156.2	0	113.9	E610 S616	E610-K614 IonicContact OE2-NZ 2.69Å; E610-K614 PolarHBondContact OE2-NZ 3.4Å; K614-S616 VanDerWaalsContact C-N 3.34Å
615	L	46	Very low	46.3	Very low	157 Å²	157	138 Å²	138	82%	0.822	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.1	-14.4	179.8	-154.7	70.6	0	0	0	113.7	S613	S613-L615 VanDerWaalsContact C-N 3.27Å; S613-L615 PolarHBondContact O-N 3.42Å
616	S	40.6	Very low	44.7	Very low	112 Å²	112	139 Å²	139	78%	0.783	72%	0.724	S	S	*	*	S	Bend	trans	-76.9	-29.6	-176.3	-163.7	0	0	0	0	113.7	S613 K614	S613-S616 PolarHBondContact O-N 3.13Å; K614-S616 VanDerWaalsContact C-N 3.34Å
617	E	38.1	Very low	43.4	Very low	174 Å²	174	140.6 Å²	140.6	81%	0.813	73%	0.733	S	S	*	*	S	Bend	trans	-104.6	3.1	-156	-146.9	172.4	-153	0	0	115.4
618	S	37.2	Very low	42	Very low	116 Å²	116	141.8 Å²	141.8	81%	0.811	74%	0.743	S	S	*	*			trans	-144.7	65.1	-178.7	-79.4	0	0	0	0	114.8
619	K	40	Very low	40.8	Very low	212 Å²	212	141.2 Å²	141.2	92%	0.922	74%	0.74	S	S	*	*	S	Bend	trans	-126.8	26	158.4	-153.7	-165.3	174.5	-178	0	112.8
620	L	36.9	Very low	39.8	Very low	161 Å²	161	142 Å²	142	84%	0.843	74%	0.742	S	S	*	*	S	Bend	trans	-133.7	5.4	-168.6	-126.9	170.3	0	0	0	114.9
621	K	36.3	Very low	38.6	Very low	196 Å²	196	140.2 Å²	140.2	85%	0.852	75%	0.747	S	S	*	*	S	Bend	trans	-143.9	129.9	176.8	-68.5	-174.7	-179.9	170.1	0	111.3
622	I	42.1	Very low	37.6	Very low	146 Å²	146	142.1 Å²	142.1	75%	0.749	76%	0.757	S	S	*	*			trans	69.2	53.7	169.8	-42.7	176.5	0	0	0	114.3	D624	I622-D624 VanDerWaalsContact C-N 3.32Å
623	E	32.6	Very low	36.8	Very low	208 Å²	208	148.4 Å²	148.4	97%	0.972	77%	0.772	S	S	*	*	S	Bend	trans	-86	-15.3	135.2	-167.4	163.5	-155.4	0	0	110.4
624	D	29.6	Very low	36	Very low	131 Å²	131	147.8 Å²	147.8	70%	0.701	78%	0.78	S	S	*	*	S	Bend	trans	-83.1	122.4	173.7	-115.4	-40.8	0	0	0	112.3	I622	I622-D624 VanDerWaalsContact C-N 3.32Å
625	I	35.5	Very low	35.4	Very low	132 Å²	132	144.8 Å²	144.8	68%	0.677	79%	0.79	S	S	*	*	S	Bend	trans	78.9	120.1	158.5	-56	171.9	0	0	0	118.1
626	K	31.2	Very low	35.2	Very low	161 Å²	161	144.9 Å²	144.9	70%	0.7	79%	0.786	S	S	*	*			cis	-152.6	142	-16.5	-101.7	-166.3	179.2	164.8	0	107.4
627	E	33.8	Very low	35.4	Very low	155 Å²	155	146.4 Å²	146.4	72%	0.724	79%	0.791	S	S	*	*				65.4	48.5	66.4	-152.5	-155.5	178.5	0	0	115.4
628	A	32.4	Very low	36.6	Very low	89 Å²	89	144.7 Å²	144.7	74%	0.736	78%	0.777	S	S	*	*			trans	-149.8	99.4	152.4	0	0	0	0	0	109.7
629	N	30.6	Very low	38.1	Very low	117 Å²	117	142.8 Å²	142.8	63%	0.626	76%	0.757	S	S	*	*				62.6	125.3	88.7	-75.9	-76.5	0	0	0	112.8
630	K	35.1	Very low	38.9	Very low	177 Å²	177	139.6 Å²	139.6	77%	0.77	74%	0.743	S	S	*	*			cis	-169.5	164.2	11.7	-139.2	169	-169.8	104.3	0	112.4
631	A	32.3	Very low	40.2	Very low	84 Å²	84	135.4 Å²	135.4	69%	0.694	72%	0.721	S	S	*	*			trans	67.7	138.4	149.6	0	0	0	0	0	118.1
632	L	32.1	Very low	41.2	Very low	164 Å²	164	135.3 Å²	135.3	86%	0.859	72%	0.721	S	S	*	*			cis	-150.9	163.1	-4.7	-88.3	140.8	0	0	0	106
633	Q	32.8	Very low	42.7	Very low	188 Å²	188	134 Å²	134	88%	0.879	72%	0.715	S	S	*	*			cis	-129.6	170	11	-59.2	173	-1	0	0	108.1
634	G	31.6	Very low	44.8	Very low	81 Å²	81	124.9 Å²	124.9	84%	0.835	68%	0.676	S	S	*	*			cis	134.4	141.4	8	0	0	0	0	0	109
635	G	36.4	Very low	46.8	Very low	80 Å²	80	122.9 Å²	122.9	83%	0.825	67%	0.669	S	S	*	*			cis	-157.5	-147.6	-2.8	0	0	0	0	0	108.6
636	Q	42.9	Very low	49.1	Very low	159 Å²	159	120.9 Å²	120.9	74%	0.743	66%	0.656	S	S	*	*			cis	-165	155.1	-4.7	178.9	175.4	-7.7	0	0	108.5
637	V	44.6	Very low	51.4	Low	144 Å²	144	113.3 Å²	113.3	87%	0.873	62%	0.623	S	S	*	*			trans	-129.9	146.6	167.4	-178.1	0	0	0	0	109.7
638	W	63	Low	53.7	Low	137 Å²	137	111.9 Å²	111.9	52%	0.519	62%	0.615	S	S	.	*			trans	-134.9	132.9	-177.3	-178.1	-73.2	0	0	0	110	H662	W638-H662 AromaticContact CE2-CD2 3.94Å; W638-H662 AromaticContact CZ2-CD2 3.62Å; W638-H662 AromaticContact NE1-CD2 3.92Å; W638-H662 AromaticContact NE1-NE2 3.61Å
639	L	67.3	Low	55.9	Low	77 Å²	77	111.3 Å²	111.3	40%	0.403	60%	0.599	S	S	.	*			trans	-77.9	150.3	-176.4	-155.4	78.6	0	0	0	111.7
640	K	57.3	Low	58.1	Low	144 Å²	144	108 Å²	108	63%	0.626	58%	0.584	S	S	*	*			trans	-102.6	137.2	-178.4	-65.3	169.3	-177.1	167.7	0	111.1	K642 D643	K640-K642 PolarHBondContact O-N 2.86Å; K640-D643 PolarHBondContact O-N 3.14Å
641	D	64.2	Low	59.9	Low	73 Å²	73	107.3 Å²	107.3	39%	0.39	58%	0.584	S	S	.	*	G	3₁₀ helix	trans	-53.5	-20.6	-179.7	-62.7	70.4	0	0	0	115.3	D643 K660 H662 I669	D641-D643 VanDerWaalsContact C-N 3.3Å; D641-K660 PolarHBondContact O-NZ 3.5Å; D641-H662 IonicContact OD1-CE1 3.59Å; D641-H662 PolarHBondContact OD1-CE1 3.45Å; D641-H662 IonicContact OD1-NE2 3.68Å; D641-H662 IonicContact OD2-CE1 3.95Å; D641-H662 PolarHBondContact OD2-CE1 2.89Å; D641-I669 HydrophobicContact CB-CD1 4.37Å
642	K	58.8	Low	61.7	Low	194 Å²	194	109.8 Å²	109.8	84%	0.843	58%	0.579	S	S	*	*	G	3₁₀ helix	trans	-70.3	-26.2	-179.3	-59.4	-171.6	-180	-173.1	0	112.7	K640	K640-K642 PolarHBondContact O-N 2.86Å
643	D	71.9	Confident	63.6	Low	118 Å²	118	108 Å²	108	63%	0.631	57%	0.567	S	S	*	*	G	3₁₀ helix	trans	-94.4	-3.4	-169.3	-47.7	-37.9	0	0	0	112.4	K640 D641	K640-D643 PolarHBondContact O-N 3.14Å; D641-D643 VanDerWaalsContact C-N 3.3Å
644	A	76.5	Confident	66	Low	17 Å²	17	100.5 Å²	100.5	14%	0.14	53%	0.531	C	S	.	.			trans	-114.7	119.4	-176.7	0	0	0	0	0	112.6	K660 I669	A644-K660 WeakPolarHBondContact O-CE 3.35Å; A644-K660 PolarHBondContact O-NZ 3.26Å; A644-I669 HydrophobicContact CB-CD1 4.3Å
645	T	73.5	Confident	67.9	Low	90 Å²	90	99.7 Å²	99.7	55%	0.552	51%	0.512	S	S	*	.			trans	-101	-33.7	177.6	45.7	0	0	0	0	113.5	F654	T645-F654 WeakPolarHBondContact O-CD2 3.25Å; T645-F654 PolarHBondContact O-N 3.11Å; T645-F654 VanDerWaalsContact O-N 3.16Å
646	H	83.6	Confident	69.5	Low	89 Å²	89	103.4 Å²	103.4	41%	0.412	51%	0.512	S	S	.	.	B	Isolated β-bridge	trans	-120.4	153.7	-174.1	-60.8	77.9	0	0	0	112	K648 E651 E653 F654	H646-K648 PolarHBondContact O-N 3.24Å; H646-E651 PolarHBondContact CD2-O 3.44Å; H646-E651 VanDerWaalsContact CD2-O 3.24Å; H646-E653 IonicContact CE1-OE1 2.74Å; H646-E653 IonicContact NE2-OE1 3.91Å; H646-F654 VanDerWaalsContact C-CE2 3.44Å; H646-F654 WeakPolarHBondContact O-CE2 3.5Å
647	C	79.1	Confident	71	Confident	2 Å²	2	101.1 Å²	101.1	1%	0.014	51%	0.513	C	S	.	.			trans	-68.9	124	175.9	178.8	0	0	0	0	111.5	L649 C650 E651 K652 F654 C671	C647-L649 PolarHBondContact O-N 2.93Å; C647-C650 PolarHBondContact O-N 2.82Å; C647-E651 WeakPolarHBondContact O-CA 3.18Å; C647-E651 PolarHBondContact O-N 2.96Å; C647-K652 PolarHBondContact N-O 2.63Å; C647-K652 VanDerWaalsContact N-O 3.11Å; C647-F654 HydrophobicContact CB-CE1 4.41Å; C647-F654 HydrophobicContact CB-CE2 4.39Å; C647-F654 HydrophobicContact CB-CZ 3.94Å; C647-C671 HydrophobicContact CB-CB 4.5Å; C647-C671 PolarHBondContact SG-N 2.9Å; C647-C671 VanDerWaalsContact SG-N 3.37Å
648	K	81.9	Confident	71.8	Confident	126 Å²	126	99 Å²	99	55%	0.548	49%	0.49	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-6.6	-171.1	-167.4	50.8	168.3	-79.8	0	116.1	H646 E668 I669 F670	H646-K648 PolarHBondContact O-N 3.24Å; K648-E668 IonicContact NZ-OE1 3.97Å; K648-E668 PolarHBondContact NZ-OE1 3.1Å; K648-E668 IonicContact NZ-OE2 2.63Å; K648-I669 PolarHBondContact N-O 3.42Å; K648-F670 HydrophobicContact CB-CD1 4.38Å; K648-F670 HydrophobicContact CB-CE1 3.86Å; K648-F670 HydrophobicContact CB-CZ 4.21Å
649	L	77.9	Confident	72.1	Confident	77 Å²	77	100.7 Å²	100.7	40%	0.403	50%	0.496	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.8	-25.9	177.6	-167.3	63.9	0	0	0	114.7	C647 F670 C674 D692 T693	C647-L649 PolarHBondContact O-N 2.93Å; L649-F670 HydrophobicContact CB-CD1 3.9Å; L649-F670 HydrophobicContact CB-CE1 3.91Å; L649-C674 HydrophobicContact CB-CB 4.47Å; L649-C674 HydrophobicContact CD2-CB 4.11Å; L649-D692 HydrophobicContact CD2-CB 4.42Å; L649-T693 WeakPolarHBondContact CD1-OG1 3.27Å
650	C	78.1	Confident	72.4	Confident	46 Å²	46	100.6 Å²	100.6	31%	0.311	49%	0.492	S	S	.	.	T	Hydrogen-bonded Turn	trans	-135.9	6.1	-170.5	71.1	0	0	0	0	114.6	C647 K652	C647-C650 PolarHBondContact O-N 2.82Å; C650-K652 PolarHBondContact O-N 3.27Å
651	E	72.4	Confident	73.2	Confident	163 Å²	163	96.6 Å²	96.6	76%	0.762	48%	0.476	S	S	*	.			trans	56.3	8.3	168.5	-56.6	-173.5	154.3	0	0	116.4	H646 C647	H646-E651 PolarHBondContact CD2-O 3.44Å; H646-E651 VanDerWaalsContact CD2-O 3.24Å; C647-E651 WeakPolarHBondContact O-CA 3.18Å; C647-E651 PolarHBondContact O-N 2.96Å
652	K	68.9	Low	73.8	Confident	137 Å²	137	94.4 Å²	94.4	60%	0.596	46%	0.463	S	S	*	.	P	Polyproline II helix	trans	-79.2	133.9	171.7	-68.9	175.3	-175.6	178.8	0	109.9	C647 C650	C647-K652 PolarHBondContact N-O 2.63Å; C647-K652 VanDerWaalsContact N-O 3.11Å; C650-K652 PolarHBondContact O-N 3.27Å
653	E	72.1	Confident	74.9	Confident	127 Å²	127	85.1 Å²	85.1	59%	0.593	42%	0.423	S	S	*	.	B	Isolated β-bridge	trans	-67.6	148	-175.1	-157.9	173	-149.5	0	0	112.5	H646 R658	H646-E653 IonicContact CE1-OE1 2.74Å; H646-E653 IonicContact NE2-OE1 3.91Å; E653-R658 WeakPolarHBondContact O-CD 3.46Å
654	F	83.1	Confident	75.3	Confident	30 Å²	30	86.1 Å²	86.1	13%	0.132	42%	0.418	C	S	.	.	P	Polyproline II helix	trans	-81.8	150.4	-179.1	-72.3	-70.4	0	0	0	112.8	T645 H646 C647 R658 K660 I669 C671	T645-F654 WeakPolarHBondContact O-CD2 3.25Å; T645-F654 PolarHBondContact O-N 3.11Å; T645-F654 VanDerWaalsContact O-N 3.16Å; H646-F654 VanDerWaalsContact C-CE2 3.44Å; H646-F654 WeakPolarHBondContact O-CE2 3.5Å; C647-F654 HydrophobicContact CB-CE1 4.41Å; C647-F654 HydrophobicContact CB-CE2 4.39Å; C647-F654 HydrophobicContact CB-CZ 3.94Å; F654-R658 HydrophobicContact CD1-CG 4.48Å; F654-R658 WeakPolarHBondContact CD1-O 3.49Å; F654-K660 HydrophobicContact CB-CG 4.22Å; F654-K660 HydrophobicContact CD1-CG 3.77Å; F654-K660 HydrophobicContact CD2-CD 4.42Å; F654-K660 HydrophobicContact CD2-CG 3.87Å; F654-K660 HydrophobicContact CE1-CG 4.01Å; F654-K660 HydrophobicContact CE2-CG 4.11Å; F654-K660 HydrophobicContact CG-CG 3.7Å; F654-K660 HydrophobicContact CZ-CG 4.18Å; F654-I669 HydrophobicContact CE2-CG2 4.07Å; F654-I669 HydrophobicContact CZ-CG2 3.82Å; F654-C671 HydrophobicContact CE1-CB 3.91Å
655	S	72.8	Confident	74.9	Confident	63 Å²	63	89.3 Å²	89.3	44%	0.441	43%	0.432	S	S	.	.			trans	-149.7	178.1	-178.7	79.4	0	0	0	0	112.8	S657 R658	S655-S657 PolarHBondContact O-N 3.24Å; S655-S657 PolarHBondContact OG-OG 3.14Å; S655-R658 PolarHBondContact N-O 3.44Å; S655-R658 CarbonylContact O-C 3.12Å; S655-R658 PolarHBondContact O-N 2.99Å; S655-R658 PolarHBondContact OG-N 3.32Å; S655-R658 VanDerWaalsContact OG-N 3.1Å
656	I	70	Confident	74.8	Confident	158 Å²	158	88 Å²	88	81%	0.81	43%	0.426	S	S	*	.	S	Bend	trans	-59.6	-34.8	-179.6	-54.7	175.8	0	0	0	111.9
657	S	73.6	Confident	74.7	Confident	112 Å²	112	84.5 Å²	84.5	78%	0.783	42%	0.415	S	S	*	.	S	Bend	trans	-87	-36.7	173.7	55.4	0	0	0	0	112.8	S655 R659	S655-S657 PolarHBondContact O-N 3.24Å; S655-S657 PolarHBondContact OG-OG 3.14Å; S657-R659 PolarHBondContact O-N 2.95Å
658	R	62.1	Low	74.9	Confident	99 Å²	99	87.1 Å²	87.1	37%	0.374	43%	0.427	S	S	.	.	S	Bend	trans	-93.2	78.1	175.8	-172.1	177.1	-67.6	-85.6	-5.1	110	E653 F654 S655 C671	E653-R658 WeakPolarHBondContact O-CD 3.46Å; F654-R658 HydrophobicContact CD1-CG 4.48Å; F654-R658 WeakPolarHBondContact CD1-O 3.49Å; S655-R658 PolarHBondContact N-O 3.44Å; S655-R658 CarbonylContact O-C 3.12Å; S655-R658 PolarHBondContact O-N 2.99Å; S655-R658 PolarHBondContact OG-N 3.32Å; S655-R658 VanDerWaalsContact OG-N 3.1Å; R658-C671 HydrophobicContact CG-CB 4.07Å
659	R	68.9	Low	75.2	Confident	173 Å²	173	81.3 Å²	81.3	65%	0.653	40%	0.401	S	S	*	.			trans	-70.6	158.9	-174.7	-62.7	-172.9	-178.9	-174.4	2.8	113.6	S657 H661	S657-R659 PolarHBondContact O-N 2.95Å; R659-H661 PolarHBondContact O-CD2 3.13Å; R659-H661 VanDerWaalsContact O-CD2 3.26Å
660	K	74.3	Confident	75.9	Confident	75 Å²	75	78 Å²	78	33%	0.326	38%	0.384	S	S	.	.			trans	-83.9	133.7	176.6	-71.7	176.5	171.5	177.6	0	111	D641 A644 F654 I669	D641-K660 PolarHBondContact O-NZ 3.5Å; A644-K660 WeakPolarHBondContact O-CE 3.35Å; A644-K660 PolarHBondContact O-NZ 3.26Å; F654-K660 HydrophobicContact CB-CG 4.22Å; F654-K660 HydrophobicContact CD1-CG 3.77Å; F654-K660 HydrophobicContact CD2-CD 4.42Å; F654-K660 HydrophobicContact CD2-CG 3.87Å; F654-K660 HydrophobicContact CE1-CG 4.01Å; F654-K660 HydrophobicContact CE2-CG 4.11Å; F654-K660 HydrophobicContact CG-CG 3.7Å; F654-K660 HydrophobicContact CZ-CG 4.18Å; K660-I669 HydrophobicContact CB-CG2 3.78Å; K660-I669 HydrophobicContact CD-CG2 4.42Å; K660-I669 HydrophobicContact CG-CG2 3.95Å
661	H	72.7	Confident	76.4	Confident	59 Å²	59	76 Å²	76	27%	0.273	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	140	175.7	-55.8	-92.1	0	0	0	110.4	R659 I669 F670	R659-H661 PolarHBondContact O-CD2 3.13Å; R659-H661 VanDerWaalsContact O-CD2 3.26Å; H661-I669 WeakPolarHBondContact O-CA 3.49Å; H661-F670 PolarHBondContact N-O 2.94Å; H661-F670 PolarHBondContact O-N 3.46Å
662	H	77.4	Confident	76.3	Confident	27 Å²	27	71.3 Å²	71.3	13%	0.125	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	138.4	-179.2	-73.6	76.3	0	0	0	112.4	W638 D641 R664 G667	W638-H662 AromaticContact CE2-CD2 3.94Å; W638-H662 AromaticContact CZ2-CD2 3.62Å; W638-H662 AromaticContact NE1-CD2 3.92Å; W638-H662 AromaticContact NE1-NE2 3.61Å; D641-H662 IonicContact OD1-CE1 3.59Å; D641-H662 PolarHBondContact OD1-CE1 3.45Å; D641-H662 IonicContact OD1-NE2 3.68Å; D641-H662 IonicContact OD2-CE1 3.95Å; D641-H662 PolarHBondContact OD2-CE1 2.89Å; H662-R664 WeakPolarHBondContact O-CD 3.42Å; H662-R664 PolarHBondContact O-NH1 2.78Å; H662-G667 PolarHBondContact CD2-O 3.16Å
663	C	81.3	Confident	76.9	Confident	0 Å²	0	68.6 Å²	68.6	0%	0	35%	0.349	C	S	.	.			trans	-77.5	124	163.9	175.6	0	0	0	0	110.1	N665 C666 G667 E668 F670 C691	C663-N665 PolarHBondContact O-N 2.86Å; C663-C666 PolarHBondContact SG-SG 3.34Å; C663-G667 WeakPolarHBondContact O-CA 3.46Å; C663-G667 PolarHBondContact O-N 3.5Å; C663-E668 PolarHBondContact N-O 3.36Å; C663-F670 HydrophobicContact CB-CD2 3.78Å; C663-F670 HydrophobicContact CB-CE2 3.57Å; C663-C691 HydrophobicContact CB-CB 4.18Å; C663-C691 PolarHBondContact SG-N 3.41Å; C663-C691 VanDerWaalsContact SG-SG 3.68Å
664	R	81	Confident	77.6	Confident	139 Å²	139	63.2 Å²	63.2	53%	0.525	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-9.1	-176.6	-84.2	57.8	174.6	-162.2	-7.9	114.5	H662 L681 V688 R689	H662-R664 WeakPolarHBondContact O-CD 3.42Å; H662-R664 PolarHBondContact O-NH1 2.78Å; R664-L681 HydrophobicContact CB-CD1 4.09Å; R664-V688 HydrophobicContact CB-CG2 4.34Å; R664-R689 PolarHBondContact N-O 3.09Å
665	N	67.1	Low	77.9	Confident	83 Å²	83	61.8 Å²	61.8	44%	0.444	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94	-37.2	178	-173.8	67.1	0	0	0	113.6	C663 L681 V690 C694	C663-N665 PolarHBondContact O-N 2.86Å; N665-L681 HydrophobicContact CB-CD1 4.1Å; N665-V690 HydrophobicContact CB-CG1 4.18Å; N665-C694 HydrophobicContact CB-CB 4.29Å; N665-C694 PolarHBondContact ND2-SG 2.74Å
666	C	73.3	Confident	77.3	Confident	62 Å²	62	63 Å²	63	42%	0.419	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.2	-6.3	-175.9	63	0	0	0	0	115.4	C663 E668	C663-C666 PolarHBondContact SG-SG 3.34Å; C666-E668 PolarHBondContact O-N 3.35Å; C666-E668 VanDerWaalsContact O-N 3.12Å
667	G	80.8	Confident	77.2	Confident	17 Å²	17	58.6 Å²	58.6	18%	0.175	30%	0.298	C	S	.	.			trans	75.7	-12	178.4	0	0	0	0	0	115.7	H662 C663	H662-G667 PolarHBondContact CD2-O 3.16Å; C663-G667 WeakPolarHBondContact O-CA 3.46Å; C663-G667 PolarHBondContact O-N 3.5Å
668	E	84.2	Confident	76.3	Confident	57 Å²	57	58.2 Å²	58.2	27%	0.266	28%	0.284	S	S	.	.			trans	-69.9	160.2	176.3	-72.1	-85.9	-153.2	0	0	113	K648 C663 C666 F670	K648-E668 IonicContact NZ-OE1 3.97Å; K648-E668 PolarHBondContact NZ-OE1 3.1Å; K648-E668 IonicContact NZ-OE2 2.63Å; C663-E668 PolarHBondContact N-O 3.36Å; C666-E668 PolarHBondContact O-N 3.35Å; C666-E668 VanDerWaalsContact O-N 3.12Å; E668-F670 HydrophobicContact CB-CE2 3.55Å; E668-F670 HydrophobicContact CB-CZ 3.78Å; E668-F670 WeakPolarHBondContact O-CD2 3.49Å; E668-F670 WeakPolarHBondContact O-CE2 3.49Å
669	I	86.3	Confident	76.9	Confident	3 Å²	3	55.3 Å²	55.3	2%	0.015	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	131.1	-171.4	-58.5	178.5	0	0	0	111.9	D641 A644 K648 F654 K660 H661	D641-I669 HydrophobicContact CB-CD1 4.37Å; A644-I669 HydrophobicContact CB-CD1 4.3Å; K648-I669 PolarHBondContact N-O 3.42Å; F654-I669 HydrophobicContact CE2-CG2 4.07Å; F654-I669 HydrophobicContact CZ-CG2 3.82Å; K660-I669 HydrophobicContact CB-CG2 3.78Å; K660-I669 HydrophobicContact CD-CG2 4.42Å; K660-I669 HydrophobicContact CG-CG2 3.95Å; H661-I669 WeakPolarHBondContact O-CA 3.49Å
670	F	93.5	Very high	77.1	Confident	9 Å²	9	50.2 Å²	50.2	4%	0.039	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	165.7	-174.5	-57.4	-89.2	0	0	0	111.6	K648 L649 H661 C663 E668 C691	K648-F670 HydrophobicContact CB-CD1 4.38Å; K648-F670 HydrophobicContact CB-CE1 3.86Å; K648-F670 HydrophobicContact CB-CZ 4.21Å; L649-F670 HydrophobicContact CB-CD1 3.9Å; L649-F670 HydrophobicContact CB-CE1 3.91Å; H661-F670 PolarHBondContact N-O 2.94Å; H661-F670 PolarHBondContact O-N 3.46Å; C663-F670 HydrophobicContact CB-CD2 3.78Å; C663-F670 HydrophobicContact CB-CE2 3.57Å; E668-F670 HydrophobicContact CB-CE2 3.55Å; E668-F670 HydrophobicContact CB-CZ 3.78Å; E668-F670 WeakPolarHBondContact O-CD2 3.49Å; E668-F670 WeakPolarHBondContact O-CE2 3.49Å; F670-C691 HydrophobicContact CD1-CB 3.94Å; F670-C691 HydrophobicContact CD2-CB 3.74Å; F670-C691 HydrophobicContact CE1-CB 3.85Å; F670-C691 HydrophobicContact CE2-CB 3.64Å; F670-C691 HydrophobicContact CG-CB 3.89Å; F670-C691 HydrophobicContact CZ-CB 3.71Å
671	C	89.8	Confident	76.9	Confident	2 Å²	2	47.6 Å²	47.6	1%	0.014	25%	0.254	C	S	.	.			trans	-91.8	162.3	168.9	82.9	0	0	0	0	111.2	C647 F654 R658 S673 C674 S675	C647-C671 HydrophobicContact CB-CB 4.5Å; C647-C671 PolarHBondContact SG-N 2.9Å; C647-C671 VanDerWaalsContact SG-N 3.37Å; F654-C671 HydrophobicContact CE1-CB 3.91Å; R658-C671 HydrophobicContact CG-CB 4.07Å; C671-S673 PolarHBondContact O-N 3.13Å; C671-C674 PolarHBondContact O-N 3.39Å; C671-S675 PolarHBondContact O-N 3.14Å; C671-S675 PolarHBondContact O-OG 2.88Å
672	N	69.1	Low	76.1	Confident	66 Å²	66	51.4 Å²	51.4	35%	0.353	28%	0.284	S	S	.	.	G	3₁₀ helix	trans	-51.8	-53.1	-170.2	-165	81.5	0	0	0	113.2	C674 S675 D676 R689	N672-C674 PolarHBondContact O-N 2.95Å; N672-S675 CarbonylContact O-C 3.12Å; N672-S675 PolarHBondContact O-N 3.38Å; N672-D676 PolarHBondContact ND2-OD1 2.95Å; N672-D676 PolarHBondContact ND2-OD2 3.39Å; N672-D676 WeakPolarHBondContact O-CB 3.34Å; N672-D676 PolarHBondContact O-N 3.15Å; N672-R689 PolarHBondContact OD1-NH1 3.31Å
673	S	81.6	Confident	74.8	Confident	80 Å²	80	55.1 Å²	55.1	56%	0.559	32%	0.32	S	S	*	.	G	3₁₀ helix	trans	-74.1	9.9	-179	64.3	0	0	0	0	115.4	C671	C671-S673 PolarHBondContact O-N 3.13Å
674	C	86.1	Confident	73.5	Confident	14 Å²	14	57 Å²	57	10%	0.095	33%	0.333	C	S	.	.	G	3₁₀ helix	trans	-118.9	9.3	168.6	-61.2	0	0	0	0	111.8	L649 C671 N672 C691 D692	L649-C674 HydrophobicContact CB-CB 4.47Å; L649-C674 HydrophobicContact CD2-CB 4.11Å; C671-C674 PolarHBondContact O-N 3.39Å; N672-C674 PolarHBondContact O-N 2.95Å; C674-C691 WeakPolarHBondContact O-CA 3.46Å; C674-D692 WeakPolarHBondContact CA-OD2 3.29Å; C674-D692 PolarHBondContact O-N 3.32Å
675	S	89.7	Confident	72.1	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	35%	0.347	C	S	.	.	S	Bend	trans	-161.2	39.2	-177.1	56.3	0	0	0	0	110.6	C671 N672 N677 R689 V690	C671-S675 PolarHBondContact O-N 3.14Å; C671-S675 PolarHBondContact O-OG 2.88Å; N672-S675 CarbonylContact O-C 3.12Å; N672-S675 PolarHBondContact O-N 3.38Å; S675-N677 VanDerWaalsContact C-N 3.28Å; S675-R689 WeakPolarHBondContact O-CD 3.33Å; S675-R689 WeakPolarHBondContact O-CG 3.37Å; S675-R689 PolarHBondContact O-NE 3.28Å; S675-R689 PolarHBondContact O-NH1 3.06Å; S675-V690 VanDerWaalsContact CA-O 3.23Å; S675-V690 WeakPolarHBondContact CA-O 3.47Å; S675-V690 WeakPolarHBondContact CB-O 3.36Å
676	D	60.7	Low	71.8	Confident	89 Å²	89	59.9 Å²	59.9	48%	0.476	36%	0.358	S	S	.	.			trans	-89.2	-2.7	179.5	-118.8	-13.9	0	0	0	112	N672 R689	N672-D676 PolarHBondContact ND2-OD1 2.95Å; N672-D676 PolarHBondContact ND2-OD2 3.39Å; N672-D676 WeakPolarHBondContact O-CB 3.34Å; N672-D676 PolarHBondContact O-N 3.15Å; D676-R689 IonicContact OD1-NH1 3.59Å; D676-R689 IonicContact OD1-NH2 2.94Å
677	N	68.9	Low	71.7	Confident	65 Å²	65	60.9 Å²	60.9	35%	0.348	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	132.1	178.2	-65.9	-71	0	0	0	110.4	S675 V690 D692 H695	S675-N677 VanDerWaalsContact C-N 3.28Å; N677-V690 PolarHBondContact O-N 3.07Å; N677-D692 PolarHBondContact ND2-OD1 3.42Å; N677-H695 HydrophobicContact CB-CB 4.4Å
678	E	54.2	Low	71.4	Confident	103 Å²	103	61.8 Å²	61.8	48%	0.481	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	126.9	-178.1	-50.7	-156.5	154.4	0	0	110.5	V688 R689	E678-V688 WeakPolarHBondContact CA-O 3.42Å; E678-R689 HydrophobicContact CG-CB 4.33Å; E678-R689 IonicContact OE1-CZ 3.81Å; E678-R689 IonicContact OE1-NE 3.88Å; E678-R689 PolarHBondContact OE1-NE 3.23Å; E678-R689 IonicContact OE1-NH2 3.91Å; E678-R689 PolarHBondContact OE1-NH2 3.28Å; E678-R689 VanDerWaalsContact OE1-NH2 3.17Å
679	L	74.9	Confident	71.5	Confident	38 Å²	38	60.9 Å²	60.9	20%	0.199	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	141.2	-169	-150.9	147.1	0	0	0	108.6	V688 V690 H695 L699	L679-V688 PolarHBondContact N-O 3Å; L679-V688 PolarHBondContact O-N 3.37Å; L679-V688 VanDerWaalsContact O-O 3.11Å; L679-V690 HydrophobicContact CB-CG2 4.46Å; L679-H695 VanDerWaalsContact CD1-CD2 3.41Å; L679-H695 WeakPolarHBondContact CD1-CD2 3.42Å; L679-L699 HydrophobicContact CD1-CD1 4.33Å; L679-L699 HydrophobicContact CD1-CD2 4.31Å; L679-L699 HydrophobicContact CD1-CG 4.02Å
680	P	72.2	Confident	71.1	Confident	67 Å²	67	60.8 Å²	60.8	44%	0.435	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	148.3	179.4	26.1	-34.4	0	0	0	111.5
681	L	70	Confident	71	Confident	19 Å²	19	60.5 Å²	60.5	10%	0.099	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	157.9	-175.9	-69.4	-179.4	0	0	0	111.3	R664 N665 A683 S684 V688 V690 L698	R664-L681 HydrophobicContact CB-CD1 4.09Å; N665-L681 HydrophobicContact CB-CD1 4.1Å; L681-A683 PolarHBondContact O-N 2.77Å; L681-S684 PolarHBondContact N-O 3.41Å; L681-S684 CarbonylContact O-C 3.36Å; L681-S684 PolarHBondContact O-N 3.46Å; L681-V688 HydrophobicContact CB-CG2 4.16Å; L681-V688 HydrophobicContact CD1-CG2 3.65Å; L681-V688 HydrophobicContact CG-CG2 3.75Å; L681-V690 HydrophobicContact CD1-CG1 3.94Å; L681-V690 HydrophobicContact CD2-CG1 4.22Å; L681-V690 HydrophobicContact CG-CG1 4.38Å; L681-L698 HydrophobicContact CD2-CD1 3.58Å
682	P	57.1	Low	69.7	Low	139 Å²	139	62.6 Å²	62.6	90%	0.903	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-15.7	-177.8	-27.9	36.4	0	0	0	116.4
683	A	49.4	Very low	70.5	Confident	105 Å²	105	62.9 Å²	62.9	87%	0.868	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.7	-7.7	176	0	0	0	0	0	114.5	L681	L681-A683 PolarHBondContact O-N 2.77Å
684	S	54.3	Low	70.6	Confident	39 Å²	39	59.8 Å²	59.8	27%	0.273	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.4	122.8	-179.8	163.2	0	0	0	0	111.3	L681 K686	L681-S684 PolarHBondContact N-O 3.41Å; L681-S684 CarbonylContact O-C 3.36Å; L681-S684 PolarHBondContact O-N 3.46Å; S684-K686 PolarHBondContact O-N 3.01Å; S684-K686 PolarHBondContact OG-N 3.38Å; S684-K686 PolarHBondContact OG-O 3.03Å
685	P	50.1	Low	70	Confident	127 Å²	127	61.1 Å²	61.1	83%	0.825	36%	0.357	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.6	-10	179.7	30.8	-36.5	0	0	0	113.9
686	K	62.5	Low	69.1	Low	157 Å²	157	63.7 Å²	63.7	68%	0.683	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.4	143.6	173	-66.2	-174.1	178.3	-177.6	0	110.5	S684 V688	S684-K686 PolarHBondContact O-N 3.01Å; S684-K686 PolarHBondContact OG-N 3.38Å; S684-K686 PolarHBondContact OG-O 3.03Å; K686-V688 PolarHBondContact O-N 3.45Å
687	P	71.1	Confident	69.6	Low	83 Å²	83	64.9 Å²	64.9	54%	0.539	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-52.7	137.8	170.4	-24.7	34.1	0	0	0	111.8
688	V	74.7	Confident	70	Confident	36 Å²	36	64 Å²	64	22%	0.218	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	154.9	179.7	-71.8	0	0	0	0	111.2	R664 E678 L679 L681 K686 V690	R664-V688 HydrophobicContact CB-CG2 4.34Å; E678-V688 WeakPolarHBondContact CA-O 3.42Å; L679-V688 PolarHBondContact N-O 3Å; L679-V688 PolarHBondContact O-N 3.37Å; L679-V688 VanDerWaalsContact O-O 3.11Å; L681-V688 HydrophobicContact CB-CG2 4.16Å; L681-V688 HydrophobicContact CD1-CG2 3.65Å; L681-V688 HydrophobicContact CG-CG2 3.75Å; K686-V688 PolarHBondContact O-N 3.45Å; V688-V690 PolarHBondContact O-N 3.43Å
689	R	84.5	Confident	70.3	Confident	38 Å²	38	63.7 Å²	63.7	14%	0.143	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	127.6	-176.2	-173.5	163.4	-71	-133.1	-3.9	114.3	R664 N672 S675 D676 E678	R664-R689 PolarHBondContact N-O 3.09Å; N672-R689 PolarHBondContact OD1-NH1 3.31Å; S675-R689 WeakPolarHBondContact O-CD 3.33Å; S675-R689 WeakPolarHBondContact O-CG 3.37Å; S675-R689 PolarHBondContact O-NE 3.28Å; S675-R689 PolarHBondContact O-NH1 3.06Å; D676-R689 IonicContact OD1-NH1 3.59Å; D676-R689 IonicContact OD1-NH2 2.94Å; E678-R689 HydrophobicContact CG-CB 4.33Å; E678-R689 IonicContact OE1-CZ 3.81Å; E678-R689 IonicContact OE1-NE 3.88Å; E678-R689 PolarHBondContact OE1-NE 3.23Å; E678-R689 IonicContact OE1-NH2 3.91Å; E678-R689 PolarHBondContact OE1-NH2 3.28Å; E678-R689 VanDerWaalsContact OE1-NH2 3.17Å
690	V	79.6	Confident	69.4	Low	0 Å²	0	69.1 Å²	69.1	0%	0	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	157.9	174.8	-71	0	0	0	0	110.6	N665 S675 N677 L679 L681 V688 C694 H695	N665-V690 HydrophobicContact CB-CG1 4.18Å; S675-V690 VanDerWaalsContact CA-O 3.23Å; S675-V690 WeakPolarHBondContact CA-O 3.47Å; S675-V690 WeakPolarHBondContact CB-O 3.36Å; N677-V690 PolarHBondContact O-N 3.07Å; L679-V690 HydrophobicContact CB-CG2 4.46Å; L681-V690 HydrophobicContact CD1-CG1 3.94Å; L681-V690 HydrophobicContact CD2-CG1 4.22Å; L681-V690 HydrophobicContact CG-CG1 4.38Å; V688-V690 PolarHBondContact O-N 3.43Å; V690-C694 HydrophobicContact CB-CB 4.31Å; V690-H695 HydrophobicContact CG2-CB 3.98Å
691	C	90.9	Very high	68.6	Low	3 Å²	3	75.9 Å²	75.9	2%	0.02	42%	0.421	C	S	.	.			trans	-79.8	155.2	167.9	65	0	0	0	0	110.9	C663 F670 C674 T693 C694 H695	C663-C691 HydrophobicContact CB-CB 4.18Å; C663-C691 PolarHBondContact SG-N 3.41Å; C663-C691 VanDerWaalsContact SG-SG 3.68Å; F670-C691 HydrophobicContact CD1-CB 3.94Å; F670-C691 HydrophobicContact CD2-CB 3.74Å; F670-C691 HydrophobicContact CE1-CB 3.85Å; F670-C691 HydrophobicContact CE2-CB 3.64Å; F670-C691 HydrophobicContact CG-CB 3.89Å; F670-C691 HydrophobicContact CZ-CB 3.71Å; C674-C691 WeakPolarHBondContact O-CA 3.46Å; C691-T693 PolarHBondContact O-N 3.05Å; C691-T693 VanDerWaalsContact O-N 3.15Å; C691-C694 WeakPolarHBondContact O-CB 3.45Å; C691-C694 PolarHBondContact O-N 3.19Å; C691-H695 PolarHBondContact O-N 2.87Å
692	D	62.2	Low	67.7	Low	47 Å²	47	80.1 Å²	80.1	25%	0.251	45%	0.451	S	S	.	.	H	α-helix	trans	-61.3	-31.3	-168.9	-51.8	-37	0	0	0	113.2	L649 C674 N677 H695 A696	L649-D692 HydrophobicContact CD2-CB 4.42Å; C674-D692 WeakPolarHBondContact CA-OD2 3.29Å; C674-D692 PolarHBondContact O-N 3.32Å; N677-D692 PolarHBondContact ND2-OD1 3.42Å; D692-H695 WeakPolarHBondContact O-CB 3.47Å; D692-H695 PolarHBondContact O-N 3.46Å; D692-A696 PolarHBondContact O-N 3.45Å
693	T	85.9	Confident	66.2	Low	72 Å²	72	78.6 Å²	78.6	44%	0.442	44%	0.444	S	S	.	.	H	α-helix	trans	-64.6	-41.1	173.4	-39	0	0	0	0	112.5	L649 C691 L697	L649-T693 WeakPolarHBondContact CD1-OG1 3.27Å; C691-T693 PolarHBondContact O-N 3.05Å; C691-T693 VanDerWaalsContact O-N 3.15Å; T693-L697 HydrophobicContact CG2-CD1 4.46Å; T693-L697 WeakPolarHBondContact O-CG 3.43Å; T693-L697 PolarHBondContact O-N 3.44Å
694	C	82.7	Confident	66.3	Low	15 Å²	15	78.4 Å²	78.4	10%	0.101	44%	0.436	C	S	.	.	H	α-helix	trans	-70	-39.6	174.9	-70.3	0	0	0	0	110.9	N665 V690 C691 L697 L698	N665-C694 HydrophobicContact CB-CB 4.29Å; N665-C694 PolarHBondContact ND2-SG 2.74Å; V690-C694 HydrophobicContact CB-CB 4.31Å; C691-C694 WeakPolarHBondContact O-CB 3.45Å; C691-C694 PolarHBondContact O-N 3.19Å; C694-L697 PolarHBondContact O-N 3.09Å; C694-L698 WeakPolarHBondContact O-CB 3.31Å; C694-L698 WeakPolarHBondContact O-CD1 3.47Å; C694-L698 WeakPolarHBondContact O-CG 3.42Å; C694-L698 PolarHBondContact O-N 3.32Å
695	H	74.3	Confident	66.2	Low	41 Å²	41	82 Å²	82	19%	0.19	46%	0.457	C	S	.	.	H	α-helix	trans	-57	-49.6	177.2	-176.1	-111.9	0	0	0	111.8	N677 L679 V690 C691 D692 L698 L699	N677-H695 HydrophobicContact CB-CB 4.4Å; L679-H695 VanDerWaalsContact CD1-CD2 3.41Å; L679-H695 WeakPolarHBondContact CD1-CD2 3.42Å; V690-H695 HydrophobicContact CG2-CB 3.98Å; C691-H695 PolarHBondContact O-N 2.87Å; D692-H695 WeakPolarHBondContact O-CB 3.47Å; D692-H695 PolarHBondContact O-N 3.46Å; H695-L698 PolarHBondContact O-N 3.29Å; H695-L699 VanDerWaalsContact CE1-CD1 3.48Å; H695-L699 WeakPolarHBondContact CE1-CD1 3.47Å; H695-L699 PolarHBondContact O-N 3.26Å
696	A	71.4	Confident	66	Low	54 Å²	54	81.9 Å²	81.9	45%	0.446	45%	0.454	S	S	.	.	H	α-helix	trans	-62.8	-48.2	177.7	0	0	0	0	0	113	D692 L698 L699 Q700	D692-A696 PolarHBondContact O-N 3.45Å; A696-L698 VanDerWaalsContact C-N 3.25Å; A696-L698 PolarHBondContact O-N 3.4Å; A696-L699 PolarHBondContact O-N 3.4Å; A696-Q700 WeakPolarHBondContact O-CB 3.42Å; A696-Q700 PolarHBondContact O-N 3.14Å; A696-Q700 VanDerWaalsContact O-N 3.16Å
697	L	69.6	Low	65.1	Low	115 Å²	115	84.6 Å²	84.6	60%	0.602	48%	0.484	S	S	*	.	H	α-helix	trans	-63.4	-27.9	179.1	-78.5	168.8	0	0	0	113.7	T693 C694	T693-L697 HydrophobicContact CG2-CD1 4.46Å; T693-L697 WeakPolarHBondContact O-CG 3.43Å; T693-L697 PolarHBondContact O-N 3.44Å; C694-L697 PolarHBondContact O-N 3.09Å
698	L	77.3	Confident	64.8	Low	46 Å²	46	84.7 Å²	84.7	24%	0.241	48%	0.481	C	S	.	.	H	α-helix	trans	-80.7	-47.2	177.4	-72.5	168.2	0	0	0	111.8	L681 C694 H695 A696 Q700 R701	L681-L698 HydrophobicContact CD2-CD1 3.58Å; C694-L698 WeakPolarHBondContact O-CB 3.31Å; C694-L698 WeakPolarHBondContact O-CD1 3.47Å; C694-L698 WeakPolarHBondContact O-CG 3.42Å; C694-L698 PolarHBondContact O-N 3.32Å; H695-L698 PolarHBondContact O-N 3.29Å; A696-L698 VanDerWaalsContact C-N 3.25Å; A696-L698 PolarHBondContact O-N 3.4Å; L698-Q700 PolarHBondContact O-N 3.43Å; L698-R701 PolarHBondContact O-N 3.49Å; L698-R701 VanDerWaalsContact O-N 3.14Å
699	L	60.7	Low	64.3	Low	96 Å²	96	87.2 Å²	87.2	50%	0.503	50%	0.495	S	S	.	.	H	α-helix	trans	-57.3	-37.9	177	-84.8	162.5	0	0	0	112.6	L679 H695 A696 R701 C702	L679-L699 HydrophobicContact CD1-CD1 4.33Å; L679-L699 HydrophobicContact CD1-CD2 4.31Å; L679-L699 HydrophobicContact CD1-CG 4.02Å; H695-L699 VanDerWaalsContact CE1-CD1 3.48Å; H695-L699 WeakPolarHBondContact CE1-CD1 3.47Å; H695-L699 PolarHBondContact O-N 3.26Å; A696-L699 PolarHBondContact O-N 3.4Å; L699-R701 PolarHBondContact O-N 3.45Å; L699-C702 PolarHBondContact O-N 3.3Å
700	Q	56.2	Low	63.2	Low	153 Å²	153	89.9 Å²	89.9	72%	0.715	51%	0.514	S	S	*	.	G	3₁₀ helix	trans	-69.7	-13.4	-177.9	-157.8	170.6	22	0	0	113.9	A696 L698	A696-Q700 WeakPolarHBondContact O-CB 3.42Å; A696-Q700 PolarHBondContact O-N 3.14Å; A696-Q700 VanDerWaalsContact O-N 3.16Å; L698-Q700 PolarHBondContact O-N 3.43Å
701	R	56.4	Low	62.2	Low	209 Å²	209	95.2 Å²	95.2	79%	0.789	55%	0.545	S	S	*	.	G	3₁₀ helix	trans	-88	-0.7	-178.2	-110.5	176.8	173.9	179	-3	115	L698 L699	L698-R701 PolarHBondContact O-N 3.49Å; L698-R701 VanDerWaalsContact O-N 3.14Å; L699-R701 PolarHBondContact O-N 3.45Å
702	C	50.2	Low	60.4	Low	107 Å²	107	101 Å²	101	72%	0.723	58%	0.577	S	S	*	*	G	3₁₀ helix	trans	-102.3	3.1	-171.7	-67.1	0	0	0	0	115.8	L699	L699-C702 PolarHBondContact O-N 3.3Å
703	S	27	Very low	60.3	Low	107 Å²	107	104.6 Å²	104.6	75%	0.748	60%	0.599	S	S	*	*	S	Bend	trans	-109.2	-41.4	-175.3	-54.1	0	0	0	0	114.4	T705	S703-T705 PolarHBondContact O-N 3.48Å
704	S	51.1	Low	58.5	Low	102 Å²	102	106.9 Å²	106.9	71%	0.713	61%	0.61	S	S	*	*			trans	-82.3	67.8	176.1	58.2	0	0	0	0	110.6
705	T	51.6	Low	56.6	Low	115 Å²	115	114 Å²	114	71%	0.706	65%	0.649	S	S	*	*			trans	-56.4	142.2	157.7	-46.8	0	0	0	0	108.6	S703	S703-T705 PolarHBondContact O-N 3.48Å
706	T	46.4	Very low	55.2	Low	124 Å²	124	120.1 Å²	120.1	76%	0.761	69%	0.688	S	S	*	*			trans	74.4	115.4	175.9	-20.3	0	0	0	0	115.7
707	T	44.1	Very low	53.7	Low	213 Å²	213	126.1 Å²	126.1	100%	1.307	71%	0.71	S	S	*	*			trans	-153.2	0	130.2	48.9	0	0	0	0	107.1

Retrieved 707 of 707 residues in 171.7 ms (Link to these results)

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